#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c41 s PRO 6 N 0.00 2.10 -0.53 1.61 0.05 -1.26 -5.10 135.00 131.87 1c41 s PRO 6 Ca 0.00 -1.21 0.01 0.00 0.05 0.00 0.00 61.00 59.85 1c41 s PRO 6 Cb 0.00 -2.48 0.14 0.00 0.05 0.00 0.00 34.50 32.20 1c41 s PRO 6 CO 0.00 -1.05 0.29 0.95 0.05 0.00 0.00 177.00 177.24 1c41 s THR 7 N -2.88 2.98 1.34 1.26 -4.23 -1.26 -5.11 115.64 107.74 1c41 s THR 7 Ca 0.62 -3.01 -0.19 0.00 -1.18 0.00 0.00 61.69 57.93 1c41 s THR 7 Cb -0.07 -3.03 0.34 0.00 1.34 0.00 0.00 72.50 71.08 1c41 s THR 7 CO 0.41 -0.80 0.96 -2.84 -0.54 0.00 0.00 174.62 171.81 1c41 s PRO 8 N 0.01 -2.27 -0.28 3.99 0.02 -1.26 -5.04 135.00 130.17 1c41 s PRO 8 Ca 0.16 0.36 -0.20 0.00 0.02 0.00 0.00 61.00 61.34 1c41 s PRO 8 Cb -0.23 -1.44 0.10 0.00 0.02 0.00 0.00 34.50 32.96 1c41 s PRO 8 CO -0.02 -4.49 0.83 -0.65 -0.33 0.00 0.00 177.00 172.33 1c41 s GLN 9 N -4.86 0.62 -0.22 5.54 -0.21 -1.26 -5.14 119.66 114.12 1c41 s GLN 9 Ca 0.69 0.92 -0.08 0.00 0.02 0.00 0.00 55.36 56.90 1c41 s GLN 9 Cb -0.17 0.21 -0.04 0.00 1.00 0.00 0.00 33.01 34.00 1c41 s GLN 9 CO 0.60 -0.10 0.10 -1.14 -2.12 0.00 0.00 175.29 172.62 1c41 s GLN 10 N 1.01 3.91 0.43 2.91 0.74 -1.26 -4.86 119.66 122.55 1c41 s GLN 10 Ca -0.05 -0.36 0.07 0.00 0.05 0.00 0.00 55.36 55.06 1c41 s GLN 10 Cb -0.05 -3.35 -0.04 0.00 1.10 0.00 0.00 33.01 30.67 1c41 s GLN 10 CO -0.11 0.06 0.18 -1.01 -0.55 0.00 0.00 175.29 173.86 1c41 s HIS 11 N 0.98 2.44 0.00 1.67 3.76 -1.26 -5.09 115.29 117.79 1c41 s HIS 11 Ca 0.05 -0.65 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 1c41 s HIS 11 Cb -0.14 -1.92 0.00 0.00 1.11 0.00 0.00 32.58 31.63 1c41 s HIS 11 CO 0.03 0.13 0.62 -3.47 -0.85 0.00 0.00 174.74 171.20 1c41 n ASP 12 N -1.29 0.00 -3.98 1.40 -0.08 -1.26 -4.81 116.55 106.54 1c41 n ASP 12 Ca -0.03 0.62 -0.28 0.00 -1.51 0.00 0.00 54.79 53.60 1c41 n ASP 12 Cb 0.65 -0.14 -0.01 0.00 2.34 0.00 0.00 41.12 43.96 1c41 n ASP 12 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1c41 n GLY 13 N -0.53 -0.31 0.00 0.27 0.00 -1.26 -4.26 105.19 99.11 1c41 n GLY 13 Ca 0.00 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.25 1c41 n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c41 n SER 14 N -2.91 0.95 -1.26 1.61 3.41 -1.26 -2.85 113.62 111.32 1c41 n SER 14 Ca -0.18 -0.43 0.09 0.00 -0.26 0.00 0.00 58.87 58.08 1c41 n SER 14 Cb 0.62 1.40 0.30 0.00 -0.26 0.00 0.00 64.21 66.27 1c41 n SER 14 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c41 n ALA 15 N -1.75 2.76 -2.58 7.33 0.00 -1.26 -4.46 120.51 120.55 1c41 n ALA 15 Ca -0.00 -1.54 -0.31 0.00 0.00 0.00 0.00 53.44 51.59 1c41 n ALA 15 Cb 0.35 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 1c41 n ALA 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1c41 s LEU 16 N -1.65 4.20 -0.20 0.00 1.02 -1.26 -5.05 118.68 115.75 1c41 s LEU 16 Ca 0.44 0.69 0.01 0.00 0.02 0.00 0.00 54.13 55.28 1c41 s LEU 16 Cb 0.27 -3.44 0.05 0.00 0.02 0.00 0.00 46.19 43.09 1c41 s LEU 16 CO 0.22 -0.03 -0.08 -0.60 0.02 0.00 0.00 176.35 175.89 1c41 s ARG 17 N -2.88 1.79 -0.09 1.70 3.52 -1.26 -4.65 118.95 117.07 1c41 s ARG 17 Ca 0.43 -0.81 -0.02 0.00 -0.13 0.00 0.00 55.73 55.20 1c41 s ARG 17 Cb -0.12 -2.38 -0.03 0.00 -1.56 0.00 0.00 34.95 30.87 1c41 s ARG 17 CO 0.25 -0.48 0.00 0.42 -0.81 0.00 0.00 175.30 174.68 1c41 s ILE 18 N 1.45 4.30 -0.12 4.11 -1.09 -0.13 -0.26 121.20 129.45 1c41 s ILE 18 Ca -0.02 -0.25 0.00 0.00 -2.23 0.00 0.00 60.65 58.15 1c41 s ILE 18 Cb -0.17 -2.82 -0.02 0.00 -1.58 0.00 0.00 42.46 37.88 1c41 s ILE 18 CO -0.08 0.59 -0.13 -0.83 -1.23 0.00 0.00 174.94 173.27 1c41 s GLY 19 N -0.75 1.55 -0.06 6.18 0.00 -0.84 -1.09 107.32 112.31 1c41 s GLY 19 Ca 0.12 -0.90 0.04 0.00 0.00 0.00 0.00 44.72 43.98 1c41 s GLY 19 CO 0.02 -0.27 -0.18 -0.42 0.00 0.00 0.00 173.10 172.26 1c41 s ILE 20 N 0.20 1.53 -0.11 0.90 1.01 0.84 -0.92 121.20 124.64 1c41 s ILE 20 Ca -0.08 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.82 1c41 s ILE 20 Cb -0.15 -1.33 0.02 0.00 0.01 0.00 0.00 42.46 41.01 1c41 s ILE 20 CO 0.05 0.44 -0.11 -0.69 0.00 0.00 0.00 174.94 174.63 1c41 s VAL 21 N 0.16 1.23 0.09 2.92 1.01 -0.58 -0.92 120.40 124.30 1c41 s VAL 21 Ca -0.07 -0.45 0.09 0.00 0.00 0.00 0.00 61.98 61.54 1c41 s VAL 21 Cb -0.13 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 1c41 s VAL 21 CO 0.03 0.40 -0.22 -1.38 0.00 0.00 0.00 175.10 173.93 1c41 s HIS 22 N 1.36 1.92 0.81 5.22 -3.43 -0.74 -1.41 115.29 119.02 1c41 s HIS 22 Ca -0.00 -0.40 -0.10 0.00 -0.80 0.00 0.00 55.06 53.76 1c41 s HIS 22 Cb -0.14 -1.08 0.11 0.00 -1.43 0.00 0.00 32.58 30.05 1c41 s HIS 22 CO -0.05 0.19 1.14 0.00 -2.00 0.00 0.00 174.74 174.02 1c41 s ALA 23 N -1.03 2.83 -0.97 -1.38 0.00 -0.06 -1.49 121.76 119.67 1c41 s ALA 23 Ca 0.08 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.10 1c41 s ALA 23 Cb -0.10 -2.67 0.10 0.00 0.00 0.00 0.00 23.12 20.46 1c41 s ALA 23 CO 0.04 -1.74 0.86 0.54 0.00 0.00 0.00 175.76 175.46 1c41 n ARG 24 N -3.25 0.77 -2.48 0.00 1.74 -0.13 -4.78 116.66 108.53 1c41 n ARG 24 Ca 0.11 -1.20 -0.41 0.00 -0.77 0.00 0.00 57.85 55.58 1c41 n ARG 24 Cb 0.60 -1.17 -0.04 0.00 -1.02 0.00 0.00 32.46 30.83 1c41 n ARG 24 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1c41 s TRP 25 N -0.76 3.57 -1.07 -1.55 0.52 -1.13 -3.33 118.94 115.19 1c41 s TRP 25 Ca 0.11 1.62 -0.00 0.00 0.02 0.00 0.00 56.10 57.85 1c41 s TRP 25 Cb 0.07 -3.30 -0.01 0.00 -1.15 0.00 0.00 33.47 29.09 1c41 s TRP 25 CO 0.11 -0.66 0.90 0.09 0.02 0.00 0.00 176.95 177.40 1c41 n ASN 26 N 1.86 -2.40 -0.16 2.95 3.02 -1.26 -4.57 115.26 114.69 1c41 n ASN 26 Ca 0.01 -0.57 0.11 0.00 -0.03 0.00 0.00 54.58 54.11 1c41 n ASN 26 Cb 0.45 -4.68 0.44 0.00 -0.61 0.00 0.00 39.78 35.38 1c41 n ASN 26 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1c41 h GLU 27 N -1.65 0.54 0.00 3.52 5.08 -1.91 0.03 114.58 120.20 1c41 h GLU 27 Ca -0.53 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 1c41 h GLU 27 Cb 1.30 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1c41 h GLU 27 CO 0.45 0.36 0.00 0.25 -1.00 0.00 0.00 179.01 179.07 1c41 n THR 28 N -4.49 1.06 -0.10 1.13 -2.24 -1.26 -0.78 114.28 107.61 1c41 n THR 28 Ca 0.12 0.62 -0.13 0.00 -2.27 0.00 0.00 64.05 62.40 1c41 n THR 28 Cb 0.38 -1.61 -0.11 0.00 -2.10 0.00 0.00 70.33 66.90 1c41 n THR 28 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1c41 n ILE 29 N -2.20 1.19 -0.08 2.28 2.08 -0.12 -4.36 119.36 118.15 1c41 n ILE 29 Ca -0.01 -0.53 -0.09 0.00 0.56 0.00 0.00 62.75 62.69 1c41 n ILE 29 Cb 0.07 -1.06 -0.02 0.00 -0.75 0.00 0.00 39.64 37.88 1c41 n ILE 29 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 1c41 h ILE 30 N 0.00 1.08 0.17 1.39 1.08 -0.15 -2.70 117.51 118.38 1c41 h ILE 30 Ca -0.46 -0.16 0.01 0.00 -0.39 0.00 0.00 64.86 63.85 1c41 h ILE 30 Cb 1.81 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 36.20 1c41 h ILE 30 CO -0.05 0.08 -0.21 -0.08 -0.69 0.00 0.00 178.15 177.20 1c41 h GLU 31 N 0.39 -0.42 -1.01 2.37 4.22 -1.19 0.33 114.58 119.27 1c41 h GLU 31 Ca 0.11 0.03 0.11 0.00 0.08 0.00 0.00 59.36 59.68 1c41 h GLU 31 Cb -0.03 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 1c41 h GLU 31 CO -0.02 -0.28 0.64 -1.35 -2.18 0.00 0.00 179.01 175.81 1c41 h PRO 32 N -0.44 1.01 0.65 0.92 0.11 -1.75 0.25 132.00 132.76 1c41 h PRO 32 Ca 0.01 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 1c41 h PRO 32 Cb 0.43 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 31.32 1c41 h PRO 32 CO -0.08 0.67 -0.31 -0.07 -0.21 0.00 0.00 178.00 178.00 1c41 h LEU 33 N 1.04 -0.74 -0.83 2.35 3.38 -1.08 -1.95 115.31 117.48 1c41 h LEU 33 Ca 0.48 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.58 1c41 h LEU 33 Cb 0.41 0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.26 1c41 h LEU 33 CO -0.24 -0.39 0.41 0.25 0.09 0.00 0.00 178.44 178.57 1c41 h LEU 34 N -1.12 0.49 0.04 1.67 5.85 0.04 -0.65 115.31 121.63 1c41 h LEU 34 Ca -0.09 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1c41 h LEU 34 Cb 0.71 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 1c41 h LEU 34 CO 0.15 0.21 -0.15 0.00 -0.34 0.00 0.00 178.44 178.30 1c41 h ALA 35 N 1.55 -0.21 -0.66 1.25 0.00 -0.47 0.67 119.26 121.39 1c41 h ALA 35 Ca 0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1c41 h ALA 35 Cb 0.64 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1c41 h ALA 35 CO -0.37 -0.66 0.38 0.78 0.00 0.00 0.00 179.25 179.39 1c41 h GLY 36 N -0.27 0.98 0.89 0.00 0.00 -0.46 0.43 103.07 104.64 1c41 h GLY 36 Ca 0.04 -0.43 -0.06 0.00 0.00 0.00 0.00 47.33 46.88 1c41 h GLY 36 CO -0.11 0.41 -0.05 0.00 0.00 0.00 0.00 176.54 176.79 1c41 h THR 37 N 0.90 1.27 -0.61 4.70 1.03 -0.89 -2.14 112.91 117.19 1c41 h THR 37 Ca 0.23 -1.05 -0.02 0.00 -0.01 0.00 0.00 66.41 65.57 1c41 h THR 37 Cb 0.02 1.34 -0.03 0.00 -1.07 0.00 0.00 68.15 68.41 1c41 h THR 37 CO -0.04 0.34 0.32 0.50 -0.01 0.00 0.00 175.52 176.63 1c41 h LYS 38 N 0.35 0.85 0.02 0.00 3.64 -0.68 -2.00 116.57 118.75 1c41 h LYS 38 Ca 0.08 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1c41 h LYS 38 Cb 0.52 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1c41 h LYS 38 CO 0.02 0.66 -0.29 0.00 -2.27 0.00 0.00 179.45 177.57 1c41 h ALA 39 N 1.14 -0.76 -0.40 5.00 0.00 -0.74 -1.40 119.26 122.11 1c41 h ALA 39 Ca 0.21 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.19 1c41 h ALA 39 Cb 0.07 0.74 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1c41 h ALA 39 CO -0.03 -0.85 0.35 0.87 0.00 0.00 0.00 179.25 179.59 1c41 h LYS 40 N -0.38 0.00 0.52 0.00 1.79 -1.28 0.66 116.57 117.88 1c41 h LYS 40 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 1c41 h LYS 40 Cb 0.40 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.06 1c41 h LYS 40 CO -0.19 0.00 -0.25 -0.07 -1.08 0.00 0.00 179.45 177.86 1c41 h LEU 41 N 0.00 -0.59 -0.38 2.94 3.38 -0.50 -1.63 115.31 118.53 1c41 h LEU 41 Ca 0.19 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.15 1c41 h LEU 41 Cb 0.89 0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1c41 h LEU 41 CO -0.00 -0.31 0.17 -0.07 0.09 0.00 0.00 178.44 178.32 1c41 h LEU 42 N -0.87 0.23 -1.78 1.67 3.38 -0.67 0.49 115.31 117.75 1c41 h LEU 42 Ca -0.07 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.03 1c41 h LEU 42 Cb 0.60 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1c41 h LEU 42 CO 0.12 0.17 0.53 0.00 0.09 0.00 0.00 178.44 179.35 1c41 h ALA 43 N 1.22 1.98 -0.29 1.53 0.00 -0.75 0.87 119.26 123.81 1c41 h ALA 43 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1c41 h ALA 43 Cb 0.10 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1c41 h ALA 43 CO -0.14 -0.70 0.00 0.00 0.00 0.00 0.00 179.25 178.41 1c41 n GLY 45 N 1.40 0.68 3.71 0.00 0.00 0.30 -4.37 105.19 106.91 1c41 n GLY 45 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1c41 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c41 s VAL 46 N -2.21 3.31 0.15 1.61 1.01 -0.94 -4.10 120.40 119.23 1c41 s VAL 46 Ca 0.00 0.88 -0.31 0.00 0.00 0.00 0.00 61.98 62.55 1c41 s VAL 46 Cb 0.00 -3.57 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 1c41 s VAL 46 CO 0.00 0.04 1.37 -0.54 0.00 0.00 0.00 175.10 175.97 1c41 s LYS 47 N 1.57 4.34 0.34 2.72 1.02 -1.26 -4.26 119.74 124.21 1c41 s LYS 47 Ca 0.66 2.08 0.14 0.00 0.02 0.00 0.00 55.97 58.87 1c41 s LYS 47 Cb -0.36 -3.22 1.11 0.00 -0.52 0.00 0.00 37.83 34.83 1c41 s LYS 47 CO 0.30 -0.38 1.63 1.49 -0.92 0.00 0.00 175.35 177.46 1c41 h GLU 48 N 6.29 0.18 0.00 1.68 4.57 -1.96 0.89 114.58 126.23 1c41 h GLU 48 Ca -0.43 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1c41 h GLU 48 Cb 1.21 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 1c41 h GLU 48 CO 0.83 0.12 0.00 -1.13 -1.18 0.00 0.00 179.01 177.65 1c41 n SER 49 N -5.17 0.68 -1.32 1.04 3.41 -1.26 -2.75 113.62 108.25 1c41 n SER 49 Ca 0.32 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.64 1c41 n SER 49 Cb 1.04 -0.78 0.30 0.00 -0.26 0.00 0.00 64.21 64.51 1c41 n SER 49 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c41 n ASN 50 N -2.20 3.87 -4.19 4.04 3.02 0.31 -2.36 115.26 117.74 1c41 n ASN 50 Ca 0.04 -2.21 -0.36 0.00 -0.03 0.00 0.00 54.58 52.01 1c41 n ASN 50 Cb 0.31 -0.49 -0.13 0.00 -0.61 0.00 0.00 39.78 38.86 1c41 n ASN 50 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1c41 s ILE 51 N -1.51 3.30 -0.07 2.41 1.01 -1.11 -0.96 121.20 124.27 1c41 s ILE 51 Ca 0.44 -1.46 -0.13 0.00 0.00 0.00 0.00 60.65 59.50 1c41 s ILE 51 Cb 0.26 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.71 1c41 s ILE 51 CO 0.25 -0.26 0.33 -0.69 0.00 0.00 0.00 174.94 174.56 1c41 s VAL 52 N 1.27 5.21 -0.16 2.92 1.01 -0.25 -5.01 120.40 125.39 1c41 s VAL 52 Ca -0.01 0.64 -0.04 0.00 0.00 0.00 0.00 61.98 62.57 1c41 s VAL 52 Cb -0.20 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.60 1c41 s VAL 52 CO -0.01 0.53 0.06 -0.69 0.00 0.00 0.00 175.10 174.99 1c41 s VAL 53 N -0.60 0.18 0.31 2.92 1.01 -1.26 -0.11 120.40 122.85 1c41 s VAL 53 Ca 0.20 -0.25 0.09 0.00 0.00 0.00 0.00 61.98 62.02 1c41 s VAL 53 Cb -0.15 -0.71 -0.06 0.00 0.00 0.00 0.00 36.38 35.46 1c41 s VAL 53 CO 0.09 -0.18 -0.11 -1.10 0.00 0.00 0.00 175.10 173.80 1c41 s GLN 54 N 2.02 1.70 0.33 2.72 -0.21 -0.10 -5.00 119.66 121.13 1c41 s GLN 54 Ca 0.01 -1.85 0.05 0.00 0.02 0.00 0.00 55.36 53.59 1c41 s GLN 54 Cb -0.16 -1.55 -0.07 0.00 1.00 0.00 0.00 33.01 32.23 1c41 s GLN 54 CO -0.08 0.16 0.04 -1.54 -2.12 0.00 0.00 175.29 171.74 1c41 s SER 55 N -3.53 2.67 0.09 5.90 1.04 -1.26 -1.79 113.70 116.83 1c41 s SER 55 Ca 0.31 -1.35 -0.08 0.00 0.48 0.00 0.00 55.95 55.30 1c41 s SER 55 Cb 0.01 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.98 1c41 s SER 55 CO 0.15 -0.55 0.18 0.68 0.98 0.00 0.00 173.24 174.68 1c41 s VAL 56 N -3.16 0.14 0.04 5.02 -7.23 -0.55 -4.89 120.40 109.76 1c41 s VAL 56 Ca 0.35 -1.27 -0.27 0.00 -1.81 0.00 0.00 61.98 58.99 1c41 s VAL 56 Cb 0.08 -1.42 -0.15 0.00 0.56 0.00 0.00 36.38 35.45 1c41 s VAL 56 CO 0.16 -0.64 1.39 1.55 -0.31 0.00 0.00 175.10 177.25 1c41 h PRO 57 N 2.76 -0.93 -5.20 4.82 0.13 -1.93 -0.61 132.00 131.03 1c41 h PRO 57 Ca -0.34 0.06 -0.68 0.00 -0.87 0.00 0.00 66.00 64.18 1c41 h PRO 57 Cb 1.20 0.21 -0.13 0.00 0.13 0.00 0.00 31.00 32.41 1c41 h PRO 57 CO 0.56 -0.62 -0.52 0.20 -0.23 0.00 0.00 178.00 177.39 1c41 s GLY 58 N -1.73 3.01 0.43 1.56 0.00 -1.26 -0.96 107.32 108.36 1c41 s GLY 58 Ca -0.14 -0.44 0.12 0.00 0.00 0.00 0.00 44.72 44.26 1c41 s GLY 58 CO 0.42 -2.19 1.98 1.76 0.00 0.00 0.00 173.10 175.08 1c41 h SER 59 N 1.37 0.13 -0.56 1.64 0.02 -1.94 -2.40 113.55 111.82 1c41 h SER 59 Ca -0.44 -0.02 0.11 0.00 -0.84 0.00 0.00 61.79 60.61 1c41 h SER 59 Cb 1.31 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.79 1c41 h SER 59 CO 0.74 0.26 0.38 -0.25 -1.14 0.00 0.00 176.83 176.82 1c41 h TRP 60 N 0.14 0.29 0.00 3.45 2.91 -1.96 0.13 115.95 120.91 1c41 h TRP 60 Ca 0.03 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.06 1c41 h TRP 60 Cb 0.28 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 28.83 1c41 h TRP 60 CO 0.00 0.13 0.00 0.93 -1.03 0.00 0.00 178.44 178.48 1c41 h GLU 61 N 0.27 0.00 0.01 2.65 3.07 -1.84 -3.37 114.58 115.37 1c41 h GLU 61 Ca 0.26 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.14 1c41 h GLU 61 Cb 0.67 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.54 1c41 h GLU 61 CO -0.06 0.00 -0.45 -0.07 -1.40 0.00 0.00 179.01 177.03 1c41 h LEU 62 N 0.00 -1.39 -0.32 1.33 4.07 -0.79 0.11 115.31 118.33 1c41 h LEU 62 Ca 0.00 0.15 0.04 0.00 0.08 0.00 0.00 57.88 58.15 1c41 h LEU 62 Cb 0.79 0.53 -0.04 0.00 1.08 0.00 0.00 40.66 43.01 1c41 h LEU 62 CO 0.00 -0.44 0.10 1.55 -1.08 0.00 0.00 178.44 178.57 1c41 h PRO 63 N -0.57 0.22 -0.64 1.13 0.13 -1.73 0.14 132.00 130.68 1c41 h PRO 63 Ca 0.01 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 1c41 h PRO 63 Cb 0.61 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 1c41 h PRO 63 CO -0.30 0.15 0.36 0.97 -0.23 0.00 0.00 178.00 178.95 1c41 h ILE 64 N 0.23 1.20 -0.54 -3.56 6.09 -1.75 -0.49 117.51 118.69 1c41 h ILE 64 Ca 0.14 -0.49 -0.02 0.00 -1.37 0.00 0.00 64.86 63.12 1c41 h ILE 64 Cb 0.12 0.36 -0.03 0.00 0.47 0.00 0.00 36.82 37.75 1c41 h ILE 64 CO -0.16 0.22 0.28 0.00 -3.07 0.00 0.00 178.15 175.42 1c41 h ALA 65 N 1.18 0.70 -0.59 0.18 0.00 -0.39 -1.61 119.26 118.72 1c41 h ALA 65 Ca 0.23 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1c41 h ALA 65 Cb 0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1c41 h ALA 65 CO -0.04 0.24 0.10 0.28 0.00 0.00 0.00 179.25 179.83 1c41 h VAL 66 N 0.73 1.26 -0.52 0.00 2.07 -0.39 0.38 116.25 119.78 1c41 h VAL 66 Ca 0.19 -0.99 0.01 0.00 0.82 0.00 0.00 66.70 66.73 1c41 h VAL 66 Cb 0.08 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1c41 h VAL 66 CO -0.03 0.36 0.34 -0.61 0.02 0.00 0.00 177.57 177.65 1c41 h GLN 67 N 0.88 0.66 -0.11 1.57 4.15 -0.81 -2.26 115.11 119.20 1c41 h GLN 67 Ca 0.18 -0.04 -0.20 0.00 0.77 0.00 0.00 58.65 59.36 1c41 h GLN 67 Cb 0.42 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.96 1c41 h GLN 67 CO 0.01 0.44 -0.76 0.00 -1.93 0.00 0.00 178.83 176.59 1c41 h ARG 68 N 0.68 0.58 0.32 1.69 2.47 -1.16 -1.80 114.38 117.16 1c41 h ARG 68 Ca 0.20 -0.48 -0.01 0.00 -1.26 0.00 0.00 59.98 58.43 1c41 h ARG 68 Cb -0.05 0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 1c41 h ARG 68 CO -0.06 1.10 -0.25 1.25 0.56 0.00 0.00 179.97 182.58 1c41 h LEU 69 N 0.39 -0.64 -0.34 3.04 6.46 -0.72 0.14 115.31 123.64 1c41 h LEU 69 Ca -0.04 0.05 0.05 0.00 -0.12 0.00 0.00 57.88 57.81 1c41 h LEU 69 Cb 1.36 0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 41.45 1c41 h LEU 69 CO 0.14 -0.38 0.09 0.22 -0.62 0.00 0.00 178.44 177.89 1c41 h TYR 70 N -0.57 0.15 -0.74 1.25 3.20 -1.46 -1.07 116.97 117.73 1c41 h TYR 70 Ca -0.02 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.03 1c41 h TYR 70 Cb 0.50 -0.02 -0.12 0.00 1.54 0.00 0.00 36.73 38.63 1c41 h TYR 70 CO -0.13 0.04 0.11 1.03 -1.64 0.00 0.00 178.16 177.57 1c41 h SER 71 N 0.21 -0.14 0.35 -2.11 0.87 -0.73 -1.43 113.55 110.57 1c41 h SER 71 Ca 0.16 0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.87 1c41 h SER 71 Cb 0.16 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1c41 h SER 71 CO -0.19 -0.10 -0.17 0.00 -0.53 0.00 0.00 176.83 175.83 1c41 h ALA 72 N 1.65 -0.47 -0.94 6.23 0.00 0.47 -2.44 119.26 123.76 1c41 h ALA 72 Ca 0.42 -0.14 0.27 0.00 0.00 0.00 0.00 54.91 55.46 1c41 h ALA 72 Cb 0.73 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 1c41 h ALA 72 CO -0.58 -0.70 0.79 0.66 0.00 0.00 0.00 179.25 179.42 1c41 h SER 73 N -0.60 0.00 -0.15 0.00 4.64 -0.32 0.15 113.55 117.28 1c41 h SER 73 Ca -0.05 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.16 1c41 h SER 73 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1c41 h SER 73 CO 0.08 0.00 -0.34 1.56 -0.87 0.00 0.00 176.83 177.26 1c41 h GLN 74 N 0.00 0.49 -0.04 4.77 4.20 -0.89 -3.05 115.11 120.59 1c41 h GLN 74 Ca 0.45 -0.33 0.01 0.00 0.06 0.00 0.00 58.65 58.84 1c41 h GLN 74 Cb 2.02 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 29.85 1c41 h GLN 74 CO -0.00 0.94 0.11 -0.07 -0.67 0.00 0.00 178.83 179.13 1c41 h LEU 75 N 0.11 0.00 0.00 1.46 3.38 -0.59 -3.46 115.31 116.21 1c41 h LEU 75 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1c41 h LEU 75 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1c41 h LEU 75 CO 0.07 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.60 1c41 n GLN 76 N -3.31 0.00 -1.05 1.13 6.02 -1.14 -5.13 117.38 113.90 1c41 n GLN 76 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 1c41 n GLN 76 Cb 0.19 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.38 1c41 n GLN 76 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1c41 n SER 107 N 0.00 0.72 -0.81 1.08 3.41 -0.99 -4.80 113.62 112.23 1c41 n SER 107 Ca 0.00 0.70 0.01 0.00 -0.26 0.00 0.00 58.87 59.33 1c41 n SER 107 Cb 0.00 -0.54 -0.01 0.00 -0.26 0.00 0.00 64.21 63.40 1c41 n SER 107 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1c41 n THR 108 N 2.61 -0.24 0.00 6.66 -2.24 -1.26 -5.03 114.28 114.78 1c41 n THR 108 Ca 0.21 0.16 0.00 0.00 -2.27 0.00 0.00 64.05 62.15 1c41 n THR 108 Cb -0.04 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 1c41 n THR 108 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c41 n GLY 109 N -2.76 1.39 3.65 3.38 0.00 -1.26 -4.99 105.19 104.61 1c41 n GLY 109 Ca -0.01 -1.37 -0.44 0.00 0.00 0.00 0.00 46.02 44.20 1c41 n GLY 109 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1c41 n PRO 110 N 2.67 1.79 -1.65 1.61 -0.04 -1.19 -4.87 135.00 133.32 1c41 n PRO 110 Ca 0.00 0.63 -0.38 0.00 -0.04 0.00 0.00 63.50 63.71 1c41 n PRO 110 Cb 0.00 -2.15 0.06 0.00 -0.04 0.00 0.00 33.50 31.36 1c41 n PRO 110 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1c41 n PHE 111 N 0.73 1.18 0.28 0.54 3.72 -1.26 -4.86 117.46 117.79 1c41 n PHE 111 Ca 0.09 0.43 0.11 0.00 -0.05 0.00 0.00 57.45 58.03 1c41 n PHE 111 Cb 0.33 -2.18 0.00 0.00 -0.94 0.00 0.00 39.48 36.69 1c41 n PHE 111 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1c41 n ASP 112 N -1.04 0.64 -3.53 4.37 8.00 0.64 -4.95 116.55 120.68 1c41 n ASP 112 Ca 0.14 0.10 -0.15 0.00 0.71 0.00 0.00 54.79 55.59 1c41 n ASP 112 Cb 0.47 0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 42.26 1c41 n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1c41 s ALA 113 N -3.32 -1.81 0.14 2.24 0.00 -1.24 -4.31 121.76 113.45 1c41 s ALA 113 Ca 0.00 1.33 0.07 0.00 0.00 0.00 0.00 51.96 53.37 1c41 s ALA 113 Cb 0.12 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1c41 s ALA 113 CO 0.80 -0.39 -0.17 -0.51 0.00 0.00 0.00 175.76 175.49 1c41 s LEU 114 N -1.33 2.39 -0.05 0.00 1.43 0.03 -1.99 118.68 119.17 1c41 s LEU 114 Ca -0.07 -0.80 0.01 0.00 -1.03 0.00 0.00 54.13 52.24 1c41 s LEU 114 Cb -0.00 -0.73 0.02 0.00 0.03 0.00 0.00 46.19 45.51 1c41 s LEU 114 CO 0.05 -0.06 -0.07 -0.63 0.23 0.00 0.00 176.35 175.88 1c41 s ILE 115 N -1.89 0.72 -0.22 -0.59 1.01 -0.10 0.27 121.20 120.40 1c41 s ILE 115 Ca 0.11 -0.22 -0.04 0.00 0.00 0.00 0.00 60.65 60.49 1c41 s ILE 115 Cb -0.06 -0.72 -0.01 0.00 0.01 0.00 0.00 42.46 41.68 1c41 s ILE 115 CO 0.05 0.27 -0.02 0.00 0.00 0.00 0.00 174.94 175.23 1c41 s ALA 116 N 0.91 2.89 -0.17 9.38 0.00 -0.65 -1.53 121.76 132.59 1c41 s ALA 116 Ca -0.11 -1.14 -0.01 0.00 0.00 0.00 0.00 51.96 50.70 1c41 s ALA 116 Cb -0.15 -1.76 -0.00 0.00 0.00 0.00 0.00 23.12 21.21 1c41 s ALA 116 CO 0.01 -0.39 -0.12 0.42 0.00 0.00 0.00 175.76 175.67 1c41 s ILE 117 N 1.42 2.91 0.11 0.00 1.01 -0.50 -0.07 121.20 126.09 1c41 s ILE 117 Ca 0.05 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 59.89 1c41 s ILE 117 Cb -0.14 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.09 1c41 s ILE 117 CO -0.01 0.49 0.32 -0.83 0.00 0.00 0.00 174.94 174.91 1c41 s GLY 118 N 0.96 -0.12 -0.27 6.18 0.00 -0.69 -0.88 107.32 112.51 1c41 s GLY 118 Ca -0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 44.72 44.39 1c41 s GLY 118 CO -0.01 -0.50 0.09 0.14 0.00 0.00 0.00 173.10 172.82 1c41 s VAL 119 N -3.83 0.39 -0.13 1.40 1.01 -1.26 -0.77 120.40 117.21 1c41 s VAL 119 Ca 0.04 -0.89 -0.10 0.00 0.00 0.00 0.00 61.98 61.03 1c41 s VAL 119 Cb 0.03 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.17 1c41 s VAL 119 CO -0.11 -0.56 0.21 -0.76 0.00 0.00 0.00 175.10 173.88 1c41 s LEU 120 N 1.88 4.33 -0.05 3.92 2.01 0.14 -4.80 118.68 126.11 1c41 s LEU 120 Ca 0.06 0.50 0.02 0.00 0.01 0.00 0.00 54.13 54.72 1c41 s LEU 120 Cb -0.17 -2.22 0.02 0.00 0.01 0.00 0.00 46.19 43.83 1c41 s LEU 120 CO -0.24 0.27 -0.08 -0.63 1.01 0.00 0.00 176.35 176.68 1c41 s ILE 121 N -0.38 0.83 0.09 -0.59 1.01 -1.26 -1.27 121.20 119.62 1c41 s ILE 121 Ca 0.15 -0.30 -0.36 0.00 0.00 0.00 0.00 60.65 60.14 1c41 s ILE 121 Cb -0.13 -0.79 -0.16 0.00 0.01 0.00 0.00 42.46 41.39 1c41 s ILE 121 CO 0.04 0.29 1.41 1.17 0.00 0.00 0.00 174.94 177.85 1c41 n LYS 122 N 3.89 1.38 0.00 2.79 0.00 -0.80 -4.85 118.16 120.56 1c41 n LYS 122 Ca -0.24 0.50 0.00 0.00 0.00 0.00 0.00 58.31 58.57 1c41 n LYS 122 Cb 0.51 -2.17 0.00 0.00 0.00 0.00 0.00 35.03 33.37 1c41 n LYS 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1c41 n GLY 123 N 2.79 2.15 0.06 3.14 0.00 -1.26 -4.94 105.19 107.13 1c41 n GLY 123 Ca 0.18 -1.81 0.09 0.00 0.00 0.00 0.00 46.02 44.48 1c41 n GLY 123 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1c41 n GLU 124 N 0.00 0.64 -2.73 1.61 1.02 -1.26 -4.97 120.64 114.95 1c41 n GLU 124 Ca 0.00 -0.03 -0.14 0.00 -0.02 0.00 0.00 57.16 56.96 1c41 n GLU 124 Cb 0.00 -1.65 0.01 0.00 -0.02 0.00 0.00 31.44 29.77 1c41 n GLU 124 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1c41 n THR 125 N -2.50 0.00 1.66 2.62 -2.24 -1.26 -5.01 114.28 107.54 1c41 n THR 125 Ca -0.05 -1.22 0.08 0.00 -2.27 0.00 0.00 64.05 60.59 1c41 n THR 125 Cb 0.63 -0.29 0.38 0.00 -2.10 0.00 0.00 70.33 68.95 1c41 n THR 125 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1c41 n MET 126 N -1.29 1.30 -0.18 -0.78 2.81 -1.26 -4.07 117.12 113.65 1c41 n MET 126 Ca 0.00 -0.46 -0.01 0.00 -1.81 0.00 0.00 57.70 55.43 1c41 n MET 126 Cb 0.35 -1.28 0.08 0.00 -0.71 0.00 0.00 33.22 31.67 1c41 n MET 126 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1c41 h HIS 127 N 0.88 0.01 -0.22 2.03 6.17 -1.97 -2.02 115.15 120.02 1c41 h HIS 127 Ca 0.00 0.04 0.05 0.00 0.71 0.00 0.00 60.37 61.17 1c41 h HIS 127 Cb 0.19 0.08 -0.07 0.00 2.52 0.00 0.00 27.41 30.13 1c41 h HIS 127 CO 0.05 -0.12 -0.45 0.35 0.71 0.00 0.00 177.93 178.48 1c41 h PHE 128 N 0.14 -1.31 -0.60 5.26 3.57 -1.89 -1.91 116.94 120.20 1c41 h PHE 128 Ca 0.29 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 1c41 h PHE 128 Cb 0.45 0.60 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1c41 h PHE 128 CO -0.32 -0.48 0.16 1.05 -2.23 0.00 0.00 178.31 176.49 1c41 h GLU 129 N -0.46 0.93 0.00 1.11 9.09 -1.74 -1.11 114.58 122.40 1c41 h GLU 129 Ca 0.09 -0.19 -0.09 0.00 0.05 0.00 0.00 59.36 59.21 1c41 h GLU 129 Cb 0.62 -0.14 -0.01 0.00 -1.65 0.00 0.00 28.75 27.57 1c41 h GLU 129 CO -0.46 0.82 -0.42 1.88 0.05 0.00 0.00 179.01 180.88 1c41 h TYR 130 N 0.89 0.00 0.21 2.06 0.05 -1.07 -2.13 116.97 116.99 1c41 h TYR 130 Ca 0.20 0.00 -0.33 0.00 0.05 0.00 0.00 58.73 58.65 1c41 h TYR 130 Cb 0.30 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.07 1c41 h TYR 130 CO 0.02 0.42 -1.52 0.82 -1.05 0.00 0.00 178.16 176.85 1c41 h ILE 131 N 0.00 1.16 -0.23 -2.88 2.04 -1.20 -3.12 117.51 113.28 1c41 h ILE 131 Ca -0.00 -2.60 -0.00 0.00 1.00 0.00 0.00 64.86 63.26 1c41 h ILE 131 Cb 0.86 2.94 -0.01 0.00 -0.74 0.00 0.00 36.82 39.87 1c41 h ILE 131 CO 0.05 0.81 0.14 0.00 0.00 0.00 0.00 178.15 179.16 1c41 h ALA 132 N 0.12 0.29 -0.74 1.87 0.00 -1.15 0.51 119.26 120.16 1c41 h ALA 132 Ca -0.28 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1c41 h ALA 132 Cb 2.08 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.74 1c41 h ALA 132 CO 0.22 -0.20 0.26 0.22 0.00 0.00 0.00 179.25 179.75 1c41 h ASP 133 N 0.29 1.05 -0.02 0.00 3.58 -1.52 -0.53 116.42 119.27 1c41 h ASP 133 Ca 0.08 -0.18 -0.26 0.00 0.42 0.00 0.00 57.03 57.10 1c41 h ASP 133 Cb 0.02 -0.27 0.02 0.00 1.72 0.00 0.00 39.33 40.81 1c41 h ASP 133 CO -0.02 0.96 -0.98 0.28 -2.88 0.00 0.00 179.24 176.60 1c41 h SER 134 N 1.09 0.91 -0.56 2.28 0.02 -1.45 -2.13 113.55 113.70 1c41 h SER 134 Ca 0.24 -0.69 -0.08 0.00 -0.84 0.00 0.00 61.79 60.42 1c41 h SER 134 Cb 0.26 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1c41 h SER 134 CO -0.01 1.49 0.03 0.58 -1.14 0.00 0.00 176.83 177.78 1c41 h VAL 135 N 0.42 1.26 0.63 2.27 2.07 -0.82 0.39 116.25 122.47 1c41 h VAL 135 Ca -0.11 -1.07 -0.03 0.00 0.82 0.00 0.00 66.70 66.31 1c41 h VAL 135 Cb 1.62 0.77 0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1c41 h VAL 135 CO 0.19 0.39 -0.30 0.28 0.02 0.00 0.00 177.57 178.15 1c41 h SER 136 N 0.92 -0.72 -0.45 0.57 0.02 -1.07 -0.21 113.55 112.62 1c41 h SER 136 Ca 0.17 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.10 1c41 h SER 136 Cb 0.49 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 1c41 h SER 136 CO 0.02 -0.49 0.16 0.45 -1.14 0.00 0.00 176.83 175.83 1c41 h HIS 137 N -0.88 0.76 -0.26 3.45 3.86 -1.30 -1.50 115.15 119.28 1c41 h HIS 137 Ca -0.09 -0.05 0.03 0.00 -1.16 0.00 0.00 60.37 59.11 1c41 h HIS 137 Cb 0.66 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.87 1c41 h HIS 137 CO -0.02 0.62 0.06 0.78 0.86 0.00 0.00 177.93 180.22 1c41 h GLY 138 N 0.90 0.29 1.01 2.45 0.00 0.08 0.67 103.07 108.49 1c41 h GLY 138 Ca 0.17 -0.02 -0.09 0.00 0.00 0.00 0.00 47.33 47.39 1c41 h GLY 138 CO -0.01 -0.00 -0.07 1.41 0.00 0.00 0.00 176.54 177.87 1c41 h LEU 139 N 0.16 0.85 -1.47 3.11 3.38 -0.70 -1.21 115.31 119.42 1c41 h LEU 139 Ca 0.12 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.79 1c41 h LEU 139 Cb 0.12 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1c41 h LEU 139 CO -0.15 1.00 0.41 -0.03 0.09 0.00 0.00 178.44 179.76 1c41 h MET 140 N 0.69 0.64 0.11 1.13 4.05 -0.91 -1.48 114.93 119.17 1c41 h MET 140 Ca 0.12 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 1c41 h MET 140 Cb 0.60 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 1c41 h MET 140 CO 0.04 0.42 -0.05 -0.09 0.23 0.00 0.00 176.91 177.46 1c41 h ARG 141 N 0.66 -0.14 -0.96 0.39 2.43 -0.35 -2.47 114.38 113.94 1c41 h ARG 141 Ca 0.26 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.62 1c41 h ARG 141 Cb 0.20 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.69 1c41 h ARG 141 CO -0.08 0.33 0.61 0.28 -1.51 0.00 0.00 179.97 179.60 1c41 h VAL 142 N -0.69 0.73 0.89 0.20 2.07 -0.92 0.61 116.25 119.14 1c41 h VAL 142 Ca -0.01 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1c41 h VAL 142 Cb 0.53 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1c41 h VAL 142 CO 0.02 0.12 -0.47 -0.61 0.02 0.00 0.00 177.57 176.66 1c41 h GLN 143 N 0.66 -1.20 -0.28 1.57 4.15 -1.25 0.72 115.11 119.49 1c41 h GLN 143 Ca 0.52 0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.93 1c41 h GLN 143 Cb 0.94 0.27 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 1c41 h GLN 143 CO -0.28 -0.80 -0.22 -0.07 -1.93 0.00 0.00 178.83 175.53 1c41 h LEU 144 N -1.25 0.52 0.42 -2.39 3.38 -0.81 0.23 115.31 115.41 1c41 h LEU 144 Ca -0.12 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1c41 h LEU 144 Cb 0.97 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1c41 h LEU 144 CO 0.17 0.74 -0.20 0.44 0.09 0.00 0.00 178.44 179.68 1c41 h ASP 145 N 0.46 -0.48 1.17 -0.43 5.19 0.24 -3.22 116.42 119.35 1c41 h ASP 145 Ca 0.07 -0.07 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 1c41 h ASP 145 Cb 0.64 0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.26 1c41 h ASP 145 CO 0.05 -0.20 -0.29 0.00 -3.12 0.00 0.00 179.24 175.68 1c41 h THR 146 N -0.74 0.60 -0.15 0.35 1.03 -0.80 -3.47 112.91 109.73 1c41 h THR 146 Ca -0.06 -1.42 -0.07 0.00 -0.01 0.00 0.00 66.41 64.85 1c41 h THR 146 Cb 0.52 1.97 -0.03 0.00 -1.07 0.00 0.00 68.15 69.55 1c41 h THR 146 CO 0.09 0.28 -0.06 0.61 -0.01 0.00 0.00 175.52 176.44 1c41 n GLY 147 N 0.53 0.62 3.24 2.99 0.00 0.78 -5.00 105.19 108.34 1c41 n GLY 147 Ca 0.01 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 1c41 n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c41 s VAL 148 N -1.99 2.23 0.26 1.61 1.01 -1.09 -5.03 120.40 117.40 1c41 s VAL 148 Ca 0.00 -0.96 -0.31 0.00 0.00 0.00 0.00 61.98 60.71 1c41 s VAL 148 Cb 0.00 -1.87 -0.12 0.00 0.00 0.00 0.00 36.38 34.39 1c41 s VAL 148 CO 0.00 0.55 1.60 -2.65 0.00 0.00 0.00 175.10 174.60 1c41 n PRO 149 N 3.53 2.58 -3.98 2.72 -0.02 -1.26 -4.44 135.00 134.13 1c41 n PRO 149 Ca -0.19 0.92 -0.31 0.00 -2.02 0.00 0.00 63.50 61.90 1c41 n PRO 149 Cb 0.53 -2.70 -0.15 0.00 -0.02 0.00 0.00 33.50 31.16 1c41 n PRO 149 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1c41 s VAL 150 N 0.32 1.91 0.13 -1.45 1.01 -1.26 -0.79 120.40 120.28 1c41 s VAL 150 Ca 0.68 -1.76 -0.31 0.00 0.00 0.00 0.00 61.98 60.59 1c41 s VAL 150 Cb -0.53 -2.24 -0.09 0.00 0.00 0.00 0.00 36.38 33.51 1c41 s VAL 150 CO 0.44 -0.32 1.60 -0.63 0.00 0.00 0.00 175.10 176.19 1c41 s ILE 151 N 1.16 2.76 -1.17 2.22 -1.09 0.14 -4.86 121.20 120.35 1c41 s ILE 151 Ca 0.01 0.45 -0.20 0.00 -2.23 0.00 0.00 60.65 58.68 1c41 s ILE 151 Cb -0.19 -3.29 0.06 0.00 -1.58 0.00 0.00 42.46 37.47 1c41 s ILE 151 CO -0.09 0.02 1.60 0.12 -1.23 0.00 0.00 174.94 175.37 1c41 s PHE 152 N 1.69 2.69 -0.67 3.97 5.36 -1.26 -1.63 117.98 128.13 1c41 s PHE 152 Ca 0.72 -1.30 -0.02 0.00 -0.96 0.00 0.00 56.93 55.36 1c41 s PHE 152 Cb -0.42 -4.72 0.42 0.00 -0.34 0.00 0.00 43.02 37.95 1c41 s PHE 152 CO 0.32 -1.85 2.05 0.41 -1.46 0.00 0.00 175.22 174.68 1c41 n GLY 153 N 6.01 5.71 3.47 13.12 0.00 0.89 -4.92 105.19 129.46 1c41 n GLY 153 Ca 0.42 -2.26 -0.35 0.00 0.00 0.00 0.00 46.02 43.83 1c41 n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c41 s VAL 154 N -4.68 4.12 -0.13 1.61 1.01 -1.23 -1.70 120.40 119.40 1c41 s VAL 154 Ca 0.61 -0.25 -0.15 0.00 0.00 0.00 0.00 61.98 62.19 1c41 s VAL 154 Cb 0.48 -2.88 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 1c41 s VAL 154 CO -0.07 0.41 0.35 -0.76 0.00 0.00 0.00 175.10 175.03 1c41 s LEU 155 N 1.08 4.28 -0.64 3.92 1.43 0.05 -4.92 118.68 123.87 1c41 s LEU 155 Ca 0.03 0.64 0.03 0.00 -1.03 0.00 0.00 54.13 53.80 1c41 s LEU 155 Cb -0.14 -2.48 0.16 0.00 0.03 0.00 0.00 46.19 43.75 1c41 s LEU 155 CO 0.02 0.10 0.43 0.42 0.23 0.00 0.00 176.35 177.55 1c41 s THR 156 N 0.32 3.00 0.34 5.49 -4.23 -1.26 0.26 115.64 119.56 1c41 s THR 156 Ca 0.20 -3.75 0.07 0.00 -1.18 0.00 0.00 61.69 57.02 1c41 s THR 156 Cb -0.14 -2.99 -0.02 0.00 1.34 0.00 0.00 72.50 70.69 1c41 s THR 156 CO 0.07 -0.92 0.38 -0.69 -0.54 0.00 0.00 174.62 172.92 1c41 s VAL 157 N -0.87 3.80 -0.04 2.29 1.01 -0.40 -5.02 120.40 121.16 1c41 s VAL 157 Ca 0.21 -1.18 0.13 0.00 0.00 0.00 0.00 61.98 61.15 1c41 s VAL 157 Cb -0.15 -3.30 -0.20 0.00 0.00 0.00 0.00 36.38 32.74 1c41 s VAL 157 CO -0.09 -0.16 0.24 0.18 0.00 0.00 0.00 175.10 175.27 1c41 n LEU 158 N -1.51 0.00 -3.96 3.92 4.77 -1.26 -1.90 117.00 117.06 1c41 n LEU 158 Ca -0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.88 1c41 n LEU 158 Cb 0.59 0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 41.65 1c41 n LEU 158 CO 0.42 0.07 -0.30 0.42 -1.33 0.00 0.00 177.39 176.68 1c41 s THR 159 N -2.80 0.12 0.21 -5.08 -4.23 -1.26 -4.46 115.64 98.14 1c41 s THR 159 Ca -0.05 -0.95 -0.11 0.00 -1.18 0.00 0.00 61.69 59.39 1c41 s THR 159 Cb 0.08 -0.49 0.19 0.00 1.34 0.00 0.00 72.50 73.63 1c41 s THR 159 CO 0.56 -0.53 1.66 0.44 -0.54 0.00 0.00 174.62 176.22 1c41 h ASP 160 N 4.31 -0.30 -0.92 3.99 5.19 -1.98 -0.76 116.42 125.95 1c41 h ASP 160 Ca -0.32 0.15 0.12 0.00 -0.62 0.00 0.00 57.03 56.36 1c41 h ASP 160 Cb 1.20 0.28 -0.07 0.00 0.18 0.00 0.00 39.33 40.91 1c41 h ASP 160 CO 0.44 -0.12 0.59 0.44 -3.12 0.00 0.00 179.24 177.47 1c41 h ASP 161 N 0.10 0.78 -0.78 6.45 3.32 -1.99 -0.35 116.42 123.96 1c41 h ASP 161 Ca 0.31 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.38 1c41 h ASP 161 Cb 0.50 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 39.90 1c41 h ASP 161 CO -0.53 0.42 0.40 1.56 -1.72 0.00 0.00 179.24 179.37 1c41 h GLN 162 N 0.84 1.10 0.43 3.56 4.20 -1.56 0.16 115.11 123.85 1c41 h GLN 162 Ca 0.45 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.99 1c41 h GLN 162 Cb 0.55 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1c41 h GLN 162 CO -0.21 0.84 -0.21 0.00 -0.67 0.00 0.00 178.83 178.58 1c41 h ALA 163 N 1.21 -0.57 -0.56 3.87 0.00 -0.90 -1.54 119.26 120.76 1c41 h ALA 163 Ca 0.27 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1c41 h ALA 163 Cb 0.08 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 1c41 h ALA 163 CO -0.04 -0.82 0.14 0.87 0.00 0.00 0.00 179.25 179.40 1c41 h LYS 164 N -0.58 0.28 -0.37 0.00 1.57 -0.85 -0.71 116.57 115.90 1c41 h LYS 164 Ca -0.06 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1c41 h LYS 164 Cb 0.44 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 1c41 h LYS 164 CO 0.10 0.19 0.17 0.00 -0.57 0.00 0.00 179.45 179.33 1c41 h ALA 165 N 1.42 0.45 0.00 3.86 0.00 -0.49 -1.06 119.26 123.44 1c41 h ALA 165 Ca 0.29 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1c41 h ALA 165 Cb 0.39 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1c41 h ALA 165 CO -0.35 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 178.70 1c41 h ARG 166 N 0.35 0.00 -0.26 0.00 -0.00 -0.40 -2.53 114.38 111.53 1c41 h ARG 166 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.64 1c41 h ARG 166 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.06 1c41 h ARG 166 CO -0.13 0.00 0.00 0.00 0.00 0.00 0.00 179.97 179.84 1c41 n ALA 167 N -1.85 2.45 -0.71 0.04 0.00 -0.36 -0.50 120.51 119.58 1c41 n ALA 167 Ca 0.01 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1c41 n ALA 167 Cb 0.23 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1c41 n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c41 n GLY 168 N 1.42 1.32 0.22 0.00 0.00 -0.85 -4.48 105.19 102.83 1c41 n GLY 168 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 1c41 n GLY 168 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1c41 h VAL 169 N 0.00 0.56 -3.31 1.61 2.07 -1.48 -3.41 116.25 112.29 1c41 h VAL 169 Ca 0.00 0.00 -0.53 0.00 0.82 0.00 0.00 66.70 66.99 1c41 h VAL 169 Cb 0.00 0.56 0.05 0.00 -1.52 0.00 0.00 31.29 30.38 1c41 h VAL 169 CO 0.00 0.00 0.73 -0.63 0.02 0.00 0.00 177.57 177.69 1c41 s ILE 170 N -6.11 2.86 -0.33 4.57 1.01 -1.23 -4.86 121.20 117.12 1c41 s ILE 170 Ca -0.15 0.70 -0.33 0.00 0.00 0.00 0.00 60.65 60.88 1c41 s ILE 170 Cb 0.09 -3.45 -0.14 0.00 0.01 0.00 0.00 42.46 38.97 1c41 s ILE 170 CO 0.66 0.10 1.09 -0.62 0.00 0.00 0.00 174.94 176.18 1c41 n GLU 171 N 2.67 0.00 -3.83 2.79 1.02 -1.26 -1.07 120.64 120.95 1c41 n GLU 171 Ca 0.07 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.93 1c41 n GLU 171 Cb 0.41 -1.05 0.04 0.00 -0.02 0.00 0.00 31.44 30.82 1c41 n GLU 171 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c41 n GLY 172 N 2.68 -0.50 3.92 0.62 0.00 -1.26 -5.00 105.19 105.66 1c41 n GLY 172 Ca 0.21 0.20 -0.19 0.00 0.00 0.00 0.00 46.02 46.24 1c41 n GLY 172 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1c41 s SER 173 N -3.38 5.27 -0.26 1.61 1.04 -0.23 -5.09 113.70 112.65 1c41 s SER 173 Ca 0.61 -0.63 -0.09 0.00 0.48 0.00 0.00 55.95 56.32 1c41 s SER 173 Cb -0.30 -0.61 -0.03 0.00 0.10 0.00 0.00 66.02 65.18 1c41 s SER 173 CO 0.81 -0.69 0.11 -2.28 0.98 0.00 0.00 173.24 172.17 1c41 s HIS 174 N -2.43 3.13 -0.30 5.02 2.46 -1.25 -4.65 115.29 117.28 1c41 s HIS 174 Ca 0.51 -0.25 -0.29 0.00 0.47 0.00 0.00 55.06 55.49 1c41 s HIS 174 Cb -0.06 -2.29 0.00 0.00 -0.13 0.00 0.00 32.58 30.10 1c41 s HIS 174 CO 0.30 -0.30 1.30 1.21 -2.47 0.00 0.00 174.74 174.78 1c41 s ASN 175 N 1.66 6.68 0.57 9.88 3.84 -1.26 -3.69 114.94 132.62 1c41 s ASN 175 Ca 0.07 1.22 0.34 0.00 0.21 0.00 0.00 52.86 54.70 1c41 s ASN 175 Cb -0.15 -2.54 1.62 0.00 -0.55 0.00 0.00 41.25 39.63 1c41 s ASN 175 CO 0.06 -1.07 2.09 0.45 -2.79 0.00 0.00 177.10 175.84 1c41 h HIS 176 N 9.27 0.00 -0.89 0.43 3.86 -1.09 -2.88 115.15 123.85 1c41 h HIS 176 Ca -0.26 0.00 0.15 0.00 -1.16 0.00 0.00 60.37 59.10 1c41 h HIS 176 Cb 1.10 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 29.47 1c41 h HIS 176 CO 0.88 0.05 0.49 0.78 0.86 0.00 0.00 177.93 180.98 1c41 h GLY 177 N 1.27 1.48 0.43 2.45 0.00 -1.79 0.18 103.07 107.10 1c41 h GLY 177 Ca -0.00 -0.29 0.09 0.00 0.00 0.00 0.00 47.33 47.14 1c41 h GLY 177 CO 0.01 -0.03 0.30 0.83 0.00 0.00 0.00 176.54 177.64 1c41 h GLU 178 N 0.68 0.50 -0.51 4.80 5.08 -1.59 -0.76 114.58 122.77 1c41 h GLU 178 Ca 0.49 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.83 1c41 h GLU 178 Cb 0.69 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1c41 h GLU 178 CO -0.36 0.33 0.33 -0.44 -1.00 0.00 0.00 179.01 177.87 1c41 h ASP 179 N 0.51 0.57 -0.57 1.42 3.32 -0.84 -1.39 116.42 119.44 1c41 h ASP 179 Ca 0.33 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.33 1c41 h ASP 179 Cb 0.37 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1c41 h ASP 179 CO -0.28 0.41 0.21 -0.50 -1.72 0.00 0.00 179.24 177.35 1c41 h TRP 180 N 0.68 0.90 -0.26 4.55 6.55 -0.35 0.14 115.95 128.16 1c41 h TRP 180 Ca 0.19 -0.08 -0.01 0.00 0.95 0.00 0.00 58.89 59.94 1c41 h TRP 180 Cb -0.06 -0.26 -0.01 0.00 -0.86 0.00 0.00 29.16 27.96 1c41 h TRP 180 CO -0.04 0.74 0.10 0.78 -1.05 0.00 0.00 178.44 178.97 1c41 h GLY 181 N 0.79 0.41 0.60 1.49 0.00 -1.00 0.18 103.07 105.55 1c41 h GLY 181 Ca 0.19 -0.22 0.06 0.00 0.00 0.00 0.00 47.33 47.35 1c41 h GLY 181 CO -0.01 0.21 0.21 -2.00 0.00 0.00 0.00 176.54 174.95 1c41 h LEU 182 N 0.27 0.25 -0.63 3.11 5.85 -0.99 -2.12 115.31 121.05 1c41 h LEU 182 Ca 0.09 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1c41 h LEU 182 Cb 0.18 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1c41 h LEU 182 CO -0.01 0.17 0.08 0.00 -0.34 0.00 0.00 178.44 178.35 1c41 h ALA 183 N 1.31 0.84 -0.60 1.25 0.00 -0.37 -2.60 119.26 119.10 1c41 h ALA 183 Ca 0.23 -0.27 0.09 0.00 0.00 0.00 0.00 54.91 54.96 1c41 h ALA 183 Cb 0.21 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 1c41 h ALA 183 CO -0.21 0.61 0.22 0.00 0.00 0.00 0.00 179.25 179.87 1c41 h ALA 184 N 1.02 0.76 0.37 0.00 0.00 -0.02 0.39 119.26 121.78 1c41 h ALA 184 Ca 0.19 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1c41 h ALA 184 Cb 0.46 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1c41 h ALA 184 CO 0.02 -0.19 -0.18 0.28 0.00 0.00 0.00 179.25 179.18 1c41 h VAL 185 N 0.40 0.65 -0.17 0.00 2.07 -1.26 0.69 116.25 118.63 1c41 h VAL 185 Ca 0.30 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.62 1c41 h VAL 185 Cb 0.36 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 30.85 1c41 h VAL 185 CO -0.30 0.05 -0.24 -0.08 0.02 0.00 0.00 177.57 177.02 1c41 h GLU 186 N -0.63 -0.28 -0.60 1.57 4.81 -1.06 -0.11 114.58 118.29 1c41 h GLU 186 Ca -0.05 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1c41 h GLU 186 Cb 0.46 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 1c41 h GLU 186 CO 0.08 -0.18 0.28 0.52 -0.73 0.00 0.00 179.01 178.98 1c41 h MET 187 N -0.29 0.84 -0.05 1.92 2.86 -0.89 0.06 114.93 119.38 1c41 h MET 187 Ca 0.11 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1c41 h MET 187 Cb 0.45 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.95 1c41 h MET 187 CO -0.33 0.66 0.03 0.78 1.06 0.00 0.00 176.91 179.10 1c41 h GLY 188 N 0.93 0.08 0.81 8.32 0.00 0.19 0.31 103.07 113.71 1c41 h GLY 188 Ca 0.21 -0.03 0.02 0.00 0.00 0.00 0.00 47.33 47.53 1c41 h GLY 188 CO -0.03 0.03 0.04 -2.08 0.00 0.00 0.00 176.54 174.51 1c41 h VAL 189 N 0.02 0.93 -0.70 4.60 2.07 -0.60 -2.30 116.25 120.26 1c41 h VAL 189 Ca 0.02 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1c41 h VAL 189 Cb 0.05 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1c41 h VAL 189 CO -0.00 0.02 0.46 0.03 0.02 0.00 0.00 177.57 178.10 1c41 h ARG 190 N 0.12 0.93 -0.49 1.57 3.08 -0.70 -2.51 114.38 116.37 1c41 h ARG 190 Ca 0.08 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.13 1c41 h ARG 190 Cb 0.07 -0.21 -0.05 0.00 0.08 0.00 0.00 29.97 29.86 1c41 h ARG 190 CO -0.10 0.62 0.20 -0.09 -1.07 0.00 0.00 179.97 179.52 1c41 h ARG 191 N 0.95 0.38 -0.16 0.04 2.43 -0.05 -0.85 114.38 117.13 1c41 h ARG 191 Ca 0.26 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.45 1c41 h ARG 191 Cb -0.10 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.31 1c41 h ARG 191 CO -0.05 0.25 -0.13 0.00 -1.51 0.00 0.00 179.97 178.52 1c41 h ARG 192 N 0.39 -0.14 -0.53 0.20 3.08 -1.00 0.16 114.38 116.54 1c41 h ARG 192 Ca 0.23 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.32 1c41 h ARG 192 Cb 0.22 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 1c41 h ARG 192 CO -0.22 -0.09 0.32 -0.44 -1.07 0.00 0.00 179.97 178.46 1c41 h ASP 193 N -0.15 0.51 -0.65 7.04 3.32 -1.08 -0.18 116.42 125.23 1c41 h ASP 193 Ca 0.10 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1c41 h ASP 193 Cb 0.29 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1c41 h ASP 193 CO -0.24 0.36 0.42 -0.50 -1.72 0.00 0.00 179.24 177.56 1c41 h TRP 194 N 0.62 0.82 0.00 4.55 6.55 -0.67 0.80 115.95 128.62 1c41 h TRP 194 Ca 0.22 0.02 -0.00 0.00 0.95 0.00 0.00 58.89 60.07 1c41 h TRP 194 Cb 0.03 -0.28 -0.00 0.00 -0.86 0.00 0.00 29.16 28.06 1c41 h TRP 194 CO -0.07 0.52 -0.01 0.00 -1.05 0.00 0.00 178.44 177.84 1c41 h ALA 195 N 1.23 1.44 -0.20 1.49 0.00 0.36 0.30 119.26 123.88 1c41 h ALA 195 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1c41 h ALA 195 Cb -0.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1c41 h ALA 195 CO -0.05 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.21 1c41 n ALA 196 N -2.29 2.51 -1.07 0.00 0.00 0.15 -4.91 120.51 114.90 1c41 n ALA 196 Ca -0.03 -0.57 -0.02 0.00 0.00 0.00 0.00 53.44 52.82 1c41 n ALA 196 Cb 0.09 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.47 1c41 n ALA 196 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c41 n GLY 197 N 1.15 0.53 3.76 0.00 0.00 0.10 -5.00 105.19 105.73 1c41 n GLY 197 Ca 0.16 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1c41 n GLY 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c41 s LYS 198 N -1.31 4.73 0.00 1.61 1.02 -0.44 -5.00 119.74 120.34 1c41 s LYS 198 Ca 0.00 1.34 0.00 0.00 0.02 0.00 0.00 55.97 57.33 1c41 s LYS 198 Cb 0.00 -3.28 0.00 0.00 -0.52 0.00 0.00 37.83 34.03 1c41 s LYS 198 CO 0.00 0.53 0.22 0.25 -0.92 0.00 0.00 175.35 175.42