#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p91 s PHE 3 N 0.00 1.51 0.31 7.33 0.40 -1.26 -1.05 117.98 125.22 1p91 s PHE 3 Ca 0.00 1.01 0.10 0.00 -0.60 0.00 0.00 56.93 57.44 1p91 s PHE 3 Cb 0.00 -3.17 -0.05 0.00 0.51 0.00 0.00 43.02 40.31 1p91 s PHE 3 CO 0.00 -3.60 -0.08 -1.12 0.70 0.00 0.00 175.22 171.13 1p91 s SER 4 N -2.98 3.98 -0.04 1.36 0.01 -0.20 -1.45 113.70 114.37 1p91 s SER 4 Ca 0.67 -0.98 -0.30 0.00 1.31 0.00 0.00 55.95 56.65 1p91 s SER 4 Cb -0.21 -0.48 -0.03 0.00 0.21 0.00 0.00 66.02 65.51 1p91 s SER 4 CO 0.61 -0.11 1.08 0.00 0.41 0.00 0.00 173.24 175.24 1p91 h PRO 6 N 7.06 0.00 0.00 0.00 0.11 -1.91 0.04 132.00 137.30 1p91 h PRO 6 Ca -0.36 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.46 1p91 h PRO 6 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1p91 h PRO 6 CO 0.83 0.00 -1.94 1.28 -0.21 0.00 0.00 178.00 177.95 1p91 n LEU 7 N -3.66 1.88 -0.55 2.35 4.32 -1.26 -4.70 117.00 115.38 1p91 n LEU 7 Ca 0.02 0.32 0.11 0.00 -0.02 0.00 0.00 56.01 56.45 1p91 n LEU 7 Cb 0.37 -0.76 0.04 0.00 -1.62 0.00 0.00 43.42 41.45 1p91 n LEU 7 CO 0.26 0.25 0.38 0.00 -1.22 0.00 0.00 177.39 177.05 1p91 n HIS 9 N 0.15 -2.05 -4.29 0.00 8.25 0.00 -4.86 115.22 112.41 1p91 n HIS 9 Ca 0.10 0.57 -0.25 0.00 -0.26 0.00 0.00 57.72 57.89 1p91 n HIS 9 Cb 0.48 -4.39 -0.08 0.00 1.12 0.00 0.00 29.99 27.12 1p91 n HIS 9 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1p91 s GLN 10 N -5.82 2.18 0.04 -0.41 -0.21 -1.26 -4.50 119.66 109.68 1p91 s GLN 10 Ca 0.35 -1.34 -0.38 0.00 0.02 0.00 0.00 55.36 54.00 1p91 s GLN 10 Cb -0.16 -2.16 -0.19 0.00 1.00 0.00 0.00 33.01 31.50 1p91 s GLN 10 CO 0.43 0.40 1.15 -2.30 -2.12 0.00 0.00 175.29 172.86 1p91 n PRO 11 N -0.43 0.43 -3.12 2.91 -0.02 -1.26 -1.00 135.00 132.50 1p91 n PRO 11 Ca -0.08 0.15 -0.44 0.00 -2.02 0.00 0.00 63.50 61.12 1p91 n PRO 11 Cb 0.57 -1.69 -0.06 0.00 -0.02 0.00 0.00 33.50 32.30 1p91 n PRO 11 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1p91 s LEU 12 N 0.25 4.82 0.24 2.45 1.43 -0.53 -4.27 118.68 123.08 1p91 s LEU 12 Ca 0.88 -0.78 -0.25 0.00 -1.03 0.00 0.00 54.13 52.94 1p91 s LEU 12 Cb -1.14 -2.52 -0.09 0.00 0.03 0.00 0.00 46.19 42.48 1p91 s LEU 12 CO 0.53 -0.91 0.85 -0.44 0.23 0.00 0.00 176.35 176.61 1p91 s SER 13 N 2.61 7.35 -0.12 2.29 0.01 0.29 -4.51 113.70 121.63 1p91 s SER 13 Ca 0.17 1.71 -0.03 0.00 1.31 0.00 0.00 55.95 59.12 1p91 s SER 13 Cb -0.18 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.49 1p91 s SER 13 CO 0.13 0.08 -0.01 -0.60 0.41 0.00 0.00 173.24 173.26 1p91 s ARG 14 N -1.61 3.29 -0.22 12.44 3.52 -1.26 0.81 118.95 135.93 1p91 s ARG 14 Ca 0.43 -0.44 0.01 0.00 -0.13 0.00 0.00 55.73 55.59 1p91 s ARG 14 Cb -0.21 -2.87 0.05 0.00 -1.56 0.00 0.00 34.95 30.37 1p91 s ARG 14 CO 0.25 0.51 -0.07 -2.00 -0.81 0.00 0.00 175.30 173.18 1p91 s GLU 15 N -0.36 1.78 1.64 5.12 2.12 0.34 -4.97 118.70 124.38 1p91 s GLU 15 Ca 0.07 -0.94 0.00 0.00 0.36 0.00 0.00 54.97 54.46 1p91 s GLU 15 Cb -0.12 -2.52 0.00 0.00 0.26 0.00 0.00 34.13 31.75 1p91 s GLU 15 CO 0.02 -0.53 0.00 1.17 -0.54 0.00 0.00 175.26 175.38 1p91 n LYS 16 N 4.67 0.00 -1.60 4.30 0.00 -1.26 -1.02 118.16 123.25 1p91 n LYS 16 Ca -0.13 0.00 -0.04 0.00 0.00 0.00 0.00 58.31 58.14 1p91 n LYS 16 Cb 0.45 0.00 0.09 0.00 0.00 0.00 0.00 35.03 35.57 1p91 n LYS 16 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1p91 n ASN 17 N 3.40 2.37 -4.07 3.14 3.02 -1.26 -5.04 115.26 116.82 1p91 n ASN 17 Ca 0.00 -3.08 -0.12 0.00 -0.03 0.00 0.00 54.58 51.35 1p91 n ASN 17 Cb 0.00 -0.42 -0.11 0.00 -0.61 0.00 0.00 39.78 38.64 1p91 n ASN 17 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1p91 s SER 18 N -3.16 0.80 -0.12 6.41 0.01 -0.19 -4.61 113.70 112.84 1p91 s SER 18 Ca 0.38 -0.66 -0.01 0.00 1.31 0.00 0.00 55.95 56.98 1p91 s SER 18 Cb 0.38 0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.65 1p91 s SER 18 CO -0.06 -0.29 -0.10 -0.31 0.41 0.00 0.00 173.24 172.89 1p91 s TYR 19 N -1.96 2.86 -0.02 2.43 1.51 0.67 -0.51 117.35 122.34 1p91 s TYR 19 Ca -0.06 -0.46 0.04 0.00 -1.01 0.00 0.00 57.07 55.58 1p91 s TYR 19 Cb -0.06 -1.84 -0.01 0.00 -0.11 0.00 0.00 41.96 39.94 1p91 s TYR 19 CO -0.01 -0.08 -0.13 0.42 -1.11 0.00 0.00 175.55 174.63 1p91 s ILE 20 N 0.15 1.03 0.37 2.71 1.09 0.24 0.08 121.20 126.88 1p91 s ILE 20 Ca -0.05 -0.54 0.08 0.00 -1.10 0.00 0.00 60.65 59.03 1p91 s ILE 20 Cb -0.15 -0.87 -0.03 0.00 -1.06 0.00 0.00 42.46 40.36 1p91 s ILE 20 CO 0.04 0.30 0.32 0.00 -0.10 0.00 0.00 174.94 175.50 1p91 h PRO 22 N 1.17 0.12 -1.01 0.00 0.11 -1.89 0.12 132.00 130.61 1p91 h PRO 22 Ca -0.43 -0.01 -0.61 0.00 0.11 0.00 0.00 66.00 65.06 1p91 h PRO 22 Cb 1.26 -0.03 -0.29 0.00 0.11 0.00 0.00 31.00 32.05 1p91 h PRO 22 CO 0.58 0.08 0.78 1.04 -0.21 0.00 0.00 178.00 180.27 1p91 n GLN 23 N -4.59 2.50 -3.65 1.05 6.02 -1.26 -4.92 117.38 112.53 1p91 n GLN 23 Ca 0.35 -3.13 -0.26 0.00 -0.01 0.00 0.00 57.00 53.95 1p91 n GLN 23 Cb 1.38 -2.23 0.04 0.00 1.02 0.00 0.00 30.24 30.45 1p91 n GLN 23 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1p91 n ARG 24 N -0.97 -2.48 -3.98 -1.09 1.74 0.03 -4.99 116.66 104.91 1p91 n ARG 24 Ca 0.61 0.55 -0.35 0.00 -0.77 0.00 0.00 57.85 57.90 1p91 n ARG 24 Cb 1.03 -4.68 -0.14 0.00 -1.02 0.00 0.00 32.46 27.65 1p91 n ARG 24 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1p91 s HIS 25 N -3.55 2.93 -0.08 -1.55 3.76 -1.25 -4.92 115.29 110.62 1p91 s HIS 25 Ca 0.31 -1.01 0.03 0.00 -0.15 0.00 0.00 55.06 54.24 1p91 s HIS 25 Cb -0.09 -2.07 -0.02 0.00 1.11 0.00 0.00 32.58 31.51 1p91 s HIS 25 CO 0.83 -0.56 -0.17 -1.14 -0.85 0.00 0.00 174.74 172.85 1p91 s GLN 26 N 1.39 2.85 -0.13 1.40 0.74 -1.25 -1.37 119.66 123.29 1p91 s GLN 26 Ca 0.05 -0.75 -0.00 0.00 0.05 0.00 0.00 55.36 54.71 1p91 s GLN 26 Cb -0.14 -2.41 0.02 0.00 1.10 0.00 0.00 33.01 31.58 1p91 s GLN 26 CO -0.04 0.40 -0.10 -0.06 -0.55 0.00 0.00 175.29 174.94 1p91 s PHE 27 N -0.16 1.72 0.00 1.67 0.40 0.11 -4.93 117.98 116.79 1p91 s PHE 27 Ca -0.01 -0.91 0.00 0.00 -0.60 0.00 0.00 56.93 55.41 1p91 s PHE 27 Cb -0.14 -1.36 0.00 0.00 0.51 0.00 0.00 43.02 42.04 1p91 s PHE 27 CO 0.03 -0.57 0.00 -0.25 0.70 0.00 0.00 175.22 175.14 1p91 n ASP 28 N 4.89 0.00 -4.43 1.36 10.43 -1.26 -0.24 116.55 127.30 1p91 n ASP 28 Ca -0.14 0.00 -0.23 0.00 2.57 0.00 0.00 54.79 56.99 1p91 n ASP 28 Cb 0.50 0.00 -0.10 0.00 1.84 0.00 0.00 41.12 43.36 1p91 n ASP 28 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1p91 s ALA 30 N -3.52 2.54 0.44 2.24 0.00 -1.12 -4.22 121.76 118.11 1p91 s ALA 30 Ca 0.00 -1.79 0.22 0.00 0.00 0.00 0.00 51.96 50.39 1p91 s ALA 30 Cb 0.00 -0.23 1.20 0.00 0.00 0.00 0.00 23.12 24.09 1p91 s ALA 30 CO 0.00 0.25 1.81 1.57 0.00 0.00 0.00 175.76 179.39 1p91 h LYS 31 N 2.48 0.30 -0.10 0.00 2.10 -2.02 -0.84 116.57 118.48 1p91 h LYS 31 Ca -0.40 -0.02 -0.14 0.00 -2.00 0.00 0.00 60.65 58.09 1p91 h LYS 31 Cb 1.24 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 32.50 1p91 h LYS 31 CO 0.59 0.20 -0.54 0.93 -2.00 0.00 0.00 179.45 178.62 1p91 h GLU 32 N 0.31 0.30 0.00 0.07 3.07 -1.95 -3.48 114.58 112.89 1p91 h GLU 32 Ca 0.54 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1p91 h GLU 32 Cb 1.54 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.47 1p91 h GLU 32 CO -0.20 0.77 0.00 0.41 -1.40 0.00 0.00 179.01 178.59 1p91 n GLY 33 N 0.15 0.54 3.77 -3.84 0.00 -0.32 -4.58 105.19 100.91 1p91 n GLY 33 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 1p91 n GLY 33 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1p91 n TYR 34 N 0.00 -3.63 -3.83 1.61 0.18 -1.26 -4.59 117.16 105.64 1p91 n TYR 34 Ca 0.00 -1.35 -0.29 0.00 1.88 0.00 0.00 57.90 58.14 1p91 n TYR 34 Cb 0.00 -0.90 -0.16 0.00 -0.38 0.00 0.00 39.34 37.90 1p91 n TYR 34 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1p91 s VAL 35 N -3.55 1.12 0.38 -3.48 1.01 -0.94 -2.80 120.40 112.13 1p91 s VAL 35 Ca 0.70 -1.18 -0.26 0.00 0.00 0.00 0.00 61.98 61.25 1p91 s VAL 35 Cb -0.03 -1.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.65 1p91 s VAL 35 CO 0.49 -0.34 1.13 0.21 0.00 0.00 0.00 175.10 176.59 1p91 s ASN 36 N 1.55 6.69 0.00 3.32 3.84 -1.26 -1.29 114.94 127.79 1p91 s ASN 36 Ca 0.01 2.27 0.00 0.00 0.21 0.00 0.00 52.86 55.35 1p91 s ASN 36 Cb -0.18 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 37.91 1p91 s ASN 36 CO -0.13 -0.55 0.86 0.18 -2.79 0.00 0.00 177.10 174.68 1p91 n LEU 37 N 0.21 0.00 -4.98 3.21 4.77 -0.56 -4.83 117.00 114.83 1p91 n LEU 37 Ca 0.04 -0.75 -0.25 0.00 -0.03 0.00 0.00 56.01 55.02 1p91 n LEU 37 Cb 0.47 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.68 1p91 n LEU 37 CO 0.50 0.20 0.60 -0.76 -1.33 0.00 0.00 177.39 176.60 1p91 s LEU 38 N 0.00 2.93 0.00 2.23 1.43 -1.25 -4.73 118.68 119.29 1p91 s LEU 38 Ca 0.00 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1p91 s LEU 38 Cb 0.00 -2.11 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1p91 s LEU 38 CO 0.00 -1.98 0.00 -2.65 0.23 0.00 0.00 176.35 171.95 1p91 n PRO 39 N -2.98 0.56 -0.10 1.29 -0.02 -1.26 -5.01 135.00 127.47 1p91 n PRO 39 Ca 0.14 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.47 1p91 n PRO 39 Cb 0.60 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.95 1p91 n PRO 39 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1p91 n VAL 40 N -1.05 1.49 -2.74 -1.45 0.31 -1.26 -4.87 118.33 108.76 1p91 n VAL 40 Ca 0.00 -0.69 -0.09 0.00 -0.01 0.00 0.00 64.34 63.56 1p91 n VAL 40 Cb 0.00 -1.11 0.09 0.00 -0.91 0.00 0.00 33.84 31.90 1p91 n VAL 40 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1p91 n GLN 41 N -3.10 1.13 -4.10 5.55 10.64 -1.26 -5.06 117.38 121.18 1p91 n GLN 41 Ca -0.39 -2.22 -0.22 0.00 -1.83 0.00 0.00 57.00 52.34 1p91 n GLN 41 Cb 1.06 -0.60 -0.17 0.00 -0.86 0.00 0.00 30.24 29.67 1p91 n GLN 41 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 1p91 s HIS 42 N -0.57 0.96 0.00 2.61 2.46 -1.26 -4.80 115.29 114.70 1p91 s HIS 42 Ca 0.24 -0.34 0.00 0.00 0.47 0.00 0.00 55.06 55.43 1p91 s HIS 42 Cb 0.38 -0.85 0.00 0.00 -0.13 0.00 0.00 32.58 31.98 1p91 s HIS 42 CO -0.06 -0.29 0.00 1.63 -2.47 0.00 0.00 174.74 173.55 1p91 n LYS 43 N 4.40 0.00 -0.31 2.88 5.02 -1.26 -4.68 118.16 124.21 1p91 n LYS 43 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 1p91 n LYS 43 Cb 0.51 -4.36 0.14 0.00 -0.02 0.00 0.00 35.03 31.29 1p91 n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p91 h ARG 44 N 0.00 0.97 -6.56 1.97 3.08 -1.97 -3.36 114.38 108.52 1p91 h ARG 44 Ca 0.00 -0.06 -0.53 0.00 0.07 0.00 0.00 59.98 59.46 1p91 h ARG 44 Cb 0.00 -0.22 0.04 0.00 0.08 0.00 0.00 29.97 29.87 1p91 h ARG 44 CO 0.00 0.64 0.92 -1.12 -1.07 0.00 0.00 179.97 179.34 1p91 s SER 45 N -5.80 6.59 0.00 7.04 0.01 -1.26 -4.92 113.70 115.35 1p91 s SER 45 Ca -0.13 2.58 0.00 0.00 1.31 0.00 0.00 55.95 59.72 1p91 s SER 45 Cb 0.18 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.83 1p91 s SER 45 CO 0.79 -0.85 0.00 -2.11 0.41 0.00 0.00 173.24 171.49 1p91 n ARG 46 N 4.48 0.00 -3.25 12.44 0.00 -1.26 -5.04 116.66 124.03 1p91 n ARG 46 Ca 0.15 0.00 -0.25 0.00 -0.00 0.00 0.00 57.85 57.75 1p91 n ARG 46 Cb 0.39 0.00 -0.07 0.00 -0.00 0.00 0.00 32.46 32.78 1p91 n ARG 46 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1p91 n ASP 47 N -2.13 1.83 0.00 2.89 8.00 -1.26 -5.10 116.55 120.79 1p91 n ASP 47 Ca 0.00 -3.07 0.00 0.00 0.71 0.00 0.00 54.79 52.43 1p91 n ASP 47 Cb 0.00 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 1p91 n ASP 47 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1p91 n PRO 48 N 0.96 0.00 0.00 -0.24 -0.02 -1.26 -4.86 135.00 129.58 1p91 n PRO 48 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1p91 n PRO 48 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 1p91 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p91 n GLY 49 N 0.00 2.29 2.83 -1.23 0.00 -1.26 -4.83 105.19 102.99 1p91 n GLY 49 Ca 0.00 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 1p91 n GLY 49 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1p91 n ASP 50 N 0.09 4.52 -4.85 1.61 5.68 -1.26 -5.06 116.55 117.28 1p91 n ASP 50 Ca 0.00 -3.69 -0.21 0.00 -0.50 0.00 0.00 54.79 50.39 1p91 n ASP 50 Cb 0.00 -0.54 -0.04 0.00 -1.14 0.00 0.00 41.12 39.41 1p91 n ASP 50 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1p91 s SER 51 N -3.49 5.50 0.00 -1.12 0.15 -1.26 -4.97 113.70 108.51 1p91 s SER 51 Ca 0.49 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.81 1p91 s SER 51 Cb 0.31 -1.25 0.00 0.00 -1.71 0.00 0.00 66.02 63.37 1p91 s SER 51 CO -0.15 -0.19 0.00 0.00 1.20 0.00 0.00 173.24 174.10 1p91 n ALA 52 N -1.30 0.00 -0.16 5.45 0.00 -1.26 -4.69 120.51 118.56 1p91 n ALA 52 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1p91 n ALA 52 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1p91 n ALA 52 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1p91 n GLU 53 N -3.79 0.00 0.00 0.00 -0.58 -1.26 -4.61 120.64 110.40 1p91 n GLU 53 Ca 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1p91 n GLU 53 Cb 0.00 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1p91 n GLU 53 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1p91 n GLN 56 N 3.16 0.00 0.00 3.49 6.02 -1.26 -4.85 117.38 123.93 1p91 n GLN 56 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1p91 n GLN 56 Cb 0.00 -0.69 -0.00 0.00 1.02 0.00 0.00 30.24 30.57 1p91 n GLN 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p91 h ALA 57 N 0.00 -0.12 -0.85 -1.58 0.00 -1.95 0.30 119.26 115.07 1p91 h ALA 57 Ca 0.00 -0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.11 1p91 h ALA 57 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.63 1p91 h ALA 57 CO 0.00 -0.12 -0.11 0.54 0.00 0.00 0.00 179.25 179.56 1p91 n ARG 58 N -2.13 -0.07 0.10 0.00 3.00 -1.26 0.10 116.66 116.39 1p91 n ARG 58 Ca -0.00 1.30 -0.04 0.00 -0.01 0.00 0.00 57.85 59.09 1p91 n ARG 58 Cb 0.00 -1.99 -0.02 0.00 0.00 0.00 0.00 32.46 30.45 1p91 n ARG 58 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1p91 h ARG 59 N 0.00 -0.26 -1.10 5.56 2.43 -1.97 0.83 114.38 119.87 1p91 h ARG 59 Ca 0.45 0.02 0.31 0.00 -0.81 0.00 0.00 59.98 59.95 1p91 h ARG 59 Cb 0.82 0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 30.35 1p91 h ARG 59 CO -0.84 -0.17 0.76 0.00 -1.51 0.00 0.00 179.97 178.20 1p91 h ALA 60 N -1.75 2.68 -0.03 2.80 0.00 0.35 0.84 119.26 124.15 1p91 h ALA 60 Ca -0.02 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1p91 h ALA 60 Cb 0.21 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1p91 h ALA 60 CO 0.03 -1.06 -0.02 0.35 0.00 0.00 0.00 179.25 178.55 1p91 h PHE 61 N 0.18 0.09 0.00 0.00 3.57 0.10 -3.12 116.94 117.76 1p91 h PHE 61 Ca 0.58 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 62.00 1p91 h PHE 61 Cb 1.89 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 40.60 1p91 h PHE 61 CO -0.00 0.50 -0.25 -0.07 -2.23 0.00 0.00 178.31 176.25 1p91 h LEU 62 N -0.35 0.00 0.00 0.59 3.38 0.11 -2.15 115.31 116.90 1p91 h LEU 62 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1p91 h LEU 62 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1p91 h LEU 62 CO 0.01 0.25 0.00 0.47 0.09 0.00 0.00 178.44 179.26 1p91 n ASP 63 N -4.04 0.00 -0.57 -0.43 8.00 0.09 0.11 116.55 119.71 1p91 n ASP 63 Ca -0.02 0.29 0.13 0.00 0.71 0.00 0.00 54.79 55.89 1p91 n ASP 63 Cb 0.32 -0.38 0.44 0.00 -0.02 0.00 0.00 41.12 41.48 1p91 n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p91 n ALA 64 N -1.38 2.55 -1.10 2.24 0.00 -0.81 -4.93 120.51 117.08 1p91 n ALA 64 Ca 0.04 -0.51 -0.04 0.00 0.00 0.00 0.00 53.44 52.94 1p91 n ALA 64 Cb 0.11 -1.10 -0.02 0.00 0.00 0.00 0.00 19.45 18.44 1p91 n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p91 n GLY 65 N 1.19 0.41 0.53 0.00 0.00 0.30 -4.82 105.19 102.81 1p91 n GLY 65 Ca 0.18 0.00 0.36 0.00 0.00 0.00 0.00 46.02 46.56 1p91 n GLY 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1p91 h HIS 66 N 0.00 0.17 -0.02 1.61 3.86 -1.76 0.43 115.15 119.43 1p91 h HIS 66 Ca -0.09 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1p91 h HIS 66 Cb 1.05 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 29.47 1p91 h HIS 66 CO 0.60 -0.01 -0.26 0.66 0.86 0.00 0.00 177.93 179.79 1p91 n TYR 67 N -4.27 0.00 -0.33 2.45 4.02 -1.26 -4.51 117.16 113.26 1p91 n TYR 67 Ca 0.30 0.00 0.22 0.00 -0.01 0.00 0.00 57.90 58.40 1p91 n TYR 67 Cb 1.33 0.00 0.44 0.00 -0.02 0.00 0.00 39.34 41.08 1p91 n TYR 67 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1p91 h GLN 68 N 3.42 0.25 -0.81 -0.72 4.15 -0.45 0.25 115.11 121.21 1p91 h GLN 68 Ca 0.00 -0.02 0.19 0.00 0.77 0.00 0.00 58.65 59.60 1p91 h GLN 68 Cb 0.86 -0.06 -0.12 0.00 0.21 0.00 0.00 27.48 28.37 1p91 h GLN 68 CO 0.00 0.17 0.22 -1.35 -1.93 0.00 0.00 178.83 175.93 1p91 h PRO 69 N 0.26 0.26 -0.74 -2.39 0.11 -1.79 0.51 132.00 128.21 1p91 h PRO 69 Ca 0.70 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.77 1p91 h PRO 69 Cb 1.58 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.60 1p91 h PRO 69 CO -0.64 0.17 0.39 1.25 -0.21 0.00 0.00 178.00 178.95 1p91 h LEU 70 N 0.26 0.94 0.79 2.35 5.85 -0.84 0.52 115.31 125.18 1p91 h LEU 70 Ca 0.48 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 59.05 1p91 h LEU 70 Cb 0.88 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 41.68 1p91 h LEU 70 CO -0.57 0.78 -0.38 -0.09 -0.34 0.00 0.00 178.44 177.84 1p91 h ARG 71 N 1.03 -1.02 -0.90 1.25 2.43 -0.53 -2.05 114.38 114.59 1p91 h ARG 71 Ca 0.26 0.07 0.17 0.00 -0.81 0.00 0.00 59.98 59.67 1p91 h ARG 71 Cb 0.06 0.23 -0.16 0.00 -0.42 0.00 0.00 29.97 29.68 1p91 h ARG 71 CO -0.04 -0.67 -0.28 -0.44 -1.51 0.00 0.00 179.97 177.04 1p91 h ASP 72 N -1.21 -1.02 -0.37 -3.80 3.45 0.09 0.17 116.42 113.74 1p91 h ASP 72 Ca -0.11 0.28 0.08 0.00 0.43 0.00 0.00 57.03 57.71 1p91 h ASP 72 Cb 0.82 0.61 -0.08 0.00 -0.56 0.00 0.00 39.33 40.13 1p91 h ASP 72 CO 0.18 -0.30 -0.13 0.00 -1.57 0.00 0.00 179.24 177.42 1p91 h ALA 73 N 1.70 0.18 0.22 3.45 0.00 -0.65 -0.09 119.26 124.08 1p91 h ALA 73 Ca 0.40 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 1p91 h ALA 73 Cb 0.64 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1p91 h ALA 73 CO -0.93 -0.50 -0.11 0.82 0.00 0.00 0.00 179.25 178.54 1p91 h ILE 74 N -0.05 0.85 -0.67 0.00 2.04 -0.05 0.09 117.51 119.71 1p91 h ILE 74 Ca 0.18 -0.44 0.13 0.00 1.00 0.00 0.00 64.86 65.73 1p91 h ILE 74 Cb 0.33 1.11 -0.13 0.00 -0.74 0.00 0.00 36.82 37.39 1p91 h ILE 74 CO -0.41 0.10 -0.22 0.58 0.00 0.00 0.00 178.15 178.20 1p91 h VAL 75 N -0.52 0.26 -0.50 1.67 2.07 -0.58 0.43 116.25 119.08 1p91 h VAL 75 Ca -0.03 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.41 1p91 h VAL 75 Cb 0.39 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1p91 h VAL 75 CO 0.05 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.66 1p91 h ALA 76 N 1.49 0.68 -0.77 1.67 0.00 -0.97 0.21 119.26 121.57 1p91 h ALA 76 Ca 0.31 -0.28 0.18 0.00 0.00 0.00 0.00 54.91 55.12 1p91 h ALA 76 Cb 0.53 -0.19 -0.12 0.00 0.00 0.00 0.00 17.79 18.01 1p91 h ALA 76 CO -0.71 0.47 0.14 0.37 0.00 0.00 0.00 179.25 179.52 1p91 h GLN 77 N 0.74 0.20 0.07 0.00 5.75 0.18 -1.76 115.11 120.29 1p91 h GLN 77 Ca 0.15 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.63 1p91 h GLN 77 Cb 0.49 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.00 1p91 h GLN 77 CO 0.02 0.13 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.24 1p91 h LEU 78 N 0.21 -0.07 -0.44 -2.39 3.38 -0.38 -2.81 115.31 112.81 1p91 h LEU 78 Ca 0.45 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1p91 h LEU 78 Cb 0.81 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1p91 h LEU 78 CO -0.59 0.57 0.76 -0.09 0.09 0.00 0.00 178.44 179.19 1p91 h ARG 79 N -0.79 0.00 0.00 1.13 2.43 0.27 -2.24 114.38 115.18 1p91 h ARG 79 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1p91 h ARG 79 Cb 0.62 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1p91 h ARG 79 CO 0.01 0.00 -0.82 -1.91 -1.51 0.00 0.00 179.97 175.75 1p91 n GLU 80 N -2.36 0.46 -0.28 0.20 2.13 -0.88 -4.74 120.64 115.18 1p91 n GLU 80 Ca -0.00 0.23 -0.01 0.00 0.66 0.00 0.00 57.16 58.04 1p91 n GLU 80 Cb 0.77 -1.36 0.11 0.00 0.27 0.00 0.00 31.44 31.23 1p91 n GLU 80 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1p91 h ARG 81 N -0.88 0.88 -6.55 5.31 2.47 -1.14 -3.42 114.38 111.05 1p91 h ARG 81 Ca 0.00 -0.05 -0.53 0.00 -1.26 0.00 0.00 59.98 58.14 1p91 h ARG 81 Cb 0.82 -0.20 0.01 0.00 -1.65 0.00 0.00 29.97 28.94 1p91 h ARG 81 CO 0.00 0.58 0.54 -0.51 0.56 0.00 0.00 179.97 181.14 1p91 s LEU 82 N -10.20 4.41 0.00 3.04 1.43 -1.12 -5.03 118.68 111.21 1p91 s LEU 82 Ca -0.13 2.06 0.00 0.00 -1.03 0.00 0.00 54.13 55.04 1p91 s LEU 82 Cb 0.17 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.80 1p91 s LEU 82 CO 0.78 -0.39 0.00 -0.90 0.23 0.00 0.00 176.35 176.07 1p91 n ASP 83 N 3.33 0.00 -0.12 2.29 5.68 -1.26 -4.92 116.55 121.54 1p91 n ASP 83 Ca 0.07 -0.91 0.13 0.00 -0.50 0.00 0.00 54.79 53.58 1p91 n ASP 83 Cb 0.46 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.15 1p91 n ASP 83 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1p91 n ASP 84 N -2.73 0.37 -1.59 -1.12 8.00 -1.26 -3.20 116.55 115.02 1p91 n ASP 84 Ca 0.00 -1.27 0.03 0.00 0.71 0.00 0.00 54.79 54.26 1p91 n ASP 84 Cb 0.00 -0.01 0.32 0.00 -0.02 0.00 0.00 41.12 41.41 1p91 n ASP 84 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1p91 n LYS 85 N -0.64 3.76 -3.20 -1.24 4.81 -1.26 -4.97 118.16 115.41 1p91 n LYS 85 Ca 0.19 -3.06 -0.39 0.00 -0.87 0.00 0.00 58.31 54.19 1p91 n LYS 85 Cb 0.15 -2.10 -0.06 0.00 0.02 0.00 0.00 35.03 33.04 1p91 n LYS 85 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1p91 s ALA 86 N -2.90 3.56 -0.19 3.14 0.00 -1.19 -4.98 121.76 119.19 1p91 s ALA 86 Ca 0.51 0.11 -0.11 0.00 0.00 0.00 0.00 51.96 52.47 1p91 s ALA 86 Cb 0.40 -2.71 -0.08 0.00 0.00 0.00 0.00 23.12 20.73 1p91 s ALA 86 CO 0.12 0.38 -0.26 0.25 0.00 0.00 0.00 175.76 176.24 1p91 n THR 87 N 1.66 1.16 -3.62 0.00 -2.24 -1.26 -4.66 114.28 105.33 1p91 n THR 87 Ca -0.09 -0.22 -0.15 0.00 -2.27 0.00 0.00 64.05 61.31 1p91 n THR 87 Cb 0.50 -1.82 -0.07 0.00 -2.10 0.00 0.00 70.33 66.84 1p91 n THR 87 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p91 s ALA 88 N -2.41 -1.30 0.35 6.98 0.00 -1.26 -0.54 121.76 123.57 1p91 s ALA 88 Ca -0.28 0.74 0.09 0.00 0.00 0.00 0.00 51.96 52.51 1p91 s ALA 88 Cb 0.10 0.17 -0.06 0.00 0.00 0.00 0.00 23.12 23.33 1p91 s ALA 88 CO 0.35 -0.39 -0.04 0.14 0.00 0.00 0.00 175.76 175.82 1p91 s VAL 89 N -1.72 2.38 0.02 0.00 -7.23 -0.68 -1.09 120.40 112.07 1p91 s VAL 89 Ca -0.09 -2.10 0.01 0.00 -1.81 0.00 0.00 61.98 57.99 1p91 s VAL 89 Cb -0.02 -2.73 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 1p91 s VAL 89 CO 0.04 -0.19 -0.05 -0.22 -0.31 0.00 0.00 175.10 174.37 1p91 s LEU 90 N -3.66 2.14 -0.53 1.32 2.96 -0.58 -1.99 118.68 118.35 1p91 s LEU 90 Ca 0.34 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1p91 s LEU 90 Cb 0.02 -0.12 0.13 0.00 0.50 0.00 0.00 46.19 46.72 1p91 s LEU 90 CO 0.18 -0.11 0.28 -0.62 -1.32 0.00 0.00 176.35 174.75 1p91 s ASP 91 N -0.90 4.48 0.22 3.68 3.68 0.15 0.24 116.67 128.20 1p91 s ASP 91 Ca -0.06 -2.95 -0.31 0.00 2.13 0.00 0.00 52.55 51.36 1p91 s ASP 91 Cb -0.06 -1.67 -0.10 0.00 -1.45 0.00 0.00 42.92 39.63 1p91 s ASP 91 CO -0.00 -0.26 1.52 -0.63 0.13 0.00 0.00 175.17 175.93 1p91 s ILE 92 N -0.20 2.55 -0.28 4.11 1.01 -0.37 -2.43 121.20 125.60 1p91 s ILE 92 Ca 0.17 0.43 -0.01 0.00 0.00 0.00 0.00 60.65 61.23 1p91 s ILE 92 Cb -0.25 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 38.95 1p91 s ILE 92 CO -0.01 0.05 0.16 0.61 0.00 0.00 0.00 174.94 175.75 1p91 n GLY 93 N 2.93 0.54 0.40 6.18 0.00 0.20 -4.07 105.19 111.37 1p91 n GLY 93 Ca 0.10 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1p91 n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p91 n GLY 95 N 0.17 0.61 0.60 0.00 0.00 -1.26 0.17 105.19 105.47 1p91 n GLY 95 Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 46.02 46.01 1p91 n GLY 95 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1p91 n GLU 96 N 4.26 1.70 -3.10 1.61 -0.00 -1.26 -4.22 120.64 119.64 1p91 n GLU 96 Ca 0.00 -0.71 -0.13 0.00 -0.00 0.00 0.00 57.16 56.32 1p91 n GLU 96 Cb 0.00 -1.44 0.05 0.00 -0.00 0.00 0.00 31.44 30.05 1p91 n GLU 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1p91 n GLY 97 N 0.44 0.06 0.15 -1.84 0.00 0.44 -4.06 105.19 100.38 1p91 n GLY 97 Ca 0.06 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.83 1p91 n GLY 97 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1p91 h TYR 98 N -1.52 0.49 0.08 1.61 3.20 -1.91 -3.16 116.97 115.77 1p91 h TYR 98 Ca -0.34 -0.11 -0.15 0.00 3.14 0.00 0.00 58.73 61.27 1p91 h TYR 98 Cb 1.21 -0.12 0.02 0.00 1.54 0.00 0.00 36.73 39.38 1p91 h TYR 98 CO 0.29 0.70 -0.64 1.88 -1.64 0.00 0.00 178.16 178.74 1p91 h TYR 99 N 0.15 0.49 -0.04 -3.82 -1.99 -1.92 -3.39 116.97 106.44 1p91 h TYR 99 Ca 0.05 -0.32 0.03 0.00 2.00 0.00 0.00 58.73 60.49 1p91 h TYR 99 Cb 0.55 -0.03 -0.04 0.00 2.00 0.00 0.00 36.73 39.21 1p91 h TYR 99 CO 0.06 1.21 -0.18 1.15 -0.00 0.00 0.00 178.16 180.39 1p91 h THR 100 N -0.37 0.55 -0.17 -2.88 2.02 -1.90 -2.25 112.91 107.91 1p91 h THR 100 Ca -0.10 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.13 1p91 h THR 100 Cb 1.45 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 1p91 h THR 100 CO 0.12 0.00 0.33 1.12 0.37 0.00 0.00 175.52 177.46 1p91 h HIS 101 N -0.28 0.00 0.07 3.16 2.07 -1.74 0.37 115.15 118.81 1p91 h HIS 101 Ca 0.07 0.00 -0.26 0.00 -2.85 0.00 0.00 60.37 57.33 1p91 h HIS 101 Cb 0.37 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.36 1p91 h HIS 101 CO -0.25 0.00 -1.11 0.00 -3.07 0.00 0.00 177.93 173.50 1p91 h ALA 102 N 1.50 0.20 -0.17 6.11 0.00 -1.60 -1.48 119.26 123.82 1p91 h ALA 102 Ca 0.08 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.19 1p91 h ALA 102 Cb 0.75 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1p91 h ALA 102 CO -0.00 0.86 0.06 0.74 0.00 0.00 0.00 179.25 180.90 1p91 h PHE 103 N 0.17 0.26 0.60 0.00 0.05 -0.19 -1.93 116.94 115.91 1p91 h PHE 103 Ca -0.12 -0.02 -0.02 0.00 3.82 0.00 0.00 57.97 61.62 1p91 h PHE 103 Cb 1.79 -0.08 -0.00 0.00 2.00 0.00 0.00 35.95 39.66 1p91 h PHE 103 CO 0.07 0.34 -0.35 0.00 -0.18 0.00 0.00 178.31 178.19 1p91 h ALA 104 N 0.89 -0.91 0.00 2.45 0.00 -1.16 -0.54 119.26 119.99 1p91 h ALA 104 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1p91 h ALA 104 Cb 0.20 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1p91 h ALA 104 CO -0.00 -1.02 0.32 -0.44 0.00 0.00 0.00 179.25 178.10 1p91 h ASP 105 N -0.90 0.00 -0.21 0.00 3.32 -1.21 0.46 116.42 117.89 1p91 h ASP 105 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1p91 h ASP 105 Cb 0.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1p91 h ASP 105 CO 0.09 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.61 1p91 n ALA 106 N -1.69 2.41 -3.06 3.45 0.00 -0.31 -4.58 120.51 116.73 1p91 n ALA 106 Ca -0.01 -0.84 -0.17 0.00 0.00 0.00 0.00 53.44 52.41 1p91 n ALA 106 Cb 0.35 -0.64 -0.01 0.00 0.00 0.00 0.00 19.45 19.15 1p91 n ALA 106 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p91 n LEU 107 N 1.05 -0.34 0.01 0.00 4.77 0.16 -4.82 117.00 117.83 1p91 n LEU 107 Ca 0.13 -4.50 -0.10 0.00 -0.03 0.00 0.00 56.01 51.52 1p91 n LEU 107 Cb 0.48 0.75 -0.03 0.00 -2.33 0.00 0.00 43.42 42.28 1p91 n LEU 107 CO 0.12 2.15 0.76 1.55 -1.33 0.00 0.00 177.39 180.64 1p91 h PRO 108 N 3.43 -0.19 0.00 3.23 0.13 -1.79 -2.13 132.00 134.68 1p91 h PRO 108 Ca 0.03 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1p91 h PRO 108 Cb 0.97 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1p91 h PRO 108 CO 0.41 -0.13 0.04 0.39 -0.23 0.00 0.00 178.00 178.48 1p91 n GLU 109 N -5.29 0.08 -4.40 0.86 -0.58 -1.26 -4.67 120.64 105.39 1p91 n GLU 109 Ca -0.03 0.57 -0.24 0.00 -0.42 0.00 0.00 57.16 57.04 1p91 n GLU 109 Cb 0.21 -1.82 -0.09 0.00 -0.57 0.00 0.00 31.44 29.17 1p91 n GLU 109 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1p91 s ILE 110 N -3.31 2.86 0.05 -3.67 -4.36 -0.80 -4.89 121.20 107.08 1p91 s ILE 110 Ca -0.01 -2.18 -0.25 0.00 -0.26 0.00 0.00 60.65 57.94 1p91 s ILE 110 Cb 0.04 -2.50 -0.06 0.00 1.25 0.00 0.00 42.46 41.19 1p91 s ILE 110 CO 0.12 -0.37 0.77 -0.89 0.24 0.00 0.00 174.94 174.81 1p91 s THR 111 N -2.38 4.72 -0.16 8.37 2.01 0.29 -4.93 115.64 123.57 1p91 s THR 111 Ca 0.30 1.64 -0.02 0.00 0.31 0.00 0.00 61.69 63.91 1p91 s THR 111 Cb -0.06 -4.12 -0.02 0.00 0.01 0.00 0.00 72.50 68.32 1p91 s THR 111 CO 0.17 0.37 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.50 1p91 s THR 112 N -0.08 3.42 -0.07 -0.82 2.01 -1.26 -1.69 115.64 117.15 1p91 s THR 112 Ca 0.39 -0.51 0.03 0.00 0.31 0.00 0.00 61.69 61.90 1p91 s THR 112 Cb -0.21 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 1p91 s THR 112 CO 0.23 0.49 -0.14 -0.36 -0.69 0.00 0.00 174.62 174.15 1p91 s PHE 113 N 0.64 2.72 -0.31 4.92 0.40 -0.84 -1.30 117.98 124.22 1p91 s PHE 113 Ca -0.04 -0.26 0.03 0.00 -0.60 0.00 0.00 56.93 56.05 1p91 s PHE 113 Cb -0.15 -1.67 0.09 0.00 0.51 0.00 0.00 43.02 41.80 1p91 s PHE 113 CO 0.02 0.10 0.03 0.20 0.70 0.00 0.00 175.22 176.27 1p91 s GLY 114 N -0.51 1.70 -0.04 4.36 0.00 -0.99 0.30 107.32 112.14 1p91 s GLY 114 Ca 0.07 -2.18 -0.13 0.00 0.00 0.00 0.00 44.72 42.48 1p91 s GLY 114 CO 0.02 1.01 0.35 -2.27 0.00 0.00 0.00 173.10 172.20 1p91 s LEU 115 N 1.09 4.43 0.23 0.66 0.20 -1.02 -1.91 118.68 122.38 1p91 s LEU 115 Ca 0.06 0.83 -0.16 0.00 0.69 0.00 0.00 54.13 55.56 1p91 s LEU 115 Cb -0.19 -2.48 0.01 0.00 -0.43 0.00 0.00 46.19 43.10 1p91 s LEU 115 CO -0.10 0.31 0.54 -0.62 -0.29 0.00 0.00 176.35 176.18 1p91 s ASP 116 N -0.87 -0.17 0.00 3.68 3.68 -1.14 -0.63 116.67 121.21 1p91 s ASP 116 Ca 0.22 -0.72 0.14 0.00 2.13 0.00 0.00 52.55 54.32 1p91 s ASP 116 Cb -0.15 0.61 0.13 0.00 -1.45 0.00 0.00 42.92 42.06 1p91 s ASP 116 CO 0.11 -1.15 0.98 1.33 0.13 0.00 0.00 175.17 176.56 1p91 n VAL 117 N -0.38 0.08 -3.05 1.11 0.24 -1.24 -0.31 118.33 114.77 1p91 n VAL 117 Ca -0.05 -0.54 -0.44 0.00 -2.04 0.00 0.00 64.34 61.27 1p91 n VAL 117 Cb 0.61 1.24 -0.05 0.00 -1.47 0.00 0.00 33.84 34.17 1p91 n VAL 117 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1p91 s SER 118 N -1.17 6.21 0.23 -1.34 0.15 -1.26 -4.80 113.70 111.73 1p91 s SER 118 Ca 0.17 -1.05 -0.06 0.00 0.70 0.00 0.00 55.95 55.71 1p91 s SER 118 Cb 0.12 -2.33 0.41 0.00 -1.71 0.00 0.00 66.02 62.51 1p91 s SER 118 CO 0.18 -1.11 1.72 0.07 1.20 0.00 0.00 173.24 175.30 1p91 h LYS 119 N 9.20 0.35 -0.43 5.44 -0.00 -1.96 0.49 116.57 129.66 1p91 h LYS 119 Ca -0.28 -0.02 -0.06 0.00 -0.00 0.00 0.00 60.65 60.29 1p91 h LYS 119 Cb 1.09 -0.08 -0.02 0.00 -0.00 0.00 0.00 32.23 33.22 1p91 h LYS 119 CO 1.07 0.23 0.03 -0.39 -0.00 0.00 0.00 179.45 180.39 1p91 h VAL 120 N 0.36 1.22 0.13 0.07 -1.51 -1.95 -0.59 116.25 113.97 1p91 h VAL 120 Ca 0.38 -0.85 -0.01 0.00 -1.23 0.00 0.00 66.70 64.99 1p91 h VAL 120 Cb 0.59 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 30.60 1p91 h VAL 120 CO -0.42 0.30 -0.06 0.00 -1.23 0.00 0.00 177.57 176.16 1p91 h ALA 121 N 1.40 -0.17 -0.85 5.19 0.00 -1.15 -2.79 119.26 120.88 1p91 h ALA 121 Ca 0.14 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1p91 h ALA 121 Cb 0.35 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1p91 h ALA 121 CO 0.01 -0.34 0.54 0.82 0.00 0.00 0.00 179.25 180.27 1p91 h ILE 122 N -0.68 1.08 -0.32 0.00 1.08 -0.03 0.08 117.51 118.72 1p91 h ILE 122 Ca -0.02 -0.35 0.04 0.00 -0.39 0.00 0.00 64.86 64.15 1p91 h ILE 122 Cb 0.51 -0.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.21 1p91 h ILE 122 CO 0.03 0.18 0.10 0.50 -0.69 0.00 0.00 178.15 178.27 1p91 h LYS 123 N 1.01 0.23 -0.40 2.37 3.64 -1.14 0.18 116.57 122.45 1p91 h LYS 123 Ca 0.36 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.71 1p91 h LYS 123 Cb 0.10 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1p91 h LYS 123 CO -0.15 0.15 0.21 0.00 -2.27 0.00 0.00 179.45 177.39 1p91 h ALA 124 N 1.21 0.52 0.45 5.00 0.00 -1.07 -1.74 119.26 123.62 1p91 h ALA 124 Ca 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1p91 h ALA 124 Cb 0.13 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1p91 h ALA 124 CO -0.16 0.06 -0.23 0.00 0.00 0.00 0.00 179.25 178.92 1p91 h ALA 125 N 1.06 -1.15 -1.19 0.00 0.00 -0.46 -2.36 119.26 115.16 1p91 h ALA 125 Ca 0.14 -0.13 0.34 0.00 0.00 0.00 0.00 54.91 55.26 1p91 h ALA 125 Cb 0.08 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 1p91 h ALA 125 CO -0.02 -1.11 0.81 0.00 0.00 0.00 0.00 179.25 178.93 1p91 h ALA 126 N -1.68 2.73 0.01 0.00 0.00 -0.66 0.51 119.26 120.17 1p91 h ALA 126 Ca -0.06 0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 1p91 h ALA 126 Cb 0.48 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1p91 h ALA 126 CO 0.09 -1.16 -1.01 -0.22 0.00 0.00 0.00 179.25 176.95 1p91 h LYS 127 N 0.18 0.56 0.14 0.00 3.64 -1.22 -3.37 116.57 116.50 1p91 h LYS 127 Ca 0.64 -0.61 -0.28 0.00 -1.27 0.00 0.00 60.65 59.13 1p91 h LYS 127 Cb 2.10 0.17 0.01 0.00 -0.41 0.00 0.00 32.23 34.10 1p91 h LYS 127 CO -0.20 1.23 -1.39 -0.09 -2.27 0.00 0.00 179.45 176.72 1p91 h ARG 128 N 0.31 0.30 -4.15 1.90 2.43 -0.20 -3.43 114.38 111.54 1p91 h ARG 128 Ca -0.11 -0.51 -0.72 0.00 -0.81 0.00 0.00 59.98 57.83 1p91 h ARG 128 Cb 1.65 0.19 -0.31 0.00 -0.42 0.00 0.00 29.97 31.08 1p91 h ARG 128 CO 0.19 1.24 -0.38 0.71 -1.51 0.00 0.00 179.97 180.22 1p91 s TYR 129 N -2.50 3.49 0.21 2.20 4.12 0.15 -4.95 117.35 120.06 1p91 s TYR 129 Ca -0.18 -2.17 0.02 0.00 0.02 0.00 0.00 57.07 54.76 1p91 s TYR 129 Cb 0.04 -3.41 0.15 0.00 -1.52 0.00 0.00 41.96 37.22 1p91 s TYR 129 CO 0.80 -0.96 1.49 -1.00 0.02 0.00 0.00 175.55 175.91 1p91 h PRO 130 N 8.02 0.31 0.00 -1.71 0.13 -1.84 -3.23 132.00 133.67 1p91 h PRO 130 Ca -0.13 -0.24 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1p91 h PRO 130 Cb 1.04 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1p91 h PRO 130 CO 0.79 0.87 0.00 0.00 -0.23 0.00 0.00 178.00 179.43 1p91 n GLN 131 N -3.84 0.16 -4.76 0.86 0.00 -1.26 -4.58 117.38 103.96 1p91 n GLN 131 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 57.00 56.73 1p91 n GLN 131 Cb 0.67 -1.17 -0.15 0.00 0.00 0.00 0.00 30.24 29.59 1p91 n GLN 131 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1p91 s VAL 132 N -2.00 1.27 -0.63 -0.39 1.01 -1.22 -4.57 120.40 113.87 1p91 s VAL 132 Ca 0.03 -0.68 -0.22 0.00 0.00 0.00 0.00 61.98 61.10 1p91 s VAL 132 Cb 0.01 -1.06 0.07 0.00 0.00 0.00 0.00 36.38 35.40 1p91 s VAL 132 CO 0.02 0.36 0.90 -0.89 0.00 0.00 0.00 175.10 175.49 1p91 s THR 133 N -0.33 4.44 -0.00 3.92 2.01 -0.42 -4.94 115.64 120.32 1p91 s THR 133 Ca 0.05 -0.43 -0.17 0.00 0.31 0.00 0.00 61.69 61.46 1p91 s THR 133 Cb -0.07 -4.62 -0.06 0.00 0.01 0.00 0.00 72.50 67.76 1p91 s THR 133 CO -0.00 -1.34 0.47 -0.36 -0.69 0.00 0.00 174.62 172.69 1p91 s PHE 134 N 3.75 3.71 0.07 4.92 0.40 -1.26 -2.34 117.98 127.23 1p91 s PHE 134 Ca 0.21 1.05 0.07 0.00 -0.60 0.00 0.00 56.93 57.65 1p91 s PHE 134 Cb -0.18 -2.40 -0.03 0.00 0.51 0.00 0.00 43.02 40.92 1p91 s PHE 134 CO 0.10 0.54 -0.18 0.00 0.70 0.00 0.00 175.22 176.38 1p91 s VAL 136 N -1.07 3.32 0.24 0.00 1.01 -0.41 -2.90 120.40 120.59 1p91 s VAL 136 Ca 0.04 -1.85 -0.22 0.00 0.00 0.00 0.00 61.98 59.95 1p91 s VAL 136 Cb -0.09 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.15 1p91 s VAL 136 CO 0.03 -0.55 0.81 0.00 0.00 0.00 0.00 175.10 175.38 1p91 s ALA 137 N 1.19 -1.35 -0.09 5.51 0.00 0.58 -1.50 121.76 126.11 1p91 s ALA 137 Ca 0.05 -0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.53 1p91 s ALA 137 Cb -0.22 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.65 1p91 s ALA 137 CO -0.03 -1.04 1.11 -1.54 0.00 0.00 0.00 175.76 174.26 1p91 s SER 138 N -2.94 7.14 -0.13 0.00 1.04 -1.26 -3.68 113.70 113.86 1p91 s SER 138 Ca 0.12 1.67 0.01 0.00 0.48 0.00 0.00 55.95 58.23 1p91 s SER 138 Cb -0.04 -2.56 0.21 0.00 0.10 0.00 0.00 66.02 63.73 1p91 s SER 138 CO 0.06 -0.53 1.25 -1.54 0.98 0.00 0.00 173.24 173.45 1p91 n SER 139 N 5.18 3.17 0.23 7.02 3.41 -1.26 -3.94 113.62 127.42 1p91 n SER 139 Ca 0.10 -2.47 0.12 0.00 -0.26 0.00 0.00 58.87 56.36 1p91 n SER 139 Cb 0.47 -0.60 0.36 0.00 -0.26 0.00 0.00 64.21 64.19 1p91 n SER 139 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 1p91 h HIS 140 N 0.37 0.00 -2.42 7.33 2.07 -1.95 -3.39 115.15 117.16 1p91 h HIS 140 Ca 0.18 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.48 1p91 h HIS 140 Cb 1.52 0.00 -0.32 0.00 2.57 0.00 0.00 27.41 31.18 1p91 h HIS 140 CO 0.47 0.12 -0.53 0.50 -3.07 0.00 0.00 177.93 175.42 1p91 s ARG 141 N -3.41 0.24 0.26 5.12 3.00 -1.25 -4.91 118.95 118.00 1p91 s ARG 141 Ca 0.03 0.53 -0.30 0.00 -1.00 0.00 0.00 55.73 54.99 1p91 s ARG 141 Cb 0.08 -0.53 -0.11 0.00 0.00 0.00 0.00 34.95 34.39 1p91 s ARG 141 CO 0.64 -0.51 1.57 -0.51 0.00 0.00 0.00 175.30 176.49 1p91 s LEU 142 N 2.44 4.36 0.00 -0.88 1.43 -1.26 -4.87 118.68 119.90 1p91 s LEU 142 Ca 0.06 2.84 0.00 0.00 -1.03 0.00 0.00 54.13 56.00 1p91 s LEU 142 Cb -0.14 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1p91 s LEU 142 CO -0.12 -0.86 0.70 -2.65 0.23 0.00 0.00 176.35 173.64 1p91 n PRO 143 N 2.67 0.60 -4.18 1.29 -0.02 -1.26 -4.82 135.00 129.27 1p91 n PRO 143 Ca 0.10 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.42 1p91 n PRO 143 Cb 0.38 -1.20 -0.11 0.00 -0.02 0.00 0.00 33.50 32.54 1p91 n PRO 143 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1p91 s PHE 144 N 0.47 1.16 0.56 6.00 0.40 -1.26 -1.04 117.98 124.27 1p91 s PHE 144 Ca 0.00 -0.58 -0.20 0.00 -0.60 0.00 0.00 56.93 55.55 1p91 s PHE 144 Cb 0.00 -0.63 -0.05 0.00 0.51 0.00 0.00 43.02 42.85 1p91 s PHE 144 CO 0.00 0.04 1.22 -1.12 0.70 0.00 0.00 175.22 176.06 1p91 s SER 145 N -2.23 5.43 0.52 1.36 0.01 -0.22 -4.63 113.70 113.94 1p91 s SER 145 Ca 0.04 2.42 -0.21 0.00 1.31 0.00 0.00 55.95 59.51 1p91 s SER 145 Cb -0.05 -2.60 -0.07 0.00 0.21 0.00 0.00 66.02 63.50 1p91 s SER 145 CO 0.01 -1.44 1.05 0.47 0.41 0.00 0.00 173.24 173.75 1p91 n ASP 146 N -1.26 1.32 -3.98 2.44 9.92 -1.26 -2.75 116.55 120.97 1p91 n ASP 146 Ca 0.12 0.92 -0.28 0.00 -0.53 0.00 0.00 54.79 55.03 1p91 n ASP 146 Cb 0.49 -1.41 -0.01 0.00 -0.64 0.00 0.00 41.12 39.54 1p91 n ASP 146 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1p91 n THR 147 N -1.12 -2.70 -1.50 -3.53 -1.04 0.21 -4.90 114.28 99.70 1p91 n THR 147 Ca 0.11 -0.35 -0.16 0.00 -2.04 0.00 0.00 64.05 61.62 1p91 n THR 147 Cb 0.44 -2.59 0.15 0.00 -1.82 0.00 0.00 70.33 66.50 1p91 n THR 147 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1p91 n SER 148 N -2.91 3.88 0.00 8.00 3.41 -0.28 -4.63 113.62 121.08 1p91 n SER 148 Ca -0.20 -3.76 0.00 0.00 -0.26 0.00 0.00 58.87 54.65 1p91 n SER 148 Cb 0.63 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1p91 n SER 148 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1p91 n ASP 150 N -1.03 0.20 -3.56 4.04 9.92 -0.25 -4.73 116.55 121.14 1p91 n ASP 150 Ca 0.44 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.57 1p91 n ASP 150 Cb 1.07 0.03 -0.05 0.00 -0.64 0.00 0.00 41.12 41.52 1p91 n ASP 150 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1p91 s ALA 151 N -0.69 -1.88 -0.07 2.24 0.00 -1.26 -0.79 121.76 119.32 1p91 s ALA 151 Ca 0.00 1.49 0.01 0.00 0.00 0.00 0.00 51.96 53.47 1p91 s ALA 151 Cb 0.00 -0.47 0.02 0.00 0.00 0.00 0.00 23.12 22.67 1p91 s ALA 151 CO 0.00 -0.33 -0.08 0.42 0.00 0.00 0.00 175.76 175.77 1p91 s ILE 152 N -1.17 0.83 -0.20 0.00 1.01 -0.58 -1.52 121.20 119.57 1p91 s ILE 152 Ca -0.05 -0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.23 1p91 s ILE 152 Cb -0.00 -0.82 -0.05 0.00 0.01 0.00 0.00 42.46 41.60 1p91 s ILE 152 CO 0.04 0.30 0.18 -0.63 0.00 0.00 0.00 174.94 174.83 1p91 s ILE 153 N 1.02 5.37 -0.53 2.92 1.09 0.14 -1.43 121.20 129.78 1p91 s ILE 153 Ca -0.09 0.27 0.04 0.00 -1.10 0.00 0.00 60.65 59.77 1p91 s ILE 153 Cb -0.14 -3.52 0.14 0.00 -1.06 0.00 0.00 42.46 37.88 1p91 s ILE 153 CO -0.00 0.40 0.28 -0.13 -0.10 0.00 0.00 174.94 175.40 1p91 s ARG 154 N 0.56 1.91 -0.84 2.79 0.52 0.25 -1.23 118.95 122.91 1p91 s ARG 154 Ca 0.10 -2.60 -0.18 0.00 -0.52 0.00 0.00 55.73 52.53 1p91 s ARG 154 Cb -0.12 -3.14 0.15 0.00 0.52 0.00 0.00 34.95 32.35 1p91 s ARG 154 CO 0.01 -1.14 0.96 0.42 0.02 0.00 0.00 175.30 175.56 1p91 s ILE 155 N -0.32 4.96 0.00 1.52 1.01 -1.26 -2.14 121.20 124.98 1p91 s ILE 155 Ca 0.18 -1.67 0.00 0.00 0.00 0.00 0.00 60.65 59.16 1p91 s ILE 155 Cb -0.23 -4.65 0.00 0.00 0.01 0.00 0.00 42.46 37.60 1p91 s ILE 155 CO -0.02 -1.32 0.00 0.00 0.00 0.00 0.00 174.94 173.60 1p91 n TYR 156 N 5.87 0.00 -3.40 3.97 9.36 0.34 -4.96 117.16 128.34 1p91 n TYR 156 Ca 0.15 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.99 1p91 n TYR 156 Cb 0.47 -0.93 -0.07 0.00 -0.63 0.00 0.00 39.34 38.19 1p91 n TYR 156 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1p91 s ALA 157 N -2.07 3.55 0.71 2.98 0.00 -1.26 -5.06 121.76 120.61 1p91 s ALA 157 Ca 0.00 -0.43 -0.16 0.00 0.00 0.00 0.00 51.96 51.37 1p91 s ALA 157 Cb 0.00 -2.59 0.03 0.00 0.00 0.00 0.00 23.12 20.56 1p91 s ALA 157 CO 0.00 -0.15 1.22 -1.25 0.00 0.00 0.00 175.76 175.58 1p91 s PRO 158 N 0.97 2.26 -0.08 0.00 0.04 -1.26 -4.92 135.00 132.02 1p91 s PRO 158 Ca 0.20 1.80 -0.30 0.00 0.04 0.00 0.00 61.00 62.74 1p91 s PRO 158 Cb -0.14 -1.84 0.11 0.00 0.04 0.00 0.00 34.50 32.67 1p91 s PRO 158 CO 0.07 -1.75 0.97 0.00 0.04 0.00 0.00 177.00 176.33 1p91 s LYS 160 N -2.41 3.80 0.07 0.00 -0.14 -1.26 -4.99 119.74 114.80 1p91 s LYS 160 Ca 0.04 0.34 -0.22 0.00 -1.36 0.00 0.00 55.97 54.76 1p91 s LYS 160 Cb -0.01 -2.54 -0.14 0.00 -1.68 0.00 0.00 37.83 33.46 1p91 s LYS 160 CO -0.05 0.18 1.60 0.00 -0.76 0.00 0.00 175.35 176.31 1p91 h ALA 161 N 1.98 0.10 -0.67 5.17 0.00 -1.96 -2.96 119.26 120.92 1p91 h ALA 161 Ca -0.47 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.47 1p91 h ALA 161 Cb 1.18 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 1p91 h ALA 161 CO 0.66 -0.31 0.20 0.93 0.00 0.00 0.00 179.25 180.73 1p91 h GLU 162 N -0.04 0.32 -0.31 0.00 5.08 -1.94 0.14 114.58 117.83 1p91 h GLU 162 Ca 0.03 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1p91 h GLU 162 Cb 0.17 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1p91 h GLU 162 CO -0.00 0.21 0.19 0.93 -1.00 0.00 0.00 179.01 179.34 1p91 h GLU 163 N 0.33 0.42 -0.01 2.33 4.39 -1.94 0.40 114.58 120.50 1p91 h GLU 163 Ca 0.36 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 60.03 1p91 h GLU 163 Cb 0.55 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1p91 h GLU 163 CO -0.41 0.29 -0.00 -0.07 -1.16 0.00 0.00 179.01 177.66 1p91 h LEU 164 N 0.43 0.02 -0.95 1.33 3.38 -0.61 -1.56 115.31 117.35 1p91 h LEU 164 Ca 0.11 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1p91 h LEU 164 Cb -0.02 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 1p91 h LEU 164 CO -0.02 0.33 0.63 0.00 0.09 0.00 0.00 178.44 179.46 1p91 h ALA 165 N 0.69 1.22 0.54 1.53 0.00 -0.14 -1.22 119.26 121.88 1p91 h ALA 165 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1p91 h ALA 165 Cb 0.32 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1p91 h ALA 165 CO 0.00 0.57 -0.26 -0.09 0.00 0.00 0.00 179.25 179.47 1p91 h ARG 166 N 1.26 -0.71 0.00 0.00 2.43 -0.10 -3.33 114.38 113.94 1p91 h ARG 166 Ca 0.36 0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.52 1p91 h ARG 166 Cb -0.11 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1p91 h ARG 166 CO -0.09 -0.47 -0.23 0.28 -1.51 0.00 0.00 179.97 177.95 1p91 h VAL 167 N -0.88 1.07 -3.36 0.20 2.07 -1.30 0.60 116.25 114.65 1p91 h VAL 167 Ca -0.07 -0.82 -0.56 0.00 0.82 0.00 0.00 66.70 66.06 1p91 h VAL 167 Cb 0.56 1.45 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 1p91 h VAL 167 CO 0.12 0.23 0.15 -0.69 0.02 0.00 0.00 177.57 177.40 1p91 s VAL 168 N -4.41 5.01 0.85 2.57 1.01 -0.46 -1.13 120.40 123.84 1p91 s VAL 168 Ca -0.03 1.49 -0.12 0.00 0.00 0.00 0.00 61.98 63.31 1p91 s VAL 168 Cb 0.15 -4.06 0.09 0.00 0.00 0.00 0.00 36.38 32.55 1p91 s VAL 168 CO 0.69 0.20 1.04 0.29 0.00 0.00 0.00 175.10 177.31 1p91 n LYS 169 N 4.10 -0.06 -2.52 2.72 5.02 -1.26 -4.64 118.16 121.52 1p91 n LYS 169 Ca 0.00 0.06 -0.41 0.00 -2.02 0.00 0.00 58.31 55.94 1p91 n LYS 169 Cb 0.51 -2.30 -0.04 0.00 -0.02 0.00 0.00 35.03 33.17 1p91 n LYS 169 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 1p91 s PRO 170 N -4.10 4.61 0.00 1.97 0.02 -1.26 -1.91 135.00 134.33 1p91 s PRO 170 Ca 0.69 1.72 0.00 0.00 0.02 0.00 0.00 61.00 63.43 1p91 s PRO 170 Cb -0.27 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 30.99 1p91 s PRO 170 CO 0.56 0.11 0.00 0.41 -0.33 0.00 0.00 177.00 177.75 1p91 n GLY 171 N 1.91 1.11 2.16 0.52 0.00 1.12 -4.82 105.19 107.19 1p91 n GLY 171 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 1p91 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p91 n GLY 172 N -2.00 -2.70 3.40 -0.02 0.00 -0.80 -4.49 105.19 98.58 1p91 n GLY 172 Ca 0.00 -1.47 -0.20 0.00 0.00 0.00 0.00 46.02 44.35 1p91 n GLY 172 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1p91 s TRP 173 N -2.21 1.89 -0.04 1.61 0.52 0.03 0.01 118.94 120.74 1p91 s TRP 173 Ca 0.44 -0.64 -0.02 0.00 0.02 0.00 0.00 56.10 55.90 1p91 s TRP 173 Cb -0.04 -1.00 0.03 0.00 -1.15 0.00 0.00 33.47 31.30 1p91 s TRP 173 CO 0.34 0.33 0.10 0.08 0.02 0.00 0.00 176.95 177.81 1p91 s VAL 174 N -2.97 -0.05 -0.11 4.03 1.01 -0.39 -1.53 120.40 120.40 1p91 s VAL 174 Ca 0.27 0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.44 1p91 s VAL 174 Cb 0.02 -0.17 0.02 0.00 0.00 0.00 0.00 36.38 36.25 1p91 s VAL 174 CO 0.10 0.07 -0.13 -0.63 0.00 0.00 0.00 175.10 174.52 1p91 s ILE 175 N 1.03 1.33 0.08 2.22 1.01 -0.52 -1.61 121.20 124.75 1p91 s ILE 175 Ca -0.08 -0.53 0.08 0.00 0.00 0.00 0.00 60.65 60.12 1p91 s ILE 175 Cb -0.11 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 1p91 s ILE 175 CO -0.04 0.41 -0.21 0.42 0.00 0.00 0.00 174.94 175.52 1p91 s THR 176 N 1.18 1.68 -0.05 2.92 -4.23 -1.05 -0.58 115.64 115.50 1p91 s THR 176 Ca -0.03 -1.40 -0.02 0.00 -1.18 0.00 0.00 61.69 59.06 1p91 s THR 176 Cb -0.14 -1.50 0.04 0.00 1.34 0.00 0.00 72.50 72.23 1p91 s THR 176 CO -0.04 0.04 0.10 0.00 -0.54 0.00 0.00 174.62 174.18 1p91 s ALA 177 N -1.02 0.02 0.30 3.99 0.00 -0.91 -0.88 121.76 123.26 1p91 s ALA 177 Ca 0.07 0.39 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1p91 s ALA 177 Cb -0.09 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 1p91 s ALA 177 CO 0.03 -0.39 0.13 0.95 0.00 0.00 0.00 175.76 176.48 1p91 s THR 178 N 1.86 0.47 0.54 0.00 -4.23 -1.11 -0.50 115.64 112.65 1p91 s THR 178 Ca -0.00 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.31 1p91 s THR 178 Cb -0.12 -2.56 -0.06 0.00 1.34 0.00 0.00 72.50 71.10 1p91 s THR 178 CO -0.04 0.00 1.11 -2.16 -0.54 0.00 0.00 174.62 172.98 1p91 s PRO 179 N -3.89 3.44 0.66 3.99 0.04 -1.26 0.07 135.00 138.04 1p91 s PRO 179 Ca 0.36 1.53 0.03 0.00 0.04 0.00 0.00 61.00 62.96 1p91 s PRO 179 Cb 0.06 -2.03 0.12 0.00 0.04 0.00 0.00 34.50 32.70 1p91 s PRO 179 CO 0.16 -0.76 0.90 0.41 0.04 0.00 0.00 177.00 177.75 1p91 n GLY 180 N 0.01 1.13 0.15 0.56 0.00 1.03 -4.52 105.19 103.54 1p91 n GLY 180 Ca 0.11 -2.10 -0.09 0.00 0.00 0.00 0.00 46.02 43.93 1p91 n GLY 180 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1p91 h PRO 181 N 0.00 -0.11 0.00 1.61 0.11 -1.85 -2.70 132.00 129.06 1p91 h PRO 181 Ca -0.30 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1p91 h PRO 181 Cb 1.20 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1p91 h PRO 181 CO 0.36 -0.07 0.00 0.54 -0.21 0.00 0.00 178.00 178.62 1p91 n ARG 182 N -5.24 1.00 -1.61 1.05 1.74 -1.26 -4.66 116.66 107.68 1p91 n ARG 182 Ca -0.03 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.64 1p91 n ARG 182 Cb 0.16 -1.14 -0.03 0.00 -1.02 0.00 0.00 32.46 30.43 1p91 n ARG 182 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1p91 s HIS 183 N -2.00 1.16 -0.05 -1.55 2.46 -1.02 -4.54 115.29 109.74 1p91 s HIS 183 Ca 0.14 0.88 -0.04 0.00 0.47 0.00 0.00 55.06 56.51 1p91 s HIS 183 Cb 0.06 -3.82 0.02 0.00 -0.13 0.00 0.00 32.58 28.71 1p91 s HIS 183 CO 0.11 -3.52 0.08 1.28 -2.47 0.00 0.00 174.74 170.22 1p91 n LEU 184 N 13.06 -4.13 0.00 8.88 4.77 -0.50 -4.87 117.00 134.22 1p91 n LEU 184 Ca 0.32 1.24 0.00 0.00 -0.03 0.00 0.00 56.01 57.54 1p91 n LEU 184 Cb 0.48 -2.12 0.00 0.00 -2.33 0.00 0.00 43.42 39.45 1p91 n LEU 184 CO 0.68 -1.79 0.00 -0.62 -1.33 0.00 0.00 177.39 174.33 1p91 n GLU 186 N 0.86 0.00 0.18 3.23 4.71 -1.26 -2.18 120.64 126.18 1p91 n GLU 186 Ca -0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 57.16 56.89 1p91 n GLU 186 Cb 0.20 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.56 1p91 n GLU 186 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1p91 h LEU 187 N 0.00 -0.42 -2.54 -4.62 5.85 -1.96 -2.51 115.31 109.12 1p91 h LEU 187 Ca 0.00 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1p91 h LEU 187 Cb 0.00 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1p91 h LEU 187 CO 0.00 -0.03 0.01 0.11 -0.34 0.00 0.00 178.44 178.19 1p91 h LYS 188 N -0.87 0.00 0.00 1.25 1.57 -1.82 0.34 116.57 117.03 1p91 h LYS 188 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1p91 h LYS 188 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1p91 h LYS 188 CO 0.08 0.00 0.00 0.78 -0.57 0.00 0.00 179.45 179.74 1p91 h GLY 189 N 0.00 0.00 0.14 3.86 0.00 -1.72 -2.34 103.07 103.02 1p91 h GLY 189 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1p91 h GLY 189 CO 0.00 0.00 -0.23 1.04 0.00 0.00 0.00 176.54 177.35 1p91 n LEU 190 N -2.74 1.09 0.00 3.11 4.77 0.12 -4.44 117.00 118.91 1p91 n LEU 190 Ca 0.03 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1p91 n LEU 190 Cb 0.40 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1p91 n LEU 190 CO 0.29 0.20 -0.01 2.30 -1.33 0.00 0.00 177.39 178.85 1p91 n ILE 191 N -0.55 0.00 -4.14 -0.08 -5.35 -1.14 -4.96 119.36 103.15 1p91 n ILE 191 Ca 0.13 -0.15 -0.33 0.00 -0.27 0.00 0.00 62.75 62.13 1p91 n ILE 191 Cb 0.35 0.97 -0.07 0.00 -1.74 0.00 0.00 39.64 39.15 1p91 n ILE 191 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1p91 s TYR 192 N -0.31 3.24 0.00 4.28 4.12 -0.89 -4.90 117.35 122.89 1p91 s TYR 192 Ca 0.00 0.18 0.00 0.00 0.02 0.00 0.00 57.07 57.27 1p91 s TYR 192 Cb 0.00 -1.73 0.00 0.00 -1.52 0.00 0.00 41.96 38.71 1p91 s TYR 192 CO 0.00 0.53 0.57 0.27 0.02 0.00 0.00 175.55 176.95 1p91 n ASN 193 N 1.25 0.00 -3.95 2.29 6.94 -1.26 -4.44 115.26 116.09 1p91 n ASN 193 Ca -0.14 0.57 -0.29 0.00 -0.02 0.00 0.00 54.58 54.71 1p91 n ASN 193 Cb 0.53 -0.07 -0.16 0.00 -2.36 0.00 0.00 39.78 37.71 1p91 n ASN 193 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1p91 s GLU 194 N -1.29 1.82 -0.18 -3.83 2.12 -1.26 -5.10 118.70 110.98 1p91 s GLU 194 Ca 0.00 -0.58 -0.29 0.00 0.36 0.00 0.00 54.97 54.46 1p91 s GLU 194 Cb 0.00 -2.08 -0.04 0.00 0.26 0.00 0.00 34.13 32.27 1p91 s GLU 194 CO 0.00 -0.36 1.77 0.08 -0.54 0.00 0.00 175.26 176.21 1p91 s VAL 195 N 1.54 3.47 -0.41 3.70 1.01 -1.26 -4.98 120.40 123.48 1p91 s VAL 195 Ca 0.02 0.53 -0.15 0.00 0.00 0.00 0.00 61.98 62.37 1p91 s VAL 195 Cb -0.15 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.78 1p91 s VAL 195 CO -0.09 -0.20 0.32 -1.00 0.00 0.00 0.00 175.10 174.14 1p91 s HIS 196 N 5.59 3.22 -0.05 5.22 0.09 -1.26 -5.06 115.29 123.04 1p91 s HIS 196 Ca 0.79 -0.51 -0.19 0.00 -0.00 0.00 0.00 55.06 55.16 1p91 s HIS 196 Cb -0.29 -2.65 -0.05 0.00 -0.00 0.00 0.00 32.58 29.59 1p91 s HIS 196 CO 0.32 -0.59 0.51 -0.51 -0.00 0.00 0.00 174.74 174.47 1p91 s LEU 197 N 1.78 4.36 -0.20 0.89 1.43 -1.26 -5.07 118.68 120.62 1p91 s LEU 197 Ca 0.07 0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 54.14 1p91 s LEU 197 Cb -0.18 -2.77 0.01 0.00 0.03 0.00 0.00 46.19 43.28 1p91 s LEU 197 CO 0.11 0.09 -0.13 -2.28 0.23 0.00 0.00 176.35 174.37 1p91 s HIS 198 N 0.02 2.89 -0.69 0.29 2.46 -1.26 -5.05 115.29 113.94 1p91 s HIS 198 Ca 0.28 -1.44 -0.26 0.00 0.47 0.00 0.00 55.06 54.10 1p91 s HIS 198 Cb -0.17 -2.00 -0.13 0.00 -0.13 0.00 0.00 32.58 30.16 1p91 s HIS 198 CO 0.14 -0.72 2.48 0.00 -2.47 0.00 0.00 174.74 174.16 1p91 n ALA 199 N 4.67 0.62 -2.45 1.58 0.00 -1.26 -4.73 120.51 118.94 1p91 n ALA 199 Ca -0.19 -0.82 -0.42 0.00 0.00 0.00 0.00 53.44 52.01 1p91 n ALA 199 Cb 0.50 -2.93 -0.03 0.00 0.00 0.00 0.00 19.45 16.99 1p91 n ALA 199 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1p91 s PRO 200 N 8.49 4.37 0.46 0.00 0.04 -1.26 -5.00 135.00 142.10 1p91 s PRO 200 Ca 1.09 1.70 -0.25 0.00 0.04 0.00 0.00 61.00 63.58 1p91 s PRO 200 Cb -0.49 -3.52 -0.08 0.00 0.04 0.00 0.00 34.50 30.45 1p91 s PRO 200 CO 0.32 -0.41 1.42 -2.39 0.04 0.00 0.00 177.00 175.98 1p91 n HIS 201 N 4.94 2.65 -2.61 0.56 1.44 -1.26 -4.97 115.22 115.96 1p91 n HIS 201 Ca 0.11 0.44 -0.42 0.00 -2.01 0.00 0.00 57.72 55.84 1p91 n HIS 201 Cb 0.46 -2.45 -0.03 0.00 0.12 0.00 0.00 29.99 28.09 1p91 n HIS 201 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1p91 s ALA 202 N -1.20 3.25 0.72 1.59 0.00 -1.26 -5.03 121.76 119.82 1p91 s ALA 202 Ca 0.62 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 53.22 1p91 s ALA 202 Cb -0.45 -3.37 0.03 0.00 0.00 0.00 0.00 23.12 19.33 1p91 s ALA 202 CO 0.57 -0.28 0.19 0.39 0.00 0.00 0.00 175.76 176.62 1p91 n GLU 203 N 3.77 0.15 -3.68 0.00 -0.58 -1.26 -5.13 120.64 113.91 1p91 n GLU 203 Ca 0.07 -0.38 -0.14 0.00 -0.42 0.00 0.00 57.16 56.28 1p91 n GLU 203 Cb 0.49 -0.16 -0.08 0.00 -0.57 0.00 0.00 31.44 31.12 1p91 n GLU 203 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1p91 s GLN 204 N -3.14 0.72 -0.32 3.49 -0.21 -1.26 -5.10 119.66 113.84 1p91 s GLN 204 Ca 0.11 0.25 0.03 0.00 0.02 0.00 0.00 55.36 55.77 1p91 s GLN 204 Cb -0.00 0.34 0.08 0.00 1.00 0.00 0.00 33.01 34.43 1p91 s GLN 204 CO 0.08 -0.17 0.00 -0.51 -2.12 0.00 0.00 175.29 172.57 1p91 s LEU 205 N -0.68 4.30 0.19 2.90 1.43 -1.26 -5.03 118.68 120.52 1p91 s LEU 205 Ca -0.08 -1.83 -0.33 0.00 -1.03 0.00 0.00 54.13 50.86 1p91 s LEU 205 Cb -0.03 -1.62 -0.13 0.00 0.03 0.00 0.00 46.19 44.43 1p91 s LEU 205 CO 0.04 -0.32 1.61 1.21 0.23 0.00 0.00 176.35 179.12 1p91 n GLU 206 N 4.36 2.36 0.00 1.70 0.00 -1.26 -0.83 120.64 126.97 1p91 n GLU 206 Ca -0.04 0.85 0.00 0.00 0.00 0.00 0.00 57.16 57.97 1p91 n GLU 206 Cb 0.42 -2.63 0.00 0.00 0.00 0.00 0.00 31.44 29.23 1p91 n GLU 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1p91 n GLY 207 N 3.40 1.92 3.61 8.31 0.00 -1.26 -4.78 105.19 116.38 1p91 n GLY 207 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1p91 n GLY 207 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1p91 n PHE 208 N -1.30 0.61 -3.72 1.61 3.01 -0.01 -1.26 117.46 116.40 1p91 n PHE 208 Ca 0.00 -2.67 -0.22 0.00 1.01 0.00 0.00 57.45 55.58 1p91 n PHE 208 Cb 0.00 -0.15 -0.18 0.00 -0.01 0.00 0.00 39.48 39.14 1p91 n PHE 208 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1p91 s THR 209 N -3.04 0.14 -0.32 4.37 2.01 -0.46 -4.83 115.64 113.52 1p91 s THR 209 Ca 0.12 0.26 -0.28 0.00 0.31 0.00 0.00 61.69 62.10 1p91 s THR 209 Cb 0.01 -0.36 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 1p91 s THR 209 CO 0.09 0.21 2.02 -0.22 -0.69 0.00 0.00 174.62 176.03 1p91 s LEU 210 N 2.07 3.46 0.00 4.42 2.96 -1.26 -1.33 118.68 128.99 1p91 s LEU 210 Ca 0.05 1.46 0.20 0.00 -0.22 0.00 0.00 54.13 55.61 1p91 s LEU 210 Cb -0.12 -3.37 -0.09 0.00 0.50 0.00 0.00 46.19 43.11 1p91 s LEU 210 CO -0.04 -1.95 0.92 0.00 -1.32 0.00 0.00 176.35 173.96 1p91 n GLN 211 N 8.66 1.13 -3.65 1.98 1.13 0.20 -4.96 117.38 121.87 1p91 n GLN 211 Ca 0.27 -0.56 -0.03 0.00 -1.94 0.00 0.00 57.00 54.74 1p91 n GLN 211 Cb 0.47 -1.40 -0.07 0.00 0.11 0.00 0.00 30.24 29.35 1p91 n GLN 211 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1p91 s GLN 212 N -2.47 0.10 -0.04 -1.09 0.74 -1.03 -5.00 119.66 110.87 1p91 s GLN 212 Ca 0.13 0.12 0.00 0.00 0.05 0.00 0.00 55.36 55.66 1p91 s GLN 212 Cb 0.15 0.04 0.03 0.00 1.10 0.00 0.00 33.01 34.33 1p91 s GLN 212 CO 0.62 -0.01 -0.01 0.45 -0.55 0.00 0.00 175.29 175.79 1p91 s SER 213 N 0.16 0.83 0.38 6.67 0.15 -1.26 -0.78 113.70 119.85 1p91 s SER 213 Ca 0.05 -0.06 0.04 0.00 0.70 0.00 0.00 55.95 56.68 1p91 s SER 213 Cb -0.05 -0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 63.91 1p91 s SER 213 CO -0.14 -0.11 0.15 0.00 1.20 0.00 0.00 173.24 174.34 1p91 s ALA 214 N 1.22 2.65 0.00 5.45 0.00 -0.26 -5.00 121.76 125.82 1p91 s ALA 214 Ca -0.07 -1.44 0.01 0.00 0.00 0.00 0.00 51.96 50.47 1p91 s ALA 214 Cb -0.13 0.89 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1p91 s ALA 214 CO -0.02 -0.40 -0.04 -2.00 0.00 0.00 0.00 175.76 173.30 1p91 s GLU 215 N -3.70 0.34 -0.25 0.00 2.56 -1.26 -2.08 118.70 114.31 1p91 s GLU 215 Ca 0.28 -0.22 -0.02 0.00 0.00 0.00 0.00 54.97 55.01 1p91 s GLU 215 Cb 0.03 -0.29 0.08 0.00 2.00 0.00 0.00 34.13 35.95 1p91 s GLU 215 CO 0.17 0.07 0.06 -1.17 -0.56 0.00 0.00 175.26 173.83 1p91 s LEU 216 N -0.30 1.60 -0.06 2.70 2.96 -0.39 -4.97 118.68 120.22 1p91 s LEU 216 Ca -0.00 -1.18 0.06 0.00 -0.22 0.00 0.00 54.13 52.78 1p91 s LEU 216 Cb -0.03 -0.71 -0.01 0.00 0.50 0.00 0.00 46.19 45.94 1p91 s LEU 216 CO -0.00 -0.35 -0.23 0.00 -1.32 0.00 0.00 176.35 174.44 1p91 s TYR 218 N -0.12 -0.59 0.14 0.00 1.13 -0.52 -4.97 117.35 112.42 1p91 s TYR 218 Ca -0.04 0.88 -0.01 0.00 -1.41 0.00 0.00 57.07 56.49 1p91 s TYR 218 Cb -0.13 0.45 0.03 0.00 -1.10 0.00 0.00 41.96 41.21 1p91 s TYR 218 CO 0.03 -0.63 0.20 -0.35 -2.51 0.00 0.00 175.55 172.29 1p91 n PRO 219 N 0.58 0.27 -3.28 -3.49 -0.04 -1.26 0.01 135.00 127.79 1p91 n PRO 219 Ca -0.17 -0.45 -0.07 0.00 -0.04 0.00 0.00 63.50 62.77 1p91 n PRO 219 Cb 0.59 -0.16 -0.04 0.00 -0.04 0.00 0.00 33.50 33.85 1p91 n PRO 219 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1p91 s ARG 221 N -3.07 0.58 0.13 0.54 0.52 -1.26 -4.96 118.95 111.43 1p91 s ARG 221 Ca 0.12 -0.16 -0.18 0.00 -0.52 0.00 0.00 55.73 54.99 1p91 s ARG 221 Cb -0.01 -0.25 -0.07 0.00 0.52 0.00 0.00 34.95 35.15 1p91 s ARG 221 CO 0.08 -1.11 0.61 -0.51 0.02 0.00 0.00 175.30 174.39 1p91 s LEU 222 N 2.14 4.44 0.69 2.53 1.43 0.19 -4.86 118.68 125.24 1p91 s LEU 222 Ca 0.13 1.27 -0.08 0.00 -1.03 0.00 0.00 54.13 54.42 1p91 s LEU 222 Cb -0.11 -3.17 0.04 0.00 0.03 0.00 0.00 46.19 42.99 1p91 s LEU 222 CO -0.18 0.17 1.02 -0.60 0.23 0.00 0.00 176.35 177.00 1p91 s ARG 223 N -1.53 2.44 0.01 1.70 3.52 -1.26 0.22 118.95 124.04 1p91 s ARG 223 Ca 0.35 -0.05 -0.02 0.00 -0.13 0.00 0.00 55.73 55.88 1p91 s ARG 223 Cb -0.18 -2.15 -0.01 0.00 -1.56 0.00 0.00 34.95 31.06 1p91 s ARG 223 CO 0.20 -1.12 1.03 0.78 -0.81 0.00 0.00 175.30 175.37 1p91 h GLY 224 N -0.56 -1.82 -0.16 8.12 0.00 -1.54 -1.60 103.07 105.50 1p91 h GLY 224 Ca -0.45 0.80 0.02 0.00 0.00 0.00 0.00 47.33 47.70 1p91 h GLY 224 CO 0.62 -0.68 -0.31 1.29 0.00 0.00 0.00 176.54 177.45 1p91 h ASP 225 N -0.02 -1.03 -0.99 0.19 2.03 -1.83 -1.69 116.42 113.08 1p91 h ASP 225 Ca 0.00 0.13 0.37 0.00 -0.73 0.00 0.00 57.03 56.81 1p91 h ASP 225 Cb 0.03 0.41 -0.18 0.00 -0.83 0.00 0.00 39.33 38.76 1p91 h ASP 225 CO -0.03 -0.25 0.38 -0.62 -1.03 0.00 0.00 179.24 177.69 1p91 n GLU 226 N -4.21 -0.07 0.24 4.15 1.02 -1.16 0.79 120.64 121.41 1p91 n GLU 226 Ca -0.03 1.40 -0.10 0.00 -0.02 0.00 0.00 57.16 58.42 1p91 n GLU 226 Cb 0.20 -2.42 -0.05 0.00 -0.02 0.00 0.00 31.44 29.15 1p91 n GLU 226 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1p91 h ALA 227 N 1.98 -1.01 -0.70 0.62 0.00 -0.38 -0.37 119.26 119.40 1p91 h ALA 227 Ca 0.77 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.69 1p91 h ALA 227 Cb 1.93 0.24 -0.12 0.00 0.00 0.00 0.00 17.79 19.84 1p91 h ALA 227 CO -0.81 -0.96 -0.01 0.28 0.00 0.00 0.00 179.25 177.75 1p91 h VAL 228 N -0.72 0.40 -0.39 0.00 2.07 -0.48 0.82 116.25 117.95 1p91 h VAL 228 Ca -0.06 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.50 1p91 h VAL 228 Cb 0.48 0.29 -0.09 0.00 -1.52 0.00 0.00 31.29 30.45 1p91 h VAL 228 CO 0.11 0.02 -0.21 0.00 0.02 0.00 0.00 177.57 177.50 1p91 h ALA 229 N 1.65 0.05 -0.55 1.67 0.00 0.46 0.71 119.26 123.26 1p91 h ALA 229 Ca 0.37 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.38 1p91 h ALA 229 Cb 0.63 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1p91 h ALA 229 CO -0.62 -0.59 0.20 1.25 0.00 0.00 0.00 179.25 179.50 1p91 h LEU 230 N -0.15 0.74 -0.58 0.00 5.85 0.21 -1.69 115.31 119.70 1p91 h LEU 230 Ca 0.19 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.68 1p91 h LEU 230 Cb 0.44 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1p91 h LEU 230 CO -0.48 0.68 -0.32 0.25 -0.34 0.00 0.00 178.44 178.23 1p91 h LEU 231 N 0.80 0.82 -3.00 2.25 5.85 0.21 -3.31 115.31 118.92 1p91 h LEU 231 Ca 0.19 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1p91 h LEU 231 Cb 0.19 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1p91 h LEU 231 CO -0.01 1.08 0.00 1.67 -0.34 0.00 0.00 178.44 180.83 1p91 n GLN 232 N -4.07 0.00 -1.53 1.25 -0.06 0.23 -4.22 117.38 108.98 1p91 n GLN 232 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.99 1p91 n GLN 232 Cb 0.49 -1.28 0.00 0.00 -4.06 0.00 0.00 30.24 25.39 1p91 n GLN 232 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1p91 n THR 234 N 1.24 -3.68 -0.33 1.69 -2.24 -1.25 -4.82 114.28 104.90 1p91 n THR 234 Ca 0.00 1.75 0.31 0.00 -2.27 0.00 0.00 64.05 63.84 1p91 n THR 234 Cb 0.00 -2.67 0.58 0.00 -2.10 0.00 0.00 70.33 66.14 1p91 n THR 234 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1p91 h PRO 235 N 0.69 0.04 0.00 -0.78 0.11 -1.96 -1.08 132.00 129.02 1p91 h PRO 235 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1p91 h PRO 235 Cb 0.59 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1p91 h PRO 235 CO 0.00 0.03 -0.20 1.97 -0.21 0.00 0.00 178.00 179.58 1p91 n PHE 236 N -5.22 0.30 -0.10 0.65 1.16 -1.26 -4.52 117.46 108.48 1p91 n PHE 236 Ca 0.37 0.09 0.08 0.00 -1.87 0.00 0.00 57.45 56.12 1p91 n PHE 236 Cb 1.26 -0.57 0.15 0.00 -1.61 0.00 0.00 39.48 38.70 1p91 n PHE 236 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1p91 n ALA 237 N -1.62 0.25 1.01 1.98 0.00 -0.41 0.11 120.51 121.84 1p91 n ALA 237 Ca 0.06 0.30 0.11 0.00 0.00 0.00 0.00 53.44 53.91 1p91 n ALA 237 Cb 0.38 -0.28 0.55 0.00 0.00 0.00 0.00 19.45 20.09 1p91 n ALA 237 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1p91 n TRP 238 N -3.83 0.00 0.91 0.00 4.27 -1.26 -2.68 117.44 114.84 1p91 n TRP 238 Ca 0.10 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.83 1p91 n TRP 238 Cb 0.33 -0.31 0.20 0.00 -1.36 0.00 0.00 31.31 30.17 1p91 n TRP 238 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1p91 n ARG 239 N -1.31 0.06 -2.32 -2.67 1.74 0.12 -4.79 116.66 107.49 1p91 n ARG 239 Ca 0.10 0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.76 1p91 n ARG 239 Cb 0.18 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 30.07 1p91 n ARG 239 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1p91 s ALA 240 N -3.04 3.17 0.45 7.54 0.00 -1.09 -4.97 121.76 123.81 1p91 s ALA 240 Ca 0.10 0.03 -0.21 0.00 0.00 0.00 0.00 51.96 51.88 1p91 s ALA 240 Cb 0.17 -3.88 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 1p91 s ALA 240 CO 0.72 -2.15 0.98 0.15 0.00 0.00 0.00 175.76 175.46 1p91 s LYS 241 N 4.70 4.10 0.09 0.00 1.02 -1.26 -4.87 119.74 123.52 1p91 s LYS 241 Ca 0.62 1.19 -0.12 0.00 0.02 0.00 0.00 55.97 57.68 1p91 s LYS 241 Cb -0.17 -2.15 0.03 0.00 -0.52 0.00 0.00 37.83 35.02 1p91 s LYS 241 CO 0.29 -0.15 0.75 -2.30 -0.92 0.00 0.00 175.35 173.01 1p91 n PRO 242 N -0.75 -0.17 -0.37 -1.68 -0.02 -1.26 -0.38 135.00 130.37 1p91 n PRO 242 Ca 0.08 0.74 0.03 0.00 -2.02 0.00 0.00 63.50 62.32 1p91 n PRO 242 Cb 0.54 -1.09 0.09 0.00 -0.02 0.00 0.00 33.50 33.02 1p91 n PRO 242 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1p91 n GLU 243 N -4.65 -0.16 -0.01 -0.52 4.71 -1.26 -0.54 120.64 118.22 1p91 n GLU 243 Ca 0.03 1.53 -0.01 0.00 -0.01 0.00 0.00 57.16 58.70 1p91 n GLU 243 Cb 0.15 -2.28 -0.01 0.00 -1.01 0.00 0.00 31.44 28.29 1p91 n GLU 243 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1p91 h VAL 244 N 0.00 0.00 -1.00 2.62 2.07 -1.07 -1.08 116.25 117.78 1p91 h VAL 244 Ca 0.41 0.00 0.20 0.00 0.82 0.00 0.00 66.70 68.13 1p91 h VAL 244 Cb 0.66 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.32 1p91 h VAL 244 CO -1.00 0.00 0.61 -0.50 0.02 0.00 0.00 177.57 176.70 1p91 h TRP 245 N -0.04 1.05 0.02 1.57 4.06 -1.03 0.94 115.95 122.53 1p91 h TRP 245 Ca 0.00 0.03 0.01 0.00 2.06 0.00 0.00 58.89 61.00 1p91 h TRP 245 Cb 0.06 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 27.89 1p91 h TRP 245 CO -0.53 0.21 -0.06 1.96 -3.56 0.00 0.00 178.44 176.46 1p91 h GLN 246 N 0.73 -0.12 0.28 0.49 4.20 -0.21 -1.56 115.11 118.92 1p91 h GLN 246 Ca 0.59 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.29 1p91 h GLN 246 Cb 0.95 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.76 1p91 h GLN 246 CO -0.39 -0.08 -0.13 1.15 -0.67 0.00 0.00 178.83 178.71 1p91 h THR 247 N -0.12 0.56 -1.13 -0.54 2.02 -0.48 -2.34 112.91 110.88 1p91 h THR 247 Ca 0.02 -0.85 0.33 0.00 0.77 0.00 0.00 66.41 66.68 1p91 h THR 247 Cb 0.14 0.91 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 1p91 h THR 247 CO -0.05 0.13 0.86 0.25 0.37 0.00 0.00 175.52 177.08 1p91 h LEU 248 N -0.93 0.00 0.00 2.58 5.85 -0.89 0.46 115.31 122.38 1p91 h LEU 248 Ca -0.04 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.44 1p91 h LEU 248 Cb 0.50 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1p91 h LEU 248 CO 0.06 0.00 -1.47 0.00 -0.34 0.00 0.00 178.44 176.69 1p91 h ALA 249 N 1.35 0.67 -0.00 1.25 0.00 -1.27 -3.28 119.26 117.98 1p91 h ALA 249 Ca 0.54 -1.21 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1p91 h ALA 249 Cb 2.25 0.31 0.00 0.00 0.00 0.00 0.00 17.79 20.35 1p91 h ALA 249 CO -0.01 1.37 -0.37 0.00 0.00 0.00 0.00 179.25 180.24 1p91 n ALA 250 N -2.47 3.28 -1.79 0.00 0.00 0.73 -4.33 120.51 115.93 1p91 n ALA 250 Ca -0.12 -0.35 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 1p91 n ALA 250 Cb 0.98 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 19.25 1p91 n ALA 250 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1p91 s LYS 251 N -2.80 4.16 0.12 0.00 2.47 0.13 -4.89 119.74 118.93 1p91 s LYS 251 Ca 0.17 2.48 -0.20 0.00 -1.56 0.00 0.00 55.97 56.86 1p91 s LYS 251 Cb 0.18 -3.80 -0.06 0.00 -1.46 0.00 0.00 37.83 32.70 1p91 s LYS 251 CO 0.62 -0.84 1.75 1.05 0.16 0.00 0.00 175.35 178.08 1p91 h GLU 252 N 9.18 0.13 -3.06 4.03 9.09 -1.89 -2.39 114.58 129.66 1p91 h GLU 252 Ca -0.45 -0.01 -0.25 0.00 0.05 0.00 0.00 59.36 58.70 1p91 h GLU 252 Cb 1.21 -0.03 -0.33 0.00 -1.65 0.00 0.00 28.75 27.95 1p91 h GLU 252 CO 0.94 0.09 -0.59 0.54 0.05 0.00 0.00 179.01 180.04 1p91 s VAL 253 N -6.18 -0.23 -0.12 -1.06 0.11 -1.26 -3.92 120.40 107.75 1p91 s VAL 253 Ca -0.13 0.28 -0.03 0.00 -2.93 0.00 0.00 61.98 59.16 1p91 s VAL 253 Cb 0.09 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 34.57 1p91 s VAL 253 CO 0.68 0.12 0.01 0.12 -3.33 0.00 0.00 175.10 172.70 1p91 s PHE 254 N 1.97 3.17 -0.26 1.54 5.36 0.60 -4.91 117.98 125.46 1p91 s PHE 254 Ca -0.01 0.09 -0.09 0.00 -0.96 0.00 0.00 56.93 55.96 1p91 s PHE 254 Cb -0.12 -1.88 -0.04 0.00 -0.34 0.00 0.00 43.02 40.65 1p91 s PHE 254 CO -0.07 0.33 0.13 -0.51 -1.46 0.00 0.00 175.22 173.64 1p91 s ASP 255 N -0.44 5.68 -0.06 6.13 1.01 -1.26 0.55 116.67 128.28 1p91 s ASP 255 Ca 0.08 -0.06 -0.02 0.00 0.71 0.00 0.00 52.55 53.26 1p91 s ASP 255 Cb -0.12 -2.03 0.04 0.00 1.01 0.00 0.00 42.92 41.81 1p91 s ASP 255 CO 0.02 -0.01 0.13 0.00 0.21 0.00 0.00 175.17 175.52 1p91 s GLN 257 N 1.10 3.62 -0.01 0.00 -2.07 -1.26 -4.54 119.66 116.50 1p91 s GLN 257 Ca -0.09 -0.03 0.07 0.00 -1.82 0.00 0.00 55.36 53.49 1p91 s GLN 257 Cb -0.11 -2.68 -0.02 0.00 -1.09 0.00 0.00 33.01 29.11 1p91 s GLN 257 CO -0.05 0.25 -0.22 0.95 -1.32 0.00 0.00 175.29 174.90 1p91 s THR 258 N -2.03 1.73 -0.26 3.63 -4.23 0.10 -1.41 115.64 113.17 1p91 s THR 258 Ca 0.43 -0.97 -0.04 0.00 -1.18 0.00 0.00 61.69 59.94 1p91 s THR 258 Cb -0.11 -1.44 0.09 0.00 1.34 0.00 0.00 72.50 72.38 1p91 s THR 258 CO 0.29 0.46 0.11 -0.62 -0.54 0.00 0.00 174.62 174.32 1p91 s ASP 259 N -0.59 3.32 0.00 3.99 3.68 -1.26 -1.45 116.67 124.37 1p91 s ASP 259 Ca 0.08 -1.17 -0.00 0.00 2.13 0.00 0.00 52.55 53.60 1p91 s ASP 259 Cb -0.08 -0.43 -0.04 0.00 -1.45 0.00 0.00 42.92 40.91 1p91 s ASP 259 CO -0.01 -0.41 0.08 -0.36 0.13 0.00 0.00 175.17 174.61 1p91 s PHE 260 N 2.01 3.27 -0.38 -5.34 0.40 -0.27 0.34 117.98 118.01 1p91 s PHE 260 Ca 0.07 0.19 -0.02 0.00 -0.60 0.00 0.00 56.93 56.57 1p91 s PHE 260 Cb -0.16 -1.73 0.10 0.00 0.51 0.00 0.00 43.02 41.74 1p91 s PHE 260 CO -0.27 0.55 0.14 1.21 0.70 0.00 0.00 175.22 177.55 1p91 s ASN 261 N -1.79 5.12 0.16 1.36 3.04 0.11 -1.26 114.94 121.67 1p91 s ASN 261 Ca 0.23 -1.92 -0.12 0.00 0.04 0.00 0.00 52.86 51.10 1p91 s ASN 261 Cb -0.12 -1.78 -0.07 0.00 -1.54 0.00 0.00 41.25 37.75 1p91 s ASN 261 CO 0.15 -0.47 0.51 -0.63 -3.04 0.00 0.00 177.10 173.62 1p91 s ILE 262 N 1.12 4.94 0.14 -5.21 1.01 -0.88 -2.76 121.20 119.55 1p91 s ILE 262 Ca 0.06 0.62 0.04 0.00 0.00 0.00 0.00 60.65 61.37 1p91 s ILE 262 Cb -0.22 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 1p91 s ILE 262 CO -0.04 0.15 -0.09 -1.00 0.00 0.00 0.00 174.94 173.96 1p91 s HIS 263 N -1.56 1.17 -0.29 3.97 3.76 -0.05 -1.10 115.29 121.19 1p91 s HIS 263 Ca 0.40 -0.81 0.02 0.00 -0.15 0.00 0.00 55.06 54.52 1p91 s HIS 263 Cb -0.14 -0.62 0.16 0.00 1.11 0.00 0.00 32.58 33.10 1p91 s HIS 263 CO 0.20 0.01 0.43 -1.17 -0.85 0.00 0.00 174.74 173.35 1p91 s LEU 264 N -3.14 -0.86 0.20 0.89 2.96 0.04 -2.52 118.68 116.25 1p91 s LEU 264 Ca 0.16 -0.27 0.07 0.00 -0.22 0.00 0.00 54.13 53.87 1p91 s LEU 264 Cb 0.03 1.20 -0.04 0.00 0.50 0.00 0.00 46.19 47.89 1p91 s LEU 264 CO -0.01 -0.34 0.05 0.26 -1.32 0.00 0.00 176.35 174.99 1p91 s TRP 265 N 2.57 2.91 -0.02 5.38 0.52 -0.63 0.60 118.94 130.27 1p91 s TRP 265 Ca 0.10 -0.13 0.02 0.00 0.02 0.00 0.00 56.10 56.11 1p91 s TRP 265 Cb -0.12 -1.37 -0.03 0.00 -1.15 0.00 0.00 33.47 30.80 1p91 s TRP 265 CO -0.29 0.54 -0.05 -1.14 0.02 0.00 0.00 176.95 176.03 1p91 s GLN 266 N -3.25 2.67 -0.20 4.98 0.74 -0.44 -1.26 119.66 122.90 1p91 s GLN 266 Ca 0.30 -0.64 -0.29 0.00 0.05 0.00 0.00 55.36 54.77 1p91 s GLN 266 Cb -0.09 -2.57 -0.00 0.00 1.10 0.00 0.00 33.01 31.45 1p91 s GLN 266 CO 0.21 0.63 1.14 0.50 -0.55 0.00 0.00 175.29 177.21 1p91 s ARG 267 N -1.28 4.25 0.41 1.67 6.06 0.10 -1.35 118.95 128.81 1p91 s ARG 267 Ca 0.16 1.50 -0.26 0.00 -2.50 0.00 0.00 55.73 54.63 1p91 s ARG 267 Cb -0.11 -3.69 -0.10 0.00 0.06 0.00 0.00 34.95 31.11 1p91 s ARG 267 CO 0.06 -0.66 1.28 -1.13 -2.50 0.00 0.00 175.30 172.36 1p91 n SER 268 N 6.41 2.61 0.00 -2.12 3.41 -0.39 0.36 113.62 123.90 1p91 n SER 268 Ca 0.13 1.12 0.10 0.00 -0.26 0.00 0.00 58.87 59.96 1p91 n SER 268 Cb 0.46 -1.50 0.61 0.00 -0.26 0.00 0.00 64.21 63.51 1p91 n SER 268 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66