#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 1.93 -0.23 1.61 0.04 -1.26 -5.10 135.00 131.98 1c41 s PRO 6 Ca 0.00 -1.08 -0.06 0.00 0.04 0.00 0.00 61.00 59.90 1c41 s PRO 6 Cb 0.00 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 32.12 1c41 s PRO 6 CO 0.00 -1.23 0.03 0.95 0.04 0.00 0.00 177.00 176.79 1c41 s THR 7 N -3.02 4.01 0.50 1.26 -4.23 -1.26 -5.09 115.64 107.82 1c41 s THR 7 Ca 0.64 -0.28 -0.23 0.00 -1.18 0.00 0.00 61.69 60.64 1c41 s THR 7 Cb -0.06 -2.85 -0.07 0.00 1.34 0.00 0.00 72.50 70.85 1c41 s THR 7 CO 0.42 0.38 1.38 -2.16 -0.54 0.00 0.00 174.62 174.10 1c41 s PRO 8 N 1.46 3.43 -0.29 3.99 0.04 -1.26 -5.04 135.00 137.33 1c41 s PRO 8 Ca 0.05 2.30 -0.09 0.00 0.04 0.00 0.00 61.00 63.30 1c41 s PRO 8 Cb -0.15 -2.46 0.13 0.00 0.04 0.00 0.00 34.50 32.06 1c41 s PRO 8 CO 0.01 -0.98 0.62 -0.65 0.04 0.00 0.00 177.00 176.04 1c41 s GLN 9 N -2.67 0.54 -0.18 4.56 -0.21 -1.26 -5.15 119.66 115.29 1c41 s GLN 9 Ca 0.66 1.39 -0.06 0.00 0.02 0.00 0.00 55.36 57.37 1c41 s GLN 9 Cb -0.41 0.79 -0.03 0.00 1.00 0.00 0.00 33.01 34.36 1c41 s GLN 9 CO 0.51 -0.22 0.01 -1.14 -2.12 0.00 0.00 175.29 172.34 1c41 s GLN 10 N 2.86 3.77 0.42 2.91 0.74 -1.26 -4.89 119.66 124.21 1c41 s GLN 10 Ca -0.05 -0.45 0.07 0.00 0.05 0.00 0.00 55.36 54.98 1c41 s GLN 10 Cb -0.12 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.85 1c41 s GLN 10 CO -0.18 0.17 0.15 -1.01 -0.55 0.00 0.00 175.29 173.87 1c41 s HIS 11 N 0.59 2.53 0.00 1.67 3.76 -1.26 -5.09 115.29 117.49 1c41 s HIS 11 Ca 0.00 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.29 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 0.22 0.60 -3.47 -0.85 0.00 0.00 174.74 171.26 1c41 n ASP 12 N -1.21 0.00 -3.95 1.40 -0.08 -1.26 -4.81 116.55 106.65 1c41 n ASP 12 Ca -0.02 0.60 -0.27 0.00 -1.51 0.00 0.00 54.79 53.59 1c41 n ASP 12 Cb 0.65 -0.10 -0.01 0.00 2.34 0.00 0.00 41.12 44.00 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 -0.62 -0.31 0.00 0.27 0.00 -1.26 -4.25 105.19 99.02 1c41 n GLY 13 Ca 0.00 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.25 1c41 n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c41 n SER 14 N -2.92 0.88 -1.23 1.61 3.41 -1.26 -2.77 113.62 111.34 1c41 n SER 14 Ca -0.19 -0.46 0.09 0.00 -0.26 0.00 0.00 58.87 58.05 1c41 n SER 14 Cb 0.63 1.40 0.29 0.00 -0.26 0.00 0.00 64.21 66.27 1c41 n SER 14 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c41 n ALA 15 N -1.75 2.71 -2.52 7.33 0.00 -1.26 -4.45 120.51 120.56 1c41 n ALA 15 Ca 0.00 -1.51 -0.30 0.00 0.00 0.00 0.00 53.44 51.63 1c41 n ALA 15 Cb 0.36 -0.82 -0.04 0.00 0.00 0.00 0.00 19.45 18.95 1c41 n ALA 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1c41 s LEU 16 N -1.58 4.14 -0.20 0.00 1.02 -1.26 -5.06 118.68 115.75 1c41 s LEU 16 Ca 0.43 0.75 0.00 0.00 0.02 0.00 0.00 54.13 55.33 1c41 s LEU 16 Cb 0.27 -3.53 0.05 0.00 0.02 0.00 0.00 46.19 42.99 1c41 s LEU 16 CO 0.23 -0.10 -0.06 -0.60 0.02 0.00 0.00 176.35 175.84 1c41 s ARG 17 N -3.10 1.58 -0.10 1.70 3.52 -1.26 -4.66 118.95 116.62 1c41 s ARG 17 Ca 0.44 -0.76 -0.03 0.00 -0.13 0.00 0.00 55.73 55.26 1c41 s ARG 17 Cb -0.11 -2.32 -0.03 0.00 -1.56 0.00 0.00 34.95 30.92 1c41 s ARG 17 CO 0.26 -0.51 0.02 0.42 -0.81 0.00 0.00 175.30 174.68 1c41 s ILE 18 N 1.51 4.48 -0.11 4.11 -1.09 -0.23 -0.69 121.20 129.18 1c41 s ILE 18 Ca -0.02 -0.18 0.01 0.00 -2.23 0.00 0.00 60.65 58.23 1c41 s ILE 18 Cb -0.17 -2.90 -0.02 0.00 -1.58 0.00 0.00 42.46 37.79 1c41 s ILE 18 CO -0.07 0.60 -0.14 -0.83 -1.23 0.00 0.00 174.94 173.27 1c41 s GLY 19 N -0.82 1.53 -0.06 6.18 0.00 -0.88 -1.18 107.32 112.10 1c41 s GLY 19 Ca 0.13 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.98 1c41 s GLY 19 CO 0.02 -0.31 -0.18 -0.42 0.00 0.00 0.00 173.10 172.22 1c41 s ILE 20 N 0.14 1.50 -0.10 0.90 1.01 0.66 -1.01 121.20 124.30 1c41 s ILE 20 Ca -0.07 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.85 1c41 s ILE 20 Cb -0.15 -1.30 0.02 0.00 0.01 0.00 0.00 42.46 41.04 1c41 s ILE 20 CO 0.05 0.43 -0.11 -0.69 0.00 0.00 0.00 174.94 174.62 1c41 s VAL 21 N 0.20 1.21 0.08 2.92 1.01 -0.47 -0.94 120.40 124.41 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 -0.13 -1.16 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 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 1.28 1.87 0.82 5.22 -3.43 -0.77 -1.06 115.29 119.23 1c41 s HIS 22 Ca -0.02 -0.40 -0.10 0.00 -0.80 0.00 0.00 55.06 53.74 1c41 s HIS 22 Cb -0.14 -1.06 0.12 0.00 -1.43 0.00 0.00 32.58 30.07 1c41 s HIS 22 CO -0.04 0.17 1.16 0.00 -2.00 0.00 0.00 174.74 174.03 1c41 s ALA 23 N -1.00 2.78 -0.76 -1.38 0.00 -0.03 -1.42 121.76 119.95 1c41 s ALA 23 Ca 0.08 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 51.05 1c41 s ALA 23 Cb -0.10 -2.67 0.11 0.00 0.00 0.00 0.00 23.12 20.46 1c41 s ALA 23 CO 0.03 -1.81 0.89 0.54 0.00 0.00 0.00 175.76 175.41 1c41 n ARG 24 N -3.30 1.09 -2.55 0.00 1.74 -0.05 -4.76 116.66 108.82 1c41 n ARG 24 Ca 0.11 -1.27 -0.40 0.00 -0.77 0.00 0.00 57.85 55.52 1c41 n ARG 24 Cb 0.60 -1.15 -0.05 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 -0.74 3.68 -1.09 -1.55 0.52 -1.13 -3.38 118.94 115.24 1c41 s TRP 25 Ca 0.11 1.73 -0.00 0.00 0.02 0.00 0.00 56.10 57.95 1c41 s TRP 25 Cb 0.06 -3.21 -0.00 0.00 -1.15 0.00 0.00 33.47 29.17 1c41 s TRP 25 CO 0.09 -0.32 0.91 0.09 0.02 0.00 0.00 176.95 177.74 1c41 n ASN 26 N 1.53 -2.16 -0.21 2.95 3.02 -1.26 -4.57 115.26 114.56 1c41 n ASN 26 Ca -0.00 -0.57 0.11 0.00 -0.03 0.00 0.00 54.58 54.09 1c41 n ASN 26 Cb 0.46 -4.74 0.41 0.00 -0.61 0.00 0.00 39.78 35.30 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 -1.72 0.61 0.00 3.52 5.08 -1.92 0.20 114.58 120.36 1c41 h GLU 27 Ca -0.54 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 1c41 h GLU 27 Cb 1.31 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1c41 h GLU 27 CO 0.46 0.40 0.00 0.25 -1.00 0.00 0.00 179.01 179.12 1c41 n THR 28 N -4.51 1.14 -0.09 1.13 -2.24 -1.26 -0.76 114.28 107.69 1c41 n THR 28 Ca 0.14 0.65 -0.12 0.00 -2.27 0.00 0.00 64.05 62.45 1c41 n THR 28 Cb 0.41 -1.64 -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 -2.15 1.15 -0.08 2.28 2.08 -0.06 -4.35 119.36 118.24 1c41 n ILE 29 Ca -0.01 -0.53 -0.09 0.00 0.56 0.00 0.00 62.75 62.68 1c41 n ILE 29 Cb 0.05 -1.01 -0.02 0.00 -0.75 0.00 0.00 39.64 37.91 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 1.10 0.16 1.39 1.08 -0.04 -2.66 117.51 118.54 1c41 h ILE 30 Ca -0.45 -0.23 0.01 0.00 -0.39 0.00 0.00 64.86 63.80 1c41 h ILE 30 Cb 1.81 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 36.29 1c41 h ILE 30 CO -0.04 0.10 -0.21 -0.08 -0.69 0.00 0.00 178.15 177.22 1c41 h GLU 31 N 0.35 -0.41 -1.00 2.37 4.22 -1.18 0.36 114.58 119.28 1c41 h GLU 31 Ca 0.10 0.03 0.10 0.00 0.08 0.00 0.00 59.36 59.67 1c41 h GLU 31 Cb 0.01 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.27 1c41 h GLU 31 CO -0.02 -0.28 0.64 -1.35 -2.18 0.00 0.00 179.01 175.82 1c41 h PRO 32 N -0.43 1.03 0.68 0.92 0.11 -1.75 0.29 132.00 132.85 1c41 h PRO 32 Ca 0.01 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 1c41 h PRO 32 Cb 0.42 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 31.31 1c41 h PRO 32 CO -0.08 0.68 -0.32 -0.07 -0.21 0.00 0.00 178.00 177.99 1c41 h LEU 33 N 1.06 -0.77 -0.79 2.35 3.38 -1.03 -1.79 115.31 117.71 1c41 h LEU 33 Ca 0.47 -0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.58 1c41 h LEU 33 Cb 0.37 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.22 1c41 h LEU 33 CO -0.23 -0.42 0.36 0.25 0.09 0.00 0.00 178.44 178.49 1c41 h LEU 34 N -1.14 0.38 -0.02 1.67 5.85 0.12 -0.60 115.31 121.57 1c41 h LEU 34 Ca -0.09 0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1c41 h LEU 34 Cb 0.73 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1c41 h LEU 34 CO 0.15 0.14 -0.15 0.00 -0.34 0.00 0.00 178.44 178.25 1c41 h ALA 35 N 1.56 -0.16 -0.74 1.25 0.00 -0.38 0.11 119.26 120.90 1c41 h ALA 35 Ca 0.44 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 1c41 h ALA 35 Cb 0.65 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1c41 h ALA 35 CO -0.39 -0.63 0.33 0.78 0.00 0.00 0.00 179.25 179.33 1c41 h GLY 36 N -0.24 1.16 0.88 0.00 0.00 -0.33 0.02 103.07 104.55 1c41 h GLY 36 Ca 0.06 -0.60 -0.08 0.00 0.00 0.00 0.00 47.33 46.71 1c41 h GLY 36 CO -0.16 0.57 -0.13 0.00 0.00 0.00 0.00 176.54 176.81 1c41 h THR 37 N 1.04 1.30 -0.58 4.70 1.03 -0.86 -2.13 112.91 117.41 1c41 h THR 37 Ca 0.25 -1.22 -0.00 0.00 -0.01 0.00 0.00 66.41 65.42 1c41 h THR 37 Cb 0.16 1.53 -0.03 0.00 -1.07 0.00 0.00 68.15 68.74 1c41 h THR 37 CO -0.03 0.38 0.34 0.50 -0.01 0.00 0.00 175.52 176.71 1c41 h LYS 38 N 0.29 0.79 0.04 0.00 3.64 -0.64 -1.93 116.57 118.77 1c41 h LYS 38 Ca 0.06 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 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 0.58 -0.35 0.00 -2.27 0.00 0.00 179.45 177.44 1c41 h ALA 39 N 1.17 -0.83 -0.33 5.00 0.00 -0.85 -1.20 119.26 122.23 1c41 h ALA 39 Ca 0.21 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1c41 h ALA 39 Cb -0.01 0.77 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1c41 h ALA 39 CO -0.04 -0.92 0.29 0.87 0.00 0.00 0.00 179.25 179.45 1c41 h LYS 40 N -0.48 0.00 0.65 0.00 1.79 -1.26 0.10 116.57 117.37 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 0.49 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.15 1c41 h LYS 40 CO -0.21 0.00 -0.31 -0.07 -1.08 0.00 0.00 179.45 177.78 1c41 h LEU 41 N 0.00 -0.74 -0.47 2.94 3.38 -0.42 -1.39 115.31 118.61 1c41 h LEU 41 Ca 0.16 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1c41 h LEU 41 Cb 0.73 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 1c41 h LEU 41 CO -0.00 -0.44 0.18 -0.07 0.09 0.00 0.00 178.44 178.20 1c41 h LEU 42 N -1.01 0.19 -1.79 1.67 3.38 -0.68 0.10 115.31 117.18 1c41 h LEU 42 Ca -0.09 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.02 1c41 h LEU 42 Cb 0.70 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1c41 h LEU 42 CO 0.15 0.14 0.51 0.00 0.09 0.00 0.00 178.44 179.32 1c41 h ALA 43 N 1.30 1.91 -0.33 1.53 0.00 -0.60 0.99 119.26 124.06 1c41 h ALA 43 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1c41 h ALA 43 Cb 0.21 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1c41 h ALA 43 CO -0.21 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 178.38 1c41 n GLY 45 N 1.46 0.62 3.71 0.00 0.00 0.34 -4.38 105.19 106.95 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 -2.17 3.17 0.13 1.61 1.01 -0.98 -4.11 120.40 119.06 1c41 s VAL 46 Ca 0.00 0.79 -0.31 0.00 0.00 0.00 0.00 61.98 62.46 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 0.00 175.10 175.97 1c41 s LYS 47 N 1.47 4.33 0.35 2.72 1.02 -1.26 -4.26 119.74 124.11 1c41 s LYS 47 Ca 0.67 2.06 0.16 0.00 0.02 0.00 0.00 55.97 58.87 1c41 s LYS 47 Cb -0.38 -3.24 1.15 0.00 -0.52 0.00 0.00 37.83 34.84 1c41 s LYS 47 CO 0.30 -0.40 1.62 1.49 -0.92 0.00 0.00 175.35 177.44 1c41 h GLU 48 N 6.57 0.15 0.00 1.68 4.57 -1.96 0.90 114.58 126.49 1c41 h GLU 48 Ca -0.43 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 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 0.85 0.10 0.00 0.66 -1.18 0.00 0.00 179.01 179.43 1c41 h SER 49 N 0.15 0.00 -0.56 1.04 4.64 -2.01 -2.94 113.55 113.87 1c41 h SER 49 Ca 0.76 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.08 1c41 h SER 49 Cb 1.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.95 1c41 h SER 49 CO -0.70 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 175.85 1c41 n ASN 50 N -2.35 3.55 -4.16 4.97 3.02 0.31 -2.51 115.26 118.09 1c41 n ASN 50 Ca 0.03 -2.18 -0.36 0.00 -0.03 0.00 0.00 54.58 52.05 1c41 n ASN 50 Cb 0.31 -0.46 -0.13 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 -1.49 3.19 -0.03 2.41 1.01 -1.11 -1.07 121.20 124.11 1c41 s ILE 51 Ca 0.41 -1.61 -0.15 0.00 0.00 0.00 0.00 60.65 59.29 1c41 s ILE 51 Cb 0.24 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.68 1c41 s ILE 51 CO 0.24 -0.34 0.41 -0.69 0.00 0.00 0.00 174.94 174.55 1c41 s VAL 52 N 1.23 5.08 -0.18 2.92 1.01 -0.32 -5.00 120.40 125.13 1c41 s VAL 52 Ca 0.01 0.83 -0.04 0.00 0.00 0.00 0.00 61.98 62.77 1c41 s VAL 52 Cb -0.21 -3.72 0.06 0.00 0.00 0.00 0.00 36.38 32.51 1c41 s VAL 52 CO -0.02 0.53 0.07 -0.69 0.00 0.00 0.00 175.10 174.99 1c41 s VAL 53 N -0.70 0.16 0.32 2.92 1.01 -1.26 -0.25 120.40 122.60 1c41 s VAL 53 Ca 0.23 -0.30 0.10 0.00 0.00 0.00 0.00 61.98 62.01 1c41 s VAL 53 Cb -0.16 -0.74 -0.06 0.00 0.00 0.00 0.00 36.38 35.41 1c41 s VAL 53 CO 0.12 -0.24 -0.12 -1.10 0.00 0.00 0.00 175.10 173.76 1c41 s GLN 54 N 2.03 1.75 0.36 2.72 -0.21 -0.12 -5.00 119.66 121.20 1c41 s GLN 54 Ca 0.01 -1.88 0.05 0.00 0.02 0.00 0.00 55.36 53.56 1c41 s GLN 54 Cb -0.16 -1.67 -0.06 0.00 1.00 0.00 0.00 33.01 32.11 1c41 s GLN 54 CO -0.08 0.19 0.04 -1.54 -2.12 0.00 0.00 175.29 171.78 1c41 s SER 55 N -3.57 2.92 0.12 5.90 1.04 -1.26 -1.85 113.70 117.01 1c41 s SER 55 Ca 0.31 -1.40 -0.08 0.00 0.48 0.00 0.00 55.95 55.26 1c41 s SER 55 Cb 0.00 -0.13 -0.01 0.00 0.10 0.00 0.00 66.02 65.99 1c41 s SER 55 CO 0.16 -0.59 0.22 0.68 0.98 0.00 0.00 173.24 174.69 1c41 s VAL 56 N -3.10 0.11 0.03 5.02 -7.23 -0.51 -4.89 120.40 109.84 1c41 s VAL 56 Ca 0.34 -1.29 -0.24 0.00 -1.81 0.00 0.00 61.98 58.99 1c41 s VAL 56 Cb 0.09 -1.56 -0.13 0.00 0.56 0.00 0.00 36.38 35.33 1c41 s VAL 56 CO 0.16 -0.51 1.29 1.55 -0.31 0.00 0.00 175.10 177.28 1c41 h PRO 57 N 2.67 -0.82 -5.27 4.82 0.13 -1.93 -0.70 132.00 130.90 1c41 h PRO 57 Ca -0.33 0.06 -0.67 0.00 -0.87 0.00 0.00 66.00 64.18 1c41 h PRO 57 Cb 1.21 0.19 -0.13 0.00 0.13 0.00 0.00 31.00 32.40 1c41 h PRO 57 CO 0.53 -0.55 -0.53 0.20 -0.23 0.00 0.00 178.00 177.43 1c41 s GLY 58 N -1.74 2.95 0.45 1.56 0.00 -1.26 -0.87 107.32 108.40 1c41 s GLY 58 Ca -0.12 -0.67 0.14 0.00 0.00 0.00 0.00 44.72 44.06 1c41 s GLY 58 CO 0.37 -2.18 1.99 1.76 0.00 0.00 0.00 173.10 175.04 1c41 h SER 59 N 1.41 0.01 -0.51 1.64 0.02 -1.94 -2.24 113.55 111.95 1c41 h SER 59 Ca -0.44 -0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.60 1c41 h SER 59 Cb 1.30 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.81 1c41 h SER 59 CO 0.75 0.19 0.35 -0.25 -1.14 0.00 0.00 176.83 176.72 1c41 h TRP 60 N 0.01 0.33 0.00 3.45 2.91 -1.96 0.77 115.95 121.47 1c41 h TRP 60 Ca 0.00 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.03 1c41 h TRP 60 Cb 0.31 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 28.85 1c41 h TRP 60 CO 0.00 0.17 0.00 0.93 -1.03 0.00 0.00 178.44 178.51 1c41 h GLU 61 N 0.32 0.00 -0.07 2.65 3.07 -1.81 -3.37 114.58 115.37 1c41 h GLU 61 Ca 0.23 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.11 1c41 h GLU 61 Cb 0.50 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.37 1c41 h GLU 61 CO -0.05 0.00 -0.39 -0.07 -1.40 0.00 0.00 179.01 177.09 1c41 h LEU 62 N 0.00 -1.24 -0.36 1.33 4.07 -0.89 0.12 115.31 118.34 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 0.79 0.48 -0.04 0.00 1.08 0.00 0.00 40.66 42.97 1c41 h LEU 62 CO 0.00 -0.36 0.09 1.55 -1.08 0.00 0.00 178.44 178.64 1c41 h PRO 63 N -0.45 0.22 -0.78 1.13 0.13 -1.73 0.13 132.00 130.66 1c41 h PRO 63 Ca 0.02 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1c41 h PRO 63 Cb 0.51 -0.05 -0.04 0.00 0.13 0.00 0.00 31.00 31.55 1c41 h PRO 63 CO -0.30 0.14 0.40 0.97 -0.23 0.00 0.00 178.00 178.98 1c41 h ILE 64 N 0.22 1.24 -0.53 -3.56 6.09 -1.75 -0.42 117.51 118.81 1c41 h ILE 64 Ca 0.17 -0.64 -0.05 0.00 -1.37 0.00 0.00 64.86 62.97 1c41 h ILE 64 Cb 0.17 0.24 -0.02 0.00 0.47 0.00 0.00 36.82 37.68 1c41 h ILE 64 CO -0.20 0.28 0.15 0.00 -3.07 0.00 0.00 178.15 175.30 1c41 h ALA 65 N 1.21 0.69 -0.62 0.18 0.00 -0.27 -1.66 119.26 118.78 1c41 h ALA 65 Ca 0.27 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1c41 h ALA 65 Cb 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1c41 h ALA 65 CO -0.04 0.37 0.02 0.28 0.00 0.00 0.00 179.25 179.88 1c41 h VAL 66 N 0.73 1.27 -0.52 0.00 2.07 -0.39 0.15 116.25 119.55 1c41 h VAL 66 Ca 0.17 -1.13 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 1c41 h VAL 66 Cb 0.31 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1c41 h VAL 66 CO -0.00 0.41 0.31 -0.61 0.02 0.00 0.00 177.57 177.70 1c41 h GLN 67 N 0.99 0.71 -0.06 1.57 4.15 -0.82 -2.28 115.11 119.37 1c41 h GLN 67 Ca 0.18 -0.07 -0.21 0.00 0.77 0.00 0.00 58.65 59.33 1c41 h GLN 67 Cb 0.54 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1c41 h GLN 67 CO 0.03 0.52 -0.82 0.00 -1.93 0.00 0.00 178.83 176.63 1c41 h ARG 68 N 0.70 0.48 0.33 1.69 2.47 -1.18 -1.74 114.38 117.13 1c41 h ARG 68 Ca 0.19 -0.44 -0.01 0.00 -1.26 0.00 0.00 59.98 58.46 1c41 h ARG 68 Cb -0.01 0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 1c41 h ARG 68 CO -0.03 1.07 -0.19 1.25 0.56 0.00 0.00 179.97 182.63 1c41 h LEU 69 N 0.31 -0.46 -0.28 3.04 6.46 -0.82 0.16 115.31 123.73 1c41 h LEU 69 Ca -0.05 0.02 0.03 0.00 -0.12 0.00 0.00 57.88 57.76 1c41 h LEU 69 Cb 1.42 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 41.46 1c41 h LEU 69 CO 0.15 -0.30 0.09 0.22 -0.62 0.00 0.00 178.44 177.97 1c41 h TYR 70 N -0.48 0.16 -0.77 1.25 3.20 -1.46 -1.28 116.97 117.58 1c41 h TYR 70 Ca -0.04 0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.03 1c41 h TYR 70 Cb 0.39 -0.03 -0.12 0.00 1.54 0.00 0.00 36.73 38.51 1c41 h TYR 70 CO -0.08 0.07 0.16 1.03 -1.64 0.00 0.00 178.16 177.70 1c41 h SER 71 N 0.21 -0.06 0.17 -2.11 0.87 -0.81 -1.02 113.55 110.80 1c41 h SER 71 Ca 0.12 0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.84 1c41 h SER 71 Cb 0.10 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 1c41 h SER 71 CO -0.13 -0.09 -0.08 0.00 -0.53 0.00 0.00 176.83 176.00 1c41 h ALA 72 N 1.67 -0.23 -0.77 6.23 0.00 0.39 -2.56 119.26 123.99 1c41 h ALA 72 Ca 0.44 -0.10 0.22 0.00 0.00 0.00 0.00 54.91 55.47 1c41 h ALA 72 Cb 0.80 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 1c41 h ALA 72 CO -0.57 -0.56 0.66 0.66 0.00 0.00 0.00 179.25 179.44 1c41 h SER 73 N -0.36 0.00 -0.14 0.00 4.64 -0.25 0.74 113.55 118.18 1c41 h SER 73 Ca -0.02 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.17 1c41 h SER 73 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1c41 h SER 73 CO 0.04 0.00 -0.42 1.56 -0.87 0.00 0.00 176.83 177.14 1c41 h GLN 74 N 0.00 0.53 -0.07 4.77 4.20 -0.97 -3.05 115.11 120.52 1c41 h GLN 74 Ca 0.37 -0.39 0.02 0.00 0.06 0.00 0.00 58.65 58.71 1c41 h GLN 74 Cb 1.69 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.53 1c41 h GLN 74 CO -0.00 1.01 0.13 -0.07 -0.67 0.00 0.00 178.83 179.22 1c41 h LEU 75 N 0.16 0.00 0.00 1.46 3.38 -0.73 -3.46 115.31 116.11 1c41 h LEU 75 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1c41 h LEU 75 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1c41 h LEU 75 CO 0.09 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.62 1c41 n GLN 76 N -3.43 0.00 -1.02 1.13 6.02 -1.16 -5.13 117.38 113.80 1c41 n GLN 76 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.57 1c41 n GLN 76 Cb 0.22 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 0.69 -0.81 1.08 3.41 -1.04 -4.79 113.62 112.16 1c41 n SER 107 Ca 0.00 0.67 0.02 0.00 -0.26 0.00 0.00 58.87 59.30 1c41 n SER 107 Cb 0.00 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 63.39 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 2.81 -0.27 0.00 6.66 -2.24 -1.26 -5.04 114.28 114.94 1c41 n THR 108 Ca 0.22 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 62.19 1c41 n THR 108 Cb -0.03 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 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 -2.85 1.28 3.66 3.38 0.00 -1.26 -4.98 105.19 104.43 1c41 n GLY 109 Ca -0.01 -1.36 -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 2.61 1.89 -1.62 1.61 -0.04 -1.17 -4.84 135.00 133.44 1c41 n PRO 110 Ca 0.00 0.67 -0.38 0.00 -0.04 0.00 0.00 63.50 63.75 1c41 n PRO 110 Cb 0.00 -2.23 0.05 0.00 -0.04 0.00 0.00 33.50 31.27 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 0.93 0.21 0.54 3.72 -1.26 -4.88 117.46 117.69 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 -2.16 -0.01 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 -0.66 0.64 -3.52 4.37 8.00 0.14 -4.94 116.55 120.58 1c41 n ASP 112 Ca 0.13 0.15 -0.16 0.00 0.71 0.00 0.00 54.79 55.62 1c41 n ASP 112 Cb 0.46 0.76 -0.05 0.00 -0.02 0.00 0.00 41.12 42.27 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 0.14 2.24 0.00 -1.25 -4.31 121.76 113.46 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 23.21 1c41 s ALA 113 CO 0.81 -0.41 -0.18 -0.51 0.00 0.00 0.00 175.76 175.47 1c41 s LEU 114 N -1.38 2.39 -0.06 0.00 1.43 -0.01 -2.07 118.68 118.98 1c41 s LEU 114 Ca -0.08 -0.80 0.01 0.00 -1.03 0.00 0.00 54.13 52.23 1c41 s LEU 114 Cb -0.00 -0.76 0.02 0.00 0.03 0.00 0.00 46.19 45.47 1c41 s LEU 114 CO 0.06 -0.04 -0.07 -0.63 0.23 0.00 0.00 176.35 175.90 1c41 s ILE 115 N -1.83 0.75 -0.23 -0.59 1.01 -0.18 0.42 121.20 120.55 1c41 s ILE 115 Ca 0.11 -0.23 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 1c41 s ILE 115 Cb -0.07 -0.75 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 1c41 s ILE 115 CO 0.05 0.28 -0.00 0.00 0.00 0.00 0.00 174.94 175.27 1c41 s ALA 116 N 0.98 2.94 -0.17 9.38 0.00 -0.66 -1.36 121.76 132.87 1c41 s ALA 116 Ca -0.10 -1.16 -0.01 0.00 0.00 0.00 0.00 51.96 50.70 1c41 s ALA 116 Cb -0.14 -1.84 -0.00 0.00 0.00 0.00 0.00 23.12 21.13 1c41 s ALA 116 CO 0.00 -0.45 -0.13 0.42 0.00 0.00 0.00 175.76 175.60 1c41 s ILE 117 N 1.53 2.85 0.11 0.00 1.01 -0.23 -0.10 121.20 126.38 1c41 s ILE 117 Ca 0.06 -0.70 -0.13 0.00 0.00 0.00 0.00 60.65 59.88 1c41 s ILE 117 Cb -0.15 -2.23 0.02 0.00 0.01 0.00 0.00 42.46 40.12 1c41 s ILE 117 CO -0.01 0.50 0.31 -0.83 0.00 0.00 0.00 174.94 174.91 1c41 s GLY 118 N 0.91 -0.08 -0.27 6.18 0.00 -0.57 -0.85 107.32 112.64 1c41 s GLY 118 Ca -0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 44.72 44.33 1c41 s GLY 118 CO -0.01 -0.54 0.10 0.14 0.00 0.00 0.00 173.10 172.79 1c41 s VAL 119 N -3.84 0.31 -0.13 1.40 1.01 -1.26 -0.68 120.40 117.22 1c41 s VAL 119 Ca 0.05 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 1c41 s VAL 119 Cb 0.03 -1.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 1c41 s VAL 119 CO -0.11 -0.57 0.23 -0.76 0.00 0.00 0.00 175.10 173.89 1c41 s LEU 120 N 1.92 4.33 -0.05 3.92 2.01 0.17 -4.79 118.68 126.18 1c41 s LEU 120 Ca 0.07 0.51 0.02 0.00 0.01 0.00 0.00 54.13 54.74 1c41 s LEU 120 Cb -0.17 -2.25 0.02 0.00 0.01 0.00 0.00 46.19 43.81 1c41 s LEU 120 CO -0.25 0.26 -0.08 -0.63 1.01 0.00 0.00 176.35 176.66 1c41 s ILE 121 N -0.33 0.82 0.09 -0.59 1.01 -1.26 -1.25 121.20 119.69 1c41 s ILE 121 Ca 0.15 -0.29 -0.36 0.00 0.00 0.00 0.00 60.65 60.15 1c41 s ILE 121 Cb -0.13 -0.79 -0.16 0.00 0.01 0.00 0.00 42.46 41.40 1c41 s ILE 121 CO 0.04 0.29 1.42 1.17 0.00 0.00 0.00 174.94 177.86 1c41 n LYS 122 N 3.91 1.42 0.00 2.79 0.00 -0.82 -4.86 118.16 120.61 1c41 n LYS 122 Ca -0.24 0.51 0.00 0.00 0.00 0.00 0.00 58.31 58.58 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 2.82 2.14 0.07 3.14 0.00 -1.26 -4.94 105.19 107.15 1c41 n GLY 123 Ca 0.18 -1.82 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 0.63 -2.72 1.61 1.02 -1.26 -4.97 120.64 114.96 1c41 n GLU 124 Ca 0.00 0.01 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 1c41 n GLU 124 Cb 0.00 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 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 -2.55 0.00 1.66 2.62 -2.24 -1.26 -5.01 114.28 107.50 1c41 n THR 125 Ca -0.05 -1.20 0.08 0.00 -2.27 0.00 0.00 64.05 60.61 1c41 n THR 125 Cb 0.64 -0.29 0.41 0.00 -2.10 0.00 0.00 70.33 68.99 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 -1.28 1.30 -0.17 -0.78 2.81 -1.26 -4.07 117.12 113.67 1c41 n MET 126 Ca 0.00 -0.46 -0.01 0.00 -1.81 0.00 0.00 57.70 55.42 1c41 n MET 126 Cb 0.35 -1.29 0.06 0.00 -0.71 0.00 0.00 33.22 31.63 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 0.89 -0.12 -0.29 2.03 6.17 -1.97 -2.02 115.15 119.83 1c41 h HIS 127 Ca 0.00 0.04 0.05 0.00 0.71 0.00 0.00 60.37 61.18 1c41 h HIS 127 Cb 0.20 0.14 -0.08 0.00 2.52 0.00 0.00 27.41 30.19 1c41 h HIS 127 CO 0.05 -0.17 -0.46 0.35 0.71 0.00 0.00 177.93 178.41 1c41 h PHE 128 N 0.07 -1.36 -0.59 5.26 3.57 -1.89 -1.82 116.94 120.18 1c41 h PHE 128 Ca 0.27 0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 1c41 h PHE 128 Cb 0.42 0.64 -0.03 0.00 2.79 0.00 0.00 35.95 39.77 1c41 h PHE 128 CO -0.37 -0.48 0.13 1.05 -2.23 0.00 0.00 178.31 176.41 1c41 h GLU 129 N -0.42 0.93 0.00 1.11 9.09 -1.75 -1.09 114.58 122.45 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 -0.13 -0.01 0.00 -1.65 0.00 0.00 28.75 27.57 1c41 h GLU 129 CO -0.51 0.84 -0.43 1.88 0.05 0.00 0.00 179.01 180.84 1c41 h TYR 130 N 0.89 0.00 0.21 2.06 0.05 -1.02 -2.12 116.97 117.04 1c41 h TYR 130 Ca 0.19 0.00 -0.32 0.00 0.05 0.00 0.00 58.73 58.65 1c41 h TYR 130 Cb 0.34 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.10 1c41 h TYR 130 CO 0.02 0.43 -1.46 0.82 -1.05 0.00 0.00 178.16 176.92 1c41 h ILE 131 N 0.00 1.20 -0.34 -2.88 2.04 -1.19 -3.08 117.51 113.25 1c41 h ILE 131 Ca -0.00 -2.60 -0.00 0.00 1.00 0.00 0.00 64.86 63.25 1c41 h ILE 131 Cb 0.86 2.97 -0.02 0.00 -0.74 0.00 0.00 36.82 39.90 1c41 h ILE 131 CO 0.06 0.80 0.21 0.00 0.00 0.00 0.00 178.15 179.21 1c41 h ALA 132 N 0.11 0.44 -0.69 1.87 0.00 -1.13 0.30 119.26 120.16 1c41 h ALA 132 Ca -0.27 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 1c41 h ALA 132 Cb 2.05 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.68 1c41 h ALA 132 CO 0.22 -0.06 0.16 0.22 0.00 0.00 0.00 179.25 179.78 1c41 h ASP 133 N 0.44 1.05 -0.10 0.00 3.58 -1.51 -0.66 116.42 119.23 1c41 h ASP 133 Ca 0.12 -0.24 -0.22 0.00 0.42 0.00 0.00 57.03 57.11 1c41 h ASP 133 Cb 0.01 -0.28 0.01 0.00 1.72 0.00 0.00 39.33 40.80 1c41 h ASP 133 CO -0.02 1.02 -0.81 0.28 -2.88 0.00 0.00 179.24 176.83 1c41 h SER 134 N 1.04 0.89 -0.69 2.28 0.02 -1.42 -1.99 113.55 113.69 1c41 h SER 134 Ca 0.21 -0.66 -0.06 0.00 -0.84 0.00 0.00 61.79 60.44 1c41 h SER 134 Cb 0.39 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 1c41 h SER 134 CO 0.00 1.42 0.19 0.58 -1.14 0.00 0.00 176.83 177.88 1c41 h VAL 135 N 0.44 1.26 0.65 2.27 2.07 -0.89 0.49 116.25 122.54 1c41 h VAL 135 Ca -0.07 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 1c41 h VAL 135 Cb 1.45 0.52 0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1c41 h VAL 135 CO 0.17 0.36 -0.31 0.28 0.02 0.00 0.00 177.57 178.08 1c41 h SER 136 N 1.05 -0.74 -0.43 0.57 0.02 -1.06 -0.15 113.55 112.80 1c41 h SER 136 Ca 0.22 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.15 1c41 h SER 136 Cb 0.34 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1c41 h SER 136 CO -0.00 -0.51 0.14 0.45 -1.14 0.00 0.00 176.83 175.77 1c41 h HIS 137 N -0.91 0.75 -0.25 3.45 3.86 -1.26 -1.44 115.15 119.35 1c41 h HIS 137 Ca -0.09 -0.05 0.04 0.00 -1.16 0.00 0.00 60.37 59.11 1c41 h HIS 137 Cb 0.68 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.89 1c41 h HIS 137 CO -0.02 0.62 0.02 0.78 0.86 0.00 0.00 177.93 180.18 1c41 h GLY 138 N 0.90 0.25 0.96 2.45 0.00 0.28 0.10 103.07 108.01 1c41 h GLY 138 Ca 0.17 0.01 -0.08 0.00 0.00 0.00 0.00 47.33 47.43 1c41 h GLY 138 CO -0.01 -0.04 -0.05 1.41 0.00 0.00 0.00 176.54 177.85 1c41 h LEU 139 N 0.10 0.73 -1.36 3.11 3.38 -0.71 -1.41 115.31 119.16 1c41 h LEU 139 Ca 0.12 -0.34 0.08 0.00 0.09 0.00 0.00 57.88 57.83 1c41 h LEU 139 Cb 0.14 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1c41 h LEU 139 CO -0.18 0.90 0.50 -0.03 0.09 0.00 0.00 178.44 179.72 1c41 h MET 140 N 0.55 0.73 0.14 1.13 4.05 -0.92 -1.33 114.93 119.29 1c41 h MET 140 Ca 0.11 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.47 1c41 h MET 140 Cb 0.56 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.19 1c41 h MET 140 CO 0.03 0.48 -0.07 -0.09 0.23 0.00 0.00 176.91 177.50 1c41 h ARG 141 N 0.75 -0.18 -0.94 0.39 2.43 -0.34 -2.39 114.38 114.10 1c41 h ARG 141 Ca 0.34 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.71 1c41 h ARG 141 Cb 0.35 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.86 1c41 h ARG 141 CO -0.12 0.23 0.60 0.28 -1.51 0.00 0.00 179.97 179.45 1c41 h VAL 142 N -0.67 0.73 0.94 0.20 2.07 -0.91 0.56 116.25 119.16 1c41 h VAL 142 Ca -0.02 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 1c41 h VAL 142 Cb 0.50 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1c41 h VAL 142 CO 0.03 0.11 -0.45 -0.61 0.02 0.00 0.00 177.57 176.67 1c41 h GLN 143 N 0.61 -1.22 -0.40 1.57 4.15 -1.19 0.29 115.11 118.92 1c41 h GLN 143 Ca 0.50 0.08 -0.08 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 -0.25 -0.81 -0.08 -0.07 -1.93 0.00 0.00 178.83 175.69 1c41 h LEU 144 N -1.30 0.67 0.56 -2.39 3.38 -0.77 0.22 115.31 115.69 1c41 h LEU 144 Ca -0.13 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 1c41 h LEU 144 Cb 0.97 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.55 1c41 h LEU 144 CO 0.21 0.79 -0.27 0.44 0.09 0.00 0.00 178.44 179.70 1c41 h ASP 145 N 0.63 -0.64 1.09 -0.43 5.19 0.10 -3.18 116.42 119.19 1c41 h ASP 145 Ca 0.12 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.45 1c41 h ASP 145 Cb 0.51 0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.18 1c41 h ASP 145 CO 0.03 -0.40 -0.30 0.00 -3.12 0.00 0.00 179.24 175.45 1c41 h THR 146 N -0.84 0.65 -0.06 0.35 1.03 -0.88 -3.47 112.91 109.69 1c41 h THR 146 Ca -0.08 -1.43 -0.03 0.00 -0.01 0.00 0.00 66.41 64.86 1c41 h THR 146 Cb 0.61 1.95 -0.01 0.00 -1.07 0.00 0.00 68.15 69.64 1c41 h THR 146 CO 0.13 0.30 -0.02 0.61 -0.01 0.00 0.00 175.52 176.52 1c41 n GLY 147 N 0.46 0.48 3.30 2.99 0.00 0.77 -5.00 105.19 108.19 1c41 n GLY 147 Ca 0.01 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.87 2.59 0.25 1.61 1.01 -1.10 -5.03 120.40 117.86 1c41 s VAL 148 Ca 0.00 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 60.84 1c41 s VAL 148 Cb 0.00 -2.05 -0.12 0.00 0.00 0.00 0.00 36.38 34.21 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 3.53 2.52 -3.97 2.72 -0.02 -1.26 -4.46 135.00 134.06 1c41 n PRO 149 Ca -0.19 0.90 -0.31 0.00 -2.02 0.00 0.00 63.50 61.89 1c41 n PRO 149 Cb 0.53 -2.67 -0.15 0.00 -0.02 0.00 0.00 33.50 31.19 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 0.34 1.85 0.15 -1.45 1.01 -1.26 -0.83 120.40 120.23 1c41 s VAL 150 Ca 0.69 -1.73 -0.31 0.00 0.00 0.00 0.00 61.98 60.62 1c41 s VAL 150 Cb -0.55 -2.20 -0.10 0.00 0.00 0.00 0.00 36.38 33.53 1c41 s VAL 150 CO 0.44 -0.33 1.56 -0.63 0.00 0.00 0.00 175.10 176.14 1c41 s ILE 151 N 1.18 2.70 -1.17 2.22 -1.09 0.17 -4.86 121.20 120.35 1c41 s ILE 151 Ca 0.01 0.48 -0.19 0.00 -2.23 0.00 0.00 60.65 58.72 1c41 s ILE 151 Cb -0.19 -3.31 0.08 0.00 -1.58 0.00 0.00 42.46 37.46 1c41 s ILE 151 CO -0.09 0.03 1.57 0.12 -1.23 0.00 0.00 174.94 175.34 1c41 s PHE 152 N 1.25 2.79 -0.69 3.97 5.36 -1.26 -1.66 117.98 127.74 1c41 s PHE 152 Ca 0.70 -1.39 -0.02 0.00 -0.96 0.00 0.00 56.93 55.26 1c41 s PHE 152 Cb -0.43 -4.66 0.41 0.00 -0.34 0.00 0.00 43.02 38.00 1c41 s PHE 152 CO 0.31 -1.79 2.05 0.41 -1.46 0.00 0.00 175.22 174.74 1c41 n GLY 153 N 5.79 5.68 3.47 13.12 0.00 0.86 -4.93 105.19 129.18 1c41 n GLY 153 Ca 0.41 -2.28 -0.35 0.00 0.00 0.00 0.00 46.02 43.80 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 -4.71 3.97 -0.15 1.61 1.01 -1.22 -1.52 120.40 119.39 1c41 s VAL 154 Ca 0.60 -0.31 -0.13 0.00 0.00 0.00 0.00 61.98 62.14 1c41 s VAL 154 Cb 0.48 -2.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 1c41 s VAL 154 CO -0.11 0.44 0.28 -0.76 0.00 0.00 0.00 175.10 174.95 1c41 s LEU 155 N 0.83 4.27 -0.67 3.92 1.43 0.15 -4.92 118.68 123.68 1c41 s LEU 155 Ca 0.00 0.51 0.03 0.00 -1.03 0.00 0.00 54.13 53.65 1c41 s LEU 155 Cb -0.14 -2.34 0.16 0.00 0.03 0.00 0.00 46.19 43.90 1c41 s LEU 155 CO 0.02 0.14 0.46 0.42 0.23 0.00 0.00 176.35 177.63 1c41 s THR 156 N 0.25 3.07 0.32 5.49 -4.23 -1.26 0.44 115.64 119.72 1c41 s THR 156 Ca 0.16 -3.87 0.07 0.00 -1.18 0.00 0.00 61.69 56.87 1c41 s THR 156 Cb -0.13 -3.02 -0.02 0.00 1.34 0.00 0.00 72.50 70.67 1c41 s THR 156 CO 0.04 -0.95 0.38 -0.69 -0.54 0.00 0.00 174.62 172.85 1c41 s VAL 157 N -1.02 4.04 -0.05 2.29 1.01 -0.38 -5.02 120.40 121.26 1c41 s VAL 157 Ca 0.22 -1.16 0.14 0.00 0.00 0.00 0.00 61.98 61.19 1c41 s VAL 157 Cb -0.12 -3.38 -0.22 0.00 0.00 0.00 0.00 36.38 32.67 1c41 s VAL 157 CO -0.10 -0.20 0.26 0.18 0.00 0.00 0.00 175.10 175.24 1c41 n LEU 158 N -1.49 0.00 -3.94 3.92 4.77 -1.26 -1.94 117.00 117.06 1c41 n LEU 158 Ca -0.02 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.86 1c41 n LEU 158 Cb 0.59 0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.66 1c41 n LEU 158 CO 0.42 0.09 -0.28 0.42 -1.33 0.00 0.00 177.39 176.71 1c41 s THR 159 N -2.87 0.11 0.21 -5.08 -4.23 -1.26 -4.44 115.64 98.09 1c41 s THR 159 Ca -0.06 -0.89 -0.12 0.00 -1.18 0.00 0.00 61.69 59.44 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 0.61 -0.49 1.64 0.44 -0.54 0.00 0.00 174.62 176.28 1c41 h ASP 160 N 4.33 -0.41 -0.94 3.99 5.19 -1.98 -0.54 116.42 126.06 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 0.33 -0.08 0.00 0.18 0.00 0.00 39.33 40.96 1c41 h ASP 160 CO 0.43 -0.16 0.60 0.44 -3.12 0.00 0.00 179.24 177.43 1c41 h ASP 161 N 0.06 0.80 -0.73 6.45 3.32 -1.99 0.20 116.42 124.54 1c41 h ASP 161 Ca 0.32 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.40 1c41 h ASP 161 Cb 0.51 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1c41 h ASP 161 CO -0.59 0.42 0.39 1.56 -1.72 0.00 0.00 179.24 179.30 1c41 h GLN 162 N 0.85 1.02 0.33 3.56 4.20 -1.52 0.22 115.11 123.77 1c41 h GLN 162 Ca 0.47 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 59.05 1c41 h GLN 162 Cb 0.58 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 1c41 h GLN 162 CO -0.23 0.76 -0.19 0.00 -0.67 0.00 0.00 178.83 178.50 1c41 h ALA 163 N 1.20 -0.49 -0.59 3.87 0.00 -0.78 -1.41 119.26 121.06 1c41 h ALA 163 Ca 0.25 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1c41 h ALA 163 Cb 0.05 0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 1c41 h ALA 163 CO -0.04 -0.78 0.22 0.87 0.00 0.00 0.00 179.25 179.52 1c41 h LYS 164 N -0.50 0.39 -0.46 0.00 1.57 -0.74 -0.40 116.57 116.44 1c41 h LYS 164 Ca -0.04 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1c41 h LYS 164 Cb 0.40 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 1c41 h LYS 164 CO 0.04 0.26 0.24 0.00 -0.57 0.00 0.00 179.45 179.43 1c41 h ALA 165 N 1.40 0.58 0.00 3.86 0.00 -0.31 -1.12 119.26 123.66 1c41 h ALA 165 Ca 0.29 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1c41 h ALA 165 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1c41 h ALA 165 CO -0.29 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 178.86 1c41 h ARG 166 N 0.48 0.00 -0.21 0.00 -0.00 -0.29 -2.56 114.38 111.80 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 0.08 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.05 1c41 h ARG 166 CO -0.12 0.00 0.00 0.00 0.00 0.00 0.00 179.97 179.85 1c41 n ALA 167 N -1.86 2.46 -0.64 0.04 0.00 -0.25 -0.68 120.51 119.58 1c41 n ALA 167 Ca 0.02 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1c41 n ALA 167 Cb 0.26 -0.90 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 1.38 1.48 0.37 0.00 0.00 -0.81 -4.47 105.19 103.15 1c41 n GLY 168 Ca 0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.18 1.61 2.07 -1.52 -3.40 116.25 113.11 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 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1c41 h VAL 169 CO 0.00 0.00 1.42 -0.63 0.02 0.00 0.00 177.57 178.38 1c41 s ILE 170 N -6.01 3.23 -0.08 4.57 -1.09 -1.22 -4.83 121.20 115.77 1c41 s ILE 170 Ca -0.17 0.21 -0.08 0.00 -2.23 0.00 0.00 60.65 58.38 1c41 s ILE 170 Cb 0.06 -3.38 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 1c41 s ILE 170 CO 0.63 -0.29 0.27 -0.62 -1.23 0.00 0.00 174.94 173.71 1c41 n GLU 171 N 8.74 0.00 -0.44 2.79 1.02 -1.26 0.11 120.64 131.60 1c41 n GLU 171 Ca 0.27 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 1c41 n GLU 171 Cb 0.48 -0.26 0.00 0.00 -0.02 0.00 0.00 31.44 31.65 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 0.67 1.65 3.86 0.62 0.00 -1.26 -5.02 105.19 105.71 1c41 n GLY 172 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.31 6.40 0.04 1.61 1.04 0.29 -5.04 113.70 114.74 1c41 s SER 173 Ca 0.00 1.44 -0.20 0.00 0.48 0.00 0.00 55.95 57.67 1c41 s SER 173 Cb 0.00 -2.46 -0.06 0.00 0.10 0.00 0.00 66.02 63.59 1c41 s SER 173 CO 0.00 -0.71 0.59 -2.28 0.98 0.00 0.00 173.24 171.81 1c41 s HIS 174 N -2.89 3.76 -0.38 5.02 2.46 -1.20 -4.39 115.29 117.67 1c41 s HIS 174 Ca 0.56 1.26 -0.18 0.00 0.47 0.00 0.00 55.06 57.16 1c41 s HIS 174 Cb -0.10 -2.56 0.01 0.00 -0.13 0.00 0.00 32.58 29.80 1c41 s HIS 174 CO 0.43 0.49 0.52 1.21 -2.47 0.00 0.00 174.74 174.92 1c41 s ASN 175 N -0.73 6.30 0.57 9.88 3.84 -1.26 -1.92 114.94 131.62 1c41 s ASN 175 Ca 0.30 -0.20 0.35 0.00 0.21 0.00 0.00 52.86 53.52 1c41 s ASN 175 Cb -0.19 -2.27 1.65 0.00 -0.55 0.00 0.00 41.25 39.89 1c41 s ASN 175 CO 0.19 -0.56 2.10 0.45 -2.79 0.00 0.00 177.10 176.49 1c41 h HIS 176 N 8.59 0.00 -0.94 0.43 3.86 -1.20 -2.84 115.15 123.05 1c41 h HIS 176 Ca -0.27 0.00 0.15 0.00 -1.16 0.00 0.00 60.37 59.09 1c41 h HIS 176 Cb 1.12 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.49 1c41 h HIS 176 CO 0.71 0.04 0.56 0.78 0.86 0.00 0.00 177.93 180.87 1c41 h GLY 177 N 1.22 1.59 0.55 2.45 0.00 -1.79 0.19 103.07 107.28 1c41 h GLY 177 Ca -0.00 -0.34 0.08 0.00 0.00 0.00 0.00 47.33 47.06 1c41 h GLY 177 CO 0.01 0.02 0.34 0.83 0.00 0.00 0.00 176.54 177.74 1c41 h GLU 178 N 0.79 0.59 -0.50 4.80 5.08 -1.59 -0.55 114.58 123.20 1c41 h GLU 178 Ca 0.51 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 1c41 h GLU 178 Cb 0.66 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1c41 h GLU 178 CO -0.33 0.39 0.33 -0.44 -1.00 0.00 0.00 179.01 177.95 1c41 h ASP 179 N 0.60 0.58 -0.46 1.42 3.32 -0.83 -1.66 116.42 119.40 1c41 h ASP 179 Ca 0.32 -0.02 -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 39.68 1c41 h ASP 179 CO -0.23 0.43 0.18 -0.50 -1.72 0.00 0.00 179.24 177.39 1c41 h TRP 180 N 0.68 0.71 -0.22 4.55 6.55 -0.35 0.94 115.95 128.82 1c41 h TRP 180 Ca 0.18 -0.06 -0.00 0.00 0.95 0.00 0.00 58.89 59.96 1c41 h TRP 180 Cb -0.07 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 28.01 1c41 h TRP 180 CO -0.04 0.61 0.13 0.78 -1.05 0.00 0.00 178.44 178.88 1c41 h GLY 181 N 0.61 0.31 0.48 1.49 0.00 -0.98 0.21 103.07 105.19 1c41 h GLY 181 Ca 0.15 -0.13 0.08 0.00 0.00 0.00 0.00 47.33 47.43 1c41 h GLY 181 CO -0.01 0.13 0.22 -2.00 0.00 0.00 0.00 176.54 174.87 1c41 h LEU 182 N 0.26 0.24 -0.63 3.11 5.85 -1.05 -1.78 115.31 121.32 1c41 h LEU 182 Ca 0.08 0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 1c41 h LEU 182 Cb 0.02 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1c41 h LEU 182 CO -0.01 0.16 -0.06 0.00 -0.34 0.00 0.00 178.44 178.18 1c41 h ALA 183 N 1.37 0.84 -0.61 1.25 0.00 -0.37 -2.60 119.26 119.14 1c41 h ALA 183 Ca 0.27 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1c41 h ALA 183 Cb 0.30 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1c41 h ALA 183 CO -0.26 0.66 0.30 0.00 0.00 0.00 0.00 179.25 179.94 1c41 h ALA 184 N 1.01 0.80 0.27 0.00 0.00 0.23 -0.08 119.26 121.49 1c41 h ALA 184 Ca 0.15 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1c41 h ALA 184 Cb 0.62 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1c41 h ALA 184 CO 0.04 -0.07 -0.13 0.28 0.00 0.00 0.00 179.25 179.37 1c41 h VAL 185 N 0.55 0.78 -0.15 0.00 2.07 -1.26 0.25 116.25 118.49 1c41 h VAL 185 Ca 0.28 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.48 1c41 h VAL 185 Cb 0.24 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 1c41 h VAL 185 CO -0.22 0.08 -0.22 -0.08 0.02 0.00 0.00 177.57 177.15 1c41 h GLU 186 N -0.56 -0.26 -0.67 1.57 4.81 -1.12 -0.31 114.58 118.04 1c41 h GLU 186 Ca -0.04 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1c41 h GLU 186 Cb 0.41 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1c41 h GLU 186 CO 0.06 -0.18 0.34 0.52 -0.73 0.00 0.00 179.01 179.03 1c41 h MET 187 N -0.27 0.93 -0.20 1.92 2.86 -1.00 0.35 114.93 119.52 1c41 h MET 187 Ca 0.11 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1c41 h MET 187 Cb 0.43 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1c41 h MET 187 CO -0.30 0.70 0.12 0.78 1.06 0.00 0.00 176.91 179.27 1c41 h GLY 188 N 1.00 0.29 0.99 8.32 0.00 -0.08 0.43 103.07 114.01 1c41 h GLY 188 Ca 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1c41 h GLY 188 CO -0.03 0.11 0.01 -2.08 0.00 0.00 0.00 176.54 174.55 1c41 h VAL 189 N 0.24 1.00 -0.69 4.60 2.07 -0.62 -2.41 116.25 120.45 1c41 h VAL 189 Ca 0.07 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1c41 h VAL 189 Cb 0.02 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1c41 h VAL 189 CO -0.01 0.01 0.45 0.03 0.02 0.00 0.00 177.57 178.06 1c41 h ARG 190 N 0.03 0.87 -0.43 1.57 3.08 -0.60 -2.44 114.38 116.47 1c41 h ARG 190 Ca 0.01 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.08 1c41 h ARG 190 Cb 0.00 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 29.80 1c41 h ARG 190 CO -0.01 0.58 0.08 -0.09 -1.07 0.00 0.00 179.97 179.46 1c41 h ARG 191 N 0.90 0.21 -0.19 0.04 2.43 0.11 -0.91 114.38 116.97 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 -0.07 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.38 1c41 h ARG 191 CO -0.07 0.14 -0.16 0.00 -1.51 0.00 0.00 179.97 178.37 1c41 h ARG 192 N 0.21 -0.16 -0.57 0.20 3.08 -0.98 0.18 114.38 116.34 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 0.26 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 1c41 h ARG 192 CO -0.28 -0.11 0.34 -0.44 -1.07 0.00 0.00 179.97 178.42 1c41 h ASP 193 N -0.17 0.55 -0.55 7.04 3.32 -1.07 -0.30 116.42 125.24 1c41 h ASP 193 Ca 0.11 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 1c41 h ASP 193 Cb 0.34 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1c41 h ASP 193 CO -0.29 0.38 0.34 -0.50 -1.72 0.00 0.00 179.24 177.45 1c41 h TRP 194 N 0.67 0.71 -0.02 4.55 6.55 -0.64 0.87 115.95 128.64 1c41 h TRP 194 Ca 0.23 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.08 1c41 h TRP 194 Cb 0.04 -0.23 -0.00 0.00 -0.86 0.00 0.00 29.16 28.11 1c41 h TRP 194 CO -0.06 0.47 0.02 0.00 -1.05 0.00 0.00 178.44 177.83 1c41 h ALA 195 N 1.17 1.44 -0.22 1.49 0.00 0.30 0.31 119.26 123.76 1c41 h ALA 195 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1c41 h ALA 195 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1c41 h ALA 195 CO -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.18 1c41 n ALA 196 N -2.27 2.50 -1.08 0.00 0.00 0.17 -4.91 120.51 114.92 1c41 n ALA 196 Ca -0.03 -0.60 -0.03 0.00 0.00 0.00 0.00 53.44 52.79 1c41 n ALA 196 Cb 0.11 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.50 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 1.17 0.56 3.77 0.00 0.00 0.11 -5.00 105.19 105.81 1c41 n GLY 197 Ca 0.16 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.46 4.62 0.00 1.61 1.02 -0.45 -5.00 119.74 120.07 1c41 s LYS 198 Ca 0.00 1.24 0.00 0.00 0.02 0.00 0.00 55.97 57.23 1c41 s LYS 198 Cb 0.00 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 1c41 s LYS 198 CO 0.00 0.49 0.19 0.25 -0.92 0.00 0.00 175.35 175.37