#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwx s GLY 2 N 0.00 -0.17 0.05 3.03 0.00 -1.26 -5.04 107.32 103.93 2jwx s GLY 2 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 44.72 45.68 2jwx s GLY 2 CO 0.00 1.10 0.00 -0.18 0.00 0.00 0.00 173.10 174.02 2jwx n GLN 3 N 3.86 0.00 -0.27 2.90 7.27 -1.26 -4.81 117.38 125.07 2jwx n GLN 3 Ca -0.21 0.00 0.04 0.00 0.07 0.00 0.00 57.00 56.89 2jwx n GLN 3 Cb 0.55 -0.36 0.17 0.00 2.41 0.00 0.00 30.24 33.02 2jwx n GLN 3 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 2jwx h PRO 4 N 0.00 0.57 -6.36 3.69 0.11 -2.08 -3.41 132.00 124.52 2jwx h PRO 4 Ca 0.00 -0.03 -0.60 0.00 0.11 0.00 0.00 66.00 65.47 2jwx h PRO 4 Cb 0.50 -0.13 0.03 0.00 0.11 0.00 0.00 31.00 31.51 2jwx h PRO 4 CO 0.00 0.38 0.99 -2.30 -0.21 0.00 0.00 178.00 176.86 2jwx n PRO 5 N -4.88 2.18 -1.01 1.05 -0.02 -1.26 -4.81 135.00 126.24 2jwx n PRO 5 Ca 0.14 0.79 -0.01 0.00 -2.02 0.00 0.00 63.50 62.40 2jwx n PRO 5 Cb 0.35 -2.61 -0.02 0.00 -0.02 0.00 0.00 33.50 31.20 2jwx n PRO 5 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jwx n ALA 6 N 5.49 2.77 -1.68 3.55 0.00 -1.26 -5.04 120.51 124.34 2jwx n ALA 6 Ca 0.21 -1.16 -0.45 0.00 0.00 0.00 0.00 53.44 52.03 2jwx n ALA 6 Cb 0.29 -0.43 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 2jwx n ALA 6 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jwx n GLU 7 N 0.16 2.38 0.00 0.00 -0.58 -1.26 -4.94 120.64 116.40 2jwx n GLU 7 Ca -0.08 0.86 0.00 0.00 -0.42 0.00 0.00 57.16 57.52 2jwx n GLU 7 Cb 0.81 -2.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.00 2jwx n GLU 7 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2jwx n GLU 8 N 4.66 0.00 -4.40 3.49 1.02 -1.26 -4.98 120.64 119.17 2jwx n GLU 8 Ca 0.18 0.46 -0.23 0.00 -0.02 0.00 0.00 57.16 57.55 2jwx n GLU 8 Cb 0.32 -1.04 -0.11 0.00 -0.02 0.00 0.00 31.44 30.58 2jwx n GLU 8 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jwx s ALA 9 N -3.05 2.36 0.00 0.62 0.00 -1.26 -5.13 121.76 115.30 2jwx s ALA 9 Ca 0.00 -1.66 0.00 0.00 0.00 0.00 0.00 51.96 50.30 2jwx s ALA 9 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.89 2jwx s ALA 9 CO 0.00 0.28 0.00 -1.91 0.00 0.00 0.00 175.76 174.13 2jwx n GLU 10 N -0.04 3.16 0.19 0.00 2.13 -1.26 -4.92 120.64 119.90 2jwx n GLU 10 Ca -0.10 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.57 2jwx n GLU 10 Cb 0.58 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.22 2jwx n GLU 10 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2jwx h GLN 11 N 0.00 -0.57 -7.20 5.31 4.20 -1.82 -3.35 115.11 111.67 2jwx h GLN 11 Ca 0.00 0.04 -0.47 0.00 0.06 0.00 0.00 58.65 58.28 2jwx h GLN 11 Cb 0.00 0.13 0.02 0.00 0.30 0.00 0.00 27.48 27.93 2jwx h GLN 11 CO 0.00 -0.38 0.38 -2.14 -0.67 0.00 0.00 178.83 176.01 2jwx s PRO 12 N -6.05 3.93 0.00 1.46 0.02 -1.26 -3.80 135.00 129.29 2jwx s PRO 12 Ca -0.16 0.94 0.00 0.00 0.02 0.00 0.00 61.00 61.80 2jwx s PRO 12 Cb 0.06 -2.13 0.00 0.00 0.02 0.00 0.00 34.50 32.45 2jwx s PRO 12 CO 0.64 -0.29 0.00 0.41 -0.33 0.00 0.00 177.00 177.43 2jwx n GLY 13 N -1.65 2.04 3.97 0.52 0.00 -1.26 -4.92 105.19 103.89 2jwx n GLY 13 Ca 0.06 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 2jwx n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jwx s ALA 14 N -0.06 3.70 -1.25 4.61 0.00 -1.26 -4.98 121.76 122.52 2jwx s ALA 14 Ca 0.00 -1.39 -0.19 0.00 0.00 0.00 0.00 51.96 50.38 2jwx s ALA 14 Cb 0.00 -2.15 0.06 0.00 0.00 0.00 0.00 23.12 21.03 2jwx s ALA 14 CO 0.00 -1.09 1.70 -1.17 0.00 0.00 0.00 175.76 175.20 2jwx s LEU 15 N -4.98 3.76 -0.36 0.00 2.96 -1.26 -4.57 118.68 114.24 2jwx s LEU 15 Ca 0.61 -2.25 -0.18 0.00 -0.22 0.00 0.00 54.13 52.08 2jwx s LEU 15 Cb -0.09 -2.58 0.03 0.00 0.50 0.00 0.00 46.19 44.05 2jwx s LEU 15 CO 0.41 -1.28 0.44 0.00 -1.32 0.00 0.00 176.35 174.60 2jwx n ALA 16 N 8.66 -2.77 -3.69 5.97 0.00 -1.26 -4.96 120.51 122.47 2jwx n ALA 16 Ca 0.46 0.68 -0.37 0.00 0.00 0.00 0.00 53.44 54.20 2jwx n ALA 16 Cb 0.47 -2.46 -0.10 0.00 0.00 0.00 0.00 19.45 17.36 2jwx n ALA 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jwx s ARG 17 N -2.20 2.47 -0.30 0.00 0.52 -1.25 -4.99 118.95 113.20 2jwx s ARG 17 Ca 0.21 -2.26 -0.14 0.00 -0.52 0.00 0.00 55.73 53.03 2jwx s ARG 17 Cb -0.04 -3.76 0.15 0.00 0.52 0.00 0.00 34.95 31.83 2jwx s ARG 17 CO 0.71 -1.16 0.89 -2.00 0.02 0.00 0.00 175.30 173.76 2jwx s GLU 18 N 0.42 0.38 -0.58 3.54 2.12 -1.26 -2.60 118.70 120.71 2jwx s GLU 18 Ca 0.13 0.94 -0.11 0.00 0.36 0.00 0.00 54.97 56.29 2jwx s GLU 18 Cb -0.21 0.54 0.01 0.00 0.26 0.00 0.00 34.13 34.73 2jwx s GLU 18 CO -0.04 -0.13 0.64 1.19 -0.54 0.00 0.00 175.26 176.39 2jwx n PHE 19 N 5.03 -3.09 -0.06 5.30 3.72 0.92 -4.83 117.46 124.44 2jwx n PHE 19 Ca -0.11 1.23 -0.02 0.00 -0.05 0.00 0.00 57.45 58.50 2jwx n PHE 19 Cb 0.52 -3.74 -0.13 0.00 -0.94 0.00 0.00 39.48 35.19 2jwx n PHE 19 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 176.76 178.18 2jwx n LEU 20 N -1.05 0.00 -4.34 4.37 -0.00 -0.87 -4.62 117.00 110.50 2jwx n LEU 20 Ca 0.01 0.00 -0.46 0.00 -0.00 0.00 0.00 56.01 55.56 2jwx n LEU 20 Cb 0.52 0.26 -0.02 0.00 -0.00 0.00 0.00 43.42 44.19 2jwx n LEU 20 CO 0.52 0.26 0.55 0.00 -0.00 0.00 0.00 177.39 178.73 2jwx s ALA 21 N -2.69 4.20 0.30 1.47 0.00 -1.26 -4.98 121.76 118.80 2jwx s ALA 21 Ca -0.08 -3.42 -0.06 0.00 0.00 0.00 0.00 51.96 48.40 2jwx s ALA 21 Cb 0.07 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.65 2jwx s ALA 21 CO 0.70 -2.30 0.50 0.00 0.00 0.00 0.00 175.76 174.66 2jwx n ALA 22 N 3.82 -0.77 0.06 0.00 0.00 -1.26 -3.23 120.51 119.13 2jwx n ALA 22 Ca 0.17 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.40 2jwx n ALA 22 Cb 0.45 0.97 0.00 0.00 0.00 0.00 0.00 19.45 20.87 2jwx n ALA 22 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jwx n MET 23 N -0.46 0.00 0.13 0.00 2.81 -1.26 -5.04 117.12 113.30 2jwx n MET 23 Ca -0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 2jwx n MET 23 Cb 0.48 -0.30 0.00 0.00 -0.71 0.00 0.00 33.22 32.69 2jwx n MET 23 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2jwx n GLU 24 N -3.27 0.00 -2.85 0.03 4.07 -1.26 -5.13 120.64 112.23 2jwx n GLU 24 Ca 0.00 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.71 2jwx n GLU 24 Cb 0.10 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.42 2jwx n GLU 24 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2jwx s PRO 25 N -1.66 4.68 -0.22 5.31 0.04 -1.26 -5.05 135.00 136.83 2jwx s PRO 25 Ca 0.00 1.32 -0.02 0.00 0.04 0.00 0.00 61.00 62.34 2jwx s PRO 25 Cb 0.00 -3.16 0.01 0.00 0.04 0.00 0.00 34.50 31.39 2jwx s PRO 25 CO 0.00 0.48 -0.07 -1.83 0.04 0.00 0.00 177.00 175.62 2jwx s GLU 26 N -1.38 3.12 -0.02 4.56 -1.05 -1.26 -5.07 118.70 117.61 2jwx s GLU 26 Ca 0.41 -0.78 -0.09 0.00 -0.15 0.00 0.00 54.97 54.35 2jwx s GLU 26 Cb -0.23 -2.94 -0.05 0.00 -0.44 0.00 0.00 34.13 30.47 2jwx s GLU 26 CO 0.28 -0.27 0.29 -1.25 0.95 0.00 0.00 175.26 175.26 2jwx s PRO 27 N 1.40 3.66 0.16 -4.83 0.04 -1.26 -5.07 135.00 129.10 2jwx s PRO 27 Ca 0.04 0.08 -0.32 0.00 0.04 0.00 0.00 61.00 60.84 2jwx s PRO 27 Cb -0.15 -3.14 -0.12 0.00 0.04 0.00 0.00 34.50 31.14 2jwx s PRO 27 CO -0.05 0.68 1.77 0.00 0.04 0.00 0.00 177.00 179.44 2jwx n ALA 28 N 1.50 2.37 -1.34 8.56 0.00 -1.26 -4.96 120.51 125.37 2jwx n ALA 28 Ca -0.14 0.36 -0.37 0.00 0.00 0.00 0.00 53.44 53.30 2jwx n ALA 28 Cb 0.53 -2.54 0.07 0.00 0.00 0.00 0.00 19.45 17.51 2jwx n ALA 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jwx n PRO 29 N 4.73 0.42 -3.53 0.00 -0.04 -1.26 -4.97 135.00 130.35 2jwx n PRO 29 Ca 0.17 0.18 -0.28 0.00 -0.04 0.00 0.00 63.50 63.53 2jwx n PRO 29 Cb 0.35 -1.90 -0.08 0.00 -0.04 0.00 0.00 33.50 31.82 2jwx n PRO 29 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jwx n ALA 30 N -2.24 3.96 -1.60 0.55 0.00 -1.26 -5.02 120.51 114.90 2jwx n ALA 30 Ca 0.11 -4.71 -0.37 0.00 0.00 0.00 0.00 53.44 48.47 2jwx n ALA 30 Cb 0.49 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 2jwx n ALA 30 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jwx s PRO 31 N -2.21 2.20 -0.35 0.00 0.04 -1.26 -4.85 135.00 128.56 2jwx s PRO 31 Ca 0.35 1.38 -0.05 0.00 0.04 0.00 0.00 61.00 62.72 2jwx s PRO 31 Cb 0.09 -4.56 0.06 0.00 0.04 0.00 0.00 34.50 30.13 2jwx s PRO 31 CO -0.05 -3.17 0.12 0.00 0.04 0.00 0.00 177.00 173.94 2jwx s ALA 32 N 11.75 3.05 -0.75 8.56 0.00 -1.26 -5.05 121.76 138.06 2jwx s ALA 32 Ca 0.95 -1.91 -0.26 0.00 0.00 0.00 0.00 51.96 50.74 2jwx s ALA 32 Cb -0.18 -2.27 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 2jwx s ALA 32 CO 0.26 -1.43 1.76 -1.25 0.00 0.00 0.00 175.76 175.09 2jwx s PRO 33 N 1.34 2.79 0.00 0.00 0.04 -1.26 -4.01 135.00 133.90 2jwx s PRO 33 Ca -0.00 0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.09 2jwx s PRO 33 Cb -0.21 -4.64 0.00 0.00 0.04 0.00 0.00 34.50 29.69 2jwx s PRO 33 CO 0.01 -2.78 0.00 0.39 0.04 0.00 0.00 177.00 174.66 2jwx n GLU 34 N 9.10 0.00 -1.78 4.56 -0.58 -1.26 -4.90 120.64 125.78 2jwx n GLU 34 Ca 0.24 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.67 2jwx n GLU 34 Cb 0.50 -0.36 -0.04 0.00 -0.57 0.00 0.00 31.44 30.97 2jwx n GLU 34 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2jwx s GLU 35 N 0.00 2.24 0.08 3.49 0.41 -1.26 -4.93 118.70 118.74 2jwx s GLU 35 Ca 0.00 0.78 -0.37 0.00 -0.41 0.00 0.00 54.97 54.97 2jwx s GLU 35 Cb 0.00 -4.62 -0.17 0.00 -1.78 0.00 0.00 34.13 27.56 2jwx s GLU 35 CO 0.00 -3.31 1.31 0.91 -0.49 0.00 0.00 175.26 173.68 2jwx n TRP 36 N 15.11 1.43 -3.61 1.61 7.02 -1.26 -4.79 117.44 132.95 2jwx n TRP 36 Ca 0.34 0.67 -0.39 0.00 -1.02 0.00 0.00 57.50 57.10 2jwx n TRP 36 Cb 0.51 -2.31 -0.11 0.00 -2.42 0.00 0.00 31.31 26.98 2jwx n TRP 36 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 2jwx s LEU 37 N 0.46 4.20 -0.68 -0.99 2.96 -0.80 -4.90 118.68 118.93 2jwx s LEU 37 Ca 0.85 -0.39 -0.26 0.00 -0.22 0.00 0.00 54.13 54.10 2jwx s LEU 37 Cb -0.98 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 43.64 2jwx s LEU 37 CO 0.48 -0.18 1.75 1.51 -1.32 0.00 0.00 176.35 178.59 2jwx s ASP 38 N 1.67 5.45 0.11 3.68 -4.77 -1.26 -2.30 116.67 119.25 2jwx s ASP 38 Ca 0.06 0.03 -0.23 0.00 -3.30 0.00 0.00 52.55 49.10 2jwx s ASP 38 Cb -0.17 -2.54 -0.09 0.00 -1.09 0.00 0.00 42.92 39.03 2jwx s ASP 38 CO 0.08 -2.30 1.70 0.40 0.70 0.00 0.00 175.17 175.76 2jwx h ILE 39 N 6.77 0.78 -0.06 2.11 2.04 -0.22 -1.09 117.51 127.84 2jwx h ILE 39 Ca -0.21 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2jwx h ILE 39 Cb 1.12 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 2jwx h ILE 39 CO 1.24 0.00 0.00 0.18 0.00 0.00 0.00 178.15 179.57 2jwx n LEU 40 N -5.21 2.15 -1.89 1.44 7.99 -1.26 -4.85 117.00 115.37 2jwx n LEU 40 Ca -0.06 -0.76 -0.20 0.00 -0.01 0.00 0.00 56.01 54.99 2jwx n LEU 40 Cb 0.14 -0.03 -0.05 0.00 -0.11 0.00 0.00 43.42 43.36 2jwx n LEU 40 CO 0.29 0.38 -0.22 0.61 -1.51 0.00 0.00 177.39 176.93 2jwx n GLY 41 N 1.25 0.87 0.09 -0.72 0.00 -0.41 -4.84 105.19 101.43 2jwx n GLY 41 Ca 0.17 -0.04 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 2jwx n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2jwx n ASN 42 N -1.53 0.75 0.00 1.61 6.94 -1.26 -4.96 115.26 116.81 2jwx n ASN 42 Ca -0.22 0.34 0.00 0.00 -0.02 0.00 0.00 54.58 54.68 2jwx n ASN 42 Cb 0.67 0.22 0.00 0.00 -2.36 0.00 0.00 39.78 38.31 2jwx n ASN 42 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jwx n GLY 43 N 1.49 2.75 0.22 4.83 0.00 -1.26 -4.77 105.19 108.45 2jwx n GLY 43 Ca -0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 46.02 45.79 2jwx n GLY 43 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jwx h LEU 44 N 0.00 0.33 -8.09 0.99 -0.00 -1.93 -3.41 115.31 103.21 2jwx h LEU 44 Ca 0.00 -0.11 -0.69 0.00 -0.00 0.00 0.00 57.88 57.08 2jwx h LEU 44 Cb 0.00 -0.09 -0.31 0.00 -0.00 0.00 0.00 40.66 40.26 2jwx h LEU 44 CO 0.00 0.63 -0.65 -0.22 -0.00 0.00 0.00 178.44 178.20 2jwx s LEU 45 N -8.49 4.18 -0.03 1.67 1.98 -1.25 -1.87 118.68 114.87 2jwx s LEU 45 Ca -0.05 -1.28 -0.01 0.00 -2.89 0.00 0.00 54.13 49.90 2jwx s LEU 45 Cb 0.14 -1.79 0.03 0.00 0.66 0.00 0.00 46.19 45.23 2jwx s LEU 45 CO 0.77 -0.31 0.07 -0.13 -1.89 0.00 0.00 176.35 174.86 2jwx s ARG 46 N 1.31 0.01 -0.04 1.98 0.52 0.80 0.60 118.95 124.13 2jwx s ARG 46 Ca -0.03 0.24 -0.01 0.00 -0.52 0.00 0.00 55.73 55.41 2jwx s ARG 46 Cb -0.20 -0.21 -0.04 0.00 0.52 0.00 0.00 34.95 35.02 2jwx s ARG 46 CO 0.00 -0.16 0.06 0.21 0.02 0.00 0.00 175.30 175.43 2jwx s LYS 47 N 1.05 3.06 -0.09 3.54 2.20 -0.97 -0.35 119.74 128.17 2jwx s LYS 47 Ca -0.09 -0.43 0.02 0.00 -0.36 0.00 0.00 55.97 55.11 2jwx s LYS 47 Cb -0.12 -2.86 0.01 0.00 -1.51 0.00 0.00 37.83 33.35 2jwx s LYS 47 CO -0.04 0.68 -0.16 0.21 -0.36 0.00 0.00 175.35 175.68 2jwx s LYS 48 N -1.40 2.18 -0.81 4.03 2.20 0.47 -1.90 119.74 124.51 2jwx s LYS 48 Ca 0.19 -0.56 -0.26 0.00 -0.36 0.00 0.00 55.97 54.98 2jwx s LYS 48 Cb -0.12 -1.79 0.02 0.00 -1.51 0.00 0.00 37.83 34.43 2jwx s LYS 48 CO 0.09 0.01 1.43 0.95 -0.36 0.00 0.00 175.35 177.47 2jwx s THR 49 N 0.77 3.71 -0.04 3.43 -4.23 -1.26 -1.10 115.64 116.94 2jwx s THR 49 Ca -0.11 0.04 -0.25 0.00 -1.18 0.00 0.00 61.69 60.18 2jwx s THR 49 Cb -0.16 -4.78 -0.19 0.00 1.34 0.00 0.00 72.50 68.71 2jwx s THR 49 CO 0.02 -1.71 1.11 -0.07 -0.54 0.00 0.00 174.62 173.43 2jwx h LEU 50 N 13.66 -0.09 -8.01 4.79 3.38 -1.73 -3.43 115.31 123.88 2jwx h LEU 50 Ca -0.13 -0.46 -0.62 0.00 0.09 0.00 0.00 57.88 56.76 2jwx h LEU 50 Cb 1.05 0.02 -0.35 0.00 0.09 0.00 0.00 40.66 41.47 2jwx h LEU 50 CO 1.31 0.44 -0.84 -0.69 0.09 0.00 0.00 178.44 178.75 2jwx s VAL 51 N -3.90 1.71 -0.07 1.22 1.01 -0.40 -5.01 120.40 114.95 2jwx s VAL 51 Ca -0.15 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 2jwx s VAL 51 Cb 0.01 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2jwx s VAL 51 CO 0.61 0.48 0.12 -2.16 0.00 0.00 0.00 175.10 174.15 2jwx s PRO 52 N 1.16 3.31 0.38 2.72 0.04 -1.26 -0.20 135.00 141.15 2jwx s PRO 52 Ca -0.01 -0.27 -0.28 0.00 0.04 0.00 0.00 61.00 60.48 2jwx s PRO 52 Cb -0.14 -3.06 -0.11 0.00 0.04 0.00 0.00 34.50 31.24 2jwx s PRO 52 CO -0.06 0.72 1.49 0.41 0.04 0.00 0.00 177.00 179.60 2jwx n GLY 53 N 1.66 1.20 3.68 0.56 0.00 -1.26 -4.77 105.19 106.25 2jwx n GLY 53 Ca -0.17 0.30 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 2jwx n GLY 53 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jwx n PRO 54 N 0.38 2.05 -0.78 1.61 -0.04 -1.26 -4.70 135.00 132.26 2jwx n PRO 54 Ca 0.01 0.72 -0.36 0.00 -0.04 0.00 0.00 63.50 63.84 2jwx n PRO 54 Cb 0.39 -2.34 -0.07 0.00 -0.04 0.00 0.00 33.50 31.45 2jwx n PRO 54 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2jwx n PRO 55 N 1.36 0.00 0.00 0.54 -0.02 -1.26 -1.03 135.00 134.59 2jwx n PRO 55 Ca 0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2jwx n PRO 55 Cb 0.33 -0.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 2jwx n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jwx n GLY 56 N 3.95 2.35 4.70 -1.23 0.00 -1.26 -4.77 105.19 108.93 2jwx n GLY 56 Ca 0.29 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2jwx n GLY 56 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jwx n SER 57 N 2.59 0.00 -3.63 1.61 7.64 -0.20 -3.17 113.62 118.45 2jwx n SER 57 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 2jwx n SER 57 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 2jwx n SER 57 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2jwx s SER 58 N -2.79 -0.78 -0.64 6.43 0.01 -1.26 -0.06 113.70 114.61 2jwx s SER 58 Ca 0.00 1.42 0.02 0.00 1.31 0.00 0.00 55.95 58.69 2jwx s SER 58 Cb 0.00 1.41 0.16 0.00 0.21 0.00 0.00 66.02 67.80 2jwx s SER 58 CO 0.00 -0.24 0.43 -0.13 0.41 0.00 0.00 173.24 173.72 2jwx s ARG 59 N 0.71 2.43 0.46 12.44 1.81 -1.23 -0.75 118.95 134.82 2jwx s ARG 59 Ca -0.03 -2.87 -0.25 0.00 -1.72 0.00 0.00 55.73 50.87 2jwx s ARG 59 Cb -0.05 -3.54 -0.08 0.00 -0.45 0.00 0.00 34.95 30.83 2jwx s ARG 59 CO -0.05 -1.19 1.42 -0.35 -0.68 0.00 0.00 175.30 174.45 2jwx n PRO 60 N 2.83 2.20 -3.59 3.54 -0.04 -1.20 -4.66 135.00 134.08 2jwx n PRO 60 Ca 0.11 0.79 -0.34 0.00 -0.04 0.00 0.00 63.50 64.02 2jwx n PRO 60 Cb 0.35 -2.62 -0.05 0.00 -0.04 0.00 0.00 33.50 31.14 2jwx n PRO 60 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jwx s VAL 61 N -1.20 5.11 -0.91 0.52 -7.23 -1.26 -4.39 120.40 111.05 2jwx s VAL 61 Ca 0.62 0.37 -0.27 0.00 -1.81 0.00 0.00 61.98 60.89 2jwx s VAL 61 Cb -0.45 -3.64 -0.21 0.00 0.56 0.00 0.00 36.38 32.65 2jwx s VAL 61 CO 0.57 0.24 2.58 0.29 -0.31 0.00 0.00 175.10 178.47 2jwx n LYS 62 N 0.76 0.19 0.00 4.82 4.01 -1.26 -0.44 118.16 126.23 2jwx n LYS 62 Ca -0.07 -0.03 0.00 0.00 -0.51 0.00 0.00 58.31 57.70 2jwx n LYS 62 Cb 0.52 -1.84 0.00 0.00 -0.51 0.00 0.00 35.03 33.21 2jwx n LYS 62 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2jwx n GLY 63 N 6.30 0.87 3.72 0.72 0.00 0.13 -4.72 105.19 112.21 2jwx n GLY 63 Ca 0.61 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.22 2jwx n GLY 63 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jwx s GLN 64 N 0.00 4.55 -0.22 1.61 -1.52 0.41 -2.08 119.66 122.42 2jwx s GLN 64 Ca 0.00 1.27 -0.29 0.00 -1.95 0.00 0.00 55.36 54.39 2jwx s GLN 64 Cb 0.00 -3.43 -0.01 0.00 -0.22 0.00 0.00 33.01 29.34 2jwx s GLN 64 CO 0.00 0.06 1.37 0.14 -0.25 0.00 0.00 175.29 176.61 2jwx s VAL 65 N 0.68 4.07 -0.17 1.09 -7.23 0.18 -2.46 120.40 116.55 2jwx s VAL 65 Ca 0.47 1.25 -0.04 0.00 -1.81 0.00 0.00 61.98 61.84 2jwx s VAL 65 Cb -0.21 -3.96 -0.03 0.00 0.56 0.00 0.00 36.38 32.75 2jwx s VAL 65 CO 0.26 -0.28 -0.02 0.68 -0.31 0.00 0.00 175.10 175.42 2jwx s VAL 66 N 4.17 3.89 -0.42 1.32 -7.23 -0.98 -2.00 120.40 119.14 2jwx s VAL 66 Ca 0.60 -0.35 -0.22 0.00 -1.81 0.00 0.00 61.98 60.20 2jwx s VAL 66 Cb -0.21 -2.72 0.02 0.00 0.56 0.00 0.00 36.38 34.02 2jwx s VAL 66 CO 0.21 0.47 0.71 -0.89 -0.31 0.00 0.00 175.10 175.29 2jwx s THR 67 N 0.64 4.76 -0.17 5.32 2.01 -0.47 -2.38 115.64 125.35 2jwx s THR 67 Ca -0.02 0.37 -0.01 0.00 0.31 0.00 0.00 61.69 62.34 2jwx s THR 67 Cb -0.14 -4.23 -0.01 0.00 0.01 0.00 0.00 72.50 68.13 2jwx s THR 67 CO 0.02 -0.59 -0.11 0.68 -0.69 0.00 0.00 174.62 173.93 2jwx s VAL 68 N 3.02 3.01 -0.45 3.82 -7.23 0.80 -0.69 120.40 122.68 2jwx s VAL 68 Ca 0.27 -0.64 -0.28 0.00 -1.81 0.00 0.00 61.98 59.51 2jwx s VAL 68 Cb -0.13 -2.31 0.03 0.00 0.56 0.00 0.00 36.38 34.53 2jwx s VAL 68 CO 0.20 0.49 1.06 -2.28 -0.31 0.00 0.00 175.10 174.26 2jwx s HIS 69 N 0.90 2.89 -0.08 2.82 2.46 0.13 0.41 115.29 124.82 2jwx s HIS 69 Ca -0.03 0.67 0.04 0.00 0.47 0.00 0.00 55.06 56.21 2jwx s HIS 69 Cb -0.15 -4.19 -0.01 0.00 -0.13 0.00 0.00 32.58 28.10 2jwx s HIS 69 CO -0.00 -1.15 -0.21 -0.48 -2.47 0.00 0.00 174.74 170.43 2jwx s LEU 70 N 4.12 2.29 -0.26 8.88 0.05 -0.21 -0.18 118.68 133.38 2jwx s LEU 70 Ca 0.44 -0.45 0.02 0.00 0.05 0.00 0.00 54.13 54.19 2jwx s LEU 70 Cb -0.09 -1.45 0.07 0.00 -2.05 0.00 0.00 46.19 42.67 2jwx s LEU 70 CO 0.28 0.22 -0.06 -1.10 -0.55 0.00 0.00 176.35 175.15 2jwx s GLN 71 N -0.02 1.79 -0.11 1.48 1.11 -0.96 0.19 119.66 123.15 2jwx s GLN 71 Ca -0.07 -1.23 -0.13 0.00 0.01 0.00 0.00 55.36 53.94 2jwx s GLN 71 Cb -0.15 -2.75 -0.05 0.00 -1.01 0.00 0.00 33.01 29.06 2jwx s GLN 71 CO 0.05 -0.64 0.31 0.99 0.01 0.00 0.00 175.29 176.01 2jwx s THR 72 N 1.24 5.25 0.13 -0.19 2.01 -0.63 -2.55 115.64 120.91 2jwx s THR 72 Ca -0.04 0.61 0.10 0.00 0.31 0.00 0.00 61.69 62.67 2jwx s THR 72 Cb -0.19 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2jwx s THR 72 CO -0.07 0.47 -0.24 -0.44 -0.69 0.00 0.00 174.62 173.66 2jwx s SER 73 N -0.16 3.52 0.88 3.53 0.01 0.33 0.12 113.70 121.92 2jwx s SER 73 Ca 0.19 -0.70 -0.11 0.00 1.31 0.00 0.00 55.95 56.64 2jwx s SER 73 Cb -0.14 -0.33 0.12 0.00 0.21 0.00 0.00 66.02 65.87 2jwx s SER 73 CO 0.07 0.17 1.09 -0.22 0.41 0.00 0.00 173.24 174.77 2jwx s LEU 74 N -2.14 2.35 0.55 2.44 2.96 0.19 0.04 118.68 125.07 2jwx s LEU 74 Ca 0.16 1.47 0.23 0.00 -0.22 0.00 0.00 54.13 55.77 2jwx s LEU 74 Cb -0.10 -3.93 1.46 0.00 0.50 0.00 0.00 46.19 44.12 2jwx s LEU 74 CO 0.08 -2.51 2.13 1.05 -1.32 0.00 0.00 176.35 175.78 2jwx h GLU 75 N -1.46 0.00 0.00 1.98 4.11 -1.37 0.46 114.58 118.31 2jwx h GLU 75 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2jwx h GLU 75 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2jwx h GLU 75 CO 0.55 0.00 0.00 -1.71 0.07 0.00 0.00 179.01 177.92 2jwx n ASN 76 N -4.25 0.00 0.00 3.06 5.15 -1.26 -4.89 115.26 113.06 2jwx n ASN 76 Ca 0.00 0.30 0.00 0.00 -0.60 0.00 0.00 54.58 54.28 2jwx n ASN 76 Cb 0.24 -0.41 0.00 0.00 -0.53 0.00 0.00 39.78 39.07 2jwx n ASN 76 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jwx n GLY 77 N 0.55 2.99 3.60 8.20 0.00 0.16 -5.03 105.19 115.67 2jwx n GLY 77 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2jwx n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jwx s THR 78 N -2.73 3.41 -0.23 2.61 2.01 -1.26 -4.34 115.64 115.11 2jwx s THR 78 Ca 0.00 0.42 -0.38 0.00 0.31 0.00 0.00 61.69 62.04 2jwx s THR 78 Cb 0.00 -3.53 -0.14 0.00 0.01 0.00 0.00 72.50 68.84 2jwx s THR 78 CO 0.00 -0.32 1.83 0.54 -0.69 0.00 0.00 174.62 175.98 2jwx n ARG 79 N 8.41 1.44 0.00 4.92 5.12 -1.26 0.57 116.66 135.86 2jwx n ARG 79 Ca 0.24 0.52 0.09 0.00 -1.93 0.00 0.00 57.85 56.77 2jwx n ARG 79 Cb 0.46 -2.29 -0.11 0.00 -1.16 0.00 0.00 32.46 29.36 2jwx n ARG 79 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 2jwx n VAL 80 N 5.01 0.00 -3.54 1.55 0.24 0.12 -4.89 118.33 116.82 2jwx n VAL 80 Ca 0.27 -0.05 -0.09 0.00 -2.04 0.00 0.00 64.34 62.43 2jwx n VAL 80 Cb 0.18 1.02 -0.03 0.00 -1.47 0.00 0.00 33.84 33.54 2jwx n VAL 80 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jwx s GLN 81 N -2.85 0.71 -0.06 7.34 -2.07 -1.18 -4.65 119.66 116.91 2jwx s GLN 81 Ca 0.08 -0.12 -0.02 0.00 -1.82 0.00 0.00 55.36 53.49 2jwx s GLN 81 Cb 0.15 0.33 0.03 0.00 -1.09 0.00 0.00 33.01 32.43 2jwx s GLN 81 CO 0.80 -0.28 0.04 -2.00 -1.32 0.00 0.00 175.29 172.53 2jwx s GLU 82 N -2.32 0.21 -0.32 9.60 2.12 -1.26 -1.60 118.70 125.13 2jwx s GLU 82 Ca 0.02 0.24 0.04 0.00 0.36 0.00 0.00 54.97 55.63 2jwx s GLU 82 Cb -0.01 -0.78 0.09 0.00 0.26 0.00 0.00 34.13 33.70 2jwx s GLU 82 CO -0.04 -0.34 0.01 -2.00 -0.54 0.00 0.00 175.26 172.35 2jwx s GLU 83 N 2.08 1.66 -1.18 4.30 2.56 0.13 -4.99 118.70 123.26 2jwx s GLU 83 Ca 0.05 -1.75 -0.21 0.00 0.00 0.00 0.00 54.97 53.06 2jwx s GLU 83 Cb -0.12 -3.13 0.02 0.00 2.00 0.00 0.00 34.13 32.90 2jwx s GLU 83 CO -0.04 -0.85 1.75 -1.25 -0.56 0.00 0.00 175.26 174.30 2jwx s PRO 84 N 0.95 3.42 0.00 4.30 0.05 -1.26 -1.04 135.00 141.42 2jwx s PRO 84 Ca 0.06 -1.47 0.00 0.00 0.05 0.00 0.00 61.00 59.64 2jwx s PRO 84 Cb -0.19 -5.39 0.00 0.00 0.05 0.00 0.00 34.50 28.97 2jwx s PRO 84 CO -0.07 -2.76 0.00 0.39 0.05 0.00 0.00 177.00 174.60 2jwx n GLU 85 N 8.51 0.00 -3.72 4.56 1.02 -1.25 -4.92 120.64 124.84 2jwx n GLU 85 Ca 0.44 0.08 -0.38 0.00 -0.02 0.00 0.00 57.16 57.28 2jwx n GLU 85 Cb 0.47 -0.16 -0.12 0.00 -0.02 0.00 0.00 31.44 31.61 2jwx n GLU 85 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2jwx s LEU 86 N 0.00 4.54 -0.17 -4.62 2.96 0.17 -4.73 118.68 116.83 2jwx s LEU 86 Ca 0.00 -1.27 -0.06 0.00 -0.22 0.00 0.00 54.13 52.57 2jwx s LEU 86 Cb 0.00 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 2jwx s LEU 86 CO 0.00 -0.38 0.05 0.54 -1.32 0.00 0.00 176.35 175.23 2jwx s VAL 87 N 1.39 4.66 0.15 1.68 0.11 -1.22 -0.14 120.40 127.03 2jwx s VAL 87 Ca -0.00 -0.09 -0.09 0.00 -2.93 0.00 0.00 61.98 58.87 2jwx s VAL 87 Cb -0.20 -3.08 -0.00 0.00 -1.53 0.00 0.00 36.38 31.56 2jwx s VAL 87 CO 0.02 0.48 0.28 0.72 -3.33 0.00 0.00 175.10 173.28 2jwx s PHE 88 N 0.23 0.32 -0.51 1.54 -0.71 -1.00 -4.90 117.98 112.94 2jwx s PHE 88 Ca 0.03 -0.69 -0.28 0.00 -1.04 0.00 0.00 56.93 54.95 2jwx s PHE 88 Cb -0.12 -0.03 0.00 0.00 -1.21 0.00 0.00 43.02 41.66 2jwx s PHE 88 CO 0.01 -0.70 1.55 0.99 -1.34 0.00 0.00 175.22 175.72 2jwx s THR 89 N -3.94 3.69 0.36 -4.49 2.01 -1.26 -2.31 115.64 109.68 2jwx s THR 89 Ca 0.15 0.60 -0.28 0.00 0.31 0.00 0.00 61.69 62.47 2jwx s THR 89 Cb 0.03 -4.19 -0.12 0.00 0.01 0.00 0.00 72.50 68.23 2jwx s THR 89 CO -0.02 -0.94 1.37 -0.11 -0.69 0.00 0.00 174.62 174.23 2jwx n LEU 90 N 10.08 4.05 0.00 4.42 7.94 -1.03 -2.39 117.00 140.07 2jwx n LEU 90 Ca 0.16 1.21 0.00 0.00 -1.11 0.00 0.00 56.01 56.27 2jwx n LEU 90 Cb 0.49 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.90 2jwx n LEU 90 CO 0.70 -0.23 0.00 0.61 -1.11 0.00 0.00 177.39 177.36 2jwx n GLY 91 N 0.64 0.23 0.94 -3.96 0.00 -1.21 0.19 105.19 102.01 2jwx n GLY 91 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 2jwx n GLY 91 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jwx n ASP 92 N -0.38 2.84 -3.47 1.61 2.03 -1.01 -4.93 116.55 113.25 2jwx n ASP 92 Ca 0.00 -1.90 -0.25 0.00 0.52 0.00 0.00 54.79 53.16 2jwx n ASP 92 Cb 0.19 -0.14 0.05 0.00 -0.72 0.00 0.00 41.12 40.50 2jwx n ASP 92 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jwx n ASP 94 N -2.81 0.23 0.00 0.00 2.03 -1.25 -4.74 116.55 110.01 2jwx n ASP 94 Ca -0.02 0.56 0.00 0.00 0.52 0.00 0.00 54.79 55.84 2jwx n ASP 94 Cb 0.57 -0.61 0.00 0.00 -0.72 0.00 0.00 41.12 40.37 2jwx n ASP 94 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2jwx n VAL 95 N -1.76 0.00 -2.77 5.18 0.24 -1.26 -4.90 118.33 113.06 2jwx n VAL 95 Ca 0.03 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.94 2jwx n VAL 95 Cb 0.20 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.51 2jwx n VAL 95 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2jwx s ILE 96 N 1.19 4.11 0.54 1.34 -0.00 -1.26 -4.90 121.20 122.21 2jwx s ILE 96 Ca 0.00 2.03 0.26 0.00 -0.00 0.00 0.00 60.65 62.94 2jwx s ILE 96 Cb 0.00 -4.28 0.39 0.00 -0.00 0.00 0.00 42.46 38.58 2jwx s ILE 96 CO 0.00 0.45 2.00 -0.61 -0.00 0.00 0.00 174.94 176.78 2jwx h GLN 97 N 4.03 0.00 -0.35 0.37 5.75 -1.29 0.10 115.11 123.73 2jwx h GLN 97 Ca -0.45 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.12 2jwx h GLN 97 Cb 1.20 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.68 2jwx h GLN 97 CO 0.67 0.00 -0.12 0.00 -2.65 0.00 0.00 178.83 176.73 2jwx h ALA 98 N 1.72 0.18 0.08 3.38 0.00 -0.99 -1.80 119.26 121.82 2jwx h ALA 98 Ca 0.24 0.13 -0.25 0.00 0.00 0.00 0.00 54.91 55.02 2jwx h ALA 98 Cb 0.98 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2jwx h ALA 98 CO -0.00 -0.49 -1.19 1.25 0.00 0.00 0.00 179.25 178.81 2jwx h LEU 99 N -0.05 0.26 -0.88 0.00 5.85 -1.13 -2.17 115.31 117.20 2jwx h LEU 99 Ca 0.17 -0.29 -0.11 0.00 0.84 0.00 0.00 57.88 58.50 2jwx h LEU 99 Cb 0.31 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2jwx h LEU 99 CO -0.39 1.23 -0.33 -0.78 -0.34 0.00 0.00 178.44 177.84 2jwx h ASP 100 N 0.05 0.45 0.37 1.25 3.58 -0.89 -2.18 116.42 119.06 2jwx h ASP 100 Ca -0.10 -0.17 -0.32 0.00 0.42 0.00 0.00 57.03 56.86 2jwx h ASP 100 Cb 1.91 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 42.79 2jwx h ASP 100 CO 0.17 0.76 -1.81 0.18 -2.88 0.00 0.00 179.24 175.65 2jwx n LEU 101 N -4.08 1.36 0.01 2.28 4.77 -0.70 -3.32 117.00 117.32 2jwx n LEU 101 Ca -0.01 0.34 -0.07 0.00 -0.03 0.00 0.00 56.01 56.24 2jwx n LEU 101 Cb 0.45 -0.19 0.10 0.00 -2.33 0.00 0.00 43.42 41.45 2jwx n LEU 101 CO 0.43 0.53 0.55 -1.28 -1.33 0.00 0.00 177.39 176.28 2jwx h SER 102 N 0.02 0.54 0.23 -1.43 0.87 -0.97 -2.96 113.55 109.85 2jwx h SER 102 Ca -0.33 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 59.96 2jwx h SER 102 Cb 2.03 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.82 2jwx h SER 102 CO 0.08 0.94 -0.22 0.58 -0.53 0.00 0.00 176.83 177.68 2jwx h VAL 103 N 0.40 0.53 0.00 2.23 2.07 -1.64 0.72 116.25 120.57 2jwx h VAL 103 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2jwx h VAL 103 Cb 0.98 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 2jwx h VAL 103 CO 0.09 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.23 2jwx h PRO 104 N -0.48 0.00 -0.00 1.57 0.13 -1.76 0.56 132.00 132.03 2jwx h PRO 104 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2jwx h PRO 104 Cb 0.44 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.57 2jwx h PRO 104 CO -0.04 0.00 -0.32 1.28 -0.23 0.00 0.00 178.00 178.69 2jwx n LEU 105 N -2.52 0.42 -4.70 1.56 4.77 -0.42 -4.80 117.00 111.32 2jwx n LEU 105 Ca -0.01 0.10 -0.23 0.00 -0.03 0.00 0.00 56.01 55.84 2jwx n LEU 105 Cb 0.12 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 40.86 2jwx n LEU 105 CO 0.16 0.10 -0.28 0.00 -1.33 0.00 0.00 177.39 176.04 2jwx s MET 106 N -2.91 2.49 0.15 3.23 0.23 0.20 -4.71 119.30 117.98 2jwx s MET 106 Ca 0.15 -1.28 0.03 0.00 -1.03 0.00 0.00 55.69 53.55 2jwx s MET 106 Cb 0.18 -2.30 -0.04 0.00 -1.53 0.00 0.00 34.83 31.15 2jwx s MET 106 CO 0.62 0.38 0.26 -0.51 -2.03 0.00 0.00 175.02 173.75 2jwx s ASP 107 N -3.65 6.21 0.12 -1.18 1.11 -1.26 -4.65 116.67 113.36 2jwx s ASP 107 Ca 0.31 0.13 -0.31 0.00 0.18 0.00 0.00 52.55 52.86 2jwx s ASP 107 Cb -0.07 -1.84 -0.10 0.00 1.07 0.00 0.00 42.92 41.98 2jwx s ASP 107 CO 0.21 0.06 1.79 -0.69 1.18 0.00 0.00 175.17 177.72 2jwx s VAL 108 N -1.74 2.59 0.00 -1.27 1.01 0.07 -1.45 120.40 119.62 2jwx s VAL 108 Ca 0.34 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.44 2jwx s VAL 108 Cb -0.11 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.19 2jwx s VAL 108 CO 0.28 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2jwx n GLY 109 N 4.18 0.56 3.86 4.51 0.00 -0.26 -4.42 105.19 113.62 2jwx n GLY 109 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2jwx n GLY 109 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jwx s GLU 110 N -0.73 3.81 -0.22 1.61 2.12 -0.53 -4.41 118.70 120.36 2jwx s GLU 110 Ca 0.00 0.77 -0.02 0.00 0.36 0.00 0.00 54.97 56.09 2jwx s GLU 110 Cb 0.00 -2.18 0.07 0.00 0.26 0.00 0.00 34.13 32.27 2jwx s GLU 110 CO 0.00 -0.29 0.03 0.99 -0.54 0.00 0.00 175.26 175.44 2jwx s THR 111 N -2.71 0.79 -0.05 -1.70 2.01 0.72 -2.16 115.64 112.53 2jwx s THR 111 Ca 0.56 -0.83 0.05 0.00 0.31 0.00 0.00 61.69 61.77 2jwx s THR 111 Cb -0.10 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 2jwx s THR 111 CO 0.37 -0.26 -0.20 0.00 -0.69 0.00 0.00 174.62 173.84 2jwx s ALA 112 N 1.72 1.77 -0.30 7.40 0.00 -0.51 -1.28 121.76 130.56 2jwx s ALA 112 Ca -0.00 -0.82 -0.17 0.00 0.00 0.00 0.00 51.96 50.97 2jwx s ALA 112 Cb -0.17 -0.58 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 2jwx s ALA 112 CO -0.10 0.32 0.45 1.41 0.00 0.00 0.00 175.76 177.84 2jwx s MET 113 N -0.01 3.88 -0.23 0.00 -2.45 -0.26 -0.13 119.30 120.11 2jwx s MET 113 Ca -0.05 0.02 -0.01 0.00 -1.25 0.00 0.00 55.69 54.40 2jwx s MET 113 Cb -0.13 -3.71 0.02 0.00 1.25 0.00 0.00 34.83 32.26 2jwx s MET 113 CO 0.03 -0.42 -0.09 0.08 1.05 0.00 0.00 175.02 175.67 2jwx s VAL 114 N 2.22 2.76 -0.41 10.11 1.01 0.38 -0.40 120.40 136.07 2jwx s VAL 114 Ca 0.17 -0.93 -0.21 0.00 0.00 0.00 0.00 61.98 61.01 2jwx s VAL 114 Cb -0.16 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 33.90 2jwx s VAL 114 CO 0.11 0.31 0.67 0.42 0.00 0.00 0.00 175.10 176.60 2jwx s THR 115 N 1.34 4.81 -0.03 3.92 -4.23 0.53 -0.42 115.64 121.56 2jwx s THR 115 Ca 0.02 0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.91 2jwx s THR 115 Cb -0.16 -4.18 0.03 0.00 1.34 0.00 0.00 72.50 69.53 2jwx s THR 115 CO -0.06 -0.51 -0.00 0.00 -0.54 0.00 0.00 174.62 173.51 2jwx s ALA 116 N 2.87 0.36 0.83 3.99 0.00 -0.21 -0.14 121.76 129.47 2jwx s ALA 116 Ca 0.25 0.13 -0.14 0.00 0.00 0.00 0.00 51.96 52.20 2jwx s ALA 116 Cb -0.14 -0.36 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2jwx s ALA 116 CO 0.18 -0.10 0.64 -3.47 0.00 0.00 0.00 175.76 173.01 2jwx n ASP 117 N 4.21 -1.01 0.25 0.00 -0.08 -0.78 -0.06 116.55 119.07 2jwx n ASP 117 Ca -0.25 0.49 0.08 0.00 -1.51 0.00 0.00 54.79 53.61 2jwx n ASP 117 Cb 0.50 -1.28 0.62 0.00 2.34 0.00 0.00 41.12 43.31 2jwx n ASP 117 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 2jwx h SER 118 N -0.93 0.00 0.10 1.67 0.87 -1.23 0.46 113.55 114.49 2jwx h SER 118 Ca -0.45 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2jwx h SER 118 Cb 1.31 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.27 2jwx h SER 118 CO 0.40 0.09 -0.01 0.07 -0.53 0.00 0.00 176.83 176.86 2jwx h LYS 119 N 0.00 0.00 -0.05 2.24 2.10 -1.86 1.63 116.57 120.63 2jwx h LYS 119 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jwx h LYS 119 Cb 0.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 2jwx h LYS 119 CO 0.01 0.01 0.00 0.66 -2.00 0.00 0.00 179.45 178.13 2jwx n TYR 120 N -3.33 0.02 0.00 0.07 4.02 0.14 -4.73 117.16 113.36 2jwx n TYR 120 Ca -0.03 -0.01 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 2jwx n TYR 120 Cb 0.10 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.42 2jwx n TYR 120 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2jwx n TYR 122 N -1.50 0.00 0.00 0.00 4.01 0.41 -4.54 117.16 115.54 2jwx n TYR 122 Ca 0.00 -0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2jwx n TYR 122 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 2jwx n TYR 122 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jwx n GLY 123 N -0.12 -2.53 0.96 2.72 0.00 0.46 -0.27 105.19 106.41 2jwx n GLY 123 Ca 0.01 0.06 0.04 0.00 0.00 0.00 0.00 46.02 46.13 2jwx n GLY 123 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jwx n PRO 124 N -2.04 2.43 0.00 1.61 -0.04 -1.26 -4.38 135.00 131.32 2jwx n PRO 124 Ca 0.00 -1.30 0.00 0.00 -0.04 0.00 0.00 63.50 62.16 2jwx n PRO 124 Cb 0.00 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 2jwx n PRO 124 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2jwx n GLN 125 N 0.31 0.00 -0.50 0.54 6.02 -1.13 -5.15 117.38 117.47 2jwx n GLN 125 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 2jwx n GLN 125 Cb 0.55 -0.71 0.00 0.00 1.02 0.00 0.00 30.24 31.10 2jwx n GLN 125 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jwx n GLY 126 N 3.01 -3.40 3.96 1.08 0.00 0.63 -4.97 105.19 105.50 2jwx n GLY 126 Ca 0.00 -1.07 -0.23 0.00 0.00 0.00 0.00 46.02 44.73 2jwx n GLY 126 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jwx s SER 127 N -2.87 5.60 0.18 1.61 0.15 -0.64 -4.81 113.70 112.92 2jwx s SER 127 Ca 0.00 0.21 -0.13 0.00 0.70 0.00 0.00 55.95 56.73 2jwx s SER 127 Cb 0.00 -1.30 0.10 0.00 -1.71 0.00 0.00 66.02 63.11 2jwx s SER 127 CO 0.00 -0.90 1.84 0.08 1.20 0.00 0.00 173.24 175.46 2jwx h ARG 128 N 0.23 0.70 0.00 5.44 0.11 -1.96 -3.37 114.38 115.52 2jwx h ARG 128 Ca -0.45 -0.04 -0.18 0.00 0.10 0.00 0.00 59.98 59.41 2jwx h ARG 128 Cb 1.27 -0.16 -0.03 0.00 1.11 0.00 0.00 29.97 32.16 2jwx h ARG 128 CO 0.56 0.46 -1.47 0.45 0.10 0.00 0.00 179.97 180.07 2jwx n SER 129 N -4.72 1.31 -4.96 0.08 2.88 -1.26 -5.02 113.62 101.92 2jwx n SER 129 Ca 0.04 0.22 -0.22 0.00 -1.33 0.00 0.00 58.87 57.58 2jwx n SER 129 Cb 0.04 -0.52 0.01 0.00 -0.75 0.00 0.00 64.21 62.99 2jwx n SER 129 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2jwx s PRO 130 N -2.38 3.10 -0.35 -1.46 0.05 -1.26 -5.07 135.00 127.63 2jwx s PRO 130 Ca -0.21 -0.59 -0.10 0.00 0.05 0.00 0.00 61.00 60.15 2jwx s PRO 130 Cb 0.07 -2.62 0.01 0.00 0.05 0.00 0.00 34.50 32.01 2jwx s PRO 130 CO 0.28 -0.18 0.18 -0.47 0.05 0.00 0.00 177.00 176.86 2jwx s TYR 131 N -2.46 3.21 -0.37 0.56 5.04 -1.26 -1.62 117.35 120.46 2jwx s TYR 131 Ca 0.47 -0.79 -0.29 0.00 -2.44 0.00 0.00 57.07 54.03 2jwx s TYR 131 Cb -0.10 -2.40 0.01 0.00 0.35 0.00 0.00 41.96 39.82 2jwx s TYR 131 CO 0.36 -0.56 1.20 0.42 -1.34 0.00 0.00 175.55 175.63 2jwx s ILE 132 N 1.58 4.25 -0.69 3.14 -1.09 -1.26 -4.84 121.20 122.30 2jwx s ILE 132 Ca 0.03 1.38 -0.30 0.00 -2.23 0.00 0.00 60.65 59.53 2jwx s ILE 132 Cb -0.18 -4.37 -0.18 0.00 -1.58 0.00 0.00 42.46 36.16 2jwx s ILE 132 CO 0.07 -0.65 2.11 -2.65 -1.23 0.00 0.00 174.94 172.58 2jwx n PRO 133 N 7.39 0.00 -1.58 2.79 -0.01 -1.26 -4.32 135.00 138.01 2jwx n PRO 133 Ca 0.13 0.00 -0.54 0.00 -0.01 0.00 0.00 63.50 63.09 2jwx n PRO 133 Cb 0.48 -1.27 -0.06 0.00 -0.01 0.00 0.00 33.50 32.63 2jwx n PRO 133 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 175.50 175.14 2jwx n PRO 134 N 6.88 0.95 -0.81 0.52 -0.04 -1.26 0.24 135.00 141.49 2jwx n PRO 134 Ca 0.52 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 2jwx n PRO 134 Cb 0.00 -1.97 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 2jwx n PRO 134 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 2jwx n HIS 135 N 2.53 0.00 -2.07 0.54 -0.00 -1.26 -4.92 115.22 110.04 2jwx n HIS 135 Ca 0.19 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.95 2jwx n HIS 135 Cb 0.17 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.01 2jwx n HIS 135 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jwx s ALA 136 N -2.75 3.63 -0.30 1.57 0.00 0.14 -4.33 121.76 119.71 2jwx s ALA 136 Ca 0.00 0.89 -0.29 0.00 0.00 0.00 0.00 51.96 52.56 2jwx s ALA 136 Cb 0.00 -3.72 -0.00 0.00 0.00 0.00 0.00 23.12 19.40 2jwx s ALA 136 CO 0.00 -1.32 1.41 0.00 0.00 0.00 0.00 175.76 175.85 2jwx s ALA 137 N 3.78 3.27 0.65 0.00 0.00 -1.26 -0.93 121.76 127.27 2jwx s ALA 137 Ca 0.70 0.15 -0.09 0.00 0.00 0.00 0.00 51.96 52.72 2jwx s ALA 137 Cb -0.32 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 18.97 2jwx s ALA 137 CO 0.28 -1.95 1.01 -0.51 0.00 0.00 0.00 175.76 174.59 2jwx s LEU 138 N 4.84 3.08 -0.22 0.00 1.43 0.91 -0.97 118.68 127.75 2jwx s LEU 138 Ca 0.62 1.04 -0.04 0.00 -1.03 0.00 0.00 54.13 54.72 2jwx s LEU 138 Cb -0.18 -3.89 0.07 0.00 0.03 0.00 0.00 46.19 42.22 2jwx s LEU 138 CO 0.27 -1.15 0.09 0.00 0.23 0.00 0.00 176.35 175.78 2jwx s LEU 140 N 2.02 1.92 -0.49 0.00 2.34 0.44 0.12 118.68 125.04 2jwx s LEU 140 Ca 0.04 -0.58 -0.25 0.00 0.06 0.00 0.00 54.13 53.40 2jwx s LEU 140 Cb -0.16 -1.32 0.03 0.00 -0.56 0.00 0.00 46.19 44.18 2jwx s LEU 140 CO -0.17 -0.04 0.91 -0.70 -1.06 0.00 0.00 176.35 175.29 2jwx s GLU 141 N 1.39 3.45 -0.11 1.48 2.12 -1.06 -0.47 118.70 125.50 2jwx s GLU 141 Ca 0.05 -0.02 -0.05 0.00 0.36 0.00 0.00 54.97 55.30 2jwx s GLU 141 Cb -0.13 -3.97 -0.04 0.00 0.26 0.00 0.00 34.13 30.25 2jwx s GLU 141 CO -0.12 -1.29 0.09 0.14 -0.54 0.00 0.00 175.26 173.54 2jwx s VAL 142 N 3.74 5.05 -0.29 3.70 -7.23 0.81 -2.26 120.40 123.92 2jwx s VAL 142 Ca 0.34 0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.57 2jwx s VAL 142 Cb -0.11 -3.18 0.08 0.00 0.56 0.00 0.00 36.38 33.72 2jwx s VAL 142 CO 0.24 0.60 -0.02 -0.89 -0.31 0.00 0.00 175.10 174.71 2jwx s THR 143 N -0.86 1.97 -0.20 5.32 2.01 0.75 -1.43 115.64 123.20 2jwx s THR 143 Ca 0.13 -1.79 -0.29 0.00 0.31 0.00 0.00 61.69 60.05 2jwx s THR 143 Cb -0.12 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 70.11 2jwx s THR 143 CO 0.03 -0.31 1.21 -0.22 -0.69 0.00 0.00 174.62 174.64 2jwx s LEU 144 N 1.13 4.13 -0.14 4.42 0.20 -0.92 0.17 118.68 127.67 2jwx s LEU 144 Ca 0.01 1.56 0.04 0.00 0.69 0.00 0.00 54.13 56.43 2jwx s LEU 144 Cb -0.19 -3.54 -0.11 0.00 -0.43 0.00 0.00 46.19 41.92 2jwx s LEU 144 CO -0.08 -0.77 -0.09 0.29 -0.29 0.00 0.00 176.35 175.41 2jwx n LYS 145 N 6.61 0.85 -3.81 1.98 4.76 0.13 -1.10 118.16 127.58 2jwx n LYS 145 Ca 0.13 0.06 -0.12 0.00 -2.87 0.00 0.00 58.31 55.51 2jwx n LYS 145 Cb 0.45 -1.31 -0.10 0.00 -1.84 0.00 0.00 35.03 32.23 2jwx n LYS 145 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2jwx s THR 146 N -2.30 0.04 -0.18 -0.18 2.01 -1.20 -4.84 115.64 108.99 2jwx s THR 146 Ca -0.17 -0.36 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 2jwx s THR 146 Cb 0.05 -0.44 0.08 0.00 0.01 0.00 0.00 72.50 72.20 2jwx s THR 146 CO 0.39 -0.20 0.39 0.00 -0.69 0.00 0.00 174.62 174.52 2jwx s ALA 147 N -0.75 -1.03 0.01 7.40 0.00 -1.24 -1.37 121.76 124.77 2jwx s ALA 147 Ca -0.08 1.42 -0.16 0.00 0.00 0.00 0.00 51.96 53.14 2jwx s ALA 147 Cb -0.05 -1.17 0.03 0.00 0.00 0.00 0.00 23.12 21.93 2jwx s ALA 147 CO 0.02 -0.61 0.35 0.14 0.00 0.00 0.00 175.76 175.65 2jwx s VAL 148 N 2.27 0.06 0.01 0.00 -7.23 -0.85 -4.66 120.40 110.00 2jwx s VAL 148 Ca -0.03 -0.50 -0.30 0.00 -1.81 0.00 0.00 61.98 59.33 2jwx s VAL 148 Cb -0.11 -0.79 -0.05 0.00 0.56 0.00 0.00 36.38 35.99 2jwx s VAL 148 CO -0.12 -0.28 1.24 -0.62 -0.31 0.00 0.00 175.10 175.01 2jwx s ASP 149 N -1.65 7.02 0.00 4.85 2.15 -1.26 0.50 116.67 128.28 2jwx s ASP 149 Ca -0.09 1.96 0.00 0.00 0.43 0.00 0.00 52.55 54.85 2jwx s ASP 149 Cb -0.03 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 2jwx s ASP 149 CO 0.01 -0.56 0.70 0.18 -0.17 0.00 0.00 175.17 175.33 2jwx n LEU 150 N 4.68 0.00 -0.05 -1.34 4.77 -1.11 -4.86 117.00 119.09 2jwx n LEU 150 Ca 0.10 -0.71 -0.01 0.00 -0.03 0.00 0.00 56.01 55.37 2jwx n LEU 150 Cb 0.46 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2jwx n LEU 150 CO 0.56 0.34 -0.06 -0.08 -1.33 0.00 0.00 177.39 176.81 2jwx h GLU 151 N 0.00 0.00 0.00 3.23 4.22 -1.73 -3.47 114.58 116.83 2jwx h GLU 151 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2jwx h GLU 151 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2jwx h GLU 151 CO 0.00 0.01 0.00 0.72 -2.18 0.00 0.00 179.01 177.56 2jwx n HIS 152 N -4.75 0.00 -2.70 0.92 8.25 -1.26 -1.66 115.22 114.02 2jwx n HIS 152 Ca -0.02 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.38 2jwx n HIS 152 Cb 0.06 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.28 2jwx n HIS 152 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2jwx n HIS 153 N 0.00 -2.12 0.40 4.41 -0.00 -1.26 -4.93 115.22 111.72 2jwx n HIS 153 Ca 0.00 -1.98 0.12 0.00 0.46 0.00 0.00 57.72 56.33 2jwx n HIS 153 Cb 0.00 1.43 0.27 0.00 -0.12 0.00 0.00 29.99 31.57 2jwx n HIS 153 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2jwx h HIS 154 N 2.00 0.00 -3.53 1.57 6.17 -1.67 -3.41 115.15 116.29 2jwx h HIS 154 Ca -0.28 0.00 -0.70 0.00 0.71 0.00 0.00 60.37 60.10 2jwx h HIS 154 Cb 1.29 0.00 -0.32 0.00 2.52 0.00 0.00 27.41 30.90 2jwx h HIS 154 CO 0.15 0.00 -0.55 -1.01 0.71 0.00 0.00 177.93 177.23 2jwx s HIS 155 N -3.16 3.43 -0.00 5.26 3.76 -1.26 -5.08 115.29 118.24 2jwx s HIS 155 Ca 0.09 -1.99 0.05 0.00 -0.15 0.00 0.00 55.06 53.05 2jwx s HIS 155 Cb 0.08 -2.91 -0.03 0.00 1.11 0.00 0.00 32.58 30.83 2jwx s HIS 155 CO 0.64 -0.90 -0.14 -3.38 -0.85 0.00 0.00 174.74 170.11 2jwx s HIS 156 N 1.26 2.68 0.00 1.40 -3.43 -1.26 -5.15 115.29 110.79 2jwx s HIS 156 Ca 0.04 -0.17 0.00 0.00 -0.80 0.00 0.00 55.06 54.12 2jwx s HIS 156 Cb -0.22 -1.56 0.00 0.00 -1.43 0.00 0.00 32.58 29.37 2jwx s HIS 156 CO -0.01 0.25 0.00 1.58 -2.00 0.00 0.00 174.74 174.55