#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bd4 h GLU 22 N 0.00 -0.74 -0.18 3.69 4.81 -1.98 0.22 114.58 120.40 1bd4 h GLU 22 Ca 0.00 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.33 1bd4 h GLU 22 Cb 0.00 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 29.48 1bd4 h GLU 22 CO 0.00 -0.44 -0.32 1.49 -0.73 0.00 0.00 179.01 179.01 1bd4 h GLU 23 N -1.10 -0.36 -0.83 1.92 4.57 -1.99 1.51 114.58 118.31 1bd4 h GLU 23 Ca -0.08 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 58.24 1bd4 h GLU 23 Cb 0.64 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 29.23 1bd4 h GLU 23 CO 0.13 -0.24 0.45 0.66 -1.18 0.00 0.00 179.01 178.83 1bd4 h SER 24 N -0.37 0.61 -0.09 1.04 4.64 -1.99 0.30 113.55 117.68 1bd4 h SER 24 Ca 0.11 0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.46 1bd4 h SER 24 Cb 0.55 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1bd4 h SER 24 CO -0.39 0.32 -0.08 0.40 -0.87 0.00 0.00 176.83 176.22 1bd4 h ILE 25 N 0.72 1.35 0.39 0.95 5.03 0.18 -2.55 117.51 123.58 1bd4 h ILE 25 Ca 0.42 -1.19 -0.01 0.00 -0.12 0.00 0.00 64.86 63.96 1bd4 h ILE 25 Cb 0.46 1.93 -0.03 0.00 -3.03 0.00 0.00 36.82 36.16 1bd4 h ILE 25 CO -0.29 0.34 -0.48 -0.07 -0.68 0.00 0.00 178.15 176.97 1bd4 h LEU 26 N -0.18 -1.34 -0.54 1.44 -0.00 0.32 -2.68 115.31 112.33 1bd4 h LEU 26 Ca 0.02 0.12 0.11 0.00 -0.00 0.00 0.00 57.88 58.12 1bd4 h LEU 26 Cb 0.57 0.46 -0.11 0.00 -0.00 0.00 0.00 40.66 41.58 1bd4 h LEU 26 CO 0.02 -0.61 -0.16 -0.61 -0.00 0.00 0.00 178.44 177.08 1bd4 h GLN 27 N -0.90 -0.03 -0.84 1.13 5.75 -0.56 -1.56 115.11 118.10 1bd4 h GLN 27 Ca -0.04 0.00 0.14 0.00 -0.15 0.00 0.00 58.65 58.60 1bd4 h GLN 27 Cb 0.81 0.01 -0.09 0.00 1.07 0.00 0.00 27.48 29.28 1bd4 h GLN 27 CO -0.11 -0.02 0.43 0.22 -2.65 0.00 0.00 178.83 176.70 1bd4 h ASP 28 N -0.03 0.53 -0.01 -0.69 1.82 -1.20 1.09 116.42 117.94 1bd4 h ASP 28 Ca 0.26 0.09 -0.00 0.00 -0.39 0.00 0.00 57.03 56.99 1bd4 h ASP 28 Cb 0.42 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.44 1bd4 h ASP 28 CO -0.57 0.23 0.00 0.40 -1.61 0.00 0.00 179.24 177.69 1bd4 h ILE 29 N 0.63 1.11 0.10 2.25 1.08 -1.01 0.47 117.51 122.14 1bd4 h ILE 29 Ca 0.45 -0.32 0.02 0.00 -0.39 0.00 0.00 64.86 64.62 1bd4 h ILE 29 Cb 0.61 1.32 -0.04 0.00 -3.07 0.00 0.00 36.82 35.64 1bd4 h ILE 29 CO -0.35 0.08 -0.38 0.40 -0.69 0.00 0.00 178.15 177.22 1bd4 h ILE 30 N -0.13 0.22 -0.44 -0.67 2.04 -0.14 1.70 117.51 120.10 1bd4 h ILE 30 Ca 0.00 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 1bd4 h ILE 30 Cb 0.14 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1bd4 h ILE 30 CO -0.00 0.00 0.05 0.00 0.00 0.00 0.00 178.15 178.20 1bd4 h THR 31 N -0.60 1.25 -0.78 -0.27 1.03 0.12 -3.22 112.91 110.44 1bd4 h THR 31 Ca 0.03 -0.94 -0.05 0.00 -0.01 0.00 0.00 66.41 65.44 1bd4 h THR 31 Cb 0.63 1.01 -0.03 0.00 -1.07 0.00 0.00 68.15 68.69 1bd4 h THR 31 CO -0.23 0.33 0.31 -0.09 -0.01 0.00 0.00 175.52 175.82 1bd4 h ARG 32 N 0.60 1.17 -4.62 0.00 9.65 0.67 -3.40 114.38 118.45 1bd4 h ARG 32 Ca 0.13 -0.21 -0.65 0.00 -1.10 0.00 0.00 59.98 58.14 1bd4 h ARG 32 Cb 0.42 -0.19 -0.39 0.00 -1.39 0.00 0.00 29.97 28.42 1bd4 h ARG 32 CO 0.01 0.95 -0.75 -0.06 2.80 0.00 0.00 179.97 182.93 1bd4 s PHE 33 N -5.53 3.38 0.53 2.20 0.40 0.57 -4.97 117.98 114.56 1bd4 s PHE 33 Ca -0.12 -2.64 0.20 0.00 -0.60 0.00 0.00 56.93 53.77 1bd4 s PHE 33 Cb 0.16 -2.48 1.41 0.00 0.51 0.00 0.00 43.02 42.62 1bd4 s PHE 33 CO 0.84 -0.91 2.16 -1.00 0.70 0.00 0.00 175.22 177.01 1bd4 h PRO 34 N 7.71 0.00 -0.01 0.24 0.13 -1.78 -2.52 132.00 135.77 1bd4 h PRO 34 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1bd4 h PRO 34 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1bd4 h PRO 34 CO 0.49 0.02 0.00 0.09 -0.23 0.00 0.00 178.00 178.37 1bd4 n ASN 35 N -4.29 0.65 -4.69 1.44 3.02 -1.26 -4.82 115.26 105.31 1bd4 n ASN 35 Ca -0.03 -1.22 -0.35 0.00 -0.03 0.00 0.00 54.58 52.95 1bd4 n ASN 35 Cb 0.11 -0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.19 1bd4 n ASN 35 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bd4 s VAL 36 N -2.00 5.23 -0.18 2.41 0.11 -0.95 -2.20 120.40 122.81 1bd4 s VAL 36 Ca 0.43 0.13 -0.08 0.00 -2.93 0.00 0.00 61.98 59.53 1bd4 s VAL 36 Cb 0.21 -3.39 -0.04 0.00 -1.53 0.00 0.00 36.38 31.63 1bd4 s VAL 36 CO 0.35 0.42 0.07 0.68 -3.33 0.00 0.00 175.10 173.30 1bd4 s VAL 37 N 0.53 4.89 -0.25 2.04 -7.23 0.46 -4.94 120.40 115.90 1bd4 s VAL 37 Ca 0.07 0.00 -0.08 0.00 -1.81 0.00 0.00 61.98 60.16 1bd4 s VAL 37 Cb -0.12 -3.21 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 1bd4 s VAL 37 CO -0.00 0.46 0.10 -0.22 -0.31 0.00 0.00 175.10 175.13 1bd4 s LEU 38 N 0.36 3.63 0.35 1.32 2.96 -1.26 -1.78 118.68 124.27 1bd4 s LEU 38 Ca 0.04 -0.13 -0.27 0.00 -0.22 0.00 0.00 54.13 53.54 1bd4 s LEU 38 Cb -0.12 -1.98 -0.12 0.00 0.50 0.00 0.00 46.19 44.47 1bd4 s LEU 38 CO -0.00 -0.02 1.25 0.80 -1.32 0.00 0.00 176.35 177.05 1bd4 n MET 39 N 4.86 1.99 -1.70 1.98 0.00 -0.29 -4.84 117.12 119.11 1bd4 n MET 39 Ca -0.16 0.70 -0.59 0.00 -0.00 0.00 0.00 57.70 57.65 1bd4 n MET 39 Cb 0.52 -2.27 -0.08 0.00 0.00 0.00 0.00 33.22 31.39 1bd4 n MET 39 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1bd4 n LYS 40 N 0.48 0.97 -1.70 2.12 2.85 -1.26 -4.88 118.16 116.75 1bd4 n LYS 40 Ca 0.06 0.35 -0.40 0.00 -1.05 0.00 0.00 58.31 57.27 1bd4 n LYS 40 Cb 0.36 -2.02 -0.01 0.00 -0.65 0.00 0.00 35.03 32.71 1bd4 n LYS 40 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1bd4 n GLN 41 N 5.34 3.72 -1.62 -1.58 1.13 -1.26 -4.88 117.38 118.23 1bd4 n GLN 41 Ca 0.28 -2.76 -0.32 0.00 -1.94 0.00 0.00 57.00 52.26 1bd4 n GLN 41 Cb 0.10 -2.88 0.06 0.00 0.11 0.00 0.00 30.24 27.63 1bd4 n GLN 41 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1bd4 s THR 42 N 1.38 3.37 0.46 5.09 -4.23 -1.26 -4.89 115.64 115.56 1bd4 s THR 42 Ca 0.57 0.56 0.16 0.00 -1.18 0.00 0.00 61.69 61.80 1bd4 s THR 42 Cb 0.16 -3.09 0.20 0.00 1.34 0.00 0.00 72.50 71.12 1bd4 s THR 42 CO -0.07 -0.47 2.02 0.00 -0.54 0.00 0.00 174.62 175.57 1bd4 h ALA 43 N -0.34 1.71 0.11 3.99 0.00 -1.99 -1.71 119.26 121.01 1bd4 h ALA 43 Ca -0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 1bd4 h ALA 43 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1bd4 h ALA 43 CO 0.54 0.19 -0.05 1.96 0.00 0.00 0.00 179.25 181.89 1bd4 h GLN 44 N 0.00 -0.14 -0.80 0.00 1.08 -1.98 0.76 115.11 114.03 1bd4 h GLN 44 Ca -0.00 0.01 0.17 0.00 -1.45 0.00 0.00 58.65 57.38 1bd4 h GLN 44 Cb 0.28 0.03 -0.11 0.00 -0.05 0.00 0.00 27.48 27.63 1bd4 h GLN 44 CO 0.02 0.23 0.29 1.25 -0.95 0.00 0.00 178.83 179.66 1bd4 h LEU 45 N -0.53 0.20 -0.33 1.46 5.85 -1.75 0.28 115.31 120.49 1bd4 h LEU 45 Ca -0.01 0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1bd4 h LEU 45 Cb 0.43 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1bd4 h LEU 45 CO 0.02 0.02 -0.01 -0.09 -0.34 0.00 0.00 178.44 178.05 1bd4 h ARG 46 N 0.37 0.59 -0.35 1.25 2.43 -1.14 -1.41 114.38 116.12 1bd4 h ARG 46 Ca 0.46 -0.19 0.07 0.00 -0.81 0.00 0.00 59.98 59.51 1bd4 h ARG 46 Cb 0.80 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 30.23 1bd4 h ARG 46 CO -0.49 0.72 -0.08 0.00 -1.51 0.00 0.00 179.97 178.62 1bd4 h ALA 47 N 0.85 0.24 0.25 2.80 0.00 0.17 0.20 119.26 123.77 1bd4 h ALA 47 Ca 0.09 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1bd4 h ALA 47 Cb 0.46 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1bd4 h ALA 47 CO 0.02 -0.45 -0.38 0.52 0.00 0.00 0.00 179.25 178.96 1bd4 h MET 48 N 0.01 -0.67 -1.00 0.00 2.86 -0.39 -2.16 114.93 113.59 1bd4 h MET 48 Ca 0.17 0.05 0.16 0.00 -2.06 0.00 0.00 59.70 58.02 1bd4 h MET 48 Cb 0.25 0.15 -0.10 0.00 0.06 0.00 0.00 31.60 31.97 1bd4 h MET 48 CO -0.35 -0.45 0.62 1.98 1.06 0.00 0.00 176.91 179.78 1bd4 h MET 49 N -0.69 0.81 -0.68 1.72 -1.53 -0.57 -1.05 114.93 112.93 1bd4 h MET 49 Ca -0.00 -0.05 -0.05 0.00 -3.44 0.00 0.00 59.70 56.16 1bd4 h MET 49 Cb 0.67 -0.18 -0.03 0.00 -0.55 0.00 0.00 31.60 31.51 1bd4 h MET 49 CO -0.14 0.53 0.21 0.00 0.14 0.00 0.00 176.91 177.65 1bd4 h THR 50 N 0.83 1.25 -0.05 -0.77 1.03 -0.01 0.11 112.91 115.30 1bd4 h THR 50 Ca 0.54 -0.86 -0.02 0.00 -0.01 0.00 0.00 66.41 66.05 1bd4 h THR 50 Cb 0.76 0.50 -0.00 0.00 -1.07 0.00 0.00 68.15 68.34 1bd4 h THR 50 CO -0.32 0.34 -0.06 0.16 -0.01 0.00 0.00 175.52 175.63 1bd4 h ILE 51 N 1.00 1.39 0.00 0.00 -0.00 -0.78 -0.84 117.51 118.29 1bd4 h ILE 51 Ca 0.22 -1.25 -0.02 0.00 -0.00 0.00 0.00 64.86 63.81 1bd4 h ILE 51 Cb 0.29 2.12 -0.00 0.00 -0.00 0.00 0.00 36.82 39.22 1bd4 h ILE 51 CO -0.01 0.34 -0.09 -0.29 -0.00 0.00 0.00 178.15 178.10 1bd4 h ILE 52 N -0.34 0.43 0.00 0.16 2.10 -1.07 -2.38 117.51 116.40 1bd4 h ILE 52 Ca 0.01 -0.46 -0.19 0.00 1.08 0.00 0.00 64.86 65.30 1bd4 h ILE 52 Cb 0.58 1.32 -0.03 0.00 -1.09 0.00 0.00 36.82 37.60 1bd4 h ILE 52 CO 0.01 0.09 -1.09 0.03 -1.08 0.00 0.00 178.15 176.11 1bd4 h ARG 53 N 0.00 0.00 -6.29 2.19 3.08 -0.67 -3.46 114.38 109.23 1bd4 h ARG 53 Ca -0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.47 1bd4 h ARG 53 Cb 0.31 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.38 1bd4 h ARG 53 CO 0.01 0.61 1.20 -3.47 -1.07 0.00 0.00 179.97 177.25 1bd4 n ASP 54 N -3.15 3.76 -0.28 7.04 2.03 -0.33 -4.81 116.55 120.80 1bd4 n ASP 54 Ca -0.05 0.88 0.09 0.00 0.52 0.00 0.00 54.79 56.23 1bd4 n ASP 54 Cb 0.88 -1.46 0.24 0.00 -0.72 0.00 0.00 41.12 40.07 1bd4 n ASP 54 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1bd4 h LYS 55 N 10.36 0.36 0.00 -0.67 3.64 -1.88 -1.28 116.57 127.10 1bd4 h LYS 55 Ca -0.48 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1bd4 h LYS 55 Cb 1.26 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1bd4 h LYS 55 CO 0.95 0.24 0.00 0.39 -2.27 0.00 0.00 179.45 178.76 1bd4 n GLU 56 N -5.07 0.75 -2.96 1.90 1.02 -1.26 -4.84 120.64 110.18 1bd4 n GLU 56 Ca 0.18 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.92 1bd4 n GLU 56 Cb 0.55 -1.14 -0.04 0.00 -0.02 0.00 0.00 31.44 30.79 1bd4 n GLU 56 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1bd4 s THR 57 N -2.00 5.00 0.71 2.62 2.01 -0.49 -5.02 115.64 118.48 1bd4 s THR 57 Ca 0.10 1.59 -0.15 0.00 0.31 0.00 0.00 61.69 63.54 1bd4 s THR 57 Cb 0.05 -4.11 0.03 0.00 0.01 0.00 0.00 72.50 68.47 1bd4 s THR 57 CO 0.08 0.23 1.19 -2.84 -0.69 0.00 0.00 174.62 172.58 1bd4 s PRO 58 N 0.88 2.32 0.25 4.92 0.02 -1.26 -4.78 135.00 137.35 1bd4 s PRO 58 Ca 0.41 1.69 -0.05 0.00 0.02 0.00 0.00 61.00 63.07 1bd4 s PRO 58 Cb -0.18 -1.86 0.29 0.00 0.02 0.00 0.00 34.50 32.77 1bd4 s PRO 58 CO 0.20 -1.68 1.88 1.57 -0.33 0.00 0.00 177.00 178.64 1bd4 h LYS 59 N -0.16 1.16 -0.77 5.54 2.10 -1.95 -1.63 116.57 120.86 1bd4 h LYS 59 Ca -0.48 -0.14 -0.04 0.00 -2.00 0.00 0.00 60.65 58.00 1bd4 h LYS 59 Cb 1.29 -0.23 -0.03 0.00 -0.90 0.00 0.00 32.23 32.35 1bd4 h LYS 59 CO 0.51 0.85 0.33 1.05 -2.00 0.00 0.00 179.45 180.19 1bd4 h GLU 60 N 1.16 1.13 0.05 0.07 9.09 -1.96 -1.79 114.58 122.33 1bd4 h GLU 60 Ca 0.29 -0.19 -0.00 0.00 0.05 0.00 0.00 59.36 59.51 1bd4 h GLU 60 Cb 0.03 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 26.94 1bd4 h GLU 60 CO -0.05 0.91 -0.02 0.93 0.05 0.00 0.00 179.01 180.83 1bd4 h GLU 61 N 1.10 -0.06 -0.82 1.06 4.39 -1.87 -2.19 114.58 116.18 1bd4 h GLU 61 Ca 0.26 0.00 0.19 0.00 0.34 0.00 0.00 59.36 60.15 1bd4 h GLU 61 Cb 0.18 0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 28.73 1bd4 h GLU 61 CO -0.03 0.26 0.28 0.35 -1.16 0.00 0.00 179.01 178.72 1bd4 h PHE 62 N -0.39 0.46 -0.02 4.33 3.04 -1.21 0.17 116.94 123.32 1bd4 h PHE 62 Ca -0.01 0.04 -0.14 0.00 3.98 0.00 0.00 57.97 61.84 1bd4 h PHE 62 Cb 0.36 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.77 1bd4 h PHE 62 CO 0.04 -0.06 -0.65 -0.24 -2.02 0.00 0.00 178.31 175.38 1bd4 h VAL 63 N 0.34 1.44 0.72 1.41 3.04 -1.23 -0.85 116.25 121.13 1bd4 h VAL 63 Ca 0.48 -2.17 -0.04 0.00 -1.01 0.00 0.00 66.70 63.97 1bd4 h VAL 63 Cb 0.86 2.15 0.01 0.00 -2.01 0.00 0.00 31.29 32.30 1bd4 h VAL 63 CO -0.52 0.63 -0.35 0.15 -1.01 0.00 0.00 177.57 176.47 1bd4 h PHE 64 N 0.06 -0.90 -0.57 3.17 3.57 -0.13 -1.50 116.94 120.64 1bd4 h PHE 64 Ca -0.01 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1bd4 h PHE 64 Cb 1.15 0.30 -0.03 0.00 2.79 0.00 0.00 35.95 40.16 1bd4 h PHE 64 CO 0.01 -0.53 0.25 1.88 -2.23 0.00 0.00 178.31 177.69 1bd4 h TYR 65 N -1.10 0.84 -0.77 0.41 0.05 -0.93 -1.73 116.97 113.76 1bd4 h TYR 65 Ca -0.10 -0.05 0.10 0.00 0.05 0.00 0.00 58.73 58.73 1bd4 h TYR 65 Cb 0.77 -0.26 -0.08 0.00 1.01 0.00 0.00 36.73 38.17 1bd4 h TYR 65 CO -0.01 0.67 0.40 0.00 -1.05 0.00 0.00 178.16 178.17 1bd4 h ALA 66 N 1.09 1.09 -0.72 3.88 0.00 -1.14 0.52 119.26 123.98 1bd4 h ALA 66 Ca 0.19 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1bd4 h ALA 66 Cb 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1bd4 h ALA 66 CO -0.02 -0.01 0.19 -0.44 0.00 0.00 0.00 179.25 178.97 1bd4 h ASP 67 N 0.67 1.07 0.20 0.00 5.19 -0.95 0.44 116.42 123.04 1bd4 h ASP 67 Ca 0.38 -0.23 0.01 0.00 -0.62 0.00 0.00 57.03 56.57 1bd4 h ASP 67 Cb 0.41 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1bd4 h ASP 67 CO -0.28 1.02 -0.25 -0.09 -3.12 0.00 0.00 179.24 176.52 1bd4 h ARG 68 N 1.07 -0.49 -0.51 3.56 1.12 -0.31 -2.28 114.38 116.56 1bd4 h ARG 68 Ca 0.23 0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 59.07 1bd4 h ARG 68 Cb 0.35 0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 30.40 1bd4 h ARG 68 CO -0.00 -0.32 0.08 1.25 -3.11 0.00 0.00 179.97 177.87 1bd4 h LEU 69 N -0.51 0.81 -0.81 3.80 5.85 -0.71 -2.88 115.31 120.87 1bd4 h LEU 69 Ca 0.01 -0.26 0.12 0.00 0.84 0.00 0.00 57.88 58.58 1bd4 h LEU 69 Cb 0.49 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 41.22 1bd4 h LEU 69 CO -0.09 0.87 0.42 0.40 -0.34 0.00 0.00 178.44 179.70 1bd4 h ILE 70 N 0.72 0.81 -0.10 4.05 2.04 -0.74 0.12 117.51 124.42 1bd4 h ILE 70 Ca 0.15 -0.23 0.03 0.00 1.00 0.00 0.00 64.86 65.81 1bd4 h ILE 70 Cb 0.40 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1bd4 h ILE 70 CO 0.01 0.12 -0.08 -0.09 0.00 0.00 0.00 178.15 178.11 1bd4 h ARG 71 N 0.67 -0.10 -0.28 2.37 1.12 -1.19 0.28 114.38 117.25 1bd4 h ARG 71 Ca 0.41 0.01 -0.02 0.00 -1.11 0.00 0.00 59.98 59.27 1bd4 h ARG 71 Cb 0.49 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.46 1bd4 h ARG 71 CO -0.30 -0.06 0.09 -0.07 -3.11 0.00 0.00 179.97 176.52 1bd4 h LEU 72 N -0.10 0.41 -0.62 3.80 4.07 -1.15 -1.44 115.31 120.27 1bd4 h LEU 72 Ca 0.07 -0.20 0.08 0.00 0.08 0.00 0.00 57.88 57.91 1bd4 h LEU 72 Cb 0.20 -0.11 -0.06 0.00 1.08 0.00 0.00 40.66 41.77 1bd4 h LEU 72 CO -0.16 0.50 0.29 0.25 -1.08 0.00 0.00 178.44 178.24 1bd4 h LEU 73 N 0.30 0.37 -0.78 1.67 5.85 -0.48 -1.24 115.31 121.01 1bd4 h LEU 73 Ca 0.09 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1bd4 h LEU 73 Cb 0.23 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1bd4 h LEU 73 CO -0.00 0.23 0.33 0.40 -0.34 0.00 0.00 178.44 179.06 1bd4 h ILE 74 N 0.52 1.26 -0.87 4.05 1.08 -0.21 -2.18 117.51 121.17 1bd4 h ILE 74 Ca 0.30 -0.78 -0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1bd4 h ILE 74 Cb 0.29 0.32 -0.04 0.00 -3.07 0.00 0.00 36.82 34.31 1bd4 h ILE 74 CO -0.24 0.32 0.54 -0.08 -0.69 0.00 0.00 178.15 178.00 1bd4 h GLU 75 N 1.12 1.17 0.59 2.37 4.57 -0.36 -1.88 114.58 122.16 1bd4 h GLU 75 Ca 0.26 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.32 1bd4 h GLU 75 Cb 0.19 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 1bd4 h GLU 75 CO -0.02 0.81 -0.44 1.49 -1.18 0.00 0.00 179.01 179.66 1bd4 h GLU 76 N 1.19 -0.97 -0.28 1.92 4.57 -0.86 -2.80 114.58 117.35 1bd4 h GLU 76 Ca 0.31 0.07 0.07 0.00 -1.18 0.00 0.00 59.36 58.63 1bd4 h GLU 76 Cb -0.07 0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1bd4 h GLU 76 CO -0.06 -0.64 0.20 0.00 -1.18 0.00 0.00 179.01 177.32 1bd4 h ALA 77 N -0.78 2.20 0.00 2.92 0.00 -1.23 -0.03 119.26 122.34 1bd4 h ALA 77 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bd4 h ALA 77 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1bd4 h ALA 77 CO 0.02 -0.27 0.00 -0.07 0.00 0.00 0.00 179.25 178.93 1bd4 h LEU 78 N 0.05 0.00 0.00 0.00 3.38 -1.06 -0.53 115.31 117.15 1bd4 h LEU 78 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1bd4 h LEU 78 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1bd4 h LEU 78 CO -0.01 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.11 1bd4 n ASN 79 N -3.05 0.00 -0.61 -0.43 4.13 -0.02 -2.52 115.26 112.75 1bd4 n ASN 79 Ca -0.01 0.10 0.10 0.00 1.68 0.00 0.00 54.58 56.45 1bd4 n ASN 79 Cb 0.17 -0.31 0.33 0.00 -1.54 0.00 0.00 39.78 38.43 1bd4 n ASN 79 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1bd4 n GLU 80 N -1.31 1.79 -3.10 3.52 -0.58 -0.21 -4.85 120.64 115.90 1bd4 n GLU 80 Ca 0.08 -1.20 -0.25 0.00 -0.42 0.00 0.00 57.16 55.37 1bd4 n GLU 80 Cb 0.14 -1.39 -0.01 0.00 -0.57 0.00 0.00 31.44 29.62 1bd4 n GLU 80 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1bd4 s LEU 81 N -1.48 3.85 0.46 -4.62 2.01 -1.05 -5.08 118.68 112.77 1bd4 s LEU 81 Ca 0.32 0.60 -0.18 0.00 0.01 0.00 0.00 54.13 54.87 1bd4 s LEU 81 Cb 0.17 -3.49 -0.09 0.00 0.01 0.00 0.00 46.19 42.79 1bd4 s LEU 81 CO 0.25 -0.42 0.94 -2.84 1.01 0.00 0.00 176.35 175.29 1bd4 s PRO 82 N -4.48 4.06 -0.01 1.29 0.02 -1.26 -5.10 135.00 129.53 1bd4 s PRO 82 Ca 0.43 0.97 -0.17 0.00 0.02 0.00 0.00 61.00 62.25 1bd4 s PRO 82 Cb -0.10 -2.19 0.03 0.00 0.02 0.00 0.00 34.50 32.26 1bd4 s PRO 82 CO 0.39 -0.12 0.37 -0.59 -0.33 0.00 0.00 177.00 176.72 1bd4 s PHE 83 N -2.37 -0.25 0.54 6.54 -0.12 -1.26 -4.05 117.98 117.01 1bd4 s PHE 83 Ca 0.59 0.36 0.03 0.00 -0.05 0.00 0.00 56.93 57.87 1bd4 s PHE 83 Cb -0.10 0.16 0.05 0.00 -0.63 0.00 0.00 43.02 42.50 1bd4 s PHE 83 CO 0.22 -0.45 0.75 -1.14 -0.05 0.00 0.00 175.22 174.56 1bd4 s GLN 84 N -1.54 2.47 -0.11 1.99 2.00 0.54 -4.89 119.66 120.13 1bd4 s GLN 84 Ca -0.12 -1.02 -0.04 0.00 -2.00 0.00 0.00 55.36 52.18 1bd4 s GLN 84 Cb -0.04 -2.55 -0.04 0.00 0.80 0.00 0.00 33.01 31.19 1bd4 s GLN 84 CO 0.04 -0.72 0.04 0.21 -0.50 0.00 0.00 175.29 174.36 1bd4 s LYS 85 N -4.70 3.25 -0.03 1.67 2.36 -1.26 -1.23 119.74 119.80 1bd4 s LYS 85 Ca 0.58 -0.34 0.02 0.00 -2.55 0.00 0.00 55.97 53.69 1bd4 s LYS 85 Cb -0.09 -2.95 0.01 0.00 -1.05 0.00 0.00 37.83 33.75 1bd4 s LYS 85 CO 0.38 0.64 -0.08 0.21 1.55 0.00 0.00 175.35 178.05 1bd4 s LYS 86 N -0.70 0.92 -0.18 4.03 2.20 0.57 -4.80 119.74 121.79 1bd4 s LYS 86 Ca 0.12 -0.26 -0.03 0.00 -0.36 0.00 0.00 55.97 55.43 1bd4 s LYS 86 Cb -0.12 -0.87 -0.02 0.00 -1.51 0.00 0.00 37.83 35.32 1bd4 s LYS 86 CO 0.02 0.08 -0.07 -2.00 -0.36 0.00 0.00 175.35 173.02 1bd4 s GLU 87 N 0.31 3.46 0.48 4.03 2.12 -1.26 0.39 118.70 128.22 1bd4 s GLU 87 Ca -0.05 -0.61 0.03 0.00 0.36 0.00 0.00 54.97 54.70 1bd4 s GLU 87 Cb -0.09 -2.87 -0.03 0.00 0.26 0.00 0.00 34.13 31.39 1bd4 s GLU 87 CO 0.01 0.04 0.03 0.14 -0.54 0.00 0.00 175.26 174.94 1bd4 s VAL 88 N 0.85 1.47 -0.19 3.70 -7.23 0.21 -4.89 120.40 114.32 1bd4 s VAL 88 Ca -0.02 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.20 1bd4 s VAL 88 Cb -0.15 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.39 1bd4 s VAL 88 CO 0.01 0.00 -0.17 0.28 -0.31 0.00 0.00 175.10 174.91 1bd4 s THR 89 N -2.81 2.21 1.09 5.32 -1.32 -1.26 0.61 115.64 119.48 1bd4 s THR 89 Ca 0.17 -0.96 -0.12 0.00 -1.21 0.00 0.00 61.69 59.57 1bd4 s THR 89 Cb 0.04 -1.97 0.24 0.00 -1.51 0.00 0.00 72.50 69.30 1bd4 s THR 89 CO 0.09 0.47 1.06 -0.89 -2.21 0.00 0.00 174.62 173.14 1bd4 s THR 90 N 1.29 2.05 -0.13 5.08 2.01 0.34 -4.88 115.64 121.41 1bd4 s THR 90 Ca 0.04 0.02 0.28 0.00 0.31 0.00 0.00 61.69 62.34 1bd4 s THR 90 Cb -0.14 -2.08 0.30 0.00 0.01 0.00 0.00 72.50 70.60 1bd4 s THR 90 CO -0.11 -0.02 1.85 -0.65 -0.69 0.00 0.00 174.62 175.00 1bd4 h PRO 91 N -2.41 0.00 -0.81 4.92 0.11 -1.99 -2.22 132.00 129.61 1bd4 h PRO 91 Ca -0.56 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.44 1bd4 h PRO 91 Cb 1.32 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.36 1bd4 h PRO 91 CO 0.48 0.00 0.14 1.28 -0.21 0.00 0.00 178.00 179.69 1bd4 n LEU 92 N -2.56 4.61 -2.72 2.35 4.32 -1.26 -4.90 117.00 116.83 1bd4 n LEU 92 Ca 0.00 -2.37 -0.17 0.00 -0.02 0.00 0.00 56.01 53.45 1bd4 n LEU 92 Cb 0.19 -0.66 0.00 0.00 -1.62 0.00 0.00 43.42 41.33 1bd4 n LEU 92 CO 0.20 0.62 -0.12 0.47 -1.22 0.00 0.00 177.39 177.33 1bd4 n ASP 93 N 0.11 -4.48 -4.25 -1.43 9.92 -0.83 -4.98 116.55 110.60 1bd4 n ASP 93 Ca 0.25 -0.03 -0.25 0.00 -0.53 0.00 0.00 54.79 54.24 1bd4 n ASP 93 Cb 1.01 -3.74 -0.14 0.00 -0.64 0.00 0.00 41.12 37.62 1bd4 n ASP 93 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1bd4 s VAL 94 N -2.83 1.64 0.36 2.53 -7.23 -1.26 -4.91 120.40 108.71 1bd4 s VAL 94 Ca 0.13 -1.27 -0.26 0.00 -1.81 0.00 0.00 61.98 58.77 1bd4 s VAL 94 Cb -0.06 -1.45 -0.09 0.00 0.56 0.00 0.00 36.38 35.34 1bd4 s VAL 94 CO 0.16 0.13 1.06 -0.44 -0.31 0.00 0.00 175.10 175.69 1bd4 s SER 95 N -1.36 6.94 0.10 4.85 0.01 -1.26 -0.50 113.70 122.48 1bd4 s SER 95 Ca 0.07 2.10 0.07 0.00 1.31 0.00 0.00 55.95 59.49 1bd4 s SER 95 Cb -0.09 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 1bd4 s SER 95 CO 0.02 -0.37 -0.16 -0.47 0.41 0.00 0.00 173.24 172.67 1bd4 s TYR 96 N -1.50 1.49 -0.21 2.43 5.04 0.20 -4.88 117.35 119.92 1bd4 s TYR 96 Ca 0.53 -0.48 0.01 0.00 -2.44 0.00 0.00 57.07 54.70 1bd4 s TYR 96 Cb -0.25 -0.80 0.05 0.00 0.35 0.00 0.00 41.96 41.30 1bd4 s TYR 96 CO 0.31 0.15 -0.10 -1.01 -1.34 0.00 0.00 175.55 173.56 1bd4 s HIS 97 N -1.56 2.56 0.00 4.97 3.76 -1.26 0.67 115.29 124.42 1bd4 s HIS 97 Ca 0.05 -1.72 0.00 0.00 -0.15 0.00 0.00 55.06 53.24 1bd4 s HIS 97 Cb -0.08 -1.69 0.00 0.00 1.11 0.00 0.00 32.58 31.92 1bd4 s HIS 97 CO 0.03 -0.77 0.00 0.41 -0.85 0.00 0.00 174.74 173.56 1bd4 n GLY 98 N 4.64 5.29 3.31 -2.22 0.00 1.26 -4.94 105.19 112.53 1bd4 n GLY 98 Ca -0.15 -1.41 -0.19 0.00 0.00 0.00 0.00 46.02 44.27 1bd4 n GLY 98 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bd4 s VAL 99 N 1.46 0.00 -0.01 1.61 -7.23 -1.25 0.21 120.40 115.19 1bd4 s VAL 99 Ca 0.00 -1.96 -0.17 0.00 -1.81 0.00 0.00 61.98 58.03 1bd4 s VAL 99 Cb 0.00 -2.52 0.03 0.00 0.56 0.00 0.00 36.38 34.45 1bd4 s VAL 99 CO 0.00 0.00 0.37 -0.94 -0.31 0.00 0.00 175.10 174.22 1bd4 s SER 100 N -3.37 -0.26 -0.23 4.85 1.04 -0.36 -4.58 113.70 110.78 1bd4 s SER 100 Ca 0.40 0.15 -0.12 0.00 0.48 0.00 0.00 55.95 56.86 1bd4 s SER 100 Cb 0.02 0.36 -0.05 0.00 0.10 0.00 0.00 66.02 66.45 1bd4 s SER 100 CO 0.28 -0.50 0.23 -0.36 0.98 0.00 0.00 173.24 173.87 1bd4 s PHE 101 N -1.50 3.33 -0.16 5.02 0.40 -1.26 -0.34 117.98 123.47 1bd4 s PHE 101 Ca -0.12 0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.55 1bd4 s PHE 101 Cb -0.04 -2.35 0.00 0.00 0.51 0.00 0.00 43.02 41.14 1bd4 s PHE 101 CO 0.04 0.03 -0.16 1.52 0.70 0.00 0.00 175.22 177.36 1bd4 s TYR 102 N 1.16 2.78 0.00 0.36 1.13 -1.26 -4.99 117.35 116.54 1bd4 s TYR 102 Ca 0.11 -1.12 0.00 0.00 -1.41 0.00 0.00 57.07 54.65 1bd4 s TYR 102 Cb -0.14 -1.90 0.00 0.00 -1.10 0.00 0.00 41.96 38.82 1bd4 s TYR 102 CO 0.06 -0.53 0.00 0.43 -2.51 0.00 0.00 175.55 173.00 1bd4 n SER 103 N 4.17 0.00 -4.64 -0.18 7.64 -1.26 -4.81 113.62 114.54 1bd4 n SER 103 Ca -0.19 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.28 1bd4 n SER 103 Cb 0.51 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.66 1bd4 n SER 103 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1bd4 s LYS 104 N 0.00 4.15 0.00 1.43 -0.14 -1.26 -5.02 119.74 118.90 1bd4 s LYS 104 Ca 0.00 0.67 0.00 0.00 -1.36 0.00 0.00 55.97 55.28 1bd4 s LYS 104 Cb 0.00 -3.63 0.00 0.00 -1.68 0.00 0.00 37.83 32.52 1bd4 s LYS 104 CO 0.00 -0.40 0.00 0.44 -0.76 0.00 0.00 175.35 174.63 1bd4 n ILE 105 N 5.10 0.00 0.00 2.17 -5.35 -1.26 -1.82 119.36 118.20 1bd4 n ILE 105 Ca 0.01 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 1bd4 n ILE 105 Cb 0.49 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.39 1bd4 n ILE 105 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1bd4 s GLY 107 N 0.00 1.75 -0.05 0.00 0.00 -0.73 -0.98 107.32 107.31 1bd4 s GLY 107 Ca 0.00 -1.33 0.01 0.00 0.00 0.00 0.00 44.72 43.40 1bd4 s GLY 107 CO 0.00 -1.34 -0.04 0.14 0.00 0.00 0.00 173.10 171.86 1bd4 s VAL 108 N -1.67 0.57 0.17 1.40 1.01 0.18 -1.38 120.40 120.68 1bd4 s VAL 108 Ca 0.27 -0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1bd4 s VAL 108 Cb -0.10 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 1bd4 s VAL 108 CO 0.19 0.24 -0.02 -0.94 0.00 0.00 0.00 175.10 174.57 1bd4 s SER 109 N 1.06 4.67 -0.24 3.32 1.04 -0.83 -0.15 113.70 122.57 1bd4 s SER 109 Ca -0.09 -0.42 -0.08 0.00 0.48 0.00 0.00 55.95 55.84 1bd4 s SER 109 Cb -0.14 -0.96 -0.04 0.00 0.10 0.00 0.00 66.02 64.98 1bd4 s SER 109 CO -0.01 0.10 0.10 -0.63 0.98 0.00 0.00 173.24 173.78 1bd4 s ILE 110 N -1.69 4.70 0.16 -1.02 1.01 -1.03 -1.54 121.20 121.78 1bd4 s ILE 110 Ca 0.27 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 1bd4 s ILE 110 Cb -0.09 -3.19 -0.07 0.00 0.01 0.00 0.00 42.46 39.11 1bd4 s ILE 110 CO 0.18 0.34 1.11 -0.69 0.00 0.00 0.00 174.94 175.88 1bd4 s VAL 111 N 1.36 3.92 -0.10 2.92 1.01 0.49 -0.87 120.40 129.13 1bd4 s VAL 111 Ca 0.06 1.60 0.10 0.00 0.00 0.00 0.00 61.98 63.74 1bd4 s VAL 111 Cb -0.15 -4.02 -0.14 0.00 0.00 0.00 0.00 36.38 32.06 1bd4 s VAL 111 CO 0.05 0.25 0.07 -2.11 0.00 0.00 0.00 175.10 173.36 1bd4 n ARG 112 N 2.61 1.92 -0.33 2.72 1.85 -1.26 -4.47 116.66 119.68 1bd4 n ARG 112 Ca 0.04 -0.02 0.31 0.00 -1.00 0.00 0.00 57.85 57.17 1bd4 n ARG 112 Cb 0.46 -1.28 0.65 0.00 -1.05 0.00 0.00 32.46 31.24 1bd4 n ARG 112 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1bd4 h ALA 113 N 0.63 2.76 0.00 2.89 0.00 -1.93 0.09 119.26 123.69 1bd4 h ALA 113 Ca -0.26 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1bd4 h ALA 113 Cb 1.51 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1bd4 h ALA 113 CO 0.01 -1.15 0.00 0.41 0.00 0.00 0.00 179.25 178.53 1bd4 n GLY 114 N -1.64 -1.33 0.17 0.00 0.00 -0.05 -2.42 105.19 99.91 1bd4 n GLY 114 Ca 0.26 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.30 1bd4 n GLY 114 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bd4 h GLU 115 N 0.00 0.00 0.00 1.61 5.08 -1.09 -2.62 114.58 117.56 1bd4 h GLU 115 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bd4 h GLU 115 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1bd4 h GLU 115 CO 0.00 0.47 0.00 -1.13 -1.00 0.00 0.00 179.01 177.35 1bd4 n SER 116 N -3.58 0.44 -0.01 1.42 3.41 -1.02 -2.09 113.62 112.19 1bd4 n SER 116 Ca -0.00 0.68 0.11 0.00 -0.26 0.00 0.00 58.87 59.39 1bd4 n SER 116 Cb 0.57 -0.75 -0.16 0.00 -0.26 0.00 0.00 64.21 63.61 1bd4 n SER 116 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1bd4 n MET 117 N -2.06 0.55 0.24 4.33 2.81 -0.99 -4.35 117.12 117.65 1bd4 n MET 117 Ca -0.00 -0.16 0.08 0.00 -1.81 0.00 0.00 57.70 55.81 1bd4 n MET 117 Cb 0.07 -1.50 0.60 0.00 -0.71 0.00 0.00 33.22 31.68 1bd4 n MET 117 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1bd4 h GLU 118 N 0.00 0.00 0.18 0.03 5.08 -1.47 -1.90 114.58 116.49 1bd4 h GLU 118 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1bd4 h GLU 118 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1bd4 h GLU 118 CO 0.00 0.14 -0.08 0.66 -1.00 0.00 0.00 179.01 178.73 1bd4 h SER 119 N 0.00 -0.20 -0.72 1.42 4.64 -1.76 0.21 113.55 117.14 1bd4 h SER 119 Ca -0.00 -0.10 0.08 0.00 -0.47 0.00 0.00 61.79 61.30 1bd4 h SER 119 Cb 0.29 0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 62.36 1bd4 h SER 119 CO 0.02 -0.02 0.38 1.23 -0.87 0.00 0.00 176.83 177.57 1bd4 h GLY 120 N -0.37 1.08 1.55 -0.77 0.00 -1.70 0.15 103.07 103.01 1bd4 h GLY 120 Ca -0.02 -0.25 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1bd4 h GLY 120 CO 0.04 0.10 -0.11 -2.00 0.00 0.00 0.00 176.54 174.57 1bd4 h LEU 121 N 0.67 0.52 -0.22 3.11 5.85 -0.97 -1.90 115.31 122.37 1bd4 h LEU 121 Ca 0.34 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 1bd4 h LEU 121 Cb 0.31 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1bd4 h LEU 121 CO -0.24 0.67 -0.33 0.03 -0.34 0.00 0.00 178.44 178.23 1bd4 h ARG 122 N 0.50 0.00 -0.18 1.25 2.47 0.69 -2.10 114.38 117.01 1bd4 h ARG 122 Ca 0.09 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.70 1bd4 h ARG 122 Cb 0.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 1bd4 h ARG 122 CO 0.03 0.33 -0.38 0.00 0.56 0.00 0.00 179.97 180.51 1bd4 h ALA 123 N 1.67 1.01 0.00 0.04 0.00 0.06 -3.29 119.26 118.75 1bd4 h ALA 123 Ca -0.00 -0.41 -0.27 0.00 0.00 0.00 0.00 54.91 54.23 1bd4 h ALA 123 Cb 1.17 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1bd4 h ALA 123 CO 0.04 0.60 -2.14 1.55 0.00 0.00 0.00 179.25 179.31 1bd4 n VAL 124 N -4.04 1.12 -3.94 0.00 3.14 -1.05 -4.78 118.33 108.79 1bd4 n VAL 124 Ca -0.01 -0.76 -0.31 0.00 -2.96 0.00 0.00 64.34 60.30 1bd4 n VAL 124 Cb 0.48 -0.46 -0.15 0.00 -1.06 0.00 0.00 33.84 32.65 1bd4 n VAL 124 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1bd4 s ARG 126 N 1.14 4.17 -1.68 0.00 3.00 -1.25 -2.94 118.95 121.39 1bd4 s ARG 126 Ca 0.09 2.48 0.00 0.00 0.00 0.00 0.00 55.73 58.30 1bd4 s ARG 126 Cb -0.19 -3.41 0.00 0.00 0.00 0.00 0.00 34.95 31.36 1bd4 s ARG 126 CO -0.13 -0.75 0.00 0.41 0.00 0.00 0.00 175.30 174.83 1bd4 n GLY 127 N 4.03 0.55 3.72 -3.53 0.00 -1.26 -4.96 105.19 103.73 1bd4 n GLY 127 Ca 0.16 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1bd4 n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bd4 s VAL 128 N -2.79 2.59 0.38 1.61 0.11 -1.15 -4.95 120.40 116.20 1bd4 s VAL 128 Ca 0.00 0.41 -0.28 0.00 -2.93 0.00 0.00 61.98 59.18 1bd4 s VAL 128 Cb 0.00 -3.26 -0.10 0.00 -1.53 0.00 0.00 36.38 31.48 1bd4 s VAL 128 CO 0.00 0.03 1.44 -0.13 -3.33 0.00 0.00 175.10 173.11 1bd4 s ARG 129 N 1.22 4.07 -0.08 1.54 0.52 -1.26 -4.86 118.95 120.09 1bd4 s ARG 129 Ca 0.71 2.48 0.02 0.00 -0.52 0.00 0.00 55.73 58.42 1bd4 s ARG 129 Cb -0.44 -2.92 0.01 0.00 0.52 0.00 0.00 34.95 32.12 1bd4 s ARG 129 CO 0.31 -0.53 -0.15 0.42 0.02 0.00 0.00 175.30 175.38 1bd4 s ILE 130 N -1.14 1.37 0.22 1.52 1.01 -1.26 -1.77 121.20 121.15 1bd4 s ILE 130 Ca 0.54 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.66 1bd4 s ILE 130 Cb -0.45 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 1bd4 s ILE 130 CO 0.60 0.41 0.17 -0.83 0.00 0.00 0.00 174.94 175.29 1bd4 s GLY 131 N 0.76 1.51 0.01 6.18 0.00 -0.48 -4.79 107.32 110.52 1bd4 s GLY 131 Ca -0.12 -1.36 0.03 0.00 0.00 0.00 0.00 44.72 43.27 1bd4 s GLY 131 CO 0.02 -1.39 -0.09 0.54 0.00 0.00 0.00 173.10 172.18 1bd4 s LYS 132 N -3.59 0.69 -0.04 2.90 1.02 0.35 -1.97 119.74 119.09 1bd4 s LYS 132 Ca 0.32 -0.49 -0.00 0.00 0.02 0.00 0.00 55.97 55.82 1bd4 s LYS 132 Cb -0.08 -0.64 0.03 0.00 -0.52 0.00 0.00 37.83 36.61 1bd4 s LYS 132 CO 0.24 0.16 0.01 0.42 -0.92 0.00 0.00 175.35 175.27 1bd4 s ILE 133 N -0.57 0.18 -0.21 2.17 1.01 -0.59 -0.87 121.20 122.32 1bd4 s ILE 133 Ca 0.00 0.15 -0.03 0.00 0.00 0.00 0.00 60.65 60.77 1bd4 s ILE 133 Cb -0.06 -0.32 -0.00 0.00 0.01 0.00 0.00 42.46 42.09 1bd4 s ILE 133 CO 0.00 0.18 -0.07 -0.22 0.00 0.00 0.00 174.94 174.83 1bd4 s LEU 134 N 1.44 2.76 0.03 2.97 2.96 0.47 -0.38 118.68 128.93 1bd4 s LEU 134 Ca -0.04 -0.43 0.08 0.00 -0.22 0.00 0.00 54.13 53.52 1bd4 s LEU 134 Cb -0.13 -1.69 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 1bd4 s LEU 134 CO -0.03 -0.01 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.14 1bd4 s ILE 135 N 1.39 1.80 -0.06 6.68 1.09 -1.26 0.13 121.20 130.97 1bd4 s ILE 135 Ca 0.05 -1.20 0.01 0.00 -1.10 0.00 0.00 60.65 58.40 1bd4 s ILE 135 Cb -0.14 -1.54 0.02 0.00 -1.06 0.00 0.00 42.46 39.74 1bd4 s ILE 135 CO -0.04 0.29 -0.06 -1.58 -0.10 0.00 0.00 174.94 173.45 1bd4 s GLN 136 N -1.08 1.02 -0.29 2.79 2.00 0.63 -4.84 119.66 119.89 1bd4 s GLN 136 Ca 0.09 -0.15 -0.29 0.00 -2.00 0.00 0.00 55.36 53.01 1bd4 s GLN 136 Cb -0.09 -1.03 -0.01 0.00 0.80 0.00 0.00 33.01 32.68 1bd4 s GLN 136 CO 0.01 -0.11 1.49 0.50 -0.50 0.00 0.00 175.29 176.69 1bd4 s ARG 137 N 1.09 3.74 0.40 1.67 6.06 -1.26 0.86 118.95 131.52 1bd4 s ARG 137 Ca -0.08 1.36 -0.24 0.00 -2.50 0.00 0.00 55.73 54.27 1bd4 s ARG 137 Cb -0.14 -4.00 -0.12 0.00 0.06 0.00 0.00 34.95 30.75 1bd4 s ARG 137 CO -0.01 -1.35 0.76 -3.47 -2.50 0.00 0.00 175.30 168.73 1bd4 n ASP 138 N 8.44 0.09 0.09 -2.12 2.03 -0.54 -4.80 116.55 119.74 1bd4 n ASP 138 Ca 0.17 0.99 -0.05 0.00 0.52 0.00 0.00 54.79 56.42 1bd4 n ASP 138 Cb 0.46 -1.21 0.12 0.00 -0.72 0.00 0.00 41.12 39.77 1bd4 n ASP 138 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1bd4 h GLU 139 N 1.17 0.21 0.22 -0.67 4.11 -1.92 -2.06 114.58 115.64 1bd4 h GLU 139 Ca -0.41 -0.15 -0.01 0.00 0.07 0.00 0.00 59.36 58.86 1bd4 h GLU 139 Cb 1.37 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.65 1bd4 h GLU 139 CO 0.54 0.76 -0.11 1.15 0.07 0.00 0.00 179.01 181.43 1bd4 h THR 140 N 0.16 0.00 0.00 -1.06 2.02 -2.00 -3.45 112.91 108.58 1bd4 h THR 140 Ca -0.01 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1bd4 h THR 140 Cb 1.12 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1bd4 h THR 140 CO 0.09 0.00 0.00 0.35 0.37 0.00 0.00 175.52 176.33 1bd4 n THR 141 N -3.83 0.00 0.00 3.16 -2.24 -1.26 -5.05 114.28 105.06 1bd4 n THR 141 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1bd4 n THR 141 Cb 0.12 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1bd4 n THR 141 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bd4 n ALA 142 N -3.00 0.00 -2.06 6.98 0.00 -0.77 -4.85 120.51 116.81 1bd4 n ALA 142 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1bd4 n ALA 142 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1bd4 n ALA 142 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1bd4 s GLU 143 N 0.00 4.24 0.36 0.00 2.12 -1.26 -4.08 118.70 120.08 1bd4 s GLU 143 Ca 0.00 2.17 -0.28 0.00 0.36 0.00 0.00 54.97 57.22 1bd4 s GLU 143 Cb 0.00 -3.55 -0.12 0.00 0.26 0.00 0.00 34.13 30.72 1bd4 s GLU 143 CO 0.00 -0.65 1.44 -2.30 -0.54 0.00 0.00 175.26 173.21 1bd4 n PRO 144 N 5.36 2.50 -4.47 4.30 -0.02 -1.26 -1.47 135.00 139.93 1bd4 n PRO 144 Ca 0.14 0.88 -0.20 0.00 -2.02 0.00 0.00 63.50 62.30 1bd4 n PRO 144 Cb 0.42 -2.57 -0.15 0.00 -0.02 0.00 0.00 33.50 31.18 1bd4 n PRO 144 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1bd4 s LYS 145 N -1.87 0.95 -0.51 -0.52 1.02 0.25 -4.85 119.74 114.21 1bd4 s LYS 145 Ca 0.55 -0.38 -0.28 0.00 0.02 0.00 0.00 55.97 55.88 1bd4 s LYS 145 Cb -0.51 -0.90 0.02 0.00 -0.52 0.00 0.00 37.83 35.92 1bd4 s LYS 145 CO 0.62 0.21 1.33 -1.17 -0.92 0.00 0.00 175.35 175.42 1bd4 s LEU 146 N -0.13 3.50 -0.03 3.17 2.96 -1.26 0.23 118.68 127.12 1bd4 s LEU 146 Ca 0.02 0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 54.20 1bd4 s LEU 146 Cb -0.06 -3.29 -0.32 0.00 0.50 0.00 0.00 46.19 43.02 1bd4 s LEU 146 CO -0.00 -1.52 0.84 0.40 -1.32 0.00 0.00 176.35 174.74 1bd4 h ILE 147 N 6.35 1.26 -2.29 6.68 1.08 0.76 -3.48 117.51 127.87 1bd4 h ILE 147 Ca -0.26 -2.57 -0.05 0.00 -0.39 0.00 0.00 64.86 61.59 1bd4 h ILE 147 Cb 1.08 3.00 -0.17 0.00 -3.07 0.00 0.00 36.82 37.66 1bd4 h ILE 147 CO 1.15 0.77 0.18 -0.47 -0.69 0.00 0.00 178.15 179.08 1bd4 s TYR 148 N -2.52 -0.61 -0.27 1.37 5.04 -0.57 -4.98 117.35 114.81 1bd4 s TYR 148 Ca -0.13 0.89 -0.19 0.00 -2.44 0.00 0.00 57.07 55.20 1bd4 s TYR 148 Cb 0.03 0.44 0.07 0.00 0.35 0.00 0.00 41.96 42.85 1bd4 s TYR 148 CO 0.86 -0.67 0.68 -1.83 -1.34 0.00 0.00 175.55 173.26 1bd4 s GLU 149 N -1.86 0.74 -0.20 4.97 4.04 -1.26 0.18 118.70 125.30 1bd4 s GLU 149 Ca -0.08 1.12 -0.04 0.00 0.04 0.00 0.00 54.97 56.01 1bd4 s GLU 149 Cb -0.00 0.23 0.06 0.00 0.02 0.00 0.00 34.13 34.44 1bd4 s GLU 149 CO 0.04 -0.13 0.07 0.15 -1.84 0.00 0.00 175.26 173.55 1bd4 s LYS 150 N 1.16 0.36 0.24 -4.83 -0.14 -0.05 -4.99 119.74 111.49 1bd4 s LYS 150 Ca -0.06 -0.31 0.07 0.00 -1.36 0.00 0.00 55.97 54.31 1bd4 s LYS 150 Cb -0.05 -1.91 -0.05 0.00 -1.68 0.00 0.00 37.83 34.13 1bd4 s LYS 150 CO -0.12 -0.70 -0.11 -0.51 -0.76 0.00 0.00 175.35 173.15 1bd4 s LEU 151 N 1.99 2.52 0.74 3.17 1.43 -1.26 -0.50 118.68 126.77 1bd4 s LEU 151 Ca 0.02 -1.09 -0.15 0.00 -1.03 0.00 0.00 54.13 51.87 1bd4 s LEU 151 Cb -0.17 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.40 1bd4 s LEU 151 CO -0.11 -0.23 1.04 -2.65 0.23 0.00 0.00 176.35 174.62 1bd4 n PRO 152 N -0.48 0.48 0.29 1.29 -0.02 -1.26 -4.92 135.00 130.37 1bd4 n PRO 152 Ca -0.07 0.22 -0.14 0.00 -2.02 0.00 0.00 63.50 61.49 1bd4 n PRO 152 Cb 0.62 -2.29 -0.08 0.00 -0.02 0.00 0.00 33.50 31.73 1bd4 n PRO 152 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bd4 h ALA 153 N -0.35 -0.75 -0.08 3.55 0.00 -2.02 -3.26 119.26 116.36 1bd4 h ALA 153 Ca -0.47 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.20 1bd4 h ALA 153 Cb 1.33 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 1bd4 h ALA 153 CO 0.47 -0.78 0.05 -0.40 0.00 0.00 0.00 179.25 178.60 1bd4 n ASP 154 N -5.31 3.38 0.26 0.00 5.75 -1.26 -4.55 116.55 114.82 1bd4 n ASP 154 Ca -0.11 -2.18 0.09 0.00 -0.01 0.00 0.00 54.79 52.58 1bd4 n ASP 154 Cb 0.33 -0.60 0.65 0.00 -1.03 0.00 0.00 41.12 40.47 1bd4 n ASP 154 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1bd4 h ILE 155 N 0.20 0.93 -0.35 2.12 2.10 -1.94 -2.19 117.51 118.37 1bd4 h ILE 155 Ca 0.05 -0.22 0.10 0.00 1.08 0.00 0.00 64.86 65.87 1bd4 h ILE 155 Cb 1.13 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 37.97 1bd4 h ILE 155 CO 0.09 0.06 0.33 0.08 -1.08 0.00 0.00 178.15 177.63 1bd4 h ARG 156 N 0.00 0.00 -0.68 2.19 0.11 -1.80 0.17 114.38 114.37 1bd4 h ARG 156 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1bd4 h ARG 156 Cb 0.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.20 1bd4 h ARG 156 CO 0.01 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.47 1bd4 n GLU 157 N -3.94 2.95 -4.49 0.08 1.02 -0.82 -4.51 120.64 110.94 1bd4 n GLU 157 Ca 0.06 -2.55 -0.26 0.00 -0.02 0.00 0.00 57.16 54.38 1bd4 n GLU 157 Cb 0.49 -1.65 -0.10 0.00 -0.02 0.00 0.00 31.44 30.16 1bd4 n GLU 157 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bd4 s ARG 158 N -1.36 1.94 0.11 3.49 0.52 0.04 -4.86 118.95 118.84 1bd4 s ARG 158 Ca 0.47 -1.93 -0.19 0.00 -0.52 0.00 0.00 55.73 53.56 1bd4 s ARG 158 Cb 0.26 -1.76 -0.07 0.00 0.52 0.00 0.00 34.95 33.91 1bd4 s ARG 158 CO 0.28 0.07 0.60 -1.58 0.02 0.00 0.00 175.30 174.69 1bd4 s TRP 159 N -2.61 3.75 -0.17 -0.53 0.52 -0.75 -4.82 118.94 114.32 1bd4 s TRP 159 Ca 0.34 1.27 -0.01 0.00 0.02 0.00 0.00 56.10 57.72 1bd4 s TRP 159 Cb 0.04 -2.50 -0.00 0.00 -1.15 0.00 0.00 33.47 29.86 1bd4 s TRP 159 CO 0.18 0.52 -0.13 0.08 0.02 0.00 0.00 176.95 177.62 1bd4 s VAL 160 N -1.24 2.78 -0.54 4.03 1.01 -0.43 -2.45 120.40 123.56 1bd4 s VAL 160 Ca 0.33 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.44 1bd4 s VAL 160 Cb -0.18 -2.20 0.13 0.00 0.00 0.00 0.00 36.38 34.13 1bd4 s VAL 160 CO 0.20 0.50 0.49 -0.04 0.00 0.00 0.00 175.10 176.25 1bd4 s MET 161 N 1.02 2.95 -0.17 2.72 -1.94 -0.16 -0.15 119.30 123.58 1bd4 s MET 161 Ca -0.01 -1.75 -0.20 0.00 -1.71 0.00 0.00 55.69 52.02 1bd4 s MET 161 Cb -0.15 -4.26 -0.03 0.00 2.01 0.00 0.00 34.83 32.40 1bd4 s MET 161 CO -0.03 -1.31 0.60 -1.17 -0.01 0.00 0.00 175.02 173.10 1bd4 s LEU 162 N 1.51 4.19 -0.26 -0.03 2.96 -0.02 0.50 118.68 127.53 1bd4 s LEU 162 Ca 0.04 0.85 -0.05 0.00 -0.22 0.00 0.00 54.13 54.76 1bd4 s LEU 162 Cb -0.29 -2.86 0.01 0.00 0.50 0.00 0.00 46.19 43.55 1bd4 s LEU 162 CO 0.02 -0.19 0.01 -0.76 -1.32 0.00 0.00 176.35 174.11 1bd4 s LEU 163 N 1.52 3.40 -0.35 -0.68 1.02 0.79 -0.66 118.68 123.71 1bd4 s LEU 163 Ca 0.29 -0.64 0.07 0.00 0.02 0.00 0.00 54.13 53.87 1bd4 s LEU 163 Cb -0.16 -1.79 0.19 0.00 0.02 0.00 0.00 46.19 44.45 1bd4 s LEU 163 CO 0.11 -0.12 0.60 -0.62 0.02 0.00 0.00 176.35 176.35 1bd4 s ASP 164 N 1.45 -1.52 0.48 2.29 -1.08 -0.94 -2.46 116.67 114.89 1bd4 s ASP 164 Ca 0.03 -0.30 0.35 0.00 -0.52 0.00 0.00 52.55 52.11 1bd4 s ASP 164 Cb -0.16 1.97 1.50 0.00 -1.46 0.00 0.00 42.92 44.78 1bd4 s ASP 164 CO -0.01 -0.24 1.64 1.55 0.52 0.00 0.00 175.17 178.63 1bd4 h PRO 165 N 7.52 0.07 -6.60 4.34 0.13 -1.83 -3.41 132.00 132.22 1bd4 h PRO 165 Ca 0.02 -0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.45 1bd4 h PRO 165 Cb 1.18 -0.02 -0.27 0.00 0.13 0.00 0.00 31.00 32.03 1bd4 h PRO 165 CO 0.13 0.04 -0.86 -1.64 -0.23 0.00 0.00 178.00 175.44 1bd4 s MET 166 N -5.16 2.07 -0.39 0.86 -1.94 -1.26 -1.69 119.30 111.78 1bd4 s MET 166 Ca -0.07 -0.96 0.02 0.00 -1.71 0.00 0.00 55.69 52.97 1bd4 s MET 166 Cb 0.28 -2.09 0.15 0.00 2.01 0.00 0.00 34.83 35.18 1bd4 s MET 166 CO 0.84 0.55 0.26 0.00 -0.01 0.00 0.00 175.02 176.66 1bd4 n ALA 168 N 3.53 0.00 0.06 0.00 0.00 -1.26 -2.27 120.51 120.57 1bd4 n ALA 168 Ca 0.17 -0.04 0.02 0.00 0.00 0.00 0.00 53.44 53.59 1bd4 n ALA 168 Cb 0.40 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.80 1bd4 n ALA 168 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1bd4 h THR 169 N 0.00 0.50 0.00 0.00 1.35 -1.91 -2.11 112.91 110.73 1bd4 h THR 169 Ca 0.00 -1.91 0.00 0.00 -0.55 0.00 0.00 66.41 63.95 1bd4 h THR 169 Cb 0.00 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1bd4 h THR 169 CO 0.00 0.28 0.00 0.00 -0.25 0.00 0.00 175.52 175.55 1bd4 n ALA 170 N -2.34 0.00 -0.04 6.62 0.00 -1.26 -4.62 120.51 118.87 1bd4 n ALA 170 Ca -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.28 1bd4 n ALA 170 Cb 0.79 -0.10 -0.03 0.00 0.00 0.00 0.00 19.45 20.11 1bd4 n ALA 170 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1bd4 h GLY 171 N 0.00 0.23 0.91 0.00 0.00 -1.95 -0.56 103.07 101.71 1bd4 h GLY 171 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 1bd4 h GLY 171 CO 0.00 0.03 -0.31 1.76 0.00 0.00 0.00 176.54 178.02 1bd4 h SER 172 N 0.16 -0.76 -0.25 0.19 0.02 -1.98 -2.20 113.55 108.73 1bd4 h SER 172 Ca 0.08 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1bd4 h SER 172 Cb 0.05 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1bd4 h SER 172 CO -0.09 -0.49 0.06 1.62 -1.14 0.00 0.00 176.83 176.79 1bd4 h VAL 173 N -0.79 1.17 -0.45 2.27 3.04 -1.93 0.17 116.25 119.72 1bd4 h VAL 173 Ca -0.07 -0.61 -0.14 0.00 -1.01 0.00 0.00 66.70 64.87 1bd4 h VAL 173 Cb 0.64 0.85 -0.01 0.00 -2.01 0.00 0.00 31.29 30.75 1bd4 h VAL 173 CO 0.09 0.22 -0.25 0.00 -1.01 0.00 0.00 177.57 176.61 1bd4 h LYS 175 N 0.82 0.71 -0.78 0.00 3.11 -0.94 -0.40 116.57 119.09 1bd4 h LYS 175 Ca 0.10 -0.14 0.04 0.00 -2.81 0.00 0.00 60.65 57.84 1bd4 h LYS 175 Cb 0.83 -0.11 -0.05 0.00 -1.00 0.00 0.00 32.23 31.89 1bd4 h LYS 175 CO 0.07 0.65 0.49 0.00 -2.81 0.00 0.00 179.45 177.85 1bd4 h ALA 176 N 1.02 1.04 -0.51 5.00 0.00 -0.10 -1.89 119.26 123.82 1bd4 h ALA 176 Ca 0.15 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1bd4 h ALA 176 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1bd4 h ALA 176 CO -0.01 0.27 -0.09 0.82 0.00 0.00 0.00 179.25 180.23 1bd4 h ILE 177 N 0.93 1.26 -0.28 0.00 2.04 -0.52 -1.96 117.51 118.98 1bd4 h ILE 177 Ca 0.32 -1.22 0.07 0.00 1.00 0.00 0.00 64.86 65.03 1bd4 h ILE 177 Cb 0.06 0.97 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 1bd4 h ILE 177 CO -0.13 0.43 -0.31 -0.08 0.00 0.00 0.00 178.15 178.06 1bd4 h GLU 178 N 0.85 -0.29 -0.55 2.37 4.81 -0.29 0.36 114.58 121.84 1bd4 h GLU 178 Ca 0.14 0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1bd4 h GLU 178 Cb 0.63 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1bd4 h GLU 178 CO 0.04 -0.19 -0.02 -0.24 -0.73 0.00 0.00 179.01 177.87 1bd4 h VAL 179 N -0.30 1.27 -0.44 0.32 3.04 -1.26 0.16 116.25 119.03 1bd4 h VAL 179 Ca 0.14 -1.14 0.07 0.00 -1.01 0.00 0.00 66.70 64.75 1bd4 h VAL 179 Cb 0.53 0.90 -0.06 0.00 -2.01 0.00 0.00 31.29 30.66 1bd4 h VAL 179 CO -0.45 0.41 0.12 -0.07 -1.01 0.00 0.00 177.57 176.57 1bd4 h LEU 180 N 0.86 0.07 -0.94 3.16 -0.00 -0.80 0.90 115.31 118.56 1bd4 h LEU 180 Ca 0.15 0.07 -0.05 0.00 -0.00 0.00 0.00 57.88 58.05 1bd4 h LEU 180 Cb 0.56 0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 41.27 1bd4 h LEU 180 CO 0.03 0.07 0.16 -0.07 -0.00 0.00 0.00 178.44 178.63 1bd4 h LEU 181 N 0.26 0.88 -1.81 1.67 3.38 0.14 -1.64 115.31 118.18 1bd4 h LEU 181 Ca 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1bd4 h LEU 181 Cb 0.25 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1bd4 h LEU 181 CO -0.26 0.84 -0.03 -0.09 0.09 0.00 0.00 178.44 178.99 1bd4 h ARG 182 N 0.90 0.08 0.00 1.13 2.43 0.16 -1.65 114.38 117.42 1bd4 h ARG 182 Ca 0.20 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1bd4 h ARG 182 Cb 0.31 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1bd4 h ARG 182 CO -0.00 0.12 0.00 1.28 -1.51 0.00 0.00 179.97 179.86 1bd4 n LEU 183 N -4.45 0.00 0.00 3.80 4.32 -0.20 -4.89 117.00 115.57 1bd4 n LEU 183 Ca -0.02 0.30 0.00 0.00 -0.02 0.00 0.00 56.01 56.27 1bd4 n LEU 183 Cb 0.14 -0.30 0.00 0.00 -1.62 0.00 0.00 43.42 41.64 1bd4 n LEU 183 CO 0.35 -0.01 0.00 0.61 -1.22 0.00 0.00 177.39 177.12 1bd4 n GLY 184 N 1.22 0.95 3.76 -0.72 0.00 -0.62 -4.56 105.19 105.21 1bd4 n GLY 184 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1bd4 n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bd4 s VAL 185 N -2.00 3.35 -0.01 1.61 1.01 -0.95 -4.64 120.40 118.77 1bd4 s VAL 185 Ca 0.00 1.33 -0.28 0.00 0.00 0.00 0.00 61.98 63.03 1bd4 s VAL 185 Cb 0.00 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1bd4 s VAL 185 CO 0.00 0.31 0.91 -0.54 0.00 0.00 0.00 175.10 175.77 1bd4 s LYS 186 N -1.37 4.53 0.31 2.72 -0.14 -1.26 -4.49 119.74 120.04 1bd4 s LYS 186 Ca 0.46 1.29 0.07 0.00 -1.36 0.00 0.00 55.97 56.43 1bd4 s LYS 186 Cb -0.34 -3.45 0.78 0.00 -1.68 0.00 0.00 37.83 33.14 1bd4 s LYS 186 CO 0.43 -0.01 1.76 1.49 -0.76 0.00 0.00 175.35 178.26 1bd4 h GLU 187 N 6.74 0.70 0.00 1.68 4.81 -1.93 0.59 114.58 127.17 1bd4 h GLU 187 Ca -0.41 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1bd4 h GLU 187 Cb 1.21 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1bd4 h GLU 187 CO 0.75 0.46 0.00 0.39 -0.73 0.00 0.00 179.01 179.88 1bd4 n GLU 188 N -4.80 0.06 -0.13 1.92 1.02 -1.25 -2.27 120.64 115.19 1bd4 n GLU 188 Ca 0.24 0.15 0.12 0.00 -0.02 0.00 0.00 57.16 57.65 1bd4 n GLU 188 Cb 0.62 -1.50 0.22 0.00 -0.02 0.00 0.00 31.44 30.76 1bd4 n GLU 188 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1bd4 n ARG 189 N -1.45 2.34 -3.47 3.49 1.74 0.20 -4.87 116.66 114.64 1bd4 n ARG 189 Ca 0.06 -2.01 -0.37 0.00 -0.77 0.00 0.00 57.85 54.76 1bd4 n ARG 189 Cb 0.22 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.09 1bd4 n ARG 189 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bd4 s ILE 190 N -1.66 5.25 -0.26 0.55 1.09 -0.96 -1.31 121.20 123.89 1bd4 s ILE 190 Ca 0.36 0.59 -0.00 0.00 -1.10 0.00 0.00 60.65 60.50 1bd4 s ILE 190 Cb 0.21 -3.67 0.04 0.00 -1.06 0.00 0.00 42.46 37.98 1bd4 s ILE 190 CO 0.31 0.31 -0.06 -0.63 -0.10 0.00 0.00 174.94 174.76 1bd4 s ILE 191 N 1.01 2.71 -0.44 2.92 1.01 0.79 -2.21 121.20 126.98 1bd4 s ILE 191 Ca 0.17 -1.28 -0.20 0.00 0.00 0.00 0.00 60.65 59.34 1bd4 s ILE 191 Cb -0.14 -2.47 0.03 0.00 0.01 0.00 0.00 42.46 39.88 1bd4 s ILE 191 CO 0.06 0.07 0.63 0.12 0.00 0.00 0.00 174.94 175.82 1bd4 s PHE 192 N 1.25 3.07 -0.20 3.97 5.36 0.52 -0.84 117.98 131.11 1bd4 s PHE 192 Ca -0.03 -0.10 -0.15 0.00 -0.96 0.00 0.00 56.93 55.69 1bd4 s PHE 192 Cb -0.18 -3.33 -0.04 0.00 -0.34 0.00 0.00 43.02 39.12 1bd4 s PHE 192 CO -0.04 -0.87 0.35 0.08 -1.46 0.00 0.00 175.22 173.28 1bd4 s VAL 193 N 2.78 5.23 0.06 3.12 1.01 0.16 -0.75 120.40 132.02 1bd4 s VAL 193 Ca 0.22 0.61 -0.09 0.00 0.00 0.00 0.00 61.98 62.72 1bd4 s VAL 193 Cb -0.14 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 1bd4 s VAL 193 CO 0.18 0.28 0.18 0.54 0.00 0.00 0.00 175.10 176.28 1bd4 s ASN 194 N 0.99 0.09 -0.20 3.32 4.22 0.13 -2.21 114.94 121.28 1bd4 s ASN 194 Ca 0.17 -0.52 0.02 0.00 -2.14 0.00 0.00 52.86 50.40 1bd4 s ASN 194 Cb -0.14 0.31 -0.21 0.00 1.28 0.00 0.00 41.25 42.48 1bd4 s ASN 194 CO 0.07 -0.63 0.05 -0.38 -2.04 0.00 0.00 177.10 174.17 1bd4 n ILE 195 N 0.35 1.57 -3.75 0.54 5.41 -0.96 -3.06 119.36 119.46 1bd4 n ILE 195 Ca -0.17 -0.65 -0.13 0.00 1.00 0.00 0.00 62.75 62.80 1bd4 n ILE 195 Cb 0.60 -1.36 -0.14 0.00 -0.71 0.00 0.00 39.64 38.03 1bd4 n ILE 195 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1bd4 s LEU 196 N -6.51 0.76 0.27 1.39 0.20 -0.68 -2.54 118.68 111.56 1bd4 s LEU 196 Ca -0.26 0.30 0.04 0.00 0.69 0.00 0.00 54.13 54.90 1bd4 s LEU 196 Cb 0.08 0.38 -0.06 0.00 -0.43 0.00 0.00 46.19 46.16 1bd4 s LEU 196 CO 0.70 -0.14 0.02 0.00 -0.29 0.00 0.00 176.35 176.63 1bd4 s ALA 197 N 1.11 2.01 -0.06 5.97 0.00 -0.57 -2.26 121.76 127.96 1bd4 s ALA 197 Ca -0.09 -1.88 0.06 0.00 0.00 0.00 0.00 51.96 50.05 1bd4 s ALA 197 Cb -0.11 0.58 -0.01 0.00 0.00 0.00 0.00 23.12 23.59 1bd4 s ALA 197 CO -0.06 -0.28 -0.24 0.00 0.00 0.00 0.00 175.76 175.19 1bd4 s ALA 198 N -3.39 2.06 0.28 0.00 0.00 -0.96 -0.79 121.76 118.96 1bd4 s ALA 198 Ca 0.32 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 51.27 1bd4 s ALA 198 Cb 0.07 -0.66 0.58 0.00 0.00 0.00 0.00 23.12 23.11 1bd4 s ALA 198 CO 0.12 0.38 1.59 -1.00 0.00 0.00 0.00 175.76 176.85 1bd4 h PRO 199 N 6.18 0.04 -0.81 0.00 0.13 -1.83 0.64 132.00 136.36 1bd4 h PRO 199 Ca -0.30 -0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.91 1bd4 h PRO 199 Cb 1.18 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 1bd4 h PRO 199 CO 0.47 0.03 0.53 0.37 -0.23 0.00 0.00 178.00 179.17 1bd4 h GLN 200 N 0.04 0.79 -0.27 0.86 4.15 -1.90 0.44 115.11 119.22 1bd4 h GLN 200 Ca 0.51 -0.05 -0.15 0.00 0.77 0.00 0.00 58.65 59.73 1bd4 h GLN 200 Cb 0.96 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.46 1bd4 h GLN 200 CO -0.84 0.52 -0.44 0.78 -1.93 0.00 0.00 178.83 176.93 1bd4 h GLY 201 N 0.81 0.73 0.91 2.39 0.00 0.99 -3.05 103.07 105.85 1bd4 h GLY 201 Ca 0.36 -0.76 0.01 0.00 0.00 0.00 0.00 47.33 46.94 1bd4 h GLY 201 CO -0.14 0.69 0.06 -2.22 0.00 0.00 0.00 176.54 174.94 1bd4 h ILE 202 N 0.54 0.98 -0.53 2.60 2.04 -0.26 -2.64 117.51 120.24 1bd4 h ILE 202 Ca 0.04 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.89 1bd4 h ILE 202 Cb 0.98 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 37.84 1bd4 h ILE 202 CO 0.09 0.03 0.29 -0.33 0.00 0.00 0.00 178.15 178.23 1bd4 h GLU 203 N 0.15 0.55 0.12 2.37 5.08 -1.18 -2.15 114.58 119.52 1bd4 h GLU 203 Ca 0.06 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1bd4 h GLU 203 Cb 0.02 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 1bd4 h GLU 203 CO -0.05 0.37 -0.08 -0.09 -1.00 0.00 0.00 179.01 178.15 1bd4 h ARG 204 N 0.57 -0.19 -0.28 2.33 1.12 -1.42 0.29 114.38 116.80 1bd4 h ARG 204 Ca 0.23 0.01 0.06 0.00 -1.11 0.00 0.00 59.98 59.17 1bd4 h ARG 204 Cb 0.09 0.04 -0.06 0.00 -0.01 0.00 0.00 29.97 30.03 1bd4 h ARG 204 CO -0.13 -0.13 -0.15 -0.24 -3.11 0.00 0.00 179.97 176.21 1bd4 h VAL 205 N -0.20 0.55 0.00 0.20 3.04 -1.27 0.20 116.25 118.77 1bd4 h VAL 205 Ca -0.01 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.59 1bd4 h VAL 205 Cb 0.18 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.00 1bd4 h VAL 205 CO 0.00 0.00 -0.44 -0.26 -1.01 0.00 0.00 177.57 175.86 1bd4 h PHE 206 N -0.12 0.00 -0.23 3.17 0.04 -1.23 0.97 116.94 119.54 1bd4 h PHE 206 Ca 0.15 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.87 1bd4 h PHE 206 Cb 0.34 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1bd4 h PHE 206 CO -0.34 0.44 -0.03 -0.22 -0.60 0.00 0.00 178.31 177.56 1bd4 h LYS 207 N 0.00 0.43 0.04 1.51 3.64 0.35 -1.67 116.57 120.87 1bd4 h LYS 207 Ca -0.00 -0.15 -0.18 0.00 -1.27 0.00 0.00 60.65 59.05 1bd4 h LYS 207 Cb 1.00 -0.03 0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1bd4 h LYS 207 CO 0.06 0.64 -0.71 0.93 -2.27 0.00 0.00 179.45 178.09 1bd4 h GLU 208 N 0.18 0.42 -2.02 1.90 5.08 -0.37 -3.39 114.58 116.37 1bd4 h GLU 208 Ca 0.06 -0.50 -0.54 0.00 -1.00 0.00 0.00 59.36 57.38 1bd4 h GLU 208 Cb 0.47 0.15 -0.41 0.00 0.50 0.00 0.00 28.75 29.46 1bd4 h GLU 208 CO 0.02 1.16 -0.88 0.66 -1.00 0.00 0.00 179.01 178.98 1bd4 n TYR 209 N -4.15 2.50 -0.56 4.33 4.01 0.33 -4.95 117.16 118.67 1bd4 n TYR 209 Ca -0.11 -3.77 0.45 0.00 -0.16 0.00 0.00 57.90 54.31 1bd4 n TYR 209 Cb 0.74 -0.42 0.73 0.00 -0.31 0.00 0.00 39.34 40.07 1bd4 n TYR 209 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1bd4 n PRO 210 N -0.08 -0.02 0.00 -0.72 -0.04 -0.63 -1.33 135.00 132.18 1bd4 n PRO 210 Ca 0.28 1.17 0.14 0.00 -0.04 0.00 0.00 63.50 65.05 1bd4 n PRO 210 Cb 0.54 -2.44 0.73 0.00 -0.04 0.00 0.00 33.50 32.28 1bd4 n PRO 210 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1bd4 n LYS 211 N -4.36 0.47 -2.09 0.54 5.02 -1.26 -4.90 118.16 111.57 1bd4 n LYS 211 Ca 0.41 0.02 -0.27 0.00 -2.02 0.00 0.00 58.31 56.45 1bd4 n LYS 211 Cb 1.73 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 35.31 1bd4 n LYS 211 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1bd4 s VAL 212 N -2.50 2.17 0.04 -0.18 -7.23 -0.44 -3.94 120.40 108.33 1bd4 s VAL 212 Ca 0.29 -0.17 0.07 0.00 -1.81 0.00 0.00 61.98 60.36 1bd4 s VAL 212 Cb 0.19 -3.00 -0.03 0.00 0.56 0.00 0.00 36.38 34.10 1bd4 s VAL 212 CO 0.42 0.00 -0.19 -0.13 -0.31 0.00 0.00 175.10 174.89 1bd4 s ARG 213 N -5.37 2.03 -0.08 4.82 3.00 -0.94 -4.84 118.95 117.57 1bd4 s ARG 213 Ca 0.61 -1.00 -0.02 0.00 0.00 0.00 0.00 55.73 55.32 1bd4 s ARG 213 Cb -0.11 -2.16 0.03 0.00 0.00 0.00 0.00 34.95 32.71 1bd4 s ARG 213 CO 0.46 0.53 0.01 1.41 0.00 0.00 0.00 175.30 177.72 1bd4 s MET 214 N -1.46 0.55 -0.19 3.54 -2.45 -0.94 -0.35 119.30 118.00 1bd4 s MET 214 Ca 0.14 0.07 -0.08 0.00 -1.25 0.00 0.00 55.69 54.58 1bd4 s MET 214 Cb -0.10 -1.08 -0.04 0.00 1.25 0.00 0.00 34.83 34.85 1bd4 s MET 214 CO 0.05 -0.35 0.07 0.08 1.05 0.00 0.00 175.02 175.92 1bd4 s VAL 215 N 1.98 4.77 0.29 10.11 1.01 0.07 -0.40 120.40 138.24 1bd4 s VAL 215 Ca 0.04 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1bd4 s VAL 215 Cb -0.13 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1bd4 s VAL 215 CO -0.05 0.44 0.12 0.28 0.00 0.00 0.00 175.10 175.89 1bd4 s THR 216 N 0.55 0.49 0.00 3.92 -1.32 -0.73 -0.69 115.64 117.85 1bd4 s THR 216 Ca 0.04 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.52 1bd4 s THR 216 Cb -0.13 -2.57 0.00 0.00 -1.51 0.00 0.00 72.50 68.29 1bd4 s THR 216 CO 0.01 0.00 0.39 0.00 -2.21 0.00 0.00 174.62 172.81 1bd4 n ALA 217 N -0.56 2.24 -3.63 11.08 0.00 -1.13 -1.14 120.51 127.37 1bd4 n ALA 217 Ca -0.00 -0.39 -0.06 0.00 0.00 0.00 0.00 53.44 52.99 1bd4 n ALA 217 Cb 0.66 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.05 1bd4 n ALA 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bd4 s ALA 218 N -0.14 -2.07 -0.09 0.00 0.00 -1.05 -4.76 121.76 113.64 1bd4 s ALA 218 Ca 0.00 1.76 0.03 0.00 0.00 0.00 0.00 51.96 53.74 1bd4 s ALA 218 Cb 0.00 -1.36 0.01 0.00 0.00 0.00 0.00 23.12 21.77 1bd4 s ALA 218 CO 0.00 -0.22 -0.18 0.08 0.00 0.00 0.00 175.76 175.44 1bd4 s VAL 219 N -0.56 1.58 0.50 0.00 1.01 -1.26 -1.52 120.40 120.15 1bd4 s VAL 219 Ca 0.05 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.38 1bd4 s VAL 219 Cb -0.03 -1.41 0.04 0.00 0.00 0.00 0.00 36.38 34.99 1bd4 s VAL 219 CO -0.07 0.45 0.61 -1.81 0.00 0.00 0.00 175.10 174.29 1bd4 s ASP 220 N 0.60 5.22 0.00 3.32 1.11 0.03 -4.95 116.67 122.01 1bd4 s ASP 220 Ca -0.15 -0.74 0.00 0.00 0.18 0.00 0.00 52.55 51.84 1bd4 s ASP 220 Cb -0.16 -0.13 0.00 0.00 1.07 0.00 0.00 42.92 43.69 1bd4 s ASP 220 CO 0.05 -1.02 0.31 -0.38 1.18 0.00 0.00 175.17 175.31 1bd4 n ILE 221 N -1.95 0.00 -3.91 0.77 2.08 -1.08 -4.12 119.36 111.14 1bd4 n ILE 221 Ca 0.09 0.65 0.00 0.00 0.56 0.00 0.00 62.75 64.05 1bd4 n ILE 221 Cb 0.61 -1.33 0.00 0.00 -0.75 0.00 0.00 39.64 38.17 1bd4 n ILE 221 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1bd4 s LEU 223 N 0.00 2.39 0.00 0.00 0.20 -1.26 -0.08 118.68 119.93 1bd4 s LEU 223 Ca 0.00 -0.80 0.06 0.00 0.69 0.00 0.00 54.13 54.09 1bd4 s LEU 223 Cb 0.00 -0.80 0.07 0.00 -0.43 0.00 0.00 46.19 45.03 1bd4 s LEU 223 CO 0.00 -0.02 0.60 -0.46 -0.29 0.00 0.00 176.35 176.18 1bd4 n ASN 224 N 0.59 1.49 0.27 3.68 6.94 -0.45 -4.88 115.26 122.90 1bd4 n ASN 224 Ca -0.16 -2.10 0.17 0.00 -0.02 0.00 0.00 54.58 52.48 1bd4 n ASN 224 Cb 0.56 -0.33 0.73 0.00 -2.36 0.00 0.00 39.78 38.38 1bd4 n ASN 224 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1bd4 h SER 225 N 0.03 0.00 -0.12 0.53 4.64 -2.02 0.17 113.55 116.78 1bd4 h SER 225 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1bd4 h SER 225 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1bd4 h SER 225 CO 0.28 0.00 0.00 -1.14 -0.87 0.00 0.00 176.83 175.10 1bd4 n ARG 226 N -2.99 1.94 -2.08 4.77 3.00 -1.26 -4.93 116.66 115.11 1bd4 n ARG 226 Ca 0.00 -1.39 -0.10 0.00 -0.00 0.00 0.00 57.85 56.36 1bd4 n ARG 226 Cb 0.27 -1.46 -0.01 0.00 0.00 0.00 0.00 32.46 31.26 1bd4 n ARG 226 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1bd4 n TYR 227 N 0.64 -0.43 -3.59 -0.14 4.01 0.05 -5.01 117.16 112.69 1bd4 n TYR 227 Ca 0.17 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.55 1bd4 n TYR 227 Cb 0.43 -2.42 -0.08 0.00 -0.31 0.00 0.00 39.34 36.96 1bd4 n TYR 227 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1bd4 s TYR 228 N -2.50 3.40 0.33 -0.72 2.02 -1.26 -4.70 117.35 113.91 1bd4 s TYR 228 Ca 0.00 0.44 -0.29 0.00 -0.37 0.00 0.00 57.07 56.85 1bd4 s TYR 228 Cb 0.00 -2.31 -0.11 0.00 -0.40 0.00 0.00 41.96 39.14 1bd4 s TYR 228 CO 0.00 0.17 1.56 -0.89 -1.57 0.00 0.00 175.55 174.82 1bd4 n ILE 229 N 3.85 1.43 -4.27 2.71 5.41 -1.26 -1.34 119.36 125.89 1bd4 n ILE 229 Ca -0.13 -0.36 -0.21 0.00 1.00 0.00 0.00 62.75 63.05 1bd4 n ILE 229 Cb 0.52 -1.99 -0.12 0.00 -0.71 0.00 0.00 39.64 37.34 1bd4 n ILE 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1bd4 s VAL 230 N -0.47 1.57 0.10 1.39 0.11 0.88 -2.47 120.40 121.52 1bd4 s VAL 230 Ca 0.59 -1.63 0.31 0.00 -2.93 0.00 0.00 61.98 58.33 1bd4 s VAL 230 Cb -0.48 -1.54 0.32 0.00 -1.53 0.00 0.00 36.38 33.15 1bd4 s VAL 230 CO 0.55 -0.22 1.96 1.55 -3.33 0.00 0.00 175.10 175.61 1bd4 h PRO 231 N 3.81 0.00 0.00 1.54 0.13 -1.95 -2.82 132.00 132.70 1bd4 h PRO 231 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1bd4 h PRO 231 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1bd4 h PRO 231 CO 0.44 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.62 1bd4 n GLY 232 N -0.88 0.40 0.00 1.56 0.00 -1.03 -4.77 105.19 100.47 1bd4 n GLY 232 Ca -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1bd4 n GLY 232 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1bd4 n ILE 233 N -0.38 0.00 -1.31 -0.61 0.00 -1.26 -4.86 119.36 110.95 1bd4 n ILE 233 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 62.75 62.44 1bd4 n ILE 233 Cb 0.00 0.91 0.00 0.00 0.00 0.00 0.00 39.64 40.55 1bd4 n ILE 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1bd4 n GLY 234 N 0.89 -0.50 3.58 4.50 0.00 -1.26 -4.77 105.19 107.62 1bd4 n GLY 234 Ca 0.00 -1.63 -0.43 0.00 0.00 0.00 0.00 46.02 43.96 1bd4 n GLY 234 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bd4 s ASP 235 N -4.00 6.55 0.06 1.61 -1.08 -1.26 -4.94 116.67 113.61 1bd4 s ASP 235 Ca 0.00 0.26 -0.34 0.00 -0.52 0.00 0.00 52.55 51.94 1bd4 s ASP 235 Cb 0.00 -2.46 -0.19 0.00 -1.46 0.00 0.00 42.92 38.80 1bd4 s ASP 235 CO 0.00 -1.03 1.56 0.15 0.52 0.00 0.00 175.17 176.37 1bd4 h PHE 236 N 8.96 -1.01 -0.64 -5.34 3.57 -1.99 -1.35 116.94 119.14 1bd4 h PHE 236 Ca -0.24 -0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.37 1bd4 h PHE 236 Cb 1.07 0.34 -0.11 0.00 2.79 0.00 0.00 35.95 40.04 1bd4 h PHE 236 CO 0.87 -0.63 -0.01 0.78 -2.23 0.00 0.00 178.31 177.10 1bd4 h GLY 237 N -1.12 0.67 1.23 2.40 0.00 -1.92 0.41 103.07 104.74 1bd4 h GLY 237 Ca -0.11 0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.21 1bd4 h GLY 237 CO 0.18 -0.21 -0.08 -0.55 0.00 0.00 0.00 176.54 175.88 1bd4 h ASP 238 N 0.11 0.90 -0.16 0.19 3.32 -1.89 -1.61 116.42 117.28 1bd4 h ASP 238 Ca 0.33 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 1bd4 h ASP 238 Cb 0.55 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1bd4 h ASP 238 CO -0.55 1.00 -0.02 0.03 -1.72 0.00 0.00 179.24 177.98 1bd4 h ARG 239 N 0.82 0.30 -0.06 3.56 2.47 0.28 -0.39 114.38 121.35 1bd4 h ARG 239 Ca 0.14 -0.11 -0.01 0.00 -1.26 0.00 0.00 59.98 58.74 1bd4 h ARG 239 Cb 0.60 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.89 1bd4 h ARG 239 CO 0.04 0.55 -0.01 -0.92 0.56 0.00 0.00 179.97 180.18 1bd4 h TYR 240 N 0.02 0.13 -0.01 3.04 3.20 -0.25 -3.24 116.97 119.87 1bd4 h TYR 240 Ca 0.04 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1bd4 h TYR 240 Cb 0.43 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.66 1bd4 h TYR 240 CO 0.04 0.44 -0.11 1.19 -1.64 0.00 0.00 178.16 178.08 1bd4 n PHE 241 N -4.83 0.00 -2.75 -3.82 3.72 -0.61 -4.89 117.46 104.27 1bd4 n PHE 241 Ca -0.07 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.24 1bd4 n PHE 241 Cb 0.22 -0.11 0.04 0.00 -0.94 0.00 0.00 39.48 38.68 1bd4 n PHE 241 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bd4 n GLY 242 N 1.25 0.07 1.34 1.37 0.00 -0.26 -4.99 105.19 103.98 1bd4 n GLY 242 Ca 0.16 -0.20 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 1bd4 n GLY 242 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bd4 n THR 243 N -2.72 2.12 0.00 2.61 -2.24 -0.62 -5.05 114.28 108.39 1bd4 n THR 243 Ca -0.12 -3.44 0.00 0.00 -2.27 0.00 0.00 64.05 58.22 1bd4 n THR 243 Cb 0.58 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1bd4 n THR 243 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30