#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bd3 h GLU 22 N 0.00 0.11 -0.24 3.69 4.81 -1.97 0.43 114.58 121.40 1bd3 h GLU 22 Ca 0.00 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.23 1bd3 h GLU 22 Cb 0.00 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.32 1bd3 h GLU 22 CO 0.00 0.60 -0.19 1.49 -0.73 0.00 0.00 179.01 180.17 1bd3 h GLU 23 N -0.37 -0.18 -0.51 1.92 4.57 -1.99 1.76 114.58 119.77 1bd3 h GLU 23 Ca 0.01 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.21 1bd3 h GLU 23 Cb 0.58 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.18 1bd3 h GLU 23 CO 0.01 -0.12 0.32 0.77 -1.18 0.00 0.00 179.01 178.81 1bd3 h SER 24 N -0.19 0.54 -0.16 1.04 0.02 -1.98 0.26 113.55 113.07 1bd3 h SER 24 Ca 0.14 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1bd3 h SER 24 Cb 0.40 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1bd3 h SER 24 CO -0.36 0.39 0.07 0.40 -1.14 0.00 0.00 176.83 176.18 1bd3 h ILE 25 N 0.65 1.15 -0.10 3.27 1.08 0.64 -1.14 117.51 123.06 1bd3 h ILE 25 Ca 0.20 -0.46 0.04 0.00 -0.39 0.00 0.00 64.86 64.25 1bd3 h ILE 25 Cb -0.02 1.16 -0.05 0.00 -3.07 0.00 0.00 36.82 34.83 1bd3 h ILE 25 CO -0.07 0.14 -0.23 -0.07 -0.69 0.00 0.00 178.15 177.24 1bd3 h LEU 26 N 0.11 -0.69 -0.77 1.44 4.07 0.32 -1.70 115.31 118.09 1bd3 h LEU 26 Ca 0.05 0.11 0.00 0.00 0.08 0.00 0.00 57.88 58.13 1bd3 h LEU 26 Cb 0.17 0.30 -0.04 0.00 1.08 0.00 0.00 40.66 42.17 1bd3 h LEU 26 CO -0.00 -0.28 0.49 -0.61 -1.08 0.00 0.00 178.44 176.96 1bd3 h GLN 27 N -0.30 1.03 -0.75 1.13 5.75 -0.39 -1.14 115.11 120.43 1bd3 h GLN 27 Ca 0.09 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 1bd3 h GLN 27 Cb 0.44 -0.23 -0.04 0.00 1.07 0.00 0.00 27.48 28.72 1bd3 h GLN 27 CO -0.27 0.70 0.44 0.22 -2.65 0.00 0.00 178.83 177.27 1bd3 h ASP 28 N 1.05 0.92 0.11 -0.69 1.82 -0.90 0.73 116.42 119.46 1bd3 h ASP 28 Ca 0.28 -0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.84 1bd3 h ASP 28 Cb -0.09 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 39.69 1bd3 h ASP 28 CO -0.06 0.72 -0.05 0.40 -1.61 0.00 0.00 179.24 178.64 1bd3 h ILE 29 N 1.03 0.92 -0.55 2.25 1.08 -0.94 0.15 117.51 121.45 1bd3 h ILE 29 Ca 0.27 -0.12 0.06 0.00 -0.39 0.00 0.00 64.86 64.68 1bd3 h ILE 29 Cb -0.01 1.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.69 1bd3 h ILE 29 CO -0.05 0.03 0.27 0.40 -0.69 0.00 0.00 178.15 178.11 1bd3 h ILE 30 N -0.20 0.91 -0.14 -0.67 2.04 -0.50 0.20 117.51 119.15 1bd3 h ILE 30 Ca -0.02 -0.17 -0.18 0.00 1.00 0.00 0.00 64.86 65.49 1bd3 h ILE 30 Cb 0.16 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1bd3 h ILE 30 CO 0.02 0.09 -0.66 0.00 0.00 0.00 0.00 178.15 177.61 1bd3 h THR 31 N 0.50 1.33 -0.25 -0.27 1.03 0.71 -3.31 112.91 112.65 1bd3 h THR 31 Ca 0.25 -1.96 -0.16 0.00 -0.01 0.00 0.00 66.41 64.53 1bd3 h THR 31 Cb 0.20 1.93 -0.00 0.00 -1.07 0.00 0.00 68.15 69.21 1bd3 h THR 31 CO -0.20 0.60 -0.51 0.03 -0.01 0.00 0.00 175.52 175.44 1bd3 h ARG 32 N 0.40 0.70 -3.43 0.00 3.08 -0.26 -3.40 114.38 111.47 1bd3 h ARG 32 Ca -0.02 -0.42 -0.64 0.00 0.07 0.00 0.00 59.98 58.97 1bd3 h ARG 32 Cb 1.23 0.04 -0.41 0.00 0.08 0.00 0.00 29.97 30.92 1bd3 h ARG 32 CO 0.12 1.04 -0.64 -0.06 -1.07 0.00 0.00 179.97 179.37 1bd3 s PHE 33 N -4.12 3.17 0.00 3.04 0.08 0.68 -4.95 117.98 115.88 1bd3 s PHE 33 Ca -0.09 -3.15 0.22 0.00 0.12 0.00 0.00 56.93 54.03 1bd3 s PHE 33 Cb 0.11 -2.80 1.21 0.00 -0.57 0.00 0.00 43.02 40.97 1bd3 s PHE 33 CO 0.86 -0.75 1.65 -1.00 -0.10 0.00 0.00 175.22 175.88 1bd3 h PRO 34 N 6.55 0.00 -0.15 0.24 0.13 -1.80 -1.70 132.00 135.26 1bd3 h PRO 34 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1bd3 h PRO 34 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1bd3 h PRO 34 CO 0.68 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.54 1bd3 n ASN 35 N -2.32 1.99 -4.79 1.44 3.02 -1.26 -4.85 115.26 108.48 1bd3 n ASN 35 Ca -0.01 -1.73 -0.36 0.00 -0.03 0.00 0.00 54.58 52.45 1bd3 n ASN 35 Cb 0.14 -0.09 -0.08 0.00 -0.61 0.00 0.00 39.78 39.14 1bd3 n ASN 35 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1bd3 s VAL 36 N -1.81 4.99 -0.15 2.41 -7.23 -0.64 -1.63 120.40 116.34 1bd3 s VAL 36 Ca 0.34 0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.53 1bd3 s VAL 36 Cb 0.19 -3.15 -0.00 0.00 0.56 0.00 0.00 36.38 33.98 1bd3 s VAL 36 CO 0.29 0.60 -0.15 0.54 -0.31 0.00 0.00 175.10 176.07 1bd3 s VAL 37 N -0.89 2.68 -0.20 1.32 0.11 0.11 -4.95 120.40 118.58 1bd3 s VAL 37 Ca 0.14 -0.77 -0.09 0.00 -2.93 0.00 0.00 61.98 58.33 1bd3 s VAL 37 Cb -0.12 -2.13 -0.05 0.00 -1.53 0.00 0.00 36.38 32.56 1bd3 s VAL 37 CO 0.03 0.52 0.11 -0.22 -3.33 0.00 0.00 175.10 172.20 1bd3 s LEU 38 N 0.76 4.00 0.50 2.54 2.96 -1.26 -1.74 118.68 126.44 1bd3 s LEU 38 Ca -0.06 0.13 -0.23 0.00 -0.22 0.00 0.00 54.13 53.75 1bd3 s LEU 38 Cb -0.15 -2.04 -0.06 0.00 0.50 0.00 0.00 46.19 44.44 1bd3 s LEU 38 CO 0.01 0.15 1.38 -0.04 -1.32 0.00 0.00 176.35 176.53 1bd3 s MET 39 N 0.54 3.40 0.20 1.98 -1.94 -0.78 -4.87 119.30 117.83 1bd3 s MET 39 Ca 0.06 2.31 -0.32 0.00 -1.71 0.00 0.00 55.69 56.02 1bd3 s MET 39 Cb -0.12 -2.44 -0.13 0.00 2.01 0.00 0.00 34.83 34.15 1bd3 s MET 39 CO 0.00 -1.01 1.58 0.36 -0.01 0.00 0.00 175.02 175.94 1bd3 n LYS 40 N -0.64 2.33 -1.97 2.03 2.85 -1.26 -4.84 118.16 116.65 1bd3 n LYS 40 Ca 0.08 0.84 -0.42 0.00 -1.05 0.00 0.00 58.31 57.76 1bd3 n LYS 40 Cb 0.44 -2.60 0.00 0.00 -0.65 0.00 0.00 35.03 32.21 1bd3 n LYS 40 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1bd3 n GLN 41 N 3.10 3.12 -1.78 -1.58 1.13 -1.26 -4.92 117.38 115.19 1bd3 n GLN 41 Ca 0.15 -2.94 -0.30 0.00 -1.94 0.00 0.00 57.00 51.96 1bd3 n GLN 41 Cb 0.32 -3.17 0.04 0.00 0.11 0.00 0.00 30.24 27.54 1bd3 n GLN 41 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1bd3 s THR 42 N 2.29 3.82 0.30 5.09 -4.23 -1.26 -4.89 115.64 116.75 1bd3 s THR 42 Ca 0.45 0.59 0.00 0.00 -1.18 0.00 0.00 61.69 61.55 1bd3 s THR 42 Cb 0.12 -3.50 0.16 0.00 1.34 0.00 0.00 72.50 70.61 1bd3 s THR 42 CO -0.05 -0.77 1.84 0.00 -0.54 0.00 0.00 174.62 175.10 1bd3 h ALA 43 N -0.65 1.27 -0.44 3.99 0.00 -1.99 -1.65 119.26 119.79 1bd3 h ALA 43 Ca -0.45 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.23 1bd3 h ALA 43 Cb 1.23 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1bd3 h ALA 43 CO 0.62 0.51 0.14 1.96 0.00 0.00 0.00 179.25 182.47 1bd3 h GLN 44 N 0.72 0.68 -0.27 0.00 1.08 -1.99 0.21 115.11 115.54 1bd3 h GLN 44 Ca 0.16 -0.14 0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1bd3 h GLN 44 Cb 0.30 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.60 1bd3 h GLN 44 CO 0.00 0.66 0.11 1.25 -0.95 0.00 0.00 178.83 179.89 1bd3 h LEU 45 N 0.57 0.13 -0.81 1.46 5.85 -1.81 0.11 115.31 120.81 1bd3 h LEU 45 Ca 0.14 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1bd3 h LEU 45 Cb 0.26 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1bd3 h LEU 45 CO -0.01 0.11 0.51 0.03 -0.34 0.00 0.00 178.44 178.75 1bd3 h ARG 46 N 0.23 0.96 -0.97 1.25 3.08 -0.95 0.46 114.38 118.44 1bd3 h ARG 46 Ca 0.12 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.11 1bd3 h ARG 46 Cb 0.07 -0.22 -0.05 0.00 0.08 0.00 0.00 29.97 29.86 1bd3 h ARG 46 CO -0.11 0.64 0.63 0.00 -1.07 0.00 0.00 179.97 180.06 1bd3 h ALA 47 N 1.34 1.23 -0.40 0.04 0.00 0.64 0.12 119.26 122.24 1bd3 h ALA 47 Ca 0.33 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1bd3 h ALA 47 Cb 0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1bd3 h ALA 47 CO -0.12 0.64 -0.08 0.52 0.00 0.00 0.00 179.25 180.21 1bd3 h MET 48 N 1.32 0.76 -0.60 0.00 2.86 0.23 -2.79 114.93 116.71 1bd3 h MET 48 Ca 0.35 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 1bd3 h MET 48 Cb -0.13 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 1bd3 h MET 48 CO -0.07 0.89 0.31 0.52 1.06 0.00 0.00 176.91 179.61 1bd3 h MET 49 N 0.57 0.83 -0.57 1.72 2.07 -0.20 -1.35 114.93 118.00 1bd3 h MET 49 Ca 0.10 -0.09 -0.11 0.00 -2.07 0.00 0.00 59.70 57.53 1bd3 h MET 49 Cb 0.60 -0.17 -0.02 0.00 -1.87 0.00 0.00 31.60 30.15 1bd3 h MET 49 CO 0.04 0.63 -0.06 1.79 1.07 0.00 0.00 176.91 180.38 1bd3 h THR 50 N 0.84 1.27 0.19 2.22 1.35 -0.81 0.34 112.91 118.30 1bd3 h THR 50 Ca 0.21 -1.21 -0.01 0.00 -0.55 0.00 0.00 66.41 64.85 1bd3 h THR 50 Cb 0.05 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 67.36 1bd3 h THR 50 CO -0.03 0.43 -0.09 0.40 -0.25 0.00 0.00 175.52 175.98 1bd3 h ILE 51 N 0.93 0.89 -0.99 6.82 2.04 -1.20 -1.29 117.51 124.71 1bd3 h ILE 51 Ca 0.15 -0.39 0.08 0.00 1.00 0.00 0.00 64.86 65.70 1bd3 h ILE 51 Cb 0.62 1.12 -0.07 0.00 -0.74 0.00 0.00 36.82 37.75 1bd3 h ILE 51 CO 0.04 0.09 0.64 0.40 0.00 0.00 0.00 178.15 179.32 1bd3 h ILE 52 N -0.45 1.05 0.00 -0.67 1.08 -1.14 -2.72 117.51 114.67 1bd3 h ILE 52 Ca -0.03 -0.38 -0.18 0.00 -0.39 0.00 0.00 64.86 63.88 1bd3 h ILE 52 Cb 0.34 -0.17 -0.02 0.00 -3.07 0.00 0.00 36.82 33.90 1bd3 h ILE 52 CO 0.04 0.20 -0.83 0.03 -0.69 0.00 0.00 178.15 176.90 1bd3 h ARG 53 N 1.12 0.01 -6.29 2.37 3.08 -0.81 -3.45 114.38 110.41 1bd3 h ARG 53 Ca 0.44 -0.01 -0.58 0.00 0.07 0.00 0.00 59.98 59.90 1bd3 h ARG 53 Cb 0.23 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.30 1bd3 h ARG 53 CO -0.18 0.84 1.18 -3.47 -1.07 0.00 0.00 179.97 177.27 1bd3 n ASP 54 N -3.56 3.72 -0.33 7.04 -0.08 -0.50 -4.85 116.55 117.99 1bd3 n ASP 54 Ca -0.01 0.89 0.08 0.00 -1.51 0.00 0.00 54.79 54.25 1bd3 n ASP 54 Cb 0.80 -1.44 0.25 0.00 2.34 0.00 0.00 41.12 43.07 1bd3 n ASP 54 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1bd3 h LYS 55 N 10.16 0.78 0.00 -0.67 1.57 -1.87 -1.43 116.57 125.11 1bd3 h LYS 55 Ca -0.48 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1bd3 h LYS 55 Cb 1.26 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1bd3 h LYS 55 CO 0.95 0.52 0.00 -1.91 -0.57 0.00 0.00 179.45 178.44 1bd3 n GLU 56 N -4.74 0.08 -2.04 3.15 4.07 -1.26 -4.81 120.64 115.08 1bd3 n GLU 56 Ca 0.19 0.44 -0.42 0.00 -0.06 0.00 0.00 57.16 57.31 1bd3 n GLU 56 Cb 0.43 -1.69 -0.03 0.00 -0.06 0.00 0.00 31.44 30.10 1bd3 n GLU 56 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1bd3 s THR 57 N -3.19 3.35 0.59 6.31 2.01 -0.54 -4.98 115.64 119.19 1bd3 s THR 57 Ca 0.02 0.72 -0.18 0.00 0.31 0.00 0.00 61.69 62.56 1bd3 s THR 57 Cb 0.06 -3.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 1bd3 s THR 57 CO 0.21 -0.01 1.15 -2.16 -0.69 0.00 0.00 174.62 173.11 1bd3 s PRO 58 N 2.82 3.06 0.25 4.92 0.04 -1.26 -4.76 135.00 140.07 1bd3 s PRO 58 Ca 0.71 1.63 -0.03 0.00 0.04 0.00 0.00 61.00 63.35 1bd3 s PRO 58 Cb -0.36 -1.96 0.46 0.00 0.04 0.00 0.00 34.50 32.68 1bd3 s PRO 58 CO 0.30 -1.09 1.78 1.57 0.04 0.00 0.00 177.00 179.60 1bd3 h LYS 59 N 0.78 0.64 -0.63 4.56 2.10 -1.93 0.15 116.57 122.24 1bd3 h LYS 59 Ca -0.49 -0.04 -0.06 0.00 -2.00 0.00 0.00 60.65 58.06 1bd3 h LYS 59 Cb 1.27 -0.14 -0.03 0.00 -0.90 0.00 0.00 32.23 32.43 1bd3 h LYS 59 CO 0.55 0.42 0.17 1.05 -2.00 0.00 0.00 179.45 179.64 1bd3 h GLU 60 N 0.66 0.97 -0.23 0.07 9.09 -1.97 -1.45 114.58 121.73 1bd3 h GLU 60 Ca 0.43 -0.21 -0.08 0.00 0.05 0.00 0.00 59.36 59.54 1bd3 h GLU 60 Cb 0.53 -0.14 -0.00 0.00 -1.65 0.00 0.00 28.75 27.48 1bd3 h GLU 60 CO -0.32 0.85 -0.19 0.93 0.05 0.00 0.00 179.01 180.34 1bd3 h GLU 61 N 0.93 0.54 -0.58 1.06 4.39 -1.72 -1.83 114.58 117.38 1bd3 h GLU 61 Ca 0.20 -0.27 0.09 0.00 0.34 0.00 0.00 59.36 59.73 1bd3 h GLU 61 Cb 0.31 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.89 1bd3 h GLU 61 CO -0.00 0.84 0.19 0.35 -1.16 0.00 0.00 179.01 179.23 1bd3 h PHE 62 N 0.24 0.32 -0.37 4.33 3.04 -0.68 -0.61 116.94 123.21 1bd3 h PHE 62 Ca 0.04 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.99 1bd3 h PHE 62 Cb 0.72 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 39.16 1bd3 h PHE 62 CO 0.07 0.06 0.10 0.28 -2.02 0.00 0.00 178.31 176.81 1bd3 h VAL 63 N 0.35 1.22 0.23 1.41 2.07 -1.19 0.43 116.25 120.77 1bd3 h VAL 63 Ca 0.29 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1bd3 h VAL 63 Cb 0.37 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1bd3 h VAL 63 CO -0.32 0.25 -0.21 0.15 0.02 0.00 0.00 177.57 177.46 1bd3 h PHE 64 N 0.45 -0.56 -0.33 1.57 3.57 -0.50 0.10 116.94 121.24 1bd3 h PHE 64 Ca 0.12 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.49 1bd3 h PHE 64 Cb 0.28 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1bd3 h PHE 64 CO 0.01 -0.32 -0.31 1.88 -2.23 0.00 0.00 178.31 177.34 1bd3 h TYR 65 N -0.47 0.81 -0.49 0.41 0.05 -1.12 -1.45 116.97 114.71 1bd3 h TYR 65 Ca -0.01 -0.21 0.00 0.00 0.05 0.00 0.00 58.73 58.57 1bd3 h TYR 65 Cb 0.43 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 1bd3 h TYR 65 CO -0.15 0.92 0.32 0.00 -1.05 0.00 0.00 178.16 178.20 1bd3 h ALA 66 N 1.06 0.63 -0.92 3.88 0.00 -0.74 0.10 119.26 123.27 1bd3 h ALA 66 Ca 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bd3 h ALA 66 Cb 0.82 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1bd3 h ALA 66 CO 0.07 0.09 0.52 -0.44 0.00 0.00 0.00 179.25 179.48 1bd3 h ASP 67 N 0.66 1.14 -0.27 0.00 3.32 -0.55 -0.74 116.42 119.98 1bd3 h ASP 67 Ca 0.18 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1bd3 h ASP 67 Cb -0.05 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 1bd3 h ASP 67 CO -0.04 0.90 0.09 -0.09 -1.72 0.00 0.00 179.24 178.39 1bd3 h ARG 68 N 1.28 0.42 -0.70 3.56 2.43 -0.48 -2.72 114.38 118.17 1bd3 h ARG 68 Ca 0.33 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1bd3 h ARG 68 Cb 0.01 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 1bd3 h ARG 68 CO -0.05 0.47 0.17 1.25 -1.51 0.00 0.00 179.97 180.30 1bd3 h LEU 69 N 0.28 1.07 -1.16 3.80 5.85 -0.77 -2.98 115.31 121.40 1bd3 h LEU 69 Ca 0.09 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1bd3 h LEU 69 Cb 0.22 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 1bd3 h LEU 69 CO -0.00 1.02 0.57 0.40 -0.34 0.00 0.00 178.44 180.09 1bd3 h ILE 70 N 1.06 1.18 -0.58 4.05 2.04 -0.98 -1.10 117.51 123.19 1bd3 h ILE 70 Ca 0.22 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1bd3 h ILE 70 Cb 0.37 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 1bd3 h ILE 70 CO 0.00 0.20 0.28 -0.09 0.00 0.00 0.00 178.15 178.55 1bd3 h ARG 71 N 1.12 0.83 -0.71 2.37 2.43 -1.33 0.15 114.38 119.24 1bd3 h ARG 71 Ca 0.33 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1bd3 h ARG 71 Cb -0.06 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.31 1bd3 h ARG 71 CO -0.08 0.67 0.38 -0.07 -1.51 0.00 0.00 179.97 179.36 1bd3 h LEU 72 N 0.78 0.90 -0.35 3.80 3.38 -1.33 -0.48 115.31 122.00 1bd3 h LEU 72 Ca 0.20 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1bd3 h LEU 72 Cb 0.12 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1bd3 h LEU 72 CO -0.03 0.74 0.22 0.25 0.09 0.00 0.00 178.44 179.72 1bd3 h LEU 73 N 0.98 0.37 -0.75 1.67 5.85 -0.70 -1.00 115.31 121.73 1bd3 h LEU 73 Ca 0.25 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.90 1bd3 h LEU 73 Cb 0.05 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1bd3 h LEU 73 CO -0.04 0.27 0.23 0.40 -0.34 0.00 0.00 178.44 178.96 1bd3 h ILE 74 N 0.45 1.26 -0.74 4.05 1.08 -0.26 -1.41 117.51 121.95 1bd3 h ILE 74 Ca 0.14 -0.92 -0.02 0.00 -0.39 0.00 0.00 64.86 63.66 1bd3 h ILE 74 Cb -0.02 0.44 -0.03 0.00 -3.07 0.00 0.00 36.82 34.13 1bd3 h ILE 74 CO -0.05 0.36 0.36 -0.33 -0.69 0.00 0.00 178.15 177.81 1bd3 h GLU 75 N 1.12 1.05 -0.01 2.37 4.39 -0.64 -1.49 114.58 121.36 1bd3 h GLU 75 Ca 0.24 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 1bd3 h GLU 75 Cb 0.32 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1bd3 h GLU 75 CO -0.01 0.80 0.00 1.49 -1.16 0.00 0.00 179.01 180.14 1bd3 h GLU 76 N 1.04 0.01 -0.58 2.33 4.57 -0.66 -3.06 114.58 118.24 1bd3 h GLU 76 Ca 0.26 -0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.46 1bd3 h GLU 76 Cb 0.09 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1bd3 h GLU 76 CO -0.03 0.20 0.38 0.00 -1.18 0.00 0.00 179.01 178.38 1bd3 h ALA 77 N 0.81 1.68 0.00 2.92 0.00 -0.96 -0.99 119.26 122.72 1bd3 h ALA 77 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1bd3 h ALA 77 Cb 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1bd3 h ALA 77 CO -0.00 0.26 0.00 -0.07 0.00 0.00 0.00 179.25 179.44 1bd3 h LEU 78 N 0.70 0.00 -0.20 0.00 3.38 -1.17 0.85 115.31 118.86 1bd3 h LEU 78 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1bd3 h LEU 78 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1bd3 h LEU 78 CO -0.06 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.06 1bd3 n ASN 79 N -3.02 0.22 -0.01 -0.43 4.13 -0.38 -2.18 115.26 113.60 1bd3 n ASN 79 Ca -0.03 0.55 0.14 0.00 1.68 0.00 0.00 54.58 56.93 1bd3 n ASN 79 Cb 0.08 -0.60 0.65 0.00 -1.54 0.00 0.00 39.78 38.37 1bd3 n ASN 79 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1bd3 n GLU 80 N -1.74 0.21 -1.72 3.52 -0.58 0.29 -4.84 120.64 115.79 1bd3 n GLU 80 Ca 0.03 -0.02 -0.30 0.00 -0.42 0.00 0.00 57.16 56.46 1bd3 n GLU 80 Cb 0.21 -1.50 0.08 0.00 -0.57 0.00 0.00 31.44 29.66 1bd3 n GLU 80 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1bd3 s LEU 81 N -2.80 2.61 0.24 -4.62 2.01 -0.93 -5.04 118.68 110.16 1bd3 s LEU 81 Ca 0.20 1.12 -0.18 0.00 0.01 0.00 0.00 54.13 55.28 1bd3 s LEU 81 Cb 0.19 -3.74 -0.08 0.00 0.01 0.00 0.00 46.19 42.57 1bd3 s LEU 81 CO 0.51 -1.82 0.71 -2.16 1.01 0.00 0.00 176.35 174.61 1bd3 s PRO 82 N -5.31 4.19 0.08 1.29 0.05 -1.26 -5.09 135.00 128.95 1bd3 s PRO 82 Ca 0.60 0.80 -0.03 0.00 0.05 0.00 0.00 61.00 62.43 1bd3 s PRO 82 Cb -0.13 -2.80 -0.03 0.00 0.05 0.00 0.00 34.50 31.59 1bd3 s PRO 82 CO 0.52 0.36 0.04 -0.59 0.05 0.00 0.00 177.00 177.38 1bd3 s PHE 83 N -1.61 0.52 0.25 0.56 -0.12 -1.26 -4.20 117.98 112.12 1bd3 s PHE 83 Ca 0.45 -1.00 0.11 0.00 -0.05 0.00 0.00 56.93 56.43 1bd3 s PHE 83 Cb -0.15 -0.33 -0.05 0.00 -0.63 0.00 0.00 43.02 41.85 1bd3 s PHE 83 CO 0.20 -0.45 -0.19 -1.14 -0.05 0.00 0.00 175.22 173.59 1bd3 s GLN 84 N -3.94 1.58 0.44 1.99 2.00 0.08 -4.93 119.66 116.89 1bd3 s GLN 84 Ca 0.11 -1.70 -0.22 0.00 -2.00 0.00 0.00 55.36 51.54 1bd3 s GLN 84 Cb 0.07 -1.63 -0.09 0.00 0.80 0.00 0.00 33.01 32.16 1bd3 s GLN 84 CO -0.07 0.30 1.04 0.21 -0.50 0.00 0.00 175.29 176.27 1bd3 s LYS 85 N -3.45 3.99 -0.12 1.67 2.36 -1.26 -0.39 119.74 122.54 1bd3 s LYS 85 Ca 0.27 1.43 -0.08 0.00 -2.55 0.00 0.00 55.97 55.05 1bd3 s LYS 85 Cb -0.04 -2.32 0.04 0.00 -1.05 0.00 0.00 37.83 34.45 1bd3 s LYS 85 CO 0.13 -0.28 0.29 0.21 1.55 0.00 0.00 175.35 177.25 1bd3 s LYS 86 N -2.86 0.29 -0.04 4.03 2.20 0.58 -4.70 119.74 119.24 1bd3 s LYS 86 Ca 0.62 0.50 0.06 0.00 -0.36 0.00 0.00 55.97 56.79 1bd3 s LYS 86 Cb -0.19 0.03 -0.02 0.00 -1.51 0.00 0.00 37.83 36.14 1bd3 s LYS 86 CO 0.24 -0.10 -0.20 -2.00 -0.36 0.00 0.00 175.35 172.92 1bd3 s GLU 87 N 0.75 2.35 0.24 4.03 2.12 -1.26 0.21 118.70 127.13 1bd3 s GLU 87 Ca -0.05 -0.81 0.00 0.00 0.36 0.00 0.00 54.97 54.47 1bd3 s GLU 87 Cb -0.06 -2.22 -0.05 0.00 0.26 0.00 0.00 34.13 32.06 1bd3 s GLU 87 CO -0.05 0.57 0.11 0.14 -0.54 0.00 0.00 175.26 175.49 1bd3 s VAL 88 N -0.62 0.37 -0.14 3.70 -7.23 0.13 -4.94 120.40 111.68 1bd3 s VAL 88 Ca 0.09 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.26 1bd3 s VAL 88 Cb -0.11 -2.59 -0.01 0.00 0.56 0.00 0.00 36.38 34.23 1bd3 s VAL 88 CO 0.00 -0.01 -0.12 0.28 -0.31 0.00 0.00 175.10 174.94 1bd3 s THR 89 N -3.89 3.07 0.96 5.32 -1.32 -1.26 0.20 115.64 118.72 1bd3 s THR 89 Ca 0.38 -0.65 -0.12 0.00 -1.21 0.00 0.00 61.69 60.09 1bd3 s THR 89 Cb 0.08 -2.30 0.17 0.00 -1.51 0.00 0.00 72.50 68.93 1bd3 s THR 89 CO 0.13 0.52 1.10 -0.89 -2.21 0.00 0.00 174.62 173.26 1bd3 s THR 90 N 0.47 2.21 -0.94 5.08 2.01 0.48 -4.89 115.64 120.07 1bd3 s THR 90 Ca -0.09 0.07 0.17 0.00 0.31 0.00 0.00 61.69 62.15 1bd3 s THR 90 Cb -0.16 -2.61 0.14 0.00 0.01 0.00 0.00 72.50 69.89 1bd3 s THR 90 CO 0.04 -0.09 1.53 -2.65 -0.69 0.00 0.00 174.62 172.76 1bd3 n PRO 91 N -4.03 0.02 -0.34 4.92 -0.02 -1.26 -1.21 135.00 133.08 1bd3 n PRO 91 Ca 0.06 0.25 0.05 0.00 -2.02 0.00 0.00 63.50 61.84 1bd3 n PRO 91 Cb 0.57 -1.55 0.20 0.00 -0.02 0.00 0.00 33.50 32.71 1bd3 n PRO 91 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1bd3 n LEU 92 N -1.59 2.84 -2.89 2.45 4.77 -1.26 -4.90 117.00 116.42 1bd3 n LEU 92 Ca 0.04 -1.43 -0.20 0.00 -0.03 0.00 0.00 56.01 54.39 1bd3 n LEU 92 Cb 0.19 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 1bd3 n LEU 92 CO 0.15 0.51 -0.09 0.47 -1.33 0.00 0.00 177.39 177.10 1bd3 n ASP 93 N 0.54 -4.73 -4.29 -1.43 8.00 -0.35 -4.97 116.55 109.31 1bd3 n ASP 93 Ca 0.14 -0.15 -0.27 0.00 0.71 0.00 0.00 54.79 55.22 1bd3 n ASP 93 Cb 0.54 -3.91 -0.14 0.00 -0.02 0.00 0.00 41.12 37.59 1bd3 n ASP 93 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1bd3 s VAL 94 N -2.93 1.84 0.35 2.53 0.11 -1.26 -4.90 120.40 116.15 1bd3 s VAL 94 Ca 0.21 -1.29 -0.26 0.00 -2.93 0.00 0.00 61.98 57.71 1bd3 s VAL 94 Cb -0.10 -1.59 -0.09 0.00 -1.53 0.00 0.00 36.38 33.06 1bd3 s VAL 94 CO 0.26 0.25 1.04 -0.44 -3.33 0.00 0.00 175.10 172.88 1bd3 s SER 95 N -1.24 7.03 -0.05 3.54 0.01 -1.26 -0.38 113.70 121.34 1bd3 s SER 95 Ca 0.09 2.07 0.04 0.00 1.31 0.00 0.00 55.95 59.46 1bd3 s SER 95 Cb -0.09 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.54 1bd3 s SER 95 CO 0.02 -0.30 -0.16 -0.47 0.41 0.00 0.00 173.24 172.74 1bd3 s TYR 96 N -1.49 1.66 -0.43 2.43 5.04 0.53 -4.90 117.35 120.19 1bd3 s TYR 96 Ca 0.52 -0.53 -0.13 0.00 -2.44 0.00 0.00 57.07 54.49 1bd3 s TYR 96 Cb -0.25 -1.14 0.06 0.00 0.35 0.00 0.00 41.96 40.98 1bd3 s TYR 96 CO 0.31 -0.21 0.32 -1.01 -1.34 0.00 0.00 175.55 173.62 1bd3 s HIS 97 N 0.24 3.27 0.00 4.97 3.76 -1.26 0.22 115.29 126.48 1bd3 s HIS 97 Ca -0.08 -1.03 0.00 0.00 -0.15 0.00 0.00 55.06 53.80 1bd3 s HIS 97 Cb -0.13 -2.91 0.00 0.00 1.11 0.00 0.00 32.58 30.65 1bd3 s HIS 97 CO 0.03 -0.76 0.00 0.41 -0.85 0.00 0.00 174.74 173.57 1bd3 n GLY 98 N 5.09 6.67 3.30 -2.22 0.00 0.56 -4.95 105.19 113.65 1bd3 n GLY 98 Ca -0.12 -1.81 -0.16 0.00 0.00 0.00 0.00 46.02 43.93 1bd3 n GLY 98 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bd3 s VAL 99 N 0.78 0.50 -0.00 1.61 -7.23 -1.24 0.22 120.40 115.02 1bd3 s VAL 99 Ca 0.00 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.09 1bd3 s VAL 99 Cb 0.00 -2.62 0.00 0.00 0.56 0.00 0.00 36.38 34.33 1bd3 s VAL 99 CO 0.00 -0.01 0.16 -0.55 -0.31 0.00 0.00 175.10 174.39 1bd3 s SER 100 N -3.29 -0.01 -0.19 4.85 0.15 0.47 -4.67 113.70 111.00 1bd3 s SER 100 Ca 0.38 -0.13 -0.08 0.00 0.70 0.00 0.00 55.95 56.81 1bd3 s SER 100 Cb 0.08 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.57 1bd3 s SER 100 CO 0.13 -0.36 0.08 -0.36 1.20 0.00 0.00 173.24 173.94 1bd3 s PHE 101 N -1.27 3.28 -0.05 3.44 0.40 -1.26 -0.74 117.98 121.77 1bd3 s PHE 101 Ca -0.14 0.11 0.07 0.00 -0.60 0.00 0.00 56.93 56.38 1bd3 s PHE 101 Cb -0.07 -2.11 0.11 0.00 0.51 0.00 0.00 43.02 41.46 1bd3 s PHE 101 CO 0.02 0.15 1.01 2.48 0.70 0.00 0.00 175.22 179.58 1bd3 n TYR 102 N 3.64 0.00 -2.57 0.36 4.11 -1.26 -5.02 117.16 116.43 1bd3 n TYR 102 Ca -0.16 -0.61 -0.29 0.00 -0.00 0.00 0.00 57.90 56.84 1bd3 n TYR 102 Cb 0.52 -0.08 -0.01 0.00 -0.00 0.00 0.00 39.34 39.77 1bd3 n TYR 102 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 1bd3 s SER 103 N -1.64 6.35 -0.19 9.48 0.01 -1.26 -5.06 113.70 121.40 1bd3 s SER 103 Ca 0.12 1.09 -0.19 0.00 1.31 0.00 0.00 55.95 58.29 1bd3 s SER 103 Cb 0.11 -2.31 -0.03 0.00 0.21 0.00 0.00 66.02 63.99 1bd3 s SER 103 CO 0.01 -0.57 0.53 -0.54 0.41 0.00 0.00 173.24 173.08 1bd3 s LYS 104 N -4.52 4.22 0.37 12.44 -0.14 -1.26 -5.03 119.74 125.81 1bd3 s LYS 104 Ca 0.50 0.45 0.04 0.00 -1.36 0.00 0.00 55.97 55.60 1bd3 s LYS 104 Cb -0.10 -3.54 -0.03 0.00 -1.68 0.00 0.00 37.83 32.47 1bd3 s LYS 104 CO 0.42 -0.12 0.15 0.96 -0.76 0.00 0.00 175.35 176.01 1bd3 s ILE 105 N 1.52 0.48 0.06 2.17 -4.36 -1.26 -1.22 121.20 118.59 1bd3 s ILE 105 Ca 0.25 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.37 1bd3 s ILE 105 Cb -0.15 -2.43 0.09 0.00 1.25 0.00 0.00 42.46 41.21 1bd3 s ILE 105 CO 0.10 0.00 0.84 0.00 0.24 0.00 0.00 174.94 176.12 1bd3 s GLY 107 N -2.62 1.81 -0.06 0.00 0.00 -0.50 -1.31 107.32 104.64 1bd3 s GLY 107 Ca 0.06 -1.25 -0.01 0.00 0.00 0.00 0.00 44.72 43.51 1bd3 s GLY 107 CO -0.08 -1.24 0.02 0.14 0.00 0.00 0.00 173.10 171.94 1bd3 s VAL 108 N -1.36 0.24 0.08 1.40 1.01 0.39 -0.47 120.40 121.70 1bd3 s VAL 108 Ca 0.24 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.44 1bd3 s VAL 108 Cb -0.11 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 1bd3 s VAL 108 CO 0.16 0.23 0.12 -0.94 0.00 0.00 0.00 175.10 174.67 1bd3 s SER 109 N 1.96 5.76 -0.37 3.32 1.04 -0.41 -0.58 113.70 124.42 1bd3 s SER 109 Ca 0.04 0.05 -0.14 0.00 0.48 0.00 0.00 55.95 56.38 1bd3 s SER 109 Cb -0.12 -1.61 -0.00 0.00 0.10 0.00 0.00 66.02 64.39 1bd3 s SER 109 CO -0.04 0.16 0.31 -0.63 0.98 0.00 0.00 173.24 174.01 1bd3 s ILE 110 N -1.46 5.23 0.23 -1.02 1.01 -1.02 -0.68 121.20 123.50 1bd3 s ILE 110 Ca 0.31 -0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.38 1bd3 s ILE 110 Cb -0.12 -3.83 -0.09 0.00 0.01 0.00 0.00 42.46 38.43 1bd3 s ILE 110 CO 0.24 -0.16 1.21 -0.69 0.00 0.00 0.00 174.94 175.54 1bd3 s VAL 111 N 1.83 3.35 -0.10 2.92 1.01 -0.19 -0.01 120.40 129.21 1bd3 s VAL 111 Ca 0.08 1.21 0.15 0.00 0.00 0.00 0.00 61.98 63.42 1bd3 s VAL 111 Cb -0.18 -3.77 -0.21 0.00 0.00 0.00 0.00 36.38 32.22 1bd3 s VAL 111 CO 0.11 0.23 0.17 -2.11 0.00 0.00 0.00 175.10 173.50 1bd3 n ARG 112 N 1.94 1.13 -0.31 2.72 1.85 -1.26 -4.54 116.66 118.19 1bd3 n ARG 112 Ca 0.03 -0.06 0.15 0.00 -1.00 0.00 0.00 57.85 56.97 1bd3 n ARG 112 Cb 0.44 -1.39 0.33 0.00 -1.05 0.00 0.00 32.46 30.78 1bd3 n ARG 112 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1bd3 h ALA 113 N 1.03 1.44 -0.00 2.89 0.00 -1.92 0.60 119.26 123.30 1bd3 h ALA 113 Ca -0.26 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1bd3 h ALA 113 Cb 1.51 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.54 1bd3 h ALA 113 CO 0.01 -0.46 -0.11 0.78 0.00 0.00 0.00 179.25 179.48 1bd3 h GLY 114 N 0.28 0.01 1.77 0.00 0.00 -0.61 -1.66 103.07 102.86 1bd3 h GLY 114 Ca 0.59 -0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.95 1bd3 h GLY 114 CO -0.62 0.00 0.09 0.83 0.00 0.00 0.00 176.54 176.85 1bd3 h GLU 115 N 0.01 0.03 -0.04 4.80 5.08 0.15 0.32 114.58 124.92 1bd3 h GLU 115 Ca 0.00 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1bd3 h GLU 115 Cb 0.19 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1bd3 h GLU 115 CO 0.01 0.02 0.08 0.66 -1.00 0.00 0.00 179.01 178.79 1bd3 h SER 116 N 0.03 0.00 0.92 1.42 4.64 -1.34 -1.93 113.55 117.29 1bd3 h SER 116 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1bd3 h SER 116 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1bd3 h SER 116 CO -0.00 0.00 -0.70 0.24 -0.87 0.00 0.00 176.83 175.50 1bd3 h MET 117 N 0.00 0.00 -0.84 4.77 2.86 -1.09 -3.38 114.93 117.25 1bd3 h MET 117 Ca 0.02 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.70 1bd3 h MET 117 Cb 0.18 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.79 1bd3 h MET 117 CO -0.00 0.00 0.53 0.93 1.06 0.00 0.00 176.91 179.43 1bd3 h GLU 118 N 0.00 0.99 -0.90 1.72 5.08 -1.40 -2.13 114.58 117.95 1bd3 h GLU 118 Ca 0.00 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1bd3 h GLU 118 Cb 0.81 -0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 1bd3 h GLU 118 CO 0.00 0.66 0.59 0.66 -1.00 0.00 0.00 179.01 179.92 1bd3 h SER 119 N 1.02 1.00 -0.32 1.42 4.64 -1.75 0.17 113.55 119.73 1bd3 h SER 119 Ca 0.35 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1bd3 h SER 119 Cb 0.06 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.89 1bd3 h SER 119 CO -0.13 0.71 0.19 1.23 -0.87 0.00 0.00 176.83 177.96 1bd3 h GLY 120 N 1.18 0.47 1.79 -0.77 0.00 -1.64 -0.40 103.07 103.69 1bd3 h GLY 120 Ca 0.34 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.37 1bd3 h GLY 120 CO -0.09 0.19 -0.38 -2.00 0.00 0.00 0.00 176.54 174.26 1bd3 h LEU 121 N 0.41 0.25 -0.81 3.11 5.85 -0.91 -2.72 115.31 120.49 1bd3 h LEU 121 Ca 0.12 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 1bd3 h LEU 121 Cb 0.01 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1bd3 h LEU 121 CO -0.02 0.61 -0.32 0.03 -0.34 0.00 0.00 178.44 178.40 1bd3 h ARG 122 N 0.20 0.00 -0.27 1.25 2.47 -0.12 -1.86 114.38 116.05 1bd3 h ARG 122 Ca 0.02 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.61 1bd3 h ARG 122 Cb 0.77 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 1bd3 h ARG 122 CO 0.06 0.32 -0.36 0.00 0.56 0.00 0.00 179.97 180.55 1bd3 h ALA 123 N 1.68 0.87 0.00 0.04 0.00 -0.76 -3.32 119.26 117.77 1bd3 h ALA 123 Ca -0.00 -0.42 -0.19 0.00 0.00 0.00 0.00 54.91 54.30 1bd3 h ALA 123 Cb 0.92 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1bd3 h ALA 123 CO 0.04 0.64 -2.03 1.33 0.00 0.00 0.00 179.25 179.22 1bd3 n VAL 124 N -4.05 0.83 -3.92 0.00 0.24 -1.19 -4.70 118.33 105.54 1bd3 n VAL 124 Ca -0.01 -0.69 -0.31 0.00 -2.04 0.00 0.00 64.34 61.28 1bd3 n VAL 124 Cb 0.49 -0.34 -0.13 0.00 -1.47 0.00 0.00 33.84 32.39 1bd3 n VAL 124 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bd3 n ARG 126 N 3.35 1.69 -1.59 0.00 3.00 -1.25 -2.23 116.66 119.64 1bd3 n ARG 126 Ca 0.05 0.61 -0.19 0.00 -0.01 0.00 0.00 57.85 58.31 1bd3 n ARG 126 Cb 0.35 -2.33 -0.08 0.00 0.00 0.00 0.00 32.46 30.40 1bd3 n ARG 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1bd3 n GLY 127 N 3.11 1.75 3.66 -0.13 0.00 -1.26 -4.94 105.19 107.38 1bd3 n GLY 127 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1bd3 n GLY 127 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1bd3 n VAL 128 N -2.33 2.79 -2.32 1.61 3.14 -0.94 -4.90 118.33 115.37 1bd3 n VAL 128 Ca -0.19 -0.50 -0.41 0.00 -2.96 0.00 0.00 64.34 60.28 1bd3 n VAL 128 Cb 0.63 -1.39 -0.03 0.00 -1.06 0.00 0.00 33.84 31.99 1bd3 n VAL 128 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1bd3 s ARG 129 N -2.28 4.48 -0.15 1.45 0.52 -1.26 -4.92 118.95 116.79 1bd3 s ARG 129 Ca 0.65 1.95 0.02 0.00 -0.52 0.00 0.00 55.73 57.82 1bd3 s ARG 129 Cb -0.50 -3.20 0.01 0.00 0.52 0.00 0.00 34.95 31.78 1bd3 s ARG 129 CO 0.55 -0.08 -0.20 0.42 0.02 0.00 0.00 175.30 176.01 1bd3 s ILE 130 N -0.35 1.98 0.19 1.52 1.09 -1.26 -1.41 121.20 122.97 1bd3 s ILE 130 Ca 0.52 -0.92 0.05 0.00 -1.10 0.00 0.00 60.65 59.19 1bd3 s ILE 130 Cb -0.34 -1.77 -0.04 0.00 -1.06 0.00 0.00 42.46 39.25 1bd3 s ILE 130 CO 0.40 0.53 0.22 -0.83 -0.10 0.00 0.00 174.94 175.16 1bd3 s GLY 131 N 0.98 1.56 0.01 6.18 0.00 0.38 -4.80 107.32 111.63 1bd3 s GLY 131 Ca -0.03 -1.22 0.03 0.00 0.00 0.00 0.00 44.72 43.50 1bd3 s GLY 131 CO -0.05 -1.24 -0.10 0.54 0.00 0.00 0.00 173.10 172.25 1bd3 s LYS 132 N -3.46 0.76 -0.05 2.90 1.02 -0.28 -1.28 119.74 119.34 1bd3 s LYS 132 Ca 0.33 -0.52 -0.00 0.00 0.02 0.00 0.00 55.97 55.80 1bd3 s LYS 132 Cb -0.10 -0.71 0.03 0.00 -0.52 0.00 0.00 37.83 36.52 1bd3 s LYS 132 CO 0.26 0.18 -0.02 0.42 -0.92 0.00 0.00 175.35 175.28 1bd3 s ILE 133 N -0.58 0.39 -0.24 2.17 1.01 0.15 -1.42 121.20 122.67 1bd3 s ILE 133 Ca 0.01 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.63 1bd3 s ILE 133 Cb -0.06 -0.48 -0.01 0.00 0.01 0.00 0.00 42.46 41.92 1bd3 s ILE 133 CO 0.00 0.22 0.00 -0.22 0.00 0.00 0.00 174.94 174.95 1bd3 s LEU 134 N 1.36 3.21 -0.03 2.97 2.96 0.14 -1.02 118.68 128.26 1bd3 s LEU 134 Ca -0.05 -0.43 0.07 0.00 -0.22 0.00 0.00 54.13 53.50 1bd3 s LEU 134 Cb -0.13 -1.80 -0.02 0.00 0.50 0.00 0.00 46.19 44.74 1bd3 s LEU 134 CO -0.02 -0.06 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.07 1bd3 s ILE 135 N 1.50 2.16 -0.05 6.68 1.01 -1.26 -0.07 121.20 131.18 1bd3 s ILE 135 Ca 0.05 -1.06 0.05 0.00 0.00 0.00 0.00 60.65 59.69 1bd3 s ILE 135 Cb -0.15 -1.76 -0.01 0.00 0.01 0.00 0.00 42.46 40.55 1bd3 s ILE 135 CO -0.01 0.58 -0.20 -1.58 0.00 0.00 0.00 174.94 173.73 1bd3 s GLN 136 N -0.51 2.00 0.14 2.79 2.00 0.42 -4.89 119.66 121.61 1bd3 s GLN 136 Ca 0.07 -0.70 -0.28 0.00 -2.00 0.00 0.00 55.36 52.45 1bd3 s GLN 136 Cb -0.11 -1.73 -0.07 0.00 0.80 0.00 0.00 33.01 31.90 1bd3 s GLN 136 CO 0.00 0.29 0.88 0.50 -0.50 0.00 0.00 175.29 176.47 1bd3 s ARG 137 N -0.04 4.67 0.57 1.67 3.52 -1.26 0.31 118.95 128.39 1bd3 s ARG 137 Ca -0.03 1.33 -0.18 0.00 -0.13 0.00 0.00 55.73 56.71 1bd3 s ARG 137 Cb -0.12 -3.33 -0.04 0.00 -1.56 0.00 0.00 34.95 29.90 1bd3 s ARG 137 CO 0.02 0.37 1.13 0.34 -0.81 0.00 0.00 175.30 176.36 1bd3 s ASP 138 N -0.52 5.54 0.07 -2.12 2.15 0.11 -4.87 116.67 117.02 1bd3 s ASP 138 Ca 0.42 2.16 -0.15 0.00 0.43 0.00 0.00 52.55 55.40 1bd3 s ASP 138 Cb -0.23 -2.58 -0.20 0.00 -0.30 0.00 0.00 42.92 39.61 1bd3 s ASP 138 CO 0.28 -1.35 1.22 -0.33 -0.17 0.00 0.00 175.17 174.83 1bd3 h GLU 139 N 0.91 0.67 0.00 4.34 5.08 -1.94 -2.85 114.58 120.79 1bd3 h GLU 139 Ca -0.49 -0.63 0.00 0.00 -1.00 0.00 0.00 59.36 57.24 1bd3 h GLU 139 Cb 1.26 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1bd3 h GLU 139 CO 0.56 1.23 0.00 2.41 -1.00 0.00 0.00 179.01 182.21 1bd3 n THR 140 N -3.99 0.00 0.00 1.13 -1.04 -1.26 -4.75 114.28 104.37 1bd3 n THR 140 Ca -0.09 1.13 0.00 0.00 -2.04 0.00 0.00 64.05 63.05 1bd3 n THR 140 Cb 0.77 -2.09 0.00 0.00 -1.82 0.00 0.00 70.33 67.18 1bd3 n THR 140 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1bd3 n THR 141 N -1.83 0.00 0.00 12.58 -2.24 -1.26 -5.04 114.28 116.49 1bd3 n THR 141 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1bd3 n THR 141 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1bd3 n THR 141 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bd3 n ALA 142 N -3.00 0.00 -1.77 6.98 0.00 -1.08 -4.78 120.51 116.87 1bd3 n ALA 142 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 1bd3 n ALA 142 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1bd3 n ALA 142 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1bd3 s GLU 143 N 0.00 4.22 0.20 0.00 -1.05 -1.26 -3.94 118.70 116.87 1bd3 s GLU 143 Ca 0.00 1.97 -0.30 0.00 -0.15 0.00 0.00 54.97 56.49 1bd3 s GLU 143 Cb 0.00 -2.88 -0.08 0.00 -0.44 0.00 0.00 34.13 30.73 1bd3 s GLU 143 CO 0.00 -0.22 1.07 -2.14 0.95 0.00 0.00 175.26 174.93 1bd3 s PRO 144 N -2.01 4.64 -0.03 -4.83 0.02 -1.26 0.06 135.00 131.59 1bd3 s PRO 144 Ca 0.53 1.69 0.07 0.00 0.02 0.00 0.00 61.00 63.31 1bd3 s PRO 144 Cb -0.34 -3.27 -0.02 0.00 0.02 0.00 0.00 34.50 30.89 1bd3 s PRO 144 CO 0.44 0.16 -0.24 0.15 -0.33 0.00 0.00 177.00 177.17 1bd3 s LYS 145 N -0.65 2.08 -0.35 5.54 -0.14 0.93 -4.90 119.74 122.24 1bd3 s LYS 145 Ca 0.47 -0.88 -0.29 0.00 -1.36 0.00 0.00 55.97 53.92 1bd3 s LYS 145 Cb -0.29 -1.96 0.01 0.00 -1.68 0.00 0.00 37.83 33.91 1bd3 s LYS 145 CO 0.35 0.50 1.31 -1.17 -0.76 0.00 0.00 175.35 175.58 1bd3 s LEU 146 N -0.50 3.77 -0.14 3.17 2.96 -1.26 0.16 118.68 126.84 1bd3 s LEU 146 Ca 0.07 1.01 0.08 0.00 -0.22 0.00 0.00 54.13 55.07 1bd3 s LEU 146 Cb -0.10 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.81 1bd3 s LEU 146 CO -0.00 -1.20 0.29 -0.38 -1.32 0.00 0.00 176.35 173.74 1bd3 n ILE 147 N 6.52 1.57 -3.55 6.68 2.08 0.90 -4.92 119.36 128.65 1bd3 n ILE 147 Ca 0.15 -0.74 -0.12 0.00 0.56 0.00 0.00 62.75 62.60 1bd3 n ILE 147 Cb 0.47 -1.11 -0.05 0.00 -0.75 0.00 0.00 39.64 38.20 1bd3 n ILE 147 CO 0.00 0.00 0.00 -0.47 0.56 0.00 0.00 176.55 176.64 1bd3 s TYR 148 N -2.55 -0.44 -0.23 1.39 6.14 -1.06 -4.99 117.35 115.61 1bd3 s TYR 148 Ca -0.15 0.69 -0.26 0.00 0.64 0.00 0.00 57.07 57.98 1bd3 s TYR 148 Cb 0.07 0.45 0.09 0.00 0.42 0.00 0.00 41.96 43.00 1bd3 s TYR 148 CO 0.77 -0.45 0.81 -1.83 0.64 0.00 0.00 175.55 175.50 1bd3 s GLU 149 N -1.47 0.77 -0.15 4.97 4.04 -1.26 0.24 118.70 125.83 1bd3 s GLU 149 Ca -0.03 0.73 -0.04 0.00 0.04 0.00 0.00 54.97 55.67 1bd3 s GLU 149 Cb -0.00 0.37 0.05 0.00 0.02 0.00 0.00 34.13 34.57 1bd3 s GLU 149 CO 0.02 -0.13 0.08 0.15 -1.84 0.00 0.00 175.26 173.54 1bd3 s LYS 150 N 0.01 0.11 0.25 -4.83 -0.14 -0.51 -5.00 119.74 109.64 1bd3 s LYS 150 Ca -0.01 -0.04 0.09 0.00 -1.36 0.00 0.00 55.97 54.65 1bd3 s LYS 150 Cb -0.04 -1.64 -0.05 0.00 -1.68 0.00 0.00 37.83 34.42 1bd3 s LYS 150 CO 0.01 -0.61 -0.15 -0.51 -0.76 0.00 0.00 175.35 173.33 1bd3 s LEU 151 N 2.11 2.57 0.61 3.17 1.43 -1.26 -1.13 118.68 126.19 1bd3 s LEU 151 Ca 0.02 -1.06 -0.19 0.00 -1.03 0.00 0.00 54.13 51.87 1bd3 s LEU 151 Cb -0.15 -0.85 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1bd3 s LEU 151 CO -0.08 -0.12 1.30 -2.84 0.23 0.00 0.00 176.35 174.84 1bd3 s PRO 152 N -3.60 2.76 0.15 1.29 0.02 -1.26 -4.92 135.00 129.44 1bd3 s PRO 152 Ca 0.27 2.08 -0.10 0.00 0.02 0.00 0.00 61.00 63.27 1bd3 s PRO 152 Cb -0.01 -1.96 -0.01 0.00 0.02 0.00 0.00 34.50 32.53 1bd3 s PRO 152 CO 0.11 -1.44 1.52 0.00 -0.33 0.00 0.00 177.00 176.86 1bd3 h ALA 153 N 0.83 0.65 -0.60 -1.55 0.00 -2.02 -3.04 119.26 113.52 1bd3 h ALA 153 Ca -0.51 -0.41 -0.25 0.00 0.00 0.00 0.00 54.91 53.74 1bd3 h ALA 153 Cb 1.32 -0.15 -0.15 0.00 0.00 0.00 0.00 17.79 18.81 1bd3 h ALA 153 CO 0.54 0.67 0.31 -0.40 0.00 0.00 0.00 179.25 180.38 1bd3 n ASP 154 N -4.10 3.77 -0.15 0.00 5.75 -1.26 -4.54 116.55 116.01 1bd3 n ASP 154 Ca -0.01 -2.97 0.27 0.00 -0.01 0.00 0.00 54.79 52.07 1bd3 n ASP 154 Cb 0.49 -0.70 0.70 0.00 -1.03 0.00 0.00 41.12 40.58 1bd3 n ASP 154 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1bd3 h ILE 155 N 1.35 0.59 -0.03 2.12 2.10 -1.91 0.02 117.51 121.75 1bd3 h ILE 155 Ca 0.30 -0.01 0.01 0.00 1.08 0.00 0.00 64.86 66.24 1bd3 h ILE 155 Cb 2.06 0.56 -0.00 0.00 -1.09 0.00 0.00 36.82 38.35 1bd3 h ILE 155 CO 0.64 0.01 0.02 0.08 -1.08 0.00 0.00 178.15 177.81 1bd3 h ARG 156 N 0.03 0.00 -0.15 2.19 0.11 -1.83 -1.48 114.38 113.25 1bd3 h ARG 156 Ca 0.40 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.48 1bd3 h ARG 156 Cb 1.56 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.64 1bd3 h ARG 156 CO -0.02 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.44 1bd3 n GLU 157 N -4.20 1.93 -4.06 0.08 1.02 -0.01 -4.48 120.64 110.93 1bd3 n GLU 157 Ca -0.02 -1.38 -0.22 0.00 -0.02 0.00 0.00 57.16 55.51 1bd3 n GLU 157 Cb 0.11 -1.45 -0.05 0.00 -0.02 0.00 0.00 31.44 30.04 1bd3 n GLU 157 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bd3 s ARG 158 N -1.82 2.60 0.17 3.49 0.52 -0.56 -4.81 118.95 118.55 1bd3 s ARG 158 Ca 0.34 -1.32 -0.16 0.00 -0.52 0.00 0.00 55.73 54.07 1bd3 s ARG 158 Cb 0.20 -2.36 -0.07 0.00 0.52 0.00 0.00 34.95 33.23 1bd3 s ARG 158 CO 0.29 0.23 0.61 -1.58 0.02 0.00 0.00 175.30 174.87 1bd3 s TRP 159 N -2.30 3.62 -0.16 -0.53 0.52 -0.35 -4.81 118.94 114.93 1bd3 s TRP 159 Ca 0.36 1.18 0.01 0.00 0.02 0.00 0.00 56.10 57.68 1bd3 s TRP 159 Cb -0.06 -2.46 0.01 0.00 -1.15 0.00 0.00 33.47 29.82 1bd3 s TRP 159 CO 0.24 0.40 -0.19 0.08 0.02 0.00 0.00 176.95 177.49 1bd3 s VAL 160 N -1.48 2.23 -0.45 4.03 1.01 -0.11 -2.06 120.40 123.57 1bd3 s VAL 160 Ca 0.39 -0.91 -0.18 0.00 0.00 0.00 0.00 61.98 61.29 1bd3 s VAL 160 Cb -0.16 -1.92 0.04 0.00 0.00 0.00 0.00 36.38 34.34 1bd3 s VAL 160 CO 0.20 0.53 0.49 -0.32 0.00 0.00 0.00 175.10 176.00 1bd3 s MET 161 N 0.99 3.09 -0.29 2.72 1.75 -0.43 -0.07 119.30 127.06 1bd3 s MET 161 Ca -0.03 -0.87 -0.18 0.00 -1.25 0.00 0.00 55.69 53.36 1bd3 s MET 161 Cb -0.15 -4.03 -0.02 0.00 2.84 0.00 0.00 34.83 33.48 1bd3 s MET 161 CO -0.05 -0.98 0.53 -1.17 -0.65 0.00 0.00 175.02 172.70 1bd3 s LEU 162 N 2.21 4.13 -0.26 4.11 2.96 0.66 -0.46 118.68 132.02 1bd3 s LEU 162 Ca 0.12 0.37 -0.10 0.00 -0.22 0.00 0.00 54.13 54.30 1bd3 s LEU 162 Cb -0.19 -2.66 -0.04 0.00 0.50 0.00 0.00 46.19 43.80 1bd3 s LEU 162 CO 0.12 -0.36 0.15 -0.76 -1.32 0.00 0.00 176.35 174.18 1bd3 s LEU 163 N 2.37 3.86 -0.29 -0.68 1.43 0.25 -0.67 118.68 124.95 1bd3 s LEU 163 Ca 0.21 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 1bd3 s LEU 163 Cb -0.15 -2.06 0.19 0.00 0.03 0.00 0.00 46.19 44.19 1bd3 s LEU 163 CO 0.11 -0.02 0.58 -0.62 0.23 0.00 0.00 176.35 176.62 1bd3 s ASP 164 N 1.59 -1.29 0.50 2.29 -1.08 -1.05 -2.42 116.67 115.21 1bd3 s ASP 164 Ca 0.07 0.66 0.20 0.00 -0.52 0.00 0.00 52.55 52.96 1bd3 s ASP 164 Cb -0.15 2.05 1.26 0.00 -1.46 0.00 0.00 42.92 44.62 1bd3 s ASP 164 CO 0.08 -0.27 2.03 1.55 0.52 0.00 0.00 175.17 179.08 1bd3 h PRO 165 N 8.02 0.11 -5.95 4.34 0.13 -1.82 -3.37 132.00 133.46 1bd3 h PRO 165 Ca -0.18 -0.01 -0.59 0.00 -0.87 0.00 0.00 66.00 64.36 1bd3 h PRO 165 Cb 1.17 -0.02 -0.29 0.00 0.13 0.00 0.00 31.00 31.98 1bd3 h PRO 165 CO 0.24 0.07 -0.85 -1.64 -0.23 0.00 0.00 178.00 175.59 1bd3 s MET 166 N -5.13 1.59 -0.44 0.86 -1.94 -1.26 -1.60 119.30 111.39 1bd3 s MET 166 Ca -0.06 -0.73 0.02 0.00 -1.71 0.00 0.00 55.69 53.21 1bd3 s MET 166 Cb 0.19 -1.56 0.14 0.00 2.01 0.00 0.00 34.83 35.61 1bd3 s MET 166 CO 0.72 0.42 0.25 0.00 -0.01 0.00 0.00 175.02 176.40 1bd3 n ALA 168 N 3.52 0.00 0.53 0.00 0.00 -1.26 -2.07 120.51 121.23 1bd3 n ALA 168 Ca 0.10 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.61 1bd3 n ALA 168 Cb 0.35 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.92 1bd3 n ALA 168 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1bd3 h THR 169 N 0.00 0.00 0.00 0.00 1.35 -1.93 -2.61 112.91 109.72 1bd3 h THR 169 Ca 0.00 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 1bd3 h THR 169 Cb 0.00 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.45 1bd3 h THR 169 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1bd3 n ALA 170 N -1.86 0.00 -0.20 6.62 0.00 -1.26 -4.62 120.51 119.19 1bd3 n ALA 170 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.40 1bd3 n ALA 170 Cb 0.45 -0.63 0.03 0.00 0.00 0.00 0.00 19.45 19.31 1bd3 n ALA 170 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1bd3 h GLY 171 N 0.00 0.82 0.69 0.00 0.00 -1.96 -0.97 103.07 101.64 1bd3 h GLY 171 Ca 0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1bd3 h GLY 171 CO 0.00 0.30 -0.00 1.76 0.00 0.00 0.00 176.54 178.59 1bd3 h SER 172 N 0.79 -0.01 -0.50 0.19 0.02 -1.99 -2.24 113.55 109.80 1bd3 h SER 172 Ca 0.21 -0.31 -0.05 0.00 -0.84 0.00 0.00 61.79 60.80 1bd3 h SER 172 Cb -0.09 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 1bd3 h SER 172 CO -0.05 0.30 0.14 1.62 -1.14 0.00 0.00 176.83 177.70 1bd3 h VAL 173 N -0.33 1.23 -0.64 2.27 3.04 -1.95 -0.14 116.25 119.74 1bd3 h VAL 173 Ca -0.00 -0.82 -0.04 0.00 -1.01 0.00 0.00 66.70 64.83 1bd3 h VAL 173 Cb 0.32 0.65 -0.03 0.00 -2.01 0.00 0.00 31.29 30.22 1bd3 h VAL 173 CO 0.00 0.31 0.22 0.00 -1.01 0.00 0.00 177.57 177.09 1bd3 h LYS 175 N 0.93 0.76 -0.80 0.00 3.11 -0.71 -1.50 116.57 118.35 1bd3 h LYS 175 Ca 0.21 -0.20 -0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1bd3 h LYS 175 Cb 0.23 -0.09 -0.04 0.00 -1.00 0.00 0.00 32.23 31.34 1bd3 h LYS 175 CO -0.01 0.78 0.49 0.00 -2.81 0.00 0.00 179.45 177.89 1bd3 h ALA 176 N 0.95 1.02 -0.53 5.00 0.00 -0.37 -2.11 119.26 123.22 1bd3 h ALA 176 Ca 0.14 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1bd3 h ALA 176 Cb 0.39 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1bd3 h ALA 176 CO 0.01 0.47 0.24 0.82 0.00 0.00 0.00 179.25 180.80 1bd3 h ILE 177 N 1.09 1.20 -0.18 0.00 2.04 -0.62 -1.29 117.51 119.76 1bd3 h ILE 177 Ca 0.29 -0.60 0.05 0.00 1.00 0.00 0.00 64.86 65.60 1bd3 h ILE 177 Cb -0.05 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1bd3 h ILE 177 CO -0.06 0.23 -0.15 -0.08 0.00 0.00 0.00 178.15 178.10 1bd3 h GLU 178 N 0.71 -0.16 -0.70 2.37 4.81 -0.88 0.22 114.58 120.96 1bd3 h GLU 178 Ca 0.18 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1bd3 h GLU 178 Cb 0.14 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 1bd3 h GLU 178 CO -0.02 -0.11 0.32 -0.24 -0.73 0.00 0.00 179.01 178.24 1bd3 h VAL 179 N -0.16 1.23 -0.38 0.32 3.04 -1.10 0.17 116.25 119.38 1bd3 h VAL 179 Ca 0.11 -0.68 0.03 0.00 -1.01 0.00 0.00 66.70 65.15 1bd3 h VAL 179 Cb 0.33 0.39 -0.03 0.00 -2.01 0.00 0.00 31.29 29.97 1bd3 h VAL 179 CO -0.28 0.28 0.19 -0.07 -1.01 0.00 0.00 177.57 176.68 1bd3 h LEU 180 N 0.98 0.28 -0.65 3.16 4.07 -0.49 -1.16 115.31 121.50 1bd3 h LEU 180 Ca 0.24 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 58.21 1bd3 h LEU 180 Cb 0.14 -0.04 -0.03 0.00 1.08 0.00 0.00 40.66 41.81 1bd3 h LEU 180 CO -0.03 0.21 0.40 -0.07 -1.08 0.00 0.00 178.44 177.87 1bd3 h LEU 181 N 0.39 0.78 -1.78 1.67 3.38 -0.22 -1.45 115.31 118.07 1bd3 h LEU 181 Ca 0.16 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.10 1bd3 h LEU 181 Cb 0.06 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1bd3 h LEU 181 CO -0.11 0.60 0.20 -0.09 0.09 0.00 0.00 178.44 179.14 1bd3 h ARG 182 N 0.89 0.27 0.00 1.13 2.43 -0.17 -0.76 114.38 118.17 1bd3 h ARG 182 Ca 0.24 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1bd3 h ARG 182 Cb -0.04 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1bd3 h ARG 182 CO -0.05 0.18 0.00 1.28 -1.51 0.00 0.00 179.97 179.88 1bd3 n LEU 183 N -4.49 0.03 0.00 3.80 7.99 -0.51 -4.90 117.00 118.92 1bd3 n LEU 183 Ca 0.03 0.50 0.00 0.00 -0.01 0.00 0.00 56.01 56.53 1bd3 n LEU 183 Cb 0.17 -0.49 0.00 0.00 -0.11 0.00 0.00 43.42 42.98 1bd3 n LEU 183 CO 0.35 -0.03 0.00 0.61 -1.51 0.00 0.00 177.39 176.80 1bd3 n GLY 184 N 1.34 1.00 3.74 -0.72 0.00 -0.29 -4.66 105.19 105.60 1bd3 n GLY 184 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1bd3 n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bd3 s VAL 185 N -2.00 3.28 -0.07 1.61 1.01 -0.84 -4.72 120.40 118.67 1bd3 s VAL 185 Ca 0.00 1.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.76 1bd3 s VAL 185 Cb 0.00 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 1bd3 s VAL 185 CO 0.00 0.18 1.19 -0.54 0.00 0.00 0.00 175.10 175.92 1bd3 s LYS 186 N -0.35 4.35 0.37 2.72 -0.14 -1.26 -4.45 119.74 120.98 1bd3 s LYS 186 Ca 0.54 1.65 0.16 0.00 -1.36 0.00 0.00 55.97 56.96 1bd3 s LYS 186 Cb -0.36 -3.57 1.05 0.00 -1.68 0.00 0.00 37.83 33.28 1bd3 s LYS 186 CO 0.39 -0.45 1.73 1.49 -0.76 0.00 0.00 175.35 177.75 1bd3 h GLU 187 N 7.46 0.42 0.00 1.68 4.81 -1.95 0.39 114.58 127.39 1bd3 h GLU 187 Ca -0.33 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1bd3 h GLU 187 Cb 1.16 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1bd3 h GLU 187 CO 0.88 0.28 0.00 -0.85 -0.73 0.00 0.00 179.01 178.59 1bd3 n GLU 188 N -4.76 0.82 -0.53 1.92 0.00 -1.26 -2.76 120.64 114.07 1bd3 n GLU 188 Ca 0.27 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.52 1bd3 n GLU 188 Cb 0.89 -1.50 0.30 0.00 0.00 0.00 0.00 31.44 31.12 1bd3 n GLU 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1bd3 n ARG 189 N -1.02 3.50 -4.02 3.44 1.74 0.14 -4.86 116.66 115.58 1bd3 n ARG 189 Ca 0.20 -2.78 -0.35 0.00 -0.77 0.00 0.00 57.85 54.15 1bd3 n ARG 189 Cb 0.10 -1.84 -0.12 0.00 -1.02 0.00 0.00 32.46 29.59 1bd3 n ARG 189 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bd3 s ILE 190 N -2.23 4.18 -0.27 0.55 1.01 -1.11 -0.94 121.20 122.38 1bd3 s ILE 190 Ca 0.44 -0.24 -0.02 0.00 0.00 0.00 0.00 60.65 60.83 1bd3 s ILE 190 Cb 0.31 -2.90 0.03 0.00 0.01 0.00 0.00 42.46 39.92 1bd3 s ILE 190 CO 0.16 0.42 -0.02 -0.63 0.00 0.00 0.00 174.94 174.86 1bd3 s ILE 191 N 0.99 3.05 -0.42 2.92 1.01 0.90 -1.73 121.20 127.93 1bd3 s ILE 191 Ca 0.02 -1.10 -0.22 0.00 0.00 0.00 0.00 60.65 59.36 1bd3 s ILE 191 Cb -0.14 -2.62 0.02 0.00 0.01 0.00 0.00 42.46 39.73 1bd3 s ILE 191 CO 0.02 0.09 0.70 0.12 0.00 0.00 0.00 174.94 175.87 1bd3 s PHE 192 N 1.32 3.06 -0.27 3.97 5.36 0.57 -0.24 117.98 131.75 1bd3 s PHE 192 Ca -0.01 0.17 -0.14 0.00 -0.96 0.00 0.00 56.93 55.99 1bd3 s PHE 192 Cb -0.18 -3.41 -0.04 0.00 -0.34 0.00 0.00 43.02 39.05 1bd3 s PHE 192 CO -0.03 -0.84 0.33 0.08 -1.46 0.00 0.00 175.22 173.30 1bd3 s VAL 193 N 2.98 5.21 0.04 3.12 1.01 0.15 -0.57 120.40 132.34 1bd3 s VAL 193 Ca 0.26 0.47 0.01 0.00 0.00 0.00 0.00 61.98 62.72 1bd3 s VAL 193 Cb -0.13 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 1bd3 s VAL 193 CO 0.19 0.19 -0.05 0.21 0.00 0.00 0.00 175.10 175.64 1bd3 s ASN 194 N 1.62 0.51 -0.23 3.32 3.84 0.34 -2.52 114.94 121.81 1bd3 s ASN 194 Ca 0.13 -0.62 -0.19 0.00 0.21 0.00 0.00 52.86 52.39 1bd3 s ASN 194 Cb -0.16 0.10 -0.17 0.00 -0.55 0.00 0.00 41.25 40.47 1bd3 s ASN 194 CO 0.10 -0.33 0.05 -0.38 -2.79 0.00 0.00 177.10 173.75 1bd3 n ILE 195 N 1.25 1.53 -4.52 -5.21 5.41 -0.62 -2.89 119.36 114.30 1bd3 n ILE 195 Ca -0.21 -0.13 -0.23 0.00 1.00 0.00 0.00 62.75 63.18 1bd3 n ILE 195 Cb 0.56 -1.99 -0.16 0.00 -0.71 0.00 0.00 39.64 37.34 1bd3 n ILE 195 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1bd3 s LEU 196 N -7.76 1.75 0.20 1.39 0.20 -0.63 -1.39 118.68 112.44 1bd3 s LEU 196 Ca -0.32 -0.25 0.03 0.00 0.69 0.00 0.00 54.13 54.29 1bd3 s LEU 196 Cb 0.09 -0.70 -0.05 0.00 -0.43 0.00 0.00 46.19 45.10 1bd3 s LEU 196 CO 0.56 0.07 -0.01 0.00 -0.29 0.00 0.00 176.35 176.68 1bd3 s ALA 197 N 0.31 1.63 -0.01 5.97 0.00 -0.37 -1.67 121.76 127.61 1bd3 s ALA 197 Ca -0.06 -1.68 0.06 0.00 0.00 0.00 0.00 51.96 50.27 1bd3 s ALA 197 Cb -0.11 0.47 -0.03 0.00 0.00 0.00 0.00 23.12 23.45 1bd3 s ALA 197 CO 0.02 -0.26 -0.19 0.00 0.00 0.00 0.00 175.76 175.32 1bd3 s ALA 198 N -3.49 2.47 0.31 0.00 0.00 -0.88 -0.79 121.76 119.39 1bd3 s ALA 198 Ca 0.26 -1.09 0.07 0.00 0.00 0.00 0.00 51.96 51.20 1bd3 s ALA 198 Cb 0.05 -0.76 0.85 0.00 0.00 0.00 0.00 23.12 23.26 1bd3 s ALA 198 CO 0.06 0.55 1.68 -1.35 0.00 0.00 0.00 175.76 176.70 1bd3 h PRO 199 N 5.16 0.35 -0.57 0.00 0.11 -1.83 0.90 132.00 136.12 1bd3 h PRO 199 Ca -0.46 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 1bd3 h PRO 199 Cb 1.14 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1bd3 h PRO 199 CO 0.48 0.23 0.15 -0.56 -0.21 0.00 0.00 178.00 178.09 1bd3 h GLN 200 N 0.36 0.88 -0.41 1.05 3.07 -1.92 0.33 115.11 118.47 1bd3 h GLN 200 Ca 0.62 -0.18 -0.12 0.00 0.09 0.00 0.00 58.65 59.06 1bd3 h GLN 200 Cb 1.27 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 28.69 1bd3 h GLN 200 CO -0.57 0.78 -0.20 0.78 0.09 0.00 0.00 178.83 179.70 1bd3 h GLY 201 N 0.99 0.94 0.75 0.06 0.00 -0.45 -2.00 103.07 103.36 1bd3 h GLY 201 Ca 0.19 -0.85 0.02 0.00 0.00 0.00 0.00 47.33 46.69 1bd3 h GLY 201 CO -0.00 0.77 -0.06 -2.22 0.00 0.00 0.00 176.54 175.03 1bd3 h ILE 202 N 0.68 0.83 -0.80 2.60 2.04 -0.73 -1.24 117.51 120.89 1bd3 h ILE 202 Ca 0.09 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.01 1bd3 h ILE 202 Cb 0.77 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 37.62 1bd3 h ILE 202 CO 0.06 0.00 0.48 -0.33 0.00 0.00 0.00 178.15 178.36 1bd3 h GLU 203 N -0.06 0.85 -0.35 2.37 5.08 -0.82 -2.44 114.58 119.20 1bd3 h GLU 203 Ca 0.05 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1bd3 h GLU 203 Cb 0.14 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1bd3 h GLU 203 CO -0.12 0.56 0.11 -0.09 -1.00 0.00 0.00 179.01 178.47 1bd3 h ARG 204 N 0.87 0.54 -0.84 2.33 1.12 -0.74 -0.80 114.38 116.88 1bd3 h ARG 204 Ca 0.35 -0.12 -0.01 0.00 -1.11 0.00 0.00 59.98 59.10 1bd3 h ARG 204 Cb 0.19 -0.08 -0.04 0.00 -0.01 0.00 0.00 29.97 30.03 1bd3 h ARG 204 CO -0.18 0.57 0.49 -0.24 -3.11 0.00 0.00 179.97 177.50 1bd3 h VAL 205 N 0.41 1.24 0.00 0.20 3.04 -0.95 -1.67 116.25 118.51 1bd3 h VAL 205 Ca 0.11 -0.53 -0.09 0.00 -1.01 0.00 0.00 66.70 65.18 1bd3 h VAL 205 Cb 0.25 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 29.60 1bd3 h VAL 205 CO -0.00 0.25 -0.45 -0.26 -1.01 0.00 0.00 177.57 176.10 1bd3 h PHE 206 N 1.15 0.00 -0.27 3.17 0.04 -1.29 0.50 116.94 120.23 1bd3 h PHE 206 Ca 0.30 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.90 1bd3 h PHE 206 Cb -0.03 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.12 1bd3 h PHE 206 CO -0.00 0.45 -0.51 -0.22 -0.60 0.00 0.00 178.31 177.42 1bd3 h LYS 207 N 0.00 0.77 0.19 1.51 3.64 -0.85 -2.73 116.57 119.10 1bd3 h LYS 207 Ca -0.00 -0.47 -0.30 0.00 -1.27 0.00 0.00 60.65 58.60 1bd3 h LYS 207 Cb 1.00 0.05 0.02 0.00 -0.41 0.00 0.00 32.23 32.89 1bd3 h LYS 207 CO 0.06 1.10 -1.42 0.93 -2.27 0.00 0.00 179.45 177.84 1bd3 h GLU 208 N 0.60 0.40 -2.11 1.90 5.08 -1.03 -3.41 114.58 116.01 1bd3 h GLU 208 Ca 0.02 -0.69 -0.58 0.00 -1.00 0.00 0.00 59.36 57.12 1bd3 h GLU 208 Cb 1.09 0.26 -0.40 0.00 0.50 0.00 0.00 28.75 30.20 1bd3 h GLU 208 CO 0.11 1.33 -0.91 0.66 -1.00 0.00 0.00 179.01 179.20 1bd3 n TYR 209 N -3.80 1.07 0.24 4.33 4.01 0.17 -4.97 117.16 118.22 1bd3 n TYR 209 Ca -0.20 -3.77 0.15 0.00 -0.16 0.00 0.00 57.90 53.92 1bd3 n TYR 209 Cb 1.01 -0.40 0.68 0.00 -0.31 0.00 0.00 39.34 40.32 1bd3 n TYR 209 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1bd3 h PRO 210 N 4.18 0.00 0.00 -0.72 0.13 -1.65 -2.53 132.00 131.40 1bd3 h PRO 210 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1bd3 h PRO 210 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1bd3 h PRO 210 CO 0.59 0.00 -0.50 1.63 -0.23 0.00 0.00 178.00 179.50 1bd3 n LYS 211 N -3.07 0.17 -1.40 0.86 5.02 -1.26 -4.93 118.16 113.55 1bd3 n LYS 211 Ca 0.02 0.06 -0.29 0.00 -2.02 0.00 0.00 58.31 56.07 1bd3 n LYS 211 Cb 0.57 -1.61 0.12 0.00 -0.02 0.00 0.00 35.03 34.10 1bd3 n LYS 211 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1bd3 s VAL 212 N -3.09 2.62 0.05 -0.18 -7.23 -0.96 -4.26 120.40 107.35 1bd3 s VAL 212 Ca 0.09 0.20 0.06 0.00 -1.81 0.00 0.00 61.98 60.52 1bd3 s VAL 212 Cb 0.15 -2.84 -0.03 0.00 0.56 0.00 0.00 36.38 34.22 1bd3 s VAL 212 CO 0.69 -0.26 -0.13 -0.13 -0.31 0.00 0.00 175.10 174.96 1bd3 s ARG 213 N -5.09 2.22 -0.05 4.82 3.00 -0.70 -4.88 118.95 118.28 1bd3 s ARG 213 Ca 0.63 -0.92 0.02 0.00 0.00 0.00 0.00 55.73 55.46 1bd3 s ARG 213 Cb -0.16 -2.31 0.01 0.00 0.00 0.00 0.00 34.95 32.49 1bd3 s ARG 213 CO 0.55 0.55 -0.11 1.41 0.00 0.00 0.00 175.30 177.71 1bd3 s MET 214 N -1.64 1.41 -0.15 3.54 1.75 -0.64 -0.32 119.30 123.24 1bd3 s MET 214 Ca 0.17 -0.36 0.01 0.00 -1.25 0.00 0.00 55.69 54.26 1bd3 s MET 214 Cb -0.11 -1.22 0.00 0.00 2.84 0.00 0.00 34.83 36.35 1bd3 s MET 214 CO 0.08 0.05 -0.17 0.08 -0.65 0.00 0.00 175.02 174.41 1bd3 s VAL 215 N 0.55 2.48 0.15 10.11 1.01 0.27 0.09 120.40 135.07 1bd3 s VAL 215 Ca -0.11 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.06 1bd3 s VAL 215 Cb -0.14 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1bd3 s VAL 215 CO 0.02 0.52 -0.04 0.28 0.00 0.00 0.00 175.10 175.89 1bd3 s THR 216 N 0.87 0.78 -0.04 3.92 -1.32 -0.71 -0.51 115.64 118.63 1bd3 s THR 216 Ca -0.05 -1.98 0.22 0.00 -1.21 0.00 0.00 61.69 58.67 1bd3 s THR 216 Cb -0.15 -1.96 -0.34 0.00 -1.51 0.00 0.00 72.50 68.55 1bd3 s THR 216 CO -0.02 -0.63 0.49 0.00 -2.21 0.00 0.00 174.62 172.25 1bd3 n ALA 217 N -0.18 2.83 -3.49 11.08 0.00 -0.78 -1.87 120.51 128.09 1bd3 n ALA 217 Ca -0.09 -0.52 -0.15 0.00 0.00 0.00 0.00 53.44 52.69 1bd3 n ALA 217 Cb 0.62 -0.75 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 1bd3 n ALA 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bd3 s ALA 218 N -3.51 -1.73 -0.14 0.00 0.00 -0.49 -4.72 121.76 111.18 1bd3 s ALA 218 Ca -0.08 1.03 -0.00 0.00 0.00 0.00 0.00 51.96 52.92 1bd3 s ALA 218 Cb 0.14 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.57 1bd3 s ALA 218 CO 0.91 -0.52 -0.11 0.08 0.00 0.00 0.00 175.76 176.12 1bd3 s VAL 219 N -2.19 1.32 0.39 0.00 1.01 -1.26 -1.24 120.40 118.43 1bd3 s VAL 219 Ca -0.05 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1bd3 s VAL 219 Cb -0.00 -1.30 0.08 0.00 0.00 0.00 0.00 36.38 35.16 1bd3 s VAL 219 CO 0.00 0.39 0.53 0.47 0.00 0.00 0.00 175.10 176.49 1bd3 n ASP 220 N 4.85 0.65 0.04 3.32 9.92 0.03 -4.92 116.55 130.43 1bd3 n ASP 220 Ca -0.15 -1.56 -0.03 0.00 -0.53 0.00 0.00 54.79 52.53 1bd3 n ASP 220 Cb 0.50 -0.35 -0.01 0.00 -0.64 0.00 0.00 41.12 40.61 1bd3 n ASP 220 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1bd3 h ILE 221 N -0.57 0.00 -1.99 0.53 1.08 -1.72 -3.38 117.51 111.47 1bd3 h ILE 221 Ca -0.17 -0.58 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 1bd3 h ILE 221 Cb 0.63 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.38 1bd3 h ILE 221 CO 0.18 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.64 1bd3 s LEU 223 N 0.00 2.19 0.00 0.00 1.02 -1.26 -0.21 118.68 120.41 1bd3 s LEU 223 Ca 0.00 -0.60 0.00 0.00 0.02 0.00 0.00 54.13 53.55 1bd3 s LEU 223 Cb 0.00 -1.20 0.13 0.00 0.02 0.00 0.00 46.19 45.14 1bd3 s LEU 223 CO 0.00 0.22 0.89 -0.46 0.02 0.00 0.00 176.35 177.02 1bd3 n ASN 224 N 1.67 1.22 0.32 2.29 6.94 0.11 -4.85 115.26 122.96 1bd3 n ASN 224 Ca -0.17 -2.03 0.20 0.00 -0.02 0.00 0.00 54.58 52.56 1bd3 n ASN 224 Cb 0.52 -0.57 1.05 0.00 -2.36 0.00 0.00 39.78 38.42 1bd3 n ASN 224 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1bd3 h SER 225 N -0.52 0.00 0.04 0.53 4.64 -2.01 0.75 113.55 116.98 1bd3 h SER 225 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1bd3 h SER 225 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1bd3 h SER 225 CO 0.32 0.01 -0.05 -1.14 -0.87 0.00 0.00 176.83 175.10 1bd3 n ARG 226 N -3.20 1.46 -1.52 4.77 3.00 -1.26 -4.93 116.66 114.99 1bd3 n ARG 226 Ca -0.02 -0.82 -0.08 0.00 -0.00 0.00 0.00 57.85 56.93 1bd3 n ARG 226 Cb 0.13 -1.48 -0.02 0.00 0.00 0.00 0.00 32.46 31.08 1bd3 n ARG 226 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1bd3 n TYR 227 N -0.05 -0.12 -3.66 -0.14 4.01 0.26 -5.02 117.16 112.45 1bd3 n TYR 227 Ca 0.18 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.58 1bd3 n TYR 227 Cb 0.34 -1.79 -0.05 0.00 -0.31 0.00 0.00 39.34 37.53 1bd3 n TYR 227 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1bd3 s TYR 228 N -2.33 3.57 0.29 -0.72 2.02 -1.26 -4.76 117.35 114.16 1bd3 s TYR 228 Ca 0.00 0.67 -0.29 0.00 -0.37 0.00 0.00 57.07 57.09 1bd3 s TYR 228 Cb 0.00 -2.07 -0.09 0.00 -0.40 0.00 0.00 41.96 39.39 1bd3 s TYR 228 CO 0.00 0.54 1.07 0.42 -1.57 0.00 0.00 175.55 176.01 1bd3 s ILE 229 N -1.40 3.59 0.02 2.71 1.01 -1.26 -0.71 121.20 125.16 1bd3 s ILE 229 Ca 0.32 1.55 0.06 0.00 0.00 0.00 0.00 60.65 62.59 1bd3 s ILE 229 Cb -0.13 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1bd3 s ILE 229 CO 0.18 0.34 -0.18 0.54 0.00 0.00 0.00 174.94 175.82 1bd3 s VAL 230 N -1.22 1.40 0.50 2.92 0.11 0.70 -2.52 120.40 122.30 1bd3 s VAL 230 Ca 0.45 -0.97 0.27 0.00 -2.93 0.00 0.00 61.98 58.80 1bd3 s VAL 230 Cb -0.30 -1.21 0.31 0.00 -1.53 0.00 0.00 36.38 33.65 1bd3 s VAL 230 CO 0.38 0.22 2.15 1.55 -3.33 0.00 0.00 175.10 176.07 1bd3 h PRO 231 N 5.20 0.00 0.00 1.54 0.13 -1.95 -2.23 132.00 134.68 1bd3 h PRO 231 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1bd3 h PRO 231 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1bd3 h PRO 231 CO 0.46 0.07 0.00 0.41 -0.23 0.00 0.00 178.00 178.70 1bd3 n GLY 232 N -1.04 0.94 0.00 1.56 0.00 -1.05 -4.73 105.19 100.87 1bd3 n GLY 232 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1bd3 n GLY 232 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1bd3 n ILE 233 N 0.00 0.00 -1.61 -0.61 3.06 -1.26 -4.83 119.36 114.10 1bd3 n ILE 233 Ca 0.00 -0.03 0.00 0.00 -2.50 0.00 0.00 62.75 60.22 1bd3 n ILE 233 Cb 0.00 1.58 0.00 0.00 0.54 0.00 0.00 39.64 41.76 1bd3 n ILE 233 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1bd3 n GLY 234 N 0.03 -0.86 3.49 4.50 0.00 -1.26 -4.72 105.19 106.36 1bd3 n GLY 234 Ca 0.00 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 1bd3 n GLY 234 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bd3 s ASP 235 N -4.00 6.22 0.17 1.61 -1.08 -1.26 -4.93 116.67 113.40 1bd3 s ASP 235 Ca 0.00 -0.74 -0.23 0.00 -0.52 0.00 0.00 52.55 51.06 1bd3 s ASP 235 Cb 0.00 -2.44 0.07 0.00 -1.46 0.00 0.00 42.92 39.09 1bd3 s ASP 235 CO 0.00 -1.45 1.59 0.15 0.52 0.00 0.00 175.17 175.99 1bd3 h PHE 236 N 9.57 -0.95 -0.42 -5.34 3.04 -1.99 -0.69 116.94 120.17 1bd3 h PHE 236 Ca -0.28 0.06 0.03 0.00 3.98 0.00 0.00 57.97 61.76 1bd3 h PHE 236 Cb 1.07 0.48 -0.03 0.00 2.56 0.00 0.00 35.95 40.03 1bd3 h PHE 236 CO 0.98 -0.39 0.22 0.78 -2.02 0.00 0.00 178.31 177.88 1bd3 h GLY 237 N -0.23 0.58 1.02 2.40 0.00 -1.91 0.49 103.07 105.41 1bd3 h GLY 237 Ca 0.19 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 1bd3 h GLY 237 CO -0.59 0.12 0.16 -0.55 0.00 0.00 0.00 176.54 175.69 1bd3 h ASP 238 N 0.45 0.92 -0.14 0.19 3.32 -1.80 -0.83 116.42 118.53 1bd3 h ASP 238 Ca 0.18 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 1bd3 h ASP 238 Cb 0.06 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 1bd3 h ASP 238 CO -0.11 0.90 -0.12 0.03 -1.72 0.00 0.00 179.24 178.22 1bd3 h ARG 239 N 0.89 0.32 -0.42 3.56 2.47 -0.60 0.68 114.38 121.28 1bd3 h ARG 239 Ca 0.19 -0.17 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 1bd3 h ARG 239 Cb 0.33 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.64 1bd3 h ARG 239 CO -0.00 0.71 0.15 -0.92 0.56 0.00 0.00 179.97 180.47 1bd3 h TYR 240 N -0.05 0.66 -0.00 3.04 3.20 0.05 -3.15 116.97 120.71 1bd3 h TYR 240 Ca 0.02 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1bd3 h TYR 240 Cb 0.64 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.72 1bd3 h TYR 240 CO 0.08 0.59 -0.29 1.19 -1.64 0.00 0.00 178.16 178.09 1bd3 n PHE 241 N -4.61 0.00 -2.29 -3.82 3.72 -0.32 -4.88 117.46 105.26 1bd3 n PHE 241 Ca 0.00 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.34 1bd3 n PHE 241 Cb 0.16 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 1bd3 n PHE 241 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bd3 n GLY 242 N 1.46 0.25 2.54 1.37 0.00 0.14 -4.98 105.19 105.98 1bd3 n GLY 242 Ca 0.07 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1bd3 n GLY 242 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bd3 n THR 243 N -3.78 3.08 0.00 2.61 -2.24 -0.67 -5.03 114.28 108.25 1bd3 n THR 243 Ca -0.05 -4.22 0.00 0.00 -2.27 0.00 0.00 64.05 57.52 1bd3 n THR 243 Cb 0.54 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 1bd3 n THR 243 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73