#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 1.96 -0.24 1.61 0.04 -1.26 -5.10 135.00 132.02 1c41 s PRO 6 Ca 0.00 -1.09 -0.07 0.00 0.04 0.00 0.00 61.00 59.88 1c41 s PRO 6 Cb 0.00 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 1c41 s PRO 6 CO 0.00 -1.20 0.05 0.95 0.04 0.00 0.00 177.00 176.84 1c41 s THR 7 N -2.99 4.17 0.52 1.26 -4.23 -1.26 -5.09 115.64 108.02 1c41 s THR 7 Ca 0.64 -0.22 -0.23 0.00 -1.18 0.00 0.00 61.69 60.70 1c41 s THR 7 Cb -0.07 -2.94 -0.06 0.00 1.34 0.00 0.00 72.50 70.78 1c41 s THR 7 CO 0.42 0.37 1.36 -2.16 -0.54 0.00 0.00 174.62 174.07 1c41 s PRO 8 N 1.47 3.30 -0.28 3.99 0.04 -1.26 -5.04 135.00 137.22 1c41 s PRO 8 Ca 0.05 2.25 -0.10 0.00 0.04 0.00 0.00 61.00 63.25 1c41 s PRO 8 Cb -0.15 -2.36 0.12 0.00 0.04 0.00 0.00 34.50 32.16 1c41 s PRO 8 CO 0.02 -1.06 0.61 -0.65 0.04 0.00 0.00 177.00 175.96 1c41 s GLN 9 N -2.79 0.54 -0.20 4.56 -0.21 -1.26 -5.15 119.66 115.16 1c41 s GLN 9 Ca 0.69 1.38 -0.05 0.00 0.02 0.00 0.00 55.36 57.39 1c41 s GLN 9 Cb -0.40 0.77 -0.03 0.00 1.00 0.00 0.00 33.01 34.35 1c41 s GLN 9 CO 0.49 -0.21 0.01 -1.14 -2.12 0.00 0.00 175.29 172.32 1c41 s GLN 10 N 2.82 3.69 0.43 2.91 0.74 -1.26 -4.89 119.66 124.10 1c41 s GLN 10 Ca -0.05 -0.48 0.07 0.00 0.05 0.00 0.00 55.36 54.94 1c41 s GLN 10 Cb -0.12 -3.10 -0.04 0.00 1.10 0.00 0.00 33.01 30.85 1c41 s GLN 10 CO -0.18 0.07 0.22 -1.01 -0.55 0.00 0.00 175.29 173.84 1c41 s HIS 11 N 0.86 2.52 0.00 1.67 3.76 -1.26 -5.09 115.29 117.75 1c41 s HIS 11 Ca 0.01 -0.61 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 1c41 s HIS 11 Cb -0.14 -1.97 0.00 0.00 1.11 0.00 0.00 32.58 31.57 1c41 s HIS 11 CO 0.02 0.09 0.65 -3.47 -0.85 0.00 0.00 174.74 171.19 1c41 n ASP 12 N -1.32 0.00 -3.98 1.40 -0.08 -1.26 -4.81 116.55 106.51 1c41 n ASP 12 Ca -0.01 0.66 -0.28 0.00 -1.51 0.00 0.00 54.79 53.65 1c41 n ASP 12 Cb 0.64 -0.17 -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 -0.59 -0.30 0.00 0.27 0.00 -1.26 -4.27 105.19 99.05 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 0.96 -1.31 1.61 3.41 -1.26 -2.77 113.62 111.35 1c41 n SER 14 Ca -0.20 -0.36 0.09 0.00 -0.26 0.00 0.00 58.87 58.15 1c41 n SER 14 Cb 0.63 1.47 0.31 0.00 -0.26 0.00 0.00 64.21 66.36 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 -1.82 2.81 -2.50 7.33 0.00 -1.26 -4.46 120.51 120.62 1c41 n ALA 15 Ca -0.01 -1.56 -0.31 0.00 0.00 0.00 0.00 53.44 51.56 1c41 n ALA 15 Cb 0.37 -0.86 -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 -1.69 4.16 -0.21 0.00 1.02 -1.26 -5.06 118.68 115.64 1c41 s LEU 16 Ca 0.45 0.79 0.00 0.00 0.02 0.00 0.00 54.13 55.39 1c41 s LEU 16 Cb 0.28 -3.56 0.05 0.00 0.02 0.00 0.00 46.19 42.99 1c41 s LEU 16 CO 0.22 -0.08 -0.06 -0.60 0.02 0.00 0.00 176.35 175.86 1c41 s ARG 17 N -2.97 1.67 -0.11 1.70 3.52 -1.26 -4.64 118.95 116.85 1c41 s ARG 17 Ca 0.45 -0.85 -0.04 0.00 -0.13 0.00 0.00 55.73 55.16 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 0.00 175.30 174.66 1c41 s ILE 18 N 1.45 4.56 -0.12 4.11 -1.09 -0.28 -0.76 121.20 129.07 1c41 s ILE 18 Ca -0.03 -0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.24 1c41 s ILE 18 Cb -0.18 -2.95 -0.02 0.00 -1.58 0.00 0.00 42.46 37.74 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 -0.94 -1.02 107.32 112.36 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 -0.27 -0.17 -0.42 0.00 0.00 0.00 173.10 172.27 1c41 s ILE 20 N 0.18 1.43 -0.11 0.90 1.01 0.65 -1.09 121.20 124.17 1c41 s ILE 20 Ca -0.07 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.89 1c41 s ILE 20 Cb -0.15 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.10 1c41 s ILE 20 CO 0.05 0.41 -0.10 -0.69 0.00 0.00 0.00 174.94 174.61 1c41 s VAL 21 N 0.19 1.15 0.09 2.92 1.01 -0.57 -1.02 120.40 124.17 1c41 s VAL 21 Ca -0.07 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 61.59 1c41 s VAL 21 Cb -0.13 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 1c41 s VAL 21 CO 0.03 0.38 -0.22 -1.38 0.00 0.00 0.00 175.10 173.91 1c41 s HIS 22 N 1.38 1.88 0.79 5.22 -3.43 -0.74 -1.46 115.29 118.93 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 -0.13 -1.05 0.10 0.00 -1.43 0.00 0.00 32.58 30.06 1c41 s HIS 22 CO -0.05 0.20 1.12 0.00 -2.00 0.00 0.00 174.74 174.00 1c41 s ALA 23 N -1.05 2.87 -0.93 -1.38 0.00 -0.22 -1.48 121.76 119.56 1c41 s ALA 23 Ca 0.08 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.17 1c41 s ALA 23 Cb -0.10 -2.70 0.10 0.00 0.00 0.00 0.00 23.12 20.42 1c41 s ALA 23 CO 0.04 -1.64 0.87 0.54 0.00 0.00 0.00 175.76 175.57 1c41 n ARG 24 N -3.20 0.83 -2.47 0.00 1.74 -0.14 -4.78 116.66 108.64 1c41 n ARG 24 Ca 0.10 -1.22 -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 3.56 -1.05 -1.55 0.52 -1.13 -3.33 118.94 115.20 1c41 s TRP 25 Ca 0.11 1.61 -0.00 0.00 0.02 0.00 0.00 56.10 57.84 1c41 s TRP 25 Cb 0.07 -3.31 -0.01 0.00 -1.15 0.00 0.00 33.47 29.08 1c41 s TRP 25 CO 0.11 -0.69 0.88 0.09 0.02 0.00 0.00 176.95 177.35 1c41 n ASN 26 N 1.90 -2.39 -0.15 2.95 3.02 -1.26 -4.58 115.26 114.74 1c41 n ASN 26 Ca 0.01 -0.55 0.11 0.00 -0.03 0.00 0.00 54.58 54.12 1c41 n ASN 26 Cb 0.45 -4.59 0.44 0.00 -0.61 0.00 0.00 39.78 35.47 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 -1.61 0.54 0.00 3.52 5.08 -1.91 0.07 114.58 120.27 1c41 h GLU 27 Ca -0.52 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 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 0.44 0.36 0.00 0.25 -1.00 0.00 0.00 179.01 179.05 1c41 n THR 28 N -4.49 1.09 -0.09 1.13 -2.24 -1.26 -0.86 114.28 107.56 1c41 n THR 28 Ca 0.12 0.61 -0.12 0.00 -2.27 0.00 0.00 64.05 62.39 1c41 n THR 28 Cb 0.37 -1.59 -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 -2.17 1.16 -0.13 2.28 2.08 -0.11 -4.36 119.36 118.11 1c41 n ILE 29 Ca -0.01 -0.53 -0.08 0.00 0.56 0.00 0.00 62.75 62.69 1c41 n ILE 29 Cb 0.07 -1.00 -0.00 0.00 -0.75 0.00 0.00 39.64 37.96 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 1.15 0.22 1.39 1.08 -0.21 -2.73 117.51 118.41 1c41 h ILE 30 Ca -0.45 -0.37 -0.00 0.00 -0.39 0.00 0.00 64.86 63.65 1c41 h ILE 30 Cb 1.81 0.66 -0.01 0.00 -3.07 0.00 0.00 36.82 36.21 1c41 h ILE 30 CO -0.04 0.15 -0.18 -0.08 -0.69 0.00 0.00 178.15 177.31 1c41 h GLU 31 N 0.52 -0.40 -0.98 2.37 4.22 -1.24 0.30 114.58 119.38 1c41 h GLU 31 Ca 0.14 0.03 0.10 0.00 0.08 0.00 0.00 59.36 59.71 1c41 h GLU 31 Cb 0.04 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.31 1c41 h GLU 31 CO -0.02 -0.27 0.62 -1.35 -2.18 0.00 0.00 179.01 175.81 1c41 h PRO 32 N -0.41 0.97 0.69 0.92 0.11 -1.75 0.28 132.00 132.81 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 0.37 -0.22 0.01 0.00 0.11 0.00 0.00 31.00 31.27 1c41 h PRO 32 CO -0.02 0.64 -0.33 -0.07 -0.21 0.00 0.00 178.00 178.01 1c41 h LEU 33 N 1.00 -0.78 -0.80 2.35 3.38 -1.12 -2.05 115.31 117.28 1c41 h LEU 33 Ca 0.46 0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.59 1c41 h LEU 33 Cb 0.42 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.27 1c41 h LEU 33 CO -0.22 -0.42 0.36 0.25 0.09 0.00 0.00 178.44 178.50 1c41 h LEU 34 N -1.20 0.39 -0.03 1.67 5.85 -0.01 -0.54 115.31 121.46 1c41 h LEU 34 Ca -0.09 0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1c41 h LEU 34 Cb 0.73 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1c41 h LEU 34 CO 0.16 0.15 -0.14 0.00 -0.34 0.00 0.00 178.44 178.27 1c41 h ALA 35 N 1.56 -0.14 -0.72 1.25 0.00 -0.42 0.84 119.26 121.63 1c41 h ALA 35 Ca 0.44 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.34 1c41 h ALA 35 Cb 0.65 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1c41 h ALA 35 CO -0.39 -0.62 0.35 0.78 0.00 0.00 0.00 179.25 179.37 1c41 h GLY 36 N -0.22 1.10 0.96 0.00 0.00 -0.48 0.13 103.07 104.56 1c41 h GLY 36 Ca 0.06 -0.54 -0.09 0.00 0.00 0.00 0.00 47.33 46.75 1c41 h GLY 36 CO -0.15 0.52 -0.14 0.00 0.00 0.00 0.00 176.54 176.76 1c41 h THR 37 N 1.00 1.28 -0.66 4.70 1.03 -0.87 -2.18 112.91 117.22 1c41 h THR 37 Ca 0.25 -1.25 -0.05 0.00 -0.01 0.00 0.00 66.41 65.36 1c41 h THR 37 Cb 0.11 1.36 -0.03 0.00 -1.07 0.00 0.00 68.15 68.53 1c41 h THR 37 CO -0.03 0.41 0.23 0.50 -0.01 0.00 0.00 175.52 176.62 1c41 h LYS 38 N 0.49 1.00 0.13 0.00 3.64 -0.64 -2.20 116.57 119.00 1c41 h LYS 38 Ca 0.08 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1c41 h LYS 38 Cb 0.67 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1c41 h LYS 38 CO 0.05 0.86 -0.32 0.00 -2.27 0.00 0.00 179.45 177.77 1c41 h ALA 39 N 1.10 -0.87 -0.34 5.00 0.00 -0.82 -1.49 119.26 121.84 1c41 h ALA 39 Ca 0.22 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1c41 h ALA 39 Cb 0.25 0.68 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1c41 h ALA 39 CO -0.01 -0.93 0.34 0.87 0.00 0.00 0.00 179.25 179.52 1c41 h LYS 40 N -0.50 0.00 0.49 0.00 1.79 -1.31 0.76 116.57 117.80 1c41 h LYS 40 Ca -0.01 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 1c41 h LYS 40 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 1c41 h LYS 40 CO -0.14 0.00 -0.24 -0.07 -1.08 0.00 0.00 179.45 177.92 1c41 h LEU 41 N 0.00 -0.56 -0.41 2.94 3.38 -0.63 -1.70 115.31 118.33 1c41 h LEU 41 Ca 0.16 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.11 1c41 h LEU 41 Cb 0.85 0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 1c41 h LEU 41 CO -0.00 -0.24 0.16 -0.07 0.09 0.00 0.00 178.44 178.38 1c41 h LEU 42 N -0.91 0.19 -1.73 1.67 3.38 -0.73 0.99 115.31 118.17 1c41 h LEU 42 Ca -0.07 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.02 1c41 h LEU 42 Cb 0.60 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1c41 h LEU 42 CO 0.11 0.15 0.52 0.00 0.09 0.00 0.00 178.44 179.31 1c41 h ALA 43 N 1.25 1.87 -0.32 1.53 0.00 -0.71 1.17 119.26 124.05 1c41 h ALA 43 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1c41 h ALA 43 Cb 0.15 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1c41 h ALA 43 CO -0.17 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 178.42 1c41 n GLY 45 N 1.44 0.64 3.71 0.00 0.00 0.40 -4.38 105.19 107.01 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 -2.28 3.16 0.13 1.61 1.01 -0.96 -4.15 120.40 118.93 1c41 s VAL 46 Ca 0.00 0.80 -0.31 0.00 0.00 0.00 0.00 61.98 62.47 1c41 s VAL 46 Cb 0.00 -3.51 -0.08 0.00 0.00 0.00 0.00 36.38 32.79 1c41 s VAL 46 CO 0.00 0.05 1.37 -0.54 0.00 0.00 0.00 175.10 175.98 1c41 s LYS 47 N 1.36 4.34 0.34 2.72 1.02 -1.26 -4.26 119.74 124.00 1c41 s LYS 47 Ca 0.67 2.07 0.14 0.00 0.02 0.00 0.00 55.97 58.87 1c41 s LYS 47 Cb -0.38 -3.24 1.12 0.00 -0.52 0.00 0.00 37.83 34.81 1c41 s LYS 47 CO 0.30 -0.40 1.62 1.49 -0.92 0.00 0.00 175.35 177.45 1c41 h GLU 48 N 6.48 0.15 0.00 1.68 4.57 -1.96 0.86 114.58 126.37 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 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1c41 h GLU 48 CO 0.84 0.10 0.00 -1.13 -1.18 0.00 0.00 179.01 177.64 1c41 n SER 49 N -5.20 0.76 -1.27 1.04 3.41 -1.26 -2.80 113.62 108.30 1c41 n SER 49 Ca 0.32 0.64 0.09 0.00 -0.26 0.00 0.00 58.87 59.66 1c41 n SER 49 Cb 1.05 -0.82 0.29 0.00 -0.26 0.00 0.00 64.21 64.47 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 -2.29 3.71 -4.18 4.04 3.02 0.30 -2.59 115.26 117.28 1c41 n ASN 50 Ca 0.03 -2.22 -0.36 0.00 -0.03 0.00 0.00 54.58 52.01 1c41 n ASN 50 Cb 0.31 -0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 38.87 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 -1.55 3.21 -0.07 2.41 1.01 -1.12 -1.13 121.20 123.96 1c41 s ILE 51 Ca 0.42 -1.48 -0.14 0.00 0.00 0.00 0.00 60.65 59.45 1c41 s ILE 51 Cb 0.25 -2.92 -0.05 0.00 0.01 0.00 0.00 42.46 39.75 1c41 s ILE 51 CO 0.23 -0.25 0.34 -0.69 0.00 0.00 0.00 174.94 174.58 1c41 s VAL 52 N 1.26 5.19 -0.19 2.92 1.01 -0.19 -5.01 120.40 125.40 1c41 s VAL 52 Ca -0.02 0.68 -0.04 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 0.06 -0.69 0.00 0.00 0.00 175.10 174.97 1c41 s VAL 53 N -0.48 0.28 0.31 2.92 1.01 -1.26 -0.25 120.40 122.93 1c41 s VAL 53 Ca 0.21 -0.42 0.11 0.00 0.00 0.00 0.00 61.98 61.87 1c41 s VAL 53 Cb -0.15 -0.86 -0.06 0.00 0.00 0.00 0.00 36.38 35.31 1c41 s VAL 53 CO 0.09 -0.26 -0.15 -1.10 0.00 0.00 0.00 175.10 173.68 1c41 s GLN 54 N 1.97 1.73 0.37 2.72 -0.21 -0.19 -5.00 119.66 121.05 1c41 s GLN 54 Ca 0.01 -1.84 0.05 0.00 0.02 0.00 0.00 55.36 53.60 1c41 s GLN 54 Cb -0.17 -1.71 -0.07 0.00 1.00 0.00 0.00 33.01 32.06 1c41 s GLN 54 CO -0.09 0.24 0.03 -1.54 -2.12 0.00 0.00 175.29 171.81 1c41 s SER 55 N -3.55 3.19 0.11 5.90 1.04 -1.26 -1.79 113.70 117.34 1c41 s SER 55 Ca 0.31 -1.38 -0.08 0.00 0.48 0.00 0.00 55.95 55.27 1c41 s SER 55 Cb -0.01 -0.23 -0.00 0.00 0.10 0.00 0.00 66.02 65.87 1c41 s SER 55 CO 0.15 -0.53 0.20 0.68 0.98 0.00 0.00 173.24 174.72 1c41 s VAL 56 N -2.98 0.13 0.04 5.02 -7.23 -0.55 -4.89 120.40 109.93 1c41 s VAL 56 Ca 0.35 -1.26 -0.28 0.00 -1.81 0.00 0.00 61.98 58.98 1c41 s VAL 56 Cb 0.09 -1.48 -0.16 0.00 0.56 0.00 0.00 36.38 35.40 1c41 s VAL 56 CO 0.17 -0.57 1.38 1.55 -0.31 0.00 0.00 175.10 177.31 1c41 h PRO 57 N 2.71 -0.98 -5.20 4.82 0.13 -1.93 -0.87 132.00 130.68 1c41 h PRO 57 Ca -0.33 0.07 -0.66 0.00 -0.87 0.00 0.00 66.00 64.20 1c41 h PRO 57 Cb 1.20 0.22 -0.13 0.00 0.13 0.00 0.00 31.00 32.43 1c41 h PRO 57 CO 0.55 -0.65 -0.52 0.20 -0.23 0.00 0.00 178.00 177.34 1c41 s GLY 58 N -1.83 2.93 0.43 1.56 0.00 -1.26 -0.97 107.32 108.18 1c41 s GLY 58 Ca -0.15 -0.63 0.11 0.00 0.00 0.00 0.00 44.72 44.06 1c41 s GLY 58 CO 0.45 -2.13 2.00 1.76 0.00 0.00 0.00 173.10 175.17 1c41 h SER 59 N 1.45 0.17 -0.55 1.64 0.02 -1.94 -2.32 113.55 112.01 1c41 h SER 59 Ca -0.43 -0.02 0.10 0.00 -0.84 0.00 0.00 61.79 60.60 1c41 h SER 59 Cb 1.30 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.77 1c41 h SER 59 CO 0.72 0.25 0.38 -0.25 -1.14 0.00 0.00 176.83 176.79 1c41 h TRP 60 N 0.18 0.33 0.00 3.45 2.91 -1.96 0.13 115.95 121.00 1c41 h TRP 60 Ca 0.04 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.07 1c41 h TRP 60 Cb 0.21 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 28.76 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 0.31 0.00 0.03 2.65 3.07 -1.83 -3.37 114.58 115.44 1c41 h GLU 61 Ca 0.26 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.13 1c41 h GLU 61 Cb 0.60 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.46 1c41 h GLU 61 CO -0.06 0.00 -0.47 -0.07 -1.40 0.00 0.00 179.01 177.01 1c41 h LEU 62 N 0.00 -1.45 -0.30 1.33 4.07 -0.80 0.11 115.31 118.27 1c41 h LEU 62 Ca 0.00 0.16 0.03 0.00 0.08 0.00 0.00 57.88 58.15 1c41 h LEU 62 Cb 0.77 0.55 -0.03 0.00 1.08 0.00 0.00 40.66 43.02 1c41 h LEU 62 CO 0.00 -0.47 0.10 1.55 -1.08 0.00 0.00 178.44 178.54 1c41 h PRO 63 N -0.62 0.23 -0.69 1.13 0.13 -1.73 0.97 132.00 131.42 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 0.65 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.69 1c41 h PRO 63 CO -0.30 0.15 0.38 0.97 -0.23 0.00 0.00 178.00 178.97 1c41 h ILE 64 N 0.23 1.21 -0.61 -3.56 6.09 -1.75 -0.44 117.51 118.69 1c41 h ILE 64 Ca 0.13 -0.54 -0.03 0.00 -1.37 0.00 0.00 64.86 63.05 1c41 h ILE 64 Cb 0.10 0.31 -0.03 0.00 0.47 0.00 0.00 36.82 37.68 1c41 h ILE 64 CO -0.13 0.24 0.25 0.00 -3.07 0.00 0.00 178.15 175.43 1c41 h ALA 65 N 1.19 0.80 -0.54 0.18 0.00 -0.44 -1.79 119.26 118.66 1c41 h ALA 65 Ca 0.24 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1c41 h ALA 65 Cb 0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1c41 h ALA 65 CO -0.04 0.41 0.02 0.28 0.00 0.00 0.00 179.25 179.92 1c41 h VAL 66 N 0.85 1.26 -0.63 0.00 2.07 -0.43 0.05 116.25 119.42 1c41 h VAL 66 Ca 0.21 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 66.67 1c41 h VAL 66 Cb 0.19 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1c41 h VAL 66 CO -0.02 0.38 0.40 -0.61 0.02 0.00 0.00 177.57 177.75 1c41 h GLN 67 N 0.81 0.78 -0.03 1.57 4.15 -0.85 -2.28 115.11 119.27 1c41 h GLN 67 Ca 0.15 -0.05 -0.22 0.00 0.77 0.00 0.00 58.65 59.31 1c41 h GLN 67 Cb 0.51 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.02 1c41 h GLN 67 CO 0.02 0.52 -0.90 0.00 -1.93 0.00 0.00 178.83 176.54 1c41 h ARG 68 N 0.80 0.47 0.42 1.69 2.47 -1.20 -1.86 114.38 117.18 1c41 h ARG 68 Ca 0.24 -0.47 -0.02 0.00 -1.26 0.00 0.00 59.98 58.47 1c41 h ARG 68 Cb -0.03 0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1c41 h ARG 68 CO -0.08 1.12 -0.22 1.25 0.56 0.00 0.00 179.97 182.59 1c41 h LEU 69 N 0.28 -0.54 -0.34 3.04 6.46 -0.81 0.13 115.31 123.52 1c41 h LEU 69 Ca -0.07 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.76 1c41 h LEU 69 Cb 1.52 0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 41.56 1c41 h LEU 69 CO 0.16 -0.37 0.09 0.22 -0.62 0.00 0.00 178.44 177.92 1c41 h TYR 70 N -0.60 0.16 -0.74 1.25 3.20 -1.47 -1.30 116.97 117.48 1c41 h TYR 70 Ca -0.05 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.00 1c41 h TYR 70 Cb 0.47 -0.02 -0.12 0.00 1.54 0.00 0.00 36.73 38.60 1c41 h TYR 70 CO -0.06 0.05 0.11 1.03 -1.64 0.00 0.00 178.16 177.64 1c41 h SER 71 N 0.22 -0.14 0.27 -2.11 0.87 -0.87 -1.09 113.55 110.70 1c41 h SER 71 Ca 0.16 0.17 -0.01 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 62.38 1c41 h SER 71 CO -0.19 -0.10 -0.13 0.00 -0.53 0.00 0.00 176.83 175.88 1c41 h ALA 72 N 1.65 -0.36 -0.77 6.23 0.00 0.32 -2.42 119.26 123.91 1c41 h ALA 72 Ca 0.41 -0.12 0.22 0.00 0.00 0.00 0.00 54.91 55.43 1c41 h ALA 72 Cb 0.73 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1c41 h ALA 72 CO -0.57 -0.65 0.71 0.66 0.00 0.00 0.00 179.25 179.40 1c41 h SER 73 N -0.47 0.00 -0.11 0.00 4.64 -0.29 0.16 113.55 117.48 1c41 h SER 73 Ca -0.04 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.14 1c41 h SER 73 Cb 0.35 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1c41 h SER 73 CO 0.06 0.00 -0.49 1.56 -0.87 0.00 0.00 176.83 177.09 1c41 h GLN 74 N 0.00 0.52 -0.09 4.77 4.20 -0.88 -3.07 115.11 120.55 1c41 h GLN 74 Ca 0.36 -0.41 0.03 0.00 0.06 0.00 0.00 58.65 58.69 1c41 h GLN 74 Cb 1.78 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.64 1c41 h GLN 74 CO -0.00 1.04 0.15 -0.07 -0.67 0.00 0.00 178.83 179.28 1c41 h LEU 75 N 0.11 0.00 0.00 1.46 3.38 -0.55 -3.46 115.31 116.25 1c41 h LEU 75 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1c41 h LEU 75 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1c41 h LEU 75 CO 0.10 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.63 1c41 n GLN 76 N -3.52 0.00 -1.02 1.13 6.02 -1.15 -5.13 117.38 113.71 1c41 n GLN 76 Ca -0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.58 1c41 n GLN 76 Cb 0.24 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.44 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 -1.07 -4.79 113.62 112.16 1c41 n SER 107 Ca 0.00 0.68 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 2.57 -0.22 0.00 6.66 -2.24 -1.26 -5.04 114.28 114.75 1c41 n THR 108 Ca 0.20 0.15 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 1c41 n THR 108 Cb -0.03 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 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 -2.77 1.28 3.66 3.38 0.00 -1.26 -4.98 105.19 104.49 1c41 n GLY 109 Ca -0.01 -1.37 -0.44 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 2.58 1.90 -1.63 1.61 -0.04 -1.18 -4.85 135.00 133.39 1c41 n PRO 110 Ca 0.00 0.67 -0.37 0.00 -0.04 0.00 0.00 63.50 63.76 1c41 n PRO 110 Cb 0.00 -2.24 0.06 0.00 -0.04 0.00 0.00 33.50 31.28 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 0.98 0.95 0.20 0.54 3.72 -1.26 -4.88 117.46 117.71 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 -2.15 -0.02 0.00 -0.94 0.00 0.00 39.48 36.70 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 -0.99 0.61 -3.51 4.37 8.00 0.06 -4.95 116.55 120.14 1c41 n ASP 112 Ca 0.14 0.13 -0.16 0.00 0.71 0.00 0.00 54.79 55.62 1c41 n ASP 112 Cb 0.48 0.84 -0.05 0.00 -0.02 0.00 0.00 41.12 42.37 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 -1.77 0.12 2.24 0.00 -1.25 -4.31 121.76 113.44 1c41 s ALA 113 Ca -0.01 1.21 0.07 0.00 0.00 0.00 0.00 51.96 53.24 1c41 s ALA 113 Cb 0.12 0.06 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 1c41 s ALA 113 CO 0.81 -0.44 -0.17 -0.51 0.00 0.00 0.00 175.76 175.46 1c41 s LEU 114 N -1.48 2.37 -0.05 0.00 1.43 0.03 -2.21 118.68 118.77 1c41 s LEU 114 Ca -0.07 -0.77 0.01 0.00 -1.03 0.00 0.00 54.13 52.27 1c41 s LEU 114 Cb -0.00 -0.71 0.02 0.00 0.03 0.00 0.00 46.19 45.53 1c41 s LEU 114 CO 0.04 -0.05 -0.07 -0.63 0.23 0.00 0.00 176.35 175.87 1c41 s ILE 115 N -1.77 0.75 -0.22 -0.59 1.01 -0.25 0.37 121.20 120.50 1c41 s ILE 115 Ca 0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.45 1c41 s ILE 115 Cb -0.07 -0.74 -0.01 0.00 0.01 0.00 0.00 42.46 41.66 1c41 s ILE 115 CO 0.04 0.27 -0.04 0.00 0.00 0.00 0.00 174.94 175.22 1c41 s ALA 116 N 0.84 2.84 -0.16 9.38 0.00 -0.65 -1.52 121.76 132.49 1c41 s ALA 116 Ca -0.12 -1.16 -0.00 0.00 0.00 0.00 0.00 51.96 50.68 1c41 s ALA 116 Cb -0.15 -1.72 -0.00 0.00 0.00 0.00 0.00 23.12 21.25 1c41 s ALA 116 CO 0.01 -0.42 -0.14 0.42 0.00 0.00 0.00 175.76 175.64 1c41 s ILE 117 N 1.46 2.73 0.12 0.00 1.01 -0.54 -0.11 121.20 125.87 1c41 s ILE 117 Ca 0.05 -0.74 -0.13 0.00 0.00 0.00 0.00 60.65 59.83 1c41 s ILE 117 Cb -0.14 -2.16 0.02 0.00 0.01 0.00 0.00 42.46 40.18 1c41 s ILE 117 CO -0.03 0.51 0.33 -0.83 0.00 0.00 0.00 174.94 174.92 1c41 s GLY 118 N 0.91 -0.04 -0.25 6.18 0.00 -0.67 -1.05 107.32 112.40 1c41 s GLY 118 Ca -0.03 -0.37 -0.03 0.00 0.00 0.00 0.00 44.72 44.29 1c41 s GLY 118 CO -0.01 -0.54 0.10 0.14 0.00 0.00 0.00 173.10 172.78 1c41 s VAL 119 N -3.85 0.26 -0.15 1.40 1.01 -1.26 -0.70 120.40 117.10 1c41 s VAL 119 Ca 0.06 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.20 1c41 s VAL 119 Cb 0.03 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1c41 s VAL 119 CO -0.09 -0.53 0.16 -0.76 0.00 0.00 0.00 175.10 173.89 1c41 s LEU 120 N 1.95 4.31 -0.06 3.92 2.01 0.13 -4.80 118.68 126.15 1c41 s LEU 120 Ca 0.06 0.40 0.02 0.00 0.01 0.00 0.00 54.13 54.62 1c41 s LEU 120 Cb -0.16 -2.13 0.02 0.00 0.01 0.00 0.00 46.19 43.92 1c41 s LEU 120 CO -0.23 0.29 -0.09 -0.63 1.01 0.00 0.00 176.35 176.69 1c41 s ILE 121 N -0.34 0.90 0.11 -0.59 1.01 -1.26 -1.28 121.20 119.75 1c41 s ILE 121 Ca 0.13 -0.34 -0.36 0.00 0.00 0.00 0.00 60.65 60.08 1c41 s ILE 121 Cb -0.12 -0.85 -0.16 0.00 0.01 0.00 0.00 42.46 41.34 1c41 s ILE 121 CO 0.02 0.30 1.37 1.17 0.00 0.00 0.00 174.94 177.80 1c41 n LYS 122 N 3.88 1.38 0.00 2.79 0.00 -0.82 -4.86 118.16 120.53 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 -2.15 0.00 0.00 0.00 0.00 0.00 35.03 33.39 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 2.64 2.29 0.07 3.14 0.00 -1.26 -4.94 105.19 107.12 1c41 n GLY 123 Ca 0.18 -1.82 0.09 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.72 1.61 1.02 -1.26 -4.96 120.64 114.96 1c41 n GLU 124 Ca 0.00 -0.02 -0.14 0.00 -0.02 0.00 0.00 57.16 56.98 1c41 n GLU 124 Cb 0.00 -1.67 0.01 0.00 -0.02 0.00 0.00 31.44 29.75 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 -2.52 0.00 1.64 2.62 -2.24 -1.26 -5.01 114.28 107.51 1c41 n THR 125 Ca -0.04 -1.23 0.08 0.00 -2.27 0.00 0.00 64.05 60.59 1c41 n THR 125 Cb 0.62 -0.31 0.37 0.00 -2.10 0.00 0.00 70.33 68.92 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 -1.31 1.31 -0.19 -0.78 2.81 -1.26 -4.07 117.12 113.63 1c41 n MET 126 Ca 0.00 -0.48 0.00 0.00 -1.81 0.00 0.00 57.70 55.42 1c41 n MET 126 Cb 0.36 -1.28 0.09 0.00 -0.71 0.00 0.00 33.22 31.68 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 0.91 0.05 -0.23 2.03 6.17 -1.97 -2.09 115.15 120.02 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 0.20 0.07 -0.07 0.00 2.52 0.00 0.00 27.41 30.12 1c41 h HIS 127 CO 0.06 -0.11 -0.42 0.35 0.71 0.00 0.00 177.93 178.53 1c41 h PHE 128 N 0.17 -1.19 -0.62 5.26 3.57 -1.89 -2.00 116.94 120.23 1c41 h PHE 128 Ca 0.30 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.80 1c41 h PHE 128 Cb 0.47 0.56 -0.03 0.00 2.79 0.00 0.00 35.95 39.74 1c41 h PHE 128 CO -0.31 -0.46 0.15 1.05 -2.23 0.00 0.00 178.31 176.51 1c41 h GLU 129 N -0.43 0.97 0.00 1.11 9.09 -1.72 -1.15 114.58 122.45 1c41 h GLU 129 Ca 0.10 -0.21 -0.09 0.00 0.05 0.00 0.00 59.36 59.21 1c41 h GLU 129 Cb 0.61 -0.14 -0.01 0.00 -1.65 0.00 0.00 28.75 27.56 1c41 h GLU 129 CO -0.46 0.86 -0.42 1.88 0.05 0.00 0.00 179.01 180.93 1c41 h TYR 130 N 0.92 0.00 0.19 2.06 0.05 -1.11 -2.17 116.97 116.92 1c41 h TYR 130 Ca 0.20 0.00 -0.30 0.00 0.05 0.00 0.00 58.73 58.67 1c41 h TYR 130 Cb 0.33 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.09 1c41 h TYR 130 CO 0.02 0.42 -1.43 0.82 -1.05 0.00 0.00 178.16 176.94 1c41 h ILE 131 N 0.00 1.18 -0.31 -2.88 2.04 -1.23 -3.10 117.51 113.22 1c41 h ILE 131 Ca -0.00 -2.57 0.01 0.00 1.00 0.00 0.00 64.86 63.30 1c41 h ILE 131 Cb 0.86 2.94 -0.02 0.00 -0.74 0.00 0.00 36.82 39.87 1c41 h ILE 131 CO 0.05 0.79 0.19 0.00 0.00 0.00 0.00 178.15 179.19 1c41 h ALA 132 N 0.09 0.39 -0.69 1.87 0.00 -1.16 0.44 119.26 120.20 1c41 h ALA 132 Ca -0.27 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1c41 h ALA 132 Cb 1.99 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.64 1c41 h ALA 132 CO 0.19 -0.16 0.20 0.22 0.00 0.00 0.00 179.25 179.70 1c41 h ASP 133 N 0.40 1.01 0.01 0.00 3.58 -1.52 -0.53 116.42 119.36 1c41 h ASP 133 Ca 0.12 -0.19 -0.26 0.00 0.42 0.00 0.00 57.03 57.11 1c41 h ASP 133 Cb -0.03 -0.27 0.02 0.00 1.72 0.00 0.00 39.33 40.78 1c41 h ASP 133 CO -0.04 0.95 -1.03 0.28 -2.88 0.00 0.00 179.24 176.53 1c41 h SER 134 N 1.04 0.89 -0.63 2.28 0.02 -1.42 -2.22 113.55 113.51 1c41 h SER 134 Ca 0.22 -0.74 -0.07 0.00 -0.84 0.00 0.00 61.79 60.36 1c41 h SER 134 Cb 0.32 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1c41 h SER 134 CO -0.00 1.52 0.13 0.58 -1.14 0.00 0.00 176.83 177.92 1c41 h VAL 135 N 0.36 1.26 0.58 2.27 2.07 -0.86 0.42 116.25 122.34 1c41 h VAL 135 Ca -0.13 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 1c41 h VAL 135 Cb 1.69 0.62 0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1c41 h VAL 135 CO 0.20 0.37 -0.28 0.28 0.02 0.00 0.00 177.57 178.16 1c41 h SER 136 N 0.99 -0.66 -0.51 0.57 0.02 -1.08 -0.28 113.55 112.60 1c41 h SER 136 Ca 0.20 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 1c41 h SER 136 Cb 0.39 0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 1c41 h SER 136 CO 0.01 -0.45 0.17 0.45 -1.14 0.00 0.00 176.83 175.87 1c41 h HIS 137 N -0.81 0.85 -0.26 3.45 3.86 -1.31 -1.43 115.15 119.49 1c41 h HIS 137 Ca -0.08 -0.06 0.04 0.00 -1.16 0.00 0.00 60.37 59.11 1c41 h HIS 137 Cb 0.61 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.79 1c41 h HIS 137 CO -0.03 0.69 0.04 0.78 0.86 0.00 0.00 177.93 180.26 1c41 h GLY 138 N 0.96 0.29 1.00 2.45 0.00 0.12 0.89 103.07 108.78 1c41 h GLY 138 Ca 0.19 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.43 1c41 h GLY 138 CO -0.01 -0.02 -0.03 1.41 0.00 0.00 0.00 176.54 177.88 1c41 h LEU 139 N 0.13 0.84 -1.40 3.11 3.38 -0.76 -1.33 115.31 119.27 1c41 h LEU 139 Ca 0.12 -0.32 0.06 0.00 0.09 0.00 0.00 57.88 57.83 1c41 h LEU 139 Cb 0.14 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1c41 h LEU 139 CO -0.18 0.96 0.46 -0.03 0.09 0.00 0.00 178.44 179.74 1c41 h MET 140 N 0.70 0.71 0.18 1.13 4.05 -0.82 -1.59 114.93 119.29 1c41 h MET 140 Ca 0.13 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 1c41 h MET 140 Cb 0.55 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.19 1c41 h MET 140 CO 0.03 0.47 -0.08 -0.09 0.23 0.00 0.00 176.91 177.47 1c41 h ARG 141 N 0.74 -0.23 -0.97 0.39 2.43 -0.31 -2.38 114.38 114.05 1c41 h ARG 141 Ca 0.30 0.02 0.21 0.00 -0.81 0.00 0.00 59.98 59.69 1c41 h ARG 141 Cb 0.24 0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 29.75 1c41 h ARG 141 CO -0.10 0.17 0.62 0.28 -1.51 0.00 0.00 179.97 179.44 1c41 h VAL 142 N -0.73 0.67 0.90 0.20 2.07 -0.96 0.61 116.25 119.01 1c41 h VAL 142 Ca -0.02 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 1c41 h VAL 142 Cb 0.51 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1c41 h VAL 142 CO 0.04 0.10 -0.43 -0.61 0.02 0.00 0.00 177.57 176.69 1c41 h GLN 143 N 0.55 -1.17 -0.34 1.57 4.15 -1.24 0.32 115.11 118.96 1c41 h GLN 143 Ca 0.53 0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.94 1c41 h GLN 143 Cb 1.12 0.27 -0.02 0.00 0.21 0.00 0.00 27.48 29.05 1c41 h GLN 143 CO -0.27 -0.77 -0.18 -0.07 -1.93 0.00 0.00 178.83 175.60 1c41 h LEU 144 N -1.26 0.61 0.45 -2.39 3.38 -0.73 0.28 115.31 115.66 1c41 h LEU 144 Ca -0.12 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1c41 h LEU 144 Cb 0.93 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1c41 h LEU 144 CO 0.20 0.80 -0.22 0.44 0.09 0.00 0.00 178.44 179.75 1c41 h ASP 145 N 0.55 -0.52 1.17 -0.43 5.19 0.21 -3.19 116.42 119.41 1c41 h ASP 145 Ca 0.09 -0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 56.39 1c41 h ASP 145 Cb 0.62 0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.25 1c41 h ASP 145 CO 0.04 -0.28 -0.31 0.00 -3.12 0.00 0.00 179.24 175.57 1c41 h THR 146 N -0.72 0.65 -0.13 0.35 1.03 -0.88 -3.47 112.91 109.73 1c41 h THR 146 Ca -0.06 -1.50 -0.06 0.00 -0.01 0.00 0.00 66.41 64.78 1c41 h THR 146 Cb 0.52 2.01 -0.02 0.00 -1.07 0.00 0.00 68.15 69.59 1c41 h THR 146 CO 0.10 0.31 -0.05 0.61 -0.01 0.00 0.00 175.52 176.48 1c41 n GLY 147 N 0.57 0.57 3.26 2.99 0.00 0.95 -5.00 105.19 108.53 1c41 n GLY 147 Ca 0.01 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.94 2.29 0.27 1.61 1.01 -1.09 -5.03 120.40 117.52 1c41 s VAL 148 Ca 0.00 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 60.73 1c41 s VAL 148 Cb 0.00 -1.89 -0.12 0.00 0.00 0.00 0.00 36.38 34.37 1c41 s VAL 148 CO 0.00 0.55 1.62 -2.65 0.00 0.00 0.00 175.10 174.63 1c41 n PRO 149 N 3.43 2.71 -3.99 2.72 -0.02 -1.26 -4.46 135.00 134.14 1c41 n PRO 149 Ca -0.19 0.97 -0.31 0.00 -2.02 0.00 0.00 63.50 61.95 1c41 n PRO 149 Cb 0.53 -2.76 -0.15 0.00 -0.02 0.00 0.00 33.50 31.09 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 0.26 1.89 0.11 -1.45 1.01 -1.26 -0.79 120.40 120.17 1c41 s VAL 150 Ca 0.67 -1.70 -0.31 0.00 0.00 0.00 0.00 61.98 60.64 1c41 s VAL 150 Cb -0.50 -2.20 -0.09 0.00 0.00 0.00 0.00 36.38 33.60 1c41 s VAL 150 CO 0.45 -0.27 1.53 -0.63 0.00 0.00 0.00 175.10 176.18 1c41 s ILE 151 N 1.18 3.02 -1.14 2.22 -1.09 0.16 -4.88 121.20 120.67 1c41 s ILE 151 Ca -0.01 0.64 -0.21 0.00 -2.23 0.00 0.00 60.65 58.85 1c41 s ILE 151 Cb -0.19 -3.41 0.06 0.00 -1.58 0.00 0.00 42.46 37.34 1c41 s ILE 151 CO -0.08 0.03 1.57 0.12 -1.23 0.00 0.00 174.94 175.35 1c41 s PHE 152 N 1.72 2.67 -0.70 3.97 5.36 -1.26 -1.63 117.98 128.10 1c41 s PHE 152 Ca 0.69 -1.22 -0.02 0.00 -0.96 0.00 0.00 56.93 55.43 1c41 s PHE 152 Cb -0.40 -4.71 0.43 0.00 -0.34 0.00 0.00 43.02 38.00 1c41 s PHE 152 CO 0.31 -1.86 2.02 0.41 -1.46 0.00 0.00 175.22 174.63 1c41 n GLY 153 N 6.16 5.81 3.47 13.12 0.00 0.84 -4.93 105.19 129.66 1c41 n GLY 153 Ca 0.40 -2.36 -0.35 0.00 0.00 0.00 0.00 46.02 43.71 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 -4.89 4.07 -0.14 1.61 1.01 -1.23 -1.67 120.40 119.17 1c41 s VAL 154 Ca 0.62 -0.28 -0.14 0.00 0.00 0.00 0.00 61.98 62.18 1c41 s VAL 154 Cb 0.49 -2.84 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 1c41 s VAL 154 CO -0.11 0.43 0.31 -0.76 0.00 0.00 0.00 175.10 174.98 1c41 s LEU 155 N 0.89 4.28 -0.66 3.92 1.43 0.12 -4.92 118.68 123.75 1c41 s LEU 155 Ca 0.01 0.58 0.04 0.00 -1.03 0.00 0.00 54.13 53.73 1c41 s LEU 155 Cb -0.14 -2.40 0.16 0.00 0.03 0.00 0.00 46.19 43.84 1c41 s LEU 155 CO 0.02 0.13 0.44 0.42 0.23 0.00 0.00 176.35 177.59 1c41 s THR 156 N 0.23 2.91 0.33 5.49 -4.23 -1.26 0.21 115.64 119.32 1c41 s THR 156 Ca 0.18 -3.95 0.07 0.00 -1.18 0.00 0.00 61.69 56.81 1c41 s THR 156 Cb -0.13 -2.93 -0.01 0.00 1.34 0.00 0.00 72.50 70.76 1c41 s THR 156 CO 0.05 -0.95 0.42 -0.69 -0.54 0.00 0.00 174.62 172.92 1c41 s VAL 157 N -1.08 3.98 -0.03 2.29 1.01 -0.40 -5.02 120.40 121.15 1c41 s VAL 157 Ca 0.22 -1.09 0.13 0.00 0.00 0.00 0.00 61.98 61.25 1c41 s VAL 157 Cb -0.11 -3.37 -0.21 0.00 0.00 0.00 0.00 36.38 32.69 1c41 s VAL 157 CO -0.11 -0.17 0.27 0.18 0.00 0.00 0.00 175.10 175.27 1c41 n LEU 158 N -1.57 0.00 -3.93 3.92 4.77 -1.26 -1.95 117.00 116.99 1c41 n LEU 158 Ca -0.01 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.87 1c41 n LEU 158 Cb 0.58 0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.61 1c41 n LEU 158 CO 0.42 0.03 -0.26 0.42 -1.33 0.00 0.00 177.39 176.68 1c41 s THR 159 N -2.87 0.10 0.22 -5.08 -4.23 -1.26 -4.46 115.64 98.06 1c41 s THR 159 Ca -0.05 -0.87 -0.11 0.00 -1.18 0.00 0.00 61.69 59.48 1c41 s THR 159 Cb 0.08 -0.45 0.22 0.00 1.34 0.00 0.00 72.50 73.69 1c41 s THR 159 CO 0.56 -0.48 1.65 0.44 -0.54 0.00 0.00 174.62 176.25 1c41 h ASP 160 N 4.31 -0.36 -0.98 3.99 5.19 -1.98 -0.79 116.42 125.81 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 0.43 -0.15 0.62 0.44 -3.12 0.00 0.00 179.24 177.46 1c41 h ASP 161 N 0.09 0.88 -0.74 6.45 3.32 -1.99 -0.43 116.42 123.99 1c41 h ASP 161 Ca 0.33 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 1c41 h ASP 161 Cb 0.54 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.92 1c41 h ASP 161 CO -0.58 0.47 0.43 1.56 -1.72 0.00 0.00 179.24 179.41 1c41 h GLN 162 N 0.95 1.02 0.27 3.56 4.20 -1.56 0.23 115.11 123.78 1c41 h GLN 162 Ca 0.48 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 59.08 1c41 h GLN 162 Cb 0.50 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 1c41 h GLN 162 CO -0.24 0.74 -0.15 0.00 -0.67 0.00 0.00 178.83 178.50 1c41 h ALA 163 N 1.23 -0.39 -0.48 3.87 0.00 -0.91 -1.46 119.26 121.12 1c41 h ALA 163 Ca 0.27 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.17 1c41 h ALA 163 Cb -0.01 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1c41 h ALA 163 CO -0.05 -0.72 0.12 0.87 0.00 0.00 0.00 179.25 179.47 1c41 h LYS 164 N -0.40 0.26 -0.39 0.00 1.57 -0.77 -0.59 116.57 116.24 1c41 h LYS 164 Ca -0.03 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1c41 h LYS 164 Cb 0.32 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 1c41 h LYS 164 CO 0.04 0.17 0.14 0.00 -0.57 0.00 0.00 179.45 179.24 1c41 h ALA 165 N 1.35 0.46 0.00 3.86 0.00 -0.29 -0.74 119.26 123.91 1c41 h ALA 165 Ca 0.24 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1c41 h ALA 165 Cb 0.29 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1c41 h ALA 165 CO -0.28 -0.25 0.00 0.00 0.00 0.00 0.00 179.25 178.71 1c41 h ARG 166 N 0.30 0.00 -0.26 0.00 -0.00 -0.45 -2.58 114.38 111.38 1c41 h ARG 166 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.66 1c41 h ARG 166 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.13 1c41 h ARG 166 CO -0.18 0.00 0.00 0.00 0.00 0.00 0.00 179.97 179.79 1c41 n ALA 167 N -1.80 2.44 -0.65 0.04 0.00 -0.31 -0.71 120.51 119.52 1c41 n ALA 167 Ca 0.02 -0.87 0.00 0.00 0.00 0.00 0.00 53.44 52.59 1c41 n ALA 167 Cb 0.23 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 1.44 1.44 0.14 0.00 0.00 -0.83 -4.48 105.19 102.91 1c41 n GLY 168 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 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 0.75 -4.17 1.61 2.07 -1.54 -3.41 116.25 111.56 1c41 h VAL 169 Ca 0.00 -0.03 -0.51 0.00 0.82 0.00 0.00 66.70 66.98 1c41 h VAL 169 Cb 0.00 0.67 0.10 0.00 -1.52 0.00 0.00 31.29 30.53 1c41 h VAL 169 CO 0.00 0.01 0.39 -0.63 0.02 0.00 0.00 177.57 177.37 1c41 s ILE 170 N -6.19 3.13 0.14 4.57 1.01 -1.23 -4.92 121.20 117.71 1c41 s ILE 170 Ca -0.13 0.58 -0.34 0.00 0.00 0.00 0.00 60.65 60.75 1c41 s ILE 170 Cb 0.12 -3.12 -0.15 0.00 0.01 0.00 0.00 42.46 39.33 1c41 s ILE 170 CO 0.70 -0.27 1.52 -0.62 0.00 0.00 0.00 174.94 176.27 1c41 n GLU 171 N -2.13 1.92 -4.03 2.79 -0.58 -1.26 -1.95 120.64 115.40 1c41 n GLU 171 Ca 0.11 0.69 -0.30 0.00 -0.42 0.00 0.00 57.16 57.24 1c41 n GLU 171 Cb 0.51 -2.43 -0.01 0.00 -0.57 0.00 0.00 31.44 28.95 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 3.20 -0.38 3.54 0.62 0.00 -1.26 -4.96 105.19 105.94 1c41 n GLY 172 Ca 0.17 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.71 4.24 -0.35 1.61 1.04 -0.82 -5.09 113.70 110.61 1c41 s SER 173 Ca 0.44 -0.33 -0.26 0.00 0.48 0.00 0.00 55.95 56.28 1c41 s SER 173 Cb -0.23 -0.82 0.01 0.00 0.10 0.00 0.00 66.02 65.07 1c41 s SER 173 CO 0.89 0.24 0.94 -2.28 0.98 0.00 0.00 173.24 174.00 1c41 s HIS 174 N -1.04 3.11 -0.24 5.02 2.46 -1.25 -4.29 115.29 119.05 1c41 s HIS 174 Ca 0.17 0.86 -0.29 0.00 0.47 0.00 0.00 55.06 56.27 1c41 s HIS 174 Cb -0.11 -3.60 -0.02 0.00 -0.13 0.00 0.00 32.58 28.73 1c41 s HIS 174 CO 0.09 -0.78 1.50 1.21 -2.47 0.00 0.00 174.74 174.28 1c41 s ASN 175 N 1.80 6.51 0.58 9.88 3.84 -1.26 -3.84 114.94 132.44 1c41 s ASN 175 Ca 0.39 1.50 0.37 0.00 0.21 0.00 0.00 52.86 55.33 1c41 s ASN 175 Cb -0.12 -2.53 1.75 0.00 -0.55 0.00 0.00 41.25 39.80 1c41 s ASN 175 CO 0.17 -1.17 2.12 0.45 -2.79 0.00 0.00 177.10 175.88 1c41 h HIS 176 N 10.12 0.00 -0.87 0.43 3.86 -1.22 -2.86 115.15 124.61 1c41 h HIS 176 Ca -0.31 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.03 1c41 h HIS 176 Cb 1.13 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.52 1c41 h HIS 176 CO 0.90 0.00 0.48 0.78 0.86 0.00 0.00 177.93 180.95 1c41 h GLY 177 N 1.25 1.41 0.44 2.45 0.00 -1.79 0.89 103.07 107.72 1c41 h GLY 177 Ca 0.00 -0.30 0.10 0.00 0.00 0.00 0.00 47.33 47.13 1c41 h GLY 177 CO 0.00 0.03 0.34 0.83 0.00 0.00 0.00 176.54 177.73 1c41 h GLU 178 N 0.72 0.55 -0.53 4.80 5.08 -1.60 -0.47 114.58 123.13 1c41 h GLU 178 Ca 0.46 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.79 1c41 h GLU 178 Cb 0.58 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1c41 h GLU 178 CO -0.32 0.37 0.35 -0.44 -1.00 0.00 0.00 179.01 177.96 1c41 h ASP 179 N 0.57 0.60 -0.51 1.42 3.32 -1.02 -1.73 116.42 119.08 1c41 h ASP 179 Ca 0.35 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.34 1c41 h ASP 179 Cb 0.39 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1c41 h ASP 179 CO -0.28 0.44 0.15 -0.50 -1.72 0.00 0.00 179.24 177.33 1c41 h TRP 180 N 0.71 0.82 -0.18 4.55 6.55 -0.37 0.13 115.95 128.16 1c41 h TRP 180 Ca 0.19 -0.08 -0.00 0.00 0.95 0.00 0.00 58.89 59.94 1c41 h TRP 180 Cb -0.08 -0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 27.97 1c41 h TRP 180 CO -0.04 0.71 0.09 0.78 -1.05 0.00 0.00 178.44 178.94 1c41 h GLY 181 N 0.69 0.27 0.47 1.49 0.00 -1.02 0.17 103.07 105.14 1c41 h GLY 181 Ca 0.16 -0.13 0.08 0.00 0.00 0.00 0.00 47.33 47.44 1c41 h GLY 181 CO -0.00 0.12 0.18 -2.00 0.00 0.00 0.00 176.54 174.84 1c41 h LEU 182 N 0.18 0.17 -0.74 3.11 5.85 -1.07 -1.74 115.31 121.07 1c41 h LEU 182 Ca 0.06 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.76 1c41 h LEU 182 Cb 0.09 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1c41 h LEU 182 CO -0.01 0.12 -0.04 0.00 -0.34 0.00 0.00 178.44 178.17 1c41 h ALA 183 N 1.36 0.94 -0.58 1.25 0.00 -0.38 -2.53 119.26 119.32 1c41 h ALA 183 Ca 0.26 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1c41 h ALA 183 Cb 0.29 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1c41 h ALA 183 CO -0.27 0.63 0.29 0.00 0.00 0.00 0.00 179.25 179.90 1c41 h ALA 184 N 1.10 0.75 0.28 0.00 0.00 0.20 -0.10 119.26 121.49 1c41 h ALA 184 Ca 0.15 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1c41 h ALA 184 Cb 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1c41 h ALA 184 CO 0.03 -0.07 -0.14 0.28 0.00 0.00 0.00 179.25 179.36 1c41 h VAL 185 N 0.54 0.76 -0.07 0.00 2.07 -1.26 0.55 116.25 118.83 1c41 h VAL 185 Ca 0.26 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1c41 h VAL 185 Cb 0.20 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 1c41 h VAL 185 CO -0.19 0.07 -0.27 -0.08 0.02 0.00 0.00 177.57 177.12 1c41 h GLU 186 N -0.55 -0.36 -0.60 1.57 4.81 -1.10 -0.30 114.58 118.04 1c41 h GLU 186 Ca -0.04 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1c41 h GLU 186 Cb 0.41 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1c41 h GLU 186 CO 0.06 -0.24 0.31 0.52 -0.73 0.00 0.00 179.01 178.93 1c41 h MET 187 N -0.37 0.84 -0.23 1.92 2.86 -1.00 0.15 114.93 119.10 1c41 h MET 187 Ca 0.08 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1c41 h MET 187 Cb 0.49 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1c41 h MET 187 CO -0.29 0.64 0.14 0.78 1.06 0.00 0.00 176.91 179.24 1c41 h GLY 188 N 0.92 0.34 1.00 8.32 0.00 0.01 0.35 103.07 114.01 1c41 h GLY 188 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1c41 h GLY 188 CO -0.03 0.14 0.09 -2.08 0.00 0.00 0.00 176.54 174.66 1c41 h VAL 189 N 0.28 1.03 -0.67 4.60 2.07 -0.61 -2.40 116.25 120.55 1c41 h VAL 189 Ca 0.08 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1c41 h VAL 189 Cb 0.03 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1c41 h VAL 189 CO -0.02 0.03 0.44 0.03 0.02 0.00 0.00 177.57 178.07 1c41 h ARG 190 N 0.18 0.89 -0.50 1.57 3.08 -0.66 -2.49 114.38 116.46 1c41 h ARG 190 Ca 0.05 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.10 1c41 h ARG 190 Cb -0.02 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 29.78 1c41 h ARG 190 CO -0.01 0.60 0.19 -0.09 -1.07 0.00 0.00 179.97 179.59 1c41 h ARG 191 N 0.91 0.37 -0.12 0.04 2.43 -0.06 -0.74 114.38 117.21 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 -0.09 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.33 1c41 h ARG 191 CO -0.05 0.24 -0.16 0.00 -1.51 0.00 0.00 179.97 178.50 1c41 h ARG 192 N 0.38 -0.19 -0.59 0.20 3.08 -1.01 0.18 114.38 116.43 1c41 h ARG 192 Ca 0.24 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.34 1c41 h ARG 192 Cb 0.23 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.28 1c41 h ARG 192 CO -0.23 -0.13 0.34 -0.44 -1.07 0.00 0.00 179.97 178.45 1c41 h ASP 193 N -0.20 0.53 -0.60 7.04 3.32 -1.03 0.42 116.42 125.90 1c41 h ASP 193 Ca 0.09 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1c41 h ASP 193 Cb 0.33 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1c41 h ASP 193 CO -0.23 0.37 0.37 -0.50 -1.72 0.00 0.00 179.24 177.52 1c41 h TRP 194 N 0.66 0.79 0.00 4.55 6.55 -0.67 0.58 115.95 128.40 1c41 h TRP 194 Ca 0.25 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 60.09 1c41 h TRP 194 Cb 0.08 -0.26 -0.00 0.00 -0.86 0.00 0.00 29.16 28.12 1c41 h TRP 194 CO -0.07 0.53 -0.01 0.00 -1.05 0.00 0.00 178.44 177.84 1c41 h ALA 195 N 1.19 1.42 -0.21 1.49 0.00 0.67 0.32 119.26 124.13 1c41 h ALA 195 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1c41 h ALA 195 Cb -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1c41 h ALA 195 CO -0.04 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.22 1c41 n ALA 196 N -2.28 2.50 -1.08 0.00 0.00 0.05 -4.90 120.51 114.80 1c41 n ALA 196 Ca -0.03 -0.57 -0.03 0.00 0.00 0.00 0.00 53.44 52.81 1c41 n ALA 196 Cb 0.09 -1.05 -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 1.14 0.53 3.76 0.00 0.00 0.11 -5.00 105.19 105.74 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 -1.38 4.76 0.00 1.61 1.02 -0.35 -5.00 119.74 120.39 1c41 s LYS 198 Ca 0.00 1.38 0.00 0.00 0.02 0.00 0.00 55.97 57.37 1c41 s LYS 198 Cb 0.00 -3.24 0.00 0.00 -0.52 0.00 0.00 37.83 34.07 1c41 s LYS 198 CO 0.00 0.52 0.21 0.25 -0.92 0.00 0.00 175.35 175.40