#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 2.15 -0.24 1.61 0.04 -1.26 -5.10 135.00 132.20 1c41 s PRO 6 Ca 0.00 -1.05 -0.07 0.00 0.04 0.00 0.00 61.00 59.92 1c41 s PRO 6 Cb 0.00 -2.45 -0.03 0.00 0.04 0.00 0.00 34.50 32.06 1c41 s PRO 6 CO 0.00 -1.03 0.06 0.95 0.04 0.00 0.00 177.00 177.01 1c41 s THR 7 N -2.90 4.26 0.49 1.26 -4.23 -1.26 -5.09 115.64 108.18 1c41 s THR 7 Ca 0.62 -0.19 -0.24 0.00 -1.18 0.00 0.00 61.69 60.70 1c41 s THR 7 Cb -0.08 -2.98 -0.07 0.00 1.34 0.00 0.00 72.50 70.72 1c41 s THR 7 CO 0.41 0.36 1.37 -2.16 -0.54 0.00 0.00 174.62 174.06 1c41 s PRO 8 N 1.44 3.48 -0.28 3.99 0.04 -1.26 -5.04 135.00 137.36 1c41 s PRO 8 Ca 0.05 2.28 -0.09 0.00 0.04 0.00 0.00 61.00 63.28 1c41 s PRO 8 Cb -0.15 -2.48 0.12 0.00 0.04 0.00 0.00 34.50 32.04 1c41 s PRO 8 CO 0.03 -0.93 0.60 -0.65 0.04 0.00 0.00 177.00 176.09 1c41 s GLN 9 N -2.64 0.53 -0.18 4.56 -0.21 -1.26 -5.15 119.66 115.31 1c41 s GLN 9 Ca 0.65 1.37 -0.05 0.00 0.02 0.00 0.00 55.36 57.35 1c41 s GLN 9 Cb -0.41 0.76 -0.03 0.00 1.00 0.00 0.00 33.01 34.33 1c41 s GLN 9 CO 0.51 -0.21 0.01 -1.14 -2.12 0.00 0.00 175.29 172.34 1c41 s GLN 10 N 2.83 3.76 0.42 2.91 0.74 -1.26 -4.89 119.66 124.18 1c41 s GLN 10 Ca -0.05 -0.46 0.07 0.00 0.05 0.00 0.00 55.36 54.97 1c41 s GLN 10 Cb -0.12 -3.07 -0.05 0.00 1.10 0.00 0.00 33.01 30.87 1c41 s GLN 10 CO -0.18 0.18 0.15 -1.01 -0.55 0.00 0.00 175.29 173.89 1c41 s HIS 11 N 0.57 2.51 0.00 1.67 3.76 -1.26 -5.09 115.29 117.44 1c41 s HIS 11 Ca -0.00 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.28 1c41 s HIS 11 Cb -0.14 -1.91 0.00 0.00 1.11 0.00 0.00 32.58 31.64 1c41 s HIS 11 CO 0.02 0.20 0.62 -3.47 -0.85 0.00 0.00 174.74 171.26 1c41 n ASP 12 N -1.22 0.00 -3.94 1.40 -0.08 -1.26 -4.81 116.55 106.64 1c41 n ASP 12 Ca -0.03 0.62 -0.27 0.00 -1.51 0.00 0.00 54.79 53.60 1c41 n ASP 12 Cb 0.65 -0.13 -0.00 0.00 2.34 0.00 0.00 41.12 43.98 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 -0.31 0.00 0.27 0.00 -1.26 -4.26 105.19 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 -2.93 0.94 -1.33 1.61 3.41 -1.26 -2.78 113.62 111.28 1c41 n SER 14 Ca -0.20 -0.38 0.09 0.00 -0.26 0.00 0.00 58.87 58.12 1c41 n SER 14 Cb 0.63 1.45 0.31 0.00 -0.26 0.00 0.00 64.21 66.34 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 -1.80 2.78 -2.57 7.33 0.00 -1.26 -4.45 120.51 120.54 1c41 n ALA 15 Ca -0.00 -1.52 -0.31 0.00 0.00 0.00 0.00 53.44 51.60 1c41 n ALA 15 Cb 0.37 -0.87 -0.05 0.00 0.00 0.00 0.00 19.45 18.90 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 -1.61 4.21 -0.21 0.00 1.02 -1.26 -5.06 118.68 115.77 1c41 s LEU 16 Ca 0.46 0.71 0.01 0.00 0.02 0.00 0.00 54.13 55.32 1c41 s LEU 16 Cb 0.28 -3.46 0.05 0.00 0.02 0.00 0.00 46.19 43.08 1c41 s LEU 16 CO 0.24 -0.03 -0.07 -0.60 0.02 0.00 0.00 176.35 175.91 1c41 s ARG 17 N -2.85 1.77 -0.10 1.70 3.52 -1.26 -4.65 118.95 117.08 1c41 s ARG 17 Ca 0.44 -0.87 -0.03 0.00 -0.13 0.00 0.00 55.73 55.14 1c41 s ARG 17 Cb -0.12 -2.45 -0.03 0.00 -1.56 0.00 0.00 34.95 30.79 1c41 s ARG 17 CO 0.24 -0.51 0.01 0.42 -0.81 0.00 0.00 175.30 174.66 1c41 s ILE 18 N 1.42 4.40 -0.12 4.11 -1.09 -0.27 -0.54 121.20 129.12 1c41 s ILE 18 Ca -0.03 -0.21 0.00 0.00 -2.23 0.00 0.00 60.65 58.18 1c41 s ILE 18 Cb -0.17 -2.87 -0.02 0.00 -1.58 0.00 0.00 42.46 37.82 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 -0.67 1.56 -0.06 6.18 0.00 -0.82 -1.11 107.32 112.41 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 -0.29 -0.19 -0.42 0.00 0.00 0.00 173.10 172.22 1c41 s ILE 20 N 0.12 1.59 -0.11 0.90 1.01 0.11 -1.05 121.20 123.78 1c41 s ILE 20 Ca -0.06 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.81 1c41 s ILE 20 Cb -0.15 -1.38 0.02 0.00 0.01 0.00 0.00 42.46 40.97 1c41 s ILE 20 CO 0.04 0.45 -0.11 -0.69 0.00 0.00 0.00 174.94 174.64 1c41 s VAL 21 N 0.17 1.21 0.08 2.92 1.01 -0.45 -0.90 120.40 124.44 1c41 s VAL 21 Ca -0.08 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.54 1c41 s VAL 21 Cb -0.14 -1.16 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 1c41 s VAL 21 CO 0.04 0.39 -0.22 -1.38 0.00 0.00 0.00 175.10 173.93 1c41 s HIS 22 N 1.32 1.91 0.81 5.22 -3.43 -0.77 -1.12 115.29 119.24 1c41 s HIS 22 Ca -0.01 -0.40 -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 -0.05 0.18 1.16 0.00 -2.00 0.00 0.00 174.74 174.03 1c41 s ALA 23 N -1.00 2.76 -0.90 -1.38 0.00 0.02 -1.48 121.76 119.79 1c41 s ALA 23 Ca 0.08 -0.95 0.08 0.00 0.00 0.00 0.00 51.96 51.17 1c41 s ALA 23 Cb -0.10 -2.74 0.10 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 0.00 175.76 175.44 1c41 n ARG 24 N -3.29 0.86 -2.47 0.00 1.74 -0.19 -4.77 116.66 108.54 1c41 n ARG 24 Ca 0.10 -1.22 -0.41 0.00 -0.77 0.00 0.00 57.85 55.56 1c41 n ARG 24 Cb 0.60 -1.16 -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 -0.75 3.56 -1.04 -1.55 0.52 -1.14 -3.27 118.94 115.28 1c41 s TRP 25 Ca 0.11 1.62 -0.01 0.00 0.02 0.00 0.00 56.10 57.85 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 0.10 -0.67 0.87 0.09 0.02 0.00 0.00 176.95 177.36 1c41 n ASN 26 N 1.77 -2.58 -0.20 2.95 3.02 -1.26 -4.56 115.26 114.40 1c41 n ASN 26 Ca 0.01 -0.56 0.09 0.00 -0.03 0.00 0.00 54.58 54.10 1c41 n ASN 26 Cb 0.45 -4.58 0.39 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 -1.57 0.66 0.00 3.52 5.08 -1.91 0.13 114.58 120.48 1c41 h GLU 27 Ca -0.52 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1c41 h GLU 27 Cb 1.30 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1c41 h GLU 27 CO 0.43 0.43 0.00 0.25 -1.00 0.00 0.00 179.01 179.13 1c41 n THR 28 N -4.50 1.16 -0.09 1.13 -2.24 -1.26 -0.74 114.28 107.74 1c41 n THR 28 Ca 0.13 0.62 -0.11 0.00 -2.27 0.00 0.00 64.05 62.42 1c41 n THR 28 Cb 0.34 -1.60 -0.11 0.00 -2.10 0.00 0.00 70.33 66.86 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 -2.12 1.11 -0.07 2.28 2.08 -0.10 -4.36 119.36 118.18 1c41 n ILE 29 Ca -0.01 -0.53 -0.10 0.00 0.56 0.00 0.00 62.75 62.67 1c41 n ILE 29 Cb 0.06 -0.94 -0.03 0.00 -0.75 0.00 0.00 39.64 37.98 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 1.13 0.17 1.39 1.08 0.08 -2.69 117.51 118.66 1c41 h ILE 30 Ca -0.44 -0.34 0.01 0.00 -0.39 0.00 0.00 64.86 63.71 1c41 h ILE 30 Cb 1.81 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 36.42 1c41 h ILE 30 CO -0.03 0.12 -0.24 -0.08 -0.69 0.00 0.00 178.15 177.23 1c41 h GLU 31 N 0.30 -0.46 -0.99 2.37 4.22 -1.17 0.40 114.58 119.25 1c41 h GLU 31 Ca 0.09 0.03 0.11 0.00 0.08 0.00 0.00 59.36 59.67 1c41 h GLU 31 Cb 0.08 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.35 1c41 h GLU 31 CO -0.01 -0.31 0.63 -1.35 -2.18 0.00 0.00 179.01 175.79 1c41 h PRO 32 N -0.47 0.97 0.61 0.92 0.11 -1.75 0.23 132.00 132.62 1c41 h PRO 32 Ca 0.01 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.04 1c41 h PRO 32 Cb 0.47 -0.22 0.01 0.00 0.11 0.00 0.00 31.00 31.37 1c41 h PRO 32 CO -0.10 0.64 -0.29 -0.07 -0.21 0.00 0.00 178.00 177.97 1c41 h LEU 33 N 1.00 -0.70 -0.79 2.35 3.38 -1.05 -1.90 115.31 117.60 1c41 h LEU 33 Ca 0.48 -0.02 0.14 0.00 0.09 0.00 0.00 57.88 58.56 1c41 h LEU 33 Cb 0.44 0.18 -0.09 0.00 0.09 0.00 0.00 40.66 41.28 1c41 h LEU 33 CO -0.24 -0.34 0.36 0.25 0.09 0.00 0.00 178.44 178.57 1c41 h LEU 34 N -1.10 0.41 0.07 1.67 5.85 0.22 -0.77 115.31 121.64 1c41 h LEU 34 Ca -0.08 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1c41 h LEU 34 Cb 0.68 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1c41 h LEU 34 CO 0.14 0.17 -0.19 0.00 -0.34 0.00 0.00 178.44 178.22 1c41 h ALA 35 N 1.54 -0.29 -0.81 1.25 0.00 -0.52 0.90 119.26 121.32 1c41 h ALA 35 Ca 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1c41 h ALA 35 Cb 0.60 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 1c41 h ALA 35 CO -0.37 -0.71 0.49 0.78 0.00 0.00 0.00 179.25 179.44 1c41 h GLY 36 N -0.35 1.18 0.89 0.00 0.00 -0.45 0.42 103.07 104.77 1c41 h GLY 36 Ca 0.04 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 1c41 h GLY 36 CO -0.13 0.48 -0.13 0.00 0.00 0.00 0.00 176.54 176.76 1c41 h THR 37 N 1.12 1.29 -0.62 4.70 1.03 -0.85 -2.11 112.91 117.48 1c41 h THR 37 Ca 0.29 -1.22 -0.02 0.00 -0.01 0.00 0.00 66.41 65.46 1c41 h THR 37 Cb -0.04 1.48 -0.03 0.00 -1.07 0.00 0.00 68.15 68.50 1c41 h THR 37 CO -0.05 0.39 0.32 0.50 -0.01 0.00 0.00 175.52 176.66 1c41 h LYS 38 N 0.33 0.87 0.07 0.00 3.64 -0.62 -1.99 116.57 118.88 1c41 h LYS 38 Ca 0.06 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1c41 h LYS 38 Cb 0.64 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 1c41 h LYS 38 CO 0.04 0.68 -0.33 0.00 -2.27 0.00 0.00 179.45 177.57 1c41 h ALA 39 N 1.14 -0.83 -0.36 5.00 0.00 -0.76 -1.20 119.26 122.25 1c41 h ALA 39 Ca 0.21 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.16 1c41 h ALA 39 Cb 0.08 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1c41 h ALA 39 CO -0.03 -0.92 0.32 0.87 0.00 0.00 0.00 179.25 179.50 1c41 h LYS 40 N -0.47 0.00 0.54 0.00 1.79 -1.25 0.79 116.57 117.97 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 0.48 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.13 1c41 h LYS 40 CO -0.19 0.00 -0.26 -0.07 -1.08 0.00 0.00 179.45 177.85 1c41 h LEU 41 N 0.00 -0.62 -0.46 2.94 3.38 -0.46 -1.61 115.31 118.48 1c41 h LEU 41 Ca 0.17 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.15 1c41 h LEU 41 Cb 0.82 0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 1c41 h LEU 41 CO -0.00 -0.31 0.18 -0.07 0.09 0.00 0.00 178.44 178.33 1c41 h LEU 42 N -0.93 0.21 -1.78 1.67 3.38 -0.61 0.15 115.31 117.40 1c41 h LEU 42 Ca -0.07 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.04 1c41 h LEU 42 Cb 0.63 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1c41 h LEU 42 CO 0.12 0.15 0.52 0.00 0.09 0.00 0.00 178.44 179.33 1c41 h ALA 43 N 1.29 1.97 -0.36 1.53 0.00 -0.70 1.03 119.26 124.02 1c41 h ALA 43 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1c41 h ALA 43 Cb 0.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1c41 h ALA 43 CO -0.20 -0.69 0.00 0.00 0.00 0.00 0.00 179.25 178.35 1c41 n GLY 45 N 1.46 0.66 3.70 0.00 0.00 0.36 -4.36 105.19 107.00 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 -2.24 3.37 0.14 1.61 1.01 -0.97 -4.08 120.40 119.24 1c41 s VAL 46 Ca 0.00 0.91 -0.31 0.00 0.00 0.00 0.00 61.98 62.58 1c41 s VAL 46 Cb 0.00 -3.58 -0.08 0.00 0.00 0.00 0.00 36.38 32.72 1c41 s VAL 46 CO 0.00 0.04 1.36 -0.54 0.00 0.00 0.00 175.10 175.96 1c41 s LYS 47 N 1.69 4.34 0.35 2.72 1.02 -1.26 -4.28 119.74 124.33 1c41 s LYS 47 Ca 0.66 2.06 0.17 0.00 0.02 0.00 0.00 55.97 58.88 1c41 s LYS 47 Cb -0.36 -3.23 1.17 0.00 -0.52 0.00 0.00 37.83 34.89 1c41 s LYS 47 CO 0.29 -0.37 1.64 1.49 -0.92 0.00 0.00 175.35 177.49 1c41 h GLU 48 N 6.30 0.23 0.00 1.68 4.57 -1.96 0.94 114.58 126.34 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 -5.08 0.71 -1.25 1.04 3.41 -1.26 -2.80 113.62 108.39 1c41 n SER 49 Ca 0.33 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.65 1c41 n SER 49 Cb 1.07 -0.79 0.28 0.00 -0.26 0.00 0.00 64.21 64.52 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 -2.22 3.64 -4.19 4.04 3.02 0.32 -2.44 115.26 117.43 1c41 n ASN 50 Ca 0.04 -2.18 -0.36 0.00 -0.03 0.00 0.00 54.58 52.05 1c41 n ASN 50 Cb 0.32 -0.46 -0.12 0.00 -0.61 0.00 0.00 39.78 38.90 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 -1.48 3.40 -0.07 2.41 1.01 -1.12 -1.11 121.20 124.24 1c41 s ILE 51 Ca 0.42 -1.50 -0.14 0.00 0.00 0.00 0.00 60.65 59.43 1c41 s ILE 51 Cb 0.24 -3.06 -0.05 0.00 0.01 0.00 0.00 42.46 39.60 1c41 s ILE 51 CO 0.24 -0.32 0.36 -0.69 0.00 0.00 0.00 174.94 174.53 1c41 s VAL 52 N 1.28 5.17 -0.19 2.92 1.01 -0.26 -5.00 120.40 125.33 1c41 s VAL 52 Ca 0.00 0.72 -0.04 0.00 0.00 0.00 0.00 61.98 62.66 1c41 s VAL 52 Cb -0.21 -3.67 0.06 0.00 0.00 0.00 0.00 36.38 32.56 1c41 s VAL 52 CO -0.01 0.50 0.06 -0.69 0.00 0.00 0.00 175.10 174.97 1c41 s VAL 53 N -0.44 0.24 0.31 2.92 1.01 -1.26 0.05 120.40 123.23 1c41 s VAL 53 Ca 0.21 -0.39 0.11 0.00 0.00 0.00 0.00 61.98 61.91 1c41 s VAL 53 Cb -0.15 -0.83 -0.06 0.00 0.00 0.00 0.00 36.38 35.34 1c41 s VAL 53 CO 0.10 -0.26 -0.15 -1.10 0.00 0.00 0.00 175.10 173.69 1c41 s GLN 54 N 1.99 1.74 0.36 2.72 -0.21 -0.08 -5.00 119.66 121.18 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 -0.17 -1.71 -0.07 0.00 1.00 0.00 0.00 33.01 32.06 1c41 s GLN 54 CO -0.09 0.23 0.03 -1.54 -2.12 0.00 0.00 175.29 171.80 1c41 s SER 55 N -3.55 3.10 0.09 5.90 1.04 -1.26 -1.84 113.70 117.17 1c41 s SER 55 Ca 0.31 -1.37 -0.07 0.00 0.48 0.00 0.00 55.95 55.30 1c41 s SER 55 Cb -0.01 -0.24 -0.01 0.00 0.10 0.00 0.00 66.02 65.86 1c41 s SER 55 CO 0.16 -0.53 0.16 0.68 0.98 0.00 0.00 173.24 174.69 1c41 s VAL 56 N -3.01 0.14 0.05 5.02 -7.23 -0.55 -4.90 120.40 109.92 1c41 s VAL 56 Ca 0.36 -1.32 -0.29 0.00 -1.81 0.00 0.00 61.98 58.91 1c41 s VAL 56 Cb 0.09 -1.45 -0.16 0.00 0.56 0.00 0.00 36.38 35.42 1c41 s VAL 56 CO 0.17 -0.66 1.44 1.55 -0.31 0.00 0.00 175.10 177.29 1c41 h PRO 57 N 2.79 -1.01 -5.18 4.82 0.13 -1.94 -0.85 132.00 130.76 1c41 h PRO 57 Ca -0.34 0.07 -0.67 0.00 -0.87 0.00 0.00 66.00 64.19 1c41 h PRO 57 Cb 1.19 0.23 -0.13 0.00 0.13 0.00 0.00 31.00 32.42 1c41 h PRO 57 CO 0.57 -0.68 -0.51 0.20 -0.23 0.00 0.00 178.00 177.35 1c41 s GLY 58 N -1.76 3.01 0.40 1.56 0.00 -1.26 -1.02 107.32 108.25 1c41 s GLY 58 Ca -0.15 -0.41 0.10 0.00 0.00 0.00 0.00 44.72 44.26 1c41 s GLY 58 CO 0.46 -2.18 1.96 1.76 0.00 0.00 0.00 173.10 175.11 1c41 h SER 59 N 1.37 0.24 -0.73 1.64 0.02 -1.94 -2.54 113.55 111.61 1c41 h SER 59 Ca -0.43 -0.04 0.14 0.00 -0.84 0.00 0.00 61.79 60.62 1c41 h SER 59 Cb 1.31 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.74 1c41 h SER 59 CO 0.73 0.34 0.49 -0.25 -1.14 0.00 0.00 176.83 177.00 1c41 h TRP 60 N 0.25 0.49 0.00 3.45 2.91 -1.96 0.19 115.95 121.28 1c41 h TRP 60 Ca 0.06 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.09 1c41 h TRP 60 Cb 0.27 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 28.76 1c41 h TRP 60 CO 0.00 0.20 0.00 0.93 -1.03 0.00 0.00 178.44 178.54 1c41 h GLU 61 N 0.43 0.00 0.05 2.65 3.07 -1.87 -3.37 114.58 115.55 1c41 h GLU 61 Ca 0.36 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.23 1c41 h GLU 61 Cb 0.78 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.65 1c41 h GLU 61 CO -0.11 0.00 -0.45 -0.07 -1.40 0.00 0.00 179.01 176.98 1c41 h LEU 62 N 0.00 -1.36 -0.36 1.33 4.07 -0.67 0.13 115.31 118.45 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 0.73 0.51 -0.04 0.00 1.08 0.00 0.00 40.66 42.94 1c41 h LEU 62 CO 0.00 -0.45 0.13 1.55 -1.08 0.00 0.00 178.44 178.59 1c41 h PRO 63 N -0.60 0.28 -0.60 1.13 0.13 -1.73 0.10 132.00 130.71 1c41 h PRO 63 Ca 0.00 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 1c41 h PRO 63 Cb 0.62 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 1c41 h PRO 63 CO -0.27 0.18 0.34 0.97 -0.23 0.00 0.00 178.00 178.99 1c41 h ILE 64 N 0.28 1.19 -0.63 -3.56 6.09 -1.75 -0.39 117.51 118.75 1c41 h ILE 64 Ca 0.16 -0.48 -0.03 0.00 -1.37 0.00 0.00 64.86 63.15 1c41 h ILE 64 Cb 0.13 0.41 -0.03 0.00 0.47 0.00 0.00 36.82 37.80 1c41 h ILE 64 CO -0.16 0.21 0.29 0.00 -3.07 0.00 0.00 178.15 175.42 1c41 h ALA 65 N 1.16 0.81 -0.46 0.18 0.00 -0.30 -1.55 119.26 119.09 1c41 h ALA 65 Ca 0.21 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1c41 h ALA 65 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1c41 h ALA 65 CO -0.04 0.39 0.03 0.28 0.00 0.00 0.00 179.25 179.91 1c41 h VAL 66 N 0.87 1.26 -0.53 0.00 2.07 -0.50 0.27 116.25 119.68 1c41 h VAL 66 Ca 0.21 -1.01 0.03 0.00 0.82 0.00 0.00 66.70 66.76 1c41 h VAL 66 Cb 0.14 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1c41 h VAL 66 CO -0.02 0.35 0.31 -0.61 0.02 0.00 0.00 177.57 177.62 1c41 h GLN 67 N 0.66 0.59 -0.09 1.57 4.15 -0.78 -2.10 115.11 119.10 1c41 h GLN 67 Ca 0.13 -0.04 -0.19 0.00 0.77 0.00 0.00 58.65 59.33 1c41 h GLN 67 Cb 0.47 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.02 1c41 h GLN 67 CO 0.02 0.39 -0.74 0.00 -1.93 0.00 0.00 178.83 176.57 1c41 h ARG 68 N 0.61 0.49 0.35 1.69 2.47 -1.19 -1.70 114.38 117.11 1c41 h ARG 68 Ca 0.22 -0.40 -0.02 0.00 -1.26 0.00 0.00 59.98 58.52 1c41 h ARG 68 Cb 0.05 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.46 1c41 h ARG 68 CO -0.11 1.03 -0.17 1.25 0.56 0.00 0.00 179.97 182.53 1c41 h LEU 69 N 0.33 -0.41 -0.32 3.04 6.46 -0.71 0.11 115.31 123.82 1c41 h LEU 69 Ca -0.04 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1c41 h LEU 69 Cb 1.33 0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 41.33 1c41 h LEU 69 CO 0.13 -0.29 0.10 0.22 -0.62 0.00 0.00 178.44 177.98 1c41 h TYR 70 N -0.48 0.17 -0.72 1.25 3.20 -1.43 -1.31 116.97 117.65 1c41 h TYR 70 Ca -0.05 0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.00 1c41 h TYR 70 Cb 0.37 -0.03 -0.12 0.00 1.54 0.00 0.00 36.73 38.49 1c41 h TYR 70 CO -0.06 0.07 0.02 1.03 -1.64 0.00 0.00 178.16 177.58 1c41 h SER 71 N 0.23 -0.31 0.24 -2.11 0.87 -0.88 -1.32 113.55 110.27 1c41 h SER 71 Ca 0.14 0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 1c41 h SER 71 Cb 0.13 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1c41 h SER 71 CO -0.16 -0.15 -0.12 0.00 -0.53 0.00 0.00 176.83 175.87 1c41 h ALA 72 N 1.67 -0.33 -0.63 6.23 0.00 0.28 -2.37 119.26 124.10 1c41 h ALA 72 Ca 0.39 -0.10 0.18 0.00 0.00 0.00 0.00 54.91 55.39 1c41 h ALA 72 Cb 0.68 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1c41 h ALA 72 CO -0.62 -0.65 0.62 0.66 0.00 0.00 0.00 179.25 179.26 1c41 h SER 73 N -0.40 0.00 -0.10 0.00 4.64 -0.26 0.57 113.55 117.99 1c41 h SER 73 Ca -0.03 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.15 1c41 h SER 73 Cb 0.30 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.40 1c41 h SER 73 CO 0.06 0.00 -0.47 1.56 -0.87 0.00 0.00 176.83 177.11 1c41 h GLN 74 N 0.00 0.50 -0.05 4.77 4.20 -0.85 -3.03 115.11 120.66 1c41 h GLN 74 Ca 0.30 -0.40 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1c41 h GLN 74 Cb 1.54 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.40 1c41 h GLN 74 CO -0.00 1.03 0.13 -0.07 -0.67 0.00 0.00 178.83 179.25 1c41 h LEU 75 N 0.09 0.00 0.00 1.46 3.38 -0.76 -3.46 115.31 116.02 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 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 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 -3.29 0.00 -1.01 1.13 6.02 -1.15 -5.13 117.38 113.95 1c41 n GLN 76 Ca -0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.58 1c41 n GLN 76 Cb 0.21 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.41 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 -0.82 1.08 3.41 -1.02 -4.79 113.62 112.17 1c41 n SER 107 Ca 0.00 0.68 0.01 0.00 -0.26 0.00 0.00 58.87 59.30 1c41 n SER 107 Cb 0.00 -0.51 -0.01 0.00 -0.26 0.00 0.00 64.21 63.44 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 2.34 -0.20 0.00 6.66 -2.24 -1.26 -5.04 114.28 114.54 1c41 n THR 108 Ca 0.18 0.13 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 1c41 n THR 108 Cb -0.03 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 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 -2.63 1.49 3.64 3.38 0.00 -1.26 -4.98 105.19 104.83 1c41 n GLY 109 Ca -0.01 -1.39 -0.45 0.00 0.00 0.00 0.00 46.02 44.18 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 2.70 1.76 -1.63 1.61 -0.04 -1.15 -4.85 135.00 133.40 1c41 n PRO 110 Ca 0.00 0.62 -0.38 0.00 -0.04 0.00 0.00 63.50 63.70 1c41 n PRO 110 Cb 0.00 -2.16 0.05 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 0.96 0.97 0.20 0.54 3.72 -1.26 -4.88 117.46 117.70 1c41 n PHE 111 Ca 0.10 0.43 0.11 0.00 -0.05 0.00 0.00 57.45 58.04 1c41 n PHE 111 Cb 0.32 -2.16 -0.02 0.00 -0.94 0.00 0.00 39.48 36.68 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 -0.89 0.62 -3.52 4.37 8.00 0.30 -4.95 116.55 120.49 1c41 n ASP 112 Ca 0.14 0.15 -0.16 0.00 0.71 0.00 0.00 54.79 55.63 1c41 n ASP 112 Cb 0.47 0.81 -0.05 0.00 -0.02 0.00 0.00 41.12 42.33 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 -4.33 121.76 113.43 1c41 s ALA 113 Ca -0.01 1.26 0.08 0.00 0.00 0.00 0.00 51.96 53.29 1c41 s ALA 113 Cb 0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 1c41 s ALA 113 CO 0.81 -0.41 -0.17 -0.51 0.00 0.00 0.00 175.76 175.48 1c41 s LEU 114 N -1.39 2.40 -0.05 0.00 1.43 0.16 -1.94 118.68 119.28 1c41 s LEU 114 Ca -0.08 -0.81 0.01 0.00 -1.03 0.00 0.00 54.13 52.22 1c41 s LEU 114 Cb -0.00 -0.74 0.02 0.00 0.03 0.00 0.00 46.19 45.49 1c41 s LEU 114 CO 0.05 -0.05 -0.05 -0.63 0.23 0.00 0.00 176.35 175.90 1c41 s ILE 115 N -1.91 0.63 -0.23 -0.59 1.01 -0.21 0.26 121.20 120.16 1c41 s ILE 115 Ca 0.12 -0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.56 1c41 s ILE 115 Cb -0.06 -0.65 -0.01 0.00 0.01 0.00 0.00 42.46 41.75 1c41 s ILE 115 CO 0.05 0.25 -0.01 0.00 0.00 0.00 0.00 174.94 175.23 1c41 s ALA 116 N 1.01 2.92 -0.17 9.38 0.00 -0.64 -1.35 121.76 132.91 1c41 s ALA 116 Ca -0.09 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 50.71 1c41 s ALA 116 Cb -0.14 -1.81 -0.00 0.00 0.00 0.00 0.00 23.12 21.16 1c41 s ALA 116 CO -0.00 -0.43 -0.12 0.42 0.00 0.00 0.00 175.76 175.63 1c41 s ILE 117 N 1.49 2.88 0.10 0.00 1.01 -0.28 -0.16 121.20 126.24 1c41 s ILE 117 Ca 0.06 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1c41 s ILE 117 Cb -0.14 -2.25 0.01 0.00 0.01 0.00 0.00 42.46 40.09 1c41 s ILE 117 CO -0.01 0.49 0.27 -0.83 0.00 0.00 0.00 174.94 174.86 1c41 s GLY 118 N 0.99 -0.04 -0.27 6.18 0.00 -0.58 -0.80 107.32 112.80 1c41 s GLY 118 Ca -0.01 -0.41 -0.03 0.00 0.00 0.00 0.00 44.72 44.27 1c41 s GLY 118 CO -0.02 -0.62 0.09 0.14 0.00 0.00 0.00 173.10 172.69 1c41 s VAL 119 N -3.82 0.44 -0.13 1.40 1.01 -1.26 -0.55 120.40 117.50 1c41 s VAL 119 Ca 0.04 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.99 1c41 s VAL 119 Cb 0.04 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 35.13 1c41 s VAL 119 CO -0.11 -0.56 0.22 -0.76 0.00 0.00 0.00 175.10 173.89 1c41 s LEU 120 N 1.86 4.33 -0.06 3.92 2.01 0.18 -4.79 118.68 126.13 1c41 s LEU 120 Ca 0.06 0.51 0.02 0.00 0.01 0.00 0.00 54.13 54.73 1c41 s LEU 120 Cb -0.17 -2.24 0.02 0.00 0.01 0.00 0.00 46.19 43.82 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 -0.36 0.85 0.10 -0.59 1.01 -1.26 -1.21 121.20 119.73 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 -0.81 -0.16 0.00 0.01 0.00 0.00 42.46 41.37 1c41 s ILE 121 CO 0.04 0.29 1.34 1.17 0.00 0.00 0.00 174.94 177.79 1c41 n LYS 122 N 3.96 1.23 0.00 2.79 0.00 -0.81 -4.86 118.16 120.47 1c41 n LYS 122 Ca -0.24 0.44 0.00 0.00 0.00 0.00 0.00 58.31 58.52 1c41 n LYS 122 Cb 0.51 -2.08 0.00 0.00 0.00 0.00 0.00 35.03 33.46 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 2.54 2.33 0.06 3.14 0.00 -1.26 -4.95 105.19 107.05 1c41 n GLY 123 Ca 0.18 -1.81 0.08 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 -2.66 1.61 1.02 -1.26 -4.97 120.64 115.02 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 29.76 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 1.53 2.62 -2.24 -1.26 -5.01 114.28 107.40 1c41 n THR 125 Ca -0.05 -1.18 0.06 0.00 -2.27 0.00 0.00 64.05 60.61 1c41 n THR 125 Cb 0.64 -0.33 0.25 0.00 -2.10 0.00 0.00 70.33 68.79 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 -1.30 1.38 -0.17 -0.78 2.81 -1.26 -4.06 117.12 113.74 1c41 n MET 126 Ca 0.01 -0.58 -0.01 0.00 -1.81 0.00 0.00 57.70 55.31 1c41 n MET 126 Cb 0.34 -1.23 0.07 0.00 -0.71 0.00 0.00 33.22 31.70 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 1.03 0.08 -0.18 2.03 6.17 -1.97 -2.10 115.15 120.21 1c41 h HIS 127 Ca 0.00 0.03 0.05 0.00 0.71 0.00 0.00 60.37 61.16 1c41 h HIS 127 Cb 0.23 0.04 -0.07 0.00 2.52 0.00 0.00 27.41 30.13 1c41 h HIS 127 CO 0.09 -0.06 -0.42 0.35 0.71 0.00 0.00 177.93 178.59 1c41 h PHE 128 N 0.19 -1.22 -0.55 5.26 3.57 -1.89 -1.85 116.94 120.44 1c41 h PHE 128 Ca 0.27 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.76 1c41 h PHE 128 Cb 0.39 0.56 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 1c41 h PHE 128 CO -0.27 -0.47 0.09 1.05 -2.23 0.00 0.00 178.31 176.48 1c41 h GLU 129 N -0.46 0.87 0.00 1.11 9.09 -1.76 -1.18 114.58 122.25 1c41 h GLU 129 Ca 0.08 -0.20 -0.10 0.00 0.05 0.00 0.00 59.36 59.19 1c41 h GLU 129 Cb 0.62 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 27.59 1c41 h GLU 129 CO -0.43 0.81 -0.49 1.88 0.05 0.00 0.00 179.01 180.83 1c41 h TYR 130 N 0.82 0.00 0.19 2.06 0.05 -1.08 -2.15 116.97 116.86 1c41 h TYR 130 Ca 0.17 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.69 1c41 h TYR 130 Cb 0.36 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.13 1c41 h TYR 130 CO 0.02 0.49 -1.15 0.82 -1.05 0.00 0.00 178.16 177.29 1c41 h ILE 131 N 0.00 1.37 -0.31 -2.88 2.04 -1.20 -3.08 117.51 113.44 1c41 h ILE 131 Ca -0.00 -2.59 0.02 0.00 1.00 0.00 0.00 64.86 63.28 1c41 h ILE 131 Cb 0.92 3.09 -0.02 0.00 -0.74 0.00 0.00 36.82 40.07 1c41 h ILE 131 CO 0.06 0.76 0.17 0.00 0.00 0.00 0.00 178.15 179.14 1c41 h ALA 132 N 0.10 0.38 -0.76 1.87 0.00 -1.18 0.48 119.26 120.16 1c41 h ALA 132 Ca -0.21 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1c41 h ALA 132 Cb 1.87 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.56 1c41 h ALA 132 CO 0.19 -0.20 0.25 0.22 0.00 0.00 0.00 179.25 179.71 1c41 h ASP 133 N 0.35 1.09 -0.05 0.00 3.58 -1.51 -0.87 116.42 119.01 1c41 h ASP 133 Ca 0.13 -0.20 -0.25 0.00 0.42 0.00 0.00 57.03 57.12 1c41 h ASP 133 Cb 0.02 -0.29 0.02 0.00 1.72 0.00 0.00 39.33 40.80 1c41 h ASP 133 CO -0.07 1.01 -0.95 0.28 -2.88 0.00 0.00 179.24 176.62 1c41 h SER 134 N 1.13 0.92 -0.45 2.28 0.02 -1.41 -2.06 113.55 113.97 1c41 h SER 134 Ca 0.25 -0.71 -0.08 0.00 -0.84 0.00 0.00 61.79 60.42 1c41 h SER 134 Cb 0.29 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 1c41 h SER 134 CO -0.01 1.50 0.01 0.58 -1.14 0.00 0.00 176.83 177.77 1c41 h VAL 135 N 0.43 1.25 0.53 2.27 2.07 -0.85 0.46 116.25 122.41 1c41 h VAL 135 Ca -0.11 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 1c41 h VAL 135 Cb 1.60 0.84 0.01 0.00 -1.52 0.00 0.00 31.29 32.21 1c41 h VAL 135 CO 0.19 0.36 -0.26 0.28 0.02 0.00 0.00 177.57 178.17 1c41 h SER 136 N 0.80 -0.60 -0.56 0.57 0.02 -1.13 -0.42 113.55 112.22 1c41 h SER 136 Ca 0.15 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1c41 h SER 136 Cb 0.46 0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.13 1c41 h SER 136 CO 0.02 -0.35 0.20 0.45 -1.14 0.00 0.00 176.83 176.00 1c41 h HIS 137 N -0.83 0.91 -0.29 3.45 3.86 -1.27 -1.57 115.15 119.42 1c41 h HIS 137 Ca -0.07 -0.07 0.05 0.00 -1.16 0.00 0.00 60.37 59.12 1c41 h HIS 137 Cb 0.59 -0.27 -0.04 0.00 1.06 0.00 0.00 27.41 28.75 1c41 h HIS 137 CO -0.02 0.73 0.00 0.78 0.86 0.00 0.00 177.93 180.29 1c41 h GLY 138 N 1.00 0.28 0.98 2.45 0.00 0.14 0.74 103.07 108.66 1c41 h GLY 138 Ca 0.20 0.03 -0.07 0.00 0.00 0.00 0.00 47.33 47.49 1c41 h GLY 138 CO -0.01 -0.06 0.02 1.41 0.00 0.00 0.00 176.54 177.90 1c41 h LEU 139 N 0.09 0.77 -1.48 3.11 3.38 -0.78 -1.22 115.31 119.18 1c41 h LEU 139 Ca 0.14 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 57.87 1c41 h LEU 139 Cb 0.18 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1c41 h LEU 139 CO -0.23 0.87 0.42 -0.03 0.09 0.00 0.00 178.44 179.56 1c41 h MET 140 N 0.64 0.63 0.08 1.13 4.05 -0.87 -1.37 114.93 119.23 1c41 h MET 140 Ca 0.13 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.51 1c41 h MET 140 Cb 0.47 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.13 1c41 h MET 140 CO 0.02 0.42 -0.04 -0.09 0.23 0.00 0.00 176.91 177.45 1c41 h ARG 141 N 0.65 -0.10 -0.96 0.39 2.43 -0.36 -2.42 114.38 114.01 1c41 h ARG 141 Ca 0.27 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.63 1c41 h ARG 141 Cb 0.22 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.71 1c41 h ARG 141 CO -0.08 0.40 0.61 0.28 -1.51 0.00 0.00 179.97 179.67 1c41 h VAL 142 N -0.68 0.73 0.95 0.20 2.07 -0.89 0.67 116.25 119.31 1c41 h VAL 142 Ca -0.01 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1c41 h VAL 142 Cb 0.55 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1c41 h VAL 142 CO 0.02 0.12 -0.46 -0.61 0.02 0.00 0.00 177.57 176.66 1c41 h GLN 143 N 0.64 -1.23 -0.34 1.57 4.15 -1.22 0.24 115.11 118.91 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 0.96 0.28 -0.02 0.00 0.21 0.00 0.00 27.48 28.91 1c41 h GLN 143 CO -0.27 -0.82 -0.15 -0.07 -1.93 0.00 0.00 178.83 175.59 1c41 h LEU 144 N -1.30 0.60 0.63 -2.39 3.38 -0.79 0.22 115.31 115.66 1c41 h LEU 144 Ca -0.13 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 1c41 h LEU 144 Cb 0.98 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.58 1c41 h LEU 144 CO 0.22 0.77 -0.30 0.44 0.09 0.00 0.00 178.44 179.65 1c41 h ASP 145 N 0.56 -0.72 1.10 -0.43 5.19 0.33 -3.19 116.42 119.26 1c41 h ASP 145 Ca 0.09 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.45 1c41 h ASP 145 Cb 0.58 0.19 -0.01 0.00 0.18 0.00 0.00 39.33 40.26 1c41 h ASP 145 CO 0.04 -0.47 -0.26 0.00 -3.12 0.00 0.00 179.24 175.43 1c41 h THR 146 N -0.93 0.57 -0.12 0.35 1.03 -0.90 -3.47 112.91 109.44 1c41 h THR 146 Ca -0.09 -1.31 -0.05 0.00 -0.01 0.00 0.00 66.41 64.95 1c41 h THR 146 Cb 0.68 1.90 -0.02 0.00 -1.07 0.00 0.00 68.15 69.63 1c41 h THR 146 CO 0.14 0.25 -0.05 0.61 -0.01 0.00 0.00 175.52 176.47 1c41 n GLY 147 N 0.40 0.56 3.30 2.99 0.00 0.77 -5.01 105.19 108.21 1c41 n GLY 147 Ca 0.01 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.92 2.45 0.27 1.61 1.01 -1.10 -5.03 120.40 117.69 1c41 s VAL 148 Ca 0.00 -0.89 -0.31 0.00 0.00 0.00 0.00 61.98 60.78 1c41 s VAL 148 Cb 0.00 -1.97 -0.12 0.00 0.00 0.00 0.00 36.38 34.30 1c41 s VAL 148 CO 0.00 0.55 1.63 -2.84 0.00 0.00 0.00 175.10 174.45 1c41 s PRO 149 N 0.17 4.12 -0.29 2.72 0.02 -1.26 -4.44 135.00 136.04 1c41 s PRO 149 Ca -0.11 2.59 0.02 0.00 0.02 0.00 0.00 61.00 63.52 1c41 s PRO 149 Cb -0.16 -3.04 0.08 0.00 0.02 0.00 0.00 34.50 31.41 1c41 s PRO 149 CO 0.06 -0.67 -0.00 0.08 -0.33 0.00 0.00 177.00 176.14 1c41 s VAL 150 N 0.33 1.82 0.14 3.83 1.01 -1.26 -0.67 120.40 125.61 1c41 s VAL 150 Ca 0.67 -1.74 -0.31 0.00 0.00 0.00 0.00 61.98 60.59 1c41 s VAL 150 Cb -0.48 -2.19 -0.10 0.00 0.00 0.00 0.00 36.38 33.61 1c41 s VAL 150 CO 0.44 -0.36 1.59 -0.63 0.00 0.00 0.00 175.10 176.14 1c41 s ILE 151 N 1.19 2.71 -1.15 2.22 -1.09 0.14 -4.87 121.20 120.35 1c41 s ILE 151 Ca 0.02 0.44 -0.20 0.00 -2.23 0.00 0.00 60.65 58.69 1c41 s ILE 151 Cb -0.19 -3.28 0.07 0.00 -1.58 0.00 0.00 42.46 37.48 1c41 s ILE 151 CO -0.10 0.03 1.57 0.12 -1.23 0.00 0.00 174.94 175.33 1c41 s PHE 152 N 1.50 2.73 -0.72 3.97 5.36 -1.26 -1.63 117.98 127.92 1c41 s PHE 152 Ca 0.71 -1.30 -0.02 0.00 -0.96 0.00 0.00 56.93 55.36 1c41 s PHE 152 Cb -0.43 -4.69 0.42 0.00 -0.34 0.00 0.00 43.02 37.98 1c41 s PHE 152 CO 0.31 -1.83 2.03 0.41 -1.46 0.00 0.00 175.22 174.69 1c41 n GLY 153 N 5.99 5.77 3.45 13.12 0.00 0.77 -4.93 105.19 129.36 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 -4.91 3.90 -0.15 1.61 1.01 -1.23 -1.53 120.40 119.10 1c41 s VAL 154 Ca 0.61 -0.34 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 1c41 s VAL 154 Cb 0.49 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 1c41 s VAL 154 CO -0.14 0.44 0.31 -0.76 0.00 0.00 0.00 175.10 174.95 1c41 s LEU 155 N 0.89 4.25 -0.67 3.92 1.43 0.29 -4.92 118.68 123.87 1c41 s LEU 155 Ca 0.01 0.54 0.03 0.00 -1.03 0.00 0.00 54.13 53.67 1c41 s LEU 155 Cb -0.14 -2.39 0.16 0.00 0.03 0.00 0.00 46.19 43.85 1c41 s LEU 155 CO 0.02 0.10 0.46 0.42 0.23 0.00 0.00 176.35 177.58 1c41 s THR 156 N 0.42 3.09 0.34 5.49 -4.23 -1.26 0.50 115.64 119.99 1c41 s THR 156 Ca 0.17 -3.80 0.07 0.00 -1.18 0.00 0.00 61.69 56.95 1c41 s THR 156 Cb -0.13 -3.04 -0.02 0.00 1.34 0.00 0.00 72.50 70.66 1c41 s THR 156 CO 0.04 -0.94 0.40 -0.69 -0.54 0.00 0.00 174.62 172.89 1c41 s VAL 157 N -0.95 3.76 -0.04 2.29 1.01 -0.35 -5.02 120.40 121.11 1c41 s VAL 157 Ca 0.22 -1.16 0.13 0.00 0.00 0.00 0.00 61.98 61.17 1c41 s VAL 157 Cb -0.13 -3.29 -0.20 0.00 0.00 0.00 0.00 36.38 32.76 1c41 s VAL 157 CO -0.10 -0.15 0.25 0.18 0.00 0.00 0.00 175.10 175.28 1c41 n LEU 158 N -1.53 0.00 -3.93 3.92 4.77 -1.26 -1.92 117.00 117.04 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 0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.63 1c41 n LEU 158 CO 0.42 0.05 -0.26 0.42 -1.33 0.00 0.00 177.39 176.69 1c41 s THR 159 N -2.82 0.10 0.22 -5.08 -4.23 -1.26 -4.46 115.64 98.11 1c41 s THR 159 Ca -0.05 -0.84 -0.11 0.00 -1.18 0.00 0.00 61.69 59.51 1c41 s THR 159 Cb 0.08 -0.41 0.23 0.00 1.34 0.00 0.00 72.50 73.73 1c41 s THR 159 CO 0.55 -0.46 1.65 0.44 -0.54 0.00 0.00 174.62 176.25 1c41 h ASP 160 N 4.37 -0.38 -0.93 3.99 5.19 -1.98 -0.34 116.42 126.34 1c41 h ASP 160 Ca -0.32 0.17 0.13 0.00 -0.62 0.00 0.00 57.03 56.39 1c41 h ASP 160 Cb 1.20 0.32 -0.08 0.00 0.18 0.00 0.00 39.33 40.95 1c41 h ASP 160 CO 0.42 -0.16 0.60 0.44 -3.12 0.00 0.00 179.24 177.42 1c41 h ASP 161 N 0.08 0.79 -0.73 6.45 3.32 -1.99 -0.19 116.42 124.16 1c41 h ASP 161 Ca 0.34 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.41 1c41 h ASP 161 Cb 0.55 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 1c41 h ASP 161 CO -0.59 0.42 0.38 1.56 -1.72 0.00 0.00 179.24 179.29 1c41 h GLN 162 N 0.85 1.03 0.39 3.56 4.20 -1.48 0.17 115.11 123.83 1c41 h GLN 162 Ca 0.46 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 59.02 1c41 h GLN 162 Cb 0.57 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1c41 h GLN 162 CO -0.22 0.79 -0.19 0.00 -0.67 0.00 0.00 178.83 178.53 1c41 h ALA 163 N 1.19 -0.53 -0.52 3.87 0.00 -0.86 -1.54 119.26 120.87 1c41 h ALA 163 Ca 0.25 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1c41 h ALA 163 Cb 0.07 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 1c41 h ALA 163 CO -0.04 -0.80 0.14 0.87 0.00 0.00 0.00 179.25 179.43 1c41 h LYS 164 N -0.53 0.29 -0.43 0.00 1.57 -0.84 -0.68 116.57 115.96 1c41 h LYS 164 Ca -0.05 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1c41 h LYS 164 Cb 0.41 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 1c41 h LYS 164 CO 0.09 0.19 0.18 0.00 -0.57 0.00 0.00 179.45 179.33 1c41 h ALA 165 N 1.38 0.52 0.00 3.86 0.00 -0.47 -0.96 119.26 123.60 1c41 h ALA 165 Ca 0.26 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1c41 h ALA 165 Cb 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1c41 h ALA 165 CO -0.31 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 178.74 1c41 h ARG 166 N 0.36 0.00 -0.24 0.00 -0.00 -0.41 -2.51 114.38 111.58 1c41 h ARG 166 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.67 1c41 h ARG 166 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.12 1c41 h ARG 166 CO -0.17 0.00 0.00 0.00 0.00 0.00 0.00 179.97 179.80 1c41 n ALA 167 N -1.81 2.45 -0.72 0.04 0.00 -0.35 -0.61 120.51 119.51 1c41 n ALA 167 Ca 0.02 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1c41 n ALA 167 Cb 0.24 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 1.23 0.37 0.00 0.00 -0.83 -4.46 105.19 102.92 1c41 n GLY 168 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 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 0.29 -2.59 1.61 2.07 -1.51 -3.43 116.25 112.69 1c41 h VAL 169 Ca 0.00 0.00 -0.55 0.00 0.82 0.00 0.00 66.70 66.97 1c41 h VAL 169 Cb 0.00 0.29 0.23 0.00 -1.52 0.00 0.00 31.29 30.29 1c41 h VAL 169 CO 0.00 0.00 -1.27 -0.38 0.02 0.00 0.00 177.57 175.94 1c41 n ILE 170 N -5.45 0.10 0.00 4.57 2.08 -1.23 -4.90 119.36 114.53 1c41 n ILE 170 Ca -0.09 -0.38 0.00 0.00 0.56 0.00 0.00 62.75 62.84 1c41 n ILE 170 Cb 0.35 -0.27 0.00 0.00 -0.75 0.00 0.00 39.64 38.97 1c41 n ILE 170 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1c41 n GLU 171 N 0.71 0.00 0.20 0.38 -0.58 -1.26 -3.17 120.64 116.92 1c41 n GLU 171 Ca 0.02 0.35 0.08 0.00 -0.42 0.00 0.00 57.16 57.19 1c41 n GLU 171 Cb 0.54 -0.89 0.37 0.00 -0.57 0.00 0.00 31.44 30.88 1c41 n GLU 171 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1c41 h GLY 172 N 0.00 0.00 -2.44 0.62 0.00 -1.91 -3.48 103.07 95.86 1c41 h GLY 172 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 1c41 h GLY 172 CO 0.00 0.00 -0.39 -1.14 0.00 0.00 0.00 176.54 175.01 1c41 n SER 173 N -3.41 -1.09 -4.69 0.19 3.41 -1.19 -4.97 113.62 101.87 1c41 n SER 173 Ca 0.00 0.51 -0.35 0.00 -0.26 0.00 0.00 58.87 58.77 1c41 n SER 173 Cb 0.49 -0.48 -0.09 0.00 -0.26 0.00 0.00 64.21 63.87 1c41 n SER 173 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1c41 s HIS 174 N -0.71 3.34 -0.33 7.33 2.46 -1.22 -4.48 115.29 121.68 1c41 s HIS 174 Ca 0.32 0.21 -0.24 0.00 0.47 0.00 0.00 55.06 55.82 1c41 s HIS 174 Cb -0.41 -2.11 0.01 0.00 -0.13 0.00 0.00 32.58 29.93 1c41 s HIS 174 CO 0.31 0.24 0.83 1.21 -2.47 0.00 0.00 174.74 174.86 1c41 s ASN 175 N 0.32 6.65 0.58 9.88 3.84 -1.26 -3.19 114.94 131.76 1c41 s ASN 175 Ca 0.06 0.59 0.36 0.00 0.21 0.00 0.00 52.86 54.08 1c41 s ASN 175 Cb -0.12 -2.42 1.68 0.00 -0.55 0.00 0.00 41.25 39.84 1c41 s ASN 175 CO -0.01 -0.70 2.11 0.45 -2.79 0.00 0.00 177.10 176.16 1c41 h HIS 176 N 8.27 0.00 -0.89 0.43 3.86 -1.16 -2.84 115.15 122.82 1c41 h HIS 176 Ca -0.24 0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.11 1c41 h HIS 176 Cb 1.09 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.47 1c41 h HIS 176 CO 0.79 0.02 0.49 0.78 0.86 0.00 0.00 177.93 180.88 1c41 h GLY 177 N 1.30 1.46 0.54 2.45 0.00 -1.79 0.11 103.07 107.15 1c41 h GLY 177 Ca -0.00 -0.30 0.08 0.00 0.00 0.00 0.00 47.33 47.11 1c41 h GLY 177 CO 0.00 0.00 0.31 0.83 0.00 0.00 0.00 176.54 177.69 1c41 h GLU 178 N 0.71 0.55 -0.61 4.80 5.08 -1.59 -0.67 114.58 122.84 1c41 h GLU 178 Ca 0.48 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.82 1c41 h GLU 178 Cb 0.64 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1c41 h GLU 178 CO -0.34 0.36 0.40 -0.44 -1.00 0.00 0.00 179.01 177.99 1c41 h ASP 179 N 0.56 0.68 -0.52 1.42 3.32 -0.96 -1.77 116.42 119.15 1c41 h ASP 179 Ca 0.31 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.30 1c41 h ASP 179 Cb 0.29 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1c41 h ASP 179 CO -0.24 0.49 0.14 -0.50 -1.72 0.00 0.00 179.24 177.41 1c41 h TRP 180 N 0.81 0.86 -0.25 4.55 6.55 -0.45 0.11 115.95 128.13 1c41 h TRP 180 Ca 0.23 -0.10 -0.01 0.00 0.95 0.00 0.00 58.89 59.96 1c41 h TRP 180 Cb -0.07 -0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 27.97 1c41 h TRP 180 CO -0.04 0.75 0.12 0.78 -1.05 0.00 0.00 178.44 179.00 1c41 h GLY 181 N 0.72 0.39 0.61 1.49 0.00 -1.02 0.17 103.07 105.43 1c41 h GLY 181 Ca 0.17 -0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.36 1c41 h GLY 181 CO -0.00 0.18 0.26 -2.00 0.00 0.00 0.00 176.54 174.98 1c41 h LEU 182 N 0.27 0.34 -0.68 3.11 5.85 -1.08 -1.98 115.31 121.15 1c41 h LEU 182 Ca 0.09 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 1c41 h LEU 182 Cb 0.12 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1c41 h LEU 182 CO -0.01 0.23 -0.18 0.00 -0.34 0.00 0.00 178.44 178.14 1c41 h ALA 183 N 1.33 0.87 -0.55 1.25 0.00 -0.44 -2.57 119.26 119.16 1c41 h ALA 183 Ca 0.26 -0.36 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1c41 h ALA 183 Cb 0.22 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1c41 h ALA 183 CO -0.21 0.63 0.27 0.00 0.00 0.00 0.00 179.25 179.95 1c41 h ALA 184 N 1.06 0.71 0.30 0.00 0.00 0.04 -0.52 119.26 120.85 1c41 h ALA 184 Ca 0.11 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1c41 h ALA 184 Cb 0.70 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1c41 h ALA 184 CO 0.05 -0.08 -0.14 0.28 0.00 0.00 0.00 179.25 179.36 1c41 h VAL 185 N 0.52 0.73 -0.16 0.00 2.07 -1.28 0.37 116.25 118.51 1c41 h VAL 185 Ca 0.25 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.52 1c41 h VAL 185 Cb 0.18 0.90 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 1c41 h VAL 185 CO -0.18 0.06 -0.25 -0.08 0.02 0.00 0.00 177.57 177.14 1c41 h GLU 186 N -0.56 -0.29 -0.66 1.57 4.81 -1.20 -0.23 114.58 118.03 1c41 h GLU 186 Ca -0.04 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1c41 h GLU 186 Cb 0.41 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.83 1c41 h GLU 186 CO 0.07 -0.19 0.32 0.52 -0.73 0.00 0.00 179.01 179.00 1c41 h MET 187 N -0.30 0.92 -0.09 1.92 2.86 -1.08 0.22 114.93 119.38 1c41 h MET 187 Ca 0.11 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1c41 h MET 187 Cb 0.47 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 1c41 h MET 187 CO -0.33 0.71 0.05 0.78 1.06 0.00 0.00 176.91 179.18 1c41 h GLY 188 N 1.00 0.13 0.88 8.32 0.00 -0.00 0.39 103.07 113.78 1c41 h GLY 188 Ca 0.23 -0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.52 1c41 h GLY 188 CO -0.03 0.05 0.09 -2.08 0.00 0.00 0.00 176.54 174.57 1c41 h VAL 189 N 0.08 0.98 -0.73 4.60 2.07 -0.63 -2.33 116.25 120.29 1c41 h VAL 189 Ca 0.03 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1c41 h VAL 189 Cb 0.04 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1c41 h VAL 189 CO -0.01 0.04 0.44 0.03 0.02 0.00 0.00 177.57 178.10 1c41 h ARG 190 N 0.20 0.98 -0.40 1.57 3.08 -0.59 -2.55 114.38 116.67 1c41 h ARG 190 Ca 0.09 -0.08 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1c41 h ARG 190 Cb 0.04 -0.21 -0.05 0.00 0.08 0.00 0.00 29.97 29.83 1c41 h ARG 190 CO -0.07 0.69 0.11 -0.09 -1.07 0.00 0.00 179.97 179.53 1c41 h ARG 191 N 0.99 0.24 -0.18 0.04 2.43 0.07 -1.02 114.38 116.95 1c41 h ARG 191 Ca 0.26 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.47 1c41 h ARG 191 Cb -0.05 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.40 1c41 h ARG 191 CO -0.05 0.16 -0.17 0.00 -1.51 0.00 0.00 179.97 178.39 1c41 h ARG 192 N 0.25 -0.19 -0.60 0.20 3.08 -1.04 0.19 114.38 116.27 1c41 h ARG 192 Ca 0.19 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.29 1c41 h ARG 192 Cb 0.21 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 1c41 h ARG 192 CO -0.23 -0.13 0.35 -0.44 -1.07 0.00 0.00 179.97 178.46 1c41 h ASP 193 N -0.20 0.56 -0.63 7.04 3.32 -1.06 0.28 116.42 125.73 1c41 h ASP 193 Ca 0.11 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1c41 h ASP 193 Cb 0.37 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 1c41 h ASP 193 CO -0.30 0.38 0.37 -0.50 -1.72 0.00 0.00 179.24 177.47 1c41 h TRP 194 N 0.69 0.84 0.00 4.55 6.55 -0.69 0.60 115.95 128.48 1c41 h TRP 194 Ca 0.25 -0.01 -0.00 0.00 0.95 0.00 0.00 58.89 60.08 1c41 h TRP 194 Cb 0.06 -0.27 -0.00 0.00 -0.86 0.00 0.00 29.16 28.09 1c41 h TRP 194 CO -0.06 0.58 -0.01 0.00 -1.05 0.00 0.00 178.44 177.90 1c41 h ALA 195 N 1.18 1.38 -0.21 1.49 0.00 0.53 0.32 119.26 123.96 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 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 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 -2.26 2.50 -1.07 0.00 0.00 0.07 -4.91 120.51 114.84 1c41 n ALA 196 Ca -0.03 -0.58 -0.02 0.00 0.00 0.00 0.00 53.44 52.81 1c41 n ALA 196 Cb 0.10 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 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 0.52 3.76 0.00 0.00 0.11 -5.00 105.19 105.74 1c41 n GLY 197 Ca 0.16 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.35 4.75 0.00 1.61 1.02 -0.44 -5.00 119.74 120.33 1c41 s LYS 198 Ca 0.00 1.37 0.00 0.00 0.02 0.00 0.00 55.97 57.36 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 0.52 0.24 0.25 -0.92 0.00 0.00 175.35 175.44