#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p84 s THR 75 N 0.00 4.52 -0.03 2.52 -1.32 -1.26 -5.00 115.64 115.07 1p84 s THR 75 Ca 0.00 1.49 -0.34 0.00 -1.21 0.00 0.00 61.69 61.64 1p84 s THR 75 Cb 0.00 -4.03 -0.12 0.00 -1.51 0.00 0.00 72.50 66.84 1p84 s THR 75 CO 0.00 0.52 1.84 -0.67 -2.21 0.00 0.00 174.62 174.10 1p84 n ASP 76 N 1.59 3.46 -0.12 8.08 2.03 -1.26 -4.89 116.55 125.44 1p84 n ASP 76 Ca -0.07 0.99 0.14 0.00 0.52 0.00 0.00 54.79 56.36 1p84 n ASP 76 Cb 0.50 -1.40 0.51 0.00 -0.72 0.00 0.00 41.12 40.01 1p84 n ASP 76 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1p84 h GLN 77 N 8.78 0.39 -0.03 -0.67 7.50 -1.98 -1.25 115.11 127.85 1p84 h GLN 77 Ca -0.48 -0.02 -0.06 0.00 0.50 0.00 0.00 58.65 58.59 1p84 h GLN 77 Cb 1.27 -0.09 0.00 0.00 0.05 0.00 0.00 27.48 28.71 1p84 h GLN 77 CO 0.94 0.26 -0.20 1.25 -1.50 0.00 0.00 178.83 179.58 1p84 h LEU 78 N 0.40 0.23 -1.68 1.46 5.85 -1.93 -2.63 115.31 117.01 1p84 h LEU 78 Ca 0.32 -0.68 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 1p84 h LEU 78 Cb 0.70 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1p84 h LEU 78 CO -0.09 0.88 0.14 -0.33 -0.34 0.00 0.00 178.44 178.69 1p84 h GLU 79 N -0.40 0.35 0.17 1.25 5.08 -1.84 0.34 114.58 119.53 1p84 h GLU 79 Ca -0.02 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1p84 h GLU 79 Cb 0.88 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1p84 h GLU 79 CO 0.04 0.26 -0.08 0.22 -1.00 0.00 0.00 179.01 178.45 1p84 h ASP 80 N 0.36 -0.19 0.02 1.42 3.58 -1.25 -1.57 116.42 118.78 1p84 h ASP 80 Ca 0.09 -0.15 -0.07 0.00 0.42 0.00 0.00 57.03 57.32 1p84 h ASP 80 Cb 0.01 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 1p84 h ASP 80 CO -0.02 0.04 -0.21 -0.07 -2.88 0.00 0.00 179.24 176.10 1p84 h LEU 81 N -0.42 0.33 -0.07 2.28 3.38 -1.01 -1.65 115.31 118.15 1p84 h LEU 81 Ca -0.02 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1p84 h LEU 81 Cb 0.33 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1p84 h LEU 81 CO 0.04 0.56 -0.00 0.03 0.09 0.00 0.00 178.44 179.15 1p84 h ARG 82 N 0.31 0.12 -0.37 1.13 3.08 -0.89 -2.23 114.38 115.53 1p84 h ARG 82 Ca 0.05 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.11 1p84 h ARG 82 Cb 0.55 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 1p84 h ARG 82 CO 0.04 0.41 0.11 1.49 -1.07 0.00 0.00 179.97 180.95 1p84 h GLU 83 N -0.18 0.25 -0.98 0.04 4.57 -1.13 0.86 114.58 117.99 1p84 h GLU 83 Ca 0.02 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.26 1p84 h GLU 83 Cb 0.36 -0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.83 1p84 h GLU 83 CO 0.00 0.16 0.63 1.25 -1.18 0.00 0.00 179.01 179.88 1p84 h HIS 84 N 0.25 1.15 0.00 0.92 2.76 -1.25 -2.72 115.15 116.27 1p84 h HIS 84 Ca 0.17 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.25 1p84 h HIS 84 Cb 0.17 -0.37 -0.02 0.00 1.55 0.00 0.00 27.41 28.74 1p84 h HIS 84 CO -0.16 0.56 -0.71 0.74 -1.30 0.00 0.00 177.93 177.06 1p84 h PHE 85 N 1.09 0.00 0.00 5.26 -1.00 -0.61 -3.18 116.94 118.50 1p84 h PHE 85 Ca 0.44 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.22 1p84 h PHE 85 Cb 0.26 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.82 1p84 h PHE 85 CO -0.00 0.53 0.00 1.63 -1.61 0.00 0.00 178.31 178.86 1p84 n LYS 86 N -3.16 0.18 -0.89 1.51 5.02 0.18 -2.54 118.16 118.47 1p84 n LYS 86 Ca -0.00 0.50 -0.04 0.00 -2.02 0.00 0.00 58.31 56.75 1p84 n LYS 86 Cb 0.76 -1.92 0.27 0.00 -0.02 0.00 0.00 35.03 34.13 1p84 n LYS 86 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1p84 n ASN 87 N -2.28 4.22 -5.01 4.39 3.02 -1.20 -3.26 115.26 115.15 1p84 n ASN 87 Ca 0.01 -3.30 -0.18 0.00 -0.03 0.00 0.00 54.58 51.08 1p84 n ASN 87 Cb 0.17 -0.70 0.03 0.00 -0.61 0.00 0.00 39.78 38.67 1p84 n ASN 87 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1p84 s THR 88 N -3.03 2.74 0.26 3.41 -4.23 -1.05 -4.89 115.64 108.85 1p84 s THR 88 Ca 0.51 -0.97 -0.05 0.00 -1.18 0.00 0.00 61.69 60.00 1p84 s THR 88 Cb 0.42 -2.77 0.26 0.00 1.34 0.00 0.00 72.50 71.75 1p84 s THR 88 CO 0.10 0.00 1.93 -0.33 -0.54 0.00 0.00 174.62 175.78 1p84 h GLU 89 N 0.46 1.28 -0.23 3.99 4.39 -1.93 -0.52 114.58 122.01 1p84 h GLU 89 Ca -0.37 -0.08 -0.17 0.00 0.34 0.00 0.00 59.36 59.08 1p84 h GLU 89 Cb 1.28 -0.29 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 1p84 h GLU 89 CO 0.44 0.85 -0.51 0.93 -1.16 0.00 0.00 179.01 179.56 1p84 h GLU 90 N 1.32 0.76 -0.42 2.33 3.07 -1.94 -2.65 114.58 117.04 1p84 h GLU 90 Ca 0.37 -0.50 -0.12 0.00 -0.50 0.00 0.00 59.36 58.60 1p84 h GLU 90 Cb -0.13 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 1p84 h GLU 90 CO -0.09 1.13 -0.22 0.78 -1.40 0.00 0.00 179.01 179.22 1p84 h GLY 91 N 0.49 0.93 1.05 -3.84 0.00 -1.66 -2.37 103.07 97.66 1p84 h GLY 91 Ca 0.00 -0.80 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1p84 h GLY 91 CO 0.11 0.73 0.01 0.50 0.00 0.00 0.00 176.54 177.89 1p84 h LYS 92 N 0.74 0.98 -0.80 4.80 1.57 -1.08 0.08 116.57 122.86 1p84 h LYS 92 Ca 0.10 -0.31 0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1p84 h LYS 92 Cb 0.75 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 1p84 h LYS 92 CO 0.06 0.98 0.53 0.00 -0.57 0.00 0.00 179.45 180.45 1p84 h ALA 93 N 0.96 1.44 -0.06 3.86 0.00 -1.37 -0.31 119.26 123.78 1p84 h ALA 93 Ca 0.16 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.78 1p84 h ALA 93 Cb 0.53 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1p84 h ALA 93 CO 0.03 0.51 -0.90 -0.07 0.00 0.00 0.00 179.25 178.82 1p84 h LEU 94 N 1.07 0.80 -0.87 0.00 4.07 -1.04 -2.46 115.31 116.88 1p84 h LEU 94 Ca 0.30 -0.58 -0.12 0.00 0.08 0.00 0.00 57.88 57.56 1p84 h LEU 94 Cb -0.10 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.39 1p84 h LEU 94 CO -0.07 1.38 -0.43 -0.37 -1.08 0.00 0.00 178.44 177.87 1p84 h VAL 95 N 0.40 1.32 0.27 1.22 -1.51 -0.61 -2.53 116.25 114.81 1p84 h VAL 95 Ca -0.08 -1.58 -0.01 0.00 -1.23 0.00 0.00 66.70 63.79 1p84 h VAL 95 Cb 1.53 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 32.39 1p84 h VAL 95 CO 0.17 0.48 -0.13 -0.74 -1.23 0.00 0.00 177.57 176.12 1p84 h HIS 96 N 0.24 -0.34 -0.70 5.19 -0.00 -1.02 0.38 115.15 118.91 1p84 h HIS 96 Ca 0.02 -0.01 0.07 0.00 -0.00 0.00 0.00 60.37 60.45 1p84 h HIS 96 Cb 0.86 0.11 -0.04 0.00 -0.00 0.00 0.00 27.41 28.34 1p84 h HIS 96 CO 0.02 -0.13 0.46 0.45 -0.00 0.00 0.00 177.93 178.73 1p84 h HIS 97 N -0.48 0.71 -0.22 5.26 -0.00 -1.38 0.32 115.15 119.34 1p84 h HIS 97 Ca -0.04 0.02 -0.19 0.00 -0.00 0.00 0.00 60.37 60.16 1p84 h HIS 97 Cb 0.36 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 27.54 1p84 h HIS 97 CO -0.03 0.37 -0.60 -0.92 -0.00 0.00 0.00 177.93 176.75 1p84 h TYR 98 N 0.69 1.03 -0.15 2.45 3.20 -1.14 -2.76 116.97 120.28 1p84 h TYR 98 Ca 0.31 -0.40 -0.00 0.00 3.14 0.00 0.00 58.73 61.78 1p84 h TYR 98 Cb 0.31 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1p84 h TYR 98 CO -0.00 1.22 0.09 1.49 -1.64 0.00 0.00 178.16 179.32 1p84 h GLU 99 N 0.54 0.20 -0.18 1.82 4.57 0.15 -0.33 114.58 121.34 1p84 h GLU 99 Ca -0.01 -0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.20 1p84 h GLU 99 Cb 1.21 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 1p84 h GLU 99 CO 0.13 0.18 0.13 1.49 -1.18 0.00 0.00 179.01 179.76 1p84 h GLU 100 N 0.17 0.00 0.00 1.92 4.81 -0.46 -0.38 114.58 120.64 1p84 h GLU 100 Ca 0.05 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1p84 h GLU 100 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1p84 h GLU 100 CO -0.01 0.00 -0.13 0.00 -0.73 0.00 0.00 179.01 178.14 1p84 h ALA 102 N 0.21 1.15 0.75 0.00 0.00 -0.35 -0.96 119.26 120.07 1p84 h ALA 102 Ca -0.02 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1p84 h ALA 102 Cb 0.93 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.58 1p84 h ALA 102 CO 0.03 0.12 -0.37 1.49 0.00 0.00 0.00 179.25 180.51 1p84 h GLU 103 N 0.81 -0.99 -0.68 0.00 4.81 -1.17 -2.20 114.58 115.15 1p84 h GLU 103 Ca 0.39 0.07 0.20 0.00 -0.13 0.00 0.00 59.36 59.88 1p84 h GLU 103 Cb 0.32 0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 1p84 h GLU 103 CO -0.23 -0.66 0.49 -0.09 -0.73 0.00 0.00 179.01 177.78 1p84 h ARG 104 N -1.03 0.01 0.00 1.92 2.43 -1.07 -2.73 114.38 113.92 1p84 h ARG 104 Ca -0.10 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1p84 h ARG 104 Cb 0.79 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1p84 h ARG 104 CO 0.16 0.00 -0.00 0.28 -1.51 0.00 0.00 179.97 178.90 1p84 h VAL 105 N 0.01 1.61 0.00 0.20 2.07 -0.79 -3.16 116.25 116.19 1p84 h VAL 105 Ca 0.32 -1.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.01 1p84 h VAL 105 Cb 1.28 2.84 -0.00 0.00 -1.52 0.00 0.00 31.29 33.90 1p84 h VAL 105 CO -0.01 0.47 -0.02 0.07 0.02 0.00 0.00 177.57 178.10 1p84 h LYS 106 N -0.79 0.00 -0.21 1.57 2.10 -1.10 -0.76 116.57 117.38 1p84 h LYS 106 Ca -0.00 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.51 1p84 h LYS 106 Cb 0.78 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.10 1p84 h LYS 106 CO 0.00 0.02 -0.45 0.82 -2.00 0.00 0.00 179.45 177.84 1p84 h ILE 107 N 0.00 1.31 0.00 0.07 2.04 -1.61 -2.81 117.51 116.51 1p84 h ILE 107 Ca -0.00 -1.64 -0.08 0.00 1.00 0.00 0.00 64.86 64.13 1p84 h ILE 107 Cb 0.05 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1p84 h ILE 107 CO 0.00 0.51 -0.40 1.56 0.00 0.00 0.00 178.15 179.82 1p84 h GLN 108 N 0.42 0.00 0.07 2.37 4.20 -1.12 -3.21 115.11 117.84 1p84 h GLN 108 Ca 0.03 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.47 1p84 h GLN 108 Cb 0.95 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.75 1p84 h GLN 108 CO 0.08 0.40 -1.12 1.96 -0.67 0.00 0.00 178.83 179.49 1p84 h GLN 109 N 0.00 0.49 0.00 1.46 4.20 -1.21 -3.30 115.11 116.75 1p84 h GLN 109 Ca -0.00 -0.62 -0.07 0.00 0.06 0.00 0.00 58.65 58.02 1p84 h GLN 109 Cb 0.95 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 1p84 h GLN 109 CO 0.05 1.25 -0.32 1.96 -0.67 0.00 0.00 178.83 181.10 1p84 h GLN 110 N 0.23 0.00 -7.11 1.46 4.20 -1.53 -3.44 115.11 108.92 1p84 h GLN 110 Ca -0.13 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.08 1p84 h GLN 110 Cb 1.79 0.00 0.07 0.00 0.30 0.00 0.00 27.48 29.64 1p84 h GLN 110 CO 0.20 0.32 0.41 -0.65 -0.67 0.00 0.00 178.83 178.44 1p84 s GLN 111 N -3.75 3.28 0.25 1.46 -0.21 -1.22 -4.97 119.66 114.50 1p84 s GLN 111 Ca -0.01 1.53 -0.30 0.00 0.02 0.00 0.00 55.36 56.60 1p84 s GLN 111 Cb 0.11 -2.00 -0.10 0.00 1.00 0.00 0.00 33.01 32.02 1p84 s GLN 111 CO 0.67 -0.89 1.50 -1.25 -2.12 0.00 0.00 175.29 173.20 1p84 s PRO 112 N -3.48 4.22 0.00 2.91 0.04 -1.26 -3.60 135.00 133.84 1p84 s PRO 112 Ca 0.71 2.39 0.00 0.00 0.04 0.00 0.00 61.00 64.14 1p84 s PRO 112 Cb -0.22 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.23 1p84 s PRO 112 CO 0.30 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 177.24 1p84 n GLY 113 N 2.39 0.71 0.29 0.56 0.00 -1.26 -4.97 105.19 102.90 1p84 n GLY 113 Ca 0.08 -0.43 -0.05 0.00 0.00 0.00 0.00 46.02 45.62 1p84 n GLY 113 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1p84 h TYR 114 N 0.00 0.90 -0.83 1.61 5.03 -1.83 -2.78 116.97 119.06 1p84 h TYR 114 Ca 0.00 -0.14 0.08 0.00 2.58 0.00 0.00 58.73 61.25 1p84 h TYR 114 Cb 0.00 -0.24 -0.06 0.00 1.55 0.00 0.00 36.73 37.98 1p84 h TYR 114 CO 0.00 0.83 0.54 0.00 -1.32 0.00 0.00 178.16 178.21 1p84 h ALA 115 N 1.20 1.63 -3.28 1.82 0.00 -1.92 -3.32 119.26 115.39 1p84 h ALA 115 Ca 0.15 -0.02 -0.68 0.00 0.00 0.00 0.00 54.91 54.36 1p84 h ALA 115 Cb 0.49 -0.22 -0.36 0.00 0.00 0.00 0.00 17.79 17.70 1p84 h ALA 115 CO 0.02 0.23 -0.56 -0.51 0.00 0.00 0.00 179.25 178.43 1p84 s ASP 116 N -6.05 5.06 0.00 0.00 1.01 -1.05 -4.80 116.67 110.84 1p84 s ASP 116 Ca -0.11 -2.31 0.00 0.00 0.71 0.00 0.00 52.55 50.85 1p84 s ASP 116 Cb 0.20 -1.77 0.00 0.00 1.01 0.00 0.00 42.92 42.35 1p84 s ASP 116 CO 0.79 -0.45 0.00 -0.11 0.21 0.00 0.00 175.17 175.61 1p84 n LEU 117 N 4.17 0.00 -3.51 1.23 0.00 -1.25 -4.88 117.00 112.76 1p84 n LEU 117 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 56.01 55.79 1p84 n LEU 117 Cb 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 43.79 1p84 n LEU 117 CO 0.31 0.00 -0.07 -1.84 0.00 0.00 0.00 177.39 175.79 1p84 n GLU 118 N -0.40 -2.47 -0.63 1.96 0.28 -1.26 -4.65 120.64 113.47 1p84 n GLU 118 Ca 0.00 0.26 -0.01 0.00 -0.16 0.00 0.00 57.16 57.24 1p84 n GLU 118 Cb 0.00 -4.87 -0.01 0.00 1.43 0.00 0.00 31.44 27.98 1p84 n GLU 118 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 1p84 n HIS 119 N -3.62 0.00 -1.69 -1.84 -0.00 -1.26 -5.11 115.22 101.70 1p84 n HIS 119 Ca 0.03 -0.12 -0.42 0.00 0.46 0.00 0.00 57.72 57.67 1p84 n HIS 119 Cb 0.50 0.28 -0.03 0.00 -0.12 0.00 0.00 29.99 30.62 1p84 n HIS 119 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 1p84 s LYS 120 N 0.00 4.14 0.21 1.57 1.02 -1.26 -4.97 119.74 120.45 1p84 s LYS 120 Ca 0.01 2.60 -0.18 0.00 0.02 0.00 0.00 55.97 58.41 1p84 s LYS 120 Cb 0.01 -4.01 -0.08 0.00 -0.52 0.00 0.00 37.83 33.23 1p84 s LYS 120 CO -0.00 -0.92 0.69 -2.00 -0.92 0.00 0.00 175.35 172.19 1p84 s GLU 121 N 3.99 4.19 0.33 1.68 2.12 -1.26 -5.09 118.70 124.66 1p84 s GLU 121 Ca 0.86 0.78 0.04 0.00 0.36 0.00 0.00 54.97 57.02 1p84 s GLU 121 Cb -0.43 -2.88 -0.06 0.00 0.26 0.00 0.00 34.13 31.01 1p84 s GLU 121 CO 0.40 0.41 0.04 0.16 -0.54 0.00 0.00 175.26 175.73 1p84 s ASP 122 N -1.68 2.55 -0.24 -1.70 3.84 -1.26 -4.98 116.67 113.20 1p84 s ASP 122 Ca 0.42 -1.36 0.12 0.00 -0.00 0.00 0.00 52.55 51.74 1p84 s ASP 122 Cb -0.16 -0.12 0.50 0.00 -1.38 0.00 0.00 42.92 41.76 1p84 s ASP 122 CO 0.20 -0.57 1.43 0.00 -0.00 0.00 0.00 175.17 176.24 1p84 h VAL 124 N 1.22 0.99 -0.31 0.00 2.07 -1.98 0.25 116.25 118.49 1p84 h VAL 124 Ca 0.13 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.59 1p84 h VAL 124 Cb 1.55 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.91 1p84 h VAL 124 CO 0.31 0.06 0.02 -0.08 0.02 0.00 0.00 177.57 177.90 1p84 h GLU 125 N 0.32 0.12 -0.39 1.57 4.81 -2.00 0.42 114.58 119.42 1p84 h GLU 125 Ca 0.13 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1p84 h GLU 125 Cb 0.04 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1p84 h GLU 125 CO -0.09 0.08 -0.13 0.93 -0.73 0.00 0.00 179.01 179.06 1p84 h GLU 126 N 0.12 0.71 -0.36 1.92 3.07 -1.81 -2.56 114.58 115.67 1p84 h GLU 126 Ca 0.15 -0.24 -0.04 0.00 -0.50 0.00 0.00 59.36 58.73 1p84 h GLU 126 Cb 0.19 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1p84 h GLU 126 CO -0.23 0.81 0.07 0.35 -1.40 0.00 0.00 179.01 178.61 1p84 h PHE 127 N 0.64 0.62 -0.85 4.33 3.57 0.53 -2.92 116.94 122.86 1p84 h PHE 127 Ca 0.11 -0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.57 1p84 h PHE 127 Cb 0.59 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.11 1p84 h PHE 127 CO 0.03 0.63 0.55 0.74 -2.23 0.00 0.00 178.31 178.03 1p84 h PHE 128 N 0.43 1.00 -0.70 0.41 0.05 0.04 -0.18 116.94 117.99 1p84 h PHE 128 Ca 0.11 0.02 -0.03 0.00 3.82 0.00 0.00 57.97 61.90 1p84 h PHE 128 Cb 0.34 -0.33 -0.03 0.00 2.00 0.00 0.00 35.95 37.92 1p84 h PHE 128 CO 0.02 0.57 0.33 0.45 -0.18 0.00 0.00 178.31 179.49 1p84 h HIS 129 N 1.02 1.02 0.82 -0.55 3.86 -1.32 0.19 115.15 120.19 1p84 h HIS 129 Ca 0.34 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.46 1p84 h HIS 129 Cb 0.08 -0.31 0.01 0.00 1.06 0.00 0.00 27.41 28.24 1p84 h HIS 129 CO -0.00 0.76 -0.40 1.25 0.86 0.00 0.00 177.93 180.41 1p84 h LEU 130 N 0.98 -0.94 -0.92 2.43 6.46 -1.17 -2.17 115.31 119.99 1p84 h LEU 130 Ca 0.24 0.03 0.17 0.00 -0.12 0.00 0.00 57.88 58.20 1p84 h LEU 130 Cb 0.13 0.24 -0.10 0.00 -0.73 0.00 0.00 40.66 40.20 1p84 h LEU 130 CO -0.03 -0.57 0.50 -0.61 -0.62 0.00 0.00 178.44 177.11 1p84 h GLN 131 N -1.30 0.64 -0.20 1.25 5.75 -0.96 -0.97 115.11 119.32 1p84 h GLN 131 Ca -0.11 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.35 1p84 h GLN 131 Cb 0.85 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.24 1p84 h GLN 131 CO 0.19 0.42 0.11 1.25 -2.65 0.00 0.00 178.83 178.15 1p84 h HIS 132 N 0.66 0.27 -0.63 3.99 2.76 -0.58 0.11 115.15 121.74 1p84 h HIS 132 Ca 0.52 -0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.74 1p84 h HIS 132 Cb 0.79 -0.09 -0.05 0.00 1.55 0.00 0.00 27.41 29.61 1p84 h HIS 132 CO -0.06 0.24 0.34 -0.92 -1.30 0.00 0.00 177.93 176.22 1p84 h TYR 133 N 0.23 0.61 -0.20 5.26 3.20 -0.54 0.37 116.97 125.90 1p84 h TYR 133 Ca 0.07 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1p84 h TYR 133 Cb 0.05 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1p84 h TYR 133 CO -0.04 0.29 0.10 -0.07 -1.64 0.00 0.00 178.16 176.79 1p84 h LEU 134 N 0.62 0.26 -0.48 2.82 3.38 -0.90 -2.37 115.31 118.64 1p84 h LEU 134 Ca 0.28 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1p84 h LEU 134 Cb 0.19 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1p84 h LEU 134 CO -0.18 0.31 0.25 0.44 0.09 0.00 0.00 178.44 179.34 1p84 h ASP 135 N 0.19 0.37 -0.65 -0.43 3.32 -0.31 0.94 116.42 119.86 1p84 h ASP 135 Ca 0.07 0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.20 1p84 h ASP 135 Cb 0.11 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.57 1p84 h ASP 135 CO -0.01 0.26 0.43 0.74 -1.72 0.00 0.00 179.24 178.94 1p84 h THR 136 N 0.50 1.01 0.09 0.35 2.02 -0.71 -1.02 112.91 115.14 1p84 h THR 136 Ca 0.21 -0.23 -0.32 0.00 0.77 0.00 0.00 66.41 66.84 1p84 h THR 136 Cb 0.10 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 1p84 h THR 136 CO -0.14 0.12 -1.73 0.00 0.37 0.00 0.00 175.52 174.14 1p84 h ALA 137 N 1.65 0.44 0.00 6.16 0.00 -0.88 -3.40 119.26 123.23 1p84 h ALA 137 Ca 0.28 -1.29 -0.16 0.00 0.00 0.00 0.00 54.91 53.74 1p84 h ALA 137 Cb 0.27 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1p84 h ALA 137 CO -0.09 1.30 -1.06 1.79 0.00 0.00 0.00 179.25 181.20 1p84 h THR 138 N 0.05 0.85 -0.57 0.00 1.35 -0.66 -3.40 112.91 110.54 1p84 h THR 138 Ca -0.31 -2.36 0.01 0.00 -0.55 0.00 0.00 66.41 63.20 1p84 h THR 138 Cb 2.02 2.33 -0.03 0.00 -1.73 0.00 0.00 68.15 70.75 1p84 h THR 138 CO 0.12 0.48 0.37 0.00 -0.25 0.00 0.00 175.52 176.24 1p84 h ALA 139 N 1.34 0.73 -0.01 6.62 0.00 -1.40 -0.69 119.26 125.85 1p84 h ALA 139 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1p84 h ALA 139 Cb 1.59 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1p84 h ALA 139 CO 0.07 0.12 0.00 -0.35 0.00 0.00 0.00 179.25 179.09 1p84 n PRO 140 N -4.72 1.12 0.00 0.00 -0.04 -1.26 -4.13 135.00 125.97 1p84 n PRO 140 Ca 0.04 -0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1p84 n PRO 140 Cb 0.05 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.09 1p84 n PRO 140 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1p84 n ARG 141 N -0.72 3.33 -0.24 0.54 1.74 -1.04 -4.82 116.66 115.46 1p84 n ARG 141 Ca 0.20 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.42 1p84 n ARG 141 Cb 0.14 -0.99 0.44 0.00 -1.02 0.00 0.00 32.46 31.03 1p84 n ARG 141 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1p84 h LEU 142 N 0.00 0.53 -0.08 0.55 5.85 -1.29 -2.68 115.31 118.18 1p84 h LEU 142 Ca 0.00 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1p84 h LEU 142 Cb 0.83 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 1p84 h LEU 142 CO 0.00 0.25 -0.12 -0.26 -0.34 0.00 0.00 178.44 177.97 1p84 h PHE 143 N 0.55 0.00 0.00 1.25 -1.00 -1.86 -3.08 116.94 112.80 1p84 h PHE 143 Ca 0.44 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.22 1p84 h PHE 143 Cb 0.89 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.45 1p84 h PHE 143 CO -0.00 0.12 0.00 -0.44 -1.61 0.00 0.00 178.31 176.37 1p84 h ASP 144 N 0.00 0.00 0.33 2.17 3.45 -1.80 -2.49 116.42 118.07 1p84 h ASP 144 Ca -0.00 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.40 1p84 h ASP 144 Cb 1.06 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.82 1p84 h ASP 144 CO 0.02 0.00 -1.73 0.29 -1.57 0.00 0.00 179.24 176.25 1p84 n LYS 145 N -2.72 0.65 -2.34 3.56 4.76 -1.17 -4.97 118.16 115.92 1p84 n LYS 145 Ca 0.00 -0.05 -0.26 0.00 -2.87 0.00 0.00 58.31 55.14 1p84 n LYS 145 Cb 0.23 -1.63 0.05 0.00 -1.84 0.00 0.00 35.03 31.84 1p84 n LYS 145 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1p84 s LEU 146 N -4.99 3.04 0.00 -0.35 1.43 -0.94 -5.09 118.68 111.78 1p84 s LEU 146 Ca -0.06 0.51 0.21 0.00 -1.03 0.00 0.00 54.13 53.76 1p84 s LEU 146 Cb 0.11 -3.25 0.17 0.00 0.03 0.00 0.00 46.19 43.25 1p84 s LEU 146 CO 0.86 -1.33 1.17 1.17 0.23 0.00 0.00 176.35 178.46