#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r50 n PHE 13 N 0.00 2.37 -1.97 3.52 7.35 -1.26 -4.95 117.46 122.52 2r50 n PHE 13 Ca 0.00 -0.16 -0.24 0.00 -0.76 0.00 0.00 57.45 56.29 2r50 n PHE 13 Cb 0.00 -2.73 0.16 0.00 0.35 0.00 0.00 39.48 37.26 2r50 n PHE 13 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2r50 n GLY 14 N 4.60 -0.94 0.16 7.13 0.00 -1.26 -4.33 105.19 110.55 2r50 n GLY 14 Ca 0.22 -1.78 -0.14 0.00 0.00 0.00 0.00 46.02 44.33 2r50 n GLY 14 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2r50 h GLU 15 N 0.00 0.42 -0.00 1.61 4.81 -1.97 -2.85 114.58 116.59 2r50 h GLU 15 Ca -0.35 -0.46 -0.12 0.00 -0.13 0.00 0.00 59.36 58.31 2r50 h GLU 15 Cb 1.01 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 2r50 h GLU 15 CO 0.27 1.12 -0.54 1.05 -0.73 0.00 0.00 179.01 180.17 2r50 h GLU 16 N 0.23 0.01 0.56 1.92 4.11 -1.97 0.31 114.58 119.76 2r50 h GLU 16 Ca -0.08 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.31 2r50 h GLU 16 Cb 1.59 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.85 2r50 h GLU 16 CO 0.17 0.55 -0.27 1.96 0.07 0.00 0.00 179.01 181.49 2r50 h GLN 17 N 0.01 -0.72 -0.91 1.06 7.50 -1.93 0.75 115.11 120.87 2r50 h GLN 17 Ca -0.01 0.05 0.14 0.00 0.50 0.00 0.00 58.65 59.33 2r50 h GLN 17 Cb 0.97 0.16 -0.09 0.00 0.05 0.00 0.00 27.48 28.57 2r50 h GLN 17 CO 0.07 -0.42 0.52 1.49 -1.50 0.00 0.00 178.83 178.99 2r50 h GLU 18 N -0.99 0.75 -0.49 1.46 4.81 -1.29 -0.98 114.58 117.85 2r50 h GLU 18 Ca -0.08 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 2r50 h GLU 18 Cb 0.64 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 2r50 h GLU 18 CO 0.13 0.50 0.02 0.00 -0.73 0.00 0.00 179.01 178.92 2r50 h ALA 19 N 1.54 1.11 -0.55 2.92 0.00 -0.26 -1.44 119.26 122.59 2r50 h ALA 19 Ca 0.48 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2r50 h ALA 19 Cb 0.59 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2r50 h ALA 19 CO -0.32 0.57 0.16 -0.07 0.00 0.00 0.00 179.25 179.59 2r50 h LEU 20 N 0.75 0.82 -0.49 0.00 3.38 0.51 -0.25 115.31 120.04 2r50 h LEU 20 Ca 0.15 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2r50 h LEU 20 Cb 0.43 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2r50 h LEU 20 CO 0.02 0.82 0.27 0.58 0.09 0.00 0.00 178.44 180.22 2r50 h VAL 21 N 0.77 1.16 -0.12 1.22 2.07 -1.16 -2.89 116.25 117.31 2r50 h VAL 21 Ca 0.18 -0.41 -0.11 0.00 0.82 0.00 0.00 66.70 67.17 2r50 h VAL 21 Cb 0.31 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2r50 h VAL 21 CO -0.00 0.17 -0.36 -0.07 0.02 0.00 0.00 177.57 177.33 2r50 h LEU 22 N 0.64 0.54 -0.92 2.57 3.38 -1.08 -1.60 115.31 118.84 2r50 h LEU 22 Ca 0.17 -0.60 -0.11 0.00 0.09 0.00 0.00 57.88 57.43 2r50 h LEU 22 Cb 0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2r50 h LEU 22 CO -0.03 1.04 -0.46 0.11 0.09 0.00 0.00 178.44 179.19 2r50 h LYS 23 N 0.06 0.18 0.05 1.13 1.57 -1.12 -0.31 116.57 118.13 2r50 h LYS 23 Ca -0.01 -0.09 -0.23 0.00 -1.87 0.00 0.00 60.65 58.45 2r50 h LYS 23 Cb 0.98 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 2r50 h LYS 23 CO 0.08 0.61 -1.07 0.66 -0.57 0.00 0.00 179.45 179.15 2r50 h SER 24 N 0.15 0.19 0.05 0.86 4.64 -1.51 -3.17 113.55 114.74 2r50 h SER 24 Ca 0.01 -0.19 -0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2r50 h SER 24 Cb 0.87 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2r50 h SER 24 CO 0.07 1.13 -0.02 -0.25 -0.87 0.00 0.00 176.83 176.88 2r50 h TRP 25 N 0.04 -0.06 -0.93 4.77 -0.00 -0.89 -0.34 115.95 118.54 2r50 h TRP 25 Ca -0.06 -0.00 0.23 0.00 -0.00 0.00 0.00 58.89 59.06 2r50 h TRP 25 Cb 1.80 0.02 -0.17 0.00 -0.00 0.00 0.00 29.16 30.81 2r50 h TRP 25 CO 0.03 0.12 -0.03 0.00 -0.00 0.00 0.00 178.44 178.55 2r50 h ALA 26 N 0.72 0.97 -0.28 2.65 0.00 -1.10 0.37 119.26 122.60 2r50 h ALA 26 Ca -0.01 0.32 -0.13 0.00 0.00 0.00 0.00 54.91 55.10 2r50 h ALA 26 Cb 0.20 0.58 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2r50 h ALA 26 CO 0.01 -0.50 -0.32 0.28 0.00 0.00 0.00 179.25 178.72 2r50 h VAL 27 N 0.03 1.30 0.01 0.00 2.07 -1.48 -3.35 116.25 114.84 2r50 h VAL 27 Ca 0.53 -1.50 -0.20 0.00 0.82 0.00 0.00 66.70 66.36 2r50 h VAL 27 Cb 1.01 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 2r50 h VAL 27 CO -0.88 0.48 -0.91 0.24 0.02 0.00 0.00 177.57 176.52 2r50 h MET 28 N 0.45 0.06 0.00 1.57 2.86 0.14 -3.15 114.93 116.86 2r50 h MET 28 Ca 0.04 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2r50 h MET 28 Cb 0.90 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2r50 h MET 28 CO 0.08 0.93 0.00 0.36 1.06 0.00 0.00 176.91 179.33 2r50 n LYS 29 N -3.52 0.12 0.04 1.72 2.85 0.39 -1.86 118.16 117.90 2r50 n LYS 29 Ca -0.02 0.21 0.13 0.00 -1.05 0.00 0.00 58.31 57.59 2r50 n LYS 29 Cb 0.85 -1.50 0.51 0.00 -0.65 0.00 0.00 35.03 34.24 2r50 n LYS 29 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2r50 n LYS 30 N -1.30 0.10 -2.84 -1.58 5.02 -1.19 -3.56 118.16 112.81 2r50 n LYS 30 Ca 0.04 0.12 -0.00 0.00 -2.02 0.00 0.00 58.31 56.45 2r50 n LYS 30 Cb 0.08 -1.62 0.05 0.00 -0.02 0.00 0.00 35.03 33.51 2r50 n LYS 30 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2r50 n ASP 31 N -1.79 1.54 -0.27 4.39 2.03 -0.78 -4.96 116.55 116.71 2r50 n ASP 31 Ca 0.06 -2.03 0.02 0.00 0.52 0.00 0.00 54.79 53.36 2r50 n ASP 31 Cb 0.34 -0.47 0.15 0.00 -0.72 0.00 0.00 41.12 40.43 2r50 n ASP 31 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2r50 h ALA 32 N 2.60 1.08 0.23 -1.67 0.00 -1.59 -1.65 119.26 118.26 2r50 h ALA 32 Ca -0.14 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2r50 h ALA 32 Cb 1.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2r50 h ALA 32 CO 0.18 0.03 -0.20 0.00 0.00 0.00 0.00 179.25 179.26 2r50 h ALA 33 N 1.44 -0.43 -0.03 0.00 0.00 -1.92 0.20 119.26 118.53 2r50 h ALA 33 Ca 0.37 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 2r50 h ALA 33 Cb 0.36 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2r50 h ALA 33 CO -0.25 -0.77 -0.20 -0.91 0.00 0.00 0.00 179.25 177.12 2r50 h ASN 34 N -0.45 0.04 0.03 0.00 4.21 -1.97 -2.09 115.58 115.35 2r50 h ASN 34 Ca -0.01 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.50 2r50 h ASN 34 Cb 0.41 -0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 37.60 2r50 h ASN 34 CO -0.03 0.25 -0.03 0.25 -1.29 0.00 0.00 177.43 176.58 2r50 h LEU 35 N 0.04 -0.08 -1.14 1.61 6.46 -0.28 -0.40 115.31 121.53 2r50 h LEU 35 Ca 0.01 0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.72 2r50 h LEU 35 Cb 0.38 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.33 2r50 h LEU 35 CO 0.03 -0.05 -0.02 1.23 -0.62 0.00 0.00 178.44 179.01 2r50 h GLY 36 N -0.07 0.62 0.85 3.75 0.00 -0.47 0.91 103.07 108.66 2r50 h GLY 36 Ca 0.00 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 2r50 h GLY 36 CO -0.01 0.36 -0.15 -2.00 0.00 0.00 0.00 176.54 174.74 2r50 h LEU 37 N 0.55 0.53 -0.92 3.11 5.85 -1.00 -1.22 115.31 122.20 2r50 h LEU 37 Ca 0.11 -0.44 0.06 0.00 0.84 0.00 0.00 57.88 58.45 2r50 h LEU 37 Cb 0.38 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.20 2r50 h LEU 37 CO 0.01 0.85 0.58 0.03 -0.34 0.00 0.00 178.44 179.58 2r50 h ARG 38 N 0.21 1.05 -0.21 1.25 3.08 -0.57 -0.37 114.38 118.81 2r50 h ARG 38 Ca 0.05 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.06 2r50 h ARG 38 Cb 0.67 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 2r50 h ARG 38 CO 0.04 0.69 0.02 0.35 -1.07 0.00 0.00 179.97 180.00 2r50 h PHE 39 N 1.08 0.03 -0.17 3.04 3.57 -0.58 -1.57 116.94 122.34 2r50 h PHE 39 Ca 0.39 0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.71 2r50 h PHE 39 Cb 0.14 0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2r50 h PHE 39 CO -0.02 -0.01 -0.68 0.74 -2.23 0.00 0.00 178.31 176.12 2r50 h PHE 40 N 0.09 0.88 -0.68 0.41 -1.00 -0.88 -2.25 116.94 113.52 2r50 h PHE 40 Ca 0.10 -0.36 -0.01 0.00 2.81 0.00 0.00 57.97 60.51 2r50 h PHE 40 Cb 0.11 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.49 2r50 h PHE 40 CO -0.16 1.15 0.40 -0.07 -1.61 0.00 0.00 178.31 178.02 2r50 h LEU 41 N 0.48 0.82 -0.17 1.54 3.38 -0.87 -1.49 115.31 119.00 2r50 h LEU 41 Ca -0.02 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2r50 h LEU 41 Cb 1.27 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2r50 h LEU 41 CO 0.13 0.64 -0.13 0.50 0.09 0.00 0.00 178.44 179.68 2r50 h LYS 42 N 0.94 0.39 -0.48 1.13 1.63 -1.12 -1.70 116.57 117.37 2r50 h LYS 42 Ca 0.24 -0.19 0.07 0.00 -0.85 0.00 0.00 60.65 59.92 2r50 h LYS 42 Cb -0.02 -0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.56 2r50 h LYS 42 CO -0.04 0.73 0.16 0.28 -3.45 0.00 0.00 179.45 177.12 2r50 h VAL 43 N 0.05 0.82 0.00 2.00 2.07 -1.11 -1.88 116.25 118.20 2r50 h VAL 43 Ca 0.03 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2r50 h VAL 43 Cb 0.64 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2r50 h VAL 43 CO 0.03 0.06 -0.03 -0.26 0.02 0.00 0.00 177.57 177.39 2r50 h PHE 44 N 0.32 0.00 0.04 1.57 0.04 -1.28 -0.91 116.94 116.72 2r50 h PHE 44 Ca 0.23 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.77 2r50 h PHE 44 Cb 0.25 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.40 2r50 h PHE 44 CO -0.17 0.03 -1.01 1.49 -0.60 0.00 0.00 178.31 178.05 2r50 h GLU 45 N 0.00 0.33 0.07 1.51 4.81 -0.53 -2.06 114.58 118.71 2r50 h GLU 45 Ca -0.00 -0.40 -0.12 0.00 -0.13 0.00 0.00 59.36 58.71 2r50 h GLU 45 Cb 0.55 0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.07 2r50 h GLU 45 CO 0.00 1.10 -0.51 0.82 -0.73 0.00 0.00 179.01 179.70 2r50 h ILE 46 N 0.16 1.59 -2.72 2.32 2.04 -1.17 -3.41 117.51 116.31 2r50 h ILE 46 Ca -0.09 -2.37 -0.60 0.00 1.00 0.00 0.00 64.86 62.80 2r50 h ILE 46 Cb 1.67 3.15 -0.40 0.00 -0.74 0.00 0.00 36.82 40.50 2r50 h ILE 46 CO 0.17 0.66 -0.80 0.00 0.00 0.00 0.00 178.15 178.17 2r50 s ALA 47 N -2.53 2.20 0.42 1.87 0.00 -0.37 -4.99 121.76 118.36 2r50 s ALA 47 Ca -0.15 -2.82 0.17 0.00 0.00 0.00 0.00 51.96 49.15 2r50 s ALA 47 Cb 0.00 -1.82 1.07 0.00 0.00 0.00 0.00 23.12 22.37 2r50 s ALA 47 CO 0.78 -2.04 1.88 -1.35 0.00 0.00 0.00 175.76 175.04 2r50 h PRO 48 N 5.92 0.40 -0.16 0.00 0.11 -1.60 -1.50 132.00 135.17 2r50 h PRO 48 Ca 0.16 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.29 2r50 h PRO 48 Cb 0.88 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 2r50 h PRO 48 CO 0.48 0.26 0.19 0.66 -0.21 0.00 0.00 178.00 179.39 2r50 h SER 49 N 0.41 0.00 0.49 -2.05 4.64 -1.94 -1.73 113.55 113.38 2r50 h SER 49 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2r50 h SER 49 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2r50 h SER 49 CO -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.81 2r50 n ALA 50 N -2.31 1.63 0.23 5.18 0.00 -0.56 -1.82 120.51 122.85 2r50 n ALA 50 Ca 0.01 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.54 2r50 n ALA 50 Cb 0.31 -1.24 0.46 0.00 0.00 0.00 0.00 19.45 18.98 2r50 n ALA 50 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2r50 h LYS 51 N 0.00 0.00 0.00 0.00 3.11 -1.51 -2.96 116.57 115.22 2r50 h LYS 51 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2r50 h LYS 51 Cb 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.48 2r50 h LYS 51 CO 0.00 0.14 0.00 1.04 -2.81 0.00 0.00 179.45 177.82 2r50 n GLN 52 N -3.24 0.12 0.10 1.90 6.02 -0.75 -2.45 117.38 119.07 2r50 n GLN 52 Ca 0.01 0.34 -0.01 0.00 -0.01 0.00 0.00 57.00 57.33 2r50 n GLN 52 Cb 0.43 -1.72 -0.03 0.00 1.02 0.00 0.00 30.24 29.94 2r50 n GLN 52 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 2r50 h MET 53 N 0.00 0.00 0.00 -1.09 2.86 -1.70 -3.42 114.93 111.58 2r50 h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2r50 h MET 53 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 2r50 h MET 53 CO 0.00 0.62 0.00 1.19 1.06 0.00 0.00 176.91 179.78 2r50 n PHE 54 N -3.22 0.00 -1.89 -0.22 3.01 -1.03 -5.04 117.46 109.08 2r50 n PHE 54 Ca -0.00 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.44 2r50 n PHE 54 Cb 0.81 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 40.29 2r50 n PHE 54 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2r50 n SER 55 N -0.43 -3.17 0.00 4.37 7.64 -1.26 -5.19 113.62 115.58 2r50 n SER 55 Ca 0.00 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2r50 n SER 55 Cb 0.00 -1.74 0.00 0.00 -1.01 0.00 0.00 64.21 61.46 2r50 n SER 55 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2r50 n GLU 65 N -1.63 0.00 -0.54 1.43 4.71 -1.26 -5.21 120.64 118.13 2r50 n GLU 65 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 2r50 n GLU 65 Cb 0.52 0.00 0.20 0.00 -1.01 0.00 0.00 31.44 31.15 2r50 n GLU 65 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2r50 n LYS 66 N 0.00 2.86 -1.61 3.49 0.00 -1.26 -4.95 118.16 116.69 2r50 n LYS 66 Ca 0.00 -1.74 -0.45 0.00 0.00 0.00 0.00 58.31 56.12 2r50 n LYS 66 Cb 0.00 -1.87 -0.04 0.00 0.00 0.00 0.00 35.03 33.12 2r50 n LYS 66 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2r50 n ASN 67 N 0.18 3.39 0.25 3.14 4.05 -1.26 -4.81 115.26 120.20 2r50 n ASN 67 Ca 0.19 0.52 0.13 0.00 0.45 0.00 0.00 54.58 55.87 2r50 n ASN 67 Cb 0.86 -1.49 0.60 0.00 1.23 0.00 0.00 39.78 40.99 2r50 n ASN 67 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2r50 h PRO 68 N 12.75 0.00 -0.82 1.20 0.13 -1.99 -1.07 132.00 142.19 2r50 h PRO 68 Ca -0.43 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.67 2r50 h PRO 68 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 2r50 h PRO 68 CO 0.96 0.15 0.40 -0.22 -0.23 0.00 0.00 178.00 179.06 2r50 h LYS 69 N 0.00 1.17 -0.68 0.86 3.11 -1.99 -0.66 116.57 118.39 2r50 h LYS 69 Ca -0.00 -0.16 -0.07 0.00 -2.81 0.00 0.00 60.65 57.61 2r50 h LYS 69 Cb 0.58 -0.22 -0.03 0.00 -1.00 0.00 0.00 32.23 31.56 2r50 h LYS 69 CO 0.02 0.90 0.16 -0.07 -2.81 0.00 0.00 179.45 177.64 2r50 h LEU 70 N 1.17 1.02 -0.36 5.20 3.38 -1.57 -1.56 115.31 122.59 2r50 h LEU 70 Ca 0.28 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2r50 h LEU 70 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2r50 h LEU 70 CO -0.04 0.99 0.19 0.11 0.09 0.00 0.00 178.44 179.77 2r50 h LYS 71 N 1.03 0.52 -0.30 1.13 1.57 -1.34 -1.97 116.57 117.20 2r50 h LYS 71 Ca 0.21 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2r50 h LYS 71 Cb 0.37 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2r50 h LYS 71 CO 0.00 0.44 0.11 1.15 -0.57 0.00 0.00 179.45 180.58 2r50 h THR 72 N 0.46 1.19 -0.56 -0.16 2.02 -0.95 -2.17 112.91 112.74 2r50 h THR 72 Ca 0.13 -0.61 0.05 0.00 0.77 0.00 0.00 66.41 66.75 2r50 h THR 72 Cb 0.09 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.48 2r50 h THR 72 CO -0.02 0.21 0.29 -0.74 0.37 0.00 0.00 175.52 175.63 2r50 h HIS 73 N 0.34 0.53 -0.35 3.16 -0.00 -1.25 0.08 115.15 117.65 2r50 h HIS 73 Ca 0.10 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.49 2r50 h HIS 73 Cb 0.22 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.45 2r50 h HIS 73 CO 0.00 0.26 0.21 0.00 -0.00 0.00 0.00 177.93 178.40 2r50 h ALA 74 N 1.30 0.45 -0.56 5.26 0.00 -1.20 -1.04 119.26 123.47 2r50 h ALA 74 Ca 0.25 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2r50 h ALA 74 Cb 0.15 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2r50 h ALA 74 CO -0.17 -0.05 0.22 0.52 0.00 0.00 0.00 179.25 179.76 2r50 h MET 75 N 0.46 0.84 -0.51 0.00 2.86 -1.28 -2.22 114.93 115.07 2r50 h MET 75 Ca 0.13 -0.16 0.10 0.00 -2.06 0.00 0.00 59.70 57.71 2r50 h MET 75 Cb 0.01 -0.13 -0.09 0.00 0.06 0.00 0.00 31.60 31.44 2r50 h MET 75 CO -0.02 0.73 -0.07 0.77 1.06 0.00 0.00 176.91 179.38 2r50 h SER 76 N 0.76 -0.36 -0.68 1.22 0.02 -0.32 0.42 113.55 114.61 2r50 h SER 76 Ca 0.18 0.14 0.11 0.00 -0.84 0.00 0.00 61.79 61.38 2r50 h SER 76 Cb 0.21 0.27 -0.08 0.00 0.14 0.00 0.00 62.40 62.94 2r50 h SER 76 CO -0.01 -0.13 0.28 0.58 -1.14 0.00 0.00 176.83 176.41 2r50 h VAL 77 N 0.05 0.76 -0.03 2.27 2.07 -0.81 0.08 116.25 120.63 2r50 h VAL 77 Ca 0.25 -0.16 -0.11 0.00 0.82 0.00 0.00 66.70 67.50 2r50 h VAL 77 Cb 0.39 0.24 0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2r50 h VAL 77 CO -0.48 0.09 -0.43 -0.26 0.02 0.00 0.00 177.57 176.50 2r50 h PHE 78 N 0.47 0.49 -0.06 1.57 0.04 -0.70 -2.41 116.94 116.33 2r50 h PHE 78 Ca 0.35 -0.25 -0.01 0.00 2.80 0.00 0.00 57.97 60.87 2r50 h PHE 78 Cb 0.45 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 2r50 h PHE 78 CO -0.15 1.04 0.01 0.28 -0.60 0.00 0.00 178.31 178.88 2r50 h VAL 79 N -0.20 1.22 0.00 -0.55 2.07 0.08 -1.61 116.25 117.25 2r50 h VAL 79 Ca -0.05 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 2r50 h VAL 79 Cb 1.14 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 32.45 2r50 h VAL 79 CO 0.09 0.18 -0.06 0.24 0.02 0.00 0.00 177.57 178.04 2r50 h MET 80 N -0.15 0.00 -0.18 1.57 2.86 -1.08 -1.41 114.93 116.54 2r50 h MET 80 Ca 0.02 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.48 2r50 h MET 80 Cb 0.28 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 2r50 h MET 80 CO 0.00 0.06 -0.62 1.15 1.06 0.00 0.00 176.91 178.56 2r50 h THR 81 N 0.00 1.31 -0.41 2.22 2.02 -1.12 -0.22 112.91 116.71 2r50 h THR 81 Ca -0.00 -1.87 -0.07 0.00 0.77 0.00 0.00 66.41 65.24 2r50 h THR 81 Cb 0.55 1.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.78 2r50 h THR 81 CO 0.01 0.59 -0.02 0.00 0.37 0.00 0.00 175.52 176.47 2r50 h GLU 83 N 0.63 0.68 -0.19 0.00 5.08 -1.09 -2.12 114.58 117.56 2r50 h GLU 83 Ca 0.13 -0.41 -0.08 0.00 -1.00 0.00 0.00 59.36 58.00 2r50 h GLU 83 Cb 0.42 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2r50 h GLU 83 CO 0.02 1.03 -0.21 0.00 -1.00 0.00 0.00 179.01 178.84 2r50 h ALA 84 N 0.89 1.28 -0.27 3.43 0.00 -0.72 -1.38 119.26 122.50 2r50 h ALA 84 Ca 0.02 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2r50 h ALA 84 Cb 1.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2r50 h ALA 84 CO 0.10 0.48 0.02 0.00 0.00 0.00 0.00 179.25 179.85 2r50 h ALA 85 N 1.47 0.36 -0.75 0.00 0.00 -1.23 0.04 119.26 119.16 2r50 h ALA 85 Ca 0.05 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 54.86 2r50 h ALA 85 Cb 0.55 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.17 2r50 h ALA 85 CO 0.04 0.07 0.37 0.00 0.00 0.00 0.00 179.25 179.73 2r50 h ALA 86 N 0.84 1.05 0.00 0.00 0.00 -1.09 -1.58 119.26 118.48 2r50 h ALA 86 Ca 0.08 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 2r50 h ALA 86 Cb 0.38 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2r50 h ALA 86 CO 0.01 -0.06 -0.43 1.96 0.00 0.00 0.00 179.25 180.73 2r50 h GLN 87 N 0.60 0.00 -0.07 0.00 4.20 -0.91 -2.41 115.11 116.52 2r50 h GLN 87 Ca 0.38 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.89 2r50 h GLN 87 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2r50 h GLN 87 CO -0.30 0.43 -0.80 -0.07 -0.67 0.00 0.00 178.83 177.42 2r50 h LEU 88 N 0.00 0.59 0.27 1.46 3.38 -0.42 -1.78 115.31 118.80 2r50 h LEU 88 Ca -0.00 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 2r50 h LEU 88 Cb 1.10 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2r50 h LEU 88 CO 0.06 1.18 -0.22 -0.09 0.09 0.00 0.00 178.44 179.45 2r50 h ARG 89 N 0.32 -0.49 0.00 1.13 1.12 -0.91 -2.31 114.38 113.24 2r50 h ARG 89 Ca -0.05 0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 2r50 h ARG 89 Cb 1.40 0.11 0.00 0.00 -0.01 0.00 0.00 29.97 31.47 2r50 h ARG 89 CO 0.14 -0.32 0.00 1.17 -3.11 0.00 0.00 179.97 177.85 2r50 n LYS 90 N -5.35 0.00 -0.04 0.20 4.81 -0.94 -4.18 118.16 112.65 2r50 n LYS 90 Ca -0.09 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.43 2r50 n LYS 90 Cb 0.26 -0.75 0.34 0.00 0.02 0.00 0.00 35.03 34.90 2r50 n LYS 90 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2r50 n ALA 91 N -0.51 2.54 -1.12 3.14 0.00 -0.67 -4.87 120.51 119.03 2r50 n ALA 91 Ca 0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 53.44 53.13 2r50 n ALA 91 Cb 0.00 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.28 2r50 n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r50 n GLY 92 N 0.84 0.61 3.41 0.00 0.00 -0.87 -4.92 105.19 104.26 2r50 n GLY 92 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 2r50 n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r50 s LYS 93 N -2.40 1.03 -0.06 1.61 -2.85 -1.23 -4.77 119.74 111.06 2r50 s LYS 93 Ca 0.00 -0.12 -0.30 0.00 -1.00 0.00 0.00 55.97 54.55 2r50 s LYS 93 Cb 0.00 0.47 -0.05 0.00 -2.06 0.00 0.00 37.83 36.20 2r50 s LYS 93 CO 0.00 -0.36 1.48 0.08 0.10 0.00 0.00 175.35 176.65 2r50 s VAL 94 N -2.12 3.78 -0.35 1.79 1.01 -1.26 -4.17 120.40 119.06 2r50 s VAL 94 Ca -0.07 1.03 0.06 0.00 0.00 0.00 0.00 61.98 63.00 2r50 s VAL 94 Cb -0.01 -3.66 0.45 0.00 0.00 0.00 0.00 36.38 33.16 2r50 s VAL 94 CO 0.01 -0.06 1.21 0.35 0.00 0.00 0.00 175.10 176.61 2r50 n THR 95 N 5.18 2.54 -2.45 3.92 -2.24 -1.26 -5.04 114.28 114.93 2r50 n THR 95 Ca 0.15 -4.37 -0.41 0.00 -2.27 0.00 0.00 64.05 57.15 2r50 n THR 95 Cb 0.43 -1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 67.45 2r50 n THR 95 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2r50 s VAL 96 N -4.87 3.65 -0.19 2.28 1.01 -1.26 -4.88 120.40 116.13 2r50 s VAL 96 Ca 0.51 1.47 -0.18 0.00 0.00 0.00 0.00 61.98 63.78 2r50 s VAL 96 Cb 0.41 -3.94 -0.08 0.00 0.00 0.00 0.00 36.38 32.78 2r50 s VAL 96 CO -0.03 0.28 0.65 -2.11 0.00 0.00 0.00 175.10 173.88 2r50 n ARG 97 N 2.06 0.00 -0.30 2.72 1.85 -1.26 -4.72 116.66 117.02 2r50 n ARG 97 Ca 0.02 0.00 0.15 0.00 -1.00 0.00 0.00 57.85 57.02 2r50 n ARG 97 Cb 0.45 -0.57 0.41 0.00 -1.05 0.00 0.00 32.46 31.69 2r50 n ARG 97 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 2r50 h GLU 98 N 2.18 0.60 0.00 2.89 4.81 -2.00 -2.03 114.58 121.02 2r50 h GLU 98 Ca -0.15 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.01 2r50 h GLU 98 Cb 0.53 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2r50 h GLU 98 CO 0.38 0.40 -0.20 1.79 -0.73 0.00 0.00 179.01 180.65 2r50 h THR 99 N 0.62 0.35 -0.08 0.32 1.35 -1.99 -2.50 112.91 110.98 2r50 h THR 99 Ca 0.52 -1.41 -0.09 0.00 -0.55 0.00 0.00 66.41 64.88 2r50 h THR 99 Cb 0.98 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 2r50 h THR 99 CO -0.27 0.19 -0.29 0.74 -0.25 0.00 0.00 175.52 175.65 2r50 h THR 100 N 0.00 1.41 -1.00 6.82 2.02 -1.73 -2.54 112.91 117.89 2r50 h THR 100 Ca -0.00 -1.66 0.05 0.00 0.77 0.00 0.00 66.41 65.57 2r50 h THR 100 Cb 1.08 2.26 -0.06 0.00 -1.74 0.00 0.00 68.15 69.69 2r50 h THR 100 CO 0.03 0.48 0.65 -0.07 0.37 0.00 0.00 175.52 176.98 2r50 h LEU 101 N -0.14 1.07 -0.17 2.58 3.38 -1.35 0.10 115.31 120.79 2r50 h LEU 101 Ca -0.01 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 2r50 h LEU 101 Cb 0.92 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2r50 h LEU 101 CO 0.06 0.72 -0.44 0.11 0.09 0.00 0.00 178.44 178.98 2r50 h LYS 102 N 1.23 0.59 -0.23 1.13 1.57 -1.49 0.33 116.57 119.70 2r50 h LYS 102 Ca 0.41 -0.41 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2r50 h LYS 102 Cb 0.06 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 2r50 h LYS 102 CO -0.14 1.03 0.14 -0.09 -0.57 0.00 0.00 179.45 179.82 2r50 h ARG 103 N 0.25 0.27 -0.70 3.15 2.43 -1.33 -1.70 114.38 116.76 2r50 h ARG 103 Ca -0.01 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.24 2r50 h ARG 103 Cb 1.05 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 30.47 2r50 h ARG 103 CO 0.10 0.18 0.33 -0.07 -1.51 0.00 0.00 179.97 179.00 2r50 h LEU 104 N 0.28 0.41 -0.44 3.80 3.38 -0.03 0.11 115.31 122.83 2r50 h LEU 104 Ca 0.09 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2r50 h LEU 104 Cb -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2r50 h LEU 104 CO -0.04 0.23 0.25 1.23 0.09 0.00 0.00 178.44 180.20 2r50 h GLY 105 N 0.56 0.66 0.98 0.83 0.00 -0.22 -2.38 103.07 103.49 2r50 h GLY 105 Ca 0.35 -0.29 -0.14 0.00 0.00 0.00 0.00 47.33 47.24 2r50 h GLY 105 CO -0.28 0.28 -0.42 0.00 0.00 0.00 0.00 176.54 176.12 2r50 h ALA 106 N 1.10 0.35 -0.18 3.60 0.00 -0.52 -0.32 119.26 123.30 2r50 h ALA 106 Ca 0.16 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2r50 h ALA 106 Cb 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2r50 h ALA 106 CO -0.03 0.47 0.11 1.15 0.00 0.00 0.00 179.25 180.95 2r50 h THR 107 N 0.38 1.06 -0.08 0.00 2.02 -0.71 0.60 112.91 116.18 2r50 h THR 107 Ca 0.01 -0.12 -0.15 0.00 0.77 0.00 0.00 66.41 66.92 2r50 h THR 107 Cb 1.02 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 2r50 h THR 107 CO 0.09 0.05 -0.63 0.45 0.37 0.00 0.00 175.52 175.86 2r50 h HIS 108 N 0.23 0.37 -0.51 3.16 3.86 -1.40 -1.66 115.15 119.19 2r50 h HIS 108 Ca 0.06 -0.15 -0.04 0.00 -1.16 0.00 0.00 60.37 59.09 2r50 h HIS 108 Cb -0.01 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 2r50 h HIS 108 CO -0.06 0.83 0.15 1.25 0.86 0.00 0.00 177.93 180.97 2r50 h LEU 109 N 0.21 0.75 -1.27 2.43 5.85 -1.00 -0.88 115.31 121.40 2r50 h LEU 109 Ca -0.01 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.57 2r50 h LEU 109 Cb 1.15 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.93 2r50 h LEU 109 CO 0.10 0.76 0.54 -0.09 -0.34 0.00 0.00 178.44 179.41 2r50 h ARG 110 N 0.70 0.84 -0.20 1.25 2.43 -0.15 -1.96 114.38 117.29 2r50 h ARG 110 Ca 0.16 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2r50 h ARG 110 Cb 0.29 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2r50 h ARG 110 CO -0.00 0.55 0.00 0.66 -1.51 0.00 0.00 179.97 179.67 2r50 n TYR 111 N -4.49 0.25 -2.01 2.20 4.02 -0.69 -4.98 117.16 111.46 2r50 n TYR 111 Ca 0.13 -0.13 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2r50 n TYR 111 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.57 2r50 n TYR 111 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2r50 n GLY 112 N 1.25 0.44 3.64 2.72 0.00 -0.74 -4.92 105.19 107.59 2r50 n GLY 112 Ca 0.17 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 2r50 n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r50 s VAL 113 N -2.08 4.60 0.54 1.61 1.01 -0.38 -5.01 120.40 120.69 2r50 s VAL 113 Ca 0.00 1.79 0.07 0.00 0.00 0.00 0.00 61.98 63.83 2r50 s VAL 113 Cb 0.00 -4.35 0.05 0.00 0.00 0.00 0.00 36.38 32.07 2r50 s VAL 113 CO 0.00 -0.35 0.50 0.00 0.00 0.00 0.00 175.10 175.25 2r50 s ALA 114 N 3.43 4.47 0.24 5.51 0.00 -1.26 -4.72 121.76 129.43 2r50 s ALA 114 Ca 0.44 -1.54 -0.06 0.00 0.00 0.00 0.00 51.96 50.80 2r50 s ALA 114 Cb -0.13 -0.94 0.44 0.00 0.00 0.00 0.00 23.12 22.49 2r50 s ALA 114 CO 0.12 -0.53 1.67 -0.44 0.00 0.00 0.00 175.76 176.58 2r50 h ASP 115 N 0.63 -0.09 -0.51 0.00 3.45 -2.00 -0.33 116.42 117.56 2r50 h ASP 115 Ca -0.35 0.16 0.08 0.00 0.43 0.00 0.00 57.03 57.34 2r50 h ASP 115 Cb 1.30 0.24 -0.06 0.00 -0.56 0.00 0.00 39.33 40.24 2r50 h ASP 115 CO 0.53 -0.08 0.17 1.23 -1.57 0.00 0.00 179.24 179.52 2r50 h GLY 116 N 0.21 0.68 1.02 2.75 0.00 -1.99 -1.33 103.07 104.41 2r50 h GLY 116 Ca 0.41 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.64 2r50 h GLY 116 CO -0.54 -0.01 0.44 0.45 0.00 0.00 0.00 176.54 176.87 2r50 h HIS 117 N 0.33 1.08 -0.39 5.60 3.86 -1.45 -0.56 115.15 123.63 2r50 h HIS 117 Ca 0.25 -0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.36 2r50 h HIS 117 Cb 0.29 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 2r50 h HIS 117 CO -0.18 0.75 -0.09 0.74 0.86 0.00 0.00 177.93 180.01 2r50 h PHE 118 N 1.10 0.73 -0.07 2.45 0.05 -0.99 -2.35 116.94 117.86 2r50 h PHE 118 Ca 0.28 -0.12 -0.07 0.00 3.82 0.00 0.00 57.97 61.88 2r50 h PHE 118 Cb 0.03 -0.19 0.00 0.00 2.00 0.00 0.00 35.95 37.78 2r50 h PHE 118 CO 0.00 0.74 -0.23 0.93 -0.18 0.00 0.00 178.31 179.57 2r50 h GLU 119 N 0.62 0.29 -0.88 1.51 5.08 -0.95 -0.66 114.58 119.58 2r50 h GLU 119 Ca 0.11 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2r50 h GLU 119 Cb 0.52 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 2r50 h GLU 119 CO 0.03 0.83 0.49 0.28 -1.00 0.00 0.00 179.01 179.64 2r50 h VAL 120 N -0.20 1.25 -0.67 3.13 2.07 -1.08 -0.90 116.25 119.85 2r50 h VAL 120 Ca -0.01 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 66.81 2r50 h VAL 120 Cb 0.85 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2r50 h VAL 120 CO 0.05 0.28 0.12 0.74 0.02 0.00 0.00 177.57 178.79 2r50 h THR 121 N 1.23 1.26 -0.70 2.57 2.02 -1.35 0.95 112.91 118.90 2r50 h THR 121 Ca 0.31 -1.02 -0.05 0.00 0.77 0.00 0.00 66.41 66.42 2r50 h THR 121 Cb 0.02 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 2r50 h THR 121 CO -0.05 0.38 0.23 1.23 0.37 0.00 0.00 175.52 177.68 2r50 h GLY 122 N 1.06 1.16 0.94 2.16 0.00 -0.48 0.33 103.07 108.24 2r50 h GLY 122 Ca 0.21 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2r50 h GLY 122 CO 0.01 0.64 0.08 -2.75 0.00 0.00 0.00 176.54 174.51 2r50 h PHE 123 N 1.02 0.19 -0.61 5.60 3.57 -0.86 -2.16 116.94 123.69 2r50 h PHE 123 Ca 0.23 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.73 2r50 h PHE 123 Cb 0.29 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 2r50 h PHE 123 CO 0.02 0.20 0.40 0.00 -2.23 0.00 0.00 178.31 176.70 2r50 h ALA 124 N 0.98 1.55 -0.03 2.41 0.00 -0.53 -2.15 119.26 121.50 2r50 h ALA 124 Ca 0.05 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2r50 h ALA 124 Cb 0.07 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2r50 h ALA 124 CO -0.01 0.41 -0.12 1.25 0.00 0.00 0.00 179.25 180.78 2r50 h LEU 125 N 0.83 -0.36 -0.60 0.00 5.85 0.23 0.55 115.31 121.81 2r50 h LEU 125 Ca 0.22 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.91 2r50 h LEU 125 Cb -0.08 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2r50 h LEU 125 CO -0.05 -0.17 0.02 -0.07 -0.34 0.00 0.00 178.44 177.83 2r50 h LEU 126 N -0.20 1.02 -1.28 2.25 3.38 -1.06 -1.38 115.31 118.04 2r50 h LEU 126 Ca 0.05 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 2r50 h LEU 126 Cb 0.27 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2r50 h LEU 126 CO -0.14 1.07 -0.36 -0.33 0.09 0.00 0.00 178.44 178.77 2r50 h GLU 127 N 0.94 0.00 0.00 1.13 5.08 -1.19 -1.82 114.58 118.72 2r50 h GLU 127 Ca 0.17 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.32 2r50 h GLU 127 Cb 0.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2r50 h GLU 127 CO 0.03 0.36 -0.91 1.15 -1.00 0.00 0.00 179.01 178.63 2r50 h THR 128 N 0.00 1.45 -0.43 1.13 2.02 -0.40 -2.42 112.91 114.25 2r50 h THR 128 Ca -0.00 -2.53 -0.06 0.00 0.77 0.00 0.00 66.41 64.58 2r50 h THR 128 Cb 0.65 2.44 -0.02 0.00 -1.74 0.00 0.00 68.15 69.49 2r50 h THR 128 CO 0.05 0.75 0.02 0.40 0.37 0.00 0.00 175.52 177.10 2r50 h ILE 129 N 0.17 1.26 0.93 3.11 1.08 -0.98 -1.71 117.51 121.38 2r50 h ILE 129 Ca -0.06 -1.00 -0.04 0.00 -0.39 0.00 0.00 64.86 63.36 2r50 h ILE 129 Cb 1.55 1.06 0.00 0.00 -3.07 0.00 0.00 36.82 36.36 2r50 h ILE 129 CO 0.15 0.34 -0.49 0.50 -0.69 0.00 0.00 178.15 177.97 2r50 h LYS 130 N 0.59 -1.25 -0.71 2.37 3.64 -1.32 0.16 116.57 120.06 2r50 h LYS 130 Ca 0.12 0.09 0.16 0.00 -1.27 0.00 0.00 60.65 59.75 2r50 h LYS 130 Cb 0.46 0.28 -0.12 0.00 -0.41 0.00 0.00 32.23 32.45 2r50 h LYS 130 CO 0.02 -0.83 0.05 0.93 -2.27 0.00 0.00 179.45 177.35 2r50 h GLU 131 N -1.30 0.14 0.00 1.90 5.08 -1.45 -3.02 114.58 115.93 2r50 h GLU 131 Ca -0.13 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 2r50 h GLU 131 Cb 1.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 2r50 h GLU 131 CO 0.18 0.10 -0.84 0.00 -1.00 0.00 0.00 179.01 177.45 2r50 h ALA 132 N 1.64 0.68 -2.36 3.43 0.00 -1.18 -3.47 119.26 117.99 2r50 h ALA 132 Ca 0.39 -0.42 -0.50 0.00 0.00 0.00 0.00 54.91 54.38 2r50 h ALA 132 Cb 0.67 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2r50 h ALA 132 CO -0.58 0.50 0.13 -1.17 0.00 0.00 0.00 179.25 178.13 2r50 s LEU 133 N -5.97 4.15 0.19 0.00 2.96 0.03 -4.99 118.68 115.06 2r50 s LEU 133 Ca 0.01 1.37 -0.33 0.00 -0.22 0.00 0.00 54.13 54.97 2r50 s LEU 133 Cb 0.08 -3.96 -0.13 0.00 0.50 0.00 0.00 46.19 42.68 2r50 s LEU 133 CO 0.77 -0.14 1.59 -2.65 -1.32 0.00 0.00 176.35 174.60 2r50 n PRO 134 N -0.01 2.33 -0.36 0.98 -0.02 -1.26 -4.83 135.00 131.82 2r50 n PRO 134 Ca 0.02 0.84 0.28 0.00 -2.02 0.00 0.00 63.50 62.61 2r50 n PRO 134 Cb 0.52 -2.61 0.57 0.00 -0.02 0.00 0.00 33.50 31.96 2r50 n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r50 h ALA 135 N 5.78 2.44 0.00 3.55 0.00 -1.94 0.14 119.26 129.23 2r50 h ALA 135 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2r50 h ALA 135 Cb 1.24 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2r50 h ALA 135 CO 0.88 -0.91 0.00 -0.40 0.00 0.00 0.00 179.25 178.81 2r50 n ASP 136 N -4.62 0.00 0.05 0.00 5.68 -1.26 -2.44 116.55 113.95 2r50 n ASP 136 Ca 0.29 0.32 0.07 0.00 -0.50 0.00 0.00 54.79 54.97 2r50 n ASP 136 Cb 1.07 -0.43 -0.07 0.00 -1.14 0.00 0.00 41.12 40.55 2r50 n ASP 136 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 2r50 n MET 137 N -1.43 0.63 -2.49 0.11 2.81 0.47 -4.94 117.12 112.27 2r50 n MET 137 Ca 0.08 0.06 -0.41 0.00 -1.81 0.00 0.00 57.70 55.62 2r50 n MET 137 Cb 0.26 -1.73 -0.04 0.00 -0.71 0.00 0.00 33.22 31.00 2r50 n MET 137 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 2r50 s TRP 138 N -3.24 3.56 0.31 2.03 -0.11 -1.02 -4.88 118.94 115.59 2r50 s TRP 138 Ca -0.04 1.55 -0.17 0.00 1.22 0.00 0.00 56.10 58.67 2r50 s TRP 138 Cb 0.10 -3.30 0.03 0.00 -1.50 0.00 0.00 33.47 28.80 2r50 s TRP 138 CO 0.83 -0.73 0.70 -1.54 -4.62 0.00 0.00 176.95 171.59 2r50 s SER 139 N 0.03 -0.09 0.34 5.86 1.04 -1.26 -5.01 113.70 114.60 2r50 s SER 139 Ca 0.51 -0.87 0.02 0.00 0.48 0.00 0.00 55.95 56.08 2r50 s SER 139 Cb -0.30 0.75 0.60 0.00 0.10 0.00 0.00 66.02 67.17 2r50 s SER 139 CO 0.35 -1.43 1.97 0.25 0.98 0.00 0.00 173.24 175.35 2r50 h LEU 140 N 2.04 0.72 -0.66 2.42 5.85 -1.99 -1.99 115.31 121.69 2r50 h LEU 140 Ca -0.25 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.34 2r50 h LEU 140 Cb 1.25 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 2r50 h LEU 140 CO 0.31 0.56 0.01 -0.33 -0.34 0.00 0.00 178.44 178.65 2r50 h GLU 141 N 0.82 1.05 -0.13 1.25 4.39 -1.98 -2.34 114.58 117.64 2r50 h GLU 141 Ca 0.21 -0.32 -0.21 0.00 0.34 0.00 0.00 59.36 59.38 2r50 h GLU 141 Cb -0.01 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 2r50 h GLU 141 CO -0.04 1.02 -0.75 1.98 -1.16 0.00 0.00 179.01 180.06 2r50 h MET 142 N 0.96 0.64 -0.31 2.33 4.05 -1.84 -2.59 114.93 118.18 2r50 h MET 142 Ca 0.17 -0.52 0.07 0.00 -0.28 0.00 0.00 59.70 59.15 2r50 h MET 142 Cb 0.54 0.11 -0.08 0.00 -0.80 0.00 0.00 31.60 31.37 2r50 h MET 142 CO 0.03 1.14 -0.22 -0.22 0.23 0.00 0.00 176.91 177.87 2r50 h LYS 143 N 0.44 -0.18 -0.49 0.39 3.64 -1.26 -2.25 116.57 116.86 2r50 h LYS 143 Ca -0.04 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2r50 h LYS 143 Cb 1.35 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 2r50 h LYS 143 CO 0.14 -0.12 0.18 0.87 -2.27 0.00 0.00 179.45 178.26 2r50 h LYS 144 N -0.19 0.71 -0.28 1.90 1.57 -1.37 -1.32 116.57 117.59 2r50 h LYS 144 Ca 0.16 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2r50 h LYS 144 Cb 0.43 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2r50 h LYS 144 CO -0.42 0.60 0.02 0.00 -0.57 0.00 0.00 179.45 179.08 2r50 h ALA 145 N 1.50 0.38 -0.22 3.86 0.00 -1.03 -1.48 119.26 122.27 2r50 h ALA 145 Ca 0.17 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2r50 h ALA 145 Cb 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2r50 h ALA 145 CO -0.01 0.09 -0.40 -1.49 0.00 0.00 0.00 179.25 177.44 2r50 h TRP 146 N 0.28 0.59 -0.45 0.00 4.06 -1.26 -2.81 115.95 116.36 2r50 h TRP 146 Ca 0.08 -0.17 -0.11 0.00 2.06 0.00 0.00 58.89 60.76 2r50 h TRP 146 Cb 0.38 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 28.40 2r50 h TRP 146 CO 0.03 0.82 -0.15 0.00 -3.56 0.00 0.00 178.44 175.59 2r50 h ALA 147 N 1.16 0.89 0.44 1.49 0.00 -1.11 -2.31 119.26 119.81 2r50 h ALA 147 Ca 0.04 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 2r50 h ALA 147 Cb 0.88 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2r50 h ALA 147 CO 0.07 0.63 -0.21 0.93 0.00 0.00 0.00 179.25 180.67 2r50 h GLU 148 N 0.75 -0.57 -0.82 0.00 4.39 -1.23 -1.68 114.58 115.41 2r50 h GLU 148 Ca 0.12 0.04 0.17 0.00 0.34 0.00 0.00 59.36 60.03 2r50 h GLU 148 Cb 0.66 0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 29.33 2r50 h GLU 148 CO 0.05 -0.33 0.34 0.00 -1.16 0.00 0.00 179.01 177.91 2r50 h ALA 149 N -1.00 1.22 -0.03 3.43 0.00 -1.55 -0.91 119.26 120.41 2r50 h ALA 149 Ca -0.06 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2r50 h ALA 149 Cb 0.51 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2r50 h ALA 149 CO 0.10 -0.26 0.00 -0.92 0.00 0.00 0.00 179.25 178.18 2r50 h TYR 150 N 0.43 0.06 -0.86 0.00 3.20 -1.46 -1.67 116.97 116.66 2r50 h TYR 150 Ca 0.48 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.45 2r50 h TYR 150 Cb 0.81 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 39.00 2r50 h TYR 150 CO -0.16 0.32 0.56 0.66 -1.64 0.00 0.00 178.16 177.90 2r50 h SER 151 N -0.22 0.70 0.51 -2.11 4.64 -0.90 -0.41 113.55 115.77 2r50 h SER 151 Ca 0.01 0.03 -0.20 0.00 -0.47 0.00 0.00 61.79 61.16 2r50 h SER 151 Cb 0.29 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2r50 h SER 151 CO 0.00 0.39 -0.86 1.56 -0.87 0.00 0.00 176.83 177.05 2r50 h GLN 152 N 0.76 0.24 -0.54 4.77 1.08 -1.07 -0.73 115.11 119.63 2r50 h GLN 152 Ca 0.41 -0.25 -0.06 0.00 -1.45 0.00 0.00 58.65 57.30 2r50 h GLN 152 Cb 0.55 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.03 2r50 h GLN 152 CO -0.18 0.97 0.09 1.25 -0.95 0.00 0.00 178.83 180.01 2r50 h LEU 153 N 0.14 0.86 -0.79 1.46 5.85 -0.74 -2.79 115.31 119.30 2r50 h LEU 153 Ca -0.05 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.31 2r50 h LEU 153 Cb 1.48 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 2r50 h LEU 153 CO 0.14 0.90 -0.18 0.58 -0.34 0.00 0.00 178.44 179.54 2r50 h VAL 154 N 0.78 1.26 -0.54 1.05 2.07 -0.88 -2.35 116.25 117.64 2r50 h VAL 154 Ca 0.17 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 2r50 h VAL 154 Cb 0.40 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 2r50 h VAL 154 CO 0.01 0.42 0.29 0.00 0.02 0.00 0.00 177.57 178.31 2r50 h ALA 155 N 1.16 0.69 -0.65 1.67 0.00 -1.04 -0.30 119.26 120.79 2r50 h ALA 155 Ca 0.10 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2r50 h ALA 155 Cb 0.65 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2r50 h ALA 155 CO 0.05 0.21 0.22 0.00 0.00 0.00 0.00 179.25 179.73 2r50 h ALA 156 N 1.13 1.16 -0.23 0.00 0.00 -1.36 -2.12 119.26 117.84 2r50 h ALA 156 Ca 0.19 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2r50 h ALA 156 Cb 0.05 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2r50 h ALA 156 CO -0.03 0.59 -0.35 0.82 0.00 0.00 0.00 179.25 180.28 2r50 h ILE 157 N 0.95 1.32 -0.10 0.00 2.04 -1.17 -2.89 117.51 117.66 2r50 h ILE 157 Ca 0.21 -1.55 0.03 0.00 1.00 0.00 0.00 64.86 64.55 2r50 h ILE 157 Cb 0.25 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2r50 h ILE 157 CO -0.01 0.49 0.07 0.11 0.00 0.00 0.00 178.15 178.81 2r50 h LYS 158 N 0.33 0.00 0.00 2.37 1.57 -0.96 -1.82 116.57 118.06 2r50 h LYS 158 Ca 0.02 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2r50 h LYS 158 Cb 0.94 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 2r50 h LYS 158 CO 0.08 0.00 -0.19 -0.09 -0.57 0.00 0.00 179.45 178.68 2r50 h ARG 159 N 0.00 0.00 -0.62 3.15 9.65 -1.16 -2.08 114.38 123.32 2r50 h ARG 159 Ca 0.05 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 2r50 h ARG 159 Cb 0.19 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.77 2r50 h ARG 159 CO -0.00 0.19 0.00 0.39 2.80 0.00 0.00 179.97 183.35 2r50 n GLU 160 N -4.04 2.68 -0.16 0.20 -0.58 -0.69 -3.95 120.64 114.09 2r50 n GLU 160 Ca -0.02 -2.24 0.06 0.00 -0.42 0.00 0.00 57.16 54.53 2r50 n GLU 160 Cb 0.27 -1.57 0.15 0.00 -0.57 0.00 0.00 31.44 29.71 2r50 n GLU 160 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 2r50 n MET 161 N 1.16 2.71 -4.10 3.49 2.81 -0.78 -4.25 117.12 118.16 2r50 n MET 161 Ca 0.21 -1.99 -0.09 0.00 -1.81 0.00 0.00 57.70 54.01 2r50 n MET 161 Cb 0.59 -1.27 -0.09 0.00 -0.71 0.00 0.00 33.22 31.74 2r50 n MET 161 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2r50 s LYS 162 N -1.00 0.96 0.66 0.03 1.02 -1.23 -5.02 119.74 115.16 2r50 s LYS 162 Ca 0.23 -1.36 -0.17 0.00 0.02 0.00 0.00 55.97 54.69 2r50 s LYS 162 Cb 0.12 0.27 -0.03 0.00 -0.52 0.00 0.00 37.83 37.68 2r50 s LYS 162 CO 0.16 -0.29 0.95 -2.30 -0.92 0.00 0.00 175.35 172.95 2r50 n PRO 163 N -0.11 0.72 0.21 -1.68 -0.02 -1.26 -4.86 135.00 127.99 2r50 n PRO 163 Ca -0.07 0.29 0.15 0.00 -2.02 0.00 0.00 63.50 61.85 2r50 n PRO 163 Cb 0.63 -2.19 0.54 0.00 -0.02 0.00 0.00 33.50 32.47 2r50 n PRO 163 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2r50 h ASP 164 N 0.15 0.00 -0.02 2.55 3.58 -2.00 -3.49 116.42 117.18 2r50 h ASP 164 Ca -0.48 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.97 2r50 h ASP 164 Cb 1.35 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.40 2r50 h ASP 164 CO 0.49 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.85