#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2owp n GLU 2 N 0.00 0.00 -3.22 1.61 2.13 -1.26 -4.17 120.64 115.73 2owp n GLU 2 Ca 0.00 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.43 2owp n GLU 2 Cb 0.00 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.65 2owp n GLU 2 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2owp s VAL 3 N -0.50 5.09 -0.94 6.31 1.01 -1.26 -0.60 120.40 129.51 2owp s VAL 3 Ca 0.00 1.00 -0.04 0.00 0.00 0.00 0.00 61.98 62.94 2owp s VAL 3 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2owp s VAL 3 CO 0.00 0.18 0.81 0.59 0.00 0.00 0.00 175.10 176.68 2owp n ASN 4 N 4.75 -4.09 -4.68 3.32 3.02 -0.70 -4.95 115.26 111.93 2owp n ASN 4 Ca -0.04 -0.41 -0.44 0.00 -0.03 0.00 0.00 54.58 53.66 2owp n ASN 4 Cb 0.50 -3.80 -0.03 0.00 -0.61 0.00 0.00 39.78 35.84 2owp n ASN 4 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2owp n GLN 5 N -3.59 2.63 -0.35 3.52 6.02 -1.26 -4.82 117.38 119.53 2owp n GLN 5 Ca -0.07 0.96 0.08 0.00 -0.01 0.00 0.00 57.00 57.95 2owp n GLN 5 Cb 0.57 -2.83 0.25 0.00 1.02 0.00 0.00 30.24 29.25 2owp n GLN 5 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2owp h PRO 6 N 8.46 0.94 -1.00 -1.09 0.11 -1.99 -0.53 132.00 136.90 2owp h PRO 6 Ca -0.47 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.60 2owp h PRO 6 Cb 1.23 -0.21 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 2owp h PRO 6 CO 0.94 0.62 0.67 -0.44 -0.21 0.00 0.00 178.00 179.58 2owp h ASP 7 N 0.97 1.15 -0.05 -2.05 3.32 -1.99 -1.30 116.42 116.47 2owp h ASP 7 Ca 0.49 -0.03 -0.20 0.00 0.02 0.00 0.00 57.03 57.31 2owp h ASP 7 Cb 0.50 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.78 2owp h ASP 7 CO -0.26 0.82 -0.76 0.40 -1.72 0.00 0.00 179.24 177.73 2owp h ILE 8 N 1.35 1.34 -0.76 0.35 1.08 -1.62 -1.79 117.51 117.47 2owp h ILE 8 Ca 0.37 -2.06 0.06 0.00 -0.39 0.00 0.00 64.86 62.84 2owp h ILE 8 Cb -0.14 2.33 -0.06 0.00 -3.07 0.00 0.00 36.82 35.89 2owp h ILE 8 CO -0.09 0.63 0.45 0.58 -0.69 0.00 0.00 178.15 179.03 2owp h VAL 9 N 0.22 0.99 -0.60 1.67 2.07 -0.97 -2.00 116.25 117.62 2owp h VAL 9 Ca -0.08 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2owp h VAL 9 Cb 1.42 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 2owp h VAL 9 CO 0.15 0.15 0.24 0.00 0.02 0.00 0.00 177.57 178.13 2owp h ALA 10 N 1.38 0.78 -0.37 1.67 0.00 -1.10 -0.10 119.26 121.52 2owp h ALA 10 Ca 0.34 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2owp h ALA 10 Cb 0.20 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2owp h ALA 10 CO -0.19 0.40 0.21 1.96 0.00 0.00 0.00 179.25 181.63 2owp h GLN 11 N 0.84 0.41 -0.23 0.00 4.20 -1.03 -2.02 115.11 117.28 2owp h GLN 11 Ca 0.20 -0.02 -0.19 0.00 0.06 0.00 0.00 58.65 58.69 2owp h GLN 11 Cb 0.21 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2owp h GLN 11 CO -0.02 0.27 -0.62 0.28 -0.67 0.00 0.00 178.83 178.07 2owp h VAL 12 N 0.43 1.28 -0.73 -0.54 2.07 -1.05 -1.71 116.25 116.00 2owp h VAL 12 Ca 0.15 -1.82 0.08 0.00 0.82 0.00 0.00 66.70 65.92 2owp h VAL 12 Cb 0.02 1.76 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 2owp h VAL 12 CO -0.08 0.59 0.41 1.56 0.02 0.00 0.00 177.57 180.06 2owp h GLN 13 N 0.60 0.70 -0.26 1.57 1.08 -0.97 0.15 115.11 117.98 2owp h GLN 13 Ca -0.01 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.13 2owp h GLN 13 Cb 1.23 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 28.49 2owp h GLN 13 CO 0.13 0.46 0.10 0.00 -0.95 0.00 0.00 178.83 178.57 2owp h ALA 14 N 1.40 0.33 -0.49 3.87 0.00 -1.10 -1.63 119.26 121.64 2owp h ALA 14 Ca 0.34 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2owp h ALA 14 Cb 0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2owp h ALA 14 CO -0.22 -0.07 0.22 0.00 0.00 0.00 0.00 179.25 179.19 2owp h ALA 15 N 0.94 0.63 -0.50 0.00 0.00 -0.94 -1.96 119.26 117.43 2owp h ALA 15 Ca 0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2owp h ALA 15 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2owp h ALA 15 CO -0.01 0.21 0.31 0.35 0.00 0.00 0.00 179.25 180.11 2owp h PHE 16 N 0.65 0.66 0.00 0.00 3.57 -0.61 -1.43 116.94 119.77 2owp h PHE 16 Ca 0.17 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.55 2owp h PHE 16 Cb 0.15 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 2owp h PHE 16 CO -0.00 0.45 -0.57 0.28 -2.23 0.00 0.00 178.31 176.24 2owp h VAL 17 N 0.67 1.25 -0.67 1.41 2.07 -1.21 -0.71 116.25 119.07 2owp h VAL 17 Ca 0.18 -2.07 -0.08 0.00 0.82 0.00 0.00 66.70 65.54 2owp h VAL 17 Cb -0.02 2.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 2owp h VAL 17 CO -0.03 0.56 0.10 -0.08 0.02 0.00 0.00 177.57 178.14 2owp h GLU 18 N 0.00 1.12 -0.70 1.57 4.57 -1.22 -1.04 114.58 118.89 2owp h GLU 18 Ca -0.01 -0.31 -0.05 0.00 -1.18 0.00 0.00 59.36 57.82 2owp h GLU 18 Cb 1.12 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.55 2owp h GLU 18 CO 0.07 1.03 0.25 -0.92 -1.18 0.00 0.00 179.01 178.26 2owp h TYR 19 N 1.04 1.09 -0.84 0.92 3.20 -0.64 -1.27 116.97 120.48 2owp h TYR 19 Ca 0.20 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 2owp h TYR 19 Cb 0.46 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 2owp h TYR 19 CO 0.03 0.86 0.45 0.93 -1.64 0.00 0.00 178.16 178.80 2owp h GLU 20 N 1.01 1.17 -0.26 1.82 4.39 -0.98 0.24 114.58 121.97 2owp h GLU 20 Ca 0.23 -0.14 0.02 0.00 0.34 0.00 0.00 59.36 59.81 2owp h GLU 20 Cb 0.25 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 2owp h GLU 20 CO -0.01 0.86 0.11 -0.09 -1.16 0.00 0.00 179.01 178.72 2owp h ARG 21 N 1.17 0.23 -0.57 2.33 2.43 -0.85 -0.13 114.38 119.00 2owp h ARG 21 Ca 0.29 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.51 2owp h ARG 21 Cb 0.04 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.48 2owp h ARG 21 CO -0.05 0.15 0.27 0.00 -1.51 0.00 0.00 179.97 178.84 2owp h ALA 22 N 1.15 0.73 0.26 2.80 0.00 -0.74 0.54 119.26 124.00 2owp h ALA 22 Ca 0.11 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2owp h ALA 22 Cb 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2owp h ALA 22 CO -0.10 -0.09 -0.29 -0.07 0.00 0.00 0.00 179.25 178.71 2owp h LEU 23 N 0.51 -0.78 -1.06 0.00 3.38 -0.28 0.72 115.31 117.80 2owp h LEU 23 Ca 0.26 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 2owp h LEU 23 Cb 0.21 0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2owp h LEU 23 CO -0.20 -0.40 0.36 0.58 0.09 0.00 0.00 178.44 178.86 2owp h VAL 24 N -0.59 1.23 -0.05 1.22 2.07 -0.72 -1.85 116.25 117.57 2owp h VAL 24 Ca -0.00 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2owp h VAL 24 Cb 0.55 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 2owp h VAL 24 CO -0.08 0.27 0.00 -0.62 0.02 0.00 0.00 177.57 177.16 2owp n GLU 25 N -4.34 1.50 -4.10 1.57 1.02 0.16 -4.86 120.64 111.59 2owp n GLU 25 Ca 0.07 -0.73 -0.30 0.00 -0.02 0.00 0.00 57.16 56.18 2owp n GLU 25 Cb 0.13 -1.44 -0.04 0.00 -0.02 0.00 0.00 31.44 30.07 2owp n GLU 25 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2owp n ASN 26 N -0.09 -0.95 -4.49 1.62 5.15 -0.30 -4.87 115.26 111.33 2owp n ASN 26 Ca 0.19 -1.06 -0.43 0.00 -0.60 0.00 0.00 54.58 52.68 2owp n ASN 26 Cb 0.27 -2.71 -0.02 0.00 -0.53 0.00 0.00 39.78 36.79 2owp n ASN 26 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2owp s ASP 27 N -4.06 6.71 0.22 1.20 -1.08 0.09 -4.86 116.67 114.89 2owp s ASP 27 Ca 0.22 -2.15 -0.09 0.00 -0.52 0.00 0.00 52.55 50.01 2owp s ASP 27 Cb -0.12 -2.45 0.20 0.00 -1.46 0.00 0.00 42.92 39.09 2owp s ASP 27 CO 0.92 -1.09 1.88 0.40 0.52 0.00 0.00 175.17 177.80 2owp h ILE 28 N 5.76 1.18 -0.61 4.11 2.04 -1.89 -2.47 117.51 125.63 2owp h ILE 28 Ca 0.22 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.74 2owp h ILE 28 Cb 0.98 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 2owp h ILE 28 CO 1.23 0.19 0.38 -0.33 0.00 0.00 0.00 178.15 179.62 2owp h GLU 29 N 1.06 0.72 -1.52 2.37 5.08 -1.98 -0.55 114.58 119.76 2owp h GLU 29 Ca 0.30 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2owp h GLU 29 Cb -0.08 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.00 2owp h GLU 29 CO -0.08 0.48 0.00 0.00 -1.00 0.00 0.00 179.01 178.41 2owp n ALA 30 N -2.30 1.94 0.00 3.43 0.00 -0.93 -1.60 120.51 121.06 2owp n ALA 30 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2owp n ALA 30 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2owp n ALA 30 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2owp n ASN 32 N 0.76 0.00 0.10 0.00 3.02 -0.22 -3.05 115.26 115.87 2owp n ASN 32 Ca 0.00 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.64 2owp n ASN 32 Cb 0.22 0.00 0.56 0.00 -0.61 0.00 0.00 39.78 39.95 2owp n ASN 32 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2owp h ALA 33 N 0.00 1.98 -0.02 5.41 0.00 -1.56 -3.00 119.26 122.07 2owp h ALA 33 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2owp h ALA 33 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2owp h ALA 33 CO 0.00 -0.02 -0.11 1.28 0.00 0.00 0.00 179.25 180.40 2owp n LEU 34 N -4.49 2.31 -4.43 0.00 4.77 -1.17 -4.92 117.00 109.07 2owp n LEU 34 Ca 0.02 -0.93 -0.33 0.00 -0.03 0.00 0.00 56.01 54.74 2owp n LEU 34 Cb 0.19 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.15 2owp n LEU 34 CO 0.35 0.41 -0.40 0.12 -1.33 0.00 0.00 177.39 176.54 2owp s PHE 35 N -1.70 2.92 0.27 -1.77 2.19 -1.13 -0.61 117.98 118.15 2owp s PHE 35 Ca 0.20 -0.49 -0.31 0.00 0.33 0.00 0.00 56.93 56.66 2owp s PHE 35 Cb 0.15 -1.91 -0.13 0.00 -1.31 0.00 0.00 43.02 39.82 2owp s PHE 35 CO 0.30 -0.14 1.46 1.87 1.83 0.00 0.00 175.22 180.53 2owp n TRP 36 N 3.59 2.40 -3.86 10.12 -0.00 0.02 -4.87 117.44 124.84 2owp n TRP 36 Ca -0.18 0.39 -0.28 0.00 -0.00 0.00 0.00 57.50 57.43 2owp n TRP 36 Cb 0.52 -2.50 -0.12 0.00 -0.00 0.00 0.00 31.31 29.21 2owp n TRP 36 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 177.69 176.11 2owp s HIS 37 N -0.14 3.31 0.14 5.87 5.65 -1.26 -4.64 115.29 124.23 2owp s HIS 37 Ca 0.66 -3.23 -0.05 0.00 0.25 0.00 0.00 55.06 52.68 2owp s HIS 37 Cb -0.59 -2.56 -0.02 0.00 -1.18 0.00 0.00 32.58 28.23 2owp s HIS 37 CO 0.50 -0.59 0.17 0.95 -0.65 0.00 0.00 174.74 175.13 2owp s THR 38 N -1.22 0.09 0.54 0.89 -4.23 -1.26 -4.84 115.64 105.61 2owp s THR 38 Ca 0.25 -1.61 0.37 0.00 -1.18 0.00 0.00 61.69 59.52 2owp s THR 38 Cb -0.06 -1.89 0.40 0.00 1.34 0.00 0.00 72.50 72.29 2owp s THR 38 CO -0.15 -0.41 2.25 -0.65 -0.54 0.00 0.00 174.62 175.12 2owp h PRO 39 N 2.71 0.00 0.00 3.99 0.11 -1.96 0.11 132.00 136.96 2owp h PRO 39 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2owp h PRO 39 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2owp h PRO 39 CO 0.54 0.02 0.00 0.93 -0.21 0.00 0.00 178.00 179.28 2owp h GLU 40 N 0.00 0.00 -6.91 1.05 3.07 -1.96 -3.26 114.58 106.58 2owp h GLU 40 Ca -0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 2owp h GLU 40 Cb 0.12 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 28.12 2owp h GLU 40 CO 0.00 0.00 0.71 0.99 -1.40 0.00 0.00 179.01 179.32 2owp s THR 41 N -3.28 2.38 -0.05 1.13 2.01 -1.04 -4.78 115.64 112.02 2owp s THR 41 Ca 0.06 0.38 0.04 0.00 0.31 0.00 0.00 61.69 62.49 2owp s THR 41 Cb 0.07 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.34 2owp s THR 41 CO 0.62 0.09 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.80 2owp s VAL 42 N -1.09 1.33 -0.09 3.82 1.01 -1.25 0.85 120.40 124.98 2owp s VAL 42 Ca 0.51 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.85 2owp s VAL 42 Cb -0.43 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 34.82 2owp s VAL 42 CO 0.58 0.39 -0.09 -0.60 0.00 0.00 0.00 175.10 175.38 2owp s ARG 43 N 0.16 1.51 -0.34 2.72 3.52 -0.50 -2.14 118.95 123.88 2owp s ARG 43 Ca -0.06 -0.28 -0.11 0.00 -0.13 0.00 0.00 55.73 55.14 2owp s ARG 43 Cb -0.12 -1.47 -0.00 0.00 -1.56 0.00 0.00 34.95 31.80 2owp s ARG 43 CO 0.02 -0.16 0.20 0.71 -0.81 0.00 0.00 175.30 175.26 2owp s TYR 44 N 1.34 3.21 0.18 5.12 2.02 -0.18 -1.00 117.35 128.03 2owp s TYR 44 Ca -0.02 -0.51 0.02 0.00 -0.37 0.00 0.00 57.07 56.19 2owp s TYR 44 Cb -0.14 -2.42 0.03 0.00 -0.40 0.00 0.00 41.96 39.03 2owp s TYR 44 CO -0.04 -0.46 0.25 0.41 -1.57 0.00 0.00 175.55 174.14 2owp n GLY 45 N 5.03 1.66 0.34 0.71 0.00 0.62 -0.41 105.19 113.14 2owp n GLY 45 Ca -0.13 -2.12 -0.04 0.00 0.00 0.00 0.00 46.02 43.74 2owp n GLY 45 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2owp h ILE 46 N -0.08 1.23 0.00 -0.61 2.04 -1.96 -3.29 117.51 114.85 2owp h ILE 46 Ca -0.08 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2owp h ILE 46 Cb 0.36 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2owp h ILE 46 CO 0.11 0.24 -0.28 0.00 0.00 0.00 0.00 178.15 178.22 2owp n ALA 47 N -2.36 2.01 -3.26 1.87 0.00 -1.26 -4.83 120.51 112.67 2owp n ALA 47 Ca 0.09 -1.47 -0.10 0.00 0.00 0.00 0.00 53.44 51.96 2owp n ALA 47 Cb 0.05 -0.40 -0.04 0.00 0.00 0.00 0.00 19.45 19.06 2owp n ALA 47 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2owp s GLU 48 N -0.94 1.31 -0.05 0.00 1.03 -1.24 -5.15 118.70 113.66 2owp s GLU 48 Ca 0.10 -0.79 0.01 0.00 0.03 0.00 0.00 54.97 54.32 2owp s GLU 48 Cb 0.09 0.52 0.02 0.00 -0.80 0.00 0.00 34.13 33.96 2owp s GLU 48 CO 0.01 -0.55 -0.06 0.08 -1.33 0.00 0.00 175.26 173.41 2owp s VAL 49 N -3.85 0.63 -0.04 1.83 1.01 -1.26 -0.28 120.40 118.44 2owp s VAL 49 Ca 0.07 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.88 2owp s VAL 49 Cb -0.00 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.76 2owp s VAL 49 CO -0.06 0.24 -0.08 -1.10 0.00 0.00 0.00 175.10 174.11 2owp s GLN 50 N 0.82 1.12 -0.21 2.72 -0.21 -0.17 -5.01 119.66 118.71 2owp s GLN 50 Ca -0.12 -0.25 0.00 0.00 0.02 0.00 0.00 55.36 55.01 2owp s GLN 50 Cb -0.14 -1.01 0.02 0.00 1.00 0.00 0.00 33.01 32.88 2owp s GLN 50 CO 0.01 0.00 -0.14 -1.01 -2.12 0.00 0.00 175.29 172.04 2owp s HIS 51 N 0.64 2.94 0.00 0.91 3.76 -1.26 -1.42 115.29 120.86 2owp s HIS 51 Ca -0.10 -1.64 0.00 0.00 -0.15 0.00 0.00 55.06 53.17 2owp s HIS 51 Cb -0.13 -1.98 0.00 0.00 1.11 0.00 0.00 32.58 31.58 2owp s HIS 51 CO 0.01 -0.77 0.00 0.41 -0.85 0.00 0.00 174.74 173.54 2owp n GLY 52 N 4.63 1.84 0.38 -2.22 0.00 0.25 -4.49 105.19 105.57 2owp n GLY 52 Ca -0.19 -1.57 0.23 0.00 0.00 0.00 0.00 46.02 44.49 2owp n GLY 52 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2owp h GLY 53 N 0.00 1.60 0.92 -0.02 0.00 -1.00 -2.42 103.07 102.15 2owp h GLY 53 Ca 0.00 -0.24 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 2owp h GLY 53 CO 0.00 -0.26 -0.09 0.83 0.00 0.00 0.00 176.54 177.02 2owp h GLU 54 N 0.41 0.63 -0.92 4.80 4.39 -1.87 0.06 114.58 122.08 2owp h GLU 54 Ca 0.66 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 60.10 2owp h GLU 54 Cb 1.56 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 30.13 2owp h GLU 54 CO -0.42 0.81 0.54 0.00 -1.16 0.00 0.00 179.01 178.78 2owp h ALA 55 N 0.80 1.18 -0.29 3.43 0.00 -1.67 -1.39 119.26 121.32 2owp h ALA 55 Ca 0.08 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2owp h ALA 55 Cb 0.59 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2owp h ALA 55 CO 0.03 0.66 -0.04 0.82 0.00 0.00 0.00 179.25 180.72 2owp h ILE 56 N 1.28 1.27 -0.52 0.00 2.04 -1.12 -1.09 117.51 119.38 2owp h ILE 56 Ca 0.33 -1.03 -0.06 0.00 1.00 0.00 0.00 64.86 65.10 2owp h ILE 56 Cb -0.02 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 2owp h ILE 56 CO -0.06 0.33 0.07 0.03 0.00 0.00 0.00 178.15 178.52 2owp h ARG 57 N 0.31 0.82 -0.32 2.37 3.08 -0.84 -1.93 114.38 117.86 2owp h ARG 57 Ca 0.08 -0.19 -0.16 0.00 0.07 0.00 0.00 59.98 59.77 2owp h ARG 57 Cb 0.50 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 2owp h ARG 57 CO 0.02 0.78 -0.45 0.00 -1.07 0.00 0.00 179.97 179.26 2owp h ALA 58 N 1.30 0.60 -0.36 0.04 0.00 -1.11 -3.01 119.26 116.72 2owp h ALA 58 Ca 0.16 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2owp h ALA 58 Cb 0.37 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2owp h ALA 58 CO 0.01 0.68 0.23 2.35 0.00 0.00 0.00 179.25 182.52 2owp h TRP 59 N 0.66 0.45 -0.80 0.00 7.01 -0.91 -2.95 115.95 119.41 2owp h TRP 59 Ca 0.04 0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.16 2owp h TRP 59 Cb 1.02 -0.15 -0.06 0.00 -2.10 0.00 0.00 29.16 27.88 2owp h TRP 59 CO 0.06 0.28 0.52 0.00 -2.79 0.00 0.00 178.44 176.51 2owp h ARG 60 N 0.48 0.65 0.00 2.65 3.08 -1.25 -0.49 114.38 119.50 2owp h ARG 60 Ca 0.13 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 2owp h ARG 60 Cb -0.05 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 2owp h ARG 60 CO -0.03 0.43 -0.12 0.93 -1.07 0.00 0.00 179.97 180.11 2owp h GLU 61 N 0.67 0.00 0.00 0.04 4.39 -1.39 -3.31 114.58 114.98 2owp h GLU 61 Ca 0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.08 2owp h GLU 61 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2owp h GLU 61 CO -0.15 0.12 -0.11 2.89 -1.16 0.00 0.00 179.01 180.60 2owp n ARG 62 N -3.69 5.90 -1.64 2.33 1.85 -0.74 -5.07 116.66 115.60 2owp n ARG 62 Ca -0.02 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.52 2owp n ARG 62 Cb 0.24 -0.53 0.05 0.00 -1.05 0.00 0.00 32.46 31.16 2owp n ARG 62 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2owp s GLU 64 N -5.10 4.50 0.83 0.00 0.41 -1.26 -5.01 118.70 113.07 2owp s GLU 64 Ca 0.58 1.91 -0.11 0.00 -0.41 0.00 0.00 54.97 56.94 2owp s GLU 64 Cb -0.13 -3.21 0.09 0.00 -1.78 0.00 0.00 34.13 29.10 2owp s GLU 64 CO 0.55 -0.06 1.09 -2.14 -0.49 0.00 0.00 175.26 174.21 2owp s PRO 65 N -0.57 1.75 0.70 0.39 0.02 -1.26 -5.00 135.00 131.04 2owp s PRO 65 Ca 0.51 1.03 -0.16 0.00 0.02 0.00 0.00 61.00 62.40 2owp s PRO 65 Cb -0.33 -1.85 0.02 0.00 0.02 0.00 0.00 34.50 32.36 2owp s PRO 65 CO 0.39 -1.96 1.23 0.14 -0.33 0.00 0.00 177.00 176.48 2owp s VAL 66 N -2.90 2.22 0.36 3.83 -7.23 -1.26 -4.94 120.40 110.47 2owp s VAL 66 Ca 0.62 0.12 -0.28 0.00 -1.81 0.00 0.00 61.98 60.63 2owp s VAL 66 Cb -0.18 -2.80 -0.10 0.00 0.56 0.00 0.00 36.38 33.86 2owp s VAL 66 CO 0.57 -0.05 1.33 -2.84 -0.31 0.00 0.00 175.10 173.80 2owp s PRO 67 N -3.73 4.21 0.48 4.82 0.02 -1.26 -4.90 135.00 134.64 2owp s PRO 67 Ca 0.77 2.25 0.13 0.00 0.02 0.00 0.00 61.00 64.17 2owp s PRO 67 Cb -0.32 -2.97 1.14 0.00 0.02 0.00 0.00 34.50 32.37 2owp s PRO 67 CO 0.43 -0.32 2.12 0.87 -0.33 0.00 0.00 177.00 179.76 2owp h LYS 68 N 3.12 0.18 0.00 5.54 6.56 -1.92 -2.12 116.57 127.93 2owp h LYS 68 Ca -0.49 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.09 2owp h LYS 68 Cb 1.23 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 2owp h LYS 68 CO 0.64 0.12 0.00 -1.13 -2.06 0.00 0.00 179.45 177.02 2owp n SER 69 N -4.52 0.00 -4.64 0.86 3.41 -1.26 -4.91 113.62 102.57 2owp n SER 69 Ca -0.01 -1.44 -0.49 0.00 -0.26 0.00 0.00 58.87 56.67 2owp n SER 69 Cb 0.09 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.99 2owp n SER 69 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2owp n ARG 70 N -0.71 1.69 -4.10 4.33 0.63 -0.80 -4.48 116.66 113.22 2owp n ARG 70 Ca 0.09 0.61 -0.21 0.00 -0.92 0.00 0.00 57.85 57.42 2owp n ARG 70 Cb 0.04 -2.33 -0.17 0.00 0.45 0.00 0.00 32.46 30.46 2owp n ARG 70 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2owp s LYS 71 N 1.10 0.84 0.40 -0.14 2.20 -0.07 -4.99 119.74 119.08 2owp s LYS 71 Ca 0.83 -0.08 -0.16 0.00 -0.36 0.00 0.00 55.97 56.20 2owp s LYS 71 Cb -0.81 -0.90 -0.09 0.00 -1.51 0.00 0.00 37.83 34.52 2owp s LYS 71 CO 0.44 -0.12 0.84 -0.51 -0.36 0.00 0.00 175.35 175.64 2owp s LEU 72 N 1.10 3.90 0.01 5.43 1.43 -1.26 -1.17 118.68 128.12 2owp s LEU 72 Ca -0.08 1.40 0.00 0.00 -1.03 0.00 0.00 54.13 54.42 2owp s LEU 72 Cb -0.14 -4.26 -0.01 0.00 0.03 0.00 0.00 46.19 41.81 2owp s LEU 72 CO -0.01 -0.36 -0.02 -1.00 0.23 0.00 0.00 176.35 175.19 2owp s HIS 73 N -2.24 0.20 -1.27 0.29 3.76 -0.06 -4.93 115.29 111.05 2owp s HIS 73 Ca 0.56 -0.34 -0.05 0.00 -0.15 0.00 0.00 55.06 55.09 2owp s HIS 73 Cb -0.10 -0.14 -0.01 0.00 1.11 0.00 0.00 32.58 33.44 2owp s HIS 73 CO 0.22 -0.11 0.68 0.54 -0.85 0.00 0.00 174.74 175.22 2owp n ARG 74 N 2.13 -3.66 -2.56 1.40 1.74 -1.26 -1.58 116.66 112.87 2owp n ARG 74 Ca -0.20 0.57 -0.42 0.00 -0.77 0.00 0.00 57.85 57.03 2owp n ARG 74 Cb 0.57 -4.89 -0.03 0.00 -1.02 0.00 0.00 32.46 27.09 2owp n ARG 74 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2owp s THR 75 N -3.66 4.48 -0.21 0.55 2.01 -1.26 -4.32 115.64 113.23 2owp s THR 75 Ca 0.13 1.78 -0.00 0.00 0.31 0.00 0.00 61.69 63.91 2owp s THR 75 Cb -0.04 -4.15 0.02 0.00 0.01 0.00 0.00 72.50 68.35 2owp s THR 75 CO 0.83 0.01 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.94 2owp s VAL 76 N 2.06 2.43 -0.23 3.82 1.01 0.39 -4.99 120.40 124.89 2owp s VAL 76 Ca 0.53 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 61.50 2owp s VAL 76 Cb -0.22 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 2owp s VAL 76 CO 0.21 0.40 0.01 -0.69 0.00 0.00 0.00 175.10 175.03 2owp s VAL 77 N 1.31 3.82 -0.09 2.92 1.01 -1.26 -1.69 120.40 126.42 2owp s VAL 77 Ca 0.03 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.68 2owp s VAL 77 Cb -0.15 -2.75 0.01 0.00 0.00 0.00 0.00 36.38 33.49 2owp s VAL 77 CO -0.09 0.39 -0.13 -0.89 0.00 0.00 0.00 175.10 174.38 2owp s THR 78 N 1.42 1.27 0.11 3.92 2.01 -0.44 -5.02 115.64 118.90 2owp s THR 78 Ca 0.05 -0.53 0.08 0.00 0.31 0.00 0.00 61.69 61.60 2owp s THR 78 Cb -0.15 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 2owp s THR 78 CO 0.00 0.39 -0.13 0.42 -0.69 0.00 0.00 174.62 174.62 2owp s THR 79 N 0.88 3.20 -0.13 -0.82 -4.23 -1.26 -1.05 115.64 112.23 2owp s THR 79 Ca -0.10 -1.34 -0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2owp s THR 79 Cb -0.15 -2.48 0.02 0.00 1.34 0.00 0.00 72.50 71.23 2owp s THR 79 CO 0.01 0.11 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.74 2owp s PHE 80 N -1.19 1.77 0.00 3.99 0.08 0.19 -1.73 117.98 121.10 2owp s PHE 80 Ca 0.20 -0.93 0.00 0.00 0.12 0.00 0.00 56.93 56.32 2owp s PHE 80 Cb -0.11 -1.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.96 2owp s PHE 80 CO 0.12 -0.57 0.00 0.41 -0.10 0.00 0.00 175.22 175.08 2owp n GLY 81 N 4.83 2.25 0.05 4.36 0.00 0.23 -3.00 105.19 113.92 2owp n GLY 81 Ca -0.15 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.53 2owp n GLY 81 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2owp n THR 82 N 0.00 0.00 -0.37 2.61 -2.24 -1.26 -4.71 114.28 108.31 2owp n THR 82 Ca 0.00 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2owp n THR 82 Cb 0.00 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 2owp n THR 82 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2owp n ASP 83 N -1.20 0.95 -4.04 3.42 8.00 -1.24 -4.91 116.55 117.53 2owp n ASP 83 Ca 0.04 -1.32 -0.11 0.00 0.71 0.00 0.00 54.79 54.10 2owp n ASP 83 Cb 0.26 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.25 2owp n ASP 83 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2owp s PHE 84 N -0.32 0.54 0.10 1.24 0.08 -1.16 -1.09 117.98 117.36 2owp s PHE 84 Ca 0.00 -0.54 -0.25 0.00 0.12 0.00 0.00 56.93 56.26 2owp s PHE 84 Cb 0.00 -0.34 0.08 0.00 -0.57 0.00 0.00 43.02 42.19 2owp s PHE 84 CO 0.00 -0.13 0.71 0.00 -0.10 0.00 0.00 175.22 175.70 2owp s ALA 85 N -1.56 -1.68 0.03 5.36 0.00 -0.07 -0.63 121.76 123.21 2owp s ALA 85 Ca -0.11 0.70 0.08 0.00 0.00 0.00 0.00 51.96 52.63 2owp s ALA 85 Cb -0.09 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.70 2owp s ALA 85 CO -0.01 -0.73 -0.22 0.95 0.00 0.00 0.00 175.76 175.75 2owp s THR 86 N -3.47 1.79 -0.13 0.00 -4.23 -0.21 -0.29 115.64 109.11 2owp s THR 86 Ca 0.02 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.36 2owp s THR 86 Cb -0.01 -1.54 0.02 0.00 1.34 0.00 0.00 72.50 72.31 2owp s THR 86 CO -0.11 0.31 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.44 2owp s VAL 87 N -0.73 1.58 -0.12 2.29 1.01 -0.27 -1.33 120.40 122.83 2owp s VAL 87 Ca 0.09 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.43 2owp s VAL 87 Cb -0.09 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.84 2owp s VAL 87 CO 0.01 0.46 -0.23 -0.44 0.00 0.00 0.00 175.10 174.90 2owp s SER 88 N 1.19 3.13 0.04 3.32 0.01 -0.68 -0.86 113.70 119.84 2owp s SER 88 Ca -0.02 -0.58 -0.01 0.00 1.31 0.00 0.00 55.95 56.66 2owp s SER 88 Cb -0.14 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.62 2owp s SER 88 CO -0.06 0.12 -0.02 0.28 0.41 0.00 0.00 173.24 173.97 2owp s THR 89 N 0.58 0.18 0.28 1.44 -1.32 0.06 -0.46 115.64 116.39 2owp s THR 89 Ca -0.13 -1.48 0.06 0.00 -1.21 0.00 0.00 61.69 58.93 2owp s THR 89 Cb -0.17 -1.08 -0.02 0.00 -1.51 0.00 0.00 72.50 69.72 2owp s THR 89 CO 0.03 -0.82 0.40 -1.61 -2.21 0.00 0.00 174.62 170.42 2owp s GLU 90 N -3.06 3.30 -0.06 7.08 2.02 -0.61 -0.27 118.70 127.10 2owp s GLU 90 Ca -0.01 -0.86 -0.22 0.00 0.02 0.00 0.00 54.97 53.89 2owp s GLU 90 Cb 0.02 -2.86 0.05 0.00 0.10 0.00 0.00 34.13 31.44 2owp s GLU 90 CO -0.07 0.28 0.50 -0.59 0.02 0.00 0.00 175.26 175.41 2owp s PHE 91 N -2.06 -0.45 0.29 1.61 -0.71 -0.27 -0.88 117.98 115.51 2owp s PHE 91 Ca 0.38 0.83 0.05 0.00 -1.04 0.00 0.00 56.93 57.15 2owp s PHE 91 Cb -0.09 0.24 -0.06 0.00 -1.21 0.00 0.00 43.02 41.90 2owp s PHE 91 CO 0.30 -0.46 0.01 0.95 -1.34 0.00 0.00 175.22 174.68 2owp s THR 92 N -0.97 1.28 0.32 -4.49 -4.23 -0.32 -0.29 115.64 106.93 2owp s THR 92 Ca -0.10 -2.04 -0.18 0.00 -1.18 0.00 0.00 61.69 58.19 2owp s THR 92 Cb -0.03 -2.57 0.03 0.00 1.34 0.00 0.00 72.50 71.27 2owp s THR 92 CO 0.06 -0.17 0.71 -0.94 -0.54 0.00 0.00 174.62 173.74 2owp s SER 93 N -3.43 -0.11 0.07 3.99 1.04 -1.26 -0.89 113.70 113.11 2owp s SER 93 Ca 0.32 -0.86 0.28 0.00 0.48 0.00 0.00 55.95 56.17 2owp s SER 93 Cb 0.06 0.76 1.09 0.00 0.10 0.00 0.00 66.02 68.04 2owp s SER 93 CO 0.13 -1.45 1.87 0.47 0.98 0.00 0.00 173.24 175.24 2owp n ASP 94 N -0.83 0.26 0.12 7.02 8.00 -1.26 -3.79 116.55 126.08 2owp n ASP 94 Ca -0.05 0.53 0.13 0.00 0.71 0.00 0.00 54.79 56.10 2owp n ASP 94 Cb 0.60 -0.60 0.43 0.00 -0.02 0.00 0.00 41.12 41.53 2owp n ASP 94 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2owp h ALA 95 N 2.84 1.00 -2.65 2.24 0.00 -1.95 -3.46 119.26 117.28 2owp h ALA 95 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2owp h ALA 95 Cb 0.57 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.14 2owp h ALA 95 CO 0.00 0.00 -0.26 -0.08 0.00 0.00 0.00 179.25 178.91 2owp s THR 96 N -3.18 0.03 -1.77 0.00 -1.32 -1.25 -5.03 115.64 103.12 2owp s THR 96 Ca 0.08 -0.22 0.31 0.00 -1.21 0.00 0.00 61.69 60.66 2owp s THR 96 Cb 0.11 -0.58 0.75 0.00 -1.51 0.00 0.00 72.50 71.27 2owp s THR 96 CO 0.54 -0.12 2.16 -0.81 -2.21 0.00 0.00 174.62 174.18 2owp n PRO 97 N 2.06 0.77 -3.17 7.08 -0.04 -1.26 -4.48 135.00 135.96 2owp n PRO 97 Ca -0.17 -0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.99 2owp n PRO 97 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 2owp n PRO 97 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2owp s LEU 98 N -2.23 3.99 -0.07 1.53 1.43 -1.26 -4.97 118.68 117.09 2owp s LEU 98 Ca 0.40 0.90 -0.19 0.00 -1.03 0.00 0.00 54.13 54.20 2owp s LEU 98 Cb 0.21 -3.73 -0.05 0.00 0.03 0.00 0.00 46.19 42.66 2owp s LEU 98 CO 0.41 -0.26 0.54 -0.22 0.23 0.00 0.00 176.35 177.05 2owp s LEU 99 N -3.57 4.34 -0.00 1.79 2.96 0.29 -4.75 118.68 119.74 2owp s LEU 99 Ca 0.47 0.99 -0.03 0.00 -0.22 0.00 0.00 54.13 55.34 2owp s LEU 99 Cb -0.11 -2.81 -0.04 0.00 0.50 0.00 0.00 46.19 43.73 2owp s LEU 99 CO 0.29 0.04 0.19 -0.83 -1.32 0.00 0.00 176.35 174.72 2owp s GLY 100 N 0.28 2.18 -0.01 7.98 0.00 0.61 -0.50 107.32 117.85 2owp s GLY 100 Ca 0.29 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 44.29 2owp s GLY 100 CO 0.14 -0.65 -0.14 0.50 0.00 0.00 0.00 173.10 172.94 2owp s ARG 101 N -1.98 1.19 0.30 2.90 3.00 0.10 -1.11 118.95 123.34 2owp s ARG 101 Ca 0.28 -0.52 0.05 0.00 0.00 0.00 0.00 55.73 55.54 2owp s ARG 101 Cb -0.13 -1.15 -0.03 0.00 0.00 0.00 0.00 34.95 33.64 2owp s ARG 101 CO 0.19 0.31 0.23 -1.14 0.00 0.00 0.00 175.30 174.89 2owp s GLN 102 N -0.32 1.61 0.00 3.54 0.74 0.63 -0.97 119.66 124.88 2owp s GLN 102 Ca 0.05 -1.92 0.00 0.00 0.05 0.00 0.00 55.36 53.55 2owp s GLN 102 Cb -0.06 0.26 0.00 0.00 1.10 0.00 0.00 33.01 34.31 2owp s GLN 102 CO -0.00 -0.57 0.00 1.04 -0.55 0.00 0.00 175.29 175.21 2owp n GLN 104 N -0.54 0.00 -3.94 1.67 6.02 -0.04 -0.76 117.38 119.79 2owp n GLN 104 Ca 0.05 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.70 2owp n GLN 104 Cb 0.63 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.81 2owp n GLN 104 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2owp s THR 105 N -0.52 4.98 0.02 5.09 2.01 -0.12 -1.11 115.64 126.00 2owp s THR 105 Ca 0.00 0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.11 2owp s THR 105 Cb 0.00 -3.24 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 2owp s THR 105 CO 0.00 0.47 -0.23 0.26 -0.69 0.00 0.00 174.62 174.44 2owp s TRP 106 N 0.20 2.43 0.00 4.92 0.52 0.61 -0.30 118.94 127.33 2owp s TRP 106 Ca 0.06 -0.34 -0.07 0.00 0.02 0.00 0.00 56.10 55.76 2owp s TRP 106 Cb -0.12 -1.46 0.00 0.00 -1.15 0.00 0.00 33.47 30.74 2owp s TRP 106 CO -0.00 0.14 0.14 0.00 0.02 0.00 0.00 176.95 177.24 2owp s ALA 107 N -0.79 -0.33 -0.53 0.98 0.00 0.06 -0.89 121.76 120.25 2owp s ALA 107 Ca 0.12 -0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.91 2owp s ALA 107 Cb -0.10 0.11 0.14 0.00 0.00 0.00 0.00 23.12 23.27 2owp s ALA 107 CO 0.02 -0.21 0.35 0.50 0.00 0.00 0.00 175.76 176.43 2owp s ARG 108 N -1.38 2.39 0.33 0.00 3.52 -0.25 -0.93 118.95 122.63 2owp s ARG 108 Ca -0.15 -2.17 0.17 0.00 -0.13 0.00 0.00 55.73 53.46 2owp s ARG 108 Cb -0.08 -3.73 0.23 0.00 -1.56 0.00 0.00 34.95 29.82 2owp s ARG 108 CO 0.02 -1.14 1.53 -0.07 -0.81 0.00 0.00 175.30 174.82 2owp h LEU 109 N 7.62 0.00 -7.25 -0.88 3.38 -1.86 -3.45 115.31 112.87 2owp h LEU 109 Ca -0.08 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2owp h LEU 109 Cb 1.01 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.62 2owp h LEU 109 CO 0.73 0.39 0.02 -0.94 0.09 0.00 0.00 178.44 178.73 2owp s SER 110 N -6.39 -0.37 0.22 -0.43 1.04 -1.26 -5.02 113.70 101.50 2owp s SER 110 Ca 0.04 -0.10 -0.08 0.00 0.48 0.00 0.00 55.95 56.29 2owp s SER 110 Cb 0.08 0.50 0.31 0.00 0.10 0.00 0.00 66.02 67.02 2owp s SER 110 CO 0.72 -0.84 1.78 -0.65 0.98 0.00 0.00 173.24 175.23 2owp h PRO 111 N 2.42 0.57 -0.46 4.02 0.11 -1.93 -2.10 132.00 134.63 2owp h PRO 111 Ca -0.33 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.69 2owp h PRO 111 Cb 1.26 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2owp h PRO 111 CO 0.43 0.38 0.06 0.00 -0.21 0.00 0.00 178.00 178.66 2owp h ALA 112 N 1.41 1.24 -0.07 -0.75 0.00 -1.99 -2.94 119.26 116.16 2owp h ALA 112 Ca 0.34 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 2owp h ALA 112 Cb 0.34 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2owp h ALA 112 CO -0.26 0.51 -0.52 -0.44 0.00 0.00 0.00 179.25 178.54 2owp h ASP 113 N 0.69 0.22 -1.39 0.00 3.32 -1.84 -3.49 116.42 113.93 2owp h ASP 113 Ca 0.15 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2owp h ASP 113 Cb 0.34 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2owp h ASP 113 CO 0.01 0.71 0.00 0.61 -1.72 0.00 0.00 179.24 178.84 2owp n GLY 114 N 0.06 -0.90 3.73 2.75 0.00 -0.84 -4.79 105.19 105.20 2owp n GLY 114 Ca -0.02 -1.12 -0.41 0.00 0.00 0.00 0.00 46.02 44.47 2owp n GLY 114 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2owp s TRP 115 N 0.00 3.77 0.04 1.61 0.52 -1.26 -4.04 118.94 119.58 2owp s TRP 115 Ca 0.00 1.74 0.01 0.00 0.02 0.00 0.00 56.10 57.87 2owp s TRP 115 Cb 0.00 -3.04 -0.03 0.00 -1.15 0.00 0.00 33.47 29.26 2owp s TRP 115 CO 0.00 0.18 -0.05 0.15 0.02 0.00 0.00 176.95 177.25 2owp s LYS 116 N 0.18 0.50 -0.27 4.98 1.02 -0.11 -4.82 119.74 121.22 2owp s LYS 116 Ca 0.47 -0.85 -0.29 0.00 0.02 0.00 0.00 55.97 55.31 2owp s LYS 116 Cb -0.23 -0.03 0.01 0.00 -0.52 0.00 0.00 37.83 37.06 2owp s LYS 116 CO 0.29 -0.03 1.07 0.42 -0.92 0.00 0.00 175.35 176.18 2owp s ILE 117 N -2.15 4.57 -0.50 2.17 1.01 0.22 -0.76 121.20 125.76 2owp s ILE 117 Ca -0.07 1.86 0.22 0.00 0.00 0.00 0.00 60.65 62.66 2owp s ILE 117 Cb -0.05 -4.34 -0.26 0.00 0.01 0.00 0.00 42.46 37.82 2owp s ILE 117 CO -0.03 -0.32 0.73 1.33 0.00 0.00 0.00 174.94 176.65 2owp n VAL 118 N 5.60 0.03 -3.63 2.92 0.24 0.59 -0.80 118.33 123.29 2owp n VAL 118 Ca 0.12 -0.27 -0.14 0.00 -2.04 0.00 0.00 64.34 62.01 2owp n VAL 118 Cb 0.46 0.43 -0.07 0.00 -1.47 0.00 0.00 33.84 33.19 2owp n VAL 118 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2owp s ALA 119 N -3.27 -1.67 -0.01 2.33 0.00 -1.19 -3.97 121.76 113.99 2owp s ALA 119 Ca 0.00 1.79 -0.04 0.00 0.00 0.00 0.00 51.96 53.71 2owp s ALA 119 Cb 0.15 -0.93 -0.00 0.00 0.00 0.00 0.00 23.12 22.34 2owp s ALA 119 CO 0.88 -0.33 0.09 0.00 0.00 0.00 0.00 175.76 176.40 2owp s ALA 120 N 0.10 -0.19 -0.06 0.00 0.00 -0.91 -0.94 121.76 119.76 2owp s ALA 120 Ca -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 2owp s ALA 120 Cb -0.04 0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.13 2owp s ALA 120 CO 0.02 -0.14 -0.02 -1.58 0.00 0.00 0.00 175.76 174.04 2owp s HIS 121 N -0.92 0.68 -0.05 0.00 5.65 -1.26 -1.01 115.29 118.38 2owp s HIS 121 Ca -0.10 -0.18 0.04 0.00 0.25 0.00 0.00 55.06 55.06 2owp s HIS 121 Cb -0.06 -0.72 0.00 0.00 -1.18 0.00 0.00 32.58 30.63 2owp s HIS 121 CO 0.00 -0.26 -0.16 0.08 -0.65 0.00 0.00 174.74 173.76 2owp s VAL 122 N 1.46 1.37 0.12 0.89 1.01 0.45 -4.23 120.40 121.47 2owp s VAL 122 Ca -0.03 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 2owp s VAL 122 Cb -0.13 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.05 2owp s VAL 122 CO -0.03 0.40 0.26 -0.94 0.00 0.00 0.00 175.10 174.79 2owp s SER 123 N 0.27 0.04 -0.05 3.32 1.04 -0.14 -3.31 113.70 114.86 2owp s SER 123 Ca -0.09 -0.69 0.06 0.00 0.48 0.00 0.00 55.95 55.71 2owp s SER 123 Cb -0.13 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.37 2owp s SER 123 CO 0.03 -0.81 -0.23 -0.76 0.98 0.00 0.00 173.24 172.45 2owp s LEU 124 N -2.89 2.18 0.17 2.42 1.43 -1.26 0.00 118.68 120.73 2owp s LEU 124 Ca 0.09 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2owp s LEU 124 Cb 0.04 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 2owp s LEU 124 CO -0.07 0.27 0.05 0.27 0.23 0.00 0.00 176.35 177.10 2owp s ILE 125 N -0.31 0.41 0.00 -0.59 -4.36 0.34 -4.94 121.20 111.76 2owp s ILE 125 Ca 0.01 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.44 2owp s ILE 125 Cb -0.13 -2.21 0.00 0.00 1.25 0.00 0.00 42.46 41.38 2owp s ILE 125 CO 0.02 -0.36 0.00 0.00 0.24 0.00 0.00 174.94 174.84 2owp n ALA 126 N -0.23 0.00 1.15 2.27 0.00 -1.26 0.10 120.51 122.55 2owp n ALA 126 Ca -0.04 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.52 2owp n ALA 126 Cb 0.64 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.32 2owp n ALA 126 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15