#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c41 h LEU 7 N 0.00 0.00 -0.63 3.22 -0.00 -2.00 -2.45 115.31 113.44 2c41 h LEU 7 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.88 57.96 2c41 h LEU 7 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.59 2c41 h LEU 7 CO 0.00 0.34 0.28 0.11 -0.00 0.00 0.00 178.44 179.17 2c41 h LYS 8 N 0.00 0.49 0.00 0.17 6.56 -2.01 -2.25 116.57 119.54 2c41 h LYS 8 Ca -0.00 -0.03 -0.05 0.00 -1.06 0.00 0.00 60.65 59.51 2c41 h LYS 8 Cb 0.62 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 32.16 2c41 h LYS 8 CO 0.04 0.32 -0.25 1.05 -2.06 0.00 0.00 179.45 178.56 2c41 h GLU 9 N 0.51 0.00 -0.18 3.15 4.11 -1.88 -2.53 114.58 117.75 2c41 h GLU 9 Ca 0.31 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.72 2c41 h GLU 9 Cb 0.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2c41 h GLU 9 CO -0.26 0.25 0.05 1.96 0.07 0.00 0.00 179.01 181.08 2c41 h GLN 10 N 0.00 0.29 -0.37 1.06 4.20 -1.11 0.37 115.11 119.55 2c41 h GLN 10 Ca -0.00 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.66 2c41 h GLN 10 Cb 0.91 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.62 2c41 h GLN 10 CO 0.03 0.41 0.20 0.28 -0.67 0.00 0.00 178.83 179.08 2c41 h VAL 11 N 0.12 1.01 -0.72 -0.54 2.07 -1.47 -2.06 116.25 114.66 2c41 h VAL 11 Ca 0.06 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2c41 h VAL 11 Cb 0.25 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 2c41 h VAL 11 CO -0.00 0.07 0.42 -0.07 0.02 0.00 0.00 177.57 178.01 2c41 h LEU 12 N 0.41 0.87 -0.48 2.57 3.38 -1.32 -1.69 115.31 119.05 2c41 h LEU 12 Ca 0.15 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.09 2c41 h LEU 12 Cb 0.03 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2c41 h LEU 12 CO -0.09 0.68 0.27 0.74 0.09 0.00 0.00 178.44 180.13 2c41 h THR 13 N 0.99 1.01 -0.73 0.22 2.02 -0.51 -2.06 112.91 113.86 2c41 h THR 13 Ca 0.26 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 2c41 h THR 13 Cb -0.02 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 2c41 h THR 13 CO -0.05 0.10 0.42 0.71 0.37 0.00 0.00 175.52 177.07 2c41 h THR 14 N 0.54 1.22 -0.73 3.16 1.35 -0.66 -2.51 112.91 115.27 2c41 h THR 14 Ca 0.20 -0.52 -0.04 0.00 -0.55 0.00 0.00 66.41 65.50 2c41 h THR 14 Cb 0.06 0.24 -0.03 0.00 -1.73 0.00 0.00 68.15 66.68 2c41 h THR 14 CO -0.11 0.23 0.29 -0.07 -0.25 0.00 0.00 175.52 175.61 2c41 h LEU 15 N 1.00 1.01 -0.34 3.87 3.38 -1.01 0.14 115.31 123.35 2c41 h LEU 15 Ca 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2c41 h LEU 15 Cb 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2c41 h LEU 15 CO -0.04 0.90 0.16 0.11 0.09 0.00 0.00 178.44 179.66 2c41 h LYS 16 N 1.05 0.50 -0.36 1.13 1.57 -1.19 0.20 116.57 119.46 2c41 h LYS 16 Ca 0.24 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 2c41 h LYS 16 Cb 0.21 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2c41 h LYS 16 CO -0.02 0.45 0.14 -0.09 -0.57 0.00 0.00 179.45 179.36 2c41 h ARG 17 N 0.42 0.55 -0.53 3.15 2.43 -1.24 -0.49 114.38 118.67 2c41 h ARG 17 Ca 0.12 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 2c41 h ARG 17 Cb 0.12 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2c41 h ARG 17 CO -0.01 0.53 0.15 0.93 -1.51 0.00 0.00 179.97 180.06 2c41 h GLU 18 N 0.44 0.83 -0.27 0.20 4.39 -0.83 -0.05 114.58 119.29 2c41 h GLU 18 Ca 0.12 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 2c41 h GLU 18 Cb 0.20 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2c41 h GLU 18 CO -0.01 0.77 0.12 0.37 -1.16 0.00 0.00 179.01 179.11 2c41 h GLN 19 N 0.73 0.39 -0.79 2.33 4.15 -0.48 -1.07 115.11 120.37 2c41 h GLN 19 Ca 0.17 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.54 2c41 h GLN 19 Cb 0.30 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.88 2c41 h GLN 19 CO -0.00 0.40 0.52 0.00 -1.93 0.00 0.00 178.83 177.81 2c41 h ALA 20 N 0.98 1.01 -0.88 3.38 0.00 -0.87 -2.09 119.26 120.79 2c41 h ALA 20 Ca 0.09 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2c41 h ALA 20 Cb 0.14 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2c41 h ALA 20 CO -0.01 0.39 0.58 -0.91 0.00 0.00 0.00 179.25 179.30 2c41 h ASN 21 N 1.05 1.01 -0.62 0.00 -0.26 -0.74 -1.41 115.58 114.61 2c41 h ASN 21 Ca 0.30 -0.03 -0.00 0.00 -0.56 0.00 0.00 56.30 56.01 2c41 h ASN 21 Cb -0.09 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 36.89 2c41 h ASN 21 CO -0.08 0.73 0.37 0.00 -1.06 0.00 0.00 177.43 177.40 2c41 h ALA 22 N 1.33 0.79 0.03 -0.83 0.00 -0.63 0.15 119.26 120.10 2c41 h ALA 22 Ca 0.32 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2c41 h ALA 22 Cb -0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.41 2c41 h ALA 22 CO -0.07 0.27 -0.01 0.28 0.00 0.00 0.00 179.25 179.72 2c41 h VAL 23 N 0.84 1.01 -0.51 0.00 2.07 -1.03 0.72 116.25 119.35 2c41 h VAL 23 Ca 0.22 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.55 2c41 h VAL 23 Cb -0.02 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 2c41 h VAL 23 CO -0.04 0.03 0.04 0.58 0.02 0.00 0.00 177.57 178.20 2c41 h VAL 24 N -0.09 1.26 -0.81 2.57 2.07 -1.13 -1.24 116.25 118.87 2c41 h VAL 24 Ca -0.00 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 2c41 h VAL 24 Cb 0.08 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2c41 h VAL 24 CO 0.01 0.36 0.34 -0.03 0.02 0.00 0.00 177.57 178.27 2c41 h MET 25 N 0.74 1.20 -0.01 1.57 -1.53 -0.62 0.65 114.93 116.94 2c41 h MET 25 Ca 0.15 -0.21 -0.00 0.00 -3.44 0.00 0.00 59.70 56.20 2c41 h MET 25 Cb 0.46 -0.20 -0.00 0.00 -0.55 0.00 0.00 31.60 31.31 2c41 h MET 25 CO 0.02 0.96 0.00 -0.92 0.14 0.00 0.00 176.91 177.11 2c41 h TYR 26 N 1.17 0.01 -0.86 1.39 3.20 -0.61 -1.12 116.97 120.15 2c41 h TYR 26 Ca 0.27 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.15 2c41 h TYR 26 Cb 0.19 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.41 2c41 h TYR 26 CO 0.02 0.14 0.56 -0.07 -1.64 0.00 0.00 178.16 177.17 2c41 h LEU 27 N -0.12 1.00 -0.36 2.82 3.38 -0.91 -1.14 115.31 119.97 2c41 h LEU 27 Ca 0.00 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.98 2c41 h LEU 27 Cb 0.13 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2c41 h LEU 27 CO -0.00 0.73 0.13 0.78 0.09 0.00 0.00 178.44 180.17 2c41 h ASN 28 N 1.17 0.15 -0.99 -0.43 -0.26 -0.72 -1.73 115.58 112.77 2c41 h ASN 28 Ca 0.31 0.04 0.05 0.00 -0.56 0.00 0.00 56.30 56.14 2c41 h ASN 28 Cb -0.12 0.02 -0.06 0.00 -1.06 0.00 0.00 38.32 37.10 2c41 h ASN 28 CO -0.07 0.12 0.65 1.88 -1.06 0.00 0.00 177.43 178.95 2c41 h TYR 29 N 0.28 1.20 -0.61 1.19 0.05 -0.23 -1.53 116.97 117.33 2c41 h TYR 29 Ca 0.16 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.95 2c41 h TYR 29 Cb 0.13 -0.40 -0.03 0.00 1.01 0.00 0.00 36.73 37.44 2c41 h TYR 29 CO -0.14 0.67 0.28 0.87 -1.05 0.00 0.00 178.16 178.80 2c41 h LYS 30 N 1.22 0.88 -0.38 4.88 1.79 -0.89 0.85 116.57 124.92 2c41 h LYS 30 Ca 0.40 -0.13 0.07 0.00 -2.18 0.00 0.00 60.65 58.81 2c41 h LYS 30 Cb 0.06 -0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 30.50 2c41 h LYS 30 CO -0.14 0.72 0.03 -0.22 -1.08 0.00 0.00 179.45 178.76 2c41 h LYS 31 N 0.84 0.14 -0.18 3.15 3.64 -0.62 -0.46 116.57 123.07 2c41 h LYS 31 Ca 0.21 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2c41 h LYS 31 Cb 0.13 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 2c41 h LYS 31 CO -0.02 0.09 0.07 1.88 -2.27 0.00 0.00 179.45 179.20 2c41 h TYR 32 N 0.15 0.28 -0.58 1.91 0.05 -0.88 0.44 116.97 118.33 2c41 h TYR 32 Ca 0.19 -0.02 0.12 0.00 0.05 0.00 0.00 58.73 59.07 2c41 h TYR 32 Cb 0.25 -0.08 -0.10 0.00 1.01 0.00 0.00 36.73 37.80 2c41 h TYR 32 CO -0.23 0.34 -0.04 1.25 -1.05 0.00 0.00 178.16 178.43 2c41 h HIS 33 N 0.14 -0.11 0.06 4.88 -0.00 -0.63 -0.35 115.15 119.13 2c41 h HIS 33 Ca 0.06 0.05 -0.25 0.00 -0.00 0.00 0.00 60.37 60.22 2c41 h HIS 33 Cb 0.18 0.14 0.01 0.00 -0.00 0.00 0.00 27.41 27.73 2c41 h HIS 33 CO -0.01 -0.18 -1.08 -1.49 -0.00 0.00 0.00 177.93 175.17 2c41 h TRP 34 N 0.08 0.65 -0.02 5.26 6.55 -0.74 -3.36 115.95 124.39 2c41 h TRP 34 Ca 0.30 -0.40 0.00 0.00 0.95 0.00 0.00 58.89 59.74 2c41 h TRP 34 Cb 0.47 -0.06 0.00 0.00 -0.86 0.00 0.00 29.16 28.72 2c41 h TRP 34 CO -0.38 1.25 -0.32 1.28 -1.05 0.00 0.00 178.44 179.21 2c41 n LEU 35 N -3.70 2.17 -4.74 -4.49 4.77 0.11 -4.96 117.00 106.18 2c41 n LEU 35 Ca -0.08 -0.83 -0.33 0.00 -0.03 0.00 0.00 56.01 54.74 2c41 n LEU 35 Cb 0.92 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 42.10 2c41 n LEU 35 CO 0.53 0.39 0.75 0.28 -1.33 0.00 0.00 177.39 178.02 2c41 s THR 36 N -2.19 2.69 0.28 -5.08 -1.32 -0.15 -4.97 115.64 104.89 2c41 s THR 36 Ca 0.19 0.30 -0.21 0.00 -1.21 0.00 0.00 61.69 60.76 2c41 s THR 36 Cb 0.17 -2.76 0.02 0.00 -1.51 0.00 0.00 72.50 68.42 2c41 s THR 36 CO 0.46 -0.22 0.72 -0.72 -2.21 0.00 0.00 174.62 172.65 2c41 s TYR 37 N -2.31 -0.17 0.00 9.09 -0.85 -1.26 -5.01 117.35 116.84 2c41 s TYR 37 Ca 0.69 -0.29 0.00 0.00 -0.52 0.00 0.00 57.07 56.95 2c41 s TYR 37 Cb -0.24 0.70 0.00 0.00 0.38 0.00 0.00 41.96 42.80 2c41 s TYR 37 CO 0.47 -1.24 0.00 0.41 -1.52 0.00 0.00 175.55 173.67 2c41 n GLY 38 N -0.46 -4.09 0.00 5.49 0.00 -1.26 -4.56 105.19 100.31 2c41 n GLY 38 Ca -0.04 -2.07 0.03 0.00 0.00 0.00 0.00 46.02 43.95 2c41 n GLY 38 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2c41 n PRO 39 N -0.08 0.01 -0.57 1.61 -0.02 -1.26 -1.25 135.00 133.44 2c41 n PRO 39 Ca 0.00 0.37 0.09 0.00 -2.02 0.00 0.00 63.50 61.94 2c41 n PRO 39 Cb 0.00 -1.50 0.33 0.00 -0.02 0.00 0.00 33.50 32.31 2c41 n PRO 39 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2c41 n LEU 40 N -1.47 4.44 0.03 2.45 4.77 -1.26 -4.78 117.00 121.17 2c41 n LEU 40 Ca 0.02 -2.24 -0.12 0.00 -0.03 0.00 0.00 56.01 53.64 2c41 n LEU 40 Cb 0.07 -0.56 -0.06 0.00 -2.33 0.00 0.00 43.42 40.55 2c41 n LEU 40 CO 0.06 0.76 0.61 0.15 -1.33 0.00 0.00 177.39 177.64 2c41 h PHE 41 N 3.83 -1.07 -0.29 -1.77 3.57 -1.42 -1.10 116.94 118.69 2c41 h PHE 41 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2c41 h PHE 41 Cb 1.35 0.48 -0.02 0.00 2.79 0.00 0.00 35.95 40.56 2c41 h PHE 41 CO 0.71 -0.45 0.19 -0.09 -2.23 0.00 0.00 178.31 176.44 2c41 h ARG 42 N -0.49 0.38 -0.24 1.11 2.43 -1.86 0.25 114.38 115.96 2c41 h ARG 42 Ca 0.07 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2c41 h ARG 42 Cb 0.61 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 2c41 h ARG 42 CO -0.34 0.25 0.13 0.22 -1.51 0.00 0.00 179.97 178.71 2c41 h ASP 43 N 0.39 0.20 -0.19 -3.80 3.58 -1.85 -1.19 116.42 113.57 2c41 h ASP 43 Ca 0.11 0.01 -0.21 0.00 0.42 0.00 0.00 57.03 57.36 2c41 h ASP 43 Cb -0.04 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 40.98 2c41 h ASP 43 CO -0.03 0.15 -0.70 -0.07 -2.88 0.00 0.00 179.24 175.72 2c41 h LEU 44 N 0.27 0.93 -0.56 2.28 3.38 -0.98 -0.46 115.31 120.17 2c41 h LEU 44 Ca 0.09 -0.60 0.11 0.00 0.09 0.00 0.00 57.88 57.57 2c41 h LEU 44 Cb 0.01 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 40.39 2c41 h LEU 44 CO -0.05 1.38 -0.00 -0.74 0.09 0.00 0.00 178.44 179.11 2c41 h HIS 45 N 0.54 -0.05 -0.17 1.13 2.76 -0.37 -0.37 115.15 118.62 2c41 h HIS 45 Ca -0.03 0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.15 2c41 h HIS 45 Cb 1.32 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 30.38 2c41 h HIS 45 CO 0.09 -0.14 -0.01 -0.07 -1.30 0.00 0.00 177.93 176.49 2c41 h LEU 46 N 0.11 0.32 -0.46 0.26 3.38 -1.13 -2.56 115.31 115.23 2c41 h LEU 46 Ca 0.29 -0.33 0.09 0.00 0.09 0.00 0.00 57.88 58.02 2c41 h LEU 46 Cb 0.45 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.04 2c41 h LEU 46 CO -0.48 0.57 -0.05 0.25 0.09 0.00 0.00 178.44 178.82 2c41 h LEU 47 N 0.05 -0.30 -0.94 1.67 5.85 -0.54 0.97 115.31 122.07 2c41 h LEU 47 Ca 0.05 0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 2c41 h LEU 47 Cb 0.42 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2c41 h LEU 47 CO 0.01 -0.11 -0.16 -0.26 -0.34 0.00 0.00 178.44 177.58 2c41 h PHE 48 N 0.06 0.65 -0.29 1.25 0.05 -1.09 -0.52 116.94 117.05 2c41 h PHE 48 Ca 0.23 -0.12 -0.11 0.00 3.82 0.00 0.00 57.97 61.79 2c41 h PHE 48 Cb 0.34 -0.17 -0.01 0.00 2.00 0.00 0.00 35.95 38.12 2c41 h PHE 48 CO -0.34 0.72 -0.25 1.49 -0.18 0.00 0.00 178.31 179.75 2c41 h GLU 49 N 0.53 0.68 0.08 1.51 4.57 -0.96 -0.40 114.58 120.60 2c41 h GLU 49 Ca 0.09 -0.35 -0.00 0.00 -1.18 0.00 0.00 59.36 57.92 2c41 h GLU 49 Cb 0.59 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2c41 h GLU 49 CO 0.04 0.95 -0.04 0.93 -1.18 0.00 0.00 179.01 179.71 2c41 h GLU 50 N 0.42 -0.11 -0.36 1.92 5.08 -0.51 0.11 114.58 121.13 2c41 h GLU 50 Ca 0.05 0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 2c41 h GLU 50 Cb 0.81 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2c41 h GLU 50 CO 0.06 0.14 -0.36 1.96 -1.00 0.00 0.00 179.01 179.81 2c41 h GLN 51 N -0.35 0.83 -0.77 2.33 4.20 -1.19 -2.57 115.11 117.59 2c41 h GLN 51 Ca -0.01 -0.42 0.09 0.00 0.06 0.00 0.00 58.65 58.37 2c41 h GLN 51 Cb 0.30 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.01 2c41 h GLN 51 CO 0.02 1.05 0.42 0.78 -0.67 0.00 0.00 178.83 180.43 2c41 h GLY 52 N 0.88 1.18 1.49 3.46 0.00 -0.99 -1.26 103.07 107.82 2c41 h GLY 52 Ca 0.06 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.05 2c41 h GLY 52 CO 0.08 0.11 -0.04 1.76 0.00 0.00 0.00 176.54 178.46 2c41 h SER 53 N 0.71 0.60 -0.33 0.19 0.02 -0.49 0.17 113.55 114.43 2c41 h SER 53 Ca 0.37 -0.14 -0.16 0.00 -0.84 0.00 0.00 61.79 61.03 2c41 h SER 53 Cb 0.35 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 2c41 h SER 53 CO -0.25 0.69 -0.41 -0.33 -1.14 0.00 0.00 176.83 175.39 2c41 h GLU 54 N 0.59 0.86 -0.45 3.45 5.08 -1.05 -2.54 114.58 120.52 2c41 h GLU 54 Ca 0.12 -0.48 -0.03 0.00 -1.00 0.00 0.00 59.36 57.96 2c41 h GLU 54 Cb 0.43 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2c41 h GLU 54 CO 0.02 1.12 0.15 0.28 -1.00 0.00 0.00 179.01 179.59 2c41 h VAL 55 N 0.65 1.22 -0.61 3.13 2.07 -0.96 -3.15 116.25 118.60 2c41 h VAL 55 Ca 0.04 -0.70 0.13 0.00 0.82 0.00 0.00 66.70 66.99 2c41 h VAL 55 Cb 1.01 0.83 -0.10 0.00 -1.52 0.00 0.00 31.29 31.51 2c41 h VAL 55 CO 0.10 0.25 0.01 0.15 0.02 0.00 0.00 177.57 178.10 2c41 h PHE 56 N 0.58 -0.03 -0.15 1.57 3.04 -0.56 -0.59 116.94 120.79 2c41 h PHE 56 Ca 0.15 0.04 0.04 0.00 3.98 0.00 0.00 57.97 62.18 2c41 h PHE 56 Cb 0.24 0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.85 2c41 h PHE 56 CO 0.01 -0.16 0.14 0.00 -2.02 0.00 0.00 178.31 176.28 2c41 h ALA 57 N 1.55 1.87 0.00 2.41 0.00 -1.41 -1.58 119.26 122.09 2c41 h ALA 57 Ca 0.32 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 2c41 h ALA 57 Cb 0.51 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2c41 h ALA 57 CO -0.52 -0.22 -0.28 0.52 0.00 0.00 0.00 179.25 178.75 2c41 h MET 58 N 0.00 0.00 0.04 0.00 2.86 -1.15 -3.28 114.93 113.39 2c41 h MET 58 Ca 0.07 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.73 2c41 h MET 58 Cb 0.36 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 2c41 h MET 58 CO -0.00 0.28 -0.13 0.82 1.06 0.00 0.00 176.91 178.94 2c41 h ILE 59 N 0.00 0.68 -0.34 -1.22 2.04 -1.32 -0.05 117.51 117.30 2c41 h ILE 59 Ca -0.00 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.72 2c41 h ILE 59 Cb 0.80 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2c41 h ILE 59 CO 0.04 0.00 -0.33 -0.78 0.00 0.00 0.00 178.15 177.07 2c41 h ASP 60 N -0.24 0.78 -0.37 1.72 1.82 -1.73 -1.18 116.42 117.21 2c41 h ASP 60 Ca 0.03 -0.33 -0.00 0.00 -0.39 0.00 0.00 57.03 56.34 2c41 h ASP 60 Cb 0.28 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 40.05 2c41 h ASP 60 CO -0.10 1.05 0.22 -0.33 -1.61 0.00 0.00 179.24 178.46 2c41 h GLU 61 N 0.63 0.51 -0.25 0.28 5.08 -1.55 -0.02 114.58 119.26 2c41 h GLU 61 Ca 0.07 -0.05 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 2c41 h GLU 61 Cb 0.86 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2c41 h GLU 61 CO 0.08 0.39 -0.55 -0.07 -1.00 0.00 0.00 179.01 177.86 2c41 h LEU 62 N 0.49 0.85 -0.17 1.33 3.38 -0.91 -1.85 115.31 118.42 2c41 h LEU 62 Ca 0.13 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 2c41 h LEU 62 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2c41 h LEU 62 CO -0.02 1.23 -0.04 0.00 0.09 0.00 0.00 178.44 179.70 2c41 h ALA 63 N 0.79 0.24 0.00 1.53 0.00 -1.12 -3.16 119.26 117.53 2c41 h ALA 63 Ca 0.01 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2c41 h ALA 63 Cb 1.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2c41 h ALA 63 CO 0.12 -0.01 -0.23 0.93 0.00 0.00 0.00 179.25 180.06 2c41 h GLU 64 N 0.04 0.00 -0.80 0.00 5.08 -1.00 -2.49 114.58 115.41 2c41 h GLU 64 Ca 0.04 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.45 2c41 h GLU 64 Cb 0.47 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 2c41 h GLU 64 CO 0.02 0.23 0.49 -0.09 -1.00 0.00 0.00 179.01 178.66 2c41 h ARG 65 N 0.00 0.90 -0.69 2.33 9.65 -1.30 -0.75 114.38 124.51 2c41 h ARG 65 Ca -0.00 -0.05 0.07 0.00 -1.10 0.00 0.00 59.98 58.90 2c41 h ARG 65 Cb 0.80 -0.20 -0.06 0.00 -1.39 0.00 0.00 29.97 29.11 2c41 h ARG 65 CO 0.03 0.60 0.37 0.77 2.80 0.00 0.00 179.97 184.54 2c41 h SER 66 N 0.93 0.53 -0.59 -3.80 0.02 -1.44 -2.34 113.55 106.85 2c41 h SER 66 Ca 0.33 0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 61.24 2c41 h SER 66 Cb 0.10 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2c41 h SER 66 CO -0.15 0.33 0.06 -0.07 -1.14 0.00 0.00 176.83 175.86 2c41 h LEU 67 N 0.66 0.99 -1.53 5.07 3.38 -1.35 0.45 115.31 122.99 2c41 h LEU 67 Ca 0.32 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2c41 h LEU 67 Cb 0.26 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2c41 h LEU 67 CO -0.22 1.01 0.00 0.24 0.09 0.00 0.00 178.44 179.57 2c41 h MET 68 N 0.96 0.00 -0.56 1.13 2.86 -0.72 -1.85 114.93 116.76 2c41 h MET 68 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 2c41 h MET 68 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 2c41 h MET 68 CO 0.02 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.27 2c41 n LEU 69 N -2.75 5.15 -1.63 1.22 4.77 -0.83 -4.93 117.00 118.00 2c41 n LEU 69 Ca 0.00 -2.77 -0.17 0.00 -0.03 0.00 0.00 56.01 53.04 2c41 n LEU 69 Cb 0.21 -0.62 -0.04 0.00 -2.33 0.00 0.00 43.42 40.63 2c41 n LEU 69 CO 0.22 0.70 -0.19 0.47 -1.33 0.00 0.00 177.39 177.26 2c41 n ASP 70 N 0.65 -5.05 -1.01 -1.43 10.43 -0.69 -5.00 116.55 114.45 2c41 n ASP 70 Ca 0.26 0.21 0.00 0.00 2.57 0.00 0.00 54.79 57.83 2c41 n ASP 70 Cb 1.05 -4.10 0.00 0.00 1.84 0.00 0.00 41.12 39.91 2c41 n ASP 70 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2c41 n GLY 71 N -0.94 4.16 3.16 0.44 0.00 0.09 -5.01 105.19 107.09 2c41 n GLY 71 Ca -0.19 -2.10 -0.23 0.00 0.00 0.00 0.00 46.02 43.50 2c41 n GLY 71 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c41 s GLN 72 N -0.07 1.18 0.92 1.61 -0.21 -1.26 -3.88 119.66 117.96 2c41 s GLN 72 Ca 0.00 -0.71 -0.13 0.00 0.02 0.00 0.00 55.36 54.53 2c41 s GLN 72 Cb 0.00 -1.20 0.15 0.00 1.00 0.00 0.00 33.01 32.96 2c41 s GLN 72 CO 0.00 0.31 1.18 -1.25 -2.12 0.00 0.00 175.29 173.41 2c41 s PRO 73 N -0.81 1.05 0.37 2.91 0.04 -1.26 -4.88 135.00 132.42 2c41 s PRO 73 Ca 0.05 0.09 -0.28 0.00 0.04 0.00 0.00 61.00 60.90 2c41 s PRO 73 Cb -0.07 -1.85 -0.11 0.00 0.04 0.00 0.00 34.50 32.52 2c41 s PRO 73 CO 0.01 -2.22 1.43 0.08 0.04 0.00 0.00 177.00 176.34 2c41 s VAL 74 N -3.43 2.24 0.00 -0.36 1.01 -1.26 -4.88 120.40 113.71 2c41 s VAL 74 Ca 0.66 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2c41 s VAL 74 Cb -0.11 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2c41 s VAL 74 CO 0.52 0.05 0.00 0.00 0.00 0.00 0.00 175.10 175.68 2c41 n ALA 75 N 0.49 1.32 -2.12 5.51 0.00 -1.26 -5.03 120.51 119.42 2c41 n ALA 75 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 2c41 n ALA 75 Cb 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.83 2c41 n ALA 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2c41 s ASP 76 N -2.17 6.75 0.47 0.00 -0.00 -1.26 -4.90 116.67 115.56 2c41 s ASP 76 Ca 0.00 2.13 0.20 0.00 -0.00 0.00 0.00 52.55 54.88 2c41 s ASP 76 Cb 0.00 -2.54 1.20 0.00 -0.00 0.00 0.00 42.92 41.58 2c41 s ASP 76 CO 0.00 -0.85 1.94 -0.65 -0.00 0.00 0.00 175.17 175.61 2c41 h PRO 77 N 8.86 0.24 0.00 8.23 0.11 -2.04 0.89 132.00 148.28 2c41 h PRO 77 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2c41 h PRO 77 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2c41 h PRO 77 CO 0.95 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 178.89 2c41 h ALA 78 N 1.66 1.00 0.00 -0.75 0.00 -2.05 -3.02 119.26 116.11 2c41 h ALA 78 Ca 0.35 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 2c41 h ALA 78 Cb 1.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2c41 h ALA 78 CO -0.08 0.00 -0.62 -0.44 0.00 0.00 0.00 179.25 178.12 2c41 h ASP 79 N 0.00 0.00 -0.25 0.00 3.45 -1.20 -3.39 116.42 115.03 2c41 h ASP 79 Ca 0.00 0.00 0.04 0.00 0.43 0.00 0.00 57.03 57.50 2c41 h ASP 79 Cb 0.25 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 38.98 2c41 h ASP 79 CO 0.00 0.40 -0.01 1.88 -1.57 0.00 0.00 179.24 179.94 2c41 h TYR 80 N 0.00 -0.03 0.00 4.55 0.05 -1.62 -1.33 116.97 118.59 2c41 h TYR 80 Ca -0.03 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2c41 h TYR 80 Cb 1.33 0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.13 2c41 h TYR 80 CO 0.00 -0.05 0.00 -0.07 -1.05 0.00 0.00 178.16 176.99 2c41 h LEU 81 N 0.06 0.00 -0.03 3.88 4.07 -1.80 -0.21 115.31 121.28 2c41 h LEU 81 Ca 0.12 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.96 2c41 h LEU 81 Cb 0.16 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 2c41 h LEU 81 CO -0.21 0.00 -0.56 0.11 -1.08 0.00 0.00 178.44 176.70 2c41 h LYS 82 N 0.00 0.00 0.00 1.13 6.56 -1.46 -3.38 116.57 119.42 2c41 h LYS 82 Ca 0.00 0.00 -0.27 0.00 -1.06 0.00 0.00 60.65 59.32 2c41 h LYS 82 Cb 0.51 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.12 2c41 h LYS 82 CO 0.00 0.56 -2.02 0.28 -2.06 0.00 0.00 179.45 176.21 2c41 n VAL 83 N -3.25 1.02 -2.00 0.50 0.31 -0.83 -5.00 118.33 109.09 2c41 n VAL 83 Ca 0.02 -0.54 -0.40 0.00 -0.01 0.00 0.00 64.34 63.40 2c41 n VAL 83 Cb 0.76 -0.80 -0.01 0.00 -0.91 0.00 0.00 33.84 32.87 2c41 n VAL 83 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2c41 s ALA 84 N -2.36 3.42 -0.27 3.52 0.00 -0.12 -4.72 121.76 121.23 2c41 s ALA 84 Ca -0.13 1.34 0.18 0.00 0.00 0.00 0.00 51.96 53.34 2c41 s ALA 84 Cb 0.05 -3.52 -0.25 0.00 0.00 0.00 0.00 23.12 19.40 2c41 s ALA 84 CO 0.54 -0.84 0.50 0.25 0.00 0.00 0.00 175.76 176.21 2c41 n THR 85 N 0.43 0.00 -2.04 0.00 -2.24 -1.26 -4.95 114.28 104.22 2c41 n THR 85 Ca 0.02 -0.31 -0.35 0.00 -2.27 0.00 0.00 64.05 61.14 2c41 n THR 85 Cb 0.42 0.38 0.03 0.00 -2.10 0.00 0.00 70.33 69.06 2c41 n THR 85 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2c41 s VAL 86 N -3.04 2.81 -0.22 2.28 -7.23 -1.26 -4.97 120.40 108.76 2c41 s VAL 86 Ca -0.02 0.49 -0.29 0.00 -1.81 0.00 0.00 61.98 60.35 2c41 s VAL 86 Cb 0.12 -3.17 0.00 0.00 0.56 0.00 0.00 36.38 33.89 2c41 s VAL 86 CO 0.73 -0.12 1.15 -0.89 -0.31 0.00 0.00 175.10 175.65 2c41 s THR 87 N -1.71 4.47 0.18 5.32 2.01 -1.26 -5.01 115.64 119.64 2c41 s THR 87 Ca 0.75 1.76 -0.31 0.00 0.31 0.00 0.00 61.69 64.21 2c41 s THR 87 Cb -0.28 -4.20 -0.09 0.00 0.01 0.00 0.00 72.50 67.95 2c41 s THR 87 CO 0.32 -0.22 1.39 -2.16 -0.69 0.00 0.00 174.62 173.26 2c41 s PRO 88 N 3.44 4.32 0.32 4.92 0.04 -1.26 -4.95 135.00 141.82 2c41 s PRO 88 Ca 0.49 2.14 -0.29 0.00 0.04 0.00 0.00 61.00 63.38 2c41 s PRO 88 Cb -0.17 -3.19 -0.11 0.00 0.04 0.00 0.00 34.50 31.07 2c41 s PRO 88 CO 0.11 -0.39 1.51 0.45 0.04 0.00 0.00 177.00 178.73 2c41 s SER 89 N 0.70 6.44 -0.04 6.66 0.15 -1.26 -5.02 113.70 121.33 2c41 s SER 89 Ca 0.61 2.91 0.01 0.00 0.70 0.00 0.00 55.95 60.19 2c41 s SER 89 Cb -0.38 -2.65 0.02 0.00 -1.71 0.00 0.00 66.02 61.30 2c41 s SER 89 CO 0.36 -0.83 -0.04 -0.55 1.20 0.00 0.00 173.24 173.38 2c41 s SER 90 N 0.17 0.84 0.01 5.45 0.15 -1.26 -5.08 113.70 113.98 2c41 s SER 90 Ca 0.58 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 57.12 2c41 s SER 90 Cb -0.46 -0.41 0.00 0.00 -1.71 0.00 0.00 66.02 63.45 2c41 s SER 90 CO 0.53 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.52 2c41 n GLY 91 N 4.04 -1.52 3.71 9.45 0.00 -1.26 -4.85 105.19 114.76 2c41 n GLY 91 Ca -0.25 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 2c41 n GLY 91 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2c41 s GLN 92 N -1.38 4.32 0.08 1.61 -1.52 -1.26 -5.03 119.66 116.48 2c41 s GLN 92 Ca 0.00 2.03 0.06 0.00 -1.95 0.00 0.00 55.36 55.51 2c41 s GLN 92 Cb 0.00 -3.32 -0.03 0.00 -0.22 0.00 0.00 33.01 29.44 2c41 s GLN 92 CO 0.00 -0.45 -0.17 -0.51 -0.25 0.00 0.00 175.29 173.91 2c41 s LEU 93 N 1.36 2.27 0.80 2.90 1.43 -1.26 -5.13 118.68 121.04 2c41 s LEU 93 Ca 0.64 -0.62 -0.11 0.00 -1.03 0.00 0.00 54.13 53.01 2c41 s LEU 93 Cb -0.35 -0.69 0.07 0.00 0.03 0.00 0.00 46.19 45.25 2c41 s LEU 93 CO 0.30 -0.00 1.09 0.42 0.23 0.00 0.00 176.35 178.38 2c41 s THR 94 N -1.16 3.15 0.20 5.49 -4.23 -1.26 -4.86 115.64 112.97 2c41 s THR 94 Ca 0.02 0.37 -0.10 0.00 -1.18 0.00 0.00 61.69 60.80 2c41 s THR 94 Cb -0.10 -3.03 0.13 0.00 1.34 0.00 0.00 72.50 70.85 2c41 s THR 94 CO 0.03 -0.49 1.84 0.58 -0.54 0.00 0.00 174.62 176.04 2c41 h VAL 95 N -1.14 1.08 -0.54 2.29 2.07 -1.93 -0.89 116.25 117.19 2c41 h VAL 95 Ca -0.47 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 66.85 2c41 h VAL 95 Cb 1.26 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 2c41 h VAL 95 CO 0.57 0.15 0.20 0.50 0.02 0.00 0.00 177.57 179.00 2c41 h LYS 96 N 0.81 0.37 -0.77 1.57 3.64 -1.99 -1.75 116.57 118.44 2c41 h LYS 96 Ca 0.27 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.59 2c41 h LYS 96 Cb 0.04 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 2c41 h LYS 96 CO -0.11 0.24 0.31 1.96 -2.27 0.00 0.00 179.45 179.58 2c41 h GLN 97 N 0.38 1.15 -0.33 1.90 4.20 -1.77 -0.64 115.11 120.00 2c41 h GLN 97 Ca 0.26 -0.21 0.03 0.00 0.06 0.00 0.00 58.65 58.80 2c41 h GLN 97 Cb 0.29 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 2c41 h GLN 97 CO -0.26 0.93 0.13 0.52 -0.67 0.00 0.00 178.83 179.49 2c41 h MET 98 N 1.11 0.28 -0.47 1.46 2.86 -0.72 0.06 114.93 119.51 2c41 h MET 98 Ca 0.26 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.83 2c41 h MET 98 Cb 0.21 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 2c41 h MET 98 CO -0.02 0.18 0.11 0.82 1.06 0.00 0.00 176.91 179.07 2c41 h ILE 99 N 0.29 1.24 -0.61 -1.22 2.04 -1.00 -0.39 117.51 117.85 2c41 h ILE 99 Ca 0.15 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.18 2c41 h ILE 99 Cb 0.10 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 2c41 h ILE 99 CO -0.14 0.30 0.41 -0.33 0.00 0.00 0.00 178.15 178.39 2c41 h GLU 100 N 0.64 0.81 -0.34 2.37 5.08 -0.94 -0.47 114.58 121.74 2c41 h GLU 100 Ca 0.15 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2c41 h GLU 100 Cb 0.33 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2c41 h GLU 100 CO 0.00 0.54 0.09 1.49 -1.00 0.00 0.00 179.01 180.13 2c41 h GLU 101 N 0.83 0.54 -0.39 2.33 4.81 -0.82 -1.68 114.58 120.22 2c41 h GLU 101 Ca 0.22 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.37 2c41 h GLU 101 Cb -0.09 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 2c41 h GLU 101 CO -0.05 0.59 0.15 0.00 -0.73 0.00 0.00 179.01 178.97 2c41 h ALA 102 N 0.93 0.46 -0.24 2.92 0.00 -0.82 -1.34 119.26 121.16 2c41 h ALA 102 Ca 0.11 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2c41 h ALA 102 Cb 0.29 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2c41 h ALA 102 CO 0.00 -0.24 0.15 0.82 0.00 0.00 0.00 179.25 179.98 2c41 h ILE 103 N 0.31 1.04 -0.48 0.00 2.04 -0.91 0.25 117.51 119.76 2c41 h ILE 103 Ca 0.17 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.97 2c41 h ILE 103 Cb 0.14 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 2c41 h ILE 103 CO -0.17 0.06 0.25 0.00 0.00 0.00 0.00 178.15 178.29 2c41 h ALA 104 N 1.10 0.61 -0.46 1.87 0.00 -1.06 0.84 119.26 122.16 2c41 h ALA 104 Ca 0.09 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2c41 h ALA 104 Cb -0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2c41 h ALA 104 CO -0.03 -0.09 -0.01 -0.91 0.00 0.00 0.00 179.25 178.21 2c41 h ASN 105 N 0.49 0.81 -0.74 0.00 -0.26 -1.02 -1.58 115.58 113.28 2c41 h ASN 105 Ca 0.21 -0.31 0.04 0.00 -0.56 0.00 0.00 56.30 55.67 2c41 h ASN 105 Cb 0.10 -0.22 -0.05 0.00 -1.06 0.00 0.00 38.32 37.10 2c41 h ASN 105 CO -0.14 0.92 0.46 0.45 -1.06 0.00 0.00 177.43 178.06 2c41 h HIS 106 N 0.67 0.86 -0.77 1.19 3.86 -0.56 -0.80 115.15 119.59 2c41 h HIS 106 Ca 0.13 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.35 2c41 h HIS 106 Cb 0.51 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 28.66 2c41 h HIS 106 CO 0.04 0.48 0.41 0.93 0.86 0.00 0.00 177.93 180.65 2c41 h GLU 107 N 0.89 1.08 -0.27 2.45 5.08 -0.60 0.13 114.58 123.34 2c41 h GLU 107 Ca 0.30 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2c41 h GLU 107 Cb 0.04 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 2c41 h GLU 107 CO -0.12 0.81 0.17 1.25 -1.00 0.00 0.00 179.01 180.12 2c41 h LEU 108 N 1.07 0.32 -0.55 1.33 6.46 -0.91 -1.39 115.31 121.64 2c41 h LEU 108 Ca 0.27 -0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.98 2c41 h LEU 108 Cb 0.05 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 2c41 h LEU 108 CO -0.04 0.25 0.25 0.40 -0.62 0.00 0.00 178.44 178.68 2c41 h ILE 109 N 0.36 1.21 -0.33 4.05 2.04 -0.71 -0.87 117.51 123.26 2c41 h ILE 109 Ca 0.10 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.37 2c41 h ILE 109 Cb -0.02 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 2c41 h ILE 109 CO -0.02 0.24 0.20 0.40 0.00 0.00 0.00 178.15 178.97 2c41 h ILE 110 N 0.74 1.05 -0.17 -0.67 2.04 -0.60 0.23 117.51 120.14 2c41 h ILE 110 Ca 0.19 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.94 2c41 h ILE 110 Cb 0.14 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 2c41 h ILE 110 CO -0.02 0.08 -0.03 0.74 0.00 0.00 0.00 178.15 178.92 2c41 h THR 111 N 0.41 0.85 -0.71 -0.27 2.02 -1.07 -2.19 112.91 111.96 2c41 h THR 111 Ca 0.13 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.26 2c41 h THR 111 Cb -0.02 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 2c41 h THR 111 CO -0.05 0.00 0.27 -0.33 0.37 0.00 0.00 175.52 175.78 2c41 h GLU 112 N 0.02 1.07 -0.32 6.66 5.08 -0.75 -1.92 114.58 124.41 2c41 h GLU 112 Ca 0.08 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 2c41 h GLU 112 Cb 0.11 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 2c41 h GLU 112 CO -0.16 0.90 -0.07 0.52 -1.00 0.00 0.00 179.01 179.20 2c41 h MET 113 N 1.02 0.53 -0.29 2.33 2.86 -0.38 0.34 114.93 121.34 2c41 h MET 113 Ca 0.23 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 2c41 h MET 113 Cb 0.24 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 2c41 h MET 113 CO -0.02 0.61 0.02 0.45 1.06 0.00 0.00 176.91 179.04 2c41 h HIS 114 N 0.50 0.53 -0.38 -0.22 3.86 -1.11 0.94 115.15 119.27 2c41 h HIS 114 Ca 0.10 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2c41 h HIS 114 Cb 0.44 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 2c41 h HIS 114 CO 0.02 0.61 0.24 1.96 0.86 0.00 0.00 177.93 181.62 2c41 h GLN 115 N 0.30 0.51 -0.06 2.45 4.20 -0.97 -2.49 115.11 119.05 2c41 h GLN 115 Ca 0.08 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.61 2c41 h GLN 115 Cb 0.38 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2c41 h GLN 115 CO 0.01 0.36 -0.60 -0.44 -0.67 0.00 0.00 178.83 177.49 2c41 h ASP 116 N 0.51 0.24 -0.71 1.46 3.45 -0.25 -1.53 116.42 119.58 2c41 h ASP 116 Ca 0.14 -0.14 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 2c41 h ASP 116 Cb -0.02 -0.07 -0.03 0.00 -0.56 0.00 0.00 39.33 38.64 2c41 h ASP 116 CO -0.03 0.79 0.40 0.00 -1.57 0.00 0.00 179.24 178.83 2c41 h ALA 117 N 1.21 0.91 -0.63 3.45 0.00 -0.72 -1.45 119.26 122.03 2c41 h ALA 117 Ca -0.01 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2c41 h ALA 117 Cb 1.10 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2c41 h ALA 117 CO 0.09 0.41 0.02 1.49 0.00 0.00 0.00 179.25 181.26 2c41 h GLU 118 N 0.97 1.09 -0.29 0.00 4.57 -1.00 -0.13 114.58 119.79 2c41 h GLU 118 Ca 0.25 -0.34 0.02 0.00 -1.18 0.00 0.00 59.36 58.11 2c41 h GLU 118 Cb 0.02 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2c41 h GLU 118 CO -0.04 1.05 0.14 0.82 -1.18 0.00 0.00 179.01 179.80 2c41 h ILE 119 N 1.00 0.99 -0.50 2.32 2.04 -1.13 -0.44 117.51 121.78 2c41 h ILE 119 Ca 0.18 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2c41 h ILE 119 Cb 0.55 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 2c41 h ILE 119 CO 0.03 0.05 0.25 0.00 0.00 0.00 0.00 178.15 178.49 2c41 h ALA 120 N 1.15 0.65 -0.57 1.87 0.00 -1.05 -1.73 119.26 119.59 2c41 h ALA 120 Ca 0.12 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2c41 h ALA 120 Cb 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2c41 h ALA 120 CO -0.09 0.20 0.36 1.15 0.00 0.00 0.00 179.25 180.87 2c41 h THR 121 N 0.67 1.10 0.00 0.00 2.02 -0.75 0.68 112.91 116.63 2c41 h THR 121 Ca 0.17 -0.25 -0.06 0.00 0.77 0.00 0.00 66.41 67.04 2c41 h THR 121 Cb 0.10 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2c41 h THR 121 CO -0.02 0.13 -0.30 -0.33 0.37 0.00 0.00 175.52 175.37 2c41 h GLU 122 N 0.72 0.00 0.00 6.66 5.08 -0.89 -1.36 114.58 124.79 2c41 h GLU 122 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2c41 h GLU 122 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2c41 h GLU 122 CO -0.08 0.30 0.00 0.00 -1.00 0.00 0.00 179.01 178.23 2c41 n ALA 123 N -2.41 2.41 -1.03 3.43 0.00 -0.67 -4.90 120.51 117.34 2c41 n ALA 123 Ca -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 53.44 53.28 2c41 n ALA 123 Cb 0.37 -1.47 -0.00 0.00 0.00 0.00 0.00 19.45 18.35 2c41 n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c41 n GLY 124 N 1.20 0.49 3.40 0.00 0.00 -0.51 -4.97 105.19 104.79 2c41 n GLY 124 Ca 0.13 -0.30 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 2c41 n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2c41 n ASP 125 N 0.37 5.21 0.03 1.61 -0.08 0.17 -4.83 116.55 119.04 2c41 n ASP 125 Ca -0.01 -2.99 0.01 0.00 -1.51 0.00 0.00 54.79 50.29 2c41 n ASP 125 Cb 0.09 -1.56 0.34 0.00 2.34 0.00 0.00 41.12 42.33 2c41 n ASP 125 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 2c41 h ILE 126 N 4.53 1.18 -0.22 5.18 3.07 -1.91 -2.10 117.51 127.24 2c41 h ILE 126 Ca 0.33 -0.70 -0.02 0.00 1.55 0.00 0.00 64.86 66.02 2c41 h ILE 126 Cb 0.84 0.95 -0.01 0.00 -0.27 0.00 0.00 36.82 38.34 2c41 h ILE 126 CO 1.29 0.24 0.06 1.23 -1.05 0.00 0.00 178.15 179.92 2c41 h GLY 127 N 0.77 0.37 1.01 0.16 0.00 -1.96 -1.07 103.07 102.36 2c41 h GLY 127 Ca 0.10 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 2c41 h GLY 127 CO 0.01 0.22 0.01 -0.84 0.00 0.00 0.00 176.54 175.93 2c41 h THR 128 N 0.17 1.26 -0.76 4.70 2.02 -1.90 -0.78 112.91 117.62 2c41 h THR 128 Ca 0.07 -1.07 0.06 0.00 0.77 0.00 0.00 66.41 66.24 2c41 h THR 128 Cb 0.26 0.94 -0.06 0.00 -1.74 0.00 0.00 68.15 67.56 2c41 h THR 128 CO 0.00 0.38 0.46 0.00 0.37 0.00 0.00 175.52 176.73 2c41 h ALA 129 N 0.94 1.03 -0.56 6.16 0.00 -1.36 -1.88 119.26 123.60 2c41 h ALA 129 Ca 0.15 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2c41 h ALA 129 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2c41 h ALA 129 CO 0.02 0.18 0.16 0.22 0.00 0.00 0.00 179.25 179.84 2c41 h ASP 130 N 0.85 0.82 -0.03 0.00 3.58 -0.86 -0.86 116.42 119.92 2c41 h ASP 130 Ca 0.33 -0.21 0.03 0.00 0.42 0.00 0.00 57.03 57.60 2c41 h ASP 130 Cb 0.15 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 40.95 2c41 h ASP 130 CO -0.17 0.82 -0.16 0.25 -2.88 0.00 0.00 179.24 177.10 2c41 h LEU 131 N 0.78 -0.47 -0.98 2.28 5.85 -0.75 0.45 115.31 122.47 2c41 h LEU 131 Ca 0.18 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2c41 h LEU 131 Cb 0.30 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2c41 h LEU 131 CO -0.00 -0.22 0.41 1.88 -0.34 0.00 0.00 178.44 180.17 2c41 h TYR 132 N -0.25 1.12 -0.68 1.25 0.99 -1.22 -0.79 116.97 117.39 2c41 h TYR 132 Ca 0.06 -0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.71 2c41 h TYR 132 Cb 0.33 -0.35 -0.03 0.00 1.00 0.00 0.00 36.73 37.68 2c41 h TYR 132 CO -0.23 0.80 0.25 1.15 -0.00 0.00 0.00 178.16 180.13 2c41 h THR 133 N 1.13 1.25 0.03 -2.88 2.02 -0.67 -0.93 112.91 112.86 2c41 h THR 133 Ca 0.28 -0.80 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 2c41 h THR 133 Cb 0.08 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2c41 h THR 133 CO -0.04 0.32 -0.01 -0.09 0.37 0.00 0.00 175.52 176.06 2c41 h ARG 134 N 0.97 -0.04 -0.38 6.66 2.43 -0.67 -3.33 114.38 120.02 2c41 h ARG 134 Ca 0.22 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2c41 h ARG 134 Cb 0.24 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2c41 h ARG 134 CO -0.01 0.45 0.05 -0.07 -1.51 0.00 0.00 179.97 178.88 2c41 h LEU 135 N -0.54 0.54 -1.57 3.80 3.38 -1.08 -2.75 115.31 117.09 2c41 h LEU 135 Ca -0.00 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2c41 h LEU 135 Cb 0.51 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2c41 h LEU 135 CO 0.01 0.57 -0.05 1.62 0.09 0.00 0.00 178.44 180.68 2c41 h VAL 136 N 0.56 1.13 -0.42 1.22 3.04 -1.27 -1.86 116.25 118.65 2c41 h VAL 136 Ca 0.13 -0.53 -0.06 0.00 -1.01 0.00 0.00 66.70 65.23 2c41 h VAL 136 Cb 0.28 1.07 -0.02 0.00 -2.01 0.00 0.00 31.29 30.61 2c41 h VAL 136 CO 0.00 0.17 0.02 1.56 -1.01 0.00 0.00 177.57 178.31 2c41 h GLN 137 N 0.21 0.66 -0.43 4.17 4.20 -1.60 0.03 115.11 122.35 2c41 h GLN 137 Ca 0.05 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 2c41 h GLN 137 Cb 0.23 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2c41 h GLN 137 CO 0.01 0.67 0.05 1.15 -0.67 0.00 0.00 178.83 180.04 2c41 h THR 138 N 0.63 1.25 -0.86 -0.54 2.02 -1.42 -0.84 112.91 113.14 2c41 h THR 138 Ca 0.13 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.40 2c41 h THR 138 Cb 0.36 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 2c41 h THR 138 CO 0.01 0.32 0.56 0.45 0.37 0.00 0.00 175.52 177.22 2c41 h HIS 139 N 0.57 1.10 -0.63 3.16 3.86 -1.08 -0.90 115.15 121.23 2c41 h HIS 139 Ca 0.13 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.28 2c41 h HIS 139 Cb 0.40 -0.37 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 2c41 h HIS 139 CO 0.03 0.70 0.08 1.96 0.86 0.00 0.00 177.93 181.56 2c41 h GLN 140 N 1.17 1.06 -0.12 2.45 4.20 -0.67 -0.19 115.11 123.01 2c41 h GLN 140 Ca 0.31 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2c41 h GLN 140 Cb -0.11 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.54 2c41 h GLN 140 CO -0.07 0.98 0.07 -0.22 -0.67 0.00 0.00 178.83 178.92 2c41 h LYS 141 N 0.99 0.16 -0.75 1.46 3.64 -0.66 -1.85 116.57 119.55 2c41 h LYS 141 Ca 0.19 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 2c41 h LYS 141 Cb 0.46 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.20 2c41 h LYS 141 CO 0.02 0.17 0.48 0.45 -2.27 0.00 0.00 179.45 178.30 2c41 h HIS 142 N 0.10 0.91 -0.34 1.91 3.86 -0.85 -1.72 115.15 119.02 2c41 h HIS 142 Ca 0.04 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2c41 h HIS 142 Cb 0.06 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.21 2c41 h HIS 142 CO -0.05 0.54 0.23 -0.09 0.86 0.00 0.00 177.93 179.41 2c41 h ARG 143 N 0.96 0.45 0.16 2.45 2.43 -0.92 -1.50 114.38 118.40 2c41 h ARG 143 Ca 0.29 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2c41 h ARG 143 Cb -0.02 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.42 2c41 h ARG 143 CO -0.10 0.30 -0.10 2.35 -1.51 0.00 0.00 179.97 180.92 2c41 h TRP 144 N 0.46 -0.25 -0.32 2.20 7.01 -0.85 -0.80 115.95 123.40 2c41 h TRP 144 Ca 0.12 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.19 2c41 h TRP 144 Cb -0.05 0.09 -0.08 0.00 -2.10 0.00 0.00 29.16 27.02 2c41 h TRP 144 CO -0.05 -0.15 -0.19 0.74 -2.79 0.00 0.00 178.44 175.99 2c41 h PHE 145 N -0.25 -0.48 -0.46 2.65 -1.00 -1.18 -1.53 116.94 114.68 2c41 h PHE 145 Ca -0.01 0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.79 2c41 h PHE 145 Cb 0.21 0.26 -0.02 0.00 3.61 0.00 0.00 35.95 40.01 2c41 h PHE 145 CO -0.08 -0.27 0.25 -0.07 -1.61 0.00 0.00 178.31 176.52 2c41 h LEU 146 N -0.15 0.59 -1.23 1.54 3.38 -1.11 -2.63 115.31 115.69 2c41 h LEU 146 Ca 0.17 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2c41 h LEU 146 Cb 0.41 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2c41 h LEU 146 CO -0.41 0.52 0.49 0.11 0.09 0.00 0.00 178.44 179.24 2c41 h LYS 147 N 0.61 1.01 -0.94 1.13 1.57 -0.70 -2.19 116.57 117.05 2c41 h LYS 147 Ca 0.16 -0.07 0.06 0.00 -1.87 0.00 0.00 60.65 58.93 2c41 h LYS 147 Cb 0.07 -0.22 -0.06 0.00 0.08 0.00 0.00 32.23 32.10 2c41 h LYS 147 CO -0.02 0.68 0.61 0.93 -0.57 0.00 0.00 179.45 181.07 2c41 h GLU 148 N 1.03 1.08 0.00 3.15 4.39 -0.91 -1.45 114.58 121.87 2c41 h GLU 148 Ca 0.28 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.91 2c41 h GLU 148 Cb -0.10 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.30 2c41 h GLU 148 CO -0.06 0.71 -0.02 0.74 -1.16 0.00 0.00 179.01 179.23 2c41 h PHE 149 N 1.11 0.00 0.00 4.33 -1.00 -1.32 -1.97 116.94 118.10 2c41 h PHE 149 Ca 0.39 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.17 2c41 h PHE 149 Cb 0.13 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.69 2c41 h PHE 149 CO -0.00 0.02 -0.59 1.28 -1.61 0.00 0.00 178.31 177.41 2c41 n LEU 150 N -3.49 0.57 -4.76 1.54 4.77 -0.56 -4.93 117.00 110.15 2c41 n LEU 150 Ca -0.03 -0.05 -0.35 0.00 -0.03 0.00 0.00 56.01 55.55 2c41 n LEU 150 Cb 0.11 -0.21 0.03 0.00 -2.33 0.00 0.00 43.42 41.02 2c41 n LEU 150 CO 0.25 0.13 0.80 0.00 -1.33 0.00 0.00 177.39 177.24 2c41 s ALA 151 N -3.02 2.54 0.44 -1.18 0.00 -0.74 -5.06 121.76 114.74 2c41 s ALA 151 Ca 0.10 0.87 0.04 0.00 0.00 0.00 0.00 51.96 52.97 2c41 s ALA 151 Cb 0.17 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 2c41 s ALA 151 CO 0.73 -1.12 0.02 0.15 0.00 0.00 0.00 175.76 175.54 2c41 s LYS 152 N -3.49 2.02 -0.40 0.00 1.02 -1.26 -4.85 119.74 112.79 2c41 s LYS 152 Ca 0.74 -2.22 -0.00 0.00 0.02 0.00 0.00 55.97 54.51 2c41 s LYS 152 Cb -0.27 -1.40 0.00 0.00 -0.52 0.00 0.00 37.83 35.65 2c41 s LYS 152 CO 0.33 -0.24 0.03 0.41 -0.92 0.00 0.00 175.35 174.96 2c41 n GLY 153 N -1.06 0.23 0.27 -3.33 0.00 -1.22 -4.94 105.19 95.14 2c41 n GLY 153 Ca -0.11 -0.66 0.17 0.00 0.00 0.00 0.00 46.02 45.42 2c41 n GLY 153 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2c41 h ASP 154 N -0.08 0.00 0.00 1.61 3.04 -1.82 -3.47 116.42 115.70 2c41 h ASP 154 Ca -0.12 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.67 2c41 h ASP 154 Cb 1.08 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.37 2c41 h ASP 154 CO 0.13 0.01 0.00 0.61 -2.04 0.00 0.00 179.24 177.95 2c41 n GLY 155 N 0.12 1.09 0.54 7.15 0.00 -0.82 -4.85 105.19 108.42 2c41 n GLY 155 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2c41 n GLY 155 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2c41 n LEU 156 N 0.00 1.21 0.00 0.99 4.77 -1.26 -4.89 117.00 117.82 2c41 n LEU 156 Ca 0.00 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2c41 n LEU 156 Cb 0.00 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2c41 n LEU 156 CO 0.00 0.32 0.05 1.33 -1.33 0.00 0.00 177.39 177.76 2c41 n VAL 157 N -3.38 0.00 -1.30 4.08 0.24 -1.26 -5.22 118.33 111.49 2c41 n VAL 157 Ca -0.22 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 2c41 n VAL 157 Cb 0.67 1.49 0.00 0.00 -1.47 0.00 0.00 33.84 34.53 2c41 n VAL 157 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15