#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fh0 s GLU 37 N 0.00 0.56 0.59 1.61 0.41 -1.26 -5.14 118.70 115.48 2fh0 s GLU 37 Ca 0.00 -0.74 -0.15 0.00 -0.41 0.00 0.00 54.97 53.67 2fh0 s GLU 37 Cb 0.00 -1.83 -0.04 0.00 -1.78 0.00 0.00 34.13 30.48 2fh0 s GLU 37 CO 0.00 -0.89 1.03 -0.80 -0.49 0.00 0.00 175.26 174.11 2fh0 s ASN 38 N 1.81 6.02 -0.34 -0.19 0.01 -1.26 -5.06 114.94 115.93 2fh0 s ASN 38 Ca 0.06 1.67 0.06 0.00 -0.71 0.00 0.00 52.86 53.94 2fh0 s ASN 38 Cb -0.17 -2.51 0.18 0.00 0.41 0.00 0.00 41.25 39.16 2fh0 s ASN 38 CO -0.23 -1.01 0.55 -0.55 -1.51 0.00 0.00 177.10 174.35 2fh0 s SER 39 N -3.16 -0.92 -0.01 -1.22 0.15 -1.26 -5.08 113.70 102.20 2fh0 s SER 39 Ca 0.60 -0.42 -0.01 0.00 0.70 0.00 0.00 55.95 56.82 2fh0 s SER 39 Cb -0.13 1.68 0.01 0.00 -1.71 0.00 0.00 66.02 65.86 2fh0 s SER 39 CO 0.40 -0.26 0.03 0.00 1.20 0.00 0.00 173.24 174.60 2fh0 n ALA 40 N 4.96 -2.46 -1.46 5.45 0.00 -1.26 -4.99 120.51 120.74 2fh0 n ALA 40 Ca 0.07 0.58 -0.32 0.00 0.00 0.00 0.00 53.44 53.77 2fh0 n ALA 40 Cb 0.53 -1.47 0.06 0.00 0.00 0.00 0.00 19.45 18.57 2fh0 n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2fh0 s PRO 41 N -0.95 2.73 -0.41 0.00 0.04 -1.26 -5.03 135.00 130.12 2fh0 s PRO 41 Ca -0.03 1.19 0.05 0.00 0.04 0.00 0.00 61.00 62.25 2fh0 s PRO 41 Cb 0.00 -1.95 0.30 0.00 0.04 0.00 0.00 34.50 32.89 2fh0 s PRO 41 CO 0.09 -1.28 1.17 1.55 0.04 0.00 0.00 177.00 178.56 2fh0 n VAL 42 N -2.88 0.00 0.00 -0.36 3.14 -1.26 -4.98 118.33 112.00 2fh0 n VAL 42 Ca 0.09 -1.18 0.00 0.00 -2.96 0.00 0.00 64.34 60.29 2fh0 n VAL 42 Cb 0.53 1.34 0.00 0.00 -1.06 0.00 0.00 33.84 34.65 2fh0 n VAL 42 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2fh0 n GLY 43 N 0.77 4.68 0.36 7.55 0.00 -1.26 -4.98 105.19 112.32 2fh0 n GLY 43 Ca 0.03 -0.76 0.02 0.00 0.00 0.00 0.00 46.02 45.30 2fh0 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fh0 h ALA 44 N 0.00 1.45 -0.79 4.61 0.00 -1.98 0.68 119.26 123.22 2fh0 h ALA 44 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2fh0 h ALA 44 Cb 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 2fh0 h ALA 44 CO 0.00 0.47 0.31 0.00 0.00 0.00 0.00 179.25 180.02 2fh0 h ALA 45 N 1.49 1.05 0.00 0.00 0.00 -1.96 -2.94 119.26 116.90 2fh0 h ALA 45 Ca 0.35 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2fh0 h ALA 45 Cb 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2fh0 h ALA 45 CO -0.10 0.67 -1.08 0.82 0.00 0.00 0.00 179.25 179.55 2fh0 h ILE 46 N 1.15 0.52 -0.74 0.00 5.03 -1.84 -3.34 117.51 118.28 2fh0 h ILE 46 Ca 0.26 -1.91 0.16 0.00 -0.12 0.00 0.00 64.86 63.26 2fh0 h ILE 46 Cb 0.23 2.07 -0.05 0.00 -3.03 0.00 0.00 36.82 36.04 2fh0 h ILE 46 CO -0.02 0.30 0.50 0.00 -0.68 0.00 0.00 178.15 178.25 2fh0 h ALA 47 N 1.53 2.24 0.00 1.87 0.00 0.54 0.20 119.26 125.64 2fh0 h ALA 47 Ca -0.10 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 2fh0 h ALA 47 Cb 1.44 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 2fh0 h ALA 47 CO 0.04 -0.45 -0.86 -0.91 0.00 0.00 0.00 179.25 177.08 2fh0 h ASN 48 N 0.31 0.00 -0.07 0.00 2.35 -1.68 -3.26 115.58 113.24 2fh0 h ASN 48 Ca 0.37 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 56.04 2fh0 h ASN 48 Cb 0.98 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.33 2fh0 h ASN 48 CO -0.10 0.74 -0.17 -0.26 -1.65 0.00 0.00 177.43 176.00 2fh0 h PHE 49 N 0.00 0.46 -3.88 1.19 -1.00 -0.76 -3.43 116.94 109.51 2fh0 h PHE 49 Ca -0.04 -0.08 -0.51 0.00 2.81 0.00 0.00 57.97 60.16 2fh0 h PHE 49 Cb 1.60 -0.12 0.04 0.00 3.61 0.00 0.00 35.95 41.08 2fh0 h PHE 49 CO 0.00 0.58 0.53 -0.51 -1.61 0.00 0.00 178.31 177.30 2fh0 s LEU 50 N -8.77 4.36 0.17 1.54 1.02 -0.79 -3.90 118.68 112.32 2fh0 s LEU 50 Ca -0.07 2.40 -0.26 0.00 0.02 0.00 0.00 54.13 56.23 2fh0 s LEU 50 Cb 0.15 -3.81 -0.08 0.00 0.02 0.00 0.00 46.19 42.47 2fh0 s LEU 50 CO 0.77 -0.47 0.79 -1.61 0.02 0.00 0.00 176.35 175.86 2fh0 s GLU 51 N -1.91 4.60 0.27 1.70 0.41 -1.26 -4.94 118.70 117.57 2fh0 s GLU 51 Ca 0.51 1.19 0.00 0.00 -0.41 0.00 0.00 54.97 56.26 2fh0 s GLU 51 Cb -0.33 -3.26 0.54 0.00 -1.78 0.00 0.00 34.13 29.29 2fh0 s GLU 51 CO 0.43 0.57 1.80 -1.35 -0.49 0.00 0.00 175.26 176.21 2fh0 h PRO 52 N 4.31 0.79 -0.23 0.39 0.11 -1.95 0.33 132.00 135.75 2fh0 h PRO 52 Ca -0.47 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 2fh0 h PRO 52 Cb 1.21 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2fh0 h PRO 52 CO 0.66 0.52 -0.04 0.37 -0.21 0.00 0.00 178.00 179.31 2fh0 h GLN 53 N 0.81 0.44 -0.38 1.05 4.15 -1.98 -2.48 115.11 116.71 2fh0 h GLN 53 Ca 0.48 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.71 2fh0 h GLN 53 Cb 0.57 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 2fh0 h GLN 53 CO -0.31 0.65 0.10 0.00 -1.93 0.00 0.00 178.83 177.35 2fh0 h ALA 54 N 0.77 1.47 -0.26 3.38 0.00 -1.64 -2.33 119.26 120.65 2fh0 h ALA 54 Ca 0.06 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 2fh0 h ALA 54 Cb 0.48 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2fh0 h ALA 54 CO 0.02 0.39 -0.30 -0.07 0.00 0.00 0.00 179.25 179.29 2fh0 h LEU 55 N 0.55 0.55 -0.19 0.00 3.38 -0.82 -1.43 115.31 117.35 2fh0 h LEU 55 Ca 0.13 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2fh0 h LEU 55 Cb 0.19 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2fh0 h LEU 55 CO -0.01 0.82 0.08 -0.08 0.09 0.00 0.00 178.44 179.35 2fh0 h GLU 56 N 0.46 0.28 -0.14 1.13 4.81 -0.95 -2.23 114.58 117.94 2fh0 h GLU 56 Ca 0.06 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.10 2fh0 h GLU 56 Cb 0.75 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2fh0 h GLU 56 CO 0.06 0.34 -0.53 0.07 -0.73 0.00 0.00 179.01 178.22 2fh0 h ARG 57 N 0.16 0.40 -0.25 1.92 -0.00 -1.47 -3.01 114.38 112.13 2fh0 h ARG 57 Ca 0.06 -0.24 -0.02 0.00 -0.00 0.00 0.00 59.98 59.78 2fh0 h ARG 57 Cb 0.16 0.02 -0.01 0.00 -0.00 0.00 0.00 29.97 30.14 2fh0 h ARG 57 CO -0.01 0.83 0.06 1.25 -0.00 0.00 0.00 179.97 182.10 2fh0 h LEU 58 N 0.31 0.32 -0.90 0.08 5.85 -1.11 -2.05 115.31 117.81 2fh0 h LEU 58 Ca 0.01 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 2fh0 h LEU 58 Cb 1.03 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 2fh0 h LEU 58 CO 0.09 0.33 0.01 0.28 -0.34 0.00 0.00 178.44 178.81 2fh0 h SER 59 N 0.35 0.78 -0.29 1.25 0.02 -1.26 -0.22 113.55 114.18 2fh0 h SER 59 Ca 0.09 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 2fh0 h SER 59 Cb 0.14 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 2fh0 h SER 59 CO -0.00 0.84 0.04 -0.09 -1.14 0.00 0.00 176.83 176.48 2fh0 h ARG 60 N 0.76 0.49 -0.43 3.45 9.65 -1.41 -2.45 114.38 124.44 2fh0 h ARG 60 Ca 0.15 -0.14 -0.14 0.00 -1.10 0.00 0.00 59.98 58.75 2fh0 h ARG 60 Cb 0.45 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 2fh0 h ARG 60 CO 0.02 0.61 -0.29 -0.24 2.80 0.00 0.00 179.97 182.87 2fh0 h VAL 61 N 0.31 1.27 -0.18 0.20 3.04 -1.35 -2.99 116.25 116.55 2fh0 h VAL 61 Ca 0.09 -1.45 0.01 0.00 -1.01 0.00 0.00 66.70 64.33 2fh0 h VAL 61 Cb 0.36 1.25 -0.01 0.00 -2.01 0.00 0.00 31.29 30.88 2fh0 h VAL 61 CO 0.01 0.49 0.12 0.00 -1.01 0.00 0.00 177.57 177.18 2fh0 h ALA 62 N 0.82 1.92 -0.42 3.17 0.00 -0.98 0.42 119.26 124.20 2fh0 h ALA 62 Ca 0.09 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2fh0 h ALA 62 Cb 0.87 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2fh0 h ALA 62 CO 0.08 0.06 0.01 -0.07 0.00 0.00 0.00 179.25 179.33 2fh0 h LEU 63 N 0.20 0.63 0.00 0.00 3.38 -1.28 -3.05 115.31 115.19 2fh0 h LEU 63 Ca 0.07 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2fh0 h LEU 63 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2fh0 h LEU 63 CO -0.01 0.69 -1.02 0.52 0.09 0.00 0.00 178.44 178.71 2fh0 n VAL 64 N -4.25 1.47 -3.81 1.22 0.31 -0.70 -4.84 118.33 107.73 2fh0 n VAL 64 Ca 0.02 0.08 -0.30 0.00 -0.01 0.00 0.00 64.34 64.13 2fh0 n VAL 64 Cb 0.27 -2.24 -0.14 0.00 -0.91 0.00 0.00 33.84 30.81 2fh0 n VAL 64 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2fh0 s ARG 65 N -2.43 1.29 0.46 5.55 3.00 0.14 -4.97 118.95 121.99 2fh0 s ARG 65 Ca -0.24 -1.85 0.11 0.00 0.00 0.00 0.00 55.73 53.75 2fh0 s ARG 65 Cb 0.05 -2.57 1.04 0.00 0.00 0.00 0.00 34.95 33.46 2fh0 s ARG 65 CO 0.38 -1.07 2.10 -0.09 0.00 0.00 0.00 175.30 176.62 2fh0 h ARG 66 N 7.19 0.30 -0.68 3.54 2.43 -1.69 -2.46 114.38 123.01 2fh0 h ARG 66 Ca -0.06 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2fh0 h ARG 66 Cb 0.96 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.38 2fh0 h ARG 66 CO 0.52 0.20 0.36 0.22 -1.51 0.00 0.00 179.97 179.76 2fh0 h ASP 67 N 0.31 0.51 -0.06 -3.80 3.58 -1.92 0.68 116.42 115.72 2fh0 h ASP 67 Ca 0.08 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 2fh0 h ASP 67 Cb -0.03 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 40.97 2fh0 h ASP 67 CO -0.02 0.32 0.00 0.03 -2.88 0.00 0.00 179.24 176.69 2fh0 h ARG 68 N 0.65 0.10 -0.56 0.28 -0.00 -1.80 -1.17 114.38 111.88 2fh0 h ARG 68 Ca 0.32 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.98 59.68 2fh0 h ARG 68 Cb 0.26 -0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.20 2fh0 h ARG 68 CO -0.22 0.38 0.00 0.00 0.00 0.00 0.00 179.97 180.13 2fh0 h ALA 69 N 0.72 0.76 -0.36 0.04 0.00 -1.36 -2.78 119.26 116.28 2fh0 h ALA 69 Ca 0.02 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 2fh0 h ALA 69 Cb 0.33 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2fh0 h ALA 69 CO 0.00 0.59 -0.23 -0.56 0.00 0.00 0.00 179.25 179.05 2fh0 h GLN 70 N 0.88 0.71 -0.46 0.00 -0.00 0.35 -2.70 115.11 113.88 2fh0 h GLN 70 Ca 0.16 -0.28 -0.03 0.00 -0.00 0.00 0.00 58.65 58.50 2fh0 h GLN 70 Cb 0.54 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.48 27.97 2fh0 h GLN 70 CO 0.03 0.88 0.16 0.00 -0.00 0.00 0.00 178.83 179.89 2fh0 h ALA 71 N 1.12 1.42 -0.14 0.06 0.00 -1.08 0.31 119.26 120.96 2fh0 h ALA 71 Ca 0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2fh0 h ALA 71 Cb 0.72 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2fh0 h ALA 71 CO 0.06 0.43 -0.02 0.28 0.00 0.00 0.00 179.25 180.00 2fh0 h VAL 72 N 0.66 1.28 -0.22 0.00 2.07 -1.22 0.14 116.25 118.96 2fh0 h VAL 72 Ca 0.16 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 2fh0 h VAL 72 Cb 0.17 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2fh0 h VAL 72 CO -0.01 0.27 -0.06 -0.33 0.02 0.00 0.00 177.57 177.46 2fh0 h GLU 73 N -0.04 0.42 -0.17 1.57 4.39 -1.19 -2.25 114.58 117.32 2fh0 h GLU 73 Ca 0.04 -0.17 -0.05 0.00 0.34 0.00 0.00 59.36 59.52 2fh0 h GLU 73 Cb 0.44 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 2fh0 h GLU 73 CO 0.01 0.68 -0.12 1.15 -1.16 0.00 0.00 179.01 179.56 2fh0 h THR 74 N 0.15 1.18 -0.22 1.13 2.02 -0.41 -2.35 112.91 114.41 2fh0 h THR 74 Ca 0.05 -0.79 -0.03 0.00 0.77 0.00 0.00 66.41 66.41 2fh0 h THR 74 Cb 0.53 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 2fh0 h THR 74 CO 0.02 0.25 0.00 0.22 0.37 0.00 0.00 175.52 176.38 2fh0 h TYR 75 N 0.25 0.41 -0.33 3.16 5.03 -0.54 -2.12 116.97 122.85 2fh0 h TYR 75 Ca 0.05 -0.07 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 2fh0 h TYR 75 Cb 0.38 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.53 2fh0 h TYR 75 CO 0.01 0.56 0.15 1.25 -1.32 0.00 0.00 178.16 178.81 2fh0 h LEU 76 N 0.15 0.43 -1.50 2.82 5.85 -1.17 -2.61 115.31 119.27 2fh0 h LEU 76 Ca 0.06 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2fh0 h LEU 76 Cb 0.39 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 2fh0 h LEU 76 CO 0.01 0.44 0.16 0.07 -0.34 0.00 0.00 178.44 178.77 2fh0 h LYS 77 N 0.39 0.49 -0.42 1.25 2.10 -1.42 -1.99 116.57 116.97 2fh0 h LYS 77 Ca 0.11 -0.05 -0.03 0.00 -2.00 0.00 0.00 60.65 58.68 2fh0 h LYS 77 Cb 0.12 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.34 2fh0 h LYS 77 CO -0.01 0.40 0.15 0.87 -2.00 0.00 0.00 179.45 178.85 2fh0 h LYS 78 N 0.49 0.63 -0.31 0.07 1.57 -1.02 0.27 116.57 118.28 2fh0 h LYS 78 Ca 0.12 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2fh0 h LYS 78 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2fh0 h LYS 78 CO -0.02 0.61 0.08 -0.07 -0.57 0.00 0.00 179.45 179.48 2fh0 h LEU 79 N 0.53 0.47 -0.45 2.94 3.38 -1.12 -0.75 115.31 120.31 2fh0 h LEU 79 Ca 0.14 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 2fh0 h LEU 79 Cb 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2fh0 h LEU 79 CO -0.01 0.57 -0.08 0.40 0.09 0.00 0.00 178.44 179.41 2fh0 h ILE 80 N 0.34 1.27 -0.16 1.22 2.04 -1.27 0.30 117.51 121.25 2fh0 h ILE 80 Ca 0.10 -1.18 -0.06 0.00 1.00 0.00 0.00 64.86 64.71 2fh0 h ILE 80 Cb 0.29 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 2fh0 h ILE 80 CO 0.00 0.40 -0.17 0.00 0.00 0.00 0.00 178.15 178.38 2fh0 h ALA 81 N 0.88 1.41 0.00 1.87 0.00 -0.37 -3.31 119.26 119.74 2fh0 h ALA 81 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2fh0 h ALA 81 Cb 0.61 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2fh0 h ALA 81 CO 0.04 0.41 -0.07 1.79 0.00 0.00 0.00 179.25 181.42 2fh0 h THR 82 N 0.25 0.00 0.00 0.00 1.35 -0.96 -3.49 112.91 110.05 2fh0 h THR 82 Ca 0.05 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 2fh0 h THR 82 Cb 0.46 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.88 2fh0 h THR 82 CO 0.03 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 174.84 2fh0 n ASN 83 N -3.90 0.00 -4.55 5.36 6.94 0.16 -5.10 115.26 114.18 2fh0 n ASN 83 Ca -0.01 0.00 -0.31 0.00 -0.02 0.00 0.00 54.58 54.24 2fh0 n ASN 83 Cb 0.04 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.41 2fh0 n ASN 83 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2fh0 n ASN 84 N 0.00 2.07 -3.48 0.53 3.02 0.82 -4.86 115.26 113.37 2fh0 n ASN 84 Ca 0.00 -0.69 -0.28 0.00 -0.03 0.00 0.00 54.58 53.58 2fh0 n ASN 84 Cb 0.00 -1.56 -0.13 0.00 -0.61 0.00 0.00 39.78 37.48 2fh0 n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2fh0 s VAL 85 N 12.53 0.06 0.00 2.41 1.01 -1.26 -3.15 120.40 131.99 2fh0 s VAL 85 Ca 0.99 -1.43 0.04 0.00 0.00 0.00 0.00 61.98 61.59 2fh0 s VAL 85 Cb -0.22 -1.06 0.07 0.00 0.00 0.00 0.00 36.38 35.17 2fh0 s VAL 85 CO 0.24 -0.90 1.01 1.07 0.00 0.00 0.00 175.10 176.51 2fh0 n THR 86 N 4.37 0.00 -4.01 3.92 5.66 -1.26 -5.14 114.28 117.82 2fh0 n THR 86 Ca 0.07 -0.16 0.03 0.00 -3.05 0.00 0.00 64.05 60.94 2fh0 n THR 86 Cb 0.39 0.56 0.01 0.00 -1.55 0.00 0.00 70.33 69.74 2fh0 n THR 86 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2fh0 n HIS 87 N 0.08 -0.11 -4.30 1.09 1.44 -1.26 -5.19 115.22 106.97 2fh0 n HIS 87 Ca -0.21 -0.40 -0.15 0.00 -2.01 0.00 0.00 57.72 54.94 2fh0 n HIS 87 Cb 0.77 0.17 -0.04 0.00 0.12 0.00 0.00 29.99 31.01 2fh0 n HIS 87 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2fh0 n LYS 88 N -0.68 0.67 0.06 -1.40 5.02 -1.26 -5.08 118.16 115.49 2fh0 n LYS 88 Ca 0.04 -2.14 -0.02 0.00 -2.02 0.00 0.00 58.31 54.17 2fh0 n LYS 88 Cb 0.41 1.21 -0.01 0.00 -0.02 0.00 0.00 35.03 36.62 2fh0 n LYS 88 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2fh0 h ILE 89 N 1.44 0.00 -3.47 -0.18 1.08 -1.92 -3.47 117.51 110.98 2fh0 h ILE 89 Ca -0.19 -0.05 0.05 0.00 -0.39 0.00 0.00 64.86 64.28 2fh0 h ILE 89 Cb 0.75 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.47 2fh0 h ILE 89 CO 0.30 0.00 -0.96 0.35 -0.69 0.00 0.00 178.15 177.15 2fh0 n THR 90 N -2.57 -2.44 0.09 -0.27 -2.24 -1.26 -3.04 114.28 102.56 2fh0 n THR 90 Ca -0.02 1.29 0.02 0.00 -2.27 0.00 0.00 64.05 63.07 2fh0 n THR 90 Cb 0.06 -2.13 0.36 0.00 -2.10 0.00 0.00 70.33 66.53 2fh0 n THR 90 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2fh0 h GLU 91 N -0.09 0.29 -0.14 -0.78 4.39 -1.91 -0.29 114.58 116.06 2fh0 h GLU 91 Ca -0.03 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.54 2fh0 h GLU 91 Cb 0.97 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.58 2fh0 h GLU 91 CO 0.01 0.42 -0.16 0.00 -1.16 0.00 0.00 179.01 178.13 2fh0 h ALA 92 N 1.61 0.20 -0.05 3.43 0.00 -2.00 -2.69 119.26 119.76 2fh0 h ALA 92 Ca 0.06 -0.33 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 2fh0 h ALA 92 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2fh0 h ALA 92 CO 0.02 0.10 -0.85 1.49 0.00 0.00 0.00 179.25 180.00 2fh0 h GLU 93 N -0.04 0.50 -0.59 0.00 4.81 -1.57 -3.15 114.58 114.53 2fh0 h GLU 93 Ca 0.02 -0.47 -0.03 0.00 -0.13 0.00 0.00 59.36 58.75 2fh0 h GLU 93 Cb 0.70 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 2fh0 h GLU 93 CO 0.04 1.11 0.25 0.97 -0.73 0.00 0.00 179.01 180.65 2fh0 h ILE 94 N 0.31 1.22 -0.79 2.32 2.10 -0.96 -1.00 117.51 120.72 2fh0 h ILE 94 Ca -0.06 -0.67 0.03 0.00 1.08 0.00 0.00 64.86 65.24 2fh0 h ILE 94 Cb 1.47 0.56 -0.05 0.00 -1.09 0.00 0.00 36.82 37.71 2fh0 h ILE 94 CO 0.15 0.26 0.51 0.58 -1.08 0.00 0.00 178.15 178.57 2fh0 h VAL 95 N 0.81 1.13 -0.49 2.19 2.07 -1.53 -0.11 116.25 120.33 2fh0 h VAL 95 Ca 0.20 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2fh0 h VAL 95 Cb 0.17 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 2fh0 h VAL 95 CO -0.02 0.18 0.18 0.28 0.02 0.00 0.00 177.57 178.21 2fh0 h SER 96 N 0.99 0.69 -0.21 0.57 0.02 -1.42 -1.59 113.55 112.59 2fh0 h SER 96 Ca 0.31 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2fh0 h SER 96 Cb 0.00 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 2fh0 h SER 96 CO -0.11 0.68 0.13 0.40 -1.14 0.00 0.00 176.83 176.79 2fh0 h ILE 97 N 0.65 1.08 -0.93 3.27 2.04 -0.54 -0.32 117.51 122.76 2fh0 h ILE 97 Ca 0.16 -0.18 0.06 0.00 1.00 0.00 0.00 64.86 65.90 2fh0 h ILE 97 Cb 0.22 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 2fh0 h ILE 97 CO -0.01 0.07 0.59 -0.07 0.00 0.00 0.00 178.15 178.74 2fh0 h LEU 98 N 0.26 0.95 -0.90 1.44 -0.00 -0.89 0.31 115.31 116.48 2fh0 h LEU 98 Ca 0.07 0.01 -0.09 0.00 -0.00 0.00 0.00 57.88 57.87 2fh0 h LEU 98 Cb 0.01 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 40.46 2fh0 h LEU 98 CO -0.01 0.62 -0.17 0.78 -0.00 0.00 0.00 178.44 179.65 2fh0 h ASN 99 N 1.09 0.62 -0.07 -0.43 2.35 -0.84 -2.08 115.58 116.22 2fh0 h ASN 99 Ca 0.40 -0.19 -0.19 0.00 -0.55 0.00 0.00 56.30 55.77 2fh0 h ASN 99 Cb 0.14 -0.17 0.01 0.00 0.05 0.00 0.00 38.32 38.35 2fh0 h ASN 99 CO -0.16 0.80 -0.71 1.23 -1.65 0.00 0.00 177.43 176.94 2fh0 h GLY 100 N 0.98 0.67 0.70 2.83 0.00 -0.02 -2.62 103.07 105.60 2fh0 h GLY 100 Ca 0.09 -1.03 0.07 0.00 0.00 0.00 0.00 47.33 46.45 2fh0 h GLY 100 CO 0.04 0.92 0.52 -2.22 0.00 0.00 0.00 176.54 175.80 2fh0 h ILE 101 N 0.23 1.02 -0.22 2.60 2.04 -0.32 0.15 117.51 123.01 2fh0 h ILE 101 Ca -0.07 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 2fh0 h ILE 101 Cb 1.37 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 2fh0 h ILE 101 CO 0.14 0.17 -0.03 0.00 0.00 0.00 0.00 178.15 178.44 2fh0 h ALA 102 N 1.41 0.30 -0.11 1.87 0.00 -1.39 -2.96 119.26 118.38 2fh0 h ALA 102 Ca 0.38 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2fh0 h ALA 102 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2fh0 h ALA 102 CO -0.18 0.06 -0.17 -0.22 0.00 0.00 0.00 179.25 178.73 2fh0 h LYS 103 N 0.16 0.18 0.38 0.00 3.64 -1.04 -3.10 116.57 116.79 2fh0 h LYS 103 Ca 0.06 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2fh0 h LYS 103 Cb 0.46 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2fh0 h LYS 103 CO 0.02 0.35 -0.23 1.96 -2.27 0.00 0.00 179.45 179.28 2fh0 h GLN 104 N 0.17 -0.57 -2.67 1.90 1.08 -0.56 -3.42 115.11 111.04 2fh0 h GLN 104 Ca 0.03 0.04 -0.34 0.00 -1.45 0.00 0.00 58.65 56.93 2fh0 h GLN 104 Cb 0.41 0.13 -0.37 0.00 -0.05 0.00 0.00 27.48 27.60 2fh0 h GLN 104 CO 0.03 -0.38 -0.65 -1.14 -0.95 0.00 0.00 178.83 175.74 2fh0 s GLN 105 N -6.09 0.15 -0.12 1.46 0.74 -1.16 -4.98 119.66 109.67 2fh0 s GLN 105 Ca -0.16 0.19 0.05 0.00 0.05 0.00 0.00 55.36 55.49 2fh0 s GLN 105 Cb 0.05 -1.22 0.15 0.00 1.10 0.00 0.00 33.01 33.08 2fh0 s GLN 105 CO 0.64 -0.62 0.86 -1.71 -0.55 0.00 0.00 175.29 173.90 2fh0 n ASN 106 N 5.31 -0.58 0.00 6.67 5.15 -1.23 -4.75 115.26 125.84 2fh0 n ASN 106 Ca -0.06 -1.41 0.00 0.00 -0.60 0.00 0.00 54.58 52.51 2fh0 n ASN 106 Cb 0.49 0.26 0.00 0.00 -0.53 0.00 0.00 39.78 40.01 2fh0 n ASN 106 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2fh0 n SER 107 N -0.55 0.00 -1.12 1.20 7.64 -1.26 -4.91 113.62 114.62 2fh0 n SER 107 Ca -0.08 0.00 0.09 0.00 1.01 0.00 0.00 58.87 59.89 2fh0 n SER 107 Cb 0.63 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.78 2fh0 n SER 107 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2fh0 n GLN 108 N 0.00 -2.70 -3.59 1.43 -0.06 -1.26 -4.87 117.38 106.33 2fh0 n GLN 108 Ca 0.00 2.18 -0.37 0.00 -2.00 0.00 0.00 57.00 56.81 2fh0 n GLN 108 Cb 0.00 -2.97 -0.09 0.00 -4.06 0.00 0.00 30.24 23.12 2fh0 n GLN 108 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2fh0 s ASN 109 N -5.93 6.17 -1.19 1.69 4.22 -1.26 -5.00 114.94 113.63 2fh0 s ASN 109 Ca 0.00 0.18 -0.19 0.00 -2.14 0.00 0.00 52.86 50.71 2fh0 s ASN 109 Cb 0.00 -2.14 -0.03 0.00 1.28 0.00 0.00 41.25 40.37 2fh0 s ASN 109 CO 0.00 0.01 1.96 -3.20 -2.04 0.00 0.00 177.10 173.83 2fh0 n ASN 110 N 4.47 3.68 -0.06 3.54 4.05 -1.26 -4.42 115.26 125.26 2fh0 n ASN 110 Ca -0.13 -2.79 -0.13 0.00 0.45 0.00 0.00 54.58 51.97 2fh0 n ASN 110 Cb 0.52 -1.57 -0.04 0.00 1.23 0.00 0.00 39.78 39.91 2fh0 n ASN 110 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 2fh0 n SER 111 N 8.90 1.07 -0.84 1.20 2.88 -1.26 -4.80 113.62 120.77 2fh0 n SER 111 Ca 0.49 0.18 0.05 0.00 -1.33 0.00 0.00 58.87 58.26 2fh0 n SER 111 Cb 0.43 -0.43 0.13 0.00 -0.75 0.00 0.00 64.21 63.59 2fh0 n SER 111 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2fh0 n LYS 112 N -3.69 0.94 -0.71 -1.46 5.02 -1.26 -4.74 118.16 112.27 2fh0 n LYS 112 Ca -0.24 -2.68 0.06 0.00 -2.02 0.00 0.00 58.31 53.43 2fh0 n LYS 112 Cb 0.62 -1.01 0.19 0.00 -0.02 0.00 0.00 35.03 34.81 2fh0 n LYS 112 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2fh0 n ILE 113 N -0.55 1.93 -0.01 -0.18 5.41 -1.26 -4.68 119.36 120.03 2fh0 n ILE 113 Ca 0.13 -2.96 -0.02 0.00 1.00 0.00 0.00 62.75 60.90 2fh0 n ILE 113 Cb 0.84 -0.09 -0.12 0.00 -0.71 0.00 0.00 39.64 39.57 2fh0 n ILE 113 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2fh0 n ILE 114 N -0.92 1.15 -1.89 1.39 5.41 -1.26 -4.78 119.36 118.47 2fh0 n ILE 114 Ca 0.17 -0.72 -0.24 0.00 1.00 0.00 0.00 62.75 62.96 2fh0 n ILE 114 Cb 0.75 -0.64 -0.05 0.00 -0.71 0.00 0.00 39.64 38.98 2fh0 n ILE 114 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 2fh0 s PHE 115 N -2.86 1.56 0.00 1.39 5.36 -1.26 -5.21 117.98 116.96 2fh0 s PHE 115 Ca -0.05 1.09 0.00 0.00 -0.96 0.00 0.00 56.93 57.01 2fh0 s PHE 115 Cb 0.09 -3.85 0.00 0.00 -0.34 0.00 0.00 43.02 38.92 2fh0 s PHE 115 CO 0.83 -1.77 0.23 0.39 -1.46 0.00 0.00 175.22 173.44