#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 2.01 -0.23 1.61 0.04 -1.26 -5.10 135.00 132.07 1c41 s PRO 6 Ca 0.00 -1.00 -0.07 0.00 0.04 0.00 0.00 61.00 59.98 1c41 s PRO 6 Cb 0.00 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 32.12 1c41 s PRO 6 CO 0.00 -1.17 0.05 0.95 0.04 0.00 0.00 177.00 176.86 1c41 s THR 7 N -3.00 4.24 0.48 1.26 -4.23 -1.26 -5.09 115.64 108.04 1c41 s THR 7 Ca 0.63 -0.20 -0.24 0.00 -1.18 0.00 0.00 61.69 60.70 1c41 s THR 7 Cb -0.07 -2.96 -0.07 0.00 1.34 0.00 0.00 72.50 70.74 1c41 s THR 7 CO 0.42 0.38 1.35 -2.16 -0.54 0.00 0.00 174.62 174.07 1c41 s PRO 8 N 1.33 3.54 -0.28 3.99 0.04 -1.26 -5.04 135.00 137.32 1c41 s PRO 8 Ca 0.05 2.24 -0.09 0.00 0.04 0.00 0.00 61.00 63.24 1c41 s PRO 8 Cb -0.15 -2.50 0.12 0.00 0.04 0.00 0.00 34.50 32.02 1c41 s PRO 8 CO 0.03 -0.87 0.59 -0.65 0.04 0.00 0.00 177.00 176.13 1c41 s GLN 9 N -2.61 0.51 -0.19 4.56 -0.21 -1.26 -5.15 119.66 115.31 1c41 s GLN 9 Ca 0.64 1.32 -0.06 0.00 0.02 0.00 0.00 55.36 57.28 1c41 s GLN 9 Cb -0.40 0.71 -0.03 0.00 1.00 0.00 0.00 33.01 34.29 1c41 s GLN 9 CO 0.49 -0.25 0.03 -1.14 -2.12 0.00 0.00 175.29 172.31 1c41 s GLN 10 N 2.82 3.78 0.43 2.91 0.74 -1.26 -4.88 119.66 124.20 1c41 s GLN 10 Ca -0.03 -0.44 0.07 0.00 0.05 0.00 0.00 55.36 55.01 1c41 s GLN 10 Cb -0.12 -3.15 -0.05 0.00 1.10 0.00 0.00 33.01 30.79 1c41 s GLN 10 CO -0.18 0.12 0.17 -1.01 -0.55 0.00 0.00 175.29 173.84 1c41 s HIS 11 N 0.75 2.49 0.00 1.67 3.76 -1.26 -5.09 115.29 117.61 1c41 s HIS 11 Ca 0.02 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.29 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 0.02 0.17 0.65 -3.47 -0.85 0.00 0.00 174.74 171.26 1c41 n ASP 12 N -1.25 0.00 -3.98 1.40 -0.08 -1.26 -4.81 116.55 106.57 1c41 n ASP 12 Ca -0.02 0.66 -0.27 0.00 -1.51 0.00 0.00 54.79 53.64 1c41 n ASP 12 Cb 0.65 -0.18 -0.01 0.00 2.34 0.00 0.00 41.12 43.92 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 -0.56 -0.29 0.00 0.27 0.00 -1.26 -4.26 105.19 99.10 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 -2.92 0.97 -1.18 1.61 3.41 -1.26 -2.79 113.62 111.47 1c41 n SER 14 Ca -0.21 -0.47 0.09 0.00 -0.26 0.00 0.00 58.87 58.01 1c41 n SER 14 Cb 0.64 1.35 0.28 0.00 -0.26 0.00 0.00 64.21 66.21 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 -1.70 2.64 -2.49 7.33 0.00 -1.26 -4.47 120.51 120.55 1c41 n ALA 15 Ca 0.00 -1.48 -0.31 0.00 0.00 0.00 0.00 53.44 51.66 1c41 n ALA 15 Cb 0.33 -0.79 -0.05 0.00 0.00 0.00 0.00 19.45 18.95 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 -1.50 4.15 -0.21 0.00 1.02 -1.26 -5.06 118.68 115.82 1c41 s LEU 16 Ca 0.42 0.80 0.00 0.00 0.02 0.00 0.00 54.13 55.37 1c41 s LEU 16 Cb 0.25 -3.58 0.05 0.00 0.02 0.00 0.00 46.19 42.94 1c41 s LEU 16 CO 0.22 -0.09 -0.06 -0.60 0.02 0.00 0.00 176.35 175.85 1c41 s ARG 17 N -3.00 1.65 -0.11 1.70 3.52 -1.26 -4.66 118.95 116.79 1c41 s ARG 17 Ca 0.45 -0.85 -0.03 0.00 -0.13 0.00 0.00 55.73 55.17 1c41 s ARG 17 Cb -0.11 -2.43 -0.03 0.00 -1.56 0.00 0.00 34.95 30.81 1c41 s ARG 17 CO 0.24 -0.53 0.03 0.42 -0.81 0.00 0.00 175.30 174.65 1c41 s ILE 18 N 1.45 4.54 -0.12 4.11 -1.09 -0.24 -0.75 121.20 129.10 1c41 s ILE 18 Ca -0.03 -0.15 -0.00 0.00 -2.23 0.00 0.00 60.65 58.23 1c41 s ILE 18 Cb -0.18 -2.94 -0.02 0.00 -1.58 0.00 0.00 42.46 37.75 1c41 s ILE 18 CO -0.07 0.58 -0.12 -0.83 -1.23 0.00 0.00 174.94 173.27 1c41 s GLY 19 N -0.68 1.56 -0.05 6.18 0.00 -0.90 -1.00 107.32 112.43 1c41 s GLY 19 Ca 0.11 -0.89 0.04 0.00 0.00 0.00 0.00 44.72 43.98 1c41 s GLY 19 CO 0.02 -0.26 -0.18 -0.42 0.00 0.00 0.00 173.10 172.27 1c41 s ILE 20 N 0.19 1.49 -0.10 0.90 1.01 0.84 -1.01 121.20 124.52 1c41 s ILE 20 Ca -0.07 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.85 1c41 s ILE 20 Cb -0.15 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.05 1c41 s ILE 20 CO 0.05 0.43 -0.11 -0.69 0.00 0.00 0.00 174.94 174.62 1c41 s VAL 21 N 0.14 1.18 0.07 2.92 1.01 -0.60 -0.83 120.40 124.29 1c41 s VAL 21 Ca -0.07 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 61.57 1c41 s VAL 21 Cb -0.13 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 1c41 s VAL 21 CO 0.03 0.38 -0.22 -1.38 0.00 0.00 0.00 175.10 173.92 1c41 s HIS 22 N 1.28 1.89 0.81 5.22 -3.43 -0.75 -1.28 115.29 119.03 1c41 s HIS 22 Ca -0.02 -0.39 -0.11 0.00 -0.80 0.00 0.00 55.06 53.74 1c41 s HIS 22 Cb -0.14 -1.08 0.11 0.00 -1.43 0.00 0.00 32.58 30.04 1c41 s HIS 22 CO -0.04 0.16 1.16 0.00 -2.00 0.00 0.00 174.74 174.02 1c41 s ALA 23 N -0.97 2.76 -0.93 -1.38 0.00 -0.20 -1.54 121.76 119.50 1c41 s ALA 23 Ca 0.08 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.18 1c41 s ALA 23 Cb -0.09 -2.75 0.11 0.00 0.00 0.00 0.00 23.12 20.39 1c41 s ALA 23 CO 0.03 -1.76 0.87 0.54 0.00 0.00 0.00 175.76 175.45 1c41 n ARG 24 N -3.29 0.87 -2.49 0.00 1.74 -0.29 -4.77 116.66 108.43 1c41 n ARG 24 Ca 0.10 -1.23 -0.41 0.00 -0.77 0.00 0.00 57.85 55.55 1c41 n ARG 24 Cb 0.60 -1.17 -0.04 0.00 -1.02 0.00 0.00 32.46 30.84 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 3.58 -1.07 -1.55 0.52 -1.14 -3.31 118.94 115.21 1c41 s TRP 25 Ca 0.11 1.64 -0.00 0.00 0.02 0.00 0.00 56.10 57.88 1c41 s TRP 25 Cb 0.07 -3.29 0.00 0.00 -1.15 0.00 0.00 33.47 29.11 1c41 s TRP 25 CO 0.11 -0.61 0.89 0.09 0.02 0.00 0.00 176.95 177.45 1c41 n ASN 26 N 1.73 -2.07 -0.20 2.95 3.02 -1.26 -4.59 115.26 114.83 1c41 n ASN 26 Ca 0.01 -0.55 0.12 0.00 -0.03 0.00 0.00 54.58 54.13 1c41 n ASN 26 Cb 0.45 -4.63 0.43 0.00 -0.61 0.00 0.00 39.78 35.42 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 -1.70 0.56 0.00 3.52 5.08 -1.91 0.12 114.58 120.25 1c41 h GLU 27 Ca -0.53 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1c41 h GLU 27 Cb 1.30 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1c41 h GLU 27 CO 0.45 0.37 0.00 0.25 -1.00 0.00 0.00 179.01 179.08 1c41 n THR 28 N -4.51 1.22 -0.09 1.13 -2.24 -1.26 -0.74 114.28 107.78 1c41 n THR 28 Ca 0.15 0.58 -0.12 0.00 -2.27 0.00 0.00 64.05 62.38 1c41 n THR 28 Cb 0.44 -1.55 -0.10 0.00 -2.10 0.00 0.00 70.33 67.02 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 -2.04 1.11 -0.12 2.28 2.08 -0.09 -4.38 119.36 118.20 1c41 n ILE 29 Ca -0.00 -0.49 -0.08 0.00 0.56 0.00 0.00 62.75 62.73 1c41 n ILE 29 Cb 0.07 -1.03 -0.00 0.00 -0.75 0.00 0.00 39.64 37.92 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 1.11 0.23 1.39 1.08 -0.19 -2.63 117.51 118.49 1c41 h ILE 30 Ca -0.44 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1c41 h ILE 30 Cb 1.76 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 36.06 1c41 h ILE 30 CO -0.04 0.11 -0.20 -0.08 -0.69 0.00 0.00 178.15 177.25 1c41 h GLU 31 N 0.52 -0.44 -0.98 2.37 4.22 -1.18 0.35 114.58 119.44 1c41 h GLU 31 Ca 0.14 0.03 0.11 0.00 0.08 0.00 0.00 59.36 59.73 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 -0.03 -0.29 0.61 -1.35 -2.18 0.00 0.00 179.01 175.77 1c41 h PRO 32 N -0.45 0.95 0.68 0.92 0.11 -1.75 0.28 132.00 132.73 1c41 h PRO 32 Ca -0.01 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1c41 h PRO 32 Cb 0.41 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.32 1c41 h PRO 32 CO -0.03 0.63 -0.33 -0.07 -0.21 0.00 0.00 178.00 177.99 1c41 h LEU 33 N 0.98 -0.77 -0.87 2.35 3.38 -1.03 -1.84 115.31 117.51 1c41 h LEU 33 Ca 0.48 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.60 1c41 h LEU 33 Cb 0.46 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.31 1c41 h LEU 33 CO -0.26 -0.41 0.46 0.25 0.09 0.00 0.00 178.44 178.56 1c41 h LEU 34 N -1.16 0.56 0.08 1.67 5.85 0.11 -0.99 115.31 121.42 1c41 h LEU 34 Ca -0.09 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1c41 h LEU 34 Cb 0.73 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1c41 h LEU 34 CO 0.15 0.23 -0.15 0.00 -0.34 0.00 0.00 178.44 178.33 1c41 h ALA 35 N 1.57 -0.23 -0.79 1.25 0.00 -0.39 0.89 119.26 121.55 1c41 h ALA 35 Ca 0.48 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.34 1c41 h ALA 35 Cb 0.68 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 1c41 h ALA 35 CO -0.37 -0.66 0.37 0.78 0.00 0.00 0.00 179.25 179.37 1c41 h GLY 36 N -0.28 1.24 0.84 0.00 0.00 -0.44 0.05 103.07 104.47 1c41 h GLY 36 Ca 0.03 -0.63 -0.06 0.00 0.00 0.00 0.00 47.33 46.67 1c41 h GLY 36 CO -0.09 0.59 -0.10 0.00 0.00 0.00 0.00 176.54 176.94 1c41 h THR 37 N 1.13 1.30 -0.61 4.70 1.03 -0.95 -2.14 112.91 117.36 1c41 h THR 37 Ca 0.27 -1.16 -0.01 0.00 -0.01 0.00 0.00 66.41 65.51 1c41 h THR 37 Cb 0.14 1.56 -0.03 0.00 -1.07 0.00 0.00 68.15 68.75 1c41 h THR 37 CO -0.03 0.36 0.35 0.50 -0.01 0.00 0.00 175.52 176.69 1c41 h LYS 38 N 0.21 0.84 0.03 0.00 3.64 -0.68 -1.99 116.57 118.62 1c41 h LYS 38 Ca 0.05 -0.09 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1c41 h LYS 38 Cb 0.59 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1c41 h LYS 38 CO 0.03 0.62 -0.33 0.00 -2.27 0.00 0.00 179.45 177.50 1c41 h ALA 39 N 1.17 -0.80 -0.43 5.00 0.00 -0.86 -1.21 119.26 122.14 1c41 h ALA 39 Ca 0.22 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.19 1c41 h ALA 39 Cb 0.01 0.75 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1c41 h ALA 39 CO -0.04 -0.89 0.36 0.87 0.00 0.00 0.00 179.25 179.55 1c41 h LYS 40 N -0.43 0.00 0.57 0.00 1.79 -1.27 0.76 116.57 117.99 1c41 h LYS 40 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1c41 h LYS 40 Cb 0.45 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1c41 h LYS 40 CO -0.20 0.00 -0.27 -0.07 -1.08 0.00 0.00 179.45 177.83 1c41 h LEU 41 N 0.00 -0.65 -0.58 2.94 3.38 -0.46 -1.60 115.31 118.35 1c41 h LEU 41 Ca 0.20 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.19 1c41 h LEU 41 Cb 0.92 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 1c41 h LEU 41 CO -0.00 -0.37 0.33 -0.07 0.09 0.00 0.00 178.44 178.42 1c41 h LEU 42 N -0.90 0.51 -1.96 1.67 3.38 -0.71 0.42 115.31 117.72 1c41 h LEU 42 Ca -0.08 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.95 1c41 h LEU 42 Cb 0.63 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1c41 h LEU 42 CO 0.13 0.35 0.39 0.00 0.09 0.00 0.00 178.44 179.39 1c41 h ALA 43 N 1.28 1.65 -0.35 1.53 0.00 -0.66 0.73 119.26 123.43 1c41 h ALA 43 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1c41 h ALA 43 Cb 0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1c41 h ALA 43 CO -0.13 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.65 1c41 n GLY 45 N 1.47 0.71 3.71 0.00 0.00 0.25 -4.38 105.19 106.96 1c41 n GLY 45 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.26 3.33 0.13 1.61 1.01 -0.95 -4.08 120.40 119.18 1c41 s VAL 46 Ca 0.00 0.93 -0.31 0.00 0.00 0.00 0.00 61.98 62.60 1c41 s VAL 46 Cb 0.00 -3.60 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 1c41 s VAL 46 CO 0.00 0.06 1.34 -0.54 0.00 0.00 0.00 175.10 175.96 1c41 s LYS 47 N 1.30 4.36 0.36 2.72 1.02 -1.26 -4.26 119.74 123.97 1c41 s LYS 47 Ca 0.65 2.02 0.18 0.00 0.02 0.00 0.00 55.97 58.84 1c41 s LYS 47 Cb -0.36 -3.25 1.18 0.00 -0.52 0.00 0.00 37.83 34.88 1c41 s LYS 47 CO 0.30 -0.36 1.65 1.49 -0.92 0.00 0.00 175.35 177.51 1c41 h GLU 48 N 6.42 0.23 0.00 1.68 4.57 -1.96 0.85 114.58 126.37 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 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1c41 h GLU 48 CO 0.83 0.15 0.00 -1.13 -1.18 0.00 0.00 179.01 177.68 1c41 n SER 49 N -5.04 0.56 -1.31 1.04 3.41 -1.26 -2.87 113.62 108.15 1c41 n SER 49 Ca 0.33 0.59 0.09 0.00 -0.26 0.00 0.00 58.87 59.63 1c41 n SER 49 Cb 1.09 -0.72 0.30 0.00 -0.26 0.00 0.00 64.21 64.61 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 -2.06 3.82 -4.19 4.04 3.02 0.29 -2.42 115.26 117.76 1c41 n ASN 50 Ca 0.04 -2.18 -0.36 0.00 -0.03 0.00 0.00 54.58 52.06 1c41 n ASN 50 Cb 0.32 -0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 38.88 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 -1.44 3.28 -0.07 2.41 1.01 -1.14 -1.08 121.20 124.17 1c41 s ILE 51 Ca 0.44 -1.48 -0.13 0.00 0.00 0.00 0.00 60.65 59.47 1c41 s ILE 51 Cb 0.25 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.71 1c41 s ILE 51 CO 0.26 -0.27 0.34 -0.69 0.00 0.00 0.00 174.94 174.58 1c41 s VAL 52 N 1.27 5.20 -0.18 2.92 1.01 -0.17 -5.01 120.40 125.44 1c41 s VAL 52 Ca -0.01 0.66 -0.03 0.00 0.00 0.00 0.00 61.98 62.60 1c41 s VAL 52 Cb -0.20 -3.65 0.06 0.00 0.00 0.00 0.00 36.38 32.59 1c41 s VAL 52 CO -0.01 0.51 0.05 -0.69 0.00 0.00 0.00 175.10 174.96 1c41 s VAL 53 N -0.50 0.32 0.29 2.92 1.01 -1.26 -0.11 120.40 123.07 1c41 s VAL 53 Ca 0.20 -0.38 0.10 0.00 0.00 0.00 0.00 61.98 61.91 1c41 s VAL 53 Cb -0.15 -0.84 -0.06 0.00 0.00 0.00 0.00 36.38 35.33 1c41 s VAL 53 CO 0.09 -0.19 -0.14 -1.10 0.00 0.00 0.00 175.10 173.75 1c41 s GLN 54 N 1.96 1.67 0.36 2.72 -0.21 -0.01 -5.00 119.66 121.14 1c41 s GLN 54 Ca 0.00 -1.80 0.05 0.00 0.02 0.00 0.00 55.36 53.64 1c41 s GLN 54 Cb -0.16 -1.60 -0.07 0.00 1.00 0.00 0.00 33.01 32.18 1c41 s GLN 54 CO -0.08 0.22 0.03 -1.54 -2.12 0.00 0.00 175.29 171.79 1c41 s SER 55 N -3.51 3.05 0.10 5.90 1.04 -1.26 -1.80 113.70 117.21 1c41 s SER 55 Ca 0.30 -1.36 -0.08 0.00 0.48 0.00 0.00 55.95 55.30 1c41 s SER 55 Cb -0.01 -0.23 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 1c41 s SER 55 CO 0.14 -0.51 0.18 0.68 0.98 0.00 0.00 173.24 174.70 1c41 s VAL 56 N -3.02 0.14 0.04 5.02 -7.23 -0.59 -4.90 120.40 109.87 1c41 s VAL 56 Ca 0.35 -1.30 -0.30 0.00 -1.81 0.00 0.00 61.98 58.93 1c41 s VAL 56 Cb 0.09 -1.45 -0.16 0.00 0.56 0.00 0.00 36.38 35.41 1c41 s VAL 56 CO 0.16 -0.63 1.41 1.55 -0.31 0.00 0.00 175.10 177.28 1c41 h PRO 57 N 2.77 -1.03 -5.20 4.82 0.13 -1.93 -0.75 132.00 130.81 1c41 h PRO 57 Ca -0.34 0.07 -0.66 0.00 -0.87 0.00 0.00 66.00 64.20 1c41 h PRO 57 Cb 1.20 0.23 -0.13 0.00 0.13 0.00 0.00 31.00 32.43 1c41 h PRO 57 CO 0.56 -0.68 -0.52 0.20 -0.23 0.00 0.00 178.00 177.33 1c41 s GLY 58 N -1.86 2.94 0.43 1.56 0.00 -1.26 -1.17 107.32 107.96 1c41 s GLY 58 Ca -0.16 -0.59 0.12 0.00 0.00 0.00 0.00 44.72 44.10 1c41 s GLY 58 CO 0.47 -2.14 1.97 1.76 0.00 0.00 0.00 173.10 175.16 1c41 h SER 59 N 1.43 0.11 -0.59 1.64 0.02 -1.94 -2.29 113.55 111.93 1c41 h SER 59 Ca -0.43 -0.02 0.11 0.00 -0.84 0.00 0.00 61.79 60.62 1c41 h SER 59 Cb 1.31 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.78 1c41 h SER 59 CO 0.72 0.26 0.40 -0.25 -1.14 0.00 0.00 176.83 176.82 1c41 h TRP 60 N 0.11 0.35 0.00 3.45 2.91 -1.96 0.12 115.95 120.94 1c41 h TRP 60 Ca 0.02 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1c41 h TRP 60 Cb 0.31 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 28.85 1c41 h TRP 60 CO 0.00 0.16 0.00 0.93 -1.03 0.00 0.00 178.44 178.50 1c41 h GLU 61 N 0.33 0.00 -0.02 2.65 3.07 -1.82 -3.37 114.58 115.41 1c41 h GLU 61 Ca 0.28 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.16 1c41 h GLU 61 Cb 0.65 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.52 1c41 h GLU 61 CO -0.07 0.00 -0.43 -0.07 -1.40 0.00 0.00 179.01 177.04 1c41 h LEU 62 N 0.00 -1.33 -0.34 1.33 4.07 -0.81 0.11 115.31 118.34 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 0.78 0.51 -0.04 0.00 1.08 0.00 0.00 40.66 42.99 1c41 h LEU 62 CO 0.00 -0.41 0.11 1.55 -1.08 0.00 0.00 178.44 178.61 1c41 h PRO 63 N -0.53 0.25 -0.72 1.13 0.13 -1.73 0.12 132.00 130.65 1c41 h PRO 63 Ca 0.01 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1c41 h PRO 63 Cb 0.57 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.61 1c41 h PRO 63 CO -0.30 0.16 0.38 0.97 -0.23 0.00 0.00 178.00 178.98 1c41 h ILE 64 N 0.25 1.23 -0.63 -3.56 6.09 -1.75 -0.28 117.51 118.86 1c41 h ILE 64 Ca 0.15 -0.59 -0.06 0.00 -1.37 0.00 0.00 64.86 63.00 1c41 h ILE 64 Cb 0.13 0.30 -0.03 0.00 0.47 0.00 0.00 36.82 37.70 1c41 h ILE 64 CO -0.16 0.25 0.17 0.00 -3.07 0.00 0.00 178.15 175.34 1c41 h ALA 65 N 1.19 0.83 -0.42 0.18 0.00 -0.42 -1.88 119.26 118.74 1c41 h ALA 65 Ca 0.25 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1c41 h ALA 65 Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1c41 h ALA 65 CO -0.04 0.53 -0.03 0.28 0.00 0.00 0.00 179.25 179.99 1c41 h VAL 66 N 0.93 1.27 -0.62 0.00 2.07 -0.40 -0.04 116.25 119.45 1c41 h VAL 66 Ca 0.20 -1.08 0.03 0.00 0.82 0.00 0.00 66.70 66.67 1c41 h VAL 66 Cb 0.34 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1c41 h VAL 66 CO -0.00 0.37 0.37 -0.61 0.02 0.00 0.00 177.57 177.72 1c41 h GLN 67 N 0.59 0.71 -0.09 1.57 4.15 -0.89 -2.16 115.11 119.00 1c41 h GLN 67 Ca 0.12 -0.04 -0.21 0.00 0.77 0.00 0.00 58.65 59.29 1c41 h GLN 67 Cb 0.53 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.06 1c41 h GLN 67 CO 0.03 0.47 -0.79 0.00 -1.93 0.00 0.00 178.83 176.61 1c41 h ARG 68 N 0.73 0.55 0.35 1.69 2.47 -1.26 -1.76 114.38 117.15 1c41 h ARG 68 Ca 0.25 -0.47 -0.01 0.00 -1.26 0.00 0.00 59.98 58.49 1c41 h ARG 68 Cb 0.04 0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.47 1c41 h ARG 68 CO -0.11 1.10 -0.19 1.25 0.56 0.00 0.00 179.97 182.57 1c41 h LEU 69 N 0.36 -0.46 -0.35 3.04 6.46 -0.81 0.21 115.31 123.76 1c41 h LEU 69 Ca -0.05 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 57.77 1c41 h LEU 69 Cb 1.39 0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 41.42 1c41 h LEU 69 CO 0.15 -0.31 0.13 0.22 -0.62 0.00 0.00 178.44 178.00 1c41 h TYR 70 N -0.51 0.22 -0.69 1.25 3.20 -1.45 -1.36 116.97 117.64 1c41 h TYR 70 Ca -0.04 0.02 0.15 0.00 3.14 0.00 0.00 58.73 61.99 1c41 h TYR 70 Cb 0.40 -0.05 -0.12 0.00 1.54 0.00 0.00 36.73 38.51 1c41 h TYR 70 CO -0.07 0.10 0.03 1.03 -1.64 0.00 0.00 178.16 177.60 1c41 h SER 71 N 0.28 -0.26 0.17 -2.11 0.87 -0.80 -1.42 113.55 110.27 1c41 h SER 71 Ca 0.16 0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.88 1c41 h SER 71 Cb 0.12 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1c41 h SER 71 CO -0.16 -0.13 -0.08 0.00 -0.53 0.00 0.00 176.83 175.93 1c41 h ALA 72 N 1.63 -0.23 -0.59 6.23 0.00 0.44 -2.44 119.26 124.30 1c41 h ALA 72 Ca 0.37 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.37 1c41 h ALA 72 Cb 0.63 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1c41 h ALA 72 CO -0.58 -0.59 0.59 0.66 0.00 0.00 0.00 179.25 179.33 1c41 h SER 73 N -0.31 0.00 -0.10 0.00 4.64 -0.35 0.56 113.55 117.99 1c41 h SER 73 Ca -0.02 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.18 1c41 h SER 73 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1c41 h SER 73 CO 0.04 0.00 -0.38 1.56 -0.87 0.00 0.00 176.83 177.18 1c41 h GLN 74 N 0.00 0.43 -0.08 4.77 4.20 -0.90 -3.02 115.11 120.51 1c41 h GLN 74 Ca 0.28 -0.33 0.02 0.00 0.06 0.00 0.00 58.65 58.68 1c41 h GLN 74 Cb 1.46 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.30 1c41 h GLN 74 CO -0.00 0.96 0.18 -0.07 -0.67 0.00 0.00 178.83 179.23 1c41 h LEU 75 N -0.01 0.00 0.00 1.46 3.38 -0.78 -3.46 115.31 115.91 1c41 h LEU 75 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1c41 h LEU 75 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1c41 h LEU 75 CO 0.08 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.61 1c41 n GLN 76 N -3.35 0.00 -1.03 1.13 6.02 -1.16 -5.13 117.38 113.87 1c41 n GLN 76 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.58 1c41 n GLN 76 Cb 0.26 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.46 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 0.70 -0.79 1.08 3.41 -1.02 -4.78 113.62 112.22 1c41 n SER 107 Ca 0.00 0.69 0.01 0.00 -0.26 0.00 0.00 58.87 59.31 1c41 n SER 107 Cb 0.00 -0.53 -0.01 0.00 -0.26 0.00 0.00 64.21 63.41 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 2.59 -0.17 -0.00 6.66 -2.24 -1.26 -5.04 114.28 114.82 1c41 n THR 108 Ca 0.20 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 62.10 1c41 n THR 108 Cb -0.03 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.02 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 -2.67 1.36 3.64 3.38 0.00 -1.26 -4.98 105.19 104.65 1c41 n GLY 109 Ca -0.01 -1.36 -0.45 0.00 0.00 0.00 0.00 46.02 44.21 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 2.75 1.70 -1.64 1.61 -0.04 -1.15 -4.85 135.00 133.37 1c41 n PRO 110 Ca 0.00 0.60 -0.38 0.00 -0.04 0.00 0.00 63.50 63.68 1c41 n PRO 110 Cb 0.00 -2.11 0.05 0.00 -0.04 0.00 0.00 33.50 31.40 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 0.85 1.14 0.19 0.54 3.72 -1.26 -4.89 117.46 117.75 1c41 n PHE 111 Ca 0.10 0.44 0.11 0.00 -0.05 0.00 0.00 57.45 58.05 1c41 n PHE 111 Cb 0.32 -2.18 -0.01 0.00 -0.94 0.00 0.00 39.48 36.66 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 -0.83 0.66 -3.52 4.37 8.00 0.07 -4.94 116.55 120.35 1c41 n ASP 112 Ca 0.13 0.17 -0.16 0.00 0.71 0.00 0.00 54.79 55.65 1c41 n ASP 112 Cb 0.46 0.74 -0.05 0.00 -0.02 0.00 0.00 41.12 42.25 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 -3.35 -1.78 0.14 2.24 0.00 -1.25 -4.32 121.76 113.44 1c41 s ALA 113 Ca -0.01 1.25 0.08 0.00 0.00 0.00 0.00 51.96 53.28 1c41 s ALA 113 Cb 0.11 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 1c41 s ALA 113 CO 0.81 -0.42 -0.17 -0.51 0.00 0.00 0.00 175.76 175.46 1c41 s LEU 114 N -1.42 2.39 -0.05 0.00 1.43 -0.10 -2.12 118.68 118.82 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 -0.75 0.02 0.00 0.03 0.00 0.00 46.19 45.49 1c41 s LEU 114 CO 0.05 -0.05 -0.06 -0.63 0.23 0.00 0.00 176.35 175.89 1c41 s ILE 115 N -1.87 0.65 -0.23 -0.59 1.01 -0.18 0.47 121.20 120.46 1c41 s ILE 115 Ca 0.11 -0.17 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 1c41 s ILE 115 Cb -0.06 -0.66 -0.01 0.00 0.01 0.00 0.00 42.46 41.73 1c41 s ILE 115 CO 0.05 0.26 -0.01 0.00 0.00 0.00 0.00 174.94 175.23 1c41 s ALA 116 N 0.97 2.89 -0.17 9.38 0.00 -0.60 -1.56 121.76 132.67 1c41 s ALA 116 Ca -0.10 -1.18 -0.01 0.00 0.00 0.00 0.00 51.96 50.67 1c41 s ALA 116 Cb -0.14 -1.80 -0.00 0.00 0.00 0.00 0.00 23.12 21.17 1c41 s ALA 116 CO 0.00 -0.47 -0.12 0.42 0.00 0.00 0.00 175.76 175.59 1c41 s ILE 117 N 1.50 2.90 0.11 0.00 1.01 -0.41 -0.01 121.20 126.32 1c41 s ILE 117 Ca 0.06 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 59.90 1c41 s ILE 117 Cb -0.15 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.08 1c41 s ILE 117 CO -0.02 0.49 0.32 -0.83 0.00 0.00 0.00 174.94 174.90 1c41 s GLY 118 N 1.00 -0.11 -0.27 6.18 0.00 -0.64 -1.03 107.32 112.45 1c41 s GLY 118 Ca -0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 44.72 44.38 1c41 s GLY 118 CO -0.02 -0.52 0.10 0.14 0.00 0.00 0.00 173.10 172.80 1c41 s VAL 119 N -3.83 0.36 -0.13 1.40 1.01 -1.26 -0.56 120.40 117.39 1c41 s VAL 119 Ca 0.04 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.04 1c41 s VAL 119 Cb 0.03 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 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 1.90 4.32 -0.05 3.92 2.01 0.15 -4.80 118.68 126.12 1c41 s LEU 120 Ca 0.07 0.49 0.02 0.00 0.01 0.00 0.00 54.13 54.72 1c41 s LEU 120 Cb -0.17 -2.22 0.01 0.00 0.01 0.00 0.00 46.19 43.83 1c41 s LEU 120 CO -0.25 0.27 -0.09 -0.63 1.01 0.00 0.00 176.35 176.66 1c41 s ILE 121 N -0.33 0.87 0.11 -0.59 1.01 -1.26 -1.27 121.20 119.75 1c41 s ILE 121 Ca 0.15 -0.34 -0.36 0.00 0.00 0.00 0.00 60.65 60.10 1c41 s ILE 121 Cb -0.13 -0.82 -0.16 0.00 0.01 0.00 0.00 42.46 41.36 1c41 s ILE 121 CO 0.04 0.29 1.38 1.17 0.00 0.00 0.00 174.94 177.82 1c41 n LYS 122 N 3.81 1.40 0.00 2.79 0.00 -0.83 -4.85 118.16 120.47 1c41 n LYS 122 Ca -0.23 0.50 0.00 0.00 0.00 0.00 0.00 58.31 58.58 1c41 n LYS 122 Cb 0.52 -2.16 0.00 0.00 0.00 0.00 0.00 35.03 33.38 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 2.67 2.13 0.06 3.14 0.00 -1.26 -4.94 105.19 106.99 1c41 n GLY 123 Ca 0.18 -1.82 0.09 0.00 0.00 0.00 0.00 46.02 44.47 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 -4.97 120.64 114.94 1c41 n GLU 124 Ca 0.00 -0.04 -0.14 0.00 -0.02 0.00 0.00 57.16 56.96 1c41 n GLU 124 Cb 0.00 -1.66 0.00 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 -2.48 0.00 1.55 2.62 -2.24 -1.26 -5.01 114.28 107.45 1c41 n THR 125 Ca -0.04 -1.19 0.07 0.00 -2.27 0.00 0.00 64.05 60.62 1c41 n THR 125 Cb 0.61 -0.27 0.30 0.00 -2.10 0.00 0.00 70.33 68.87 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 -1.23 1.37 -0.16 -0.78 2.81 -1.26 -4.07 117.12 113.80 1c41 n MET 126 Ca -0.01 -0.57 -0.02 0.00 -1.81 0.00 0.00 57.70 55.29 1c41 n MET 126 Cb 0.34 -1.25 0.07 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 1.05 0.04 -0.21 2.03 6.17 -1.98 -2.08 115.15 120.18 1c41 h HIS 127 Ca 0.00 0.04 0.04 0.00 0.71 0.00 0.00 60.37 61.16 1c41 h HIS 127 Cb 0.23 0.06 -0.07 0.00 2.52 0.00 0.00 27.41 30.15 1c41 h HIS 127 CO 0.08 -0.08 -0.48 0.35 0.71 0.00 0.00 177.93 178.51 1c41 h PHE 128 N 0.16 -1.40 -0.56 5.26 3.57 -1.89 -1.91 116.94 120.17 1c41 h PHE 128 Ca 0.26 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.77 1c41 h PHE 128 Cb 0.38 0.64 -0.03 0.00 2.79 0.00 0.00 35.95 39.73 1c41 h PHE 128 CO -0.28 -0.50 0.15 1.05 -2.23 0.00 0.00 178.31 176.50 1c41 h GLU 129 N -0.49 0.86 0.00 1.11 9.09 -1.75 -1.19 114.58 122.21 1c41 h GLU 129 Ca 0.07 -0.17 -0.10 0.00 0.05 0.00 0.00 59.36 59.22 1c41 h GLU 129 Cb 0.64 -0.13 -0.01 0.00 -1.65 0.00 0.00 28.75 27.59 1c41 h GLU 129 CO -0.46 0.76 -0.45 1.88 0.05 0.00 0.00 179.01 180.79 1c41 h TYR 130 N 0.83 0.00 0.21 2.06 0.05 -1.10 -2.20 116.97 116.83 1c41 h TYR 130 Ca 0.18 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.65 1c41 h TYR 130 Cb 0.28 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.05 1c41 h TYR 130 CO 0.02 0.45 -1.42 0.82 -1.05 0.00 0.00 178.16 176.98 1c41 h ILE 131 N 0.00 1.23 -0.19 -2.88 2.04 -1.17 -3.07 117.51 113.47 1c41 h ILE 131 Ca -0.00 -2.61 0.00 0.00 1.00 0.00 0.00 64.86 63.25 1c41 h ILE 131 Cb 0.90 2.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.97 1c41 h ILE 131 CO 0.06 0.80 0.13 0.00 0.00 0.00 0.00 178.15 179.13 1c41 h ALA 132 N 0.11 0.25 -0.81 1.87 0.00 -1.18 0.67 119.26 120.16 1c41 h ALA 132 Ca -0.26 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1c41 h ALA 132 Cb 2.04 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.71 1c41 h ALA 132 CO 0.22 -0.28 0.36 0.22 0.00 0.00 0.00 179.25 179.77 1c41 h ASP 133 N 0.26 1.08 -0.05 0.00 3.58 -1.52 -0.45 116.42 119.33 1c41 h ASP 133 Ca 0.07 -0.15 -0.24 0.00 0.42 0.00 0.00 57.03 57.13 1c41 h ASP 133 Cb -0.03 -0.28 0.02 0.00 1.72 0.00 0.00 39.33 40.76 1c41 h ASP 133 CO -0.02 0.94 -0.91 0.28 -2.88 0.00 0.00 179.24 176.65 1c41 h SER 134 N 1.16 0.88 -0.50 2.28 0.02 -1.41 -2.20 113.55 113.79 1c41 h SER 134 Ca 0.27 -0.70 -0.07 0.00 -0.84 0.00 0.00 61.79 60.44 1c41 h SER 134 Cb 0.16 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 1c41 h SER 134 CO -0.03 1.47 0.04 0.58 -1.14 0.00 0.00 176.83 177.75 1c41 h VAL 135 N 0.39 1.25 0.54 2.27 2.07 -0.79 0.40 116.25 122.38 1c41 h VAL 135 Ca -0.10 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 1c41 h VAL 135 Cb 1.56 0.78 0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1c41 h VAL 135 CO 0.18 0.37 -0.26 0.28 0.02 0.00 0.00 177.57 178.16 1c41 h SER 136 N 0.85 -0.62 -0.48 0.57 0.02 -1.06 -0.48 113.55 112.35 1c41 h SER 136 Ca 0.17 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.06 1c41 h SER 136 Cb 0.44 0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 1c41 h SER 136 CO 0.02 -0.39 0.13 0.45 -1.14 0.00 0.00 176.83 175.90 1c41 h HIS 137 N -0.81 0.84 -0.25 3.45 3.86 -1.31 -1.59 115.15 119.35 1c41 h HIS 137 Ca -0.07 -0.08 0.05 0.00 -1.16 0.00 0.00 60.37 59.11 1c41 h HIS 137 Cb 0.59 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.77 1c41 h HIS 137 CO -0.02 0.71 -0.02 0.78 0.86 0.00 0.00 177.93 180.23 1c41 h GLY 138 N 0.96 0.22 0.95 2.45 0.00 0.04 0.59 103.07 108.28 1c41 h GLY 138 Ca 0.18 0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.50 1c41 h GLY 138 CO -0.00 -0.07 0.03 1.41 0.00 0.00 0.00 176.54 177.91 1c41 h LEU 139 N 0.05 0.68 -1.51 3.11 3.38 -0.79 -1.38 115.31 118.84 1c41 h LEU 139 Ca 0.12 -0.29 0.08 0.00 0.09 0.00 0.00 57.88 57.88 1c41 h LEU 139 Cb 0.17 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1c41 h LEU 139 CO -0.23 0.80 0.42 -0.03 0.09 0.00 0.00 178.44 179.50 1c41 h MET 140 N 0.54 0.56 0.10 1.13 4.05 -0.90 -1.28 114.93 119.13 1c41 h MET 140 Ca 0.12 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.50 1c41 h MET 140 Cb 0.43 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 1c41 h MET 140 CO 0.02 0.37 -0.05 -0.09 0.23 0.00 0.00 176.91 177.39 1c41 h ARG 141 N 0.58 -0.13 -0.96 0.39 2.43 -0.37 -2.45 114.38 113.87 1c41 h ARG 141 Ca 0.28 0.01 0.17 0.00 -0.81 0.00 0.00 59.98 59.64 1c41 h ARG 141 Cb 0.36 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.86 1c41 h ARG 141 CO -0.09 0.36 0.61 0.28 -1.51 0.00 0.00 179.97 179.62 1c41 h VAL 142 N -0.72 0.76 0.91 0.20 2.07 -0.89 0.64 116.25 119.21 1c41 h VAL 142 Ca -0.01 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1c41 h VAL 142 Cb 0.55 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1c41 h VAL 142 CO 0.02 0.13 -0.49 -0.61 0.02 0.00 0.00 177.57 176.65 1c41 h GLN 143 N 0.70 -1.23 -0.32 1.57 4.15 -1.22 0.76 115.11 119.52 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 0.87 0.28 -0.02 0.00 0.21 0.00 0.00 27.48 28.82 1c41 h GLN 143 CO -0.28 -0.82 -0.17 -0.07 -1.93 0.00 0.00 178.83 175.56 1c41 h LEU 144 N -1.28 0.57 0.52 -2.39 3.38 -0.80 0.29 115.31 115.61 1c41 h LEU 144 Ca -0.12 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 1c41 h LEU 144 Cb 1.00 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.60 1c41 h LEU 144 CO 0.17 0.75 -0.25 0.44 0.09 0.00 0.00 178.44 179.65 1c41 h ASP 145 N 0.52 -0.59 1.13 -0.43 5.19 0.30 -3.19 116.42 119.35 1c41 h ASP 145 Ca 0.09 -0.03 -0.06 0.00 -0.62 0.00 0.00 57.03 56.41 1c41 h ASP 145 Cb 0.59 0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 1c41 h ASP 145 CO 0.04 -0.34 -0.28 0.00 -3.12 0.00 0.00 179.24 175.53 1c41 h THR 146 N -0.81 0.61 -0.15 0.35 1.03 -0.78 -3.47 112.91 109.68 1c41 h THR 146 Ca -0.07 -1.40 -0.06 0.00 -0.01 0.00 0.00 66.41 64.86 1c41 h THR 146 Cb 0.58 1.95 -0.03 0.00 -1.07 0.00 0.00 68.15 69.59 1c41 h THR 146 CO 0.12 0.28 -0.06 0.61 -0.01 0.00 0.00 175.52 176.46 1c41 n GLY 147 N 0.48 0.61 3.27 2.99 0.00 0.10 -5.00 105.19 107.64 1c41 n GLY 147 Ca 0.01 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.96 2.40 0.27 1.61 1.01 -1.09 -5.03 120.40 117.60 1c41 s VAL 148 Ca 0.00 -0.90 -0.31 0.00 0.00 0.00 0.00 61.98 60.78 1c41 s VAL 148 Cb 0.00 -1.95 -0.12 0.00 0.00 0.00 0.00 36.38 34.31 1c41 s VAL 148 CO 0.00 0.55 1.54 -2.65 0.00 0.00 0.00 175.10 174.54 1c41 n PRO 149 N 3.53 2.48 -3.96 2.72 -0.02 -1.26 -4.46 135.00 134.03 1c41 n PRO 149 Ca -0.19 0.88 -0.31 0.00 -2.02 0.00 0.00 63.50 61.87 1c41 n PRO 149 Cb 0.53 -2.63 -0.15 0.00 -0.02 0.00 0.00 33.50 31.23 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 0.07 1.75 0.12 -1.45 1.01 -1.26 -0.92 120.40 119.72 1c41 s VAL 150 Ca 0.66 -1.57 -0.31 0.00 0.00 0.00 0.00 61.98 60.76 1c41 s VAL 150 Cb -0.55 -2.07 -0.09 0.00 0.00 0.00 0.00 36.38 33.67 1c41 s VAL 150 CO 0.48 -0.26 1.53 -0.63 0.00 0.00 0.00 175.10 176.22 1c41 s ILE 151 N 1.25 2.95 -1.17 2.22 -1.09 0.17 -4.87 121.20 120.66 1c41 s ILE 151 Ca -0.01 0.62 -0.20 0.00 -2.23 0.00 0.00 60.65 58.83 1c41 s ILE 151 Cb -0.19 -3.40 0.07 0.00 -1.58 0.00 0.00 42.46 37.36 1c41 s ILE 151 CO -0.08 0.03 1.59 0.12 -1.23 0.00 0.00 174.94 175.37 1c41 s PHE 152 N 1.51 2.72 -0.67 3.97 5.36 -1.26 -1.55 117.98 128.06 1c41 s PHE 152 Ca 0.69 -1.32 -0.02 0.00 -0.96 0.00 0.00 56.93 55.32 1c41 s PHE 152 Cb -0.40 -4.70 0.41 0.00 -0.34 0.00 0.00 43.02 37.98 1c41 s PHE 152 CO 0.31 -1.83 2.05 0.41 -1.46 0.00 0.00 175.22 174.70 1c41 n GLY 153 N 5.96 5.65 3.47 13.12 0.00 0.99 -4.93 105.19 129.46 1c41 n GLY 153 Ca 0.41 -2.24 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 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 -4.63 4.01 -0.15 1.61 1.01 -1.22 -1.62 120.40 119.40 1c41 s VAL 154 Ca 0.60 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 62.14 1c41 s VAL 154 Cb 0.48 -2.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 1c41 s VAL 154 CO -0.08 0.44 0.29 -0.76 0.00 0.00 0.00 175.10 174.99 1c41 s LEU 155 N 0.80 4.26 -0.65 3.92 1.43 0.28 -4.92 118.68 123.80 1c41 s LEU 155 Ca 0.00 0.52 0.03 0.00 -1.03 0.00 0.00 54.13 53.66 1c41 s LEU 155 Cb -0.14 -2.36 0.16 0.00 0.03 0.00 0.00 46.19 43.87 1c41 s LEU 155 CO 0.02 0.12 0.43 0.42 0.23 0.00 0.00 176.35 177.57 1c41 s THR 156 N 0.34 2.98 0.34 5.49 -4.23 -1.26 0.33 115.64 119.64 1c41 s THR 156 Ca 0.16 -3.80 0.07 0.00 -1.18 0.00 0.00 61.69 56.95 1c41 s THR 156 Cb -0.13 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.71 1c41 s THR 156 CO 0.04 -0.93 0.40 -0.69 -0.54 0.00 0.00 174.62 172.90 1c41 s VAL 157 N -0.92 3.76 -0.03 2.29 1.01 -0.39 -5.02 120.40 121.09 1c41 s VAL 157 Ca 0.22 -1.16 0.12 0.00 0.00 0.00 0.00 61.98 61.16 1c41 s VAL 157 Cb -0.14 -3.29 -0.19 0.00 0.00 0.00 0.00 36.38 32.77 1c41 s VAL 157 CO -0.09 -0.15 0.24 0.18 0.00 0.00 0.00 175.10 175.28 1c41 n LEU 158 N -1.54 0.00 -3.93 3.92 4.77 -1.26 -1.97 117.00 116.99 1c41 n LEU 158 Ca -0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 1c41 n LEU 158 Cb 0.59 0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.62 1c41 n LEU 158 CO 0.42 0.04 -0.27 0.42 -1.33 0.00 0.00 177.39 176.68 1c41 s THR 159 N -2.79 0.10 0.22 -5.08 -4.23 -1.26 -4.45 115.64 98.14 1c41 s THR 159 Ca -0.05 -0.85 -0.11 0.00 -1.18 0.00 0.00 61.69 59.50 1c41 s THR 159 Cb 0.07 -0.41 0.22 0.00 1.34 0.00 0.00 72.50 73.72 1c41 s THR 159 CO 0.52 -0.47 1.65 0.44 -0.54 0.00 0.00 174.62 176.23 1c41 h ASP 160 N 4.37 -0.36 -0.97 3.99 5.19 -1.98 -0.75 116.42 125.92 1c41 h ASP 160 Ca -0.32 0.17 0.12 0.00 -0.62 0.00 0.00 57.03 56.38 1c41 h ASP 160 Cb 1.20 0.31 -0.08 0.00 0.18 0.00 0.00 39.33 40.94 1c41 h ASP 160 CO 0.42 -0.15 0.62 0.44 -3.12 0.00 0.00 179.24 177.45 1c41 h ASP 161 N 0.08 0.87 -0.80 6.45 3.32 -1.99 -0.17 116.42 124.19 1c41 h ASP 161 Ca 0.33 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.41 1c41 h ASP 161 Cb 0.54 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 1c41 h ASP 161 CO -0.57 0.47 0.46 1.56 -1.72 0.00 0.00 179.24 179.43 1c41 h GLN 162 N 0.94 1.10 0.36 3.56 4.20 -1.56 0.21 115.11 123.92 1c41 h GLN 162 Ca 0.48 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 59.05 1c41 h GLN 162 Cb 0.50 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1c41 h GLN 162 CO -0.24 0.80 -0.18 0.00 -0.67 0.00 0.00 178.83 178.54 1c41 h ALA 163 N 1.24 -0.49 -0.49 3.87 0.00 -0.87 -1.46 119.26 121.07 1c41 h ALA 163 Ca 0.28 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.17 1c41 h ALA 163 Cb -0.00 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1c41 h ALA 163 CO -0.05 -0.77 0.10 0.87 0.00 0.00 0.00 179.25 179.39 1c41 h LYS 164 N -0.49 0.23 -0.56 0.00 1.57 -0.74 -0.96 116.57 115.62 1c41 h LYS 164 Ca -0.05 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1c41 h LYS 164 Cb 0.37 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 1c41 h LYS 164 CO 0.08 0.15 0.29 0.00 -0.57 0.00 0.00 179.45 179.40 1c41 h ALA 165 N 1.38 0.72 0.00 3.86 0.00 -0.35 -0.86 119.26 124.01 1c41 h ALA 165 Ca 0.25 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1c41 h ALA 165 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1c41 h ALA 165 CO -0.32 -0.04 0.00 0.54 0.00 0.00 0.00 179.25 179.43 1c41 n ARG 166 N -4.85 0.21 -0.13 0.00 3.00 -0.57 -2.37 116.66 111.95 1c41 n ARG 166 Ca 0.06 0.41 0.12 0.00 -0.01 0.00 0.00 57.85 58.43 1c41 n ARG 166 Cb 0.14 -1.89 0.18 0.00 0.00 0.00 0.00 32.46 30.90 1c41 n ARG 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1c41 n ALA 167 N -1.79 2.43 -0.63 7.54 0.00 -0.42 -0.65 120.51 126.98 1c41 n ALA 167 Ca 0.02 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.56 1c41 n ALA 167 Cb 0.25 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 1.52 0.25 0.00 0.00 -0.86 -4.48 105.19 103.03 1c41 n GLY 168 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 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 0.51 -3.91 1.61 2.07 -1.55 -3.39 116.25 111.59 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 0.51 0.08 0.00 -1.52 0.00 0.00 31.29 30.36 1c41 h VAL 169 CO 0.00 0.00 0.68 -0.63 0.02 0.00 0.00 177.57 177.64 1c41 s ILE 170 N -6.10 2.50 -0.43 4.57 1.01 -1.23 -4.81 121.20 116.71 1c41 s ILE 170 Ca -0.15 0.50 -0.39 0.00 0.00 0.00 0.00 60.65 60.61 1c41 s ILE 170 Cb 0.09 -3.32 -0.17 0.00 0.01 0.00 0.00 42.46 39.08 1c41 s ILE 170 CO 0.66 0.12 1.64 -0.62 0.00 0.00 0.00 174.94 176.74 1c41 n GLU 171 N 0.63 0.00 -4.15 2.79 -0.58 -1.26 -0.98 120.64 117.09 1c41 n GLU 171 Ca 0.01 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.40 1c41 n GLU 171 Cb 0.41 -1.30 -0.01 0.00 -0.57 0.00 0.00 31.44 29.97 1c41 n GLU 171 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1c41 n GLY 172 N 5.08 -0.45 0.02 0.62 0.00 -1.26 -4.86 105.19 104.33 1c41 n GLY 172 Ca 0.38 0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.68 1c41 n GLY 172 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c41 n SER 173 N -2.70 0.23 -1.28 1.61 3.41 -0.15 -5.01 113.62 109.72 1c41 n SER 173 Ca 0.06 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1c41 n SER 173 Cb 0.50 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1c41 n SER 173 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1c41 n HIS 174 N -1.41 -1.41 -2.92 7.33 -0.00 -1.26 -4.71 115.22 110.84 1c41 n HIS 174 Ca 0.08 0.84 -0.42 0.00 0.46 0.00 0.00 57.72 58.68 1c41 n HIS 174 Cb 0.32 -2.53 -0.05 0.00 -0.12 0.00 0.00 29.99 27.62 1c41 n HIS 174 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1c41 s ASN 175 N -0.17 6.76 0.57 0.26 3.84 -1.26 -3.48 114.94 121.46 1c41 s ASN 175 Ca 0.00 0.89 0.36 0.00 0.21 0.00 0.00 52.86 54.32 1c41 s ASN 175 Cb 0.00 -2.42 1.64 0.00 -0.55 0.00 0.00 41.25 39.91 1c41 s ASN 175 CO 0.00 -0.55 2.07 0.45 -2.79 0.00 0.00 177.10 176.28 1c41 h HIS 176 N 7.85 0.00 -0.97 0.43 3.86 -1.18 -2.89 115.15 122.25 1c41 h HIS 176 Ca -0.24 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.10 1c41 h HIS 176 Cb 1.10 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.48 1c41 h HIS 176 CO 0.76 0.00 0.59 0.78 0.86 0.00 0.00 177.93 180.93 1c41 h GLY 177 N 1.47 1.60 0.57 2.45 0.00 -1.79 0.69 103.07 108.07 1c41 h GLY 177 Ca 0.00 -0.39 0.07 0.00 0.00 0.00 0.00 47.33 47.01 1c41 h GLY 177 CO 0.00 0.11 0.31 0.83 0.00 0.00 0.00 176.54 177.79 1c41 h GLU 178 N 0.91 0.55 -0.47 4.80 5.08 -1.60 -0.74 114.58 123.11 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 0.54 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1c41 h GLU 178 CO -0.29 0.36 0.29 -0.44 -1.00 0.00 0.00 179.01 177.94 1c41 h ASP 179 N 0.56 0.49 -0.49 1.42 3.32 -1.06 -1.74 116.42 118.93 1c41 h ASP 179 Ca 0.30 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 1c41 h ASP 179 Cb 0.27 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1c41 h ASP 179 CO -0.23 0.35 0.22 -0.50 -1.72 0.00 0.00 179.24 177.36 1c41 h TRP 180 N 0.59 0.73 -0.24 4.55 6.55 -0.48 0.13 115.95 127.79 1c41 h TRP 180 Ca 0.18 -0.04 -0.01 0.00 0.95 0.00 0.00 58.89 59.97 1c41 h TRP 180 Cb -0.03 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.04 1c41 h TRP 180 CO -0.06 0.59 0.12 0.78 -1.05 0.00 0.00 178.44 178.83 1c41 h GLY 181 N 0.65 0.36 0.53 1.49 0.00 -1.03 0.20 103.07 105.28 1c41 h GLY 181 Ca 0.17 -0.17 0.07 0.00 0.00 0.00 0.00 47.33 47.40 1c41 h GLY 181 CO -0.02 0.16 0.23 -2.00 0.00 0.00 0.00 176.54 174.92 1c41 h LEU 182 N 0.26 0.27 -0.67 3.11 5.85 -1.06 -1.76 115.31 121.30 1c41 h LEU 182 Ca 0.08 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.75 1c41 h LEU 182 Cb 0.10 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1c41 h LEU 182 CO -0.01 0.18 -0.10 0.00 -0.34 0.00 0.00 178.44 178.17 1c41 h ALA 183 N 1.35 0.87 -0.69 1.25 0.00 -0.36 -2.57 119.26 119.11 1c41 h ALA 183 Ca 0.27 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.91 1c41 h ALA 183 Cb 0.27 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1c41 h ALA 183 CO -0.24 0.65 0.37 0.00 0.00 0.00 0.00 179.25 180.03 1c41 h ALA 184 N 1.04 0.94 0.33 0.00 0.00 0.24 -0.40 119.26 121.41 1c41 h ALA 184 Ca 0.14 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1c41 h ALA 184 Cb 0.63 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1c41 h ALA 184 CO 0.04 0.03 -0.16 0.28 0.00 0.00 0.00 179.25 179.44 1c41 h VAL 185 N 0.67 0.69 -0.13 0.00 2.07 -1.24 0.13 116.25 118.45 1c41 h VAL 185 Ca 0.32 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.51 1c41 h VAL 185 Cb 0.25 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 1c41 h VAL 185 CO -0.21 0.08 -0.25 -0.08 0.02 0.00 0.00 177.57 177.13 1c41 h GLU 186 N -0.65 -0.30 -0.56 1.57 4.81 -1.14 -0.10 114.58 118.20 1c41 h GLU 186 Ca -0.04 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1c41 h GLU 186 Cb 0.46 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 1c41 h GLU 186 CO 0.07 -0.20 0.29 0.52 -0.73 0.00 0.00 179.01 178.96 1c41 h MET 187 N -0.31 0.77 -0.12 1.92 2.86 -1.07 0.44 114.93 119.41 1c41 h MET 187 Ca 0.10 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1c41 h MET 187 Cb 0.46 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1c41 h MET 187 CO -0.31 0.58 0.06 0.78 1.06 0.00 0.00 176.91 179.09 1c41 h GLY 188 N 0.86 0.18 0.91 8.32 0.00 0.04 0.30 103.07 113.69 1c41 h GLY 188 Ca 0.20 -0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.45 1c41 h GLY 188 CO -0.03 0.08 0.02 -2.08 0.00 0.00 0.00 176.54 174.53 1c41 h VAL 189 N 0.09 0.97 -0.63 4.60 2.07 -0.54 -2.37 116.25 120.43 1c41 h VAL 189 Ca 0.04 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.56 1c41 h VAL 189 Cb 0.09 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 1c41 h VAL 189 CO -0.01 0.01 0.41 0.03 0.02 0.00 0.00 177.57 178.03 1c41 h ARG 190 N 0.06 0.79 -0.51 1.57 3.08 -0.66 -2.52 114.38 116.20 1c41 h ARG 190 Ca 0.04 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.12 1c41 h ARG 190 Cb 0.03 -0.18 -0.06 0.00 0.08 0.00 0.00 29.97 29.84 1c41 h ARG 190 CO -0.05 0.52 0.16 -0.09 -1.07 0.00 0.00 179.97 179.44 1c41 h ARG 191 N 0.82 0.31 -0.14 0.04 2.43 -0.13 -0.78 114.38 116.93 1c41 h ARG 191 Ca 0.24 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 1c41 h ARG 191 Cb -0.05 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.38 1c41 h ARG 191 CO -0.07 0.21 -0.13 0.00 -1.51 0.00 0.00 179.97 178.47 1c41 h ARG 192 N 0.32 -0.14 -0.52 0.20 3.08 -1.01 0.17 114.38 116.47 1c41 h ARG 192 Ca 0.25 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.34 1c41 h ARG 192 Cb 0.30 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.34 1c41 h ARG 192 CO -0.28 -0.09 0.31 -0.44 -1.07 0.00 0.00 179.97 178.39 1c41 h ASP 193 N -0.15 0.49 -0.55 7.04 3.32 -1.09 -0.32 116.42 125.17 1c41 h ASP 193 Ca 0.09 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.16 1c41 h ASP 193 Cb 0.28 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1c41 h ASP 193 CO -0.23 0.35 0.36 -0.50 -1.72 0.00 0.00 179.24 177.50 1c41 h TRP 194 N 0.61 0.68 -0.01 4.55 6.55 -0.71 0.66 115.95 128.28 1c41 h TRP 194 Ca 0.21 0.02 0.00 0.00 0.95 0.00 0.00 58.89 60.07 1c41 h TRP 194 Cb 0.03 -0.23 -0.00 0.00 -0.86 0.00 0.00 29.16 28.10 1c41 h TRP 194 CO -0.07 0.43 0.02 0.00 -1.05 0.00 0.00 178.44 177.77 1c41 h ALA 195 N 1.20 1.38 -0.26 1.49 0.00 0.31 0.34 119.26 123.72 1c41 h ALA 195 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1c41 h ALA 195 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1c41 h ALA 195 CO -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.17 1c41 n ALA 196 N -2.24 2.48 -1.07 0.00 0.00 0.09 -4.91 120.51 114.87 1c41 n ALA 196 Ca -0.03 -0.65 -0.02 0.00 0.00 0.00 0.00 53.44 52.74 1c41 n ALA 196 Cb 0.10 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 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 1.20 0.52 3.76 0.00 0.00 0.12 -5.00 105.19 105.79 1c41 n GLY 197 Ca 0.16 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.30 4.78 0.00 1.61 1.02 -0.40 -5.00 119.74 120.45 1c41 s LYS 198 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 55.97 57.39 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 0.21 0.25 -0.92 0.00 0.00 175.35 175.42