#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 1.90 -0.22 1.61 0.04 -1.26 -5.10 135.00 131.97 1c41 s PRO 6 Ca 0.00 -1.10 -0.06 0.00 0.04 0.00 0.00 61.00 59.88 1c41 s PRO 6 Cb 0.00 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 32.13 1c41 s PRO 6 CO 0.00 -1.26 0.02 0.95 0.04 0.00 0.00 177.00 176.75 1c41 s THR 7 N -3.03 4.05 0.50 1.26 -4.23 -1.26 -5.09 115.64 107.84 1c41 s THR 7 Ca 0.64 -0.27 -0.23 0.00 -1.18 0.00 0.00 61.69 60.65 1c41 s THR 7 Cb -0.06 -2.85 -0.06 0.00 1.34 0.00 0.00 72.50 70.86 1c41 s THR 7 CO 0.43 0.40 1.32 -2.16 -0.54 0.00 0.00 174.62 174.07 1c41 s PRO 8 N 1.21 3.43 -0.30 3.99 0.04 -1.26 -5.05 135.00 137.07 1c41 s PRO 8 Ca 0.04 2.16 -0.10 0.00 0.04 0.00 0.00 61.00 63.14 1c41 s PRO 8 Cb -0.15 -2.40 0.13 0.00 0.04 0.00 0.00 34.50 32.12 1c41 s PRO 8 CO 0.02 -0.93 0.65 -0.65 0.04 0.00 0.00 177.00 176.12 1c41 s GLN 9 N -2.72 0.57 -0.18 4.56 -0.21 -1.26 -5.15 119.66 115.27 1c41 s GLN 9 Ca 0.67 1.45 -0.05 0.00 0.02 0.00 0.00 55.36 57.45 1c41 s GLN 9 Cb -0.38 0.87 -0.03 0.00 1.00 0.00 0.00 33.01 34.46 1c41 s GLN 9 CO 0.47 -0.20 0.01 -1.14 -2.12 0.00 0.00 175.29 172.30 1c41 s GLN 10 N 2.89 3.74 0.41 2.91 0.74 -1.26 -4.89 119.66 124.21 1c41 s GLN 10 Ca -0.06 -0.47 0.07 0.00 0.05 0.00 0.00 55.36 54.96 1c41 s GLN 10 Cb -0.12 -3.07 -0.06 0.00 1.10 0.00 0.00 33.01 30.87 1c41 s GLN 10 CO -0.19 0.17 0.15 -1.01 -0.55 0.00 0.00 175.29 173.86 1c41 s HIS 11 N 0.60 2.59 0.00 1.67 3.76 -1.26 -5.09 115.29 117.57 1c41 s HIS 11 Ca -0.00 -0.60 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 1c41 s HIS 11 Cb -0.14 -1.93 0.00 0.00 1.11 0.00 0.00 32.58 31.62 1c41 s HIS 11 CO 0.02 0.23 0.66 -3.47 -0.85 0.00 0.00 174.74 171.33 1c41 n ASP 12 N -1.19 0.00 -3.98 1.40 -0.08 -1.26 -4.81 116.55 106.63 1c41 n ASP 12 Ca -0.02 0.66 -0.28 0.00 -1.51 0.00 0.00 54.79 53.64 1c41 n ASP 12 Cb 0.65 -0.16 -0.01 0.00 2.34 0.00 0.00 41.12 43.94 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 -0.68 -0.30 0.00 0.27 0.00 -1.26 -4.25 105.19 98.97 1c41 n GLY 13 Ca 0.00 0.15 0.09 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 0.89 -1.26 1.61 3.41 -1.26 -2.76 113.62 111.34 1c41 n SER 14 Ca -0.19 -0.41 0.09 0.00 -0.26 0.00 0.00 58.87 58.10 1c41 n SER 14 Cb 0.63 1.44 0.30 0.00 -0.26 0.00 0.00 64.21 66.32 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 -1.79 2.66 -2.49 7.33 0.00 -1.26 -4.45 120.51 120.51 1c41 n ALA 15 Ca -0.00 -1.47 -0.31 0.00 0.00 0.00 0.00 53.44 51.66 1c41 n ALA 15 Cb 0.37 -0.84 -0.05 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.48 4.17 -0.21 0.00 1.02 -1.26 -5.06 118.68 115.86 1c41 s LEU 16 Ca 0.44 0.82 0.01 0.00 0.02 0.00 0.00 54.13 55.41 1c41 s LEU 16 Cb 0.26 -3.58 0.05 0.00 0.02 0.00 0.00 46.19 42.94 1c41 s LEU 16 CO 0.24 -0.07 -0.08 -0.60 0.02 0.00 0.00 176.35 175.87 1c41 s ARG 17 N -2.91 1.78 -0.10 1.70 3.52 -1.26 -4.65 118.95 117.03 1c41 s ARG 17 Ca 0.45 -0.86 -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 0.23 -0.50 0.01 0.42 -0.81 0.00 0.00 175.30 174.65 1c41 s ILE 18 N 1.43 4.37 -0.11 4.11 -1.09 -0.17 -0.81 121.20 128.92 1c41 s ILE 18 Ca -0.03 -0.22 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 1c41 s ILE 18 Cb -0.17 -2.86 -0.02 0.00 -1.58 0.00 0.00 42.46 37.83 1c41 s ILE 18 CO -0.07 0.59 -0.14 -0.83 -1.23 0.00 0.00 174.94 173.26 1c41 s GLY 19 N -0.68 1.53 -0.06 6.18 0.00 -0.94 -0.96 107.32 112.39 1c41 s GLY 19 Ca 0.11 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.96 1c41 s GLY 19 CO 0.02 -0.33 -0.18 -0.42 0.00 0.00 0.00 173.10 172.19 1c41 s ILE 20 N 0.09 1.53 -0.10 0.90 1.01 0.72 -1.01 121.20 124.34 1c41 s ILE 20 Ca -0.06 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.85 1c41 s ILE 20 Cb -0.15 -1.32 0.02 0.00 0.01 0.00 0.00 42.46 41.02 1c41 s ILE 20 CO 0.05 0.44 -0.11 -0.69 0.00 0.00 0.00 174.94 174.62 1c41 s VAL 21 N 0.20 1.23 0.09 2.92 1.01 -0.62 -0.88 120.40 124.34 1c41 s VAL 21 Ca -0.08 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.52 1c41 s VAL 21 Cb -0.14 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 1c41 s VAL 21 CO 0.04 0.39 -0.21 -1.38 0.00 0.00 0.00 175.10 173.94 1c41 s HIS 22 N 1.25 1.79 0.78 5.22 -3.43 -0.73 -1.36 115.29 118.81 1c41 s HIS 22 Ca -0.03 -0.41 -0.09 0.00 -0.80 0.00 0.00 55.06 53.73 1c41 s HIS 22 Cb -0.14 -1.00 0.10 0.00 -1.43 0.00 0.00 32.58 30.12 1c41 s HIS 22 CO -0.04 0.18 1.11 0.00 -2.00 0.00 0.00 174.74 173.99 1c41 s ALA 23 N -1.09 2.93 -0.82 -1.38 0.00 -0.18 -1.44 121.76 119.78 1c41 s ALA 23 Ca 0.07 -1.03 0.07 0.00 0.00 0.00 0.00 51.96 51.07 1c41 s ALA 23 Cb -0.10 -2.64 0.11 0.00 0.00 0.00 0.00 23.12 20.49 1c41 s ALA 23 CO 0.04 -1.64 0.88 0.54 0.00 0.00 0.00 175.76 175.58 1c41 n ARG 24 N -3.17 1.02 -2.45 0.00 1.74 -0.11 -4.77 116.66 108.91 1c41 n ARG 24 Ca 0.10 -1.26 -0.41 0.00 -0.77 0.00 0.00 57.85 55.52 1c41 n ARG 24 Cb 0.60 -1.15 -0.04 0.00 -1.02 0.00 0.00 32.46 30.85 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 3.53 -1.04 -1.55 0.52 -1.13 -3.33 118.94 115.19 1c41 s TRP 25 Ca 0.11 1.60 -0.01 0.00 0.02 0.00 0.00 56.10 57.82 1c41 s TRP 25 Cb 0.07 -3.33 -0.01 0.00 -1.15 0.00 0.00 33.47 29.05 1c41 s TRP 25 CO 0.10 -0.76 0.87 0.09 0.02 0.00 0.00 176.95 177.27 1c41 n ASN 26 N 1.79 -2.73 -0.18 2.95 3.02 -1.26 -4.56 115.26 114.29 1c41 n ASN 26 Ca 0.01 -0.56 0.09 0.00 -0.03 0.00 0.00 54.58 54.09 1c41 n ASN 26 Cb 0.45 -4.61 0.39 0.00 -0.61 0.00 0.00 39.78 35.40 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 -1.56 0.64 0.00 3.52 5.08 -1.91 -0.17 114.58 120.18 1c41 h GLU 27 Ca -0.53 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1c41 h GLU 27 Cb 1.30 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1c41 h GLU 27 CO 0.43 0.42 0.00 0.25 -1.00 0.00 0.00 179.01 179.12 1c41 n THR 28 N -4.49 1.21 -0.09 1.13 -2.24 -1.26 -0.71 114.28 107.83 1c41 n THR 28 Ca 0.12 0.60 -0.11 0.00 -2.27 0.00 0.00 64.05 62.39 1c41 n THR 28 Cb 0.31 -1.58 -0.10 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 -2.07 1.11 -0.02 2.28 2.08 -0.20 -4.37 119.36 118.17 1c41 n ILE 29 Ca -0.00 -0.53 -0.11 0.00 0.56 0.00 0.00 62.75 62.67 1c41 n ILE 29 Cb 0.06 -0.95 -0.05 0.00 -0.75 0.00 0.00 39.64 37.95 1c41 n ILE 29 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 1c41 h ILE 30 N 0.00 1.08 0.04 1.39 1.08 -0.06 -2.66 117.51 118.37 1c41 h ILE 30 Ca -0.43 -0.20 0.03 0.00 -0.39 0.00 0.00 64.86 63.86 1c41 h ILE 30 Cb 1.80 0.96 -0.04 0.00 -3.07 0.00 0.00 36.82 36.47 1c41 h ILE 30 CO -0.03 0.07 -0.23 -0.08 -0.69 0.00 0.00 178.15 177.19 1c41 h GLU 31 N 0.14 -0.37 -0.98 2.37 4.22 -1.16 0.34 114.58 119.15 1c41 h GLU 31 Ca 0.05 0.03 0.10 0.00 0.08 0.00 0.00 59.36 59.61 1c41 h GLU 31 Cb 0.04 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 1c41 h GLU 31 CO -0.01 -0.25 0.63 -1.35 -2.18 0.00 0.00 179.01 175.85 1c41 h PRO 32 N -0.38 0.99 0.54 0.92 0.11 -1.75 0.26 132.00 132.69 1c41 h PRO 32 Ca 0.05 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.07 1c41 h PRO 32 Cb 0.45 -0.22 0.01 0.00 0.11 0.00 0.00 31.00 31.34 1c41 h PRO 32 CO -0.18 0.66 -0.26 -0.07 -0.21 0.00 0.00 178.00 177.94 1c41 h LEU 33 N 1.02 -0.61 -0.81 2.35 3.38 -0.99 -1.92 115.31 117.73 1c41 h LEU 33 Ca 0.46 -0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.50 1c41 h LEU 33 Cb 0.38 0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.20 1c41 h LEU 33 CO -0.22 -0.26 0.41 0.25 0.09 0.00 0.00 178.44 178.71 1c41 h LEU 34 N -1.01 0.50 0.06 1.67 5.85 0.06 -0.80 115.31 121.64 1c41 h LEU 34 Ca -0.07 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1c41 h LEU 34 Cb 0.63 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1c41 h LEU 34 CO 0.12 0.23 -0.16 0.00 -0.34 0.00 0.00 178.44 178.29 1c41 h ALA 35 N 1.52 -0.24 -0.77 1.25 0.00 -0.45 0.98 119.26 121.54 1c41 h ALA 35 Ca 0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 1c41 h ALA 35 Cb 0.56 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1c41 h ALA 35 CO -0.34 -0.67 0.42 0.78 0.00 0.00 0.00 179.25 179.43 1c41 h GLY 36 N -0.30 1.16 0.90 0.00 0.00 -0.47 0.37 103.07 104.73 1c41 h GLY 36 Ca 0.04 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.75 1c41 h GLY 36 CO -0.12 0.51 -0.13 0.00 0.00 0.00 0.00 176.54 176.80 1c41 h THR 37 N 1.07 1.29 -0.56 4.70 1.03 -0.89 -2.13 112.91 117.42 1c41 h THR 37 Ca 0.27 -1.23 -0.02 0.00 -0.01 0.00 0.00 66.41 65.43 1c41 h THR 37 Cb 0.05 1.47 -0.03 0.00 -1.07 0.00 0.00 68.15 68.57 1c41 h THR 37 CO -0.04 0.39 0.28 0.50 -0.01 0.00 0.00 175.52 176.64 1c41 h LYS 38 N 0.36 0.80 0.00 0.00 3.64 -0.62 -1.85 116.57 118.91 1c41 h LYS 38 Ca 0.07 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1c41 h LYS 38 Cb 0.65 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1c41 h LYS 38 CO 0.04 0.65 -0.27 0.00 -2.27 0.00 0.00 179.45 177.60 1c41 h ALA 39 N 1.11 -0.73 -0.51 5.00 0.00 -0.79 -1.14 119.26 122.21 1c41 h ALA 39 Ca 0.19 -0.04 0.15 0.00 0.00 0.00 0.00 54.91 55.21 1c41 h ALA 39 Cb 0.10 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1c41 h ALA 39 CO -0.03 -0.81 0.41 0.87 0.00 0.00 0.00 179.25 179.70 1c41 h LYS 40 N -0.34 0.00 0.59 0.00 1.79 -1.26 0.87 116.57 118.21 1c41 h LYS 40 Ca 0.01 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 1c41 h LYS 40 Cb 0.37 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.02 1c41 h LYS 40 CO -0.18 0.00 -0.28 -0.07 -1.08 0.00 0.00 179.45 177.84 1c41 h LEU 41 N 0.00 -0.67 -0.57 2.94 3.38 -0.36 -1.32 115.31 118.71 1c41 h LEU 41 Ca 0.24 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.25 1c41 h LEU 41 Cb 1.06 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 1c41 h LEU 41 CO -0.00 -0.39 0.29 -0.07 0.09 0.00 0.00 178.44 178.35 1c41 h LEU 42 N -0.93 0.40 -1.98 1.67 3.38 -0.59 0.11 115.31 117.37 1c41 h LEU 42 Ca -0.08 0.04 0.06 0.00 0.09 0.00 0.00 57.88 57.99 1c41 h LEU 42 Cb 0.65 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1c41 h LEU 42 CO 0.13 0.27 0.39 0.00 0.09 0.00 0.00 178.44 179.32 1c41 h ALA 43 N 1.32 1.76 -0.37 1.53 0.00 -0.65 0.77 119.26 123.61 1c41 h ALA 43 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1c41 h ALA 43 Cb 0.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1c41 h ALA 43 CO -0.19 -0.50 0.00 0.00 0.00 0.00 0.00 179.25 178.56 1c41 n GLY 45 N 1.47 0.67 3.71 0.00 0.00 0.27 -4.36 105.19 106.94 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 3.31 0.15 1.61 1.01 -0.98 -4.08 120.40 119.16 1c41 s VAL 46 Ca 0.00 0.88 -0.31 0.00 0.00 0.00 0.00 61.98 62.56 1c41 s VAL 46 Cb 0.00 -3.57 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 1c41 s VAL 46 CO 0.00 0.05 1.34 -0.54 0.00 0.00 0.00 175.10 175.95 1c41 s LYS 47 N 1.52 4.36 0.35 2.72 1.02 -1.26 -4.26 119.74 124.18 1c41 s LYS 47 Ca 0.66 2.04 0.16 0.00 0.02 0.00 0.00 55.97 58.85 1c41 s LYS 47 Cb -0.37 -3.23 1.15 0.00 -0.52 0.00 0.00 37.83 34.86 1c41 s LYS 47 CO 0.30 -0.34 1.64 1.49 -0.92 0.00 0.00 175.35 177.51 1c41 h GLU 48 N 6.19 0.23 0.00 1.68 4.57 -1.96 0.84 114.58 126.13 1c41 h GLU 48 Ca -0.43 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 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 0.82 0.15 0.00 -1.13 -1.18 0.00 0.00 179.01 177.67 1c41 n SER 49 N -5.11 0.68 -1.23 1.04 3.41 -1.26 -2.79 113.62 108.36 1c41 n SER 49 Ca 0.33 0.61 0.09 0.00 -0.26 0.00 0.00 58.87 59.65 1c41 n SER 49 Cb 1.06 -0.78 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 -2.19 3.59 -4.20 4.04 3.02 0.29 -2.33 115.26 117.49 1c41 n ASN 50 Ca 0.04 -2.14 -0.36 0.00 -0.03 0.00 0.00 54.58 52.08 1c41 n ASN 50 Cb 0.32 -0.46 -0.12 0.00 -0.61 0.00 0.00 39.78 38.91 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 -1.42 3.39 -0.06 2.41 1.01 -1.12 -1.00 121.20 124.41 1c41 s ILE 51 Ca 0.42 -1.47 -0.13 0.00 0.00 0.00 0.00 60.65 59.46 1c41 s ILE 51 Cb 0.24 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.62 1c41 s ILE 51 CO 0.25 -0.30 0.34 -0.69 0.00 0.00 0.00 174.94 174.54 1c41 s VAL 52 N 1.28 5.18 -0.17 2.92 1.01 -0.14 -5.00 120.40 125.49 1c41 s VAL 52 Ca -0.00 0.67 -0.04 0.00 0.00 0.00 0.00 61.98 62.61 1c41 s VAL 52 Cb -0.21 -3.64 0.06 0.00 0.00 0.00 0.00 36.38 32.59 1c41 s VAL 52 CO -0.00 0.54 0.07 -0.69 0.00 0.00 0.00 175.10 175.02 1c41 s VAL 53 N -0.72 0.05 0.29 2.92 1.01 -1.26 -0.20 120.40 122.49 1c41 s VAL 53 Ca 0.21 -0.20 0.10 0.00 0.00 0.00 0.00 61.98 62.09 1c41 s VAL 53 Cb -0.15 -0.64 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 1c41 s VAL 53 CO 0.10 -0.23 -0.15 -1.10 0.00 0.00 0.00 175.10 173.72 1c41 s GLN 54 N 2.08 1.66 0.35 2.72 -0.21 -0.06 -5.00 119.66 121.20 1c41 s GLN 54 Ca 0.02 -1.79 0.05 0.00 0.02 0.00 0.00 55.36 53.66 1c41 s GLN 54 Cb -0.16 -1.61 -0.07 0.00 1.00 0.00 0.00 33.01 32.17 1c41 s GLN 54 CO -0.08 0.23 0.02 -1.54 -2.12 0.00 0.00 175.29 171.80 1c41 s SER 55 N -3.50 3.03 0.10 5.90 1.04 -1.26 -1.77 113.70 117.23 1c41 s SER 55 Ca 0.30 -1.35 -0.07 0.00 0.48 0.00 0.00 55.95 55.30 1c41 s SER 55 Cb -0.02 -0.22 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 1c41 s SER 55 CO 0.14 -0.51 0.17 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 -0.52 -4.90 120.40 109.93 1c41 s VAL 56 Ca 0.35 -1.32 -0.27 0.00 -1.81 0.00 0.00 61.98 58.93 1c41 s VAL 56 Cb 0.09 -1.47 -0.15 0.00 0.56 0.00 0.00 36.38 35.41 1c41 s VAL 56 CO 0.16 -0.63 1.38 1.55 -0.31 0.00 0.00 175.10 177.25 1c41 h PRO 57 N 2.77 -0.93 -5.19 4.82 0.13 -1.93 -0.59 132.00 131.07 1c41 h PRO 57 Ca -0.34 0.06 -0.68 0.00 -0.87 0.00 0.00 66.00 64.18 1c41 h PRO 57 Cb 1.20 0.21 -0.13 0.00 0.13 0.00 0.00 31.00 32.41 1c41 h PRO 57 CO 0.56 -0.62 -0.51 0.20 -0.23 0.00 0.00 178.00 177.40 1c41 s GLY 58 N -1.75 3.02 0.42 1.56 0.00 -1.26 -0.93 107.32 108.38 1c41 s GLY 58 Ca -0.14 -0.38 0.12 0.00 0.00 0.00 0.00 44.72 44.32 1c41 s GLY 58 CO 0.42 -2.19 1.95 1.76 0.00 0.00 0.00 173.10 175.05 1c41 h SER 59 N 1.36 0.09 -0.54 1.64 0.02 -1.94 -2.47 113.55 111.72 1c41 h SER 59 Ca -0.44 -0.02 0.10 0.00 -0.84 0.00 0.00 61.79 60.60 1c41 h SER 59 Cb 1.31 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 1c41 h SER 59 CO 0.74 0.27 0.37 -0.25 -1.14 0.00 0.00 176.83 176.81 1c41 h TRP 60 N 0.09 0.30 0.00 3.45 2.91 -1.96 0.12 115.95 120.87 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 0.36 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 28.91 1c41 h TRP 60 CO 0.00 0.14 0.00 0.93 -1.03 0.00 0.00 178.44 178.48 1c41 h GLU 61 N 0.28 0.00 -0.02 2.65 3.07 -1.85 -3.37 114.58 115.33 1c41 h GLU 61 Ca 0.25 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.13 1c41 h GLU 61 Cb 0.61 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.48 1c41 h GLU 61 CO -0.05 0.00 -0.38 -0.07 -1.40 0.00 0.00 179.01 177.10 1c41 h LEU 62 N 0.00 -1.19 -0.40 1.33 4.07 -0.81 0.99 115.31 119.30 1c41 h LEU 62 Ca 0.00 0.14 0.05 0.00 0.08 0.00 0.00 57.88 58.15 1c41 h LEU 62 Cb 0.82 0.46 -0.05 0.00 1.08 0.00 0.00 40.66 42.97 1c41 h LEU 62 CO 0.00 -0.37 0.12 1.55 -1.08 0.00 0.00 178.44 178.67 1c41 h PRO 63 N -0.46 0.27 -0.70 1.13 0.13 -1.73 0.13 132.00 130.77 1c41 h PRO 63 Ca 0.01 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1c41 h PRO 63 Cb 0.51 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.54 1c41 h PRO 63 CO -0.27 0.18 0.36 0.97 -0.23 0.00 0.00 178.00 179.01 1c41 h ILE 64 N 0.27 1.22 -0.52 -3.56 6.09 -1.75 -0.49 117.51 118.77 1c41 h ILE 64 Ca 0.19 -0.59 -0.03 0.00 -1.37 0.00 0.00 64.86 63.06 1c41 h ILE 64 Cb 0.19 0.33 -0.02 0.00 0.47 0.00 0.00 36.82 37.79 1c41 h ILE 64 CO -0.21 0.25 0.20 0.00 -3.07 0.00 0.00 178.15 175.32 1c41 h ALA 65 N 1.18 0.68 -0.56 0.18 0.00 -0.32 -1.62 119.26 118.80 1c41 h ALA 65 Ca 0.24 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1c41 h ALA 65 Cb 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1c41 h ALA 65 CO -0.04 0.30 0.09 0.28 0.00 0.00 0.00 179.25 179.88 1c41 h VAL 66 N 0.70 1.25 -0.66 0.00 2.07 -0.37 0.24 116.25 119.48 1c41 h VAL 66 Ca 0.17 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.74 1c41 h VAL 66 Cb 0.21 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1c41 h VAL 66 CO -0.01 0.35 0.43 -0.61 0.02 0.00 0.00 177.57 177.75 1c41 h GLN 67 N 0.81 0.85 -0.05 1.57 4.15 -0.85 -2.01 115.11 119.58 1c41 h GLN 67 Ca 0.17 -0.05 -0.21 0.00 0.77 0.00 0.00 58.65 59.32 1c41 h GLN 67 Cb 0.41 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 27.91 1c41 h GLN 67 CO 0.01 0.57 -0.85 0.00 -1.93 0.00 0.00 178.83 176.63 1c41 h ARG 68 N 0.88 0.49 0.41 1.69 2.47 -1.13 -1.82 114.38 117.37 1c41 h ARG 68 Ca 0.25 -0.46 -0.02 0.00 -1.26 0.00 0.00 59.98 58.49 1c41 h ARG 68 Cb -0.08 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1c41 h ARG 68 CO -0.06 1.10 -0.21 1.25 0.56 0.00 0.00 179.97 182.60 1c41 h LEU 69 N 0.31 -0.51 -0.26 3.04 6.46 -0.74 0.12 115.31 123.73 1c41 h LEU 69 Ca -0.06 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 57.76 1c41 h LEU 69 Cb 1.46 0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 41.49 1c41 h LEU 69 CO 0.15 -0.35 0.02 0.22 -0.62 0.00 0.00 178.44 177.86 1c41 h TYR 70 N -0.57 0.02 -0.76 1.25 3.20 -1.42 -1.43 116.97 117.25 1c41 h TYR 70 Ca -0.05 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.01 1c41 h TYR 70 Cb 0.45 0.03 -0.13 0.00 1.54 0.00 0.00 36.73 38.62 1c41 h TYR 70 CO -0.06 -0.02 -0.01 1.03 -1.64 0.00 0.00 178.16 177.46 1c41 h SER 71 N 0.10 -0.37 0.22 -2.11 0.87 -0.86 -0.94 113.55 110.46 1c41 h SER 71 Ca 0.12 0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 1c41 h SER 71 Cb 0.15 0.35 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1c41 h SER 71 CO -0.19 -0.19 -0.11 0.00 -0.53 0.00 0.00 176.83 175.82 1c41 h ALA 72 N 1.71 -0.29 -0.58 6.23 0.00 0.22 -2.39 119.26 124.16 1c41 h ALA 72 Ca 0.41 -0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.39 1c41 h ALA 72 Cb 0.72 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1c41 h ALA 72 CO -0.67 -0.62 0.60 0.66 0.00 0.00 0.00 179.25 179.22 1c41 h SER 73 N -0.39 0.00 -0.09 0.00 4.64 -0.27 0.96 113.55 118.41 1c41 h SER 73 Ca -0.03 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.13 1c41 h SER 73 Cb 0.30 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1c41 h SER 73 CO 0.05 0.00 -0.56 1.56 -0.87 0.00 0.00 176.83 177.01 1c41 h GLN 74 N 0.00 0.53 -0.03 4.77 4.20 -0.86 -3.09 115.11 120.63 1c41 h GLN 74 Ca 0.27 -0.46 0.01 0.00 0.06 0.00 0.00 58.65 58.54 1c41 h GLN 74 Cb 1.47 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 29.35 1c41 h GLN 74 CO -0.00 1.09 0.08 -0.07 -0.67 0.00 0.00 178.83 179.26 1c41 h LEU 75 N 0.13 0.00 0.00 1.46 3.38 -0.69 -3.46 115.31 116.12 1c41 h LEU 75 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1c41 h LEU 75 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1c41 h LEU 75 CO 0.12 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.65 1c41 n GLN 76 N -3.35 0.00 -1.07 1.13 6.02 -1.15 -5.13 117.38 113.83 1c41 n GLN 76 Ca -0.02 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.54 1c41 n GLN 76 Cb 0.16 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.35 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 0.73 -0.83 1.08 3.41 -0.98 -4.81 113.62 112.21 1c41 n SER 107 Ca 0.00 0.71 0.01 0.00 -0.26 0.00 0.00 58.87 59.33 1c41 n SER 107 Cb 0.00 -0.57 -0.01 0.00 -0.26 0.00 0.00 64.21 63.37 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 2.88 -0.25 0.00 6.66 -2.24 -1.26 -5.04 114.28 115.03 1c41 n THR 108 Ca 0.23 0.16 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 1c41 n THR 108 Cb -0.04 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 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 -2.71 1.41 3.65 3.38 0.00 -1.26 -4.98 105.19 104.68 1c41 n GLY 109 Ca -0.01 -1.38 -0.44 0.00 0.00 0.00 0.00 46.02 44.19 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 2.66 1.82 -1.64 1.61 -0.04 -1.19 -4.87 135.00 133.36 1c41 n PRO 110 Ca 0.00 0.64 -0.38 0.00 -0.04 0.00 0.00 63.50 63.72 1c41 n PRO 110 Cb 0.00 -2.19 0.05 0.00 -0.04 0.00 0.00 33.50 31.32 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 0.91 1.10 0.24 0.54 3.72 -1.26 -4.87 117.46 117.84 1c41 n PHE 111 Ca 0.09 0.45 0.11 0.00 -0.05 0.00 0.00 57.45 58.05 1c41 n PHE 111 Cb 0.33 -2.18 -0.01 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 -0.73 0.64 -3.52 4.37 8.00 0.01 -4.95 116.55 120.38 1c41 n ASP 112 Ca 0.13 0.13 -0.16 0.00 0.71 0.00 0.00 54.79 55.59 1c41 n ASP 112 Cb 0.46 0.75 -0.05 0.00 -0.02 0.00 0.00 41.12 42.26 1c41 n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1c41 s ALA 113 N -3.33 -1.77 0.11 2.24 0.00 -1.25 -4.31 121.76 113.45 1c41 s ALA 113 Ca -0.00 1.25 0.07 0.00 0.00 0.00 0.00 51.96 53.28 1c41 s ALA 113 Cb 0.12 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1c41 s ALA 113 CO 0.81 -0.42 -0.17 -0.51 0.00 0.00 0.00 175.76 175.47 1c41 s LEU 114 N -1.39 2.34 -0.06 0.00 1.43 -0.00 -2.21 118.68 118.78 1c41 s LEU 114 Ca -0.08 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.31 1c41 s LEU 114 Cb -0.00 -0.72 0.02 0.00 0.03 0.00 0.00 46.19 45.52 1c41 s LEU 114 CO 0.06 -0.03 -0.08 -0.63 0.23 0.00 0.00 176.35 175.89 1c41 s ILE 115 N -1.56 0.83 -0.22 -0.59 1.01 -0.18 0.59 121.20 121.08 1c41 s ILE 115 Ca 0.07 -0.28 -0.04 0.00 0.00 0.00 0.00 60.65 60.39 1c41 s ILE 115 Cb -0.08 -0.81 -0.01 0.00 0.01 0.00 0.00 42.46 41.57 1c41 s ILE 115 CO 0.04 0.29 -0.02 0.00 0.00 0.00 0.00 174.94 175.25 1c41 s ALA 116 N 0.90 2.90 -0.16 9.38 0.00 -0.62 -1.58 121.76 132.59 1c41 s ALA 116 Ca -0.11 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1c41 s ALA 116 Cb -0.15 -1.75 -0.00 0.00 0.00 0.00 0.00 23.12 21.22 1c41 s ALA 116 CO 0.01 -0.35 -0.16 0.42 0.00 0.00 0.00 175.76 175.68 1c41 s ILE 117 N 1.35 2.63 0.12 0.00 1.01 -0.47 0.04 121.20 125.88 1c41 s ILE 117 Ca 0.04 -0.78 -0.14 0.00 0.00 0.00 0.00 60.65 59.77 1c41 s ILE 117 Cb -0.14 -2.11 0.02 0.00 0.01 0.00 0.00 42.46 40.24 1c41 s ILE 117 CO -0.01 0.52 0.34 -0.83 0.00 0.00 0.00 174.94 174.96 1c41 s GLY 118 N 0.84 -0.14 -0.27 6.18 0.00 -0.61 -1.01 107.32 112.31 1c41 s GLY 118 Ca -0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 44.72 44.40 1c41 s GLY 118 CO -0.01 -0.47 0.09 0.14 0.00 0.00 0.00 173.10 172.86 1c41 s VAL 119 N -3.83 0.42 -0.12 1.40 1.01 -1.26 -0.66 120.40 117.36 1c41 s VAL 119 Ca 0.04 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 1c41 s VAL 119 Cb 0.03 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 1c41 s VAL 119 CO -0.11 -0.55 0.21 -0.76 0.00 0.00 0.00 175.10 173.88 1c41 s LEU 120 N 1.87 4.35 -0.05 3.92 2.01 0.19 -4.79 118.68 126.17 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 -2.20 0.02 0.00 0.01 0.00 0.00 46.19 43.85 1c41 s LEU 120 CO -0.24 0.30 -0.07 -0.63 1.01 0.00 0.00 176.35 176.72 1c41 s ILE 121 N -0.54 0.74 0.12 -0.59 1.01 -1.26 -1.23 121.20 119.46 1c41 s ILE 121 Ca 0.15 -0.26 -0.35 0.00 0.00 0.00 0.00 60.65 60.19 1c41 s ILE 121 Cb -0.13 -0.72 -0.16 0.00 0.01 0.00 0.00 42.46 41.47 1c41 s ILE 121 CO 0.04 0.27 1.39 1.17 0.00 0.00 0.00 174.94 177.81 1c41 n LYS 122 N 3.89 1.45 0.00 2.79 0.00 -0.76 -4.86 118.16 120.68 1c41 n LYS 122 Ca -0.24 0.52 0.00 0.00 0.00 0.00 0.00 58.31 58.59 1c41 n LYS 122 Cb 0.51 -2.19 0.00 0.00 0.00 0.00 0.00 35.03 33.35 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 2.72 2.22 0.06 3.14 0.00 -1.26 -4.94 105.19 107.13 1c41 n GLY 123 Ca 0.17 -1.81 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 -2.83 1.61 1.02 -1.26 -4.97 120.64 114.84 1c41 n GLU 124 Ca 0.00 -0.04 -0.15 0.00 -0.02 0.00 0.00 57.16 56.95 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 -2.49 0.00 1.61 2.62 -2.24 -1.26 -5.01 114.28 107.51 1c41 n THR 125 Ca -0.05 -1.31 0.07 0.00 -2.27 0.00 0.00 64.05 60.50 1c41 n THR 125 Cb 0.62 -0.27 0.33 0.00 -2.10 0.00 0.00 70.33 68.91 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 -1.33 1.33 -0.17 -0.78 2.81 -1.26 -4.05 117.12 113.66 1c41 n MET 126 Ca -0.00 -0.50 -0.01 0.00 -1.81 0.00 0.00 57.70 55.38 1c41 n MET 126 Cb 0.38 -1.26 0.08 0.00 -0.71 0.00 0.00 33.22 31.71 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 0.93 0.01 -0.21 2.03 6.17 -1.98 -2.12 115.15 119.99 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 0.21 0.08 -0.07 0.00 2.52 0.00 0.00 27.41 30.14 1c41 h HIS 127 CO 0.07 -0.11 -0.44 0.35 0.71 0.00 0.00 177.93 178.51 1c41 h PHE 128 N 0.14 -1.28 -0.54 5.26 3.57 -1.89 -1.90 116.94 120.31 1c41 h PHE 128 Ca 0.28 0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.77 1c41 h PHE 128 Cb 0.42 0.59 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 1c41 h PHE 128 CO -0.31 -0.48 0.09 1.05 -2.23 0.00 0.00 178.31 176.44 1c41 h GLU 129 N -0.46 0.84 0.00 1.11 9.09 -1.75 -1.03 114.58 122.38 1c41 h GLU 129 Ca 0.09 -0.19 -0.10 0.00 0.05 0.00 0.00 59.36 59.21 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 -0.45 0.78 -0.48 1.88 0.05 0.00 0.00 179.01 180.79 1c41 h TYR 130 N 0.80 0.00 0.17 2.06 0.05 -1.07 -2.16 116.97 116.83 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 0.35 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.11 1c41 h TYR 130 CO 0.02 0.48 -1.17 0.82 -1.05 0.00 0.00 178.16 177.26 1c41 h ILE 131 N 0.00 1.33 -0.35 -2.88 2.04 -1.20 -3.09 117.51 113.36 1c41 h ILE 131 Ca -0.00 -2.56 0.02 0.00 1.00 0.00 0.00 64.86 63.31 1c41 h ILE 131 Cb 0.92 3.05 -0.02 0.00 -0.74 0.00 0.00 36.82 40.03 1c41 h ILE 131 CO 0.06 0.75 0.20 0.00 0.00 0.00 0.00 178.15 179.16 1c41 h ALA 132 N 0.08 0.44 -0.68 1.87 0.00 -1.15 0.45 119.26 120.27 1c41 h ALA 132 Ca -0.22 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1c41 h ALA 132 Cb 1.85 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.52 1c41 h ALA 132 CO 0.18 -0.16 0.17 0.22 0.00 0.00 0.00 179.25 179.66 1c41 h ASP 133 N 0.40 1.01 -0.02 0.00 3.58 -1.52 -0.51 116.42 119.36 1c41 h ASP 133 Ca 0.14 -0.20 -0.25 0.00 0.42 0.00 0.00 57.03 57.13 1c41 h ASP 133 Cb 0.02 -0.27 0.02 0.00 1.72 0.00 0.00 39.33 40.82 1c41 h ASP 133 CO -0.08 0.96 -0.98 0.28 -2.88 0.00 0.00 179.24 176.55 1c41 h SER 134 N 1.02 0.90 -0.58 2.28 0.02 -1.41 -2.08 113.55 113.70 1c41 h SER 134 Ca 0.22 -0.72 -0.08 0.00 -0.84 0.00 0.00 61.79 60.36 1c41 h SER 134 Cb 0.34 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1c41 h SER 134 CO -0.00 1.50 0.06 0.58 -1.14 0.00 0.00 176.83 177.83 1c41 h VAL 135 N 0.38 1.26 0.57 2.27 2.07 -0.86 0.40 116.25 122.35 1c41 h VAL 135 Ca -0.12 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 1c41 h VAL 135 Cb 1.64 0.72 0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1c41 h VAL 135 CO 0.19 0.39 -0.27 0.28 0.02 0.00 0.00 177.57 178.18 1c41 h SER 136 N 0.94 -0.65 -0.47 0.57 0.02 -1.06 -0.14 113.55 112.76 1c41 h SER 136 Ca 0.18 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 1c41 h SER 136 Cb 0.46 0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 1c41 h SER 136 CO 0.02 -0.42 0.18 0.45 -1.14 0.00 0.00 176.83 175.92 1c41 h HIS 137 N -0.83 0.78 -0.25 3.45 3.86 -1.29 -1.57 115.15 119.30 1c41 h HIS 137 Ca -0.08 -0.05 0.04 0.00 -1.16 0.00 0.00 60.37 59.12 1c41 h HIS 137 Cb 0.61 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.81 1c41 h HIS 137 CO -0.02 0.62 0.04 0.78 0.86 0.00 0.00 177.93 180.21 1c41 h GLY 138 N 0.91 0.27 0.95 2.45 0.00 0.10 0.56 103.07 108.31 1c41 h GLY 138 Ca 0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 1c41 h GLY 138 CO -0.01 -0.02 0.01 1.41 0.00 0.00 0.00 176.54 177.93 1c41 h LEU 139 N 0.13 0.69 -1.35 3.11 3.38 -0.72 -1.35 115.31 119.20 1c41 h LEU 139 Ca 0.11 -0.30 0.08 0.00 0.09 0.00 0.00 57.88 57.87 1c41 h LEU 139 Cb 0.12 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1c41 h LEU 139 CO -0.16 0.82 0.51 -0.03 0.09 0.00 0.00 178.44 179.67 1c41 h MET 140 N 0.54 0.73 0.12 1.13 4.05 -0.98 -1.29 114.93 119.23 1c41 h MET 140 Ca 0.11 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.49 1c41 h MET 140 Cb 0.46 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 1c41 h MET 140 CO 0.02 0.48 -0.06 -0.09 0.23 0.00 0.00 176.91 177.49 1c41 h ARG 141 N 0.75 -0.16 -0.98 0.39 2.43 -0.43 -2.38 114.38 114.00 1c41 h ARG 141 Ca 0.35 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.71 1c41 h ARG 141 Cb 0.37 0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 29.87 1c41 h ARG 141 CO -0.13 0.28 0.61 0.28 -1.51 0.00 0.00 179.97 179.50 1c41 h VAL 142 N -0.68 0.75 0.82 0.20 2.07 -0.92 0.57 116.25 119.05 1c41 h VAL 142 Ca -0.02 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1c41 h VAL 142 Cb 0.51 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1c41 h VAL 142 CO 0.03 0.13 -0.45 -0.61 0.02 0.00 0.00 177.57 176.69 1c41 h GLN 143 N 0.73 -1.13 -0.32 1.57 4.15 -1.20 0.62 115.11 119.52 1c41 h GLN 143 Ca 0.53 0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.96 1c41 h GLN 143 Cb 0.87 0.26 -0.02 0.00 0.21 0.00 0.00 27.48 28.80 1c41 h GLN 143 CO -0.30 -0.75 -0.11 -0.07 -1.93 0.00 0.00 178.83 175.66 1c41 h LEU 144 N -1.17 0.53 0.42 -2.39 3.38 -0.80 0.23 115.31 115.51 1c41 h LEU 144 Ca -0.11 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1c41 h LEU 144 Cb 0.92 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1c41 h LEU 144 CO 0.14 0.67 -0.20 0.44 0.09 0.00 0.00 178.44 179.58 1c41 h ASP 145 N 0.51 -0.48 1.30 -0.43 5.19 0.15 -3.19 116.42 119.46 1c41 h ASP 145 Ca 0.09 -0.06 -0.05 0.00 -0.62 0.00 0.00 57.03 56.39 1c41 h ASP 145 Cb 0.49 0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.12 1c41 h ASP 145 CO 0.03 -0.23 -0.24 0.00 -3.12 0.00 0.00 179.24 175.68 1c41 h THR 146 N -0.73 0.49 -0.11 0.35 1.03 -0.80 -3.47 112.91 109.66 1c41 h THR 146 Ca -0.06 -1.35 -0.05 0.00 -0.01 0.00 0.00 66.41 64.94 1c41 h THR 146 Cb 0.52 1.97 -0.02 0.00 -1.07 0.00 0.00 68.15 69.55 1c41 h THR 146 CO 0.10 0.24 -0.04 0.61 -0.01 0.00 0.00 175.52 176.41 1c41 n GLY 147 N 0.62 0.54 3.29 2.99 0.00 0.78 -5.00 105.19 108.41 1c41 n GLY 147 Ca 0.01 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.90 2.53 0.27 1.61 1.01 -1.10 -5.03 120.40 117.78 1c41 s VAL 148 Ca 0.00 -0.85 -0.31 0.00 0.00 0.00 0.00 61.98 60.82 1c41 s VAL 148 Cb 0.00 -2.01 -0.12 0.00 0.00 0.00 0.00 36.38 34.24 1c41 s VAL 148 CO 0.00 0.54 1.58 -2.65 0.00 0.00 0.00 175.10 174.57 1c41 n PRO 149 N 3.52 2.57 -3.98 2.72 -0.02 -1.26 -4.45 135.00 134.09 1c41 n PRO 149 Ca -0.19 0.92 -0.31 0.00 -2.02 0.00 0.00 63.50 61.90 1c41 n PRO 149 Cb 0.53 -2.68 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 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 0.19 1.83 0.12 -1.45 1.01 -1.26 -0.82 120.40 120.03 1c41 s VAL 150 Ca 0.67 -1.64 -0.31 0.00 0.00 0.00 0.00 61.98 60.70 1c41 s VAL 150 Cb -0.53 -2.14 -0.09 0.00 0.00 0.00 0.00 36.38 33.62 1c41 s VAL 150 CO 0.46 -0.26 1.51 -0.63 0.00 0.00 0.00 175.10 176.18 1c41 s ILE 151 N 1.21 2.97 -1.15 2.22 -1.09 0.20 -4.87 121.20 120.68 1c41 s ILE 151 Ca -0.01 0.65 -0.20 0.00 -2.23 0.00 0.00 60.65 58.85 1c41 s ILE 151 Cb -0.19 -3.41 0.07 0.00 -1.58 0.00 0.00 42.46 37.34 1c41 s ILE 151 CO -0.08 0.04 1.57 0.12 -1.23 0.00 0.00 174.94 175.36 1c41 s PHE 152 N 1.43 2.69 -0.71 3.97 5.36 -1.26 -1.58 117.98 127.88 1c41 s PHE 152 Ca 0.69 -1.25 -0.02 0.00 -0.96 0.00 0.00 56.93 55.38 1c41 s PHE 152 Cb -0.40 -4.70 0.43 0.00 -0.34 0.00 0.00 43.02 38.00 1c41 s PHE 152 CO 0.31 -1.85 2.04 0.41 -1.46 0.00 0.00 175.22 174.67 1c41 n GLY 153 N 6.09 5.79 3.46 13.12 0.00 0.11 -4.93 105.19 128.83 1c41 n GLY 153 Ca 0.40 -2.35 -0.35 0.00 0.00 0.00 0.00 46.02 43.73 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 -4.88 3.96 -0.15 1.61 1.01 -1.23 -1.58 120.40 119.14 1c41 s VAL 154 Ca 0.62 -0.32 -0.13 0.00 0.00 0.00 0.00 61.98 62.15 1c41 s VAL 154 Cb 0.49 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 1c41 s VAL 154 CO -0.11 0.44 0.27 -0.76 0.00 0.00 0.00 175.10 174.94 1c41 s LEU 155 N 0.83 4.26 -0.67 3.92 1.43 0.17 -4.92 118.68 123.70 1c41 s LEU 155 Ca 0.00 0.49 0.04 0.00 -1.03 0.00 0.00 54.13 53.64 1c41 s LEU 155 Cb -0.14 -2.33 0.16 0.00 0.03 0.00 0.00 46.19 43.91 1c41 s LEU 155 CO 0.02 0.15 0.45 0.42 0.23 0.00 0.00 176.35 177.62 1c41 s THR 156 N 0.25 2.98 0.34 5.49 -4.23 -1.26 0.53 115.64 119.75 1c41 s THR 156 Ca 0.16 -3.92 0.07 0.00 -1.18 0.00 0.00 61.69 56.81 1c41 s THR 156 Cb -0.13 -2.97 -0.01 0.00 1.34 0.00 0.00 72.50 70.73 1c41 s THR 156 CO 0.04 -0.95 0.43 -0.69 -0.54 0.00 0.00 174.62 172.91 1c41 s VAL 157 N -1.07 3.90 -0.04 2.29 1.01 -0.36 -5.02 120.40 121.11 1c41 s VAL 157 Ca 0.23 -1.09 0.13 0.00 0.00 0.00 0.00 61.98 61.25 1c41 s VAL 157 Cb -0.11 -3.34 -0.20 0.00 0.00 0.00 0.00 36.38 32.73 1c41 s VAL 157 CO -0.11 -0.15 0.25 0.18 0.00 0.00 0.00 175.10 175.27 1c41 n LEU 158 N -1.58 0.00 -3.93 3.92 4.77 -1.26 -1.83 117.00 117.09 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 0.00 177.39 176.70 1c41 s THR 159 N -2.82 0.10 0.22 -5.08 -4.23 -1.26 -4.44 115.64 98.13 1c41 s THR 159 Ca -0.05 -0.85 -0.10 0.00 -1.18 0.00 0.00 61.69 59.50 1c41 s THR 159 Cb 0.08 -0.44 0.23 0.00 1.34 0.00 0.00 72.50 73.70 1c41 s THR 159 CO 0.55 -0.47 1.65 0.44 -0.54 0.00 0.00 174.62 176.25 1c41 h ASP 160 N 4.33 -0.34 -0.95 3.99 5.19 -1.98 -0.47 116.42 126.19 1c41 h ASP 160 Ca -0.32 0.17 0.11 0.00 -0.62 0.00 0.00 57.03 56.38 1c41 h ASP 160 Cb 1.20 0.31 -0.07 0.00 0.18 0.00 0.00 39.33 40.94 1c41 h ASP 160 CO 0.42 -0.15 0.60 0.44 -3.12 0.00 0.00 179.24 177.44 1c41 h ASP 161 N 0.09 0.84 -0.77 6.45 3.32 -1.99 -0.45 116.42 123.93 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 0.57 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 1c41 h ASP 161 CO -0.59 0.47 0.41 1.56 -1.72 0.00 0.00 179.24 179.37 1c41 h GLN 162 N 0.91 1.08 0.38 3.56 4.20 -1.50 0.21 115.11 123.94 1c41 h GLN 162 Ca 0.46 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 59.02 1c41 h GLN 162 Cb 0.49 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1c41 h GLN 162 CO -0.22 0.81 -0.20 0.00 -0.67 0.00 0.00 178.83 178.55 1c41 h ALA 163 N 1.21 -0.52 -0.47 3.87 0.00 -0.91 -1.44 119.26 120.99 1c41 h ALA 163 Ca 0.27 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1c41 h ALA 163 Cb 0.05 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1c41 h ALA 163 CO -0.04 -0.80 0.06 0.87 0.00 0.00 0.00 179.25 179.34 1c41 h LYS 164 N -0.53 0.18 -0.44 0.00 1.57 -0.85 -0.47 116.57 116.04 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 0.41 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1c41 h LYS 164 CO 0.07 0.12 0.18 0.00 -0.57 0.00 0.00 179.45 179.25 1c41 h ALA 165 N 1.39 0.54 0.00 3.86 0.00 -0.38 -0.88 119.26 123.78 1c41 h ALA 165 Ca 0.24 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.19 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 -0.34 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 178.71 1c41 h ARG 166 N 0.37 0.00 -0.25 0.00 -0.00 -0.39 -2.51 114.38 111.59 1c41 h ARG 166 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.68 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 -1.89 2.45 -0.72 0.04 0.00 -0.27 -0.49 120.51 119.64 1c41 n ALA 167 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1c41 n ALA 167 Cb 0.23 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.78 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 1.41 1.16 0.34 0.00 0.00 -0.84 -4.48 105.19 102.77 1c41 n GLY 168 Ca 0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 0.35 -3.54 1.61 2.07 -1.51 -3.39 116.25 111.84 1c41 h VAL 169 Ca 0.00 0.00 -0.56 0.00 0.82 0.00 0.00 66.70 66.96 1c41 h VAL 169 Cb 0.00 0.35 0.17 0.00 -1.52 0.00 0.00 31.29 30.29 1c41 h VAL 169 CO 0.00 0.00 -0.01 -0.38 0.02 0.00 0.00 177.57 177.20 1c41 n ILE 170 N -5.42 3.03 -1.71 4.57 5.41 -1.23 -4.83 119.36 119.18 1c41 n ILE 170 Ca -0.08 -0.44 -0.43 0.00 1.00 0.00 0.00 62.75 62.79 1c41 n ILE 170 Cb 0.33 -1.03 -0.02 0.00 -0.71 0.00 0.00 39.64 38.21 1c41 n ILE 170 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1c41 n GLU 171 N -1.20 2.36 -2.56 0.38 1.02 -1.26 -1.85 120.64 117.53 1c41 n GLU 171 Ca 0.13 0.84 -0.18 0.00 -0.02 0.00 0.00 57.16 57.93 1c41 n GLU 171 Cb 0.49 -2.56 -0.00 0.00 -0.02 0.00 0.00 31.44 29.34 1c41 n GLU 171 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c41 n GLY 172 N 2.25 -0.50 3.79 0.62 0.00 -1.26 -4.96 105.19 105.12 1c41 n GLY 172 Ca 0.10 0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.17 5.77 -0.35 1.61 1.04 -0.77 -5.07 113.70 113.76 1c41 s SER 173 Ca 0.06 0.23 -0.28 0.00 0.48 0.00 0.00 55.95 56.45 1c41 s SER 173 Cb -0.03 -1.71 0.02 0.00 0.10 0.00 0.00 66.02 64.39 1c41 s SER 173 CO 0.08 0.33 1.03 -2.28 0.98 0.00 0.00 173.24 173.38 1c41 s HIS 174 N -1.09 3.09 -0.26 5.02 2.46 -1.26 -4.13 115.29 119.13 1c41 s HIS 174 Ca 0.19 1.00 -0.29 0.00 0.47 0.00 0.00 55.06 56.43 1c41 s HIS 174 Cb -0.12 -3.75 -0.01 0.00 -0.13 0.00 0.00 32.58 28.58 1c41 s HIS 174 CO 0.09 -0.83 1.37 1.21 -2.47 0.00 0.00 174.74 174.10 1c41 s ASN 175 N 1.81 6.65 0.55 9.88 3.84 -1.26 -3.86 114.94 132.55 1c41 s ASN 175 Ca 0.43 1.38 0.32 0.00 0.21 0.00 0.00 52.86 55.20 1c41 s ASN 175 Cb -0.12 -2.54 1.53 0.00 -0.55 0.00 0.00 41.25 39.58 1c41 s ASN 175 CO 0.18 -1.07 2.07 0.45 -2.79 0.00 0.00 177.10 175.94 1c41 h HIS 176 N 9.42 0.00 -0.97 0.43 3.86 -1.08 -2.84 115.15 123.97 1c41 h HIS 176 Ca -0.28 0.00 0.17 0.00 -1.16 0.00 0.00 60.37 59.10 1c41 h HIS 176 Cb 1.11 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 29.48 1c41 h HIS 176 CO 0.88 0.07 0.58 0.78 0.86 0.00 0.00 177.93 181.10 1c41 h GLY 177 N 1.26 1.69 0.57 2.45 0.00 -1.79 0.23 103.07 107.48 1c41 h GLY 177 Ca -0.00 -0.35 0.08 0.00 0.00 0.00 0.00 47.33 47.06 1c41 h GLY 177 CO 0.01 -0.03 0.38 0.83 0.00 0.00 0.00 176.54 177.73 1c41 h GLU 178 N 0.76 0.65 -0.52 4.80 5.08 -1.61 -0.62 114.58 123.13 1c41 h GLU 178 Ca 0.55 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.87 1c41 h GLU 178 Cb 0.80 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 1c41 h GLU 178 CO -0.37 0.43 0.33 -0.44 -1.00 0.00 0.00 179.01 177.96 1c41 h ASP 179 N 0.67 0.60 -0.41 1.42 3.32 -0.74 -1.66 116.42 119.62 1c41 h ASP 179 Ca 0.34 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 1c41 h ASP 179 Cb 0.29 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1c41 h ASP 179 CO -0.23 0.46 0.14 -0.50 -1.72 0.00 0.00 179.24 177.39 1c41 h TRP 180 N 0.70 0.65 -0.22 4.55 6.55 -0.39 0.89 115.95 128.68 1c41 h TRP 180 Ca 0.19 -0.06 -0.00 0.00 0.95 0.00 0.00 58.89 59.97 1c41 h TRP 180 Cb -0.05 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.05 1c41 h TRP 180 CO -0.03 0.59 0.13 0.78 -1.05 0.00 0.00 178.44 178.86 1c41 h GLY 181 N 0.52 0.31 0.49 1.49 0.00 -1.03 0.24 103.07 105.09 1c41 h GLY 181 Ca 0.13 -0.13 0.08 0.00 0.00 0.00 0.00 47.33 47.41 1c41 h GLY 181 CO -0.01 0.12 0.23 -2.00 0.00 0.00 0.00 176.54 174.88 1c41 h LEU 182 N 0.27 0.25 -0.61 3.11 5.85 -1.06 -1.80 115.31 121.32 1c41 h LEU 182 Ca 0.08 0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.74 1c41 h LEU 182 Cb 0.01 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1c41 h LEU 182 CO -0.02 0.16 -0.18 0.00 -0.34 0.00 0.00 178.44 178.07 1c41 h ALA 183 N 1.37 0.81 -0.52 1.25 0.00 -0.36 -2.59 119.26 119.23 1c41 h ALA 183 Ca 0.28 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.89 1c41 h ALA 183 Cb 0.30 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1c41 h ALA 183 CO -0.26 0.65 0.18 0.00 0.00 0.00 0.00 179.25 179.82 1c41 h ALA 184 N 0.99 0.64 0.27 0.00 0.00 0.29 -0.05 119.26 121.41 1c41 h ALA 184 Ca 0.12 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1c41 h ALA 184 Cb 0.72 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1c41 h ALA 184 CO 0.06 -0.22 -0.13 0.28 0.00 0.00 0.00 179.25 179.23 1c41 h VAL 185 N 0.35 0.76 -0.07 0.00 2.07 -1.26 0.35 116.25 118.46 1c41 h VAL 185 Ca 0.25 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1c41 h VAL 185 Cb 0.28 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1c41 h VAL 185 CO -0.26 0.05 -0.23 -0.08 0.02 0.00 0.00 177.57 177.06 1c41 h GLU 186 N -0.49 -0.32 -0.80 1.57 4.81 -1.09 -0.35 114.58 117.91 1c41 h GLU 186 Ca -0.04 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1c41 h GLU 186 Cb 0.37 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 1c41 h GLU 186 CO 0.06 -0.21 0.47 0.52 -0.73 0.00 0.00 179.01 179.12 1c41 h MET 187 N -0.33 1.08 -0.23 1.92 2.86 -0.98 0.12 114.93 119.37 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 0.45 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 1c41 h MET 187 CO -0.26 0.77 0.15 0.78 1.06 0.00 0.00 176.91 179.41 1c41 h GLY 188 N 1.12 0.33 0.98 8.32 0.00 -0.11 0.42 103.07 114.14 1c41 h GLY 188 Ca 0.29 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1c41 h GLY 188 CO -0.05 0.13 0.07 -2.08 0.00 0.00 0.00 176.54 174.61 1c41 h VAL 189 N 0.31 1.05 -0.58 4.60 2.07 -0.63 -2.39 116.25 120.68 1c41 h VAL 189 Ca 0.09 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1c41 h VAL 189 Cb -0.02 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1c41 h VAL 189 CO -0.02 0.05 0.38 0.03 0.02 0.00 0.00 177.57 178.03 1c41 h ARG 190 N 0.13 0.76 -0.42 1.57 3.08 -0.62 -2.51 114.38 116.38 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 0.01 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 29.82 1c41 h ARG 190 CO -0.01 0.50 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.29 1c41 h ARG 191 N 0.78 0.09 -0.22 0.04 2.43 0.06 -0.74 114.38 116.81 1c41 h ARG 191 Ca 0.21 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.43 1c41 h ARG 191 Cb -0.08 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.39 1c41 h ARG 191 CO -0.05 0.06 -0.18 0.00 -1.51 0.00 0.00 179.97 178.29 1c41 h ARG 192 N 0.09 -0.18 -0.73 0.20 3.08 -1.01 0.18 114.38 116.01 1c41 h ARG 192 Ca 0.21 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.30 1c41 h ARG 192 Cb 0.30 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.34 1c41 h ARG 192 CO -0.35 -0.12 0.46 -0.44 -1.07 0.00 0.00 179.97 178.45 1c41 h ASP 193 N -0.19 0.76 -0.57 7.04 3.32 -1.02 0.28 116.42 126.04 1c41 h ASP 193 Ca 0.13 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1c41 h ASP 193 Cb 0.38 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1c41 h ASP 193 CO -0.33 0.53 0.31 -0.50 -1.72 0.00 0.00 179.24 177.53 1c41 h TRP 194 N 0.90 0.78 0.00 4.55 6.55 -0.51 0.07 115.95 128.29 1c41 h TRP 194 Ca 0.29 -0.02 -0.00 0.00 0.95 0.00 0.00 58.89 60.11 1c41 h TRP 194 Cb 0.01 -0.25 -0.00 0.00 -0.86 0.00 0.00 29.16 28.06 1c41 h TRP 194 CO -0.04 0.57 -0.01 0.00 -1.05 0.00 0.00 178.44 177.92 1c41 h ALA 195 N 1.14 1.54 -0.20 1.49 0.00 0.46 0.27 119.26 123.96 1c41 h ALA 195 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1c41 h ALA 195 Cb 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1c41 h ALA 195 CO -0.03 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.23 1c41 n ALA 196 N -2.33 2.50 -1.08 0.00 0.00 -0.02 -4.90 120.51 114.68 1c41 n ALA 196 Ca -0.03 -0.54 -0.03 0.00 0.00 0.00 0.00 53.44 52.85 1c41 n ALA 196 Cb 0.09 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.46 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 1.11 0.53 3.76 0.00 0.00 0.96 -5.00 105.19 106.56 1c41 n GLY 197 Ca 0.15 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1c41 n GLY 197 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c41 s LYS 198 N -1.38 4.74 0.00 1.61 1.02 -0.30 -5.00 119.74 120.42 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 -3.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.10 1c41 s LYS 198 CO 0.00 0.50 0.20 0.25 -0.92 0.00 0.00 175.35 175.39