#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pbn s ALA 2 N 0.00 -1.73 0.53 3.17 0.00 -1.26 -4.39 121.76 118.08 1pbn s ALA 2 Ca 0.00 1.14 -0.22 0.00 0.00 0.00 0.00 51.96 52.88 1pbn s ALA 2 Cb 0.00 0.19 -0.06 0.00 0.00 0.00 0.00 23.12 23.25 1pbn s ALA 2 CO 0.00 -0.46 1.19 -1.71 0.00 0.00 0.00 175.76 174.78 1pbn n ASN 3 N 0.61 1.93 0.00 0.00 2.85 -1.20 -4.94 115.26 114.51 1pbn n ASN 3 Ca -0.18 0.95 0.00 0.00 -0.11 0.00 0.00 54.58 55.24 1pbn n ASN 3 Cb 0.59 -1.48 0.00 0.00 1.24 0.00 0.00 39.78 40.12 1pbn n ASN 3 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1pbn n GLY 4 N 0.97 -0.20 3.79 8.20 0.00 -1.26 -5.01 105.19 111.69 1pbn n GLY 4 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1pbn n GLY 4 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pbn s TYR 5 N -0.49 3.50 0.29 1.61 2.02 -1.26 -5.10 117.35 117.93 1pbn s TYR 5 Ca 0.00 0.47 -0.04 0.00 -0.37 0.00 0.00 57.07 57.14 1pbn s TYR 5 Cb 0.00 -2.10 -0.05 0.00 -0.40 0.00 0.00 41.96 39.41 1pbn s TYR 5 CO 0.00 0.47 0.54 0.95 -1.57 0.00 0.00 175.55 175.94 1pbn s THR 6 N -0.23 5.05 0.41 -0.71 -4.23 -1.26 -4.96 115.64 109.71 1pbn s THR 6 Ca 0.12 -0.07 0.21 0.00 -1.18 0.00 0.00 61.69 60.77 1pbn s THR 6 Cb -0.12 -3.76 0.41 0.00 1.34 0.00 0.00 72.50 70.37 1pbn s THR 6 CO 0.02 -0.36 1.74 0.22 -0.54 0.00 0.00 174.62 175.70 1pbn h TYR 7 N 1.52 0.62 -0.17 3.99 3.20 -2.01 0.40 116.97 124.52 1pbn h TYR 7 Ca -0.48 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.35 1pbn h TYR 7 Cb 1.19 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 1pbn h TYR 7 CO 0.56 0.01 -0.18 0.93 -1.64 0.00 0.00 178.16 177.84 1pbn h GLU 8 N 0.33 0.28 -0.51 1.82 3.07 -1.99 -2.67 114.58 114.92 1pbn h GLU 8 Ca 0.63 -0.08 0.04 0.00 -0.50 0.00 0.00 59.36 59.45 1pbn h GLU 8 Cb 1.70 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 29.54 1pbn h GLU 8 CO -0.32 0.47 0.27 -0.44 -1.40 0.00 0.00 179.01 177.59 1pbn h ASP 9 N 0.26 0.39 -0.48 1.42 3.32 -0.56 0.12 116.42 120.91 1pbn h ASP 9 Ca 0.05 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1pbn h ASP 9 Cb 0.48 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 1pbn h ASP 9 CO 0.03 0.27 0.09 1.88 -1.72 0.00 0.00 179.24 179.79 1pbn h TYR 10 N 0.52 0.83 -0.79 4.55 0.05 -1.50 -2.64 116.97 118.00 1pbn h TYR 10 Ca 0.22 -0.11 -0.03 0.00 0.05 0.00 0.00 58.73 58.86 1pbn h TYR 10 Cb 0.11 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 37.59 1pbn h TYR 10 CO -0.09 0.76 0.36 1.96 -1.05 0.00 0.00 178.16 180.10 1pbn h GLN 11 N 0.66 1.15 -0.67 4.88 4.20 -1.04 -0.40 115.11 123.89 1pbn h GLN 11 Ca 0.15 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.61 1pbn h GLN 11 Cb 0.37 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 1pbn h GLN 11 CO 0.01 0.90 0.15 -0.44 -0.67 0.00 0.00 178.83 178.78 1pbn h ASP 12 N 1.12 1.01 -0.19 1.46 3.32 -0.68 -0.80 116.42 121.65 1pbn h ASP 12 Ca 0.27 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 1pbn h ASP 12 Cb 0.15 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1pbn h ASP 12 CO -0.03 0.98 -0.04 0.74 -1.72 0.00 0.00 179.24 179.17 1pbn h THR 13 N 1.01 1.28 -0.66 0.35 2.02 -1.09 -1.13 112.91 114.69 1pbn h THR 13 Ca 0.21 -0.99 -0.02 0.00 0.77 0.00 0.00 66.41 66.37 1pbn h THR 13 Cb 0.37 1.54 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 1pbn h THR 13 CO 0.00 0.30 0.32 0.00 0.37 0.00 0.00 175.52 176.51 1pbn h ALA 14 N 0.74 0.85 -0.18 6.16 0.00 -0.94 -1.71 119.26 124.17 1pbn h ALA 14 Ca 0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1pbn h ALA 14 Cb 0.47 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1pbn h ALA 14 CO 0.02 0.41 -0.15 0.87 0.00 0.00 0.00 179.25 180.40 1pbn h LYS 15 N 0.91 0.30 0.02 0.00 1.79 -1.07 0.81 116.57 119.33 1pbn h LYS 15 Ca 0.23 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1pbn h LYS 15 Cb 0.12 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1pbn h LYS 15 CO -0.03 0.45 -0.01 2.35 -1.08 0.00 0.00 179.45 181.13 1pbn h TRP 16 N 0.28 -0.03 -0.15 -1.35 7.01 -0.57 -1.84 115.95 119.31 1pbn h TRP 16 Ca 0.05 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.06 1pbn h TRP 16 Cb 0.44 0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.49 1pbn h TRP 16 CO 0.01 0.22 0.06 -0.07 -2.79 0.00 0.00 178.44 175.87 1pbn h LEU 17 N -0.27 0.08 -2.76 0.65 3.38 -0.89 -1.88 115.31 113.62 1pbn h LEU 17 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pbn h LEU 17 Cb 0.25 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1pbn h LEU 17 CO 0.00 0.07 0.01 -0.07 0.09 0.00 0.00 178.44 178.54 1pbn h LEU 18 N 0.14 0.00 -3.03 1.67 3.38 -0.76 -0.46 115.31 116.25 1pbn h LEU 18 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1pbn h LEU 18 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1pbn h LEU 18 CO -0.06 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.93 1pbn n SER 19 N -3.39 4.72 0.00 -0.43 3.41 -0.70 -4.17 113.62 113.06 1pbn n SER 19 Ca -0.03 -2.56 0.00 0.00 -0.26 0.00 0.00 58.87 56.03 1pbn n SER 19 Cb 0.09 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 1pbn n SER 19 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1pbn n HIS 20 N 0.88 0.00 -3.61 7.33 8.25 -0.19 -5.05 115.22 122.82 1pbn n HIS 20 Ca 0.24 -0.06 -0.15 0.00 -0.26 0.00 0.00 57.72 57.49 1pbn n HIS 20 Cb 0.93 -0.01 -0.07 0.00 1.12 0.00 0.00 29.99 31.96 1pbn n HIS 20 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1pbn s THR 21 N -0.12 0.01 -1.07 1.59 -1.32 -1.13 -5.03 115.64 108.56 1pbn s THR 21 Ca 0.00 -0.06 0.25 0.00 -1.21 0.00 0.00 61.69 60.67 1pbn s THR 21 Cb 0.00 -0.90 0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1pbn s THR 21 CO 0.00 -0.03 1.41 -1.84 -2.21 0.00 0.00 174.62 171.95 1pbn n GLU 22 N 1.82 0.08 -2.31 7.08 0.00 -1.26 -4.73 120.64 121.31 1pbn n GLU 22 Ca -0.17 -0.05 -0.41 0.00 0.00 0.00 0.00 57.16 56.53 1pbn n GLU 22 Cb 0.56 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.47 1pbn n GLU 22 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 1pbn s GLN 23 N -2.95 4.48 -0.52 3.44 -0.21 -1.26 -5.01 119.66 117.64 1pbn s GLN 23 Ca 0.12 1.97 0.04 0.00 0.02 0.00 0.00 55.36 57.51 1pbn s GLN 23 Cb 0.18 -3.17 0.15 0.00 1.00 0.00 0.00 33.01 31.17 1pbn s GLN 23 CO 0.69 -0.05 0.34 1.03 -2.12 0.00 0.00 175.29 175.18 1pbn s ARG 24 N -0.96 1.57 0.35 2.91 1.81 -1.26 -5.00 118.95 118.36 1pbn s ARG 24 Ca 0.50 -2.46 -0.27 0.00 -1.72 0.00 0.00 55.73 51.78 1pbn s ARG 24 Cb -0.35 -2.46 -0.09 0.00 -0.45 0.00 0.00 34.95 31.60 1pbn s ARG 24 CO 0.42 -1.26 1.14 -1.25 -0.68 0.00 0.00 175.30 173.67 1pbn s PRO 25 N -0.30 4.30 -0.01 3.54 0.04 -1.26 -4.96 135.00 136.36 1pbn s PRO 25 Ca 0.24 1.81 0.20 0.00 0.04 0.00 0.00 61.00 63.28 1pbn s PRO 25 Cb -0.11 -2.86 -0.26 0.00 0.04 0.00 0.00 34.50 31.30 1pbn s PRO 25 CO -0.10 -0.09 0.65 1.04 0.04 0.00 0.00 177.00 178.53 1pbn n GLN 26 N 0.50 0.56 -5.08 4.56 6.02 -1.11 -4.05 117.38 118.77 1pbn n GLN 26 Ca 0.02 -0.09 -0.28 0.00 -0.01 0.00 0.00 57.00 56.64 1pbn n GLN 26 Cb 0.46 -1.45 -0.16 0.00 1.02 0.00 0.00 30.24 30.11 1pbn n GLN 26 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1pbn s VAL 27 N -3.12 1.73 -0.03 5.09 1.01 -1.24 -0.84 120.40 123.01 1pbn s VAL 27 Ca 0.00 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.11 1pbn s VAL 27 Cb 0.14 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 1pbn s VAL 27 CO 0.82 0.49 -0.20 0.00 0.00 0.00 0.00 175.10 176.22 1pbn s ALA 28 N -0.42 2.45 -0.09 5.51 0.00 -0.06 -1.78 121.76 127.36 1pbn s ALA 28 Ca 0.06 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.97 1pbn s ALA 28 Cb -0.09 -0.77 0.02 0.00 0.00 0.00 0.00 23.12 22.27 1pbn s ALA 28 CO -0.00 0.55 -0.13 0.08 0.00 0.00 0.00 175.76 176.26 1pbn s VAL 29 N -0.70 1.30 -0.38 0.00 1.01 0.07 -0.73 120.40 120.98 1pbn s VAL 29 Ca 0.11 -0.53 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 1pbn s VAL 29 Cb -0.10 -1.21 0.07 0.00 0.00 0.00 0.00 36.38 35.14 1pbn s VAL 29 CO 0.00 0.40 0.17 -0.63 0.00 0.00 0.00 175.10 175.04 1pbn s ILE 30 N 0.99 3.69 -0.43 2.22 1.01 -0.59 -0.54 121.20 127.57 1pbn s ILE 30 Ca -0.07 -1.49 -0.20 0.00 0.00 0.00 0.00 60.65 58.89 1pbn s ILE 30 Cb -0.15 -3.26 0.02 0.00 0.01 0.00 0.00 42.46 39.08 1pbn s ILE 30 CO -0.01 -0.41 0.59 0.00 0.00 0.00 0.00 174.94 175.12 1pbn n GLY 32 N 5.02 -0.71 3.72 0.00 0.00 -0.78 -3.02 105.19 109.41 1pbn n GLY 32 Ca -0.03 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1pbn n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pbn s SER 33 N -6.99 6.67 -0.70 1.61 1.04 -1.26 -4.78 113.70 109.28 1pbn s SER 33 Ca -0.30 2.52 -0.14 0.00 0.48 0.00 0.00 55.95 58.51 1pbn s SER 33 Cb 0.08 -2.59 -0.19 0.00 0.10 0.00 0.00 66.02 63.42 1pbn s SER 33 CO 0.60 -0.76 1.90 0.61 0.98 0.00 0.00 173.24 176.57 1pbn n GLY 34 N 3.61 -0.28 2.47 7.32 0.00 -1.26 -4.68 105.19 112.37 1pbn n GLY 34 Ca 0.13 0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 1pbn n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pbn n LEU 35 N 10.97 4.52 -0.34 0.99 4.32 -1.26 -0.36 117.00 135.83 1pbn n LEU 35 Ca 0.40 -5.11 0.18 0.00 -0.02 0.00 0.00 56.01 51.46 1pbn n LEU 35 Cb 0.36 -0.40 0.40 0.00 -1.62 0.00 0.00 43.42 42.16 1pbn n LEU 35 CO 0.72 2.19 1.17 1.23 -1.22 0.00 0.00 177.39 181.48 1pbn h GLY 36 N 2.59 1.81 0.90 -0.72 0.00 -1.95 0.15 103.07 105.84 1pbn h GLY 36 Ca 0.28 -0.30 0.09 0.00 0.00 0.00 0.00 47.33 47.40 1pbn h GLY 36 CO 0.82 -0.21 0.46 -1.33 0.00 0.00 0.00 176.54 176.28 1pbn h GLY 37 N 0.58 0.00 1.00 4.60 0.00 -1.93 0.12 103.07 107.43 1pbn h GLY 37 Ca 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.93 1pbn h GLY 37 CO -0.44 0.00 0.26 -2.00 0.00 0.00 0.00 176.54 174.36 1pbn h LEU 38 N 0.00 0.82 -1.68 3.11 5.85 -1.10 -0.58 115.31 121.73 1pbn h LEU 38 Ca 0.15 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1pbn h LEU 38 Cb 1.07 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 1pbn h LEU 38 CO -0.00 0.75 -0.17 1.62 -0.34 0.00 0.00 178.44 180.30 1pbn h VAL 39 N 0.84 0.66 0.00 1.05 3.04 -0.92 -1.58 116.25 119.34 1pbn h VAL 39 Ca 0.21 -0.74 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 1pbn h VAL 39 Cb 0.17 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.92 1pbn h VAL 39 CO -0.02 0.17 0.00 0.59 -1.01 0.00 0.00 177.57 177.30 1pbn n ASN 40 N -3.66 0.48 -0.07 3.17 4.13 -0.25 -2.45 115.26 116.61 1pbn n ASN 40 Ca -0.01 0.60 0.11 0.00 1.68 0.00 0.00 54.58 56.96 1pbn n ASN 40 Cb 0.29 -0.71 0.12 0.00 -1.54 0.00 0.00 39.78 37.95 1pbn n ASN 40 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1pbn n LYS 41 N -2.00 0.19 -2.32 3.52 5.02 -0.60 -4.95 118.16 117.02 1pbn n LYS 41 Ca 0.03 -0.13 -0.42 0.00 -2.02 0.00 0.00 58.31 55.77 1pbn n LYS 41 Cb 0.26 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 1pbn n LYS 41 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1pbn s LEU 42 N -2.90 4.38 0.18 -0.35 1.43 -1.03 -4.70 118.68 115.69 1pbn s LEU 42 Ca 0.12 2.16 0.00 0.00 -1.03 0.00 0.00 54.13 55.38 1pbn s LEU 42 Cb 0.17 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.77 1pbn s LEU 42 CO 0.73 -0.53 0.35 -0.89 0.23 0.00 0.00 176.35 176.24 1pbn s THR 43 N 0.95 5.24 -1.64 5.49 2.01 0.05 -4.29 115.64 123.44 1pbn s THR 43 Ca 0.60 -0.45 -0.16 0.00 0.31 0.00 0.00 61.69 61.99 1pbn s THR 43 Cb -0.33 -3.73 0.13 0.00 0.01 0.00 0.00 72.50 68.59 1pbn s THR 43 CO 0.30 -0.13 0.83 0.00 -0.69 0.00 0.00 174.62 174.93 1pbn n GLN 44 N -0.57 -3.83 -2.19 4.92 6.02 -1.26 -0.48 117.38 119.98 1pbn n GLN 44 Ca -0.05 0.44 -0.40 0.00 -0.01 0.00 0.00 57.00 56.97 1pbn n GLN 44 Cb 0.54 -5.18 -0.02 0.00 1.02 0.00 0.00 30.24 26.59 1pbn n GLN 44 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pbn s ALA 45 N -3.32 3.42 -0.02 -1.58 0.00 -1.26 -4.46 121.76 114.54 1pbn s ALA 45 Ca 0.68 1.16 -0.00 0.00 0.00 0.00 0.00 51.96 53.80 1pbn s ALA 45 Cb -0.37 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.33 1pbn s ALA 45 CO 0.90 -0.56 0.03 -1.14 0.00 0.00 0.00 175.76 174.99 1pbn s GLN 46 N -1.84 -0.01 0.12 0.00 0.74 -0.35 -4.99 119.66 113.34 1pbn s GLN 46 Ca 0.50 0.14 0.11 0.00 0.05 0.00 0.00 55.36 56.16 1pbn s GLN 46 Cb -0.37 -0.15 -0.04 0.00 1.10 0.00 0.00 33.01 33.55 1pbn s GLN 46 CO 0.49 -0.11 -0.27 0.99 -0.55 0.00 0.00 175.29 175.84 1pbn s THR 47 N 0.69 2.24 -0.04 -0.34 2.01 -1.26 -0.98 115.64 117.96 1pbn s THR 47 Ca -0.06 -1.73 0.02 0.00 0.31 0.00 0.00 61.69 60.23 1pbn s THR 47 Cb -0.08 -1.98 0.01 0.00 0.01 0.00 0.00 72.50 70.47 1pbn s THR 47 CO -0.02 0.10 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.58 1pbn s PHE 48 N -1.05 0.87 0.15 4.92 0.08 0.29 -4.99 117.98 118.24 1pbn s PHE 48 Ca 0.14 -0.24 -0.22 0.00 0.12 0.00 0.00 56.93 56.73 1pbn s PHE 48 Cb -0.10 -0.69 -0.08 0.00 -0.57 0.00 0.00 43.02 41.58 1pbn s PHE 48 CO 0.06 -0.16 0.69 -0.51 -0.10 0.00 0.00 175.22 175.19 1pbn s ASP 49 N 0.62 7.19 0.31 1.36 1.01 -1.26 -0.11 116.67 125.78 1pbn s ASP 49 Ca -0.09 1.44 0.07 0.00 0.71 0.00 0.00 52.55 54.68 1pbn s ASP 49 Cb -0.12 -2.43 0.77 0.00 1.01 0.00 0.00 42.92 42.15 1pbn s ASP 49 CO 0.01 0.19 1.76 1.88 0.21 0.00 0.00 175.17 179.22 1pbn h TYR 50 N 4.16 1.03 0.00 4.23 0.05 -1.85 -0.80 116.97 123.79 1pbn h TYR 50 Ca -0.48 0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.32 1pbn h TYR 50 Cb 1.21 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 38.64 1pbn h TYR 50 CO 0.65 0.17 -0.06 0.66 -1.05 0.00 0.00 178.16 178.53 1pbn h SER 51 N 0.69 0.00 0.32 3.88 4.64 -1.86 -2.30 113.55 118.92 1pbn h SER 51 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 1pbn h SER 51 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1pbn h SER 51 CO -0.42 0.06 -0.33 -1.84 -0.87 0.00 0.00 176.83 173.44 1pbn n GLU 52 N -4.07 0.59 -3.41 4.77 0.28 -0.31 -4.82 120.64 113.67 1pbn n GLU 52 Ca -0.03 -0.34 -0.39 0.00 -0.16 0.00 0.00 57.16 56.24 1pbn n GLU 52 Cb 0.15 -1.49 -0.09 0.00 1.43 0.00 0.00 31.44 31.44 1pbn n GLU 52 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1pbn s ILE 53 N -2.65 5.19 0.37 3.84 1.01 -0.86 -5.00 121.20 123.08 1pbn s ILE 53 Ca 0.20 0.55 -0.25 0.00 0.00 0.00 0.00 60.65 61.15 1pbn s ILE 53 Cb 0.19 -3.69 -0.13 0.00 0.01 0.00 0.00 42.46 38.84 1pbn s ILE 53 CO 0.57 0.17 0.84 -2.65 0.00 0.00 0.00 174.94 173.87 1pbn n PRO 54 N 5.25 1.02 -0.73 2.79 -0.02 -1.26 -1.83 135.00 140.22 1pbn n PRO 54 Ca -0.09 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1pbn n PRO 54 Cb 0.51 -1.75 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 1pbn n PRO 54 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pbn n ASN 55 N 1.05 -3.16 -4.65 2.55 5.03 -1.26 -4.81 115.26 110.00 1pbn n ASN 55 Ca 0.11 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.15 1pbn n ASN 55 Cb 0.36 -2.87 -0.05 0.00 -1.02 0.00 0.00 39.78 36.19 1pbn n ASN 55 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1pbn s PHE 56 N -0.93 3.36 0.86 3.10 2.19 -0.76 -5.04 117.98 120.76 1pbn s PHE 56 Ca 0.00 1.01 -0.10 0.00 0.33 0.00 0.00 56.93 58.17 1pbn s PHE 56 Cb 0.00 -2.89 0.11 0.00 -1.31 0.00 0.00 43.02 38.93 1pbn s PHE 56 CO 0.00 -0.25 1.11 -2.14 1.83 0.00 0.00 175.22 175.77 1pbn s PRO 57 N 2.20 1.49 0.03 10.12 0.02 -1.26 -4.68 135.00 142.92 1pbn s PRO 57 Ca 0.31 1.28 -0.01 0.00 0.02 0.00 0.00 61.00 62.60 1pbn s PRO 57 Cb -0.16 -1.80 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 1pbn s PRO 57 CO 0.10 -2.22 0.18 -1.21 -0.33 0.00 0.00 177.00 173.53 1pbn s GLU 58 N -4.78 3.38 0.09 5.54 2.02 -1.26 -4.79 118.70 118.90 1pbn s GLU 58 Ca 0.64 -0.41 -0.15 0.00 0.02 0.00 0.00 54.97 55.06 1pbn s GLU 58 Cb -0.20 -3.03 -0.06 0.00 0.10 0.00 0.00 34.13 30.94 1pbn s GLU 58 CO 0.57 0.64 0.51 0.45 0.02 0.00 0.00 175.26 177.45 1pbn s SER 59 N -2.23 6.88 -0.00 -0.19 0.15 -1.26 -4.99 113.70 112.06 1pbn s SER 59 Ca 0.31 1.08 -0.00 0.00 0.70 0.00 0.00 55.95 58.04 1pbn s SER 59 Cb -0.13 -2.29 -0.00 0.00 -1.71 0.00 0.00 66.02 61.89 1pbn s SER 59 CO 0.23 0.21 -0.00 0.35 1.20 0.00 0.00 173.24 175.23 1pbn n THR 60 N 1.31 0.03 -1.53 6.45 -2.24 -1.26 -4.96 114.28 112.09 1pbn n THR 60 Ca -0.09 0.00 -0.51 0.00 -2.27 0.00 0.00 64.05 61.19 1pbn n THR 60 Cb 0.52 -1.50 -0.05 0.00 -2.10 0.00 0.00 70.33 67.20 1pbn n THR 60 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1pbn n VAL 61 N -3.02 0.96 -0.88 2.28 0.31 -1.26 -4.91 118.33 111.81 1pbn n VAL 61 Ca -0.00 -0.24 -0.32 0.00 -0.01 0.00 0.00 64.34 63.76 1pbn n VAL 61 Cb 0.49 -0.50 0.15 0.00 -0.91 0.00 0.00 33.84 33.07 1pbn n VAL 61 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1pbn n PRO 62 N 1.52 -0.16 0.00 5.55 -0.04 -1.26 -2.79 135.00 137.82 1pbn n PRO 62 Ca 0.16 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 1pbn n PRO 62 Cb 0.21 -2.38 0.00 0.00 -0.04 0.00 0.00 33.50 31.30 1pbn n PRO 62 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pbn n GLY 63 N 0.46 3.01 3.48 0.55 0.00 -1.26 -4.95 105.19 106.48 1pbn n GLY 63 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1pbn n GLY 63 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1pbn s HIS 64 N -1.35 3.00 0.24 1.61 3.76 -1.12 -4.91 115.29 116.53 1pbn s HIS 64 Ca 0.00 -0.32 -0.05 0.00 -0.15 0.00 0.00 55.06 54.54 1pbn s HIS 64 Cb 0.00 -3.59 0.37 0.00 1.11 0.00 0.00 32.58 30.48 1pbn s HIS 64 CO 0.00 -1.05 1.81 0.00 -0.85 0.00 0.00 174.74 174.65 1pbn h ALA 65 N 9.02 1.13 -2.24 -1.40 0.00 -1.88 -3.47 119.26 120.44 1pbn h ALA 65 Ca -0.27 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1pbn h ALA 65 Cb 1.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1pbn h ALA 65 CO 0.97 0.09 0.00 0.41 0.00 0.00 0.00 179.25 180.72 1pbn n GLY 66 N -1.32 0.58 3.47 0.00 0.00 -0.18 -5.02 105.19 102.71 1pbn n GLY 66 Ca 0.13 -0.42 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 1pbn n GLY 66 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1pbn s ARG 67 N -3.64 0.77 -0.14 1.61 1.70 -1.20 -2.80 118.95 115.24 1pbn s ARG 67 Ca 0.00 0.57 -0.17 0.00 -0.47 0.00 0.00 55.73 55.66 1pbn s ARG 67 Cb 0.00 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.71 1pbn s ARG 67 CO 0.00 -0.15 0.45 -1.17 -1.08 0.00 0.00 175.30 173.35 1pbn s LEU 68 N -0.22 4.25 -0.09 -1.89 2.96 0.85 -0.97 118.68 123.57 1pbn s LEU 68 Ca -0.04 0.74 0.03 0.00 -0.22 0.00 0.00 54.13 54.64 1pbn s LEU 68 Cb -0.03 -2.64 0.01 0.00 0.50 0.00 0.00 46.19 44.02 1pbn s LEU 68 CO 0.03 -0.01 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.19 1pbn s VAL 69 N 0.74 1.56 -0.02 1.68 1.01 0.11 -0.55 120.40 124.93 1pbn s VAL 69 Ca 0.24 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1pbn s VAL 69 Cb -0.15 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 1pbn s VAL 69 CO 0.09 0.45 0.08 -0.36 0.00 0.00 0.00 175.10 175.36 1pbn s PHE 70 N 0.63 3.30 -0.24 5.22 0.40 -0.15 0.01 117.98 127.16 1pbn s PHE 70 Ca -0.14 0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.43 1pbn s PHE 70 Cb -0.16 -1.76 0.00 0.00 0.51 0.00 0.00 43.02 41.60 1pbn s PHE 70 CO 0.04 0.56 0.00 0.41 0.70 0.00 0.00 175.22 176.93 1pbn n GLY 71 N 1.37 -1.19 3.33 4.36 0.00 -0.46 -1.21 105.19 111.39 1pbn n GLY 71 Ca -0.14 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 1pbn n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pbn s ILE 72 N -2.24 3.81 -0.28 -0.61 -1.09 0.37 -0.68 121.20 120.48 1pbn s ILE 72 Ca 0.00 -0.72 -0.05 0.00 -2.23 0.00 0.00 60.65 57.65 1pbn s ILE 72 Cb 0.00 -2.95 0.02 0.00 -1.58 0.00 0.00 42.46 37.94 1pbn s ILE 72 CO 0.00 0.11 0.02 -0.22 -1.23 0.00 0.00 174.94 173.62 1pbn s LEU 73 N 1.48 3.59 -1.39 2.97 0.20 0.76 -0.77 118.68 125.52 1pbn s LEU 73 Ca 0.02 -0.78 -0.02 0.00 0.69 0.00 0.00 54.13 54.04 1pbn s LEU 73 Cb -0.17 -1.80 0.00 0.00 -0.43 0.00 0.00 46.19 43.80 1pbn s LEU 73 CO 0.01 -0.17 0.43 -3.20 -0.29 0.00 0.00 176.35 173.14 1pbn n ASN 74 N 4.79 -0.69 0.00 3.68 5.15 -1.26 -0.81 115.26 126.11 1pbn n ASN 74 Ca -0.15 -1.02 0.00 0.00 -0.60 0.00 0.00 54.58 52.81 1pbn n ASN 74 Cb 0.48 -3.01 0.00 0.00 -0.53 0.00 0.00 39.78 36.72 1pbn n ASN 74 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1pbn n GLY 75 N -1.98 0.58 3.33 8.20 0.00 -1.26 -4.66 105.19 109.40 1pbn n GLY 75 Ca -0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1pbn n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1pbn s ARG 76 N -0.42 3.35 -0.01 1.61 6.06 0.01 -3.64 118.95 125.91 1pbn s ARG 76 Ca 0.00 -0.68 -0.30 0.00 -2.50 0.00 0.00 55.73 52.25 1pbn s ARG 76 Cb 0.00 -2.75 -0.04 0.00 0.06 0.00 0.00 34.95 32.22 1pbn s ARG 76 CO 0.00 0.05 1.16 0.00 -2.50 0.00 0.00 175.30 174.01 1pbn s ALA 77 N 0.78 3.41 0.21 6.12 0.00 -1.26 -0.17 121.76 130.85 1pbn s ALA 77 Ca -0.04 0.68 -0.07 0.00 0.00 0.00 0.00 51.96 52.52 1pbn s ALA 77 Cb -0.15 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 1pbn s ALA 77 CO 0.01 -0.57 0.30 0.00 0.00 0.00 0.00 175.76 175.50 1pbn s VAL 79 N -4.06 1.23 0.00 0.00 0.11 -0.74 -1.36 120.40 115.58 1pbn s VAL 79 Ca 0.28 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1pbn s VAL 79 Cb 0.03 -1.05 -0.00 0.00 -1.53 0.00 0.00 36.38 33.82 1pbn s VAL 79 CO 0.08 0.36 -0.02 0.00 -3.33 0.00 0.00 175.10 172.19 1pbn s MET 80 N -0.02 0.15 -0.26 1.54 0.23 0.10 -0.75 119.30 120.29 1pbn s MET 80 Ca -0.01 -0.15 -0.21 0.00 -1.03 0.00 0.00 55.69 54.29 1pbn s MET 80 Cb -0.09 -0.09 -0.01 0.00 -1.53 0.00 0.00 34.83 33.10 1pbn s MET 80 CO 0.01 0.02 0.67 -1.64 -2.03 0.00 0.00 175.02 172.05 1pbn s MET 81 N -0.27 4.09 -1.02 3.16 -1.94 0.30 -0.71 119.30 122.92 1pbn s MET 81 Ca -0.02 0.59 -0.17 0.00 -1.71 0.00 0.00 55.69 54.38 1pbn s MET 81 Cb -0.02 -3.66 0.15 0.00 2.01 0.00 0.00 34.83 33.31 1pbn s MET 81 CO -0.00 -0.46 1.22 -1.14 -0.01 0.00 0.00 175.02 174.63 1pbn s GLN 82 N 2.59 3.77 0.00 2.03 2.00 -0.15 -2.47 119.66 127.44 1pbn s GLN 82 Ca 0.28 -2.09 0.00 0.00 -2.00 0.00 0.00 55.36 51.55 1pbn s GLN 82 Cb -0.15 -4.94 0.00 0.00 0.80 0.00 0.00 33.01 28.72 1pbn s GLN 82 CO 0.09 -1.74 0.00 0.41 -0.50 0.00 0.00 175.29 173.54 1pbn n GLY 83 N 4.93 2.49 3.82 2.59 0.00 -1.17 -1.01 105.19 116.85 1pbn n GLY 83 Ca 0.28 -1.47 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 1pbn n GLY 83 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1pbn s ARG 84 N -5.14 2.22 0.05 1.61 1.70 -1.26 -4.74 118.95 113.39 1pbn s ARG 84 Ca 0.00 -2.28 0.01 0.00 -0.47 0.00 0.00 55.73 52.99 1pbn s ARG 84 Cb 0.00 -1.73 -0.04 0.00 -0.57 0.00 0.00 34.95 32.61 1pbn s ARG 84 CO 0.00 -0.47 0.13 -0.06 -1.08 0.00 0.00 175.30 173.81 1pbn s PHE 85 N -2.85 3.34 0.05 5.89 0.08 -1.26 -4.87 117.98 118.35 1pbn s PHE 85 Ca 0.14 0.18 0.04 0.00 0.12 0.00 0.00 56.93 57.41 1pbn s PHE 85 Cb -0.00 -1.70 -0.02 0.00 -0.57 0.00 0.00 43.02 40.72 1pbn s PHE 85 CO 0.09 0.56 -0.12 -1.01 -0.10 0.00 0.00 175.22 174.64 1pbn s HIS 86 N -1.38 1.02 0.43 0.36 3.76 -1.26 -4.91 115.29 113.30 1pbn s HIS 86 Ca 0.30 -0.41 0.11 0.00 -0.15 0.00 0.00 55.06 54.91 1pbn s HIS 86 Cb -0.12 -0.60 0.93 0.00 1.11 0.00 0.00 32.58 33.90 1pbn s HIS 86 CO 0.22 0.01 1.99 1.98 -0.85 0.00 0.00 174.74 178.09 1pbn h MET 87 N 4.69 0.18 0.00 1.40 4.05 -1.84 -2.21 114.93 121.20 1pbn h MET 87 Ca -0.38 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.01 1pbn h MET 87 Cb 1.19 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.96 1pbn h MET 87 CO 0.42 0.26 0.00 2.48 0.23 0.00 0.00 176.91 180.30 1pbn n TYR 88 N -4.36 0.00 1.16 1.39 0.18 -1.26 -0.70 117.16 113.57 1pbn n TYR 88 Ca -0.01 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.90 1pbn n TYR 88 Cb 0.20 -0.21 0.39 0.00 -0.38 0.00 0.00 39.34 39.34 1pbn n TYR 88 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1pbn n GLU 89 N -1.21 0.42 0.00 -3.48 1.02 -0.83 -4.86 120.64 111.69 1pbn n GLU 89 Ca 0.05 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 56.97 1pbn n GLU 89 Cb 0.06 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 1pbn n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pbn n GLY 90 N 1.40 0.67 3.71 0.62 0.00 0.13 -5.08 105.19 106.65 1pbn n GLY 90 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1pbn n GLY 90 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pbn s TYR 91 N -2.00 3.38 0.66 1.61 2.02 -1.17 -5.03 117.35 116.82 1pbn s TYR 91 Ca 0.00 1.21 -0.13 0.00 -0.37 0.00 0.00 57.07 57.78 1pbn s TYR 91 Cb 0.00 -3.49 -0.01 0.00 -0.40 0.00 0.00 41.96 38.06 1pbn s TYR 91 CO 0.00 -1.59 1.07 -1.25 -1.57 0.00 0.00 175.55 172.21 1pbn s PRO 92 N 1.00 3.01 0.44 -1.71 0.04 -1.26 -4.25 135.00 132.27 1pbn s PRO 92 Ca 0.60 1.12 0.10 0.00 0.04 0.00 0.00 61.00 62.86 1pbn s PRO 92 Cb -0.32 -1.99 0.98 0.00 0.04 0.00 0.00 34.50 33.20 1pbn s PRO 92 CO 0.30 -1.05 2.07 0.74 0.04 0.00 0.00 177.00 179.10 1pbn h PHE 93 N -0.22 0.34 0.00 0.56 0.04 -1.94 -1.86 116.94 113.85 1pbn h PHE 93 Ca -0.45 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1pbn h PHE 93 Cb 1.22 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 39.26 1pbn h PHE 93 CO 0.60 0.23 0.00 -2.67 -0.60 0.00 0.00 178.31 175.87 1pbn n TRP 94 N -4.48 0.26 -0.08 -0.55 4.27 -1.26 -1.16 117.44 114.44 1pbn n TRP 94 Ca 0.01 0.11 -0.23 0.00 -3.89 0.00 0.00 57.50 53.50 1pbn n TRP 94 Cb 0.09 -0.67 -0.12 0.00 -1.36 0.00 0.00 31.31 29.24 1pbn n TRP 94 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 1pbn n LYS 95 N -1.74 0.65 -0.34 -2.67 5.02 -0.74 -3.52 118.16 114.82 1pbn n LYS 95 Ca 0.02 0.32 0.11 0.00 -2.02 0.00 0.00 58.31 56.74 1pbn n LYS 95 Cb 0.14 -1.63 0.31 0.00 -0.02 0.00 0.00 35.03 33.83 1pbn n LYS 95 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1pbn h VAL 96 N -0.45 0.81 -0.26 -0.18 2.07 -0.98 -1.53 116.25 115.74 1pbn h VAL 96 Ca -0.50 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1pbn h VAL 96 Cb 1.73 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1pbn h VAL 96 CO -0.14 0.15 0.00 0.35 0.02 0.00 0.00 177.57 177.95 1pbn n THR 97 N -4.66 0.33 -0.16 2.57 -2.24 -0.31 -4.59 114.28 105.23 1pbn n THR 97 Ca 0.20 -0.56 -0.02 0.00 -2.27 0.00 0.00 64.05 61.40 1pbn n THR 97 Cb 0.47 0.80 0.05 0.00 -2.10 0.00 0.00 70.33 69.56 1pbn n THR 97 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1pbn h PHE 98 N 3.63 -0.18 0.00 4.78 3.57 -1.32 -2.02 116.94 125.41 1pbn h PHE 98 Ca 0.00 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 1pbn h PHE 98 Cb 0.80 0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.69 1pbn h PHE 98 CO 0.16 -0.18 -0.03 -1.00 -2.23 0.00 0.00 178.31 175.03 1pbn h PRO 99 N 0.04 0.00 -0.69 6.41 0.13 -1.81 -2.74 132.00 133.34 1pbn h PRO 99 Ca 0.25 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.38 1pbn h PRO 99 Cb 0.38 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.48 1pbn h PRO 99 CO -0.49 0.03 0.42 0.28 -0.23 0.00 0.00 178.00 178.02 1pbn h VAL 100 N 0.00 1.19 -0.01 1.56 2.07 -1.70 -0.68 116.25 118.69 1pbn h VAL 100 Ca -0.00 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 66.99 1pbn h VAL 100 Cb 0.06 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1pbn h VAL 100 CO 0.00 0.20 -0.52 0.03 0.02 0.00 0.00 177.57 177.30 1pbn h ARG 101 N 0.94 0.04 -0.45 1.57 3.08 -1.55 -2.55 114.38 115.46 1pbn h ARG 101 Ca 0.25 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 60.15 1pbn h ARG 101 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1pbn h ARG 101 CO -0.05 0.55 -0.23 0.28 -1.07 0.00 0.00 179.97 179.45 1pbn h VAL 102 N 0.03 1.27 -0.74 2.04 2.07 -1.28 -2.73 116.25 116.91 1pbn h VAL 102 Ca -0.00 -1.39 0.04 0.00 0.82 0.00 0.00 66.70 66.17 1pbn h VAL 102 Cb 0.94 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1pbn h VAL 102 CO 0.07 0.47 0.46 -0.26 0.02 0.00 0.00 177.57 178.33 1pbn h PHE 103 N 0.79 0.86 -0.39 1.57 0.04 -0.75 -0.58 116.94 118.49 1pbn h PHE 103 Ca 0.10 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 1pbn h PHE 103 Cb 0.79 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.64 1pbn h PHE 103 CO 0.05 0.48 0.15 -0.09 -0.60 0.00 0.00 178.31 178.29 1pbn h ARG 104 N 0.89 0.55 0.00 1.51 1.12 -1.31 -1.49 114.38 115.65 1pbn h ARG 104 Ca 0.30 -0.07 0.00 0.00 -1.11 0.00 0.00 59.98 59.10 1pbn h ARG 104 Cb 0.05 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 29.91 1pbn h ARG 104 CO -0.13 0.46 0.00 1.28 -3.11 0.00 0.00 179.97 178.48 1pbn n LEU 105 N -4.38 0.56 0.05 3.80 4.77 -0.31 -2.53 117.00 118.97 1pbn n LEU 105 Ca 0.02 0.56 0.12 0.00 -0.03 0.00 0.00 56.01 56.69 1pbn n LEU 105 Cb 0.15 -0.39 0.30 0.00 -2.33 0.00 0.00 43.42 41.14 1pbn n LEU 105 CO 0.37 -0.16 0.58 0.18 -1.33 0.00 0.00 177.39 177.02 1pbn n LEU 106 N -2.03 0.61 0.00 2.23 4.77 -0.60 -4.91 117.00 117.06 1pbn n LEU 106 Ca 0.06 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1pbn n LEU 106 Cb 0.38 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1pbn n LEU 106 CO 0.28 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1pbn n GLY 107 N 1.38 1.02 3.77 -0.72 0.00 -1.05 -4.86 105.19 104.73 1pbn n GLY 107 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1pbn n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pbn s VAL 108 N -2.00 2.74 0.00 1.61 1.01 -0.93 -4.78 120.40 118.05 1pbn s VAL 108 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1pbn s VAL 108 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1pbn s VAL 108 CO 0.00 0.07 0.00 -0.62 0.00 0.00 0.00 175.10 174.55 1pbn n GLU 109 N -0.06 1.27 -4.78 2.72 1.02 -0.02 -4.59 120.64 116.21 1pbn n GLU 109 Ca 0.05 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.93 1pbn n GLU 109 Cb 0.45 -1.00 -0.16 0.00 -0.02 0.00 0.00 31.44 30.71 1pbn n GLU 109 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1pbn s THR 110 N -1.99 1.38 -0.17 2.62 2.01 -1.07 -1.41 115.64 117.01 1pbn s THR 110 Ca 0.00 -0.65 0.00 0.00 0.31 0.00 0.00 61.69 61.35 1pbn s THR 110 Cb 0.00 -1.22 0.01 0.00 0.01 0.00 0.00 72.50 71.30 1pbn s THR 110 CO 0.00 0.41 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.95 1pbn s LEU 111 N 0.35 2.34 -0.15 4.42 2.96 0.23 -0.88 118.68 127.95 1pbn s LEU 111 Ca -0.11 -0.55 -0.06 0.00 -0.22 0.00 0.00 54.13 53.20 1pbn s LEU 111 Cb -0.14 -1.53 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 1pbn s LEU 111 CO 0.04 0.04 0.05 -0.69 -1.32 0.00 0.00 176.35 174.47 1pbn s VAL 112 N 1.06 4.72 0.01 1.68 1.01 0.10 -2.92 120.40 126.06 1pbn s VAL 112 Ca -0.01 -0.07 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1pbn s VAL 112 Cb -0.14 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 1pbn s VAL 112 CO -0.05 0.52 -0.21 0.68 0.00 0.00 0.00 175.10 176.03 1pbn s VAL 113 N -0.10 1.69 0.07 2.92 -7.23 -0.77 -1.54 120.40 115.44 1pbn s VAL 113 Ca 0.06 -1.03 0.02 0.00 -1.81 0.00 0.00 61.98 59.23 1pbn s VAL 113 Cb -0.12 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.36 1pbn s VAL 113 CO 0.01 0.37 -0.08 0.42 -0.31 0.00 0.00 175.10 175.52 1pbn s THR 114 N -0.61 0.64 0.33 5.32 -4.23 -0.76 -1.00 115.64 115.33 1pbn s THR 114 Ca 0.08 -1.46 -0.18 0.00 -1.18 0.00 0.00 61.69 58.95 1pbn s THR 114 Cb -0.08 -1.09 0.05 0.00 1.34 0.00 0.00 72.50 72.72 1pbn s THR 114 CO 0.00 -0.58 0.80 0.54 -0.54 0.00 0.00 174.62 174.84 1pbn s ASN 115 N -2.21 -0.07 -0.12 3.99 6.03 -0.90 -1.87 114.94 119.78 1pbn s ASN 115 Ca -0.00 -0.93 0.00 0.00 -1.03 0.00 0.00 52.86 50.90 1pbn s ASN 115 Cb -0.04 0.78 -0.02 0.00 -3.03 0.00 0.00 41.25 38.94 1pbn s ASN 115 CO -0.02 -1.51 -0.13 0.00 -2.03 0.00 0.00 177.10 173.41 1pbn s ALA 116 N -2.77 2.64 0.10 3.54 0.00 -1.26 -0.83 121.76 123.18 1pbn s ALA 116 Ca 0.15 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.23 1pbn s ALA 116 Cb -0.05 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1pbn s ALA 116 CO 0.09 0.30 -0.07 0.00 0.00 0.00 0.00 175.76 176.09 1pbn s ALA 117 N 0.16 1.01 -0.15 0.00 0.00 -0.46 -4.80 121.76 117.52 1pbn s ALA 117 Ca -0.07 -1.33 -0.19 0.00 0.00 0.00 0.00 51.96 50.37 1pbn s ALA 117 Cb -0.15 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1pbn s ALA 117 CO 0.05 -0.21 0.52 0.20 0.00 0.00 0.00 175.76 176.32 1pbn s GLY 118 N -2.97 2.26 0.05 0.00 0.00 -0.36 -2.27 107.32 104.03 1pbn s GLY 118 Ca 0.11 -0.25 -0.31 0.00 0.00 0.00 0.00 44.72 44.27 1pbn s GLY 118 CO -0.04 0.96 1.38 -0.32 0.00 0.00 0.00 173.10 175.09 1pbn s GLY 119 N 0.88 1.95 -0.17 0.20 0.00 0.15 -1.40 107.32 108.93 1pbn s GLY 119 Ca 0.26 0.97 0.08 0.00 0.00 0.00 0.00 44.72 46.04 1pbn s GLY 119 CO 0.11 2.41 -0.05 1.04 0.00 0.00 0.00 173.10 176.61 1pbn n LEU 120 N 4.71 1.33 -4.70 0.66 4.77 -0.19 -2.03 117.00 121.55 1pbn n LEU 120 Ca 0.12 -0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.63 1pbn n LEU 120 Cb 0.43 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 1pbn n LEU 120 CO 0.58 0.57 1.16 0.21 -1.33 0.00 0.00 177.39 178.59 1pbn s ASN 121 N -5.29 6.77 0.60 -1.43 3.84 -0.93 -4.89 114.94 113.60 1pbn s ASN 121 Ca -0.16 2.29 0.31 0.00 0.21 0.00 0.00 52.86 55.51 1pbn s ASN 121 Cb 0.05 -2.57 1.82 0.00 -0.55 0.00 0.00 41.25 40.01 1pbn s ASN 121 CO 0.54 -0.75 2.20 -0.65 -2.79 0.00 0.00 177.10 175.65 1pbn h PRO 122 N 7.64 0.00 -0.00 0.43 0.11 -1.93 -2.46 132.00 135.79 1pbn h PRO 122 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1pbn h PRO 122 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1pbn h PRO 122 CO 0.90 0.00 -0.12 0.09 -0.21 0.00 0.00 178.00 178.66 1pbn n ASN 123 N -3.71 0.25 -4.75 -2.05 4.13 -1.26 -4.85 115.26 103.01 1pbn n ASN 123 Ca -0.01 -0.10 -0.40 0.00 1.68 0.00 0.00 54.58 55.75 1pbn n ASN 123 Cb 0.18 -0.19 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 1pbn n ASN 123 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1pbn s PHE 124 N -2.75 3.93 0.19 3.10 0.40 -0.93 -5.06 117.98 116.86 1pbn s PHE 124 Ca 0.21 1.81 0.10 0.00 -0.60 0.00 0.00 56.93 58.45 1pbn s PHE 124 Cb 0.19 -2.93 -0.04 0.00 0.51 0.00 0.00 43.02 40.75 1pbn s PHE 124 CO 0.53 0.43 -0.13 -1.21 0.70 0.00 0.00 175.22 175.54 1pbn s GLU 125 N -0.96 1.92 0.36 0.44 8.01 -1.26 -4.96 118.70 122.25 1pbn s GLU 125 Ca 0.40 -1.35 -0.28 0.00 0.01 0.00 0.00 54.97 53.75 1pbn s GLU 125 Cb -0.25 -2.07 -0.12 0.00 -4.31 0.00 0.00 34.13 27.38 1pbn s GLU 125 CO 0.30 0.42 1.40 1.33 0.01 0.00 0.00 175.26 178.72 1pbn n VAL 126 N 0.05 2.00 -0.41 2.63 0.24 -1.26 -1.48 118.33 120.10 1pbn n VAL 126 Ca -0.11 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 1pbn n VAL 126 Cb 0.56 -1.80 0.00 0.00 -1.47 0.00 0.00 33.84 31.12 1pbn n VAL 126 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1pbn n GLY 127 N 0.59 0.77 3.78 7.63 0.00 0.67 -5.04 105.19 113.59 1pbn n GLY 127 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1pbn n GLY 127 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pbn s ASP 128 N -2.99 6.49 -0.16 1.61 1.01 -0.55 -4.77 116.67 117.31 1pbn s ASP 128 Ca 0.00 2.06 -0.05 0.00 0.71 0.00 0.00 52.55 55.27 1pbn s ASP 128 Cb 0.00 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 1pbn s ASP 128 CO 0.00 -0.68 -0.00 -0.63 0.21 0.00 0.00 175.17 174.07 1pbn s ILE 129 N -1.73 4.22 -0.23 0.77 1.01 -1.26 -0.26 121.20 123.71 1pbn s ILE 129 Ca 0.62 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 61.05 1pbn s ILE 129 Cb -0.22 -2.87 0.04 0.00 0.01 0.00 0.00 42.46 39.43 1pbn s ILE 129 CO 0.27 0.49 -0.13 -0.32 0.00 0.00 0.00 174.94 175.24 1pbn s MET 130 N 0.32 2.52 0.11 2.79 1.75 -0.10 -2.11 119.30 124.58 1pbn s MET 130 Ca -0.01 -1.16 -0.31 0.00 -1.25 0.00 0.00 55.69 52.96 1pbn s MET 130 Cb -0.13 -2.80 -0.09 0.00 2.84 0.00 0.00 34.83 34.65 1pbn s MET 130 CO 0.02 -0.45 1.55 -1.17 -0.65 0.00 0.00 175.02 174.32 1pbn s LEU 131 N 1.18 4.36 -0.37 4.11 0.20 -0.11 -1.41 118.68 126.64 1pbn s LEU 131 Ca -0.04 2.47 -0.28 0.00 0.69 0.00 0.00 54.13 56.97 1pbn s LEU 131 Cb -0.18 -3.58 0.02 0.00 -0.43 0.00 0.00 46.19 42.03 1pbn s LEU 131 CO -0.07 -0.80 1.06 -0.63 -0.29 0.00 0.00 176.35 175.61 1pbn s ILE 132 N 1.77 4.44 -0.08 6.68 1.01 -0.52 -1.82 121.20 132.69 1pbn s ILE 132 Ca 0.70 1.48 -0.04 0.00 0.00 0.00 0.00 60.65 62.79 1pbn s ILE 132 Cb -0.40 -4.45 -0.27 0.00 0.01 0.00 0.00 42.46 37.35 1pbn s ILE 132 CO 0.31 -0.64 0.53 -0.09 0.00 0.00 0.00 174.94 175.05 1pbn h ARG 133 N 8.48 0.25 -2.95 2.79 2.43 -1.16 -3.43 114.38 120.80 1pbn h ARG 133 Ca -0.22 -0.43 0.05 0.00 -0.81 0.00 0.00 59.98 58.58 1pbn h ARG 133 Cb 1.06 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.74 1pbn h ARG 133 CO 1.05 1.12 0.27 0.34 -1.51 0.00 0.00 179.97 181.24 1pbn s ASP 134 N -6.95 -0.17 0.18 -3.80 -1.08 -1.19 -4.62 116.67 99.03 1pbn s ASP 134 Ca -0.17 -0.75 -0.01 0.00 -0.52 0.00 0.00 52.55 51.10 1pbn s ASP 134 Cb 0.07 0.74 -0.04 0.00 -1.46 0.00 0.00 42.92 42.23 1pbn s ASP 134 CO 0.81 -1.41 0.10 -1.38 0.52 0.00 0.00 175.17 173.81 1pbn s HIS 135 N -3.38 1.09 -0.15 -5.34 -3.43 -1.26 -0.94 115.29 101.88 1pbn s HIS 135 Ca 0.13 -1.32 -0.00 0.00 -0.80 0.00 0.00 55.06 53.07 1pbn s HIS 135 Cb -0.05 -0.56 0.03 0.00 -1.43 0.00 0.00 32.58 30.57 1pbn s HIS 135 CO 0.08 -0.58 -0.07 0.42 -2.00 0.00 0.00 174.74 172.59 1pbn s ILE 136 N -4.09 1.17 -1.03 -5.38 1.01 -0.18 -4.88 121.20 107.82 1pbn s ILE 136 Ca 0.34 -0.54 -0.12 0.00 0.00 0.00 0.00 60.65 60.33 1pbn s ILE 136 Cb 0.07 -1.25 0.23 0.00 0.01 0.00 0.00 42.46 41.52 1pbn s ILE 136 CO 0.09 0.25 1.07 0.21 0.00 0.00 0.00 174.94 176.56 1pbn s ASN 137 N 1.63 7.04 0.15 3.58 3.04 -1.26 -2.32 114.94 126.80 1pbn s ASN 137 Ca 0.03 -3.06 -0.17 0.00 0.04 0.00 0.00 52.86 49.70 1pbn s ASN 137 Cb -0.14 -2.26 0.05 0.00 -1.54 0.00 0.00 41.25 37.36 1pbn s ASN 137 CO -0.08 -0.53 1.72 -0.07 -3.04 0.00 0.00 177.10 175.09 1pbn h LEU 138 N 7.92 -0.05 -2.01 3.21 3.38 -1.95 -0.94 115.31 124.87 1pbn h LEU 138 Ca 0.18 0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.29 1pbn h LEU 138 Cb 0.94 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1pbn h LEU 138 CO 0.99 0.01 0.19 -0.65 0.09 0.00 0.00 178.44 179.07 1pbn h PRO 139 N 0.14 0.00 0.00 1.13 0.11 -1.86 -0.69 132.00 130.83 1pbn h PRO 139 Ca 0.16 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.21 1pbn h PRO 139 Cb 0.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 1pbn h PRO 139 CO -0.23 0.00 -0.25 0.78 -0.21 0.00 0.00 178.00 178.09 1pbn h GLY 140 N 0.00 0.00 1.42 -0.55 0.00 -1.21 -2.41 103.07 100.32 1pbn h GLY 140 Ca 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.40 1pbn h GLY 140 CO -0.00 0.00 0.10 0.74 0.00 0.00 0.00 176.54 177.37 1pbn h PHE 141 N 0.00 0.75 -0.01 5.60 -1.00 -0.93 -2.43 116.94 118.93 1pbn h PHE 141 Ca -0.00 -0.07 0.00 0.00 2.81 0.00 0.00 57.97 60.71 1pbn h PHE 141 Cb 0.55 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 39.89 1pbn h PHE 141 CO 0.00 0.65 -0.07 -1.13 -1.61 0.00 0.00 178.31 176.15 1pbn n SER 142 N -4.28 0.78 0.00 2.17 3.41 -1.02 -4.91 113.62 109.76 1pbn n SER 142 Ca 0.03 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.64 1pbn n SER 142 Cb 0.23 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1pbn n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pbn n GLY 143 N 1.20 0.18 3.56 5.00 0.00 -0.91 -5.01 105.19 109.20 1pbn n GLY 143 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1pbn n GLY 143 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pbn s GLU 144 N -0.88 3.25 -0.02 1.61 2.02 -0.94 -4.89 118.70 118.84 1pbn s GLU 144 Ca 0.00 -0.60 0.01 0.00 0.02 0.00 0.00 54.97 54.41 1pbn s GLU 144 Cb 0.00 -4.89 0.01 0.00 0.10 0.00 0.00 34.13 29.35 1pbn s GLU 144 CO 0.00 -2.40 -0.05 1.21 0.02 0.00 0.00 175.26 174.04 1pbn s ASN 145 N 5.31 0.77 0.50 -0.19 3.84 -1.26 -3.52 114.94 120.39 1pbn s ASN 145 Ca 0.48 -0.11 0.30 0.00 0.21 0.00 0.00 52.86 53.74 1pbn s ASN 145 Cb -0.04 -0.23 1.65 0.00 -0.55 0.00 0.00 41.25 42.07 1pbn s ASN 145 CO 0.01 0.01 1.92 1.55 -2.79 0.00 0.00 177.10 177.80 1pbn h PRO 146 N 6.55 0.00 -0.41 0.43 0.13 -1.90 -1.21 132.00 135.58 1pbn h PRO 146 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1pbn h PRO 146 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1pbn h PRO 146 CO 0.49 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.54 1pbn n LEU 147 N -2.63 3.05 -4.75 1.56 4.77 -1.26 -4.46 117.00 113.28 1pbn n LEU 147 Ca -0.02 -1.38 -0.41 0.00 -0.03 0.00 0.00 56.01 54.17 1pbn n LEU 147 Cb 0.14 -0.27 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1pbn n LEU 147 CO 0.13 0.69 1.10 -0.60 -1.33 0.00 0.00 177.39 177.39 1pbn s ARG 148 N -1.46 4.26 0.00 3.23 3.52 -0.46 -4.77 118.95 123.27 1pbn s ARG 148 Ca 0.38 2.32 0.00 0.00 -0.13 0.00 0.00 55.73 58.30 1pbn s ARG 148 Cb 0.21 -3.09 0.00 0.00 -1.56 0.00 0.00 34.95 30.51 1pbn s ARG 148 CO 0.29 -0.42 0.00 0.41 -0.81 0.00 0.00 175.30 174.78 1pbn n GLY 149 N 2.00 -0.67 3.74 8.12 0.00 -1.26 -3.26 105.19 113.86 1pbn n GLY 149 Ca 0.06 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 1pbn n GLY 149 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1pbn n PRO 150 N -0.02 2.74 -2.79 1.61 -0.02 -1.26 -4.97 135.00 130.29 1pbn n PRO 150 Ca 0.00 0.98 -0.40 0.00 -2.02 0.00 0.00 63.50 62.06 1pbn n PRO 150 Cb 0.00 -2.78 -0.06 0.00 -0.02 0.00 0.00 33.50 30.64 1pbn n PRO 150 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1pbn s ASN 151 N 0.66 7.60 -0.54 2.55 2.47 -1.26 -4.92 114.94 121.50 1pbn s ASN 151 Ca 0.66 1.89 -0.19 0.00 0.42 0.00 0.00 52.86 55.65 1pbn s ASN 151 Cb -0.49 -2.59 0.08 0.00 -1.45 0.00 0.00 41.25 36.80 1pbn s ASN 151 CO 0.45 0.16 0.64 -0.70 -3.72 0.00 0.00 177.10 173.93 1pbn s GLU 152 N -1.19 3.08 0.44 0.43 2.56 -1.26 -4.93 118.70 117.83 1pbn s GLU 152 Ca 0.40 -1.12 0.15 0.00 0.00 0.00 0.00 54.97 54.39 1pbn s GLU 152 Cb -0.25 -4.18 1.06 0.00 2.00 0.00 0.00 34.13 32.76 1pbn s GLU 152 CO 0.31 -1.35 1.98 1.05 -0.56 0.00 0.00 175.26 176.69 1pbn h GLU 153 N 9.06 0.36 0.00 4.30 9.09 -1.96 -0.74 114.58 134.70 1pbn h GLU 153 Ca -0.28 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.10 1pbn h GLU 153 Cb 1.09 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 28.11 1pbn h GLU 153 CO 1.02 0.24 0.00 0.54 0.05 0.00 0.00 179.01 180.86 1pbn n ARG 154 N -4.47 0.04 -0.09 1.06 1.74 -1.26 -2.94 116.66 110.74 1pbn n ARG 154 Ca 0.10 0.28 -0.14 0.00 -0.77 0.00 0.00 57.85 57.31 1pbn n ARG 154 Cb 0.38 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.25 1pbn n ARG 154 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1pbn n PHE 155 N -1.45 0.00 -4.00 -1.55 3.72 -0.32 -5.12 117.46 108.73 1pbn n PHE 155 Ca 0.03 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.45 1pbn n PHE 155 Cb 0.12 -0.66 0.00 0.00 -0.94 0.00 0.00 39.48 38.00 1pbn n PHE 155 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pbn n GLY 156 N 2.43 0.30 3.88 1.37 0.00 -0.96 -3.98 105.19 108.23 1pbn n GLY 156 Ca -0.32 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 1pbn n GLY 156 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pbn s VAL 157 N -2.01 4.36 0.13 1.61 -7.23 -1.26 -4.10 120.40 111.90 1pbn s VAL 157 Ca 0.12 0.67 -0.15 0.00 -1.81 0.00 0.00 61.98 60.82 1pbn s VAL 157 Cb -0.00 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.19 1pbn s VAL 157 CO -0.01 -0.96 1.67 -0.09 -0.31 0.00 0.00 175.10 175.40 1pbn h ARG 158 N -0.35 0.64 -3.16 4.82 9.65 -1.97 -3.36 114.38 120.65 1pbn h ARG 158 Ca -0.45 -0.13 -0.64 0.00 -1.10 0.00 0.00 59.98 57.66 1pbn h ARG 158 Cb 1.21 -0.10 -0.40 0.00 -1.39 0.00 0.00 29.97 29.29 1pbn h ARG 158 CO 0.62 0.62 -0.45 -0.06 2.80 0.00 0.00 179.97 183.50 1pbn s PHE 159 N -5.46 3.65 0.43 2.20 0.08 -1.26 -5.08 117.98 112.54 1pbn s PHE 159 Ca -0.13 -3.26 -0.21 0.00 0.12 0.00 0.00 56.93 53.45 1pbn s PHE 159 Cb 0.10 -2.86 -0.10 0.00 -0.57 0.00 0.00 43.02 39.59 1pbn s PHE 159 CO 0.76 -0.60 0.97 -1.25 -0.10 0.00 0.00 175.22 175.00 1pbn s PRO 160 N -1.39 4.19 0.32 0.24 0.04 -1.26 -5.06 135.00 132.08 1pbn s PRO 160 Ca 0.25 1.18 -0.14 0.00 0.04 0.00 0.00 61.00 62.33 1pbn s PRO 160 Cb -0.06 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 32.17 1pbn s PRO 160 CO -0.15 -0.07 0.72 0.00 0.04 0.00 0.00 177.00 177.54 1pbn s ALA 161 N -2.09 3.34 0.00 8.56 0.00 -1.26 -4.98 121.76 125.32 1pbn s ALA 161 Ca 0.62 0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.59 1pbn s ALA 161 Cb -0.11 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.27 1pbn s ALA 161 CO 0.15 0.33 0.09 -1.33 0.00 0.00 0.00 175.76 175.01 1pbn n MET 162 N -0.38 4.19 0.07 0.00 2.81 -1.26 -4.75 117.12 117.79 1pbn n MET 162 Ca 0.03 -0.09 0.05 0.00 -1.81 0.00 0.00 57.70 55.89 1pbn n MET 162 Cb 0.53 -0.51 0.28 0.00 -0.71 0.00 0.00 33.22 32.80 1pbn n MET 162 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1pbn n SER 163 N -0.62 0.25 -0.70 7.83 3.41 -1.26 -2.09 113.62 120.43 1pbn n SER 163 Ca 0.00 0.60 0.05 0.00 -0.26 0.00 0.00 58.87 59.26 1pbn n SER 163 Cb 0.01 -0.64 0.09 0.00 -0.26 0.00 0.00 64.21 63.41 1pbn n SER 163 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1pbn n ASP 164 N -1.82 1.22 -0.31 4.04 5.75 -1.26 -4.89 116.55 119.27 1pbn n ASP 164 Ca 0.00 -2.70 0.03 0.00 -0.01 0.00 0.00 54.79 52.11 1pbn n ASP 164 Cb 0.05 -0.36 0.22 0.00 -1.03 0.00 0.00 41.12 40.00 1pbn n ASP 164 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1pbn h ALA 165 N 0.52 1.48 -2.08 2.12 0.00 -1.73 -3.38 119.26 116.19 1pbn h ALA 165 Ca -0.06 -0.03 -0.69 0.00 0.00 0.00 0.00 54.91 54.13 1pbn h ALA 165 Cb 1.35 -0.28 -0.18 0.00 0.00 0.00 0.00 17.79 18.68 1pbn h ALA 165 CO 0.03 0.39 0.06 0.71 0.00 0.00 0.00 179.25 180.43 1pbn s TYR 166 N -5.93 3.04 -0.28 0.00 2.02 -1.26 -4.09 117.35 110.85 1pbn s TYR 166 Ca -0.12 -0.57 -0.43 0.00 -0.37 0.00 0.00 57.07 55.58 1pbn s TYR 166 Cb 0.20 -3.58 -0.19 0.00 -0.40 0.00 0.00 41.96 37.99 1pbn s TYR 166 CO 0.80 -1.06 1.47 -3.47 -1.57 0.00 0.00 175.55 171.72 1pbn n ASP 167 N 6.19 1.14 0.03 2.29 2.03 0.83 -4.89 116.55 124.17 1pbn n ASP 167 Ca -0.07 1.16 -0.18 0.00 0.52 0.00 0.00 54.79 56.22 1pbn n ASP 167 Cb 0.45 -0.96 -0.08 0.00 -0.72 0.00 0.00 41.12 39.80 1pbn n ASP 167 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1pbn h ARG 168 N 4.84 0.66 -0.76 -0.67 -0.00 -1.89 -2.87 114.38 113.69 1pbn h ARG 168 Ca -0.47 -0.67 0.01 0.00 -0.00 0.00 0.00 59.98 58.85 1pbn h ARG 168 Cb 1.37 0.18 -0.04 0.00 -0.00 0.00 0.00 29.97 31.48 1pbn h ARG 168 CO 0.87 1.26 0.50 -0.44 -0.00 0.00 0.00 179.97 182.17 1pbn h ASP 169 N 0.39 0.87 0.74 0.08 3.32 -2.00 -1.64 116.42 118.19 1pbn h ASP 169 Ca -0.10 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.88 1pbn h ASP 169 Cb 1.61 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.94 1pbn h ASP 169 CO 0.19 0.63 -0.24 0.24 -1.72 0.00 0.00 179.24 178.34 1pbn h MET 170 N 1.03 0.00 -0.16 3.56 2.86 -1.95 -2.24 114.93 118.03 1pbn h MET 170 Ca 0.28 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.73 1pbn h MET 170 Cb -0.11 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 1pbn h MET 170 CO -0.06 0.24 -0.67 0.00 1.06 0.00 0.00 176.91 177.47 1pbn h ARG 171 N 0.00 0.62 -0.66 1.72 3.08 -1.08 -0.88 114.38 117.19 1pbn h ARG 171 Ca -0.00 -0.46 -0.07 0.00 0.07 0.00 0.00 59.98 59.52 1pbn h ARG 171 Cb 0.67 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 1pbn h ARG 171 CO 0.03 1.08 0.13 1.96 -1.07 0.00 0.00 179.97 182.10 1pbn h GLN 172 N 0.45 1.06 -0.66 0.04 4.20 -1.11 -2.11 115.11 116.98 1pbn h GLN 172 Ca -0.02 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.39 1pbn h GLN 172 Cb 1.26 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.87 1pbn h GLN 172 CO 0.13 0.95 0.25 0.87 -0.67 0.00 0.00 178.83 180.36 1pbn h LYS 173 N 1.00 0.99 -0.23 1.46 6.56 -1.24 -2.18 116.57 122.93 1pbn h LYS 173 Ca 0.20 -0.19 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1pbn h LYS 173 Cb 0.39 -0.16 -0.01 0.00 -0.57 0.00 0.00 32.23 31.88 1pbn h LYS 173 CO 0.01 0.83 0.14 0.00 -2.06 0.00 0.00 179.45 178.37 1pbn h ALA 174 N 1.11 0.29 0.07 3.86 0.00 -0.73 -0.32 119.26 123.52 1pbn h ALA 174 Ca 0.22 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1pbn h ALA 174 Cb 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1pbn h ALA 174 CO -0.02 -0.22 -0.03 0.45 0.00 0.00 0.00 179.25 179.43 1pbn h HIS 175 N 0.29 -0.08 -0.39 0.00 3.86 -1.28 -0.24 115.15 117.31 1pbn h HIS 175 Ca 0.08 -0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.33 1pbn h HIS 175 Cb -0.00 0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 1pbn h HIS 175 CO -0.05 0.03 0.17 0.77 0.86 0.00 0.00 177.93 179.70 1pbn h SER 176 N -0.18 0.21 -0.84 2.45 0.02 -1.33 -1.87 113.55 112.02 1pbn h SER 176 Ca -0.01 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1pbn h SER 176 Cb 0.15 -0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 1pbn h SER 176 CO 0.01 0.16 0.54 0.74 -1.14 0.00 0.00 176.83 177.15 1pbn h THR 177 N 0.35 1.14 -0.82 -2.27 2.02 -0.88 -2.07 112.91 110.37 1pbn h THR 177 Ca 0.17 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 1pbn h THR 177 Cb 0.12 -0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 66.48 1pbn h THR 177 CO -0.15 0.19 0.46 -0.25 0.37 0.00 0.00 175.52 176.14 1pbn h TRP 178 N 1.06 1.12 -0.42 3.16 2.91 -0.48 -1.89 115.95 121.41 1pbn h TRP 178 Ca 0.33 -0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.34 1pbn h TRP 178 Cb -0.00 -0.36 -0.02 0.00 -0.51 0.00 0.00 29.16 28.26 1pbn h TRP 178 CO -0.02 0.78 0.26 0.87 -1.03 0.00 0.00 178.44 179.30 1pbn h LYS 179 N 1.14 0.52 -0.11 2.65 1.57 -0.69 -1.42 116.57 120.23 1pbn h LYS 179 Ca 0.29 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 59.04 1pbn h LYS 179 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1pbn h LYS 179 CO -0.05 0.34 0.07 1.96 -0.57 0.00 0.00 179.45 181.21 1pbn h GLN 180 N 0.53 0.12 0.00 3.15 4.20 -0.84 -0.78 115.11 121.50 1pbn h GLN 180 Ca 0.16 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1pbn h GLN 180 Cb -0.02 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1pbn h GLN 180 CO -0.06 0.08 0.00 0.52 -0.67 0.00 0.00 178.83 178.70 1pbn h MET 181 N 0.13 0.00 -3.73 1.46 2.86 -0.49 -3.46 114.93 111.71 1pbn h MET 181 Ca 0.04 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.40 1pbn h MET 181 Cb 0.01 0.00 0.07 0.00 0.06 0.00 0.00 31.60 31.74 1pbn h MET 181 CO -0.01 0.00 -0.44 0.41 1.06 0.00 0.00 176.91 177.93 1pbn n GLY 182 N -0.88 -0.12 3.77 8.32 0.00 -0.30 -4.98 105.19 111.00 1pbn n GLY 182 Ca -0.01 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 1pbn n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pbn s GLU 183 N -5.59 4.67 0.05 1.61 0.41 -1.26 -4.98 118.70 113.61 1pbn s GLU 183 Ca 0.30 1.42 -0.17 0.00 -0.41 0.00 0.00 54.97 56.11 1pbn s GLU 183 Cb -0.13 -2.99 -0.17 0.00 -1.78 0.00 0.00 34.13 29.06 1pbn s GLU 183 CO 0.37 0.35 1.25 0.37 -0.49 0.00 0.00 175.26 177.11 1pbn h GLN 184 N 3.54 0.55 -6.65 1.61 5.75 -1.97 -3.44 115.11 114.50 1pbn h GLN 184 Ca -0.46 -0.42 -0.51 0.00 -0.15 0.00 0.00 58.65 57.11 1pbn h GLN 184 Cb 1.20 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.80 1pbn h GLN 184 CO 0.66 1.05 0.10 0.50 -2.65 0.00 0.00 178.83 178.49 1pbn s ARG 185 N -3.77 4.12 0.50 1.69 6.06 -1.26 -5.06 118.95 121.23 1pbn s ARG 185 Ca -0.13 0.76 -0.14 0.00 -2.50 0.00 0.00 55.73 53.72 1pbn s ARG 185 Cb 0.06 -2.64 -0.07 0.00 0.06 0.00 0.00 34.95 32.35 1pbn s ARG 185 CO 0.83 0.27 0.93 -1.21 -2.50 0.00 0.00 175.30 173.62 1pbn s GLU 186 N -2.50 3.87 -0.20 5.12 8.01 -1.26 -5.01 118.70 126.72 1pbn s GLU 186 Ca 0.49 0.81 -0.29 0.00 0.01 0.00 0.00 54.97 55.98 1pbn s GLU 186 Cb -0.13 -2.20 -0.00 0.00 -4.31 0.00 0.00 34.13 27.49 1pbn s GLU 186 CO 0.19 -0.24 1.14 -1.17 0.01 0.00 0.00 175.26 175.19 1pbn s LEU 187 N -4.14 4.14 0.79 1.80 2.96 -1.26 -4.84 118.68 118.14 1pbn s LEU 187 Ca 0.56 1.53 -0.12 0.00 -0.22 0.00 0.00 54.13 55.89 1pbn s LEU 187 Cb -0.10 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.12 1pbn s LEU 187 CO 0.34 -0.71 1.14 -1.10 -1.32 0.00 0.00 176.35 174.70 1pbn s GLN 188 N 3.30 2.15 -0.27 1.98 -1.52 -0.90 -4.92 119.66 119.48 1pbn s GLN 188 Ca 0.49 0.30 -0.16 0.00 -1.95 0.00 0.00 55.36 54.04 1pbn s GLN 188 Cb -0.18 -1.95 0.08 0.00 -0.22 0.00 0.00 33.01 30.73 1pbn s GLN 188 CO 0.10 -1.50 0.66 -2.00 -0.25 0.00 0.00 175.29 172.30 1pbn s GLU 189 N -5.43 0.69 0.00 2.91 2.12 -1.26 -0.93 118.70 116.80 1pbn s GLU 189 Ca 0.61 1.17 0.00 0.00 0.36 0.00 0.00 54.97 57.11 1pbn s GLU 189 Cb -0.12 0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.41 1pbn s GLU 189 CO 0.51 -0.15 0.00 0.41 -0.54 0.00 0.00 175.26 175.49 1pbn n GLY 190 N 4.19 1.22 3.66 -1.50 0.00 -0.75 -4.93 105.19 107.09 1pbn n GLY 190 Ca -0.20 -0.82 -0.38 0.00 0.00 0.00 0.00 46.02 44.62 1pbn n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pbn s THR 191 N -2.41 5.22 -0.12 2.61 2.01 -1.26 -0.54 115.64 121.16 1pbn s THR 191 Ca 0.00 0.62 -0.14 0.00 0.31 0.00 0.00 61.69 62.48 1pbn s THR 191 Cb 0.00 -3.69 -0.05 0.00 0.01 0.00 0.00 72.50 68.77 1pbn s THR 191 CO 0.00 0.25 0.32 -0.47 -0.69 0.00 0.00 174.62 174.03 1pbn s TYR 192 N 1.36 3.54 -0.10 4.92 5.04 -0.11 -0.70 117.35 131.29 1pbn s TYR 192 Ca 0.17 0.71 -0.00 0.00 -2.44 0.00 0.00 57.07 55.50 1pbn s TYR 192 Cb -0.15 -2.30 -0.02 0.00 0.35 0.00 0.00 41.96 39.84 1pbn s TYR 192 CO 0.08 0.38 -0.09 0.54 -1.34 0.00 0.00 175.55 175.11 1pbn s VAL 193 N -0.04 3.43 -0.02 3.14 0.11 0.42 -1.01 120.40 126.43 1pbn s VAL 193 Ca 0.19 -0.55 0.05 0.00 -2.93 0.00 0.00 61.98 58.74 1pbn s VAL 193 Cb -0.14 -2.43 -0.03 0.00 -1.53 0.00 0.00 36.38 32.25 1pbn s VAL 193 CO 0.07 0.55 -0.16 -0.32 -3.33 0.00 0.00 175.10 171.91 1pbn s MET 194 N -0.16 2.34 0.15 1.54 1.75 -0.98 -1.39 119.30 122.54 1pbn s MET 194 Ca 0.01 -0.81 0.01 0.00 -1.25 0.00 0.00 55.69 53.65 1pbn s MET 194 Cb -0.13 -2.29 -0.04 0.00 2.84 0.00 0.00 34.83 35.20 1pbn s MET 194 CO 0.03 0.59 0.01 -0.48 -0.65 0.00 0.00 175.02 174.52 1pbn s LEU 195 N -0.98 2.10 0.15 4.11 0.05 -0.84 -3.08 118.68 120.19 1pbn s LEU 195 Ca 0.13 -1.16 -0.17 0.00 0.05 0.00 0.00 54.13 52.98 1pbn s LEU 195 Cb -0.11 0.02 0.02 0.00 -2.05 0.00 0.00 46.19 44.08 1pbn s LEU 195 CO 0.02 -0.59 1.78 1.23 -0.55 0.00 0.00 176.35 178.24 1pbn h GLY 196 N 2.77 0.47 0.00 -3.48 0.00 -1.92 -3.38 103.07 97.53 1pbn h GLY 196 Ca -0.36 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1pbn h GLY 196 CO 0.62 0.12 0.00 0.61 0.00 0.00 0.00 176.54 177.89 1pbn n GLY 197 N -1.20 -1.88 0.14 4.60 0.00 -1.26 -4.14 105.19 101.45 1pbn n GLY 197 Ca 0.00 -1.66 0.12 0.00 0.00 0.00 0.00 46.02 44.48 1pbn n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pbn h PRO 198 N 0.00 0.00 -7.29 1.61 0.13 -1.96 -3.47 132.00 121.01 1pbn h PRO 198 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 1pbn h PRO 198 Cb 0.00 0.00 0.16 0.00 0.13 0.00 0.00 31.00 31.29 1pbn h PRO 198 CO 0.00 0.00 0.29 0.54 -0.23 0.00 0.00 178.00 178.60 1pbn s ASN 199 N -5.42 3.93 0.43 1.44 4.22 -1.26 -5.02 114.94 113.26 1pbn s ASN 199 Ca 0.04 1.97 -0.06 0.00 -2.14 0.00 0.00 52.86 52.67 1pbn s ASN 199 Cb 0.09 -2.54 -0.04 0.00 1.28 0.00 0.00 41.25 40.03 1pbn s ASN 199 CO 0.72 -2.43 0.73 -0.36 -2.04 0.00 0.00 177.10 173.73 1pbn s PHE 200 N -2.78 3.53 0.73 1.54 0.08 -1.26 -5.07 117.98 114.75 1pbn s PHE 200 Ca 0.64 0.80 -0.12 0.00 0.12 0.00 0.00 56.93 58.37 1pbn s PHE 200 Cb -0.19 -2.27 0.04 0.00 -0.57 0.00 0.00 43.02 40.02 1pbn s PHE 200 CO 0.56 -0.15 1.09 -1.21 -0.10 0.00 0.00 175.22 175.41 1pbn s GLU 201 N -4.37 2.47 0.46 0.44 8.01 -1.26 -5.06 118.70 119.39 1pbn s GLU 201 Ca 0.47 1.20 0.05 0.00 0.01 0.00 0.00 54.97 56.70 1pbn s GLU 201 Cb -0.10 -1.92 0.01 0.00 -4.31 0.00 0.00 34.13 27.81 1pbn s GLU 201 CO 0.39 -1.48 0.64 0.95 0.01 0.00 0.00 175.26 175.77 1pbn s THR 202 N -2.77 3.11 0.12 3.63 -4.23 -1.26 -4.89 115.64 109.34 1pbn s THR 202 Ca 0.62 -0.83 -0.20 0.00 -1.18 0.00 0.00 61.69 60.10 1pbn s THR 202 Cb -0.18 -3.10 -0.07 0.00 1.34 0.00 0.00 72.50 70.50 1pbn s THR 202 CO 0.52 -0.05 1.73 0.58 -0.54 0.00 0.00 174.62 176.86 1pbn h VAL 203 N 0.44 0.91 -1.00 2.29 2.07 -1.96 0.46 116.25 119.45 1pbn h VAL 203 Ca -0.42 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.19 1pbn h VAL 203 Cb 1.28 0.83 -0.08 0.00 -1.52 0.00 0.00 31.29 31.80 1pbn h VAL 203 CO 0.50 0.01 0.63 0.00 0.02 0.00 0.00 177.57 178.73 1pbn h ALA 204 N 1.13 1.50 -0.26 1.67 0.00 -1.94 0.81 119.26 122.17 1pbn h ALA 204 Ca 0.07 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 1pbn h ALA 204 Cb 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1pbn h ALA 204 CO -0.11 0.26 -0.52 0.93 0.00 0.00 0.00 179.25 179.81 1pbn h GLU 205 N 1.02 0.82 -0.78 0.00 5.08 -1.81 -2.29 114.58 116.62 1pbn h GLU 205 Ca 0.49 -0.53 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1pbn h GLU 205 Cb 0.45 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1pbn h GLU 205 CO -0.25 1.15 0.33 0.00 -1.00 0.00 0.00 179.01 179.24 1pbn h ARG 207 N 1.12 0.89 -0.03 0.00 3.08 -0.87 -1.71 114.38 116.87 1pbn h ARG 207 Ca 0.26 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 1pbn h ARG 207 Cb 0.18 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 1pbn h ARG 207 CO -0.03 0.67 0.02 1.25 -1.07 0.00 0.00 179.97 180.81 1pbn h LEU 208 N 0.87 0.03 -0.55 3.04 5.85 -0.91 -0.65 115.31 122.99 1pbn h LEU 208 Ca 0.23 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.98 1pbn h LEU 208 Cb 0.03 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.00 1pbn h LEU 208 CO -0.04 0.05 0.23 -0.07 -0.34 0.00 0.00 178.44 178.28 1pbn h LEU 209 N 0.01 0.28 -0.29 2.25 -0.00 -0.93 -2.06 115.31 114.57 1pbn h LEU 209 Ca 0.01 0.05 -0.06 0.00 -0.00 0.00 0.00 57.88 57.89 1pbn h LEU 209 Cb 0.03 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 40.69 1pbn h LEU 209 CO -0.00 0.19 -0.05 -0.09 -0.00 0.00 0.00 178.44 178.49 1pbn h ARG 210 N 0.44 0.53 0.00 1.13 9.65 -1.15 -2.57 114.38 122.41 1pbn h ARG 210 Ca 0.26 -0.19 -0.00 0.00 -1.10 0.00 0.00 59.98 58.95 1pbn h ARG 210 Cb 0.25 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.80 1pbn h ARG 210 CO -0.23 0.72 -0.01 -0.91 2.80 0.00 0.00 179.97 182.34 1pbn h ASN 211 N 0.30 0.00 0.92 -3.80 2.35 -0.81 0.16 115.58 114.70 1pbn h ASN 211 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1pbn h ASN 211 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1pbn h ASN 211 CO 0.02 0.01 0.00 0.18 -1.65 0.00 0.00 177.43 175.99 1pbn n LEU 212 N -3.90 0.00 0.00 1.61 4.77 -0.80 -4.89 117.00 113.78 1pbn n LEU 212 Ca -0.03 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1pbn n LEU 212 Cb 0.09 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.69 1pbn n LEU 212 CO 0.28 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1pbn n GLY 213 N 1.28 1.09 3.77 -0.72 0.00 0.57 -5.09 105.19 106.08 1pbn n GLY 213 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1pbn n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pbn s ALA 214 N -2.00 3.24 -0.16 4.61 0.00 -1.00 -4.71 121.76 121.74 1pbn s ALA 214 Ca 0.00 0.80 0.15 0.00 0.00 0.00 0.00 51.96 52.91 1pbn s ALA 214 Cb 0.00 -3.30 -0.20 0.00 0.00 0.00 0.00 23.12 19.62 1pbn s ALA 214 CO 0.00 -0.19 0.06 -0.25 0.00 0.00 0.00 175.76 175.37 1pbn n ASP 215 N 0.55 0.93 -3.74 0.00 8.00 0.12 -4.41 116.55 118.01 1pbn n ASP 215 Ca 0.02 -0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.39 1pbn n ASP 215 Cb 0.47 0.91 -0.08 0.00 -0.02 0.00 0.00 41.12 42.40 1pbn n ASP 215 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pbn s ALA 216 N -2.40 -0.82 -0.04 2.24 0.00 -1.11 -1.02 121.76 118.62 1pbn s ALA 216 Ca -0.08 0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.19 1pbn s ALA 216 Cb 0.05 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 1pbn s ALA 216 CO 0.68 -0.34 -0.17 0.54 0.00 0.00 0.00 175.76 176.47 1pbn s VAL 217 N -1.85 1.43 0.35 0.00 0.11 -0.49 -0.44 120.40 119.50 1pbn s VAL 217 Ca -0.10 -0.73 -0.05 0.00 -2.93 0.00 0.00 61.98 58.17 1pbn s VAL 217 Cb -0.03 -1.22 0.01 0.00 -1.53 0.00 0.00 36.38 33.61 1pbn s VAL 217 CO 0.01 0.41 0.53 -0.83 -3.33 0.00 0.00 175.10 171.89 1pbn s GLY 218 N -0.07 1.27 -0.27 6.54 0.00 -0.49 -1.22 107.32 113.07 1pbn s GLY 218 Ca -0.01 -1.36 0.09 0.00 0.00 0.00 0.00 44.72 43.43 1pbn s GLY 218 CO 0.02 -0.87 1.33 1.03 0.00 0.00 0.00 173.10 174.60 1pbn n MET 219 N -0.55 2.17 -0.47 2.90 2.81 -1.26 -1.98 117.12 120.74 1pbn n MET 219 Ca -0.01 -3.47 0.00 0.00 -1.81 0.00 0.00 57.70 52.42 1pbn n MET 219 Cb 0.61 -1.86 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 1pbn n MET 219 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1pbn n SER 220 N -1.02 0.00 0.00 7.83 3.41 -1.26 -4.70 113.62 117.88 1pbn n SER 220 Ca 0.31 -0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 1pbn n SER 220 Cb 0.87 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.82 1pbn n SER 220 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1pbn n THR 221 N 0.00 0.00 -0.23 6.66 -1.04 -1.26 -4.69 114.28 113.72 1pbn n THR 221 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.04 1pbn n THR 221 Cb 0.00 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 68.64 1pbn n THR 221 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1pbn h VAL 222 N 0.00 0.45 -0.11 12.58 2.07 -1.98 -1.07 116.25 128.19 1pbn h VAL 222 Ca 0.00 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1pbn h VAL 222 Cb 0.00 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1pbn h VAL 222 CO 0.00 0.03 -0.01 -0.65 0.02 0.00 0.00 177.57 176.95 1pbn h PRO 223 N 0.14 0.16 -0.07 1.57 0.11 -2.00 -1.22 132.00 130.69 1pbn h PRO 223 Ca 0.37 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 66.25 1pbn h PRO 223 Cb 0.62 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1pbn h PRO 223 CO -0.56 0.19 -0.81 0.93 -0.21 0.00 0.00 178.00 177.53 1pbn h GLU 224 N 0.16 0.52 -0.40 1.05 5.08 -1.60 -2.60 114.58 116.78 1pbn h GLU 224 Ca 0.04 -0.46 -0.12 0.00 -1.00 0.00 0.00 59.36 57.82 1pbn h GLU 224 Cb 0.14 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1pbn h GLU 224 CO 0.00 1.09 -0.22 0.28 -1.00 0.00 0.00 179.01 179.16 1pbn h VAL 225 N 0.33 1.27 0.95 3.13 2.07 -0.58 -0.70 116.25 122.72 1pbn h VAL 225 Ca -0.05 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.07 1pbn h VAL 225 Cb 1.42 1.20 0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1pbn h VAL 225 CO 0.15 0.45 -0.49 0.40 0.02 0.00 0.00 177.57 178.10 1pbn h ILE 226 N 0.70 0.01 -0.87 4.57 1.08 -1.19 -0.01 117.51 121.81 1pbn h ILE 226 Ca 0.10 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.61 1pbn h ILE 226 Cb 0.75 0.01 -0.06 0.00 -3.07 0.00 0.00 36.82 34.45 1pbn h ILE 226 CO 0.06 0.00 0.55 0.58 -0.69 0.00 0.00 178.15 178.65 1pbn h VAL 227 N -1.31 1.10 -0.53 1.67 2.07 -1.46 0.12 116.25 117.91 1pbn h VAL 227 Ca -0.13 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 1pbn h VAL 227 Cb 1.02 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1pbn h VAL 227 CO 0.19 0.19 0.25 0.00 0.02 0.00 0.00 177.57 178.22 1pbn h ALA 228 N 1.38 0.68 -0.12 1.67 0.00 -1.01 -1.62 119.26 120.25 1pbn h ALA 228 Ca 0.36 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 1pbn h ALA 228 Cb 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1pbn h ALA 228 CO -0.14 0.25 -0.41 0.00 0.00 0.00 0.00 179.25 178.94 1pbn h ARG 229 N 0.71 0.28 -0.48 0.00 2.47 -0.38 0.15 114.38 117.13 1pbn h ARG 229 Ca 0.18 -0.13 -0.08 0.00 -1.26 0.00 0.00 59.98 58.69 1pbn h ARG 229 Cb 0.13 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.42 1pbn h ARG 229 CO -0.02 0.65 -0.03 1.25 0.56 0.00 0.00 179.97 182.38 1pbn h HIS 230 N 0.23 0.87 -0.35 3.04 2.76 -0.28 -2.59 115.15 118.83 1pbn h HIS 230 Ca 0.02 -0.13 0.00 0.00 -2.20 0.00 0.00 60.37 58.06 1pbn h HIS 230 Cb 0.83 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.56 1pbn h HIS 230 CO 0.02 0.81 0.00 0.00 -1.30 0.00 0.00 177.93 177.46 1pbn n GLY 232 N 1.35 0.79 3.79 0.00 0.00 -0.75 -4.95 105.19 105.41 1pbn n GLY 232 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1pbn n GLY 232 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pbn s LEU 233 N 0.00 4.13 0.12 0.99 1.43 0.45 -4.98 118.68 120.82 1pbn s LEU 233 Ca 0.00 1.99 -0.30 0.00 -1.03 0.00 0.00 54.13 54.79 1pbn s LEU 233 Cb 0.00 -4.22 -0.06 0.00 0.03 0.00 0.00 46.19 41.94 1pbn s LEU 233 CO 0.00 -0.46 1.04 -0.60 0.23 0.00 0.00 176.35 176.55 1pbn s ARG 234 N -2.55 4.63 0.05 1.70 3.52 -0.50 -4.37 118.95 121.43 1pbn s ARG 234 Ca 0.58 1.58 0.06 0.00 -0.13 0.00 0.00 55.73 57.82 1pbn s ARG 234 Cb -0.20 -3.34 -0.02 0.00 -1.56 0.00 0.00 34.95 29.82 1pbn s ARG 234 CO 0.26 0.10 -0.16 0.08 -0.81 0.00 0.00 175.30 174.77 1pbn s VAL 235 N 0.07 1.27 -0.22 7.11 1.01 -1.26 -0.60 120.40 127.78 1pbn s VAL 235 Ca 0.49 -1.15 -0.27 0.00 0.00 0.00 0.00 61.98 61.06 1pbn s VAL 235 Cb -0.26 -1.15 0.10 0.00 0.00 0.00 0.00 36.38 35.07 1pbn s VAL 235 CO 0.32 -0.01 0.90 0.72 0.00 0.00 0.00 175.10 177.03 1pbn s PHE 236 N -0.95 -0.55 0.29 5.22 -0.71 -1.15 -0.12 117.98 120.01 1pbn s PHE 236 Ca 0.02 1.23 -0.11 0.00 -1.04 0.00 0.00 56.93 57.03 1pbn s PHE 236 Cb -0.09 0.36 0.01 0.00 -1.21 0.00 0.00 43.02 42.10 1pbn s PHE 236 CO 0.02 -0.34 0.54 0.20 -1.34 0.00 0.00 175.22 174.30 1pbn s GLY 237 N -0.20 0.70 0.10 1.99 0.00 -1.26 -1.84 107.32 106.81 1pbn s GLY 237 Ca -0.00 -0.97 0.04 0.00 0.00 0.00 0.00 44.72 43.78 1pbn s GLY 237 CO -0.01 -0.63 -0.11 -1.36 0.00 0.00 0.00 173.10 170.99 1pbn s PHE 238 N -3.53 1.13 -0.14 1.90 0.08 -0.17 -1.44 117.98 115.81 1pbn s PHE 238 Ca 0.23 -0.63 0.01 0.00 0.12 0.00 0.00 56.93 56.66 1pbn s PHE 238 Cb -0.02 -0.61 0.02 0.00 -0.57 0.00 0.00 43.02 41.84 1pbn s PHE 238 CO 0.12 0.03 -0.15 -1.12 -0.10 0.00 0.00 175.22 173.99 1pbn s SER 239 N -2.41 2.68 -0.24 1.36 0.01 -0.50 -2.11 113.70 112.48 1pbn s SER 239 Ca 0.06 -0.49 -0.27 0.00 1.31 0.00 0.00 55.95 56.56 1pbn s SER 239 Cb -0.04 -1.19 0.00 0.00 0.21 0.00 0.00 66.02 65.00 1pbn s SER 239 CO 0.01 -0.02 0.92 -0.22 0.41 0.00 0.00 173.24 174.34 1pbn s LEU 240 N 1.28 4.08 -0.83 2.44 0.20 -0.01 -0.92 118.68 124.93 1pbn s LEU 240 Ca 0.01 1.16 -0.25 0.00 0.69 0.00 0.00 54.13 55.74 1pbn s LEU 240 Cb -0.14 -3.34 0.03 0.00 -0.43 0.00 0.00 46.19 42.31 1pbn s LEU 240 CO -0.08 -0.60 1.44 -0.63 -0.29 0.00 0.00 176.35 176.20 1pbn s ILE 241 N 3.03 3.73 -0.95 6.68 -1.09 0.64 -1.36 121.20 131.88 1pbn s ILE 241 Ca 0.39 -0.04 0.28 0.00 -2.23 0.00 0.00 60.65 59.05 1pbn s ILE 241 Cb -0.15 -4.80 0.19 0.00 -1.58 0.00 0.00 42.46 36.13 1pbn s ILE 241 CO 0.07 -1.72 1.79 0.35 -1.23 0.00 0.00 174.94 174.20 1pbn n THR 242 N 6.73 0.09 -3.53 2.92 -2.24 -0.96 -0.24 114.28 117.05 1pbn n THR 242 Ca 0.17 -0.05 -0.08 0.00 -2.27 0.00 0.00 64.05 61.82 1pbn n THR 242 Cb 0.50 -0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 68.35 1pbn n THR 242 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1pbn s ASN 243 N -3.25 -0.32 -0.24 3.42 2.20 -1.26 -4.78 114.94 110.72 1pbn s ASN 243 Ca 0.13 0.05 -0.09 0.00 -0.94 0.00 0.00 52.86 52.00 1pbn s ASN 243 Cb 0.18 0.32 -0.04 0.00 -2.00 0.00 0.00 41.25 39.71 1pbn s ASN 243 CO 0.58 -0.51 0.12 -0.54 -2.94 0.00 0.00 177.10 173.81 1pbn s LYS 244 N -2.74 3.89 0.41 3.55 1.02 -1.26 0.29 119.74 124.90 1pbn s LYS 244 Ca 0.05 -0.36 -0.23 0.00 0.02 0.00 0.00 55.97 55.45 1pbn s LYS 244 Cb -0.01 -3.44 -0.09 0.00 -0.52 0.00 0.00 37.83 33.76 1pbn s LYS 244 CO -0.07 -0.04 1.02 0.14 -0.92 0.00 0.00 175.35 175.48 1pbn s VAL 245 N 1.29 3.90 0.10 3.17 -7.23 -0.86 -4.91 120.40 115.85 1pbn s VAL 245 Ca 0.06 1.38 -0.31 0.00 -1.81 0.00 0.00 61.98 61.30 1pbn s VAL 245 Cb -0.14 -3.67 -0.08 0.00 0.56 0.00 0.00 36.38 33.04 1pbn s VAL 245 CO 0.05 -0.07 1.51 -0.63 -0.31 0.00 0.00 175.10 175.66 1pbn s ILE 246 N -1.79 3.10 -0.08 -0.62 -1.09 -1.26 -4.91 121.20 114.55 1pbn s ILE 246 Ca 0.59 0.70 0.01 0.00 -2.23 0.00 0.00 60.65 59.72 1pbn s ILE 246 Cb -0.19 -3.45 0.00 0.00 -1.58 0.00 0.00 42.46 37.25 1pbn s ILE 246 CO 0.23 0.03 0.42 0.23 -1.23 0.00 0.00 174.94 174.63 1pbn n MET 247 N 4.59 0.65 -4.90 2.79 2.81 -1.26 -4.54 117.12 117.25 1pbn n MET 247 Ca 0.14 -0.43 -0.26 0.00 -1.81 0.00 0.00 57.70 55.33 1pbn n MET 247 Cb 0.41 -0.92 -0.15 0.00 -0.71 0.00 0.00 33.22 31.85 1pbn n MET 247 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 1pbn s ASP 248 N -0.26 2.28 0.34 7.83 -4.77 -1.26 -4.97 116.67 115.85 1pbn s ASP 248 Ca 0.01 -0.37 0.04 0.00 -3.30 0.00 0.00 52.55 48.93 1pbn s ASP 248 Cb 0.01 -0.25 0.60 0.00 -1.09 0.00 0.00 42.92 42.19 1pbn s ASP 248 CO 0.01 0.23 1.88 0.74 0.70 0.00 0.00 175.17 178.73 1pbn h THR 249 N 4.62 1.19 -3.52 2.11 2.02 -1.99 -3.37 112.91 113.98 1pbn h THR 249 Ca -0.39 -0.76 -0.77 0.00 0.77 0.00 0.00 66.41 65.26 1pbn h THR 249 Cb 1.15 0.91 -0.24 0.00 -1.74 0.00 0.00 68.15 68.22 1pbn h THR 249 CO 0.48 0.26 0.15 -1.61 0.37 0.00 0.00 175.52 175.17 1pbn s GLU 250 N -5.00 3.50 0.00 6.66 8.01 -1.26 -4.84 118.70 125.77 1pbn s GLU 250 Ca -0.08 -2.23 0.00 0.00 0.01 0.00 0.00 54.97 52.68 1pbn s GLU 250 Cb 0.16 -4.46 0.00 0.00 -4.31 0.00 0.00 34.13 25.51 1pbn s GLU 250 CO 0.77 -1.37 0.00 -1.13 0.01 0.00 0.00 175.26 173.54 1pbn n SER 251 N 4.56 0.00 0.21 -0.19 3.41 -1.26 -4.99 113.62 115.36 1pbn n SER 251 Ca 0.10 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.86 1pbn n SER 251 Cb 0.46 0.00 0.76 0.00 -0.26 0.00 0.00 64.21 65.17 1pbn n SER 251 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1pbn h GLN 252 N 0.00 0.00 0.00 4.33 7.50 -1.92 -3.45 115.11 121.57 1pbn h GLN 252 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1pbn h GLN 252 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 1pbn h GLN 252 CO 0.00 0.00 0.00 0.41 -1.50 0.00 0.00 178.83 177.74 1pbn n GLY 253 N -1.47 0.40 3.37 3.46 0.00 -1.26 -4.84 105.19 104.85 1pbn n GLY 253 Ca 0.00 0.61 -0.52 0.00 0.00 0.00 0.00 46.02 46.12 1pbn n GLY 253 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1pbn n LYS 254 N 0.00 0.18 -2.25 1.61 2.85 -1.26 -4.83 118.16 114.45 1pbn n LYS 254 Ca 0.00 0.04 -0.35 0.00 -1.05 0.00 0.00 58.31 56.94 1pbn n LYS 254 Cb 0.00 -1.70 -0.04 0.00 -0.65 0.00 0.00 35.03 32.64 1pbn n LYS 254 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1pbn s ALA 255 N 7.40 2.22 1.03 0.58 0.00 -1.26 -4.97 121.76 126.76 1pbn s ALA 255 Ca 1.23 -1.45 -0.17 0.00 0.00 0.00 0.00 51.96 51.57 1pbn s ALA 255 Cb -1.29 -4.44 0.22 0.00 0.00 0.00 0.00 23.12 17.62 1pbn s ALA 255 CO 0.57 -4.05 1.24 0.54 0.00 0.00 0.00 175.76 174.06 1pbn s ASN 256 N 6.61 2.48 -0.74 0.00 2.20 -1.26 -4.90 114.94 119.32 1pbn s ASN 256 Ca 0.58 0.43 -0.02 0.00 -0.94 0.00 0.00 52.86 52.91 1pbn s ASN 256 Cb -0.07 -0.57 0.40 0.00 -2.00 0.00 0.00 41.25 39.02 1pbn s ASN 256 CO 0.05 -3.14 2.00 1.57 -2.94 0.00 0.00 177.10 174.64 1pbn n HIS 257 N -4.07 3.11 1.45 1.54 -0.00 -1.26 -4.70 115.22 111.30 1pbn n HIS 257 Ca 0.14 -2.69 0.00 0.00 -0.00 0.00 0.00 57.72 55.17 1pbn n HIS 257 Cb 0.59 -1.28 0.00 0.00 -0.00 0.00 0.00 29.99 29.30 1pbn n HIS 257 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 1pbn n GLU 258 N -0.73 0.85 0.27 1.57 1.02 -1.26 -3.88 120.64 118.48 1pbn n GLU 258 Ca 0.58 0.00 0.18 0.00 -0.02 0.00 0.00 57.16 57.90 1pbn n GLU 258 Cb 0.46 -1.13 0.92 0.00 -0.02 0.00 0.00 31.44 31.68 1pbn n GLU 258 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1pbn h GLU 259 N 0.04 0.00 0.00 3.49 5.08 -1.86 -1.43 114.58 119.90 1pbn h GLU 259 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1pbn h GLU 259 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1pbn h GLU 259 CO 0.00 0.00 0.00 1.33 -1.00 0.00 0.00 179.01 179.34 1pbn n VAL 260 N -3.36 1.14 0.00 3.13 0.24 -1.25 -1.97 118.33 116.26 1pbn n VAL 260 Ca -0.00 0.53 -0.17 0.00 -2.04 0.00 0.00 64.34 62.66 1pbn n VAL 260 Cb 0.29 -1.50 -0.12 0.00 -1.47 0.00 0.00 33.84 31.04 1pbn n VAL 260 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1pbn h LEU 261 N 0.00 0.39 -0.30 1.34 3.38 -1.60 -3.31 115.31 115.21 1pbn h LEU 261 Ca 0.00 -0.83 -0.20 0.00 0.09 0.00 0.00 57.88 56.94 1pbn h LEU 261 Cb 0.11 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1pbn h LEU 261 CO 0.00 1.18 -0.84 -0.33 0.09 0.00 0.00 178.44 178.53 1pbn h GLU 262 N -0.35 0.32 -6.64 1.13 3.07 -1.70 -3.35 114.58 107.06 1pbn h GLU 262 Ca -0.07 -0.32 -0.52 0.00 -0.50 0.00 0.00 59.36 57.94 1pbn h GLU 262 Cb 1.29 0.08 0.03 0.00 -0.84 0.00 0.00 28.75 29.31 1pbn h GLU 262 CO 0.10 1.00 0.63 0.00 -1.40 0.00 0.00 179.01 179.33 1pbn s ALA 263 N -3.36 3.50 0.00 3.43 0.00 -0.83 -2.93 121.76 121.56 1pbn s ALA 263 Ca -0.05 1.04 0.00 0.00 0.00 0.00 0.00 51.96 52.96 1pbn s ALA 263 Cb 0.10 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1pbn s ALA 263 CO 0.84 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.52 1pbn n GLY 264 N 2.51 1.93 0.00 0.00 0.00 0.51 -4.84 105.19 105.29 1pbn n GLY 264 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1pbn n GLY 264 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pbn n LYS 265 N 0.00 3.94 0.00 1.61 5.02 -1.15 -4.62 118.16 122.96 1pbn n LYS 265 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1pbn n LYS 265 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1pbn n LYS 265 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1pbn n GLN 266 N 0.00 0.00 0.17 1.97 7.27 -1.26 -0.95 117.38 124.58 1pbn n GLN 266 Ca 0.00 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.19 1pbn n GLN 266 Cb 0.00 0.00 0.11 0.00 2.41 0.00 0.00 30.24 32.76 1pbn n GLN 266 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1pbn h ALA 267 N 0.00 0.79 -0.78 1.69 0.00 -1.86 -3.34 119.26 115.75 1pbn h ALA 267 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1pbn h ALA 267 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1pbn h ALA 267 CO 0.00 0.00 0.50 0.00 0.00 0.00 0.00 179.25 179.75 1pbn h ALA 268 N 2.02 1.02 -0.55 0.00 0.00 -0.99 -0.51 119.26 120.25 1pbn h ALA 268 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1pbn h ALA 268 Cb 0.99 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1pbn h ALA 268 CO 0.00 0.32 0.28 1.96 0.00 0.00 0.00 179.25 181.81 1pbn h GLN 269 N 0.98 0.76 -0.14 0.00 4.20 -1.68 0.27 115.11 119.51 1pbn h GLN 269 Ca 0.31 -0.08 -0.18 0.00 0.06 0.00 0.00 58.65 58.76 1pbn h GLN 269 Cb -0.01 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.62 1pbn h GLN 269 CO -0.11 0.58 -0.66 -0.22 -0.67 0.00 0.00 178.83 177.75 1pbn h LYS 270 N 0.76 0.53 -0.47 1.46 3.64 -1.55 -2.21 116.57 118.72 1pbn h LYS 270 Ca 0.19 -0.38 -0.13 0.00 -1.27 0.00 0.00 60.65 59.06 1pbn h LYS 270 Cb 0.05 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1pbn h LYS 270 CO -0.03 1.01 -0.20 1.25 -2.27 0.00 0.00 179.45 179.20 1pbn h LEU 271 N 0.38 1.00 -0.15 5.20 5.85 -0.10 0.14 115.31 127.63 1pbn h LEU 271 Ca -0.02 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 1pbn h LEU 271 Cb 1.23 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 1pbn h LEU 271 CO 0.12 1.17 0.07 -0.33 -0.34 0.00 0.00 178.44 179.13 1pbn h GLU 272 N 0.83 0.21 -0.73 1.25 5.08 -0.95 0.55 114.58 120.82 1pbn h GLU 272 Ca 0.11 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1pbn h GLU 272 Cb 0.78 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.94 1pbn h GLU 272 CO 0.06 0.26 0.44 0.37 -1.00 0.00 0.00 179.01 179.14 1pbn h GLN 273 N 0.11 0.79 -0.44 2.33 5.75 -1.25 -0.92 115.11 121.49 1pbn h GLN 273 Ca 0.05 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1pbn h GLN 273 Cb 0.12 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 1pbn h GLN 273 CO -0.01 0.52 0.26 0.35 -2.65 0.00 0.00 178.83 177.31 1pbn h PHE 274 N 0.81 0.58 -0.68 3.99 3.57 -0.59 -2.88 116.94 121.74 1pbn h PHE 274 Ca 0.32 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.79 1pbn h PHE 274 Cb 0.13 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1pbn h PHE 274 CO -0.05 0.41 0.34 0.28 -2.23 0.00 0.00 178.31 177.05 1pbn h VAL 275 N 0.58 1.22 -0.25 1.41 2.07 -0.03 -2.47 116.25 118.79 1pbn h VAL 275 Ca 0.16 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 67.10 1pbn h VAL 275 Cb -0.00 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.11 1pbn h VAL 275 CO -0.03 0.26 0.03 0.28 0.02 0.00 0.00 177.57 178.12 1pbn h SER 276 N 0.95 -0.04 -0.77 0.57 0.02 -1.03 -2.69 113.55 110.56 1pbn h SER 276 Ca 0.24 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.22 1pbn h SER 276 Cb 0.10 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 1pbn h SER 276 CO -0.03 0.01 0.44 -0.07 -1.14 0.00 0.00 176.83 176.04 1pbn h LEU 277 N 0.11 0.94 -1.96 5.07 3.38 -1.38 -2.57 115.31 118.91 1pbn h LEU 277 Ca 0.12 -0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.13 1pbn h LEU 277 Cb 0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1pbn h LEU 277 CO -0.18 0.75 0.32 -0.07 0.09 0.00 0.00 178.44 179.36 1pbn h LEU 278 N 1.06 0.04 -1.34 1.67 -0.00 -1.12 -2.06 115.31 113.55 1pbn h LEU 278 Ca 0.27 0.00 0.14 0.00 -0.00 0.00 0.00 57.88 58.29 1pbn h LEU 278 Cb 0.01 -0.01 -0.06 0.00 -0.00 0.00 0.00 40.66 40.59 1pbn h LEU 278 CO -0.05 0.02 0.55 -0.03 -0.00 0.00 0.00 178.44 178.94 1pbn h MET 279 N 0.04 0.64 -0.30 1.13 4.05 -1.25 -1.12 114.93 118.12 1pbn h MET 279 Ca 0.21 -0.04 -0.08 0.00 -0.28 0.00 0.00 59.70 59.52 1pbn h MET 279 Cb 0.79 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.44 1pbn h MET 279 CO -0.01 0.42 -0.10 0.00 0.23 0.00 0.00 176.91 177.45 1pbn h ALA 280 N 1.60 0.42 0.00 0.39 0.00 -1.53 -3.10 119.26 117.05 1pbn h ALA 280 Ca 0.42 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1pbn h ALA 280 Cb 0.69 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1pbn h ALA 280 CO -0.18 0.28 -0.30 0.77 0.00 0.00 0.00 179.25 179.81 1pbn h SER 281 N 0.37 0.00 -2.32 0.00 0.02 -1.34 -3.45 113.55 106.83 1pbn h SER 281 Ca 0.07 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 60.41 1pbn h SER 281 Cb 0.61 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.23 1pbn h SER 281 CO 0.04 0.30 0.45 -0.38 -1.14 0.00 0.00 176.83 176.09 1pbn n ILE 282 N -3.88 0.93 -0.57 3.27 5.41 -0.66 -4.94 119.36 118.92 1pbn n ILE 282 Ca -0.02 -0.23 -0.30 0.00 1.00 0.00 0.00 62.75 63.21 1pbn n ILE 282 Cb 0.38 -1.17 0.22 0.00 -0.71 0.00 0.00 39.64 38.36 1pbn n ILE 282 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1pbn n PRO 283 N 1.89 -1.56 -0.24 0.38 -0.02 -1.26 -4.91 135.00 129.28 1pbn n PRO 283 Ca 0.13 -0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.20 1pbn n PRO 283 Cb 0.28 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1pbn n PRO 283 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1pbn n VAL 284 N -4.64 -0.64 -2.64 -1.45 0.31 -1.26 -4.97 118.33 103.04 1pbn n VAL 284 Ca 0.07 0.25 -0.41 0.00 -0.01 0.00 0.00 64.34 64.23 1pbn n VAL 284 Cb 0.53 -0.39 -0.04 0.00 -0.91 0.00 0.00 33.84 33.03 1pbn n VAL 284 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1pbn s SER 285 N -3.19 7.38 0.00 4.52 0.01 -1.26 -4.58 113.70 116.58 1pbn s SER 285 Ca 0.00 1.88 0.00 0.00 1.31 0.00 0.00 55.95 59.14 1pbn s SER 285 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1pbn s SER 285 CO 0.00 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.09 1pbn n GLY 286 N 2.37 0.64 3.58 3.44 0.00 -0.25 -5.04 105.19 109.93 1pbn n GLY 286 Ca 0.03 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1pbn n GLY 286 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1pbn s HIS 287 N 0.00 2.20 0.00 1.61 -0.00 -1.25 -4.50 115.29 113.35 1pbn s HIS 287 Ca 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 55.06 54.89 1pbn s HIS 287 Cb 0.00 -4.23 0.00 0.00 -0.00 0.00 0.00 32.58 28.35 1pbn s HIS 287 CO 0.00 -1.39 0.00 2.41 -0.00 0.00 0.00 174.74 175.76 1pbn n THR 288 N 7.38 0.00 -0.08 -5.38 -1.04 -1.24 -4.98 114.28 108.94 1pbn n THR 288 Ca 0.46 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.47 1pbn n THR 288 Cb 0.46 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.97 1pbn n THR 288 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04