#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rrm s ASN 4 N 0.00 5.86 0.04 0.00 0.01 -1.26 -5.28 114.94 114.31 1rrm s ASN 4 Ca 0.00 0.21 0.00 0.00 -0.71 0.00 0.00 52.86 52.36 1rrm s ASN 4 Cb 0.00 -1.94 0.00 0.00 0.41 0.00 0.00 41.25 39.72 1rrm s ASN 4 CO 0.00 0.26 0.00 -1.14 -1.51 0.00 0.00 177.10 174.71 1rrm n ARG 5 N 2.98 1.42 -3.64 -0.60 0.63 -1.26 -5.23 116.66 110.97 1rrm n ARG 5 Ca -0.18 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.74 1rrm n ARG 5 Cb 0.53 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.38 1rrm n ARG 5 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1rrm s ILE 7 N 1.14 -0.00 0.24 5.15 -1.09 -1.26 -4.88 121.20 120.50 1rrm s ILE 7 Ca 0.00 0.00 -0.01 0.00 -2.23 0.00 0.00 60.65 58.41 1rrm s ILE 7 Cb 0.00 -1.00 -0.03 0.00 -1.58 0.00 0.00 42.46 39.85 1rrm s ILE 7 CO 0.00 0.00 0.22 -0.76 -1.23 0.00 0.00 174.94 173.17 1rrm s LEU 8 N 1.27 1.12 0.13 2.97 1.43 -1.26 -4.87 118.68 119.47 1rrm s LEU 8 Ca -0.09 -1.39 -0.30 0.00 -1.03 0.00 0.00 54.13 51.32 1rrm s LEU 8 Cb -0.03 0.66 -0.07 0.00 0.03 0.00 0.00 46.19 46.78 1rrm s LEU 8 CO -0.13 -0.94 1.17 0.20 0.23 0.00 0.00 176.35 176.88 1rrm s ASN 9 N -3.18 7.13 0.31 2.29 0.01 -1.26 -4.90 114.94 115.34 1rrm s ASN 9 Ca 0.37 2.11 0.05 0.00 -0.71 0.00 0.00 52.86 54.67 1rrm s ASN 9 Cb 0.05 -2.59 0.52 0.00 0.41 0.00 0.00 41.25 39.63 1rrm s ASN 9 CO 0.15 -0.37 1.78 -0.08 -1.51 0.00 0.00 177.10 177.06 1rrm h GLU 10 N 5.84 0.39 -4.62 -0.60 4.81 -1.80 -3.43 114.58 115.17 1rrm h GLU 10 Ca -0.43 -0.13 -0.37 0.00 -0.13 0.00 0.00 59.36 58.29 1rrm h GLU 10 Cb 1.21 -0.03 -0.28 0.00 0.63 0.00 0.00 28.75 30.28 1rrm h GLU 10 CO 0.77 0.60 -0.77 0.99 -0.73 0.00 0.00 179.01 179.86 1rrm s THR 11 N -4.54 0.63 -0.17 0.32 2.01 -1.21 -5.10 115.64 107.59 1rrm s THR 11 Ca -0.06 -0.36 -0.21 0.00 0.31 0.00 0.00 61.69 61.37 1rrm s THR 11 Cb 0.14 -0.53 0.05 0.00 0.01 0.00 0.00 72.50 72.17 1rrm s THR 11 CO 0.77 0.17 0.56 0.00 -0.69 0.00 0.00 174.62 175.43 1rrm s ALA 12 N -0.21 -1.40 -0.10 7.40 0.00 -1.26 -2.14 121.76 124.05 1rrm s ALA 12 Ca 0.03 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.45 1rrm s ALA 12 Cb -0.03 -0.69 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 1rrm s ALA 12 CO -0.00 -0.28 -0.19 -1.58 0.00 0.00 0.00 175.76 173.71 1rrm s TRP 13 N -0.09 2.65 0.03 0.00 0.52 0.13 -4.95 118.94 117.24 1rrm s TRP 13 Ca -0.03 -0.73 0.09 0.00 0.02 0.00 0.00 56.10 55.44 1rrm s TRP 13 Cb -0.03 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.52 1rrm s TRP 13 CO 0.03 -0.24 -0.25 -0.06 0.02 0.00 0.00 176.95 176.45 1rrm s PHE 14 N 0.14 2.24 0.00 -1.98 0.08 -1.26 -0.61 117.98 116.59 1rrm s PHE 14 Ca -0.10 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 56.54 1rrm s PHE 14 Cb -0.16 -1.37 0.00 0.00 -0.57 0.00 0.00 43.02 40.93 1rrm s PHE 14 CO 0.06 0.08 0.00 0.41 -0.10 0.00 0.00 175.22 175.67 1rrm n GLY 15 N 1.96 2.97 3.71 4.36 0.00 -0.67 -4.78 105.19 112.75 1rrm n GLY 15 Ca -0.17 -1.96 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 1rrm n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rrm s ARG 16 N -2.97 4.20 0.00 1.61 0.52 -1.26 -1.26 118.95 119.79 1rrm s ARG 16 Ca 0.00 2.38 0.00 0.00 -0.52 0.00 0.00 55.73 57.59 1rrm s ARG 16 Cb 0.00 -3.24 0.00 0.00 0.52 0.00 0.00 34.95 32.23 1rrm s ARG 16 CO 0.00 -0.65 0.00 0.41 0.02 0.00 0.00 175.30 175.08 1rrm n GLY 17 N 3.83 0.42 0.34 -3.53 0.00 -1.26 -4.96 105.19 100.02 1rrm n GLY 17 Ca 0.14 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.32 1rrm n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rrm h ALA 18 N 0.00 2.31 0.00 4.61 0.00 -1.48 0.14 119.26 124.83 1rrm h ALA 18 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rrm h ALA 18 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1rrm h ALA 18 CO 0.00 -0.41 0.00 -0.39 0.00 0.00 0.00 179.25 178.45 1rrm h VAL 19 N 0.02 0.00 0.00 0.00 -1.51 -1.90 -1.72 116.25 111.13 1rrm h VAL 19 Ca 0.17 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 1rrm h VAL 19 Cb 0.64 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1rrm h VAL 19 CO -0.01 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.94 1rrm n GLY 20 N -0.50 -1.03 0.02 5.19 0.00 0.04 -1.49 105.19 107.41 1rrm n GLY 20 Ca 0.00 0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1rrm n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rrm n ALA 21 N -1.74 3.12 0.07 4.61 0.00 -0.65 -4.41 120.51 121.51 1rrm n ALA 21 Ca 0.01 -0.27 -0.11 0.00 0.00 0.00 0.00 53.44 53.07 1rrm n ALA 21 Cb 0.13 -1.21 -0.05 0.00 0.00 0.00 0.00 19.45 18.32 1rrm n ALA 21 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rrm h LEU 22 N 0.00 -0.55 -1.22 0.00 6.46 -1.44 -2.24 115.31 116.32 1rrm h LEU 22 Ca 0.00 0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.88 1rrm h LEU 22 Cb 0.57 0.23 -0.05 0.00 -0.73 0.00 0.00 40.66 40.67 1rrm h LEU 22 CO 0.00 -0.26 0.55 0.71 -0.62 0.00 0.00 178.44 178.82 1rrm h THR 23 N -0.32 1.10 -0.50 1.05 1.35 -1.79 -1.08 112.91 112.71 1rrm h THR 23 Ca 0.05 -0.34 -0.11 0.00 -0.55 0.00 0.00 66.41 65.47 1rrm h THR 23 Cb 0.38 0.03 -0.02 0.00 -1.73 0.00 0.00 68.15 66.82 1rrm h THR 23 CO -0.16 0.18 -0.10 -0.78 -0.25 0.00 0.00 175.52 174.41 1rrm h ASP 24 N 0.99 0.95 -0.69 5.36 3.58 -1.79 -1.70 116.42 123.12 1rrm h ASP 24 Ca 0.34 -0.35 -0.04 0.00 0.42 0.00 0.00 57.03 57.40 1rrm h ASP 24 Cb 0.11 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 40.87 1rrm h ASP 24 CO -0.11 1.08 0.28 -0.33 -2.88 0.00 0.00 179.24 177.28 1rrm h GLU 25 N 0.81 1.04 -0.25 0.28 4.39 -0.74 -0.73 114.58 119.39 1rrm h GLU 25 Ca 0.13 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1rrm h GLU 25 Cb 0.65 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1rrm h GLU 25 CO 0.05 0.85 0.03 0.28 -1.16 0.00 0.00 179.01 179.06 1rrm h VAL 26 N 1.02 1.23 -0.80 3.13 2.07 -1.01 -2.61 116.25 119.29 1rrm h VAL 26 Ca 0.24 -0.79 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 1rrm h VAL 26 Cb 0.20 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1rrm h VAL 26 CO -0.02 0.25 0.38 0.11 0.02 0.00 0.00 177.57 178.31 1rrm h LYS 27 N 0.21 1.15 0.00 1.57 1.57 -1.06 -1.79 116.57 118.22 1rrm h LYS 27 Ca 0.07 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1rrm h LYS 27 Cb 0.34 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 1rrm h LYS 27 CO 0.01 0.89 -0.12 0.00 -0.57 0.00 0.00 179.45 179.66 1rrm h ARG 28 N 1.13 0.00 -0.01 3.15 3.08 -1.05 -2.43 114.38 118.26 1rrm h ARG 28 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1rrm h ARG 28 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1rrm h ARG 28 CO -0.03 0.12 -0.50 0.54 -1.07 0.00 0.00 179.97 179.03 1rrm n ARG 29 N -3.93 0.67 -1.23 0.04 1.74 -0.84 -4.98 116.66 108.13 1rrm n ARG 29 Ca -0.02 -0.49 -0.08 0.00 -0.77 0.00 0.00 57.85 56.49 1rrm n ARG 29 Cb 0.21 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 1rrm n ARG 29 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rrm n GLY 30 N 1.42 0.98 3.77 -0.13 0.00 -0.73 -5.01 105.19 105.49 1rrm n GLY 30 Ca 0.09 -0.48 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 1rrm n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rrm s TYR 31 N -2.21 2.65 -0.19 1.61 2.02 -1.18 -4.98 117.35 115.06 1rrm s TYR 31 Ca 0.00 1.52 0.15 0.00 -0.37 0.00 0.00 57.07 58.36 1rrm s TYR 31 Cb 0.00 -3.42 -0.22 0.00 -0.40 0.00 0.00 41.96 37.92 1rrm s TYR 31 CO 0.00 -1.82 0.02 1.04 -1.57 0.00 0.00 175.55 173.22 1rrm n GLN 32 N -1.00 0.88 -3.64 -0.62 1.13 -1.26 -4.87 117.38 108.00 1rrm n GLN 32 Ca 0.10 0.01 -0.08 0.00 -1.94 0.00 0.00 57.00 55.09 1rrm n GLN 32 Cb 0.49 -1.48 -0.07 0.00 0.11 0.00 0.00 30.24 29.28 1rrm n GLN 32 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1rrm s LYS 33 N -2.46 0.70 0.13 -1.09 2.20 -1.26 -4.20 119.74 113.76 1rrm s LYS 33 Ca -0.13 1.16 0.02 0.00 -0.36 0.00 0.00 55.97 56.66 1rrm s LYS 33 Cb 0.06 0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.51 1rrm s LYS 33 CO 0.74 -0.14 0.25 0.00 -0.36 0.00 0.00 175.35 175.84 1rrm s ALA 34 N 1.43 3.95 -0.23 3.13 0.00 -0.89 -0.33 121.76 128.81 1rrm s ALA 34 Ca -0.08 -0.99 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 1rrm s ALA 34 Cb -0.05 -1.76 0.03 0.00 0.00 0.00 0.00 23.12 21.33 1rrm s ALA 34 CO -0.16 0.62 -0.10 -1.17 0.00 0.00 0.00 175.76 174.95 1rrm s LEU 35 N -3.02 2.95 -0.18 0.00 2.96 -0.86 -1.01 118.68 119.51 1rrm s LEU 35 Ca 0.34 -0.84 -0.23 0.00 -0.22 0.00 0.00 54.13 53.18 1rrm s LEU 35 Cb -0.11 -1.61 -0.02 0.00 0.50 0.00 0.00 46.19 44.94 1rrm s LEU 35 CO 0.28 -0.10 0.74 -0.63 -1.32 0.00 0.00 176.35 175.32 1rrm s ILE 36 N 1.30 4.94 -0.28 6.68 1.01 0.67 -1.56 121.20 133.97 1rrm s ILE 36 Ca 0.01 1.43 -0.09 0.00 0.00 0.00 0.00 60.65 62.00 1rrm s ILE 36 Cb -0.16 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 1rrm s ILE 36 CO -0.06 0.06 0.13 -0.69 0.00 0.00 0.00 174.94 174.38 1rrm s VAL 37 N 2.05 4.67 0.00 2.92 1.01 0.15 -0.61 120.40 130.59 1rrm s VAL 37 Ca 0.34 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1rrm s VAL 37 Cb -0.16 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1rrm s VAL 37 CO 0.11 0.23 0.00 1.07 0.00 0.00 0.00 175.10 176.51 1rrm n THR 38 N 4.98 0.00 -4.47 3.92 5.66 -0.45 -1.31 114.28 122.61 1rrm n THR 38 Ca -0.15 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.63 1rrm n THR 38 Cb 0.51 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.18 1rrm n THR 38 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 1rrm s ASP 39 N 0.65 2.53 0.43 1.09 1.47 -1.26 -3.15 116.67 118.43 1rrm s ASP 39 Ca 0.00 -1.38 0.13 0.00 1.18 0.00 0.00 52.55 52.48 1rrm s ASP 39 Cb 0.00 -0.10 0.93 0.00 -0.34 0.00 0.00 42.92 43.40 1rrm s ASP 39 CO 0.00 -0.60 1.95 0.11 0.68 0.00 0.00 175.17 177.32 1rrm h LYS 40 N 2.07 0.03 -0.26 2.11 1.57 -1.76 -2.83 116.57 117.50 1rrm h LYS 40 Ca -0.41 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.29 1rrm h LYS 40 Cb 1.24 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1rrm h LYS 40 CO 0.71 0.24 -0.10 1.15 -0.57 0.00 0.00 179.45 180.88 1rrm h THR 41 N 0.03 1.29 0.00 -0.16 2.02 -1.95 -0.64 112.91 113.50 1rrm h THR 41 Ca 0.00 -1.16 -0.05 0.00 0.77 0.00 0.00 66.41 65.98 1rrm h THR 41 Cb 0.38 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 1rrm h THR 41 CO 0.03 0.36 -0.23 -0.07 0.37 0.00 0.00 175.52 175.98 1rrm h LEU 42 N 0.27 0.00 -0.03 2.58 3.38 -1.93 0.22 115.31 119.80 1rrm h LEU 42 Ca 0.06 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1rrm h LEU 42 Cb 0.59 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.35 1rrm h LEU 42 CO 0.03 0.23 -0.39 0.58 0.09 0.00 0.00 178.44 178.98 1rrm h VAL 43 N 0.00 1.46 -0.49 1.22 2.07 -1.33 -1.47 116.25 117.71 1rrm h VAL 43 Ca -0.00 -1.91 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1rrm h VAL 43 Cb 0.46 2.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.75 1rrm h VAL 43 CO 0.03 0.54 0.31 -0.61 0.02 0.00 0.00 177.57 177.86 1rrm h GLN 44 N -0.24 0.65 0.00 1.57 5.75 -0.58 -2.48 115.11 119.79 1rrm h GLN 44 Ca -0.04 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.41 1rrm h GLN 44 Cb 1.09 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.50 1rrm h GLN 44 CO 0.08 0.45 0.00 0.00 -2.65 0.00 0.00 178.83 176.71 1rrm n GLY 46 N 0.40 0.75 0.14 0.00 0.00 -0.93 -4.95 105.19 100.60 1rrm n GLY 46 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 1rrm n GLY 46 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1rrm h VAL 47 N 0.00 1.23 -0.79 1.61 2.07 -1.52 -2.76 116.25 116.10 1rrm h VAL 47 Ca 0.00 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 1rrm h VAL 47 Cb 0.00 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1rrm h VAL 47 CO 0.00 0.23 0.43 0.58 0.02 0.00 0.00 177.57 178.83 1rrm h VAL 48 N 0.17 1.23 -0.18 2.57 2.07 -1.74 -2.07 116.25 118.30 1rrm h VAL 48 Ca 0.07 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1rrm h VAL 48 Cb 0.32 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1rrm h VAL 48 CO 0.00 0.26 0.06 0.00 0.02 0.00 0.00 177.57 177.91 1rrm h ALA 49 N 1.37 1.77 -0.43 1.67 0.00 -1.80 -0.73 119.26 121.11 1rrm h ALA 49 Ca 0.28 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.20 1rrm h ALA 49 Cb 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1rrm h ALA 49 CO -0.04 0.19 0.29 0.87 0.00 0.00 0.00 179.25 180.56 1rrm h LYS 50 N 0.25 0.23 0.00 0.00 1.57 -1.08 0.27 116.57 117.80 1rrm h LYS 50 Ca 0.06 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.64 1rrm h LYS 50 Cb 0.08 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1rrm h LYS 50 CO -0.01 0.15 -1.05 0.28 -0.57 0.00 0.00 179.45 178.25 1rrm h VAL 51 N 0.23 0.95 -0.02 0.50 2.07 -1.25 -3.35 116.25 115.38 1rrm h VAL 51 Ca 0.19 -2.11 -0.01 0.00 0.82 0.00 0.00 66.70 65.59 1rrm h VAL 51 Cb 0.46 2.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1rrm h VAL 51 CO -0.04 0.32 -0.06 0.71 0.02 0.00 0.00 177.57 178.53 1rrm h THR 52 N -1.00 1.05 -0.72 2.57 1.35 -1.10 -1.76 112.91 113.31 1rrm h THR 52 Ca -0.28 -0.24 -0.07 0.00 -0.55 0.00 0.00 66.41 65.27 1rrm h THR 52 Cb 1.20 1.10 -0.03 0.00 -1.73 0.00 0.00 68.15 68.70 1rrm h THR 52 CO -0.17 0.07 0.18 0.44 -0.25 0.00 0.00 175.52 175.79 1rrm h ASP 53 N 0.02 1.09 0.00 5.36 3.32 -1.12 0.15 116.42 125.24 1rrm h ASP 53 Ca 0.01 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1rrm h ASP 53 Cb 0.12 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.38 1rrm h ASP 53 CO 0.01 1.03 0.00 0.29 -1.72 0.00 0.00 179.24 178.85 1rrm n LYS 54 N -4.24 0.41 0.00 3.56 5.02 -0.66 -1.78 118.16 120.47 1rrm n LYS 54 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1rrm n LYS 54 Cb 0.26 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 1rrm n LYS 54 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1rrm n ASP 56 N 0.66 0.00 0.17 4.39 8.00 0.52 -1.64 116.55 128.65 1rrm n ASP 56 Ca 0.00 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.55 1rrm n ASP 56 Cb 0.18 0.00 0.51 0.00 -0.02 0.00 0.00 41.12 41.79 1rrm n ASP 56 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rrm h ALA 57 N 0.00 1.76 -0.01 2.24 0.00 -1.60 -1.43 119.26 120.22 1rrm h ALA 57 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1rrm h ALA 57 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1rrm h ALA 57 CO 0.00 0.18 -0.11 0.00 0.00 0.00 0.00 179.25 179.33 1rrm n ALA 58 N -2.51 2.78 -1.55 0.00 0.00 -0.65 -4.94 120.51 113.64 1rrm n ALA 58 Ca -0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 53.44 52.96 1rrm n ALA 58 Cb 0.16 -1.17 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 1rrm n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rrm n GLY 59 N 1.24 0.53 3.73 0.00 0.00 -0.54 -5.02 105.19 105.13 1rrm n GLY 59 Ca 0.16 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 1rrm n GLY 59 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rrm s LEU 60 N -1.36 4.25 0.44 0.99 1.43 -1.26 -5.01 118.68 118.16 1rrm s LEU 60 Ca 0.00 0.52 -0.22 0.00 -1.03 0.00 0.00 54.13 53.41 1rrm s LEU 60 Cb 0.00 -2.38 -0.09 0.00 0.03 0.00 0.00 46.19 43.75 1rrm s LEU 60 CO 0.00 0.11 1.01 0.00 0.23 0.00 0.00 176.35 177.70 1rrm s ALA 61 N 0.40 2.99 0.13 4.21 0.00 -1.26 -4.39 121.76 123.84 1rrm s ALA 61 Ca 0.17 0.57 -0.23 0.00 0.00 0.00 0.00 51.96 52.47 1rrm s ALA 61 Cb -0.13 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 19.83 1rrm s ALA 61 CO 0.04 -0.13 0.58 1.67 0.00 0.00 0.00 175.76 177.92 1rrm s TRP 62 N -1.93 -0.50 0.07 0.00 1.48 -1.26 -2.11 118.94 114.69 1rrm s TRP 62 Ca 0.62 0.37 0.01 0.00 -1.06 0.00 0.00 56.10 56.04 1rrm s TRP 62 Cb -0.16 0.49 -0.04 0.00 -1.16 0.00 0.00 33.47 32.61 1rrm s TRP 62 CO 0.20 -0.79 -0.06 0.00 -4.06 0.00 0.00 176.95 172.24 1rrm s ALA 63 N -3.41 0.71 0.02 2.67 0.00 -0.18 -4.93 121.76 116.63 1rrm s ALA 63 Ca -0.00 -1.14 0.06 0.00 0.00 0.00 0.00 51.96 50.88 1rrm s ALA 63 Cb -0.01 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 1rrm s ALA 63 CO -0.10 -0.23 -0.19 0.42 0.00 0.00 0.00 175.76 175.67 1rrm s ILE 64 N -3.11 1.52 -0.23 0.00 1.01 -1.26 -0.24 121.20 118.89 1rrm s ILE 64 Ca 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 59.67 1rrm s ILE 64 Cb 0.02 -1.30 0.06 0.00 0.01 0.00 0.00 42.46 41.24 1rrm s ILE 64 CO -0.05 0.26 -0.05 -0.47 0.00 0.00 0.00 174.94 174.63 1rrm s TYR 65 N -0.67 2.24 -0.27 3.97 5.04 0.22 -4.92 117.35 122.96 1rrm s TYR 65 Ca 0.07 -1.63 0.09 0.00 -2.44 0.00 0.00 57.07 53.16 1rrm s TYR 65 Cb -0.08 -1.52 0.48 0.00 0.35 0.00 0.00 41.96 41.19 1rrm s TYR 65 CO 0.01 -0.75 1.39 -0.40 -1.34 0.00 0.00 175.55 174.46 1rrm n ASP 66 N 4.72 2.22 -0.62 4.32 5.68 -1.26 -1.34 116.55 130.28 1rrm n ASP 66 Ca -0.12 -3.83 0.06 0.00 -0.50 0.00 0.00 54.79 50.40 1rrm n ASP 66 Cb 0.45 -0.60 0.16 0.00 -1.14 0.00 0.00 41.12 39.98 1rrm n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rrm n GLY 67 N -1.13 0.56 3.76 6.12 0.00 -1.25 -2.74 105.19 110.51 1rrm n GLY 67 Ca 0.29 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1rrm n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rrm s VAL 68 N -1.56 2.88 0.19 1.61 1.01 -1.19 -4.95 120.40 118.39 1rrm s VAL 68 Ca 0.23 0.86 0.11 0.00 0.00 0.00 0.00 61.98 63.18 1rrm s VAL 68 Cb 0.12 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 1rrm s VAL 68 CO 0.16 0.19 -0.23 0.68 0.00 0.00 0.00 175.10 175.90 1rrm s VAL 69 N -0.95 2.29 0.30 2.92 -7.23 -1.26 -4.59 120.40 111.89 1rrm s VAL 69 Ca 0.50 -2.02 -0.29 0.00 -1.81 0.00 0.00 61.98 58.35 1rrm s VAL 69 Cb -0.38 -2.09 -0.13 0.00 0.56 0.00 0.00 36.38 34.33 1rrm s VAL 69 CO 0.49 -0.14 1.27 -2.65 -0.31 0.00 0.00 175.10 173.76 1rrm n PRO 70 N 0.27 1.93 -3.19 4.82 -0.02 -1.26 -2.28 135.00 135.27 1rrm n PRO 70 Ca -0.13 0.68 -0.09 0.00 -2.02 0.00 0.00 63.50 61.94 1rrm n PRO 70 Cb 0.56 -2.24 0.04 0.00 -0.02 0.00 0.00 33.50 31.84 1rrm n PRO 70 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1rrm n ASN 71 N 1.25 -7.08 -4.55 2.55 5.03 -1.26 -4.84 115.26 106.36 1rrm n ASN 71 Ca 0.08 -0.46 -0.50 0.00 0.87 0.00 0.00 54.58 54.57 1rrm n ASN 71 Cb 0.34 -5.18 -0.04 0.00 -1.02 0.00 0.00 39.78 33.87 1rrm n ASN 71 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1rrm n PRO 72 N -2.66 0.91 -3.10 3.52 -0.04 -0.96 -4.51 135.00 128.16 1rrm n PRO 72 Ca -0.04 0.32 -0.18 0.00 -0.04 0.00 0.00 63.50 63.56 1rrm n PRO 72 Cb 0.57 -1.76 0.01 0.00 -0.04 0.00 0.00 33.50 32.28 1rrm n PRO 72 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1rrm s THR 73 N -0.32 3.34 0.40 0.52 -4.23 -1.26 0.49 115.64 114.57 1rrm s THR 73 Ca 0.73 -0.94 0.08 0.00 -1.18 0.00 0.00 61.69 60.39 1rrm s THR 73 Cb -0.90 -3.15 0.21 0.00 1.34 0.00 0.00 72.50 70.00 1rrm s THR 73 CO 0.54 -0.06 1.98 0.40 -0.54 0.00 0.00 174.62 176.93 1rrm h ILE 74 N 0.64 1.14 -0.42 2.99 2.04 -1.79 -2.05 117.51 120.06 1rrm h ILE 74 Ca -0.42 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 64.90 1rrm h ILE 74 Cb 1.27 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.24 1rrm h ILE 74 CO 0.49 0.18 0.15 0.74 0.00 0.00 0.00 178.15 179.70 1rrm h THR 75 N 0.36 1.21 -0.49 -0.27 2.02 -1.95 -1.05 112.91 112.74 1rrm h THR 75 Ca 0.09 -0.66 -0.07 0.00 0.77 0.00 0.00 66.41 66.53 1rrm h THR 75 Cb 0.18 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 1rrm h THR 75 CO -0.00 0.24 0.02 0.58 0.37 0.00 0.00 175.52 176.73 1rrm h VAL 76 N 0.53 1.24 -0.32 3.16 2.07 -1.81 -0.62 116.25 120.51 1rrm h VAL 76 Ca 0.14 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 1rrm h VAL 76 Cb 0.22 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1rrm h VAL 76 CO -0.01 0.35 0.08 0.58 0.02 0.00 0.00 177.57 178.59 1rrm h VAL 77 N 0.76 1.22 -0.67 2.57 2.07 -1.08 0.26 116.25 121.37 1rrm h VAL 77 Ca 0.15 -0.71 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 1rrm h VAL 77 Cb 0.43 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1rrm h VAL 77 CO 0.02 0.24 0.10 0.11 0.02 0.00 0.00 177.57 178.05 1rrm h LYS 78 N 0.36 1.11 -0.26 1.57 1.57 -0.94 -0.03 116.57 119.95 1rrm h LYS 78 Ca 0.10 -0.30 -0.03 0.00 -1.87 0.00 0.00 60.65 58.54 1rrm h LYS 78 Cb 0.28 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1rrm h LYS 78 CO -0.00 1.02 0.03 1.49 -0.57 0.00 0.00 179.45 181.42 1rrm h GLU 79 N 1.03 0.44 -0.54 3.15 4.81 -0.98 -2.10 114.58 120.38 1rrm h GLU 79 Ca 0.20 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1rrm h GLU 79 Cb 0.46 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1rrm h GLU 79 CO 0.02 0.58 0.25 0.78 -0.73 0.00 0.00 179.01 179.90 1rrm h GLY 80 N 0.24 0.82 0.96 1.92 0.00 -0.75 -1.87 103.07 104.38 1rrm h GLY 80 Ca 0.08 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1rrm h GLY 80 CO 0.01 0.37 0.20 -2.00 0.00 0.00 0.00 176.54 175.11 1rrm h LEU 81 N 0.76 0.58 -0.56 3.11 5.85 -0.79 -0.72 115.31 123.55 1rrm h LEU 81 Ca 0.19 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1rrm h LEU 81 Cb 0.10 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1rrm h LEU 81 CO -0.02 0.56 0.37 1.23 -0.34 0.00 0.00 178.44 180.23 1rrm h GLY 82 N 0.56 0.80 1.01 3.75 0.00 -0.82 0.03 103.07 108.40 1rrm h GLY 82 Ca 0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1rrm h GLY 82 CO -0.02 0.27 0.39 -2.08 0.00 0.00 0.00 176.54 175.11 1rrm h VAL 83 N 0.74 1.22 -0.06 4.60 2.07 -1.06 -0.27 116.25 123.50 1rrm h VAL 83 Ca 0.21 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 1rrm h VAL 83 Cb -0.06 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1rrm h VAL 83 CO -0.06 0.25 0.03 0.15 0.02 0.00 0.00 177.57 177.96 1rrm h PHE 84 N 1.01 0.08 -0.40 1.57 3.57 -0.57 -0.72 116.94 121.47 1rrm h PHE 84 Ca 0.26 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1rrm h PHE 84 Cb 0.05 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 1rrm h PHE 84 CO -0.00 0.14 0.21 1.96 -2.23 0.00 0.00 178.31 178.39 1rrm h GLN 85 N -0.01 0.55 -0.00 1.11 4.20 -0.69 -2.41 115.11 117.85 1rrm h GLN 85 Ca 0.02 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1rrm h GLN 85 Cb 0.09 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1rrm h GLN 85 CO -0.00 0.41 -0.29 0.09 -0.67 0.00 0.00 178.83 178.37 1rrm n ASN 86 N -4.42 0.60 0.10 1.46 3.02 -0.14 -4.06 115.26 111.82 1rrm n ASN 86 Ca 0.03 -0.43 0.04 0.00 -0.03 0.00 0.00 54.58 54.19 1rrm n ASN 86 Cb 0.10 0.07 -0.00 0.00 -0.61 0.00 0.00 39.78 39.34 1rrm n ASN 86 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1rrm h SER 87 N 0.48 0.00 0.00 6.41 4.64 -0.60 -3.48 113.55 121.00 1rrm h SER 87 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rrm h SER 87 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1rrm h SER 87 CO 0.00 0.38 0.00 0.61 -0.87 0.00 0.00 176.83 176.95 1rrm n GLY 88 N 1.27 0.85 3.75 -0.77 0.00 -1.23 -5.02 105.19 104.04 1rrm n GLY 88 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1rrm n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rrm s ALA 89 N -3.34 2.52 -0.76 4.61 0.00 -1.26 -4.80 121.76 118.74 1rrm s ALA 89 Ca 0.00 1.05 0.06 0.00 0.00 0.00 0.00 51.96 53.07 1rrm s ALA 89 Cb 0.00 -3.47 0.08 0.00 0.00 0.00 0.00 23.12 19.73 1rrm s ALA 89 CO 0.00 -1.23 0.81 -0.40 0.00 0.00 0.00 175.76 174.94 1rrm n ASP 90 N -1.63 1.77 -3.76 0.00 5.75 0.55 -4.97 116.55 114.26 1rrm n ASP 90 Ca 0.14 -1.44 -0.09 0.00 -0.01 0.00 0.00 54.79 53.39 1rrm n ASP 90 Cb 0.49 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.52 1rrm n ASP 90 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1rrm s TYR 91 N -0.65 -0.11 0.05 2.11 -0.85 -1.19 -4.58 117.35 112.14 1rrm s TYR 91 Ca 0.09 -0.25 0.09 0.00 -0.52 0.00 0.00 57.07 56.49 1rrm s TYR 91 Cb 0.06 0.43 -0.03 0.00 0.38 0.00 0.00 41.96 42.80 1rrm s TYR 91 CO 0.08 -0.97 -0.26 -0.51 -1.52 0.00 0.00 175.55 172.37 1rrm s LEU 92 N -2.89 2.18 -0.23 -3.49 1.43 0.15 -2.03 118.68 113.81 1rrm s LEU 92 Ca 0.10 -0.61 0.01 0.00 -1.03 0.00 0.00 54.13 52.61 1rrm s LEU 92 Cb -0.02 -1.26 0.05 0.00 0.03 0.00 0.00 46.19 44.99 1rrm s LEU 92 CO -0.01 0.24 -0.09 -0.63 0.23 0.00 0.00 176.35 176.10 1rrm s ILE 93 N -0.83 1.72 -0.34 -0.59 1.01 -0.60 -0.63 121.20 120.93 1rrm s ILE 93 Ca 0.12 -1.23 -0.19 0.00 0.00 0.00 0.00 60.65 59.34 1rrm s ILE 93 Cb -0.10 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.49 1rrm s ILE 93 CO 0.02 0.02 0.57 0.00 0.00 0.00 0.00 174.94 175.55 1rrm s ALA 94 N 1.33 3.49 -0.29 9.38 0.00 -0.40 -0.67 121.76 134.58 1rrm s ALA 94 Ca -0.05 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 1rrm s ALA 94 Cb -0.18 -3.07 0.05 0.00 0.00 0.00 0.00 23.12 19.92 1rrm s ALA 94 CO -0.07 -1.20 -0.01 0.42 0.00 0.00 0.00 175.76 174.90 1rrm s ILE 95 N 2.52 2.99 -5.00 0.00 1.01 -0.43 -0.45 121.20 121.84 1rrm s ILE 95 Ca 0.22 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.54 1rrm s ILE 95 Cb -0.15 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.63 1rrm s ILE 95 CO 0.13 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.61 1rrm n GLY 96 N 4.63 0.30 0.00 6.18 0.00 -0.84 -4.31 105.19 111.15 1rrm n GLY 96 Ca -0.14 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1rrm n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rrm n GLY 97 N 0.00 -0.02 0.31 -0.02 0.00 -1.26 -1.83 105.19 102.38 1rrm n GLY 97 Ca 0.00 -1.69 0.08 0.00 0.00 0.00 0.00 46.02 44.41 1rrm n GLY 97 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1rrm h GLY 98 N 0.00 0.38 0.80 -0.02 0.00 -1.96 -2.34 103.07 99.93 1rrm h GLY 98 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1rrm h GLY 98 CO 0.00 0.11 -0.18 1.76 0.00 0.00 0.00 176.54 178.23 1rrm h SER 99 N 0.33 -0.44 -0.23 0.19 0.02 -1.92 0.63 113.55 112.13 1rrm h SER 99 Ca 0.15 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.91 1rrm h SER 99 Cb 0.18 0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1rrm h SER 99 CO -0.03 -0.15 -0.16 -0.65 -1.14 0.00 0.00 176.83 174.70 1rrm h PRO 100 N -0.73 0.66 -0.62 3.45 0.11 -1.88 -1.40 132.00 131.60 1rrm h PRO 100 Ca -0.05 -0.23 -0.09 0.00 0.11 0.00 0.00 66.00 65.74 1rrm h PRO 100 Cb 0.51 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1rrm h PRO 100 CO 0.09 0.79 0.03 1.96 -0.21 0.00 0.00 178.00 180.66 1rrm h GLN 101 N 0.59 1.07 -0.17 1.05 4.20 -1.39 -0.26 115.11 120.20 1rrm h GLN 101 Ca 0.10 -0.33 -0.17 0.00 0.06 0.00 0.00 58.65 58.32 1rrm h GLN 101 Cb 0.61 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1rrm h GLN 101 CO 0.04 1.03 -0.58 -0.44 -0.67 0.00 0.00 178.83 178.21 1rrm h ASP 102 N 0.98 0.62 -0.67 1.46 5.19 -0.74 -1.69 116.42 121.56 1rrm h ASP 102 Ca 0.18 -0.34 -0.05 0.00 -0.62 0.00 0.00 57.03 56.19 1rrm h ASP 102 Cb 0.52 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.83 1rrm h ASP 102 CO 0.03 1.06 0.22 0.74 -3.12 0.00 0.00 179.24 178.17 1rrm h THR 103 N 0.42 1.25 -0.68 0.35 2.02 -1.06 -1.88 112.91 113.33 1rrm h THR 103 Ca 0.00 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.29 1rrm h THR 103 Cb 1.13 0.54 -0.03 0.00 -1.74 0.00 0.00 68.15 68.05 1rrm h THR 103 CO 0.11 0.33 0.29 0.00 0.37 0.00 0.00 175.52 176.62 1rrm h LYS 105 N 0.95 0.74 -0.25 0.00 1.57 -1.03 0.25 116.57 118.80 1rrm h LYS 105 Ca 0.23 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1rrm h LYS 105 Cb 0.18 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1rrm h LYS 105 CO -0.02 0.63 0.15 0.00 -0.57 0.00 0.00 179.45 179.64 1rrm h ALA 106 N 1.07 0.31 -0.05 3.86 0.00 -1.02 -0.96 119.26 122.47 1rrm h ALA 106 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1rrm h ALA 106 Cb 0.15 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1rrm h ALA 106 CO -0.02 -0.23 0.03 0.82 0.00 0.00 0.00 179.25 179.85 1rrm h ILE 107 N 0.31 1.03 -0.74 0.00 2.04 -1.02 -0.99 117.51 118.14 1rrm h ILE 107 Ca 0.09 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.90 1rrm h ILE 107 Cb -0.02 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 1rrm h ILE 107 CO -0.03 0.02 0.49 1.23 0.00 0.00 0.00 178.15 179.86 1rrm h GLY 108 N 0.05 1.05 0.49 5.37 0.00 -0.76 -1.30 103.07 107.96 1rrm h GLY 108 Ca 0.02 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.92 1rrm h GLY 108 CO -0.00 0.38 -0.13 -2.22 0.00 0.00 0.00 176.54 174.56 1rrm h ILE 109 N 1.00 1.48 -0.69 2.60 2.04 -0.93 -1.49 117.51 121.52 1rrm h ILE 109 Ca 0.28 -1.61 -0.02 0.00 1.00 0.00 0.00 64.86 64.50 1rrm h ILE 109 Cb -0.10 2.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.41 1rrm h ILE 109 CO -0.06 0.44 0.33 0.40 0.00 0.00 0.00 178.15 179.26 1rrm h ILE 110 N -0.44 1.22 -0.79 -0.67 2.04 -1.09 0.09 117.51 117.87 1rrm h ILE 110 Ca -0.01 -0.61 0.08 0.00 1.00 0.00 0.00 64.86 65.32 1rrm h ILE 110 Cb 0.78 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 1rrm h ILE 110 CO 0.03 0.26 0.52 -1.28 0.00 0.00 0.00 178.15 177.67 1rrm h SER 111 N 0.97 0.71 -0.04 1.72 0.87 -1.30 -1.38 113.55 115.09 1rrm h SER 111 Ca 0.24 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1rrm h SER 111 Cb 0.10 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1rrm h SER 111 CO -0.03 0.44 0.00 0.59 -0.53 0.00 0.00 176.83 177.30 1rrm n ASN 112 N -4.49 2.95 -3.13 6.23 3.02 -0.95 -4.54 115.26 114.34 1rrm n ASN 112 Ca 0.12 -1.97 -0.21 0.00 -0.03 0.00 0.00 54.58 52.49 1rrm n ASN 112 Cb 0.27 -0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 1rrm n ASN 112 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1rrm n ASN 113 N 1.31 -0.14 0.32 6.41 3.02 -0.02 -4.61 115.26 121.55 1rrm n ASN 113 Ca 0.14 -2.84 0.15 0.00 -0.03 0.00 0.00 54.58 52.00 1rrm n ASN 113 Cb 0.58 -0.29 0.79 0.00 -0.61 0.00 0.00 39.78 40.25 1rrm n ASN 113 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1rrm h PRO 114 N 3.82 0.00 0.00 3.52 0.13 -1.61 -2.40 132.00 135.46 1rrm h PRO 114 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1rrm h PRO 114 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1rrm h PRO 114 CO 0.44 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.36 1rrm n GLU 115 N -2.82 0.04 -1.01 0.86 0.00 -1.26 -2.32 120.64 114.12 1rrm n GLU 115 Ca -0.02 0.30 -0.11 0.00 0.00 0.00 0.00 57.16 57.32 1rrm n GLU 115 Cb 0.37 -1.57 0.23 0.00 0.00 0.00 0.00 31.44 30.46 1rrm n GLU 115 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1rrm n PHE 116 N -1.65 2.28 0.33 -1.84 3.72 -0.90 -4.64 117.46 114.76 1rrm n PHE 116 Ca 0.03 -1.52 0.22 0.00 -0.05 0.00 0.00 57.45 56.14 1rrm n PHE 116 Cb 0.17 -0.72 1.18 0.00 -0.94 0.00 0.00 39.48 39.18 1rrm n PHE 116 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rrm h ALA 117 N 1.60 1.00 0.00 4.37 0.00 -1.68 -0.33 119.26 124.21 1rrm h ALA 117 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1rrm h ALA 117 Cb 2.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.12 1rrm h ALA 117 CO 0.77 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.62 1rrm n ASP 118 N -3.05 0.15 0.00 0.00 5.75 -1.26 -4.92 116.55 113.22 1rrm n ASP 118 Ca -0.03 0.52 0.00 0.00 -0.01 0.00 0.00 54.79 55.27 1rrm n ASP 118 Cb 0.08 -0.56 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 1rrm n ASP 118 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1rrm n VAL 119 N -1.65 0.00 0.31 2.12 0.31 -0.14 -4.55 118.33 114.74 1rrm n VAL 119 Ca 0.06 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.57 1rrm n VAL 119 Cb 0.33 0.00 1.02 0.00 -0.91 0.00 0.00 33.84 34.28 1rrm n VAL 119 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 1rrm h ARG 120 N 0.00 0.00 0.00 5.55 0.11 -1.91 -1.63 114.38 116.50 1rrm h ARG 120 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1rrm h ARG 120 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1rrm h ARG 120 CO 0.00 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 178.94 1rrm n SER 121 N -3.58 0.00 -0.06 0.08 3.41 -1.26 -2.71 113.62 109.50 1rrm n SER 121 Ca -0.03 -0.34 0.13 0.00 -0.26 0.00 0.00 58.87 58.37 1rrm n SER 121 Cb 0.08 -0.13 0.35 0.00 -0.26 0.00 0.00 64.21 64.25 1rrm n SER 121 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1rrm n LEU 122 N -1.13 0.56 -4.62 1.04 4.77 -0.61 -4.89 117.00 112.13 1rrm n LEU 122 Ca 0.12 -0.01 -0.41 0.00 -0.03 0.00 0.00 56.01 55.69 1rrm n LEU 122 Cb 0.10 -0.24 0.02 0.00 -2.33 0.00 0.00 43.42 40.97 1rrm n LEU 122 CO 0.13 0.12 0.60 1.21 -1.33 0.00 0.00 177.39 178.12 1rrm n GLU 123 N -1.27 1.35 0.00 3.23 2.13 -1.10 -3.99 120.64 120.99 1rrm n GLU 123 Ca 0.08 0.49 0.00 0.00 0.66 0.00 0.00 57.16 58.39 1rrm n GLU 123 Cb 0.33 -2.08 0.00 0.00 0.27 0.00 0.00 31.44 29.96 1rrm n GLU 123 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rrm n GLY 124 N 1.17 -0.37 3.57 8.31 0.00 0.41 -4.42 105.19 113.85 1rrm n GLY 124 Ca 0.10 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.62 1rrm n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rrm s LEU 125 N 0.00 3.64 -0.33 0.99 1.43 -1.26 -0.36 118.68 122.79 1rrm s LEU 125 Ca 0.00 -2.01 -0.40 0.00 -1.03 0.00 0.00 54.13 50.68 1rrm s LEU 125 Cb 0.00 -2.58 -0.16 0.00 0.03 0.00 0.00 46.19 43.49 1rrm s LEU 125 CO 0.00 -1.52 1.84 -1.20 0.23 0.00 0.00 176.35 175.70 1rrm n SER 126 N 9.37 2.13 -2.62 2.29 7.64 -1.01 -4.83 113.62 126.59 1rrm n SER 126 Ca 0.44 0.95 -0.25 0.00 1.01 0.00 0.00 58.87 61.02 1rrm n SER 126 Cb 0.47 -1.12 -0.10 0.00 -1.01 0.00 0.00 64.21 62.46 1rrm n SER 126 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1rrm n PRO 127 N 5.90 2.83 -2.83 1.43 -0.04 -1.26 -4.89 135.00 136.14 1rrm n PRO 127 Ca 0.32 -1.67 -0.35 0.00 -0.04 0.00 0.00 63.50 61.75 1rrm n PRO 127 Cb 0.11 -2.36 -0.07 0.00 -0.04 0.00 0.00 33.50 31.15 1rrm n PRO 127 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1rrm s THR 128 N 1.19 4.31 -0.12 0.52 -4.23 -1.26 -4.99 115.64 111.05 1rrm s THR 128 Ca 0.67 1.65 0.20 0.00 -1.18 0.00 0.00 61.69 63.03 1rrm s THR 128 Cb 0.26 -3.85 -0.28 0.00 1.34 0.00 0.00 72.50 69.98 1rrm s THR 128 CO -0.04 -0.03 0.30 0.59 -0.54 0.00 0.00 174.62 174.91 1rrm n ASN 129 N 0.12 0.07 -4.42 3.99 5.03 -1.26 -4.99 115.26 113.80 1rrm n ASN 129 Ca 0.03 0.03 -0.30 0.00 0.87 0.00 0.00 54.58 55.22 1rrm n ASN 129 Cb 0.52 1.35 -0.13 0.00 -1.02 0.00 0.00 39.78 40.50 1rrm n ASN 129 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1rrm s LYS 130 N -2.96 1.77 0.76 3.52 -0.14 -1.26 -5.12 119.74 116.32 1rrm s LYS 130 Ca -0.09 -1.15 -0.13 0.00 -1.36 0.00 0.00 55.97 53.24 1rrm s LYS 130 Cb 0.10 -2.05 0.06 0.00 -1.68 0.00 0.00 37.83 34.25 1rrm s LYS 130 CO 0.86 0.50 1.17 -2.14 -0.76 0.00 0.00 175.35 174.98 1rrm s PRO 131 N -1.71 2.01 0.87 -1.68 0.02 -1.26 -4.86 135.00 128.39 1rrm s PRO 131 Ca 0.15 1.60 -0.11 0.00 0.02 0.00 0.00 61.00 62.66 1rrm s PRO 131 Cb -0.10 -1.84 0.12 0.00 0.02 0.00 0.00 34.50 32.70 1rrm s PRO 131 CO 0.06 -1.90 1.10 0.45 -0.33 0.00 0.00 177.00 176.38 1rrm s SER 132 N -2.39 3.56 0.42 2.53 0.15 -0.05 -4.79 113.70 113.12 1rrm s SER 132 Ca 0.70 1.80 -0.26 0.00 0.70 0.00 0.00 55.95 58.88 1rrm s SER 132 Cb -0.25 -2.42 -0.09 0.00 -1.71 0.00 0.00 66.02 61.55 1rrm s SER 132 CO 0.48 -2.63 1.45 0.52 1.20 0.00 0.00 173.24 174.26 1rrm n VAL 133 N -3.91 2.49 -1.62 4.45 0.31 -0.56 -4.82 118.33 114.67 1rrm n VAL 133 Ca 0.09 -0.50 -0.49 0.00 -0.01 0.00 0.00 64.34 63.42 1rrm n VAL 133 Cb 0.53 -1.89 -0.05 0.00 -0.91 0.00 0.00 33.84 31.53 1rrm n VAL 133 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1rrm n PRO 134 N 0.06 1.54 -5.20 5.55 -0.02 -1.26 -4.78 135.00 130.89 1rrm n PRO 134 Ca 0.04 0.55 -0.32 0.00 -2.02 0.00 0.00 63.50 61.75 1rrm n PRO 134 Cb 0.40 -2.23 -0.16 0.00 -0.02 0.00 0.00 33.50 31.49 1rrm n PRO 134 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1rrm s ILE 135 N 0.52 2.17 -0.26 4.25 1.01 -1.26 -0.68 121.20 126.95 1rrm s ILE 135 Ca 0.80 -1.00 -0.04 0.00 0.00 0.00 0.00 60.65 60.41 1rrm s ILE 135 Cb -0.83 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 39.84 1rrm s ILE 135 CO 0.45 0.56 -0.00 -0.76 0.00 0.00 0.00 174.94 175.18 1rrm s LEU 136 N 0.07 3.40 -0.16 2.97 1.02 0.19 -0.63 118.68 125.54 1rrm s LEU 136 Ca -0.10 -0.74 -0.07 0.00 0.02 0.00 0.00 54.13 53.23 1rrm s LEU 136 Cb -0.16 -1.76 -0.04 0.00 0.02 0.00 0.00 46.19 44.25 1rrm s LEU 136 CO 0.06 -0.14 0.08 0.00 0.02 0.00 0.00 176.35 176.38 1rrm s ALA 137 N 1.41 3.54 -0.42 4.21 0.00 -0.14 -1.28 121.76 129.08 1rrm s ALA 137 Ca 0.02 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.28 1rrm s ALA 137 Cb -0.17 -1.94 0.13 0.00 0.00 0.00 0.00 23.12 21.15 1rrm s ALA 137 CO -0.02 0.30 0.21 0.42 0.00 0.00 0.00 175.76 176.67 1rrm s ILE 138 N -0.01 1.39 0.51 0.00 1.01 0.40 -0.77 121.20 123.73 1rrm s ILE 138 Ca 0.07 -2.42 -0.22 0.00 0.00 0.00 0.00 60.65 58.09 1rrm s ILE 138 Cb -0.12 -1.98 -0.06 0.00 0.01 0.00 0.00 42.46 40.31 1rrm s ILE 138 CO 0.01 -0.86 1.21 -2.16 0.00 0.00 0.00 174.94 173.14 1rrm s PRO 139 N 0.52 3.46 0.00 2.79 0.04 -1.25 -1.99 135.00 138.56 1rrm s PRO 139 Ca 0.16 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1rrm s PRO 139 Cb -0.24 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.04 1rrm s PRO 139 CO -0.03 -0.83 0.60 0.25 0.04 0.00 0.00 177.00 177.04 1rrm n THR 140 N -0.86 0.23 -4.32 1.26 -2.24 -0.76 -4.71 114.28 102.88 1rrm n THR 140 Ca 0.09 -0.60 -0.22 0.00 -2.27 0.00 0.00 64.05 61.06 1rrm n THR 140 Cb 0.48 0.91 -0.11 0.00 -2.10 0.00 0.00 70.33 69.50 1rrm n THR 140 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1rrm s THR 141 N -0.23 1.78 -0.89 4.28 -4.23 -1.26 -4.84 115.64 110.25 1rrm s THR 141 Ca 0.00 -1.89 -0.00 0.00 -1.18 0.00 0.00 61.69 58.61 1rrm s THR 141 Cb 0.00 -1.81 0.26 0.00 1.34 0.00 0.00 72.50 72.29 1rrm s THR 141 CO 0.00 -0.32 1.04 0.00 -0.54 0.00 0.00 174.62 174.80 1rrm n ALA 142 N 0.33 4.39 0.00 3.99 0.00 -1.26 -4.66 120.51 123.31 1rrm n ALA 142 Ca -0.13 -4.73 0.00 0.00 0.00 0.00 0.00 53.44 48.57 1rrm n ALA 142 Cb 0.57 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1rrm n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rrm n GLY 143 N 1.53 0.18 0.13 0.00 0.00 -1.24 -3.23 105.19 102.55 1rrm n GLY 143 Ca 0.26 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 46.19 1rrm n GLY 143 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1rrm h THR 144 N 0.00 0.52 -1.62 2.61 1.35 -1.83 -3.14 112.91 110.80 1rrm h THR 144 Ca 0.00 -1.85 -0.42 0.00 -0.55 0.00 0.00 66.41 63.59 1rrm h THR 144 Cb 0.00 2.10 -0.12 0.00 -1.73 0.00 0.00 68.15 68.40 1rrm h THR 144 CO 0.00 0.30 -0.43 0.00 -0.25 0.00 0.00 175.52 175.13 1rrm n ALA 145 N -2.27 -0.41 0.29 6.62 0.00 -1.26 -4.84 120.51 118.64 1rrm n ALA 145 Ca -0.03 0.28 0.19 0.00 0.00 0.00 0.00 53.44 53.88 1rrm n ALA 145 Cb 0.73 -2.10 0.98 0.00 0.00 0.00 0.00 19.45 19.06 1rrm n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rrm h ALA 146 N 0.31 1.38 0.00 0.00 0.00 -1.93 -0.95 119.26 118.08 1rrm h ALA 146 Ca -0.45 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1rrm h ALA 146 Cb 1.36 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1rrm h ALA 146 CO 0.61 -0.17 -0.01 1.05 0.00 0.00 0.00 179.25 180.73 1rrm h GLU 147 N 0.00 0.00 0.00 0.00 9.09 -1.95 -3.31 114.58 118.41 1rrm h GLU 147 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 1rrm h GLU 147 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 1rrm h GLU 147 CO -0.00 0.01 0.00 1.55 0.05 0.00 0.00 179.01 180.62 1rrm n VAL 148 N -3.11 0.00 -2.40 -1.06 3.14 -0.40 -4.36 118.33 110.14 1rrm n VAL 148 Ca 0.00 -0.43 -0.25 0.00 -2.96 0.00 0.00 64.34 60.71 1rrm n VAL 148 Cb 0.30 1.02 0.05 0.00 -1.06 0.00 0.00 33.84 34.15 1rrm n VAL 148 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1rrm s THR 149 N -0.73 2.93 -1.05 1.55 -4.23 -0.95 -4.66 115.64 108.50 1rrm s THR 149 Ca 0.00 -0.27 0.17 0.00 -1.18 0.00 0.00 61.69 60.41 1rrm s THR 149 Cb 0.00 -3.18 0.65 0.00 1.34 0.00 0.00 72.50 71.30 1rrm s THR 149 CO 0.00 -0.18 1.56 2.30 -0.54 0.00 0.00 174.62 177.76 1rrm n ILE 150 N -2.64 1.73 -4.17 2.99 -5.35 -1.26 -4.64 119.36 106.02 1rrm n ILE 150 Ca 0.06 -1.24 -0.24 0.00 -0.27 0.00 0.00 62.75 61.07 1rrm n ILE 150 Cb 0.59 0.16 -0.07 0.00 -1.74 0.00 0.00 39.64 38.58 1rrm n ILE 150 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1rrm s ASN 151 N -1.04 4.52 -0.26 7.28 0.02 -1.26 -0.88 114.94 123.33 1rrm s ASN 151 Ca 0.47 -0.85 -0.25 0.00 -1.02 0.00 0.00 52.86 51.20 1rrm s ASN 151 Cb 0.30 -0.66 0.09 0.00 0.02 0.00 0.00 41.25 41.00 1rrm s ASN 151 CO 0.22 -0.29 0.84 -0.72 0.02 0.00 0.00 177.10 177.17 1rrm s TYR 152 N -2.46 -0.66 -0.13 2.20 -0.85 -0.74 -4.95 117.35 109.76 1rrm s TYR 152 Ca 0.37 1.58 0.03 0.00 -0.52 0.00 0.00 57.07 58.53 1rrm s TYR 152 Cb -0.01 0.31 0.01 0.00 0.38 0.00 0.00 41.96 42.65 1rrm s TYR 152 CO 0.22 -0.34 -0.22 0.54 -1.52 0.00 0.00 175.55 174.23 1rrm s VAL 153 N 0.21 2.04 0.12 -3.49 0.11 -1.26 -0.61 120.40 117.52 1rrm s VAL 153 Ca 0.01 -0.98 0.08 0.00 -2.93 0.00 0.00 61.98 58.16 1rrm s VAL 153 Cb -0.05 -1.80 -0.04 0.00 -1.53 0.00 0.00 36.38 32.97 1rrm s VAL 153 CO -0.01 0.55 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.56 1rrm s ILE 154 N 0.71 3.20 -0.23 7.04 -1.09 -0.83 -4.62 121.20 125.38 1rrm s ILE 154 Ca -0.10 -1.40 -0.13 0.00 -2.23 0.00 0.00 60.65 56.79 1rrm s ILE 154 Cb -0.16 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.17 1rrm s ILE 154 CO 0.01 0.07 0.26 -0.89 -1.23 0.00 0.00 174.94 173.15 1rrm s THR 155 N -1.29 5.29 -0.74 2.92 2.01 0.18 -0.41 115.64 123.60 1rrm s THR 155 Ca 0.21 0.39 -0.18 0.00 0.31 0.00 0.00 61.69 62.42 1rrm s THR 155 Cb -0.11 -3.59 0.14 0.00 0.01 0.00 0.00 72.50 68.95 1rrm s THR 155 CO 0.13 0.30 0.85 -0.62 -0.69 0.00 0.00 174.62 174.59 1rrm s ASP 156 N 1.10 6.44 0.28 3.53 -1.08 0.87 -2.06 116.67 125.75 1rrm s ASP 156 Ca 0.12 -1.87 -0.02 0.00 -0.52 0.00 0.00 52.55 50.26 1rrm s ASP 156 Cb -0.14 -2.31 0.42 0.00 -1.46 0.00 0.00 42.92 39.43 1rrm s ASP 156 CO 0.06 -1.00 1.93 -0.33 0.52 0.00 0.00 175.17 176.36 1rrm h GLU 157 N 8.79 1.12 -0.73 4.34 5.08 -1.96 0.23 114.58 131.46 1rrm h GLU 157 Ca -0.08 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1rrm h GLU 157 Cb 1.06 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 30.02 1rrm h GLU 157 CO 1.03 0.74 0.45 1.49 -1.00 0.00 0.00 179.01 181.72 1rrm h GLU 158 N 1.16 0.98 -0.58 2.33 4.81 -1.96 -2.57 114.58 118.74 1rrm h GLU 158 Ca 0.36 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1rrm h GLU 158 Cb 0.00 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.17 1rrm h GLU 158 CO -0.11 0.68 0.00 1.63 -0.73 0.00 0.00 179.01 180.49 1rrm n LYS 159 N -4.54 2.60 -3.80 1.92 5.02 -1.01 -4.99 118.16 113.36 1rrm n LYS 159 Ca 0.07 -2.45 -0.32 0.00 -2.02 0.00 0.00 58.31 53.58 1rrm n LYS 159 Cb 0.05 -1.54 0.02 0.00 -0.02 0.00 0.00 35.03 33.53 1rrm n LYS 159 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1rrm n ARG 160 N 1.55 -1.01 -3.61 1.97 0.63 0.77 -4.98 116.66 111.98 1rrm n ARG 160 Ca 0.22 0.52 -0.13 0.00 -0.92 0.00 0.00 57.85 57.54 1rrm n ARG 160 Cb 0.61 -3.11 -0.07 0.00 0.45 0.00 0.00 32.46 30.34 1rrm n ARG 160 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 1rrm s ARG 161 N -5.86 0.76 -0.14 -0.14 1.70 -0.94 -4.72 118.95 109.61 1rrm s ARG 161 Ca 0.28 0.65 -0.19 0.00 -0.47 0.00 0.00 55.73 56.01 1rrm s ARG 161 Cb -0.13 0.36 -0.04 0.00 -0.57 0.00 0.00 34.95 34.57 1rrm s ARG 161 CO 0.90 -0.14 0.52 0.15 -1.08 0.00 0.00 175.30 175.65 1rrm s LYS 162 N -0.12 4.30 -0.12 3.89 1.02 -1.26 -0.09 119.74 127.37 1rrm s LYS 162 Ca -0.01 0.49 0.01 0.00 0.02 0.00 0.00 55.97 56.48 1rrm s LYS 162 Cb -0.04 -3.48 -0.01 0.00 -0.52 0.00 0.00 37.83 33.78 1rrm s LYS 162 CO 0.01 0.04 -0.16 -0.59 -0.92 0.00 0.00 175.35 173.73 1rrm s PHE 163 N 0.99 2.73 -0.01 3.18 -0.12 0.45 -4.93 117.98 120.27 1rrm s PHE 163 Ca 0.27 -0.72 -0.22 0.00 -0.05 0.00 0.00 56.93 56.21 1rrm s PHE 163 Cb -0.15 -1.79 -0.05 0.00 -0.63 0.00 0.00 43.02 40.39 1rrm s PHE 163 CO 0.11 -0.24 0.66 0.08 -0.05 0.00 0.00 175.22 175.78 1rrm s VAL 164 N 0.27 4.90 -0.16 -2.49 1.01 -1.26 -1.97 120.40 120.71 1rrm s VAL 164 Ca -0.12 1.39 -0.00 0.00 0.00 0.00 0.00 61.98 63.25 1rrm s VAL 164 Cb -0.16 -4.00 -0.00 0.00 0.00 0.00 0.00 36.38 32.21 1rrm s VAL 164 CO 0.06 0.36 -0.14 0.00 0.00 0.00 0.00 175.10 175.38 1rrm s VAL 166 N 0.83 3.07 -0.30 0.00 1.01 0.52 -1.79 120.40 123.74 1rrm s VAL 166 Ca -0.05 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 1rrm s VAL 166 Cb -0.15 -2.44 0.15 0.00 0.00 0.00 0.00 36.38 33.94 1rrm s VAL 166 CO 0.00 0.36 0.64 -0.62 0.00 0.00 0.00 175.10 175.48 1rrm s ASP 167 N 1.41 -1.22 0.61 3.32 2.15 -0.06 -2.39 116.67 120.50 1rrm s ASP 167 Ca 0.04 1.37 0.32 0.00 0.43 0.00 0.00 52.55 54.71 1rrm s ASP 167 Cb -0.15 2.27 1.82 0.00 -0.30 0.00 0.00 42.92 46.55 1rrm s ASP 167 CO -0.05 -0.23 2.15 -0.65 -0.17 0.00 0.00 175.17 176.22 1rrm h PRO 168 N 8.00 0.00 0.00 4.34 0.11 -1.93 -1.32 132.00 141.20 1rrm h PRO 168 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1rrm h PRO 168 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1rrm h PRO 168 CO 0.15 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 178.66 1rrm n HIS 169 N -3.58 0.75 0.87 0.65 8.25 -1.26 -2.80 115.22 118.10 1rrm n HIS 169 Ca -0.00 0.31 0.12 0.00 -0.26 0.00 0.00 57.72 57.89 1rrm n HIS 169 Cb 0.25 -1.00 0.27 0.00 1.12 0.00 0.00 29.99 30.63 1rrm n HIS 169 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1rrm n ASP 170 N -2.20 2.64 -4.70 0.41 5.68 -0.50 -0.87 116.55 117.01 1rrm n ASP 170 Ca 0.02 -1.86 -0.42 0.00 -0.50 0.00 0.00 54.79 52.03 1rrm n ASP 170 Cb 0.19 -0.12 -0.03 0.00 -1.14 0.00 0.00 41.12 40.02 1rrm n ASP 170 CO 0.00 0.00 0.00 -0.51 -1.33 0.00 0.00 177.20 175.36 1rrm s ILE 171 N -1.76 2.65 0.49 2.12 1.10 -1.12 -4.94 121.20 119.74 1rrm s ILE 171 Ca 0.34 0.31 -0.23 0.00 -0.51 0.00 0.00 60.65 60.56 1rrm s ILE 171 Cb 0.21 -3.20 -0.07 0.00 0.15 0.00 0.00 42.46 39.55 1rrm s ILE 171 CO 0.30 0.01 1.32 -2.84 -2.11 0.00 0.00 174.94 171.63 1rrm s PRO 172 N 1.99 3.49 0.19 3.50 0.02 -1.26 -4.79 135.00 138.13 1rrm s PRO 172 Ca 0.74 2.17 -0.04 0.00 0.02 0.00 0.00 61.00 63.89 1rrm s PRO 172 Cb -0.44 -2.44 0.10 0.00 0.02 0.00 0.00 34.50 31.74 1rrm s PRO 172 CO 0.33 -0.89 1.51 1.96 -0.33 0.00 0.00 177.00 179.58 1rrm h GLN 173 N 1.93 0.62 -3.56 5.54 1.08 -1.24 -3.41 115.11 116.07 1rrm h GLN 173 Ca -0.50 -0.37 -0.20 0.00 -1.45 0.00 0.00 58.65 56.13 1rrm h GLN 173 Cb 1.27 0.03 -0.26 0.00 -0.05 0.00 0.00 27.48 28.48 1rrm h GLN 173 CO 0.59 0.98 -0.61 0.08 -0.95 0.00 0.00 178.83 178.92 1rrm s VAL 174 N -4.09 0.02 -0.02 -0.54 1.01 -1.20 -3.28 120.40 112.29 1rrm s VAL 174 Ca -0.08 -0.14 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1rrm s VAL 174 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.31 1rrm s VAL 174 CO 0.85 -0.08 -0.22 0.00 0.00 0.00 0.00 175.10 175.65 1rrm s ALA 175 N -0.21 1.84 -0.28 5.51 0.00 -0.91 -0.97 121.76 126.75 1rrm s ALA 175 Ca -0.03 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.03 1rrm s ALA 175 Cb -0.02 -0.50 0.07 0.00 0.00 0.00 0.00 23.12 22.67 1rrm s ALA 175 CO 0.00 0.43 -0.06 -0.06 0.00 0.00 0.00 175.76 176.07 1rrm s PHE 176 N -0.41 3.21 -0.73 0.00 0.08 0.05 -0.69 117.98 119.49 1rrm s PHE 176 Ca 0.06 -2.38 -0.12 0.00 0.12 0.00 0.00 56.93 54.60 1rrm s PHE 176 Cb -0.09 -2.10 0.19 0.00 -0.57 0.00 0.00 43.02 40.44 1rrm s PHE 176 CO 0.00 -0.88 0.65 0.42 -0.10 0.00 0.00 175.22 175.31 1rrm s ILE 177 N 1.11 5.15 -0.26 0.64 1.09 0.22 -3.90 121.20 125.25 1rrm s ILE 177 Ca -0.03 -2.39 0.01 0.00 -1.10 0.00 0.00 60.65 57.14 1rrm s ILE 177 Cb -0.20 -4.23 0.05 0.00 -1.06 0.00 0.00 42.46 37.03 1rrm s ILE 177 CO -0.06 -0.97 -0.10 -0.62 -0.10 0.00 0.00 174.94 173.09 1rrm s ASP 178 N 2.12 4.36 0.65 3.58 -1.08 -1.26 -1.67 116.67 123.37 1rrm s ASP 178 Ca 0.15 -1.23 0.43 0.00 -0.52 0.00 0.00 52.55 51.37 1rrm s ASP 178 Cb -0.15 -1.58 2.25 0.00 -1.46 0.00 0.00 42.92 41.97 1rrm s ASP 178 CO -0.06 -0.17 2.31 0.00 0.52 0.00 0.00 175.17 177.77 1rrm h ALA 179 N 7.86 1.01 -0.13 3.66 0.00 -1.90 -3.47 119.26 126.29 1rrm h ALA 179 Ca -0.24 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.47 1rrm h ALA 179 Cb 1.06 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.88 1rrm h ALA 179 CO 0.51 0.00 0.57 -0.25 0.00 0.00 0.00 179.25 180.08 1rrm n ASP 180 N -3.10 1.64 0.00 0.00 8.00 -1.26 -4.86 116.55 116.98 1rrm n ASP 180 Ca -0.02 -2.54 0.00 0.00 0.71 0.00 0.00 54.79 52.94 1rrm n ASP 180 Cb 0.11 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 39.73 1rrm n ASP 180 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1rrm n ASP 183 N 16.37 0.00 -4.55 -2.24 8.00 -1.26 -5.12 116.55 127.75 1rrm n ASP 183 Ca 0.43 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.59 1rrm n ASP 183 Cb 0.46 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.52 1rrm n ASP 183 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1rrm s GLY 184 N -1.63 0.33 0.14 0.44 0.00 -1.26 -5.04 107.32 100.30 1rrm s GLY 184 Ca 0.00 -1.18 0.09 0.00 0.00 0.00 0.00 44.72 43.63 1rrm s GLY 184 CO 0.00 3.33 -0.15 -4.14 0.00 0.00 0.00 173.10 172.14 1rrm s PRO 186 N 6.77 1.88 0.30 2.90 0.02 -1.26 -5.12 135.00 140.48 1rrm s PRO 186 Ca 0.64 -1.21 0.06 0.00 0.02 0.00 0.00 61.00 60.51 1rrm s PRO 186 Cb -0.09 -2.13 0.79 0.00 0.02 0.00 0.00 34.50 33.09 1rrm s PRO 186 CO 0.09 0.47 1.70 -1.35 -0.33 0.00 0.00 177.00 177.57 1rrm h PRO 187 N 3.46 0.41 -0.17 5.54 0.11 -1.95 0.10 132.00 139.50 1rrm h PRO 187 Ca -0.49 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1rrm h PRO 187 Cb 1.18 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1rrm h PRO 187 CO 0.49 0.27 -0.10 0.00 -0.21 0.00 0.00 178.00 178.45 1rrm h ALA 188 N 1.73 1.51 -0.13 -0.75 0.00 -1.91 -0.63 119.26 119.07 1rrm h ALA 188 Ca 0.59 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 55.08 1rrm h ALA 188 Cb 1.14 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.85 1rrm h ALA 188 CO -0.53 0.35 -0.82 1.25 0.00 0.00 0.00 179.25 179.51 1rrm h LEU 189 N 0.26 0.92 -0.95 0.00 5.85 -1.27 -0.68 115.31 119.45 1rrm h LEU 189 Ca 0.05 -0.62 -0.02 0.00 0.84 0.00 0.00 57.88 58.13 1rrm h LEU 189 Cb 0.35 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1rrm h LEU 189 CO 0.02 1.42 0.42 0.11 -0.34 0.00 0.00 178.44 180.07 1rrm h LYS 190 N 0.51 1.17 0.16 1.25 1.57 -0.82 0.10 116.57 120.50 1rrm h LYS 190 Ca -0.06 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 1rrm h LYS 190 Cb 1.45 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1rrm h LYS 190 CO 0.17 0.88 -0.08 0.00 -0.57 0.00 0.00 179.45 179.85 1rrm h ALA 191 N 1.29 -0.21 -0.10 3.86 0.00 -0.95 -0.00 119.26 123.15 1rrm h ALA 191 Ca 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1rrm h ALA 191 Cb 0.08 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1rrm h ALA 191 CO -0.04 -0.51 0.04 0.00 0.00 0.00 0.00 179.25 178.74 1rrm h ALA 192 N 0.37 0.14 0.00 0.00 0.00 -0.89 -1.41 119.26 117.47 1rrm h ALA 192 Ca -0.02 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1rrm h ALA 192 Cb 0.34 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1rrm h ALA 192 CO 0.04 -0.29 -0.43 1.79 0.00 0.00 0.00 179.25 180.36 1rrm h THR 193 N 0.02 1.25 -0.28 0.00 1.35 -0.85 -1.77 112.91 112.63 1rrm h THR 193 Ca 0.04 -1.50 -0.15 0.00 -0.55 0.00 0.00 66.41 64.25 1rrm h THR 193 Cb 0.15 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 68.39 1rrm h THR 193 CO -0.00 0.42 -0.42 1.23 -0.25 0.00 0.00 175.52 176.50 1rrm h GLY 194 N 1.40 0.75 2.00 5.82 0.00 -0.77 -1.55 103.07 110.71 1rrm h GLY 194 Ca -0.00 -0.77 -0.10 0.00 0.00 0.00 0.00 47.33 46.45 1rrm h GLY 194 CO 0.06 0.70 -0.48 -2.08 0.00 0.00 0.00 176.54 174.73 1rrm h VAL 195 N 0.56 0.93 -0.35 4.60 2.07 -1.03 -1.26 116.25 121.78 1rrm h VAL 195 Ca 0.04 -2.00 -0.02 0.00 0.82 0.00 0.00 66.70 65.55 1rrm h VAL 195 Cb 0.96 2.24 -0.02 0.00 -1.52 0.00 0.00 31.29 32.95 1rrm h VAL 195 CO 0.09 0.47 0.14 -0.78 0.02 0.00 0.00 177.57 177.51 1rrm h ASP 196 N 0.00 0.48 -0.62 0.57 3.58 -1.02 0.95 116.42 120.37 1rrm h ASP 196 Ca -0.00 -0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 1rrm h ASP 196 Cb 1.20 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 42.09 1rrm h ASP 196 CO 0.06 0.52 0.30 0.00 -2.88 0.00 0.00 179.24 177.24 1rrm h ALA 197 N 0.99 0.80 -0.88 -0.78 0.00 -1.07 -0.61 119.26 117.70 1rrm h ALA 197 Ca 0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1rrm h ALA 197 Cb 0.18 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1rrm h ALA 197 CO -0.01 0.35 0.45 1.25 0.00 0.00 0.00 179.25 181.30 1rrm h LEU 198 N 0.85 1.13 -0.80 0.00 5.85 -0.90 -1.74 115.31 119.70 1rrm h LEU 198 Ca 0.21 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1rrm h LEU 198 Cb 0.11 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 1rrm h LEU 198 CO -0.03 0.93 0.41 0.74 -0.34 0.00 0.00 178.44 180.14 1rrm h THR 199 N 1.25 1.25 -0.39 1.05 2.02 -0.23 -0.06 112.91 117.79 1rrm h THR 199 Ca 0.31 -0.66 0.03 0.00 0.77 0.00 0.00 66.41 66.86 1rrm h THR 199 Cb 0.07 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 1rrm h THR 199 CO -0.04 0.29 0.19 0.45 0.37 0.00 0.00 175.52 176.78 1rrm h HIS 200 N 1.12 0.36 -0.30 3.16 3.86 -0.41 0.92 115.15 123.85 1rrm h HIS 200 Ca 0.28 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.44 1rrm h HIS 200 Cb 0.09 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 1rrm h HIS 200 CO 0.01 0.19 -0.04 0.00 0.86 0.00 0.00 177.93 178.94 1rrm h ALA 201 N 1.21 0.42 -0.05 2.45 0.00 -0.89 0.02 119.26 122.42 1rrm h ALA 201 Ca 0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1rrm h ALA 201 Cb 0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1rrm h ALA 201 CO -0.12 0.21 -0.03 0.82 0.00 0.00 0.00 179.25 180.13 1rrm h ILE 202 N 0.35 1.34 -0.65 0.00 2.04 -0.88 -0.38 117.51 119.33 1rrm h ILE 202 Ca 0.08 -1.08 -0.02 0.00 1.00 0.00 0.00 64.86 64.84 1rrm h ILE 202 Cb 0.51 1.97 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 1rrm h ILE 202 CO 0.02 0.29 0.34 -0.33 0.00 0.00 0.00 178.15 178.48 1rrm h GLU 203 N -0.30 0.91 -0.21 2.37 5.08 -0.86 -2.37 114.58 119.19 1rrm h GLU 203 Ca 0.01 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 1rrm h GLU 203 Cb 0.49 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1rrm h GLU 203 CO 0.01 0.70 -0.08 0.78 -1.00 0.00 0.00 179.01 179.42 1rrm h GLY 204 N 0.89 0.35 1.71 -3.84 0.00 -0.95 0.30 103.07 101.54 1rrm h GLY 204 Ca 0.23 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 1rrm h GLY 204 CO -0.03 0.20 -0.35 -1.82 0.00 0.00 0.00 176.54 174.53 1rrm h TYR 205 N 0.31 0.38 -0.14 5.60 3.20 -0.55 -3.23 116.97 122.54 1rrm h TYR 205 Ca 0.07 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1rrm h TYR 205 Cb 0.35 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.53 1rrm h TYR 205 CO 0.01 0.64 0.00 0.44 -1.64 0.00 0.00 178.16 177.61 1rrm n ILE 206 N -4.07 0.28 -1.31 1.81 -5.35 -1.02 -4.91 119.36 104.80 1rrm n ILE 206 Ca -0.01 -0.64 -0.34 0.00 -0.27 0.00 0.00 62.75 61.49 1rrm n ILE 206 Cb 0.45 1.07 0.11 0.00 -1.74 0.00 0.00 39.64 39.53 1rrm n ILE 206 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1rrm s THR 207 N -1.12 2.16 0.26 7.28 -1.32 0.07 -4.33 115.64 118.64 1rrm s THR 207 Ca 0.20 0.08 -0.01 0.00 -1.21 0.00 0.00 61.69 60.74 1rrm s THR 207 Cb 0.13 -2.61 0.25 0.00 -1.51 0.00 0.00 72.50 68.75 1rrm s THR 207 CO 0.18 -0.04 1.80 0.03 -2.21 0.00 0.00 174.62 174.37 1rrm h ARG 208 N -0.51 0.76 -0.04 7.08 3.08 -1.44 -2.19 114.38 121.12 1rrm h ARG 208 Ca -0.47 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.53 1rrm h ARG 208 Cb 1.30 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1rrm h ARG 208 CO 0.48 0.50 0.00 0.41 -1.07 0.00 0.00 179.97 180.29 1rrm n GLY 209 N -1.33 -0.71 3.67 0.04 0.00 -1.26 -4.94 105.19 100.67 1rrm n GLY 209 Ca 0.17 -0.18 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 1rrm n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rrm n ALA 210 N -0.52 1.01 -4.10 4.61 0.00 -0.83 -4.89 120.51 115.79 1rrm n ALA 210 Ca 0.14 0.38 -0.20 0.00 0.00 0.00 0.00 53.44 53.77 1rrm n ALA 210 Cb 0.12 -2.23 -0.06 0.00 0.00 0.00 0.00 19.45 17.28 1rrm n ALA 210 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1rrm n TRP 211 N 0.92 -0.82 -0.21 0.00 4.27 -1.26 -5.02 117.44 115.32 1rrm n TRP 211 Ca 0.08 -2.46 -0.07 0.00 -3.89 0.00 0.00 57.50 51.16 1rrm n TRP 211 Cb 0.34 0.30 -0.02 0.00 -1.36 0.00 0.00 31.31 30.57 1rrm n TRP 211 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1rrm h ALA 212 N 1.97 -0.20 -0.52 -1.67 0.00 -1.99 -0.32 119.26 116.53 1rrm h ALA 212 Ca -0.22 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1rrm h ALA 212 Cb 1.08 0.90 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 1rrm h ALA 212 CO 0.31 -0.76 0.17 1.25 0.00 0.00 0.00 179.25 180.22 1rrm h LEU 213 N -0.19 0.75 -0.76 0.00 5.85 -2.00 -2.24 115.31 116.71 1rrm h LEU 213 Ca 0.21 -0.20 -0.13 0.00 0.84 0.00 0.00 57.88 58.60 1rrm h LEU 213 Cb 0.56 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1rrm h LEU 213 CO -0.70 0.75 -0.61 0.71 -0.34 0.00 0.00 178.44 178.25 1rrm h THR 214 N 0.70 1.42 -0.71 1.05 1.35 -1.87 -2.62 112.91 112.25 1rrm h THR 214 Ca 0.17 -2.11 -0.07 0.00 -0.55 0.00 0.00 66.41 63.85 1rrm h THR 214 Cb 0.27 2.14 -0.03 0.00 -1.73 0.00 0.00 68.15 68.80 1rrm h THR 214 CO -0.01 0.60 0.16 0.44 -0.25 0.00 0.00 175.52 176.47 1rrm h ASP 215 N 0.00 1.07 -0.47 5.36 3.32 -0.87 0.63 116.42 125.46 1rrm h ASP 215 Ca -0.01 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 56.77 1rrm h ASP 215 Cb 1.09 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 1rrm h ASP 215 CO 0.08 1.03 0.13 0.00 -1.72 0.00 0.00 179.24 178.76 1rrm h ALA 216 N 1.10 0.62 -0.11 3.45 0.00 -1.22 -1.16 119.26 121.94 1rrm h ALA 216 Ca 0.22 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1rrm h ALA 216 Cb 0.38 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1rrm h ALA 216 CO 0.00 0.29 -0.03 -0.07 0.00 0.00 0.00 179.25 179.44 1rrm h LEU 217 N 0.63 0.22 -0.11 0.00 3.38 -1.25 -2.91 115.31 115.27 1rrm h LEU 217 Ca 0.15 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1rrm h LEU 217 Cb 0.29 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1rrm h LEU 217 CO -0.00 0.55 0.06 0.45 0.09 0.00 0.00 178.44 179.59 1rrm h HIS 218 N -0.10 0.16 -0.01 1.13 3.86 -0.82 -0.15 115.15 119.22 1rrm h HIS 218 Ca 0.03 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 1rrm h HIS 218 Cb 0.45 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1rrm h HIS 218 CO 0.05 0.18 -0.19 0.97 0.86 0.00 0.00 177.93 179.80 1rrm h ILE 219 N 0.09 1.14 -0.23 2.45 6.09 -1.29 0.06 117.51 125.81 1rrm h ILE 219 Ca 0.04 -0.66 -0.17 0.00 -1.37 0.00 0.00 64.86 62.69 1rrm h ILE 219 Cb 0.07 1.35 0.00 0.00 0.47 0.00 0.00 36.82 38.71 1rrm h ILE 219 CO -0.01 0.19 -0.54 0.50 -3.07 0.00 0.00 178.15 175.23 1rrm h LYS 220 N 0.01 0.77 -0.60 2.19 1.63 -1.28 -2.54 116.57 116.76 1rrm h LYS 220 Ca 0.00 -0.52 -0.01 0.00 -0.85 0.00 0.00 60.65 59.27 1rrm h LYS 220 Cb 0.34 0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 32.02 1rrm h LYS 220 CO 0.02 1.15 0.32 0.00 -3.45 0.00 0.00 179.45 177.49 1rrm h ALA 221 N 0.62 0.77 -0.37 5.00 0.00 -0.10 -0.98 119.26 124.20 1rrm h ALA 221 Ca -0.00 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1rrm h ALA 221 Cb 1.15 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1rrm h ALA 221 CO 0.12 0.29 0.20 0.82 0.00 0.00 0.00 179.25 180.68 1rrm h ILE 222 N 0.81 1.00 -0.26 0.00 2.04 -1.00 0.01 117.51 120.13 1rrm h ILE 222 Ca 0.21 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.95 1rrm h ILE 222 Cb 0.06 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 1rrm h ILE 222 CO -0.03 0.07 0.12 -0.08 0.00 0.00 0.00 178.15 178.23 1rrm h GLU 223 N 0.40 0.25 -0.02 2.37 4.81 -1.11 0.08 114.58 121.36 1rrm h GLU 223 Ca 0.15 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1rrm h GLU 223 Cb 0.04 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1rrm h GLU 223 CO -0.09 0.16 0.01 0.82 -0.73 0.00 0.00 179.01 179.18 1rrm h ILE 224 N 0.25 1.08 -0.03 2.32 2.04 -0.84 -2.23 117.51 120.10 1rrm h ILE 224 Ca 0.11 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1rrm h ILE 224 Cb 0.04 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1rrm h ILE 224 CO -0.08 0.06 0.01 0.40 0.00 0.00 0.00 178.15 178.54 1rrm h ILE 225 N -0.06 1.16 -0.10 -0.67 2.04 -0.89 -2.14 117.51 116.86 1rrm h ILE 225 Ca 0.01 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1rrm h ILE 225 Cb 0.09 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1rrm h ILE 225 CO -0.00 0.13 0.01 0.00 0.00 0.00 0.00 178.15 178.29 1rrm h ALA 226 N 0.81 1.83 0.00 1.87 0.00 -1.01 -0.70 119.26 122.06 1rrm h ALA 226 Ca 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1rrm h ALA 226 Cb 0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1rrm h ALA 226 CO -0.00 0.13 -0.42 0.78 0.00 0.00 0.00 179.25 179.75 1rrm h GLY 227 N 0.29 0.00 0.00 0.00 0.00 -1.22 -3.39 103.07 98.74 1rrm h GLY 227 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1rrm h GLY 227 CO 0.00 0.00 -1.27 0.00 0.00 0.00 0.00 176.54 175.27 1rrm n ALA 228 N -2.16 2.46 -0.08 3.60 0.00 -0.82 -4.77 120.51 118.73 1rrm n ALA 228 Ca 0.02 -0.22 -0.07 0.00 0.00 0.00 0.00 53.44 53.17 1rrm n ALA 228 Cb 0.60 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.74 1rrm n ALA 228 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rrm h LEU 229 N 0.00 -0.04 -0.41 0.00 5.85 -1.34 -0.73 115.31 118.64 1rrm h LEU 229 Ca 0.00 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.82 1rrm h LEU 229 Cb 0.38 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1rrm h LEU 229 CO 0.00 0.02 0.16 0.03 -0.34 0.00 0.00 178.44 178.31 1rrm h ARG 230 N 0.14 0.33 -0.61 1.25 3.08 -1.85 -0.22 114.38 116.51 1rrm h ARG 230 Ca 0.15 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.12 1rrm h ARG 230 Cb 0.17 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1rrm h ARG 230 CO -0.21 0.22 0.16 0.78 -1.07 0.00 0.00 179.97 179.85 1rrm h GLY 231 N 0.34 1.01 0.86 0.04 0.00 -1.77 -1.73 103.07 101.82 1rrm h GLY 231 Ca 0.19 -0.59 -0.06 0.00 0.00 0.00 0.00 47.33 46.87 1rrm h GLY 231 CO -0.17 0.55 -0.05 0.23 0.00 0.00 0.00 176.54 177.10 1rrm h SER 232 N 0.90 0.51 -0.43 0.19 0.87 -0.57 0.24 113.55 115.26 1rrm h SER 232 Ca 0.20 -0.36 0.02 0.00 -1.23 0.00 0.00 61.79 60.42 1rrm h SER 232 Cb 0.30 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 1rrm h SER 232 CO -0.00 0.74 0.29 0.58 -0.53 0.00 0.00 176.83 177.91 1rrm h VAL 233 N 0.26 1.07 0.00 2.23 2.07 -0.89 0.13 116.25 121.12 1rrm h VAL 233 Ca 0.07 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1rrm h VAL 233 Cb 0.52 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1rrm h VAL 233 CO 0.02 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.71 1rrm h ALA 234 N 1.74 1.00 0.00 1.67 0.00 -0.86 -3.43 119.26 119.38 1rrm h ALA 234 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1rrm h ALA 234 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1rrm h ALA 234 CO -0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.62 1rrm n GLY 235 N 0.44 0.89 3.70 0.00 0.00 0.44 -5.08 105.19 105.58 1rrm n GLY 235 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1rrm n GLY 235 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rrm s ASP 236 N -1.95 6.66 0.07 1.61 2.15 0.01 -4.93 116.67 120.28 1rrm s ASP 236 Ca 0.00 2.48 -0.21 0.00 0.43 0.00 0.00 52.55 55.24 1rrm s ASP 236 Cb 0.00 -2.58 -0.12 0.00 -0.30 0.00 0.00 42.92 39.92 1rrm s ASP 236 CO 0.00 -0.81 1.58 0.11 -0.17 0.00 0.00 175.17 175.88 1rrm h LYS 237 N 7.43 0.21 -0.54 4.34 1.57 -1.94 -2.44 116.57 125.20 1rrm h LYS 237 Ca -0.42 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.28 1rrm h LYS 237 Cb 1.20 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 1rrm h LYS 237 CO 0.91 0.34 0.19 -0.44 -0.57 0.00 0.00 179.45 179.89 1rrm h ASP 238 N 0.03 0.73 -0.25 0.86 3.32 -1.97 -1.79 116.42 117.34 1rrm h ASP 238 Ca 0.04 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 1rrm h ASP 238 Cb 0.22 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1rrm h ASP 238 CO -0.00 0.67 -0.00 0.00 -1.72 0.00 0.00 179.24 178.19 1rrm h ALA 239 N 1.43 1.32 -0.45 3.45 0.00 -1.86 -0.67 119.26 122.48 1rrm h ALA 239 Ca 0.18 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1rrm h ALA 239 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1rrm h ALA 239 CO -0.01 0.46 -0.14 0.78 0.00 0.00 0.00 179.25 180.34 1rrm h GLY 240 N 0.87 0.92 1.41 0.00 0.00 -0.85 -2.67 103.07 102.75 1rrm h GLY 240 Ca 0.11 -0.73 -0.12 0.00 0.00 0.00 0.00 47.33 46.59 1rrm h GLY 240 CO 0.01 0.67 -0.28 -2.09 0.00 0.00 0.00 176.54 174.85 1rrm h GLU 241 N 0.76 0.67 -1.26 4.80 4.81 -0.80 -1.55 114.58 122.01 1rrm h GLU 241 Ca 0.12 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1rrm h GLU 241 Cb 0.66 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1rrm h GLU 241 CO 0.05 0.88 0.00 0.39 -0.73 0.00 0.00 179.01 179.59 1rrm n GLU 242 N -4.09 0.29 0.00 1.92 1.02 -0.31 -2.54 120.64 116.93 1rrm n GLU 242 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1rrm n GLU 242 Cb 0.45 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.59 1rrm n GLU 242 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rrm n ALA 244 N 0.69 0.00 -0.03 0.62 0.00 -0.59 -0.85 120.51 120.35 1rrm n ALA 244 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1rrm n ALA 244 Cb 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.47 1rrm n ALA 244 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rrm h LEU 245 N 0.00 0.19 -0.66 0.00 5.85 -1.78 -3.24 115.31 115.68 1rrm h LEU 245 Ca 0.00 -0.70 0.08 0.00 0.84 0.00 0.00 57.88 58.10 1rrm h LEU 245 Cb 0.00 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 1rrm h LEU 245 CO 0.00 0.86 0.32 1.23 -0.34 0.00 0.00 178.44 180.51 1rrm h GLY 246 N -0.47 0.96 1.94 3.75 0.00 -1.28 -0.70 103.07 107.27 1rrm h GLY 246 Ca -0.02 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 1rrm h GLY 246 CO 0.03 0.07 -0.26 0.06 0.00 0.00 0.00 176.54 176.45 1rrm h GLN 247 N 0.57 0.08 -0.03 4.80 -0.00 -1.82 -2.05 115.11 116.65 1rrm h GLN 247 Ca 0.31 -0.02 -0.10 0.00 -0.00 0.00 0.00 58.65 58.84 1rrm h GLN 247 Cb 0.30 -0.01 0.01 0.00 -0.00 0.00 0.00 27.48 27.78 1rrm h GLN 247 CO -0.24 0.33 -0.37 -0.92 -0.00 0.00 0.00 178.83 177.63 1rrm h TYR 248 N 0.07 0.44 -0.82 0.06 3.20 -1.37 -2.99 116.97 115.56 1rrm h TYR 248 Ca 0.01 -0.22 0.05 0.00 3.14 0.00 0.00 58.73 61.72 1rrm h TYR 248 Cb 0.50 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.66 1rrm h TYR 248 CO 0.00 0.99 0.54 0.28 -1.64 0.00 0.00 178.16 178.33 1rrm h VAL 249 N -0.23 1.08 -0.59 1.81 2.07 -0.98 -0.27 116.25 119.14 1rrm h VAL 249 Ca -0.04 -0.32 0.03 0.00 0.82 0.00 0.00 66.70 67.18 1rrm h VAL 249 Cb 1.07 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1rrm h VAL 249 CO 0.08 0.17 0.36 0.00 0.02 0.00 0.00 177.57 178.20 1rrm h ALA 250 N 1.54 0.76 0.00 1.67 0.00 -1.37 -3.10 119.26 118.77 1rrm h ALA 250 Ca 0.34 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1rrm h ALA 250 Cb 0.15 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1rrm h ALA 250 CO -0.11 0.10 0.06 0.41 0.00 0.00 0.00 179.25 179.70 1rrm n GLY 251 N -1.26 1.03 0.00 0.00 0.00 -0.11 -1.71 105.19 103.14 1rrm n GLY 251 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rrm n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rrm n GLY 253 N 2.08 0.00 0.26 -0.02 0.00 -1.17 -2.31 105.19 104.03 1rrm n GLY 253 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 1rrm n GLY 253 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1rrm h PHE 254 N 0.00 0.00 -0.46 1.61 -5.15 -1.61 -1.30 116.94 110.03 1rrm h PHE 254 Ca 0.00 0.00 0.05 0.00 -0.20 0.00 0.00 57.97 57.82 1rrm h PHE 254 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.14 1rrm h PHE 254 CO 0.00 0.06 0.31 1.03 -2.00 0.00 0.00 178.31 177.71 1rrm h SER 255 N 0.00 0.39 0.23 -0.68 0.87 -1.71 0.18 113.55 112.83 1rrm h SER 255 Ca -0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1rrm h SER 255 Cb 0.11 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1rrm h SER 255 CO 0.01 0.26 -0.62 0.59 -0.53 0.00 0.00 176.83 176.53 1rrm n ASN 256 N -4.48 0.93 0.00 6.23 4.13 -0.50 -4.57 115.26 117.00 1rrm n ASN 256 Ca 0.06 -0.75 0.00 0.00 1.68 0.00 0.00 54.58 55.56 1rrm n ASN 256 Cb 0.20 0.51 0.00 0.00 -1.54 0.00 0.00 39.78 38.95 1rrm n ASN 256 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1rrm n VAL 257 N -1.19 0.00 0.00 2.41 0.24 -1.04 -4.85 118.33 113.90 1rrm n VAL 257 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 1rrm n VAL 257 Cb 0.35 -0.56 0.00 0.00 -1.47 0.00 0.00 33.84 32.16 1rrm n VAL 257 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rrm n GLY 258 N 2.02 0.35 0.00 7.63 0.00 0.60 -4.33 105.19 111.47 1rrm n GLY 258 Ca 0.00 -2.31 0.00 0.00 0.00 0.00 0.00 46.02 43.71 1rrm n GLY 258 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rrm n LEU 259 N 0.00 0.00 0.00 0.99 4.77 -1.26 -4.02 117.00 117.48 1rrm n LEU 259 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1rrm n LEU 259 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1rrm n LEU 259 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1rrm n GLY 260 N 4.20 2.21 0.24 -0.72 0.00 -1.21 -3.73 105.19 106.17 1rrm n GLY 260 Ca 0.00 -0.42 0.10 0.00 0.00 0.00 0.00 46.02 45.70 1rrm n GLY 260 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1rrm h LEU 261 N 0.00 0.00 0.33 0.99 5.85 -1.79 -2.22 115.31 118.47 1rrm h LEU 261 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1rrm h LEU 261 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1rrm h LEU 261 CO 0.00 0.20 -0.16 0.58 -0.34 0.00 0.00 178.44 178.72 1rrm h VAL 262 N 0.00 0.69 -0.23 1.05 2.07 -1.95 -2.80 116.25 115.08 1rrm h VAL 262 Ca -0.00 -0.11 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 1rrm h VAL 262 Cb 0.54 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1rrm h VAL 262 CO 0.03 0.02 -0.27 0.45 0.02 0.00 0.00 177.57 177.82 1rrm h HIS 263 N -0.50 0.50 0.00 1.57 3.86 -1.93 -0.04 115.15 118.60 1rrm h HIS 263 Ca -0.05 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.06 1rrm h HIS 263 Cb 0.38 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1rrm h HIS 263 CO -0.04 0.67 0.00 0.41 0.86 0.00 0.00 177.93 179.84 1rrm n GLY 264 N -0.36 0.18 1.48 2.45 0.00 -0.84 -1.62 105.19 106.46 1rrm n GLY 264 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1rrm n GLY 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rrm n ALA 266 N 0.41 0.00 -0.16 4.61 0.00 -0.03 -4.21 120.51 121.13 1rrm n ALA 266 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1rrm n ALA 266 Cb 0.03 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.51 1rrm n ALA 266 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rrm h HIS 267 N 0.00 0.58 -0.01 0.00 3.86 -1.57 -2.29 115.15 115.72 1rrm h HIS 267 Ca 0.00 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 1rrm h HIS 267 Cb 0.00 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.27 1rrm h HIS 267 CO 0.00 0.35 -0.11 -1.35 0.86 0.00 0.00 177.93 177.68 1rrm h PRO 268 N 0.63 0.02 -0.23 2.45 0.11 -1.86 -0.98 132.00 132.13 1rrm h PRO 268 Ca 0.19 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.18 1rrm h PRO 268 Cb -0.03 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 1rrm h PRO 268 CO -0.06 0.13 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.45 1rrm h LEU 269 N 0.02 0.52 -0.64 2.35 3.38 -1.80 0.58 115.31 119.72 1rrm h LEU 269 Ca 0.00 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.63 1rrm h LEU 269 Cb 0.21 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1rrm h LEU 269 CO 0.02 0.83 -0.38 1.23 0.09 0.00 0.00 178.44 180.22 1rrm h GLY 270 N 1.07 0.70 0.99 0.83 0.00 -0.74 -0.66 103.07 105.26 1rrm h GLY 270 Ca 0.05 -0.68 -0.18 0.00 0.00 0.00 0.00 47.33 46.51 1rrm h GLY 270 CO 0.07 0.62 -0.66 0.00 0.00 0.00 0.00 176.54 176.57 1rrm h ALA 271 N 1.05 0.21 -0.06 3.60 0.00 -1.07 -0.02 119.26 122.97 1rrm h ALA 271 Ca 0.05 -0.56 -0.19 0.00 0.00 0.00 0.00 54.91 54.20 1rrm h ALA 271 Cb 0.89 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1rrm h ALA 271 CO 0.08 0.50 -0.72 0.74 0.00 0.00 0.00 179.25 179.85 1rrm h PHE 272 N 0.26 0.85 0.00 0.00 -1.00 -0.88 -3.40 116.94 112.76 1rrm h PHE 272 Ca -0.05 -0.41 0.00 0.00 2.81 0.00 0.00 57.97 60.31 1rrm h PHE 272 Cb 1.30 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 40.75 1rrm h PHE 272 CO 0.11 1.23 0.00 0.66 -1.61 0.00 0.00 178.31 178.70 1rrm n TYR 273 N -4.08 0.00 -2.96 -0.55 4.01 -0.26 -4.99 117.16 108.33 1rrm n TYR 273 Ca -0.09 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.43 1rrm n TYR 273 Cb 0.72 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.78 1rrm n TYR 273 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1rrm n ASN 274 N -0.01 -6.00 -4.75 7.72 5.15 -0.02 -4.93 115.26 112.42 1rrm n ASN 274 Ca 0.00 -0.27 -0.41 0.00 -0.60 0.00 0.00 54.58 53.30 1rrm n ASN 274 Cb 0.03 -4.82 -0.03 0.00 -0.53 0.00 0.00 39.78 34.43 1rrm n ASN 274 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1rrm s THR 275 N -3.16 2.97 0.24 -0.44 2.01 -1.19 -4.93 115.64 111.14 1rrm s THR 275 Ca 0.28 0.86 -0.31 0.00 0.31 0.00 0.00 61.69 62.83 1rrm s THR 275 Cb -0.12 -3.55 -0.12 0.00 0.01 0.00 0.00 72.50 68.71 1rrm s THR 275 CO 0.35 0.16 1.61 -2.65 -0.69 0.00 0.00 174.62 173.39 1rrm n PRO 276 N 1.97 2.54 -0.16 4.92 -0.02 -1.26 -4.41 135.00 138.59 1rrm n PRO 276 Ca 0.04 0.91 -0.04 0.00 -2.02 0.00 0.00 63.50 62.39 1rrm n PRO 276 Cb 0.42 -2.69 0.02 0.00 -0.02 0.00 0.00 33.50 31.23 1rrm n PRO 276 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1rrm h HIS 277 N 5.53 -0.50 -0.61 6.00 2.76 -1.94 -2.06 115.15 124.32 1rrm h HIS 277 Ca -0.45 0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 57.75 1rrm h HIS 277 Cb 1.23 0.30 -0.03 0.00 1.55 0.00 0.00 27.41 30.46 1rrm h HIS 277 CO 0.60 -0.29 0.31 0.78 -1.30 0.00 0.00 177.93 178.04 1rrm h GLY 278 N -0.09 0.91 0.91 5.26 0.00 -1.90 -1.41 103.07 106.75 1rrm h GLY 278 Ca 0.23 -0.41 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 1rrm h GLY 278 CO -0.55 0.40 -0.03 -2.08 0.00 0.00 0.00 176.54 174.28 1rrm h VAL 279 N 0.86 1.27 0.12 4.60 2.07 -1.63 -0.63 116.25 122.90 1rrm h VAL 279 Ca 0.22 -1.03 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 1rrm h VAL 279 Cb 0.06 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1rrm h VAL 279 CO -0.03 0.34 -0.07 0.00 0.02 0.00 0.00 177.57 177.82 1rrm h ALA 280 N 0.84 -0.18 -0.47 1.67 0.00 -1.09 -2.05 119.26 117.98 1rrm h ALA 280 Ca 0.09 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1rrm h ALA 280 Cb 0.50 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1rrm h ALA 280 CO 0.02 -0.61 0.24 -0.91 0.00 0.00 0.00 179.25 178.00 1rrm h ASN 281 N -0.19 0.36 -0.48 0.00 2.35 -1.22 -2.03 115.58 114.37 1rrm h ASN 281 Ca -0.01 0.02 0.07 0.00 -0.55 0.00 0.00 56.30 55.83 1rrm h ASN 281 Cb 0.16 -0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.42 1rrm h ASN 281 CO 0.01 0.26 0.13 0.00 -1.65 0.00 0.00 177.43 176.17 1rrm h ALA 282 N 1.24 0.56 -0.53 -0.83 0.00 -0.81 0.43 119.26 119.31 1rrm h ALA 282 Ca 0.20 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 1rrm h ALA 282 Cb 0.09 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1rrm h ALA 282 CO -0.13 -0.28 -0.14 0.82 0.00 0.00 0.00 179.25 179.52 1rrm h ILE 283 N 0.27 1.27 0.02 0.00 2.04 -1.17 -3.29 117.51 116.65 1rrm h ILE 283 Ca 0.24 -1.30 -0.27 0.00 1.00 0.00 0.00 64.86 64.52 1rrm h ILE 283 Cb 0.29 1.00 0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1rrm h ILE 283 CO -0.28 0.46 -1.08 -0.07 0.00 0.00 0.00 178.15 177.18 1rrm h LEU 284 N 0.91 0.92 -0.84 1.44 3.38 -0.90 -3.40 115.31 116.82 1rrm h LEU 284 Ca 0.13 -0.75 0.08 0.00 0.09 0.00 0.00 57.88 57.43 1rrm h LEU 284 Cb 0.71 -0.28 -0.10 0.00 0.09 0.00 0.00 40.66 41.08 1rrm h LEU 284 CO 0.05 1.55 -0.49 -0.11 0.09 0.00 0.00 178.44 179.53 1rrm n LEU 285 N -3.85 -0.89 -0.20 1.67 7.94 0.15 -1.39 117.00 120.44 1rrm n LEU 285 Ca -0.11 1.56 0.03 0.00 -1.11 0.00 0.00 56.01 56.37 1rrm n LEU 285 Cb 0.90 -0.23 0.29 0.00 0.53 0.00 0.00 43.42 44.92 1rrm n LEU 285 CO 0.56 -1.25 1.23 1.55 -1.11 0.00 0.00 177.39 178.37 1rrm h PRO 286 N 0.00 0.87 -0.28 1.96 0.13 -1.78 -2.79 132.00 130.12 1rrm h PRO 286 Ca 0.13 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 65.09 1rrm h PRO 286 Cb 0.34 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 31.27 1rrm h PRO 286 CO -0.79 0.58 -0.30 0.45 -0.23 0.00 0.00 178.00 177.71 1rrm h HIS 287 N 0.90 0.84 0.00 1.56 3.86 -1.50 -2.19 115.15 118.62 1rrm h HIS 287 Ca 0.29 -0.26 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1rrm h HIS 287 Cb 0.04 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.34 1rrm h HIS 287 CO -0.00 1.01 0.00 0.28 0.86 0.00 0.00 177.93 180.08 1rrm n VAL 288 N -4.26 0.51 0.00 2.45 0.31 -0.48 -1.88 118.33 114.97 1rrm n VAL 288 Ca -0.04 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1rrm n VAL 288 Cb 0.48 -0.84 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 1rrm n VAL 288 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1rrm n ARG 290 N 1.09 0.00 -0.26 5.55 0.63 -0.83 -0.81 116.66 122.04 1rrm n ARG 290 Ca 0.00 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.87 1rrm n ARG 290 Cb 0.20 0.00 0.05 0.00 0.45 0.00 0.00 32.46 33.16 1rrm n ARG 290 CO 0.00 0.00 0.00 -0.92 -2.51 0.00 0.00 177.63 174.20 1rrm h TYR 291 N 0.00 0.98 0.00 -0.14 3.20 -1.66 -2.97 116.97 116.39 1rrm h TYR 291 Ca 0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1rrm h TYR 291 Cb 0.00 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 37.95 1rrm h TYR 291 CO 0.00 0.69 -0.27 -0.91 -1.64 0.00 0.00 178.16 176.03 1rrm h ASN 292 N 0.99 0.00 -0.45 -2.11 2.35 -1.26 -3.42 115.58 111.68 1rrm h ASN 292 Ca 0.25 -0.09 0.04 0.00 -0.55 0.00 0.00 56.30 55.96 1rrm h ASN 292 Cb 0.03 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 1rrm h ASN 292 CO -0.04 0.04 -0.26 0.00 -1.65 0.00 0.00 177.43 175.52 1rrm n ALA 293 N -1.82 -0.27 0.75 -0.83 0.00 -1.12 -0.46 120.51 116.75 1rrm n ALA 293 Ca 0.04 0.39 0.05 0.00 0.00 0.00 0.00 53.44 53.93 1rrm n ALA 293 Cb 0.44 -0.07 0.32 0.00 0.00 0.00 0.00 19.45 20.14 1rrm n ALA 293 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1rrm n ASP 294 N -4.57 0.00 -1.22 0.00 8.00 -1.26 -2.67 116.55 114.83 1rrm n ASP 294 Ca 0.01 -0.42 0.01 0.00 0.71 0.00 0.00 54.79 55.10 1rrm n ASP 294 Cb 0.12 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.34 1rrm n ASP 294 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1rrm n PHE 295 N -0.95 0.51 -0.57 1.24 3.72 0.40 -4.68 117.46 117.12 1rrm n PHE 295 Ca 0.08 -1.40 0.02 0.00 -0.05 0.00 0.00 57.45 56.10 1rrm n PHE 295 Cb 0.04 -0.24 0.02 0.00 -0.94 0.00 0.00 39.48 38.36 1rrm n PHE 295 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1rrm n THR 296 N -0.60 0.83 0.00 4.37 -2.24 -1.09 -4.86 114.28 110.69 1rrm n THR 296 Ca 0.18 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 1rrm n THR 296 Cb 0.86 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 1rrm n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rrm n GLY 297 N -0.50 3.41 0.96 3.38 0.00 -1.26 -1.23 105.19 109.95 1rrm n GLY 297 Ca 0.03 0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1rrm n GLY 297 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rrm n GLU 298 N 14.00 2.31 -0.07 1.61 -0.58 -1.26 -4.61 120.64 132.03 1rrm n GLU 298 Ca 0.00 -1.91 0.11 0.00 -0.42 0.00 0.00 57.16 54.94 1rrm n GLU 298 Cb 0.00 -1.47 0.49 0.00 -0.57 0.00 0.00 31.44 29.89 1rrm n GLU 298 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1rrm h LYS 299 N 4.45 0.42 0.00 3.49 1.57 -1.59 -0.93 116.57 123.97 1rrm h LYS 299 Ca 0.00 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1rrm h LYS 299 Cb 0.95 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.16 1rrm h LYS 299 CO 0.00 0.28 -0.10 1.88 -0.57 0.00 0.00 179.45 180.94 1rrm h TYR 300 N 0.43 0.00 -0.36 -1.35 -1.99 -1.82 -1.18 116.97 110.70 1rrm h TYR 300 Ca 0.26 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.84 1rrm h TYR 300 Cb 0.47 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.19 1rrm h TYR 300 CO -0.00 0.10 -0.37 -0.09 -0.00 0.00 0.00 178.16 177.80 1rrm h ARG 301 N 0.00 0.86 -0.32 4.88 2.43 -1.42 -0.68 114.38 120.13 1rrm h ARG 301 Ca -0.00 -0.44 -0.09 0.00 -0.81 0.00 0.00 59.98 58.64 1rrm h ARG 301 Cb 0.46 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1rrm h ARG 301 CO 0.01 1.08 -0.13 -0.44 -1.51 0.00 0.00 179.97 178.98 1rrm h ASP 302 N 0.71 0.68 0.03 -3.80 3.32 -1.25 -1.95 116.42 114.16 1rrm h ASP 302 Ca 0.06 -0.40 -0.00 0.00 0.02 0.00 0.00 57.03 56.72 1rrm h ASP 302 Cb 0.94 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1rrm h ASP 302 CO 0.09 0.92 -0.02 0.40 -1.72 0.00 0.00 179.24 178.92 1rrm h ILE 303 N 0.43 1.01 -0.67 0.35 2.04 -1.16 -1.84 117.51 117.68 1rrm h ILE 303 Ca 0.08 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 65.86 1rrm h ILE 303 Cb 0.66 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 1rrm h ILE 303 CO 0.04 0.04 0.37 0.00 0.00 0.00 0.00 178.15 178.60 1rrm h ALA 304 N 0.86 0.90 0.08 1.87 0.00 -1.10 -2.85 119.26 119.02 1rrm h ALA 304 Ca -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1rrm h ALA 304 Cb 0.09 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1rrm h ALA 304 CO 0.01 0.04 -0.05 -0.09 0.00 0.00 0.00 179.25 179.15 1rrm h ARG 305 N 0.67 -0.13 -2.66 0.00 2.43 -1.07 -0.85 114.38 112.78 1rrm h ARG 305 Ca 0.30 0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.33 1rrm h ARG 305 Cb 0.21 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1rrm h ARG 305 CO -0.19 -0.08 0.50 1.33 -1.51 0.00 0.00 179.97 180.02 1rrm n VAL 306 N -5.16 1.74 0.39 0.20 0.24 -0.72 -3.83 118.33 111.19 1rrm n VAL 306 Ca -0.07 -0.91 0.04 0.00 -2.04 0.00 0.00 64.34 61.36 1rrm n VAL 306 Cb 0.09 -1.83 0.01 0.00 -1.47 0.00 0.00 33.84 30.64 1rrm n VAL 306 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rrm n GLY 308 N 2.93 -0.27 3.71 7.63 0.00 -1.19 -4.53 105.19 113.47 1rrm n GLY 308 Ca 0.27 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1rrm n GLY 308 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rrm s VAL 309 N -1.12 4.91 -0.95 1.61 1.01 -0.33 -4.98 120.40 120.55 1rrm s VAL 309 Ca 0.08 1.86 -0.22 0.00 0.00 0.00 0.00 61.98 63.70 1rrm s VAL 309 Cb 0.07 -4.23 0.08 0.00 0.00 0.00 0.00 36.38 32.30 1rrm s VAL 309 CO 0.19 0.15 1.31 -0.54 0.00 0.00 0.00 175.10 176.22 1rrm s LYS 310 N 1.19 3.54 0.00 2.72 -0.14 -1.26 -3.97 119.74 121.82 1rrm s LYS 310 Ca 0.46 -1.25 0.25 0.00 -1.36 0.00 0.00 55.97 54.07 1rrm s LYS 310 Cb -0.19 -5.09 1.47 0.00 -1.68 0.00 0.00 37.83 32.34 1rrm s LYS 310 CO 0.23 -2.05 1.94 1.33 -0.76 0.00 0.00 175.35 176.03 1rrm n VAL 311 N 6.37 0.00 -0.09 3.17 0.24 -1.26 -4.56 118.33 122.19 1rrm n VAL 311 Ca 0.26 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.56 1rrm n VAL 311 Cb 0.50 -0.40 0.02 0.00 -1.47 0.00 0.00 33.84 32.48 1rrm n VAL 311 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1rrm n GLU 312 N -0.89 -0.05 -3.44 7.34 1.02 -1.26 -4.87 120.64 118.49 1rrm n GLU 312 Ca 0.18 0.38 -0.26 0.00 -0.02 0.00 0.00 57.16 57.44 1rrm n GLU 312 Cb 0.08 -0.56 -0.08 0.00 -0.02 0.00 0.00 31.44 30.86 1rrm n GLU 312 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rrm n GLY 313 N -1.12 4.12 3.71 0.62 0.00 -1.26 -5.24 105.19 106.02 1rrm n GLY 313 Ca 0.03 -2.40 -0.28 0.00 0.00 0.00 0.00 46.02 43.37 1rrm n GLY 313 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rrm s SER 315 N -1.91 4.15 0.21 1.61 1.04 -1.26 -5.15 113.70 112.39 1rrm s SER 315 Ca 0.36 -1.35 -0.10 0.00 0.48 0.00 0.00 55.95 55.35 1rrm s SER 315 Cb 0.12 -0.14 0.18 0.00 0.10 0.00 0.00 66.02 66.28 1rrm s SER 315 CO -0.07 -0.62 1.88 0.25 0.98 0.00 0.00 173.24 175.66 1rrm h LEU 316 N 1.50 0.87 -0.85 2.42 5.85 -1.99 0.27 115.31 123.37 1rrm h LEU 316 Ca -0.43 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1rrm h LEU 316 Cb 1.27 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 1rrm h LEU 316 CO 0.75 0.62 0.54 -0.08 -0.34 0.00 0.00 178.44 179.92 1rrm h GLU 317 N 1.02 1.14 -0.17 1.25 4.81 -1.99 0.89 114.58 121.54 1rrm h GLU 317 Ca 0.29 -0.09 -0.20 0.00 -0.13 0.00 0.00 59.36 59.24 1rrm h GLU 317 Cb -0.09 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.05 1rrm h GLU 317 CO -0.07 0.78 -0.68 0.93 -0.73 0.00 0.00 179.01 179.24 1rrm h GLU 318 N 1.16 0.68 -0.73 1.92 5.08 -1.84 -2.32 114.58 118.53 1rrm h GLU 318 Ca 0.31 -0.50 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1rrm h GLU 318 Cb -0.09 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1rrm h GLU 318 CO -0.06 1.12 0.32 0.00 -1.00 0.00 0.00 179.01 179.39 1rrm h ALA 319 N 0.75 0.95 -0.64 3.43 0.00 -0.06 0.65 119.26 124.34 1rrm h ALA 319 Ca -0.02 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 1rrm h ALA 319 Cb 1.27 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1rrm h ALA 319 CO 0.13 0.54 0.09 0.00 0.00 0.00 0.00 179.25 180.02 1rrm h ARG 320 N 1.04 1.06 -0.43 0.00 3.08 -0.77 -1.13 114.38 117.22 1rrm h ARG 320 Ca 0.25 -0.28 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 1rrm h ARG 320 Cb 0.17 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1rrm h ARG 320 CO -0.03 0.98 -0.20 -0.91 -1.07 0.00 0.00 179.97 178.74 1rrm h ASN 321 N 0.99 0.86 -0.70 7.04 2.35 -0.96 -2.80 115.58 122.36 1rrm h ASN 321 Ca 0.19 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 1rrm h ASN 321 Cb 0.44 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1rrm h ASN 321 CO 0.01 1.04 0.34 0.00 -1.65 0.00 0.00 177.43 177.18 1rrm h ALA 322 N 1.02 0.90 -0.30 -0.83 0.00 -0.48 -1.10 119.26 118.49 1rrm h ALA 322 Ca 0.10 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1rrm h ALA 322 Cb 0.73 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1rrm h ALA 322 CO 0.06 0.46 0.17 0.00 0.00 0.00 0.00 179.25 179.94 1rrm h ALA 323 N 1.16 0.38 -0.49 0.00 0.00 -1.09 -0.47 119.26 118.76 1rrm h ALA 323 Ca 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1rrm h ALA 323 Cb 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1rrm h ALA 323 CO -0.03 -0.11 0.27 0.28 0.00 0.00 0.00 179.25 179.66 1rrm h VAL 324 N 0.37 1.17 -0.49 0.00 2.07 -1.26 -2.67 116.25 115.44 1rrm h VAL 324 Ca 0.11 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 1rrm h VAL 324 Cb 0.03 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1rrm h VAL 324 CO -0.02 0.18 0.06 -0.08 0.02 0.00 0.00 177.57 177.73 1rrm h GLU 325 N 0.65 0.78 -0.60 1.57 4.57 -1.00 -1.71 114.58 118.82 1rrm h GLU 325 Ca 0.17 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1rrm h GLU 325 Cb 0.04 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 1rrm h GLU 325 CO -0.03 0.74 0.40 0.00 -1.18 0.00 0.00 179.01 178.95 1rrm h ALA 326 N 1.33 1.57 -0.12 2.92 0.00 -0.76 0.21 119.26 124.42 1rrm h ALA 326 Ca 0.16 -0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.83 1rrm h ALA 326 Cb 0.36 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1rrm h ALA 326 CO 0.01 0.40 -0.70 0.28 0.00 0.00 0.00 179.25 179.24 1rrm h VAL 327 N 0.82 1.31 -0.66 0.00 2.07 -1.11 -1.18 116.25 117.50 1rrm h VAL 327 Ca 0.22 -1.95 0.01 0.00 0.82 0.00 0.00 66.70 65.80 1rrm h VAL 327 Cb -0.10 2.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1rrm h VAL 327 CO -0.05 0.60 0.43 -0.26 0.02 0.00 0.00 177.57 178.32 1rrm h PHE 328 N 0.36 0.82 -0.29 1.57 0.05 -0.60 -1.55 116.94 117.29 1rrm h PHE 328 Ca -0.05 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.74 1rrm h PHE 328 Cb 1.34 -0.28 -0.01 0.00 2.00 0.00 0.00 35.95 39.00 1rrm h PHE 328 CO 0.10 0.51 0.13 0.00 -0.18 0.00 0.00 178.31 178.87 1rrm h ALA 329 N 1.25 0.37 -0.30 2.45 0.00 -0.54 -2.10 119.26 120.39 1rrm h ALA 329 Ca 0.24 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1rrm h ALA 329 Cb -0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1rrm h ALA 329 CO -0.06 -0.06 0.18 1.25 0.00 0.00 0.00 179.25 180.56 1rrm h LEU 330 N 0.32 0.29 -1.17 0.00 5.85 -0.95 0.11 115.31 119.76 1rrm h LEU 330 Ca 0.10 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1rrm h LEU 330 Cb 0.14 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 1rrm h LEU 330 CO -0.01 0.21 0.57 0.78 -0.34 0.00 0.00 178.44 179.66 1rrm h ASN 331 N 0.37 0.89 -0.30 1.25 2.35 -1.15 -0.62 115.58 118.36 1rrm h ASN 331 Ca 0.12 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.77 1rrm h ASN 331 Cb -0.01 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 1rrm h ASN 331 CO -0.05 0.58 -0.21 0.03 -1.65 0.00 0.00 177.43 176.13 1rrm h ARG 332 N 1.01 0.67 -0.09 0.81 3.08 -0.74 -1.74 114.38 117.38 1rrm h ARG 332 Ca 0.37 -0.32 -0.04 0.00 0.07 0.00 0.00 59.98 60.07 1rrm h ARG 332 Cb 0.17 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1rrm h ARG 332 CO -0.13 0.92 -0.12 -0.44 -1.07 0.00 0.00 179.97 179.13 1rrm h ASP 333 N 0.42 0.12 -0.72 7.04 3.32 0.26 -2.52 116.42 124.34 1rrm h ASP 333 Ca 0.06 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1rrm h ASP 333 Cb 0.76 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1rrm h ASP 333 CO 0.06 0.26 0.00 1.33 -1.72 0.00 0.00 179.24 179.17 1rrm n VAL 334 N -4.33 1.19 -2.21 -1.35 0.24 -0.34 -4.98 118.33 106.54 1rrm n VAL 334 Ca -0.01 -1.03 -0.09 0.00 -2.04 0.00 0.00 64.34 61.16 1rrm n VAL 334 Cb 0.23 0.40 -0.00 0.00 -1.47 0.00 0.00 33.84 33.00 1rrm n VAL 334 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rrm n GLY 335 N 1.55 -0.00 3.79 7.63 0.00 -0.95 -4.84 105.19 112.36 1rrm n GLY 335 Ca 0.25 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 1rrm n GLY 335 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rrm s ILE 336 N -2.49 5.02 0.36 -0.61 1.01 -0.68 -5.03 121.20 118.77 1rrm s ILE 336 Ca 0.01 0.97 -0.27 0.00 0.00 0.00 0.00 60.65 61.36 1rrm s ILE 336 Cb -0.00 -3.79 -0.12 0.00 0.01 0.00 0.00 42.46 38.55 1rrm s ILE 336 CO 0.01 0.48 1.27 -2.65 0.00 0.00 0.00 174.94 174.05 1rrm n PRO 337 N 2.47 2.04 0.13 2.79 -0.02 -1.26 -4.62 135.00 136.53 1rrm n PRO 337 Ca -0.11 0.72 0.12 0.00 -2.02 0.00 0.00 63.50 62.21 1rrm n PRO 337 Cb 0.52 -2.31 0.17 0.00 -0.02 0.00 0.00 33.50 31.85 1rrm n PRO 337 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1rrm h PRO 338 N 2.41 0.00 -6.46 0.52 0.13 -1.96 -3.43 132.00 123.21 1rrm h PRO 338 Ca -0.46 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.01 1rrm h PRO 338 Cb 1.29 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.14 1rrm h PRO 338 CO 0.62 0.00 -0.87 -1.01 -0.23 0.00 0.00 178.00 176.51 1rrm s HIS 339 N -3.22 2.15 0.51 1.56 3.76 -1.26 -4.83 115.29 113.97 1rrm s HIS 339 Ca 0.05 -0.40 0.17 0.00 -0.15 0.00 0.00 55.06 54.73 1rrm s HIS 339 Cb 0.09 -1.33 1.28 0.00 1.11 0.00 0.00 32.58 33.73 1rrm s HIS 339 CO 0.70 0.05 2.14 -0.07 -0.85 0.00 0.00 174.74 176.70 1rrm h LEU 340 N 5.15 0.00 -1.58 0.89 3.38 -0.95 -0.34 115.31 121.86 1rrm h LEU 340 Ca -0.44 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 1rrm h LEU 340 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1rrm h LEU 340 CO 0.45 0.03 -0.21 -0.09 0.09 0.00 0.00 178.44 178.71 1rrm h ARG 341 N 0.00 0.01 0.00 1.13 2.43 -1.63 -2.22 114.38 114.10 1rrm h ARG 341 Ca -0.00 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1rrm h ARG 341 Cb 0.05 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1rrm h ARG 341 CO 0.00 0.22 -0.17 -0.44 -1.51 0.00 0.00 179.97 178.07 1rrm h ASP 342 N 0.01 0.00 -0.49 -3.80 3.32 -1.31 -3.16 116.42 110.99 1rrm h ASP 342 Ca -0.00 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 1rrm h ASP 342 Cb 0.37 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.83 1rrm h ASP 342 CO 0.03 0.17 0.11 1.33 -1.72 0.00 0.00 179.24 179.15 1rrm n VAL 343 N -3.73 2.63 -0.56 -1.35 0.24 -0.85 -4.97 118.33 109.75 1rrm n VAL 343 Ca -0.02 -2.06 0.00 0.00 -2.04 0.00 0.00 64.34 60.22 1rrm n VAL 343 Cb 0.28 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 1rrm n VAL 343 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rrm n GLY 344 N -0.62 0.66 3.88 7.63 0.00 -1.19 -4.95 105.19 110.59 1rrm n GLY 344 Ca 0.34 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 1rrm n GLY 344 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rrm s VAL 345 N -2.00 4.82 -0.09 1.61 1.01 -1.14 -4.97 120.40 119.64 1rrm s VAL 345 Ca 0.00 0.55 0.04 0.00 0.00 0.00 0.00 61.98 62.57 1rrm s VAL 345 Cb 0.00 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 1rrm s VAL 345 CO 0.00 -0.44 -0.24 -0.13 0.00 0.00 0.00 175.10 174.30 1rrm s ARG 346 N -3.68 2.89 0.46 2.72 0.52 -1.26 -4.71 118.95 115.89 1rrm s ARG 346 Ca 0.50 -0.86 0.14 0.00 -0.52 0.00 0.00 55.73 54.99 1rrm s ARG 346 Cb -0.10 -2.23 1.10 0.00 0.52 0.00 0.00 34.95 34.24 1rrm s ARG 346 CO 0.29 0.21 2.05 0.87 0.02 0.00 0.00 175.30 178.75 1rrm h LYS 347 N 6.61 0.27 0.00 3.54 1.57 -2.00 -1.39 116.57 125.16 1rrm h LYS 347 Ca -0.22 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1rrm h LYS 347 Cb 1.23 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.47 1rrm h LYS 347 CO 0.47 0.18 -0.03 0.93 -0.57 0.00 0.00 179.45 180.43 1rrm h GLU 348 N 0.28 0.00 -0.00 3.15 3.07 -2.05 -1.95 114.58 117.08 1rrm h GLU 348 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 1rrm h GLU 348 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1rrm h GLU 348 CO -0.03 0.03 -0.39 -0.25 -1.40 0.00 0.00 179.01 176.97 1rrm n ASP 349 N -3.39 0.44 -0.21 1.42 8.00 -0.53 -4.41 116.55 117.88 1rrm n ASP 349 Ca -0.02 -0.16 0.01 0.00 0.71 0.00 0.00 54.79 55.33 1rrm n ASP 349 Cb 0.15 0.10 0.12 0.00 -0.02 0.00 0.00 41.12 41.47 1rrm n ASP 349 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1rrm h ILE 350 N 0.08 0.58 -0.95 0.53 2.04 -1.41 0.10 117.51 118.49 1rrm h ILE 350 Ca 0.00 -0.08 0.05 0.00 1.00 0.00 0.00 64.86 65.83 1rrm h ILE 350 Cb 0.50 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 1rrm h ILE 350 CO 0.00 0.04 0.61 -0.65 0.00 0.00 0.00 178.15 178.15 1rrm h PRO 351 N 0.22 1.11 -0.30 2.37 0.11 -1.80 0.29 132.00 134.00 1rrm h PRO 351 Ca 0.33 -0.07 -0.16 0.00 0.11 0.00 0.00 66.00 66.22 1rrm h PRO 351 Cb 0.52 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 1rrm h PRO 351 CO -0.45 0.74 -0.42 0.00 -0.21 0.00 0.00 178.00 177.66 1rrm h ALA 352 N 1.41 0.45 -0.63 -0.75 0.00 -1.62 -2.42 119.26 115.70 1rrm h ALA 352 Ca 0.39 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1rrm h ALA 352 Cb 0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1rrm h ALA 352 CO -0.15 0.57 0.26 -0.07 0.00 0.00 0.00 179.25 179.87 1rrm h LEU 353 N 0.57 0.87 -0.81 0.00 3.38 -0.29 -1.72 115.31 117.33 1rrm h LEU 353 Ca 0.03 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1rrm h LEU 353 Cb 1.02 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 1rrm h LEU 353 CO 0.10 0.80 0.39 0.00 0.09 0.00 0.00 178.44 179.82 1rrm h ALA 354 N 1.11 1.04 -0.52 1.53 0.00 -0.39 0.31 119.26 122.34 1rrm h ALA 354 Ca 0.21 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1rrm h ALA 354 Cb 0.20 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1rrm h ALA 354 CO -0.02 0.60 -0.05 0.37 0.00 0.00 0.00 179.25 180.15 1rrm h GLN 355 N 1.14 0.95 -0.61 0.00 5.75 -1.20 -0.23 115.11 120.90 1rrm h GLN 355 Ca 0.28 -0.33 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1rrm h GLN 355 Cb 0.12 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.57 1rrm h GLN 355 CO -0.04 0.99 0.26 0.00 -2.65 0.00 0.00 178.83 177.40 1rrm h ALA 356 N 0.92 0.79 -0.57 3.38 0.00 -0.95 -2.14 119.26 120.70 1rrm h ALA 356 Ca 0.14 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1rrm h ALA 356 Cb 0.60 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1rrm h ALA 356 CO 0.04 0.40 0.12 0.00 0.00 0.00 0.00 179.25 179.81 1rrm h ALA 357 N 1.10 1.14 -0.15 0.00 0.00 -0.71 -1.38 119.26 119.26 1rrm h ALA 357 Ca 0.21 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1rrm h ALA 357 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1rrm h ALA 357 CO -0.02 0.58 -0.07 1.25 0.00 0.00 0.00 179.25 180.99 1rrm h LEU 358 N 0.86 0.21 -1.59 0.00 5.85 -0.55 -2.53 115.31 117.56 1rrm h LEU 358 Ca 0.18 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1rrm h LEU 358 Cb 0.33 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1rrm h LEU 358 CO 0.00 0.32 0.00 0.47 -0.34 0.00 0.00 178.44 178.89 1rrm n ASP 359 N -4.33 2.44 -4.76 1.25 8.00 -0.78 -4.91 116.55 113.46 1rrm n ASP 359 Ca -0.01 -1.81 -0.40 0.00 0.71 0.00 0.00 54.79 53.28 1rrm n ASP 359 Cb 0.22 -0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 1rrm n ASP 359 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1rrm s ASP 360 N -1.88 7.11 0.25 -2.24 -1.08 -0.59 -4.94 116.67 113.30 1rrm s ASP 360 Ca 0.33 2.38 -0.03 0.00 -0.52 0.00 0.00 52.55 54.72 1rrm s ASP 360 Cb 0.20 -2.63 0.52 0.00 -1.46 0.00 0.00 42.92 39.55 1rrm s ASP 360 CO 0.31 -0.27 1.70 0.58 0.52 0.00 0.00 175.17 178.02 1rrm h VAL 361 N 3.05 0.56 0.00 1.11 2.07 -1.91 -2.40 116.25 118.72 1rrm h VAL 361 Ca -0.47 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 1rrm h VAL 361 Cb 1.22 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1rrm h VAL 361 CO 0.66 0.07 -0.32 0.00 0.02 0.00 0.00 177.57 178.00 1rrm h THR 363 N 0.00 0.90 -0.00 0.00 2.02 -1.52 -2.35 112.91 111.95 1rrm h THR 363 Ca -0.00 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1rrm h THR 363 Cb 0.71 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1rrm h THR 363 CO 0.04 0.12 0.02 1.23 0.37 0.00 0.00 175.52 177.30 1rrm h GLY 364 N 0.68 0.00 1.51 2.16 0.00 -1.72 -1.97 103.07 103.72 1rrm h GLY 364 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1rrm h GLY 364 CO -0.15 0.00 -0.15 0.61 0.00 0.00 0.00 176.54 176.84 1rrm n GLY 365 N -1.13 -1.32 3.70 4.60 0.00 -0.89 -4.90 105.19 105.25 1rrm n GLY 365 Ca -0.03 -0.20 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 1rrm n GLY 365 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rrm n ASN 366 N -1.39 3.35 0.20 1.61 5.15 -0.74 -1.20 115.26 122.24 1rrm n ASN 366 Ca 0.08 1.12 0.14 0.00 -0.60 0.00 0.00 54.58 55.32 1rrm n ASN 366 Cb 0.32 -1.50 0.71 0.00 -0.53 0.00 0.00 39.78 38.77 1rrm n ASN 366 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1rrm h PRO 367 N 5.08 0.00 -5.23 1.20 0.13 -1.89 -3.40 132.00 127.90 1rrm h PRO 367 Ca -0.45 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 1rrm h PRO 367 Cb 1.24 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.06 1rrm h PRO 367 CO 0.82 0.00 -0.84 0.50 -0.23 0.00 0.00 178.00 178.25 1rrm s ARG 368 N -3.64 3.12 -0.20 0.86 3.52 -1.26 -4.92 118.95 116.43 1rrm s ARG 368 Ca -0.01 -0.81 -0.29 0.00 -0.13 0.00 0.00 55.73 54.49 1rrm s ARG 368 Cb 0.08 -2.50 -0.04 0.00 -1.56 0.00 0.00 34.95 30.94 1rrm s ARG 368 CO 0.30 0.05 1.86 -2.00 -0.81 0.00 0.00 175.30 174.70 1rrm s GLU 369 N 0.69 3.58 -0.06 5.12 2.12 -1.26 -4.95 118.70 123.95 1rrm s GLU 369 Ca -0.09 1.85 -0.18 0.00 0.36 0.00 0.00 54.97 56.92 1rrm s GLU 369 Cb -0.16 -4.17 -0.05 0.00 0.26 0.00 0.00 34.13 30.01 1rrm s GLU 369 CO 0.01 -1.57 0.48 0.00 -0.54 0.00 0.00 175.26 173.64 1rrm s ALA 370 N 6.23 3.54 0.38 6.30 0.00 -1.26 -5.08 121.76 131.87 1rrm s ALA 370 Ca 0.83 -0.16 0.05 0.00 0.00 0.00 0.00 51.96 52.69 1rrm s ALA 370 Cb -0.29 -2.59 -0.00 0.00 0.00 0.00 0.00 23.12 20.24 1rrm s ALA 370 CO 0.34 0.18 0.53 0.95 0.00 0.00 0.00 175.76 177.76 1rrm s THR 371 N -0.05 3.85 0.17 0.00 -4.23 -1.26 -4.97 115.64 109.15 1rrm s THR 371 Ca 0.26 -0.89 -0.14 0.00 -1.18 0.00 0.00 61.69 59.74 1rrm s THR 371 Cb -0.16 -3.35 0.06 0.00 1.34 0.00 0.00 72.50 70.39 1rrm s THR 371 CO 0.12 -0.16 1.79 0.25 -0.54 0.00 0.00 174.62 176.09 1rrm h LEU 372 N 0.73 0.39 -1.11 4.79 5.85 -1.98 -1.73 115.31 122.25 1rrm h LEU 372 Ca -0.45 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.34 1rrm h LEU 372 Cb 1.26 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 1rrm h LEU 372 CO 0.52 0.28 0.60 -0.33 -0.34 0.00 0.00 178.44 179.18 1rrm h GLU 373 N 0.51 1.09 -0.49 1.25 3.07 -1.97 -0.70 114.58 117.34 1rrm h GLU 373 Ca 0.20 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.98 1rrm h GLU 373 Cb 0.08 -0.25 -0.02 0.00 -0.84 0.00 0.00 28.75 27.72 1rrm h GLU 373 CO -0.12 0.72 0.23 -0.44 -1.40 0.00 0.00 179.01 177.99 1rrm h ASP 374 N 1.12 0.66 -0.33 1.42 3.32 -1.73 -1.75 116.42 119.13 1rrm h ASP 374 Ca 0.38 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.18 1rrm h ASP 374 Cb 0.08 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1rrm h ASP 374 CO -0.13 0.62 -0.17 0.40 -1.72 0.00 0.00 179.24 178.24 1rrm h ILE 375 N 0.66 1.27 -0.36 0.35 2.04 -0.60 -1.50 117.51 119.35 1rrm h ILE 375 Ca 0.17 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 1rrm h ILE 375 Cb 0.14 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1rrm h ILE 375 CO -0.02 0.43 0.19 0.58 0.00 0.00 0.00 178.15 179.33 1rrm h VAL 376 N 0.70 1.15 -0.93 1.67 2.07 -0.96 -1.54 116.25 118.41 1rrm h VAL 376 Ca 0.11 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.22 1rrm h VAL 376 Cb 0.67 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 1rrm h VAL 376 CO 0.05 0.16 0.61 -0.08 0.02 0.00 0.00 177.57 178.33 1rrm h GLU 377 N 0.46 1.24 -0.46 1.57 4.57 -1.09 -1.80 114.58 119.07 1rrm h GLU 377 Ca 0.13 -0.08 -0.12 0.00 -1.18 0.00 0.00 59.36 58.11 1rrm h GLU 377 Cb 0.08 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.38 1rrm h GLU 377 CO -0.02 0.83 -0.18 -0.07 -1.18 0.00 0.00 179.01 178.39 1rrm h LEU 378 N 1.27 0.92 -0.43 1.64 3.38 -0.88 -1.42 115.31 119.78 1rrm h LEU 378 Ca 0.34 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1rrm h LEU 378 Cb -0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.35 1rrm h LEU 378 CO -0.07 1.08 0.13 1.88 0.09 0.00 0.00 178.44 181.55 1rrm h TYR 379 N 0.79 0.70 -0.73 1.13 0.99 -0.87 -1.34 116.97 117.64 1rrm h TYR 379 Ca 0.11 -0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.77 1rrm h TYR 379 Cb 0.73 -0.20 -0.04 0.00 1.00 0.00 0.00 36.73 38.22 1rrm h TYR 379 CO 0.04 0.64 0.44 0.45 -0.00 0.00 0.00 178.16 179.73 1rrm h HIS 380 N 0.56 0.96 -0.40 4.88 3.86 -1.19 -0.57 115.15 123.24 1rrm h HIS 380 Ca 0.14 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.23 1rrm h HIS 380 Cb 0.27 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1rrm h HIS 380 CO 0.01 0.64 -0.24 1.15 0.86 0.00 0.00 177.93 180.35 1rrm h THR 381 N 1.01 1.27 0.00 2.45 2.02 -0.90 -2.61 112.91 116.15 1rrm h THR 381 Ca 0.26 -1.37 0.00 0.00 0.77 0.00 0.00 66.41 66.08 1rrm h THR 381 Cb -0.04 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1rrm h THR 381 CO -0.05 0.46 0.00 0.00 0.37 0.00 0.00 175.52 176.30 1rrm n ALA 382 N -2.51 2.12 0.26 6.16 0.00 -0.54 -1.96 120.51 124.04 1rrm n ALA 382 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1rrm n ALA 382 Cb 0.45 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.35 1rrm n ALA 382 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1rrm h TRP 383 N 0.00 -1.42 0.00 0.00 2.91 -0.71 -0.59 115.95 116.14 1rrm h TRP 383 Ca 0.00 0.02 -0.13 0.00 1.13 0.00 0.00 58.89 59.90 1rrm h TRP 383 Cb 0.63 0.56 -0.29 0.00 -0.51 0.00 0.00 29.16 29.56 1rrm h TRP 383 CO 0.00 -0.66 -0.90 0.39 -1.03 0.00 0.00 178.44 176.25 1rrm n GLU 384 N -5.55 0.00 0.00 2.65 1.02 -1.26 -1.98 120.64 115.53 1rrm n GLU 384 Ca -0.11 -1.74 0.00 0.00 -0.02 0.00 0.00 57.16 55.29 1rrm n GLU 384 Cb 0.45 -0.13 0.00 0.00 -0.02 0.00 0.00 31.44 31.74 1rrm n GLU 384 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rrm n GLY 385 N 0.37 3.00 3.40 0.62 0.00 -0.91 -5.03 105.19 106.63 1rrm n GLY 385 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1rrm n GLY 385 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93