#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nba n ASN 9 N 0.00 0.00 0.30 5.98 2.85 -1.26 -5.01 115.26 118.12 1nba n ASN 9 Ca 0.00 0.00 -0.16 0.00 -0.11 0.00 0.00 54.58 54.31 1nba n ASN 9 Cb 0.00 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 40.94 1nba n ASN 9 CO 0.00 0.00 0.00 -0.78 -2.11 0.00 0.00 177.26 174.37 1nba h ASP 10 N 0.00 -0.63 0.59 1.20 1.82 -2.08 -3.35 116.42 113.96 1nba h ASP 10 Ca 0.00 -0.04 -0.28 0.00 -0.39 0.00 0.00 57.03 56.32 1nba h ASP 10 Cb 0.00 0.16 0.01 0.00 0.68 0.00 0.00 39.33 40.18 1nba h ASP 10 CO 0.00 -0.33 -1.24 0.16 -1.61 0.00 0.00 179.24 176.22 1nba h ILE 11 N -0.94 1.48 -0.85 2.25 3.07 -2.02 -3.40 117.51 117.10 1nba h ILE 11 Ca -0.08 -3.01 0.12 0.00 1.55 0.00 0.00 64.86 63.44 1nba h ILE 11 Cb 0.64 2.93 -0.06 0.00 -0.27 0.00 0.00 36.82 40.05 1nba h ILE 11 CO 0.13 0.88 0.55 -0.33 -1.05 0.00 0.00 178.15 178.33 1nba h GLU 12 N 0.09 0.71 -0.29 0.16 5.08 -1.95 -0.03 114.58 118.34 1nba h GLU 12 Ca -0.14 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.15 1nba h GLU 12 Cb 1.97 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 31.05 1nba h GLU 12 CO 0.21 0.47 0.06 0.00 -1.00 0.00 0.00 179.01 178.74 1nba h ALA 13 N 1.59 0.38 0.02 3.43 0.00 -1.78 0.15 119.26 123.06 1nba h ALA 13 Ca 0.41 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1nba h ALA 13 Cb 0.57 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1nba h ALA 13 CO -0.17 0.06 -0.01 0.00 0.00 0.00 0.00 179.25 179.12 1nba h ARG 14 N 0.30 -0.03 -0.52 0.00 3.08 -1.60 -1.59 114.38 114.01 1nba h ARG 14 Ca 0.09 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.24 1nba h ARG 14 Cb 0.32 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.29 1nba h ARG 14 CO 0.00 0.28 -0.01 1.25 -1.07 0.00 0.00 179.97 180.42 1nba h LEU 15 N -0.34 -0.25 -0.29 3.04 5.85 -0.98 0.84 115.31 123.18 1nba h LEU 15 Ca -0.00 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1nba h LEU 15 Cb 0.32 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1nba h LEU 15 CO 0.00 -0.09 0.16 0.00 -0.34 0.00 0.00 178.44 178.17 1nba h ALA 16 N 1.48 0.37 -0.27 1.25 0.00 -0.63 0.13 119.26 121.58 1nba h ALA 16 Ca 0.27 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1nba h ALA 16 Cb 0.41 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1nba h ALA 16 CO -0.45 -0.10 0.16 0.00 0.00 0.00 0.00 179.25 178.86 1nba h ALA 17 N 1.04 0.35 -0.04 0.00 0.00 -0.66 -1.41 119.26 118.53 1nba h ALA 17 Ca 0.10 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 1nba h ALA 17 Cb 0.06 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1nba h ALA 17 CO -0.02 -0.15 -0.84 0.28 0.00 0.00 0.00 179.25 178.52 1nba h VAL 18 N 0.34 1.39 -0.94 0.00 2.07 -0.67 -2.88 116.25 115.57 1nba h VAL 18 Ca 0.10 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.32 1nba h VAL 18 Cb 0.02 2.27 -0.05 0.00 -1.52 0.00 0.00 31.29 32.01 1nba h VAL 18 CO -0.02 0.69 0.59 -0.07 0.02 0.00 0.00 177.57 178.78 1nba h LEU 19 N 0.26 1.10 -0.81 2.57 3.38 -0.68 -1.46 115.31 119.68 1nba h LEU 19 Ca -0.06 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 57.92 1nba h LEU 19 Cb 1.45 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.86 1nba h LEU 19 CO 0.15 0.82 0.50 -0.08 0.09 0.00 0.00 178.44 179.92 1nba h GLU 20 N 1.28 0.90 -0.51 1.13 4.81 -1.05 0.79 114.58 121.92 1nba h GLU 20 Ca 0.34 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1nba h GLU 20 Cb -0.10 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.06 1nba h GLU 20 CO -0.07 0.59 0.15 0.93 -0.73 0.00 0.00 179.01 179.89 1nba h GLU 21 N 0.92 0.80 -0.60 1.92 5.08 -1.20 -1.00 114.58 120.50 1nba h GLU 21 Ca 0.35 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 1nba h GLU 21 Cb 0.14 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1nba h GLU 21 CO -0.16 0.75 0.21 0.00 -1.00 0.00 0.00 179.01 178.81 1nba h ALA 22 N 1.02 1.23 -0.56 3.43 0.00 -0.79 -2.63 119.26 120.96 1nba h ALA 22 Ca 0.16 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1nba h ALA 22 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1nba h ALA 22 CO -0.00 0.55 -0.01 0.74 0.00 0.00 0.00 179.25 180.52 1nba h PHE 23 N 0.88 1.07 -0.10 0.00 0.04 -0.22 -1.21 116.94 117.39 1nba h PHE 23 Ca 0.20 -0.18 0.02 0.00 2.80 0.00 0.00 57.97 60.81 1nba h PHE 23 Cb 0.22 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 1nba h PHE 23 CO 0.01 0.96 0.00 0.93 -0.60 0.00 0.00 178.31 179.62 1nba h GLU 24 N 0.90 0.04 0.07 1.51 4.39 -0.92 0.11 114.58 120.68 1nba h GLU 24 Ca 0.16 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.87 1nba h GLU 24 Cb 0.54 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 1nba h GLU 24 CO 0.03 0.03 -0.17 0.00 -1.16 0.00 0.00 179.01 177.74 1nba h ALA 25 N 1.08 -0.26 -0.75 3.43 0.00 -1.21 -1.61 119.26 119.95 1nba h ALA 25 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1nba h ALA 25 Cb 0.05 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1nba h ALA 25 CO -0.08 -0.68 0.37 0.78 0.00 0.00 0.00 179.25 179.64 1nba h GLY 26 N -0.31 1.14 1.09 0.00 0.00 -1.12 -2.67 103.07 101.20 1nba h GLY 26 Ca 0.03 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 1nba h GLY 26 CO -0.11 0.53 0.55 -0.84 0.00 0.00 0.00 176.54 176.67 1nba h THR 27 N 1.04 1.24 -0.13 4.70 2.02 -0.55 0.05 112.91 121.28 1nba h THR 27 Ca 0.26 -0.52 0.02 0.00 0.77 0.00 0.00 66.41 66.93 1nba h THR 27 Cb 0.10 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.47 1nba h THR 27 CO -0.03 0.25 0.02 0.28 0.37 0.00 0.00 175.52 176.41 1nba h SER 28 N 1.23 -0.00 -0.25 4.18 0.02 -0.96 0.14 113.55 117.91 1nba h SER 28 Ca 0.32 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1nba h SER 28 Cb -0.06 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1nba h SER 28 CO -0.06 0.02 0.16 0.40 -1.14 0.00 0.00 176.83 176.21 1nba h ILE 29 N 0.07 1.07 -0.41 3.27 2.04 -1.24 -0.88 117.51 121.43 1nba h ILE 29 Ca 0.06 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.81 1nba h ILE 29 Cb 0.05 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1nba h ILE 29 CO -0.08 0.06 0.23 1.88 0.00 0.00 0.00 178.15 180.25 1nba h TYR 30 N 0.33 0.44 -0.47 1.37 0.05 -0.83 -1.83 116.97 116.02 1nba h TYR 30 Ca 0.09 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.84 1nba h TYR 30 Cb -0.04 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.55 1nba h TYR 30 CO -0.06 0.25 0.11 -0.91 -1.05 0.00 0.00 178.16 176.50 1nba h ASN 31 N 0.47 0.72 -0.79 3.88 2.35 -0.46 0.33 115.58 122.08 1nba h ASN 31 Ca 0.17 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1nba h ASN 31 Cb 0.03 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.17 1nba h ASN 31 CO -0.09 0.77 0.40 -0.33 -1.65 0.00 0.00 177.43 176.53 1nba h GLU 32 N 0.64 1.13 0.00 0.81 5.08 -0.90 -2.67 114.58 118.67 1nba h GLU 32 Ca 0.15 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nba h GLU 32 Cb 0.33 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1nba h GLU 32 CO 0.00 0.85 -0.06 0.54 -1.00 0.00 0.00 179.01 179.35 1nba n ARG 33 N -4.32 0.12 -0.24 2.33 1.74 -0.71 -4.92 116.66 110.66 1nba n ARG 33 Ca 0.08 0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.25 1nba n ARG 33 Cb 0.12 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 29.93 1nba n ARG 33 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nba n GLY 34 N 1.41 0.95 3.18 -0.13 0.00 -0.43 -5.03 105.19 105.15 1nba n GLY 34 Ca 0.06 -0.23 -0.19 0.00 0.00 0.00 0.00 46.02 45.66 1nba n GLY 34 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nba n PHE 35 N -2.16 -3.07 -3.20 1.61 3.01 -0.03 -4.61 117.46 109.02 1nba n PHE 35 Ca 0.00 -1.42 -0.21 0.00 1.01 0.00 0.00 57.45 56.83 1nba n PHE 35 Cb 0.01 -0.61 0.05 0.00 -0.01 0.00 0.00 39.48 38.92 1nba n PHE 35 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1nba n LYS 36 N -2.55 -5.76 -1.75 -1.08 4.81 -0.81 -4.46 118.16 106.56 1nba n LYS 36 Ca 0.14 0.79 -0.30 0.00 -0.87 0.00 0.00 58.31 58.06 1nba n LYS 36 Cb 0.48 -5.52 0.06 0.00 0.02 0.00 0.00 35.03 30.08 1nba n LYS 36 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1nba s ARG 37 N -5.87 2.57 -0.20 1.64 0.52 -1.26 -5.01 118.95 111.34 1nba s ARG 37 Ca 0.40 0.54 -0.18 0.00 -0.52 0.00 0.00 55.73 55.97 1nba s ARG 37 Cb -0.17 -1.98 -0.03 0.00 0.52 0.00 0.00 34.95 33.28 1nba s ARG 37 CO 0.49 -1.26 0.48 1.03 0.02 0.00 0.00 175.30 176.06 1nba s ARG 38 N -5.28 4.18 0.20 3.54 1.81 -1.26 -4.95 118.95 117.19 1nba s ARG 38 Ca 0.59 0.34 0.01 0.00 -1.72 0.00 0.00 55.73 54.95 1nba s ARG 38 Cb -0.12 -3.55 0.14 0.00 -0.45 0.00 0.00 34.95 30.96 1nba s ARG 38 CO 0.53 -0.11 1.49 0.97 -0.68 0.00 0.00 175.30 177.49 1nba h ILE 39 N 5.09 1.38 0.00 1.52 2.10 -1.95 -3.48 117.51 122.17 1nba h ILE 39 Ca -0.34 -2.07 0.00 0.00 1.08 0.00 0.00 64.86 63.52 1nba h ILE 39 Cb 1.16 2.05 0.00 0.00 -1.09 0.00 0.00 36.82 38.94 1nba h ILE 39 CO 0.73 0.62 0.00 0.61 -1.08 0.00 0.00 178.15 179.03 1nba n GLY 40 N 0.43 -1.79 3.77 8.18 0.00 -1.26 -4.67 105.19 109.84 1nba n GLY 40 Ca -0.03 -1.45 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 1nba n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nba s TYR 41 N -3.34 3.60 0.00 1.61 2.02 -1.26 -4.91 117.35 115.06 1nba s TYR 41 Ca 0.00 1.74 0.00 0.00 -0.37 0.00 0.00 57.07 58.44 1nba s TYR 41 Cb 0.00 -3.13 0.00 0.00 -0.40 0.00 0.00 41.96 38.43 1nba s TYR 41 CO 0.00 -0.26 0.00 0.41 -1.57 0.00 0.00 175.55 174.13 1nba n GLY 42 N 0.94 0.60 0.02 0.71 0.00 -1.26 -5.07 105.19 101.12 1nba n GLY 42 Ca 0.01 -1.84 0.04 0.00 0.00 0.00 0.00 46.02 44.23 1nba n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nba n ASN 43 N 0.00 2.17 -3.87 1.61 5.03 -1.26 -4.84 115.26 114.11 1nba n ASN 43 Ca 0.00 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.16 1nba n ASN 43 Cb 0.00 1.42 -0.13 0.00 -1.02 0.00 0.00 39.78 40.05 1nba n ASN 43 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1nba s ARG 44 N -2.75 1.94 0.52 3.52 3.52 -1.26 -4.63 118.95 119.82 1nba s ARG 44 Ca -0.05 -2.70 -0.04 0.00 -0.13 0.00 0.00 55.73 52.82 1nba s ARG 44 Cb 0.07 -3.08 -0.01 0.00 -1.56 0.00 0.00 34.95 30.37 1nba s ARG 44 CO 0.51 -1.18 0.81 -1.25 -0.81 0.00 0.00 175.30 173.37 1nba s PRO 45 N -0.49 3.12 0.07 5.12 0.04 -1.26 -0.89 135.00 140.72 1nba s PRO 45 Ca 0.20 -0.07 0.03 0.00 0.04 0.00 0.00 61.00 61.19 1nba s PRO 45 Cb -0.18 -2.37 -0.03 0.00 0.04 0.00 0.00 34.50 31.95 1nba s PRO 45 CO -0.06 -0.46 -0.09 0.00 0.04 0.00 0.00 177.00 176.44 1nba s ALA 46 N -2.81 0.88 -0.08 8.56 0.00 -0.46 -4.37 121.76 123.48 1nba s ALA 46 Ca 0.51 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 51.45 1nba s ALA 46 Cb -0.10 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1nba s ALA 46 CO 0.43 -0.06 -0.15 0.08 0.00 0.00 0.00 175.76 176.06 1nba s VAL 47 N -2.19 2.92 -0.06 0.00 1.01 -0.33 -1.10 120.40 120.65 1nba s VAL 47 Ca 0.00 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1nba s VAL 47 Cb -0.04 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 34.18 1nba s VAL 47 CO -0.01 0.56 -0.11 -0.51 0.00 0.00 0.00 175.10 175.04 1nba s ILE 48 N -0.24 1.01 -0.41 2.22 2.07 0.11 -0.45 121.20 125.52 1nba s ILE 48 Ca 0.01 -0.40 -0.13 0.00 -1.41 0.00 0.00 60.65 58.71 1nba s ILE 48 Cb -0.13 -0.94 0.04 0.00 0.13 0.00 0.00 42.46 41.56 1nba s ILE 48 CO 0.03 0.33 0.28 -1.00 -1.91 0.00 0.00 174.94 172.66 1nba s HIS 49 N 0.71 3.25 -0.39 3.50 3.76 0.26 -1.61 115.29 124.77 1nba s HIS 49 Ca -0.14 -0.85 -0.28 0.00 -0.15 0.00 0.00 55.06 53.64 1nba s HIS 49 Cb -0.15 -2.64 0.02 0.00 1.11 0.00 0.00 32.58 30.91 1nba s HIS 49 CO 0.03 -0.66 1.03 0.42 -0.85 0.00 0.00 174.74 174.71 1nba s ILE 50 N 1.61 4.44 -1.39 0.60 -1.09 -0.24 -1.55 121.20 123.58 1nba s ILE 50 Ca 0.04 1.31 -0.01 0.00 -2.23 0.00 0.00 60.65 59.76 1nba s ILE 50 Cb -0.20 -4.44 0.01 0.00 -1.58 0.00 0.00 42.46 36.24 1nba s ILE 50 CO 0.08 -0.68 0.51 0.47 -1.23 0.00 0.00 174.94 174.08 1nba n ASP 51 N 7.14 -0.69 -3.22 3.58 8.00 -0.85 -1.71 116.55 128.80 1nba n ASP 51 Ca 0.10 -0.96 -0.37 0.00 0.71 0.00 0.00 54.79 54.27 1nba n ASP 51 Cb 0.48 -3.31 -0.00 0.00 -0.02 0.00 0.00 41.12 38.27 1nba n ASP 51 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1nba n LEU 52 N -4.38 7.44 -4.98 0.64 4.32 -1.26 -4.63 117.00 114.15 1nba n LEU 52 Ca -0.29 -4.85 -0.18 0.00 -0.02 0.00 0.00 56.01 50.67 1nba n LEU 52 Cb 0.68 -1.23 0.00 0.00 -1.62 0.00 0.00 43.42 41.25 1nba n LEU 52 CO 0.74 1.94 0.12 0.00 -1.22 0.00 0.00 177.39 178.97 1nba s ALA 53 N -2.66 4.43 0.37 -1.18 0.00 -1.26 -1.68 121.76 119.78 1nba s ALA 53 Ca 0.51 -1.72 0.05 0.00 0.00 0.00 0.00 51.96 50.79 1nba s ALA 53 Cb 0.27 -1.50 0.74 0.00 0.00 0.00 0.00 23.12 22.63 1nba s ALA 53 CO -0.19 -0.27 2.01 -0.91 0.00 0.00 0.00 175.76 176.40 1nba h ASN 54 N 0.72 0.62 -0.29 0.00 -0.26 -0.86 -1.26 115.58 114.25 1nba h ASN 54 Ca -0.40 -0.01 0.09 0.00 -0.56 0.00 0.00 56.30 55.41 1nba h ASN 54 Cb 1.28 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 38.38 1nba h ASN 54 CO 0.48 0.44 0.30 0.00 -1.06 0.00 0.00 177.43 177.59 1nba h ALA 55 N 1.65 1.99 0.00 -0.83 0.00 -1.40 -0.19 119.26 120.47 1nba h ALA 55 Ca 0.23 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.82 1nba h ALA 55 Cb 0.01 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1nba h ALA 55 CO -0.06 -0.45 -2.16 0.91 0.00 0.00 0.00 179.25 177.49 1nba n TRP 56 N -3.83 0.00 0.06 0.00 8.01 -0.69 -2.07 117.44 118.91 1nba n TRP 56 Ca 0.04 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.27 1nba n TRP 56 Cb 0.45 -0.81 -0.05 0.00 -2.01 0.00 0.00 31.31 28.89 1nba n TRP 56 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.69 178.47 1nba h THR 57 N 0.00 0.37 -2.92 -0.99 1.35 -0.86 0.05 112.91 109.91 1nba h THR 57 Ca -0.46 -1.73 -0.65 0.00 -0.55 0.00 0.00 66.41 63.03 1nba h THR 57 Cb 1.90 1.91 -0.07 0.00 -1.73 0.00 0.00 68.15 70.15 1nba h THR 57 CO -0.02 0.21 -0.53 -1.10 -0.25 0.00 0.00 175.52 173.84 1nba s GLN 58 N -3.04 3.28 0.64 4.72 -1.52 -0.12 -4.92 119.66 118.69 1nba s GLN 58 Ca -0.02 -0.38 -0.15 0.00 -1.95 0.00 0.00 55.36 52.87 1nba s GLN 58 Cb 0.09 -3.00 -0.01 0.00 -0.22 0.00 0.00 33.01 29.86 1nba s GLN 58 CO 0.80 0.67 1.08 -1.25 -0.25 0.00 0.00 175.29 176.35 1nba s PRO 59 N -1.77 3.02 0.00 2.91 0.04 -1.26 -4.35 135.00 133.59 1nba s PRO 59 Ca 0.24 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.55 1nba s PRO 59 Cb -0.12 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1nba s PRO 59 CO 0.15 -1.06 0.00 0.41 0.04 0.00 0.00 177.00 176.54 1nba n GLY 60 N -0.84 0.56 3.81 0.56 0.00 -1.26 -5.05 105.19 102.96 1nba n GLY 60 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1nba n GLY 60 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1nba s HIS 61 N -2.00 3.20 0.62 1.61 5.04 -1.26 -4.99 115.29 117.51 1nba s HIS 61 Ca 0.00 0.03 0.28 0.00 -1.54 0.00 0.00 55.06 53.83 1nba s HIS 61 Cb 0.00 -1.56 1.47 0.00 0.04 0.00 0.00 32.58 32.53 1nba s HIS 61 CO 0.00 0.52 1.86 -1.00 -2.34 0.00 0.00 174.74 173.78 1nba h PRO 62 N 2.64 0.00 -0.73 2.88 0.13 -1.94 -1.75 132.00 133.22 1nba h PRO 62 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1nba h PRO 62 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1nba h PRO 62 CO 0.65 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.61 1nba n PHE 63 N -3.35 0.97 -1.99 1.56 3.01 -1.26 -5.00 117.46 111.41 1nba n PHE 63 Ca 0.04 -0.48 -0.41 0.00 1.01 0.00 0.00 57.45 57.61 1nba n PHE 63 Cb 0.59 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.04 1nba n PHE 63 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1nba s SER 64 N -1.02 6.61 -0.09 4.37 0.01 -0.66 -4.19 113.70 118.73 1nba s SER 64 Ca 0.49 2.77 -0.00 0.00 1.31 0.00 0.00 55.95 60.52 1nba s SER 64 Cb 0.26 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.82 1nba s SER 64 CO 0.34 -0.69 -0.08 0.00 0.41 0.00 0.00 173.24 173.22 1nba s PRO 66 N -0.39 -0.67 0.00 0.00 0.04 -1.25 -4.46 135.00 128.27 1nba s PRO 66 Ca 0.05 -0.00 0.00 0.00 0.04 0.00 0.00 61.00 61.09 1nba s PRO 66 Cb -0.12 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.76 1nba s PRO 66 CO 0.02 -3.36 0.00 0.41 0.04 0.00 0.00 177.00 174.12 1nba n GLY 67 N -1.34 1.21 0.39 0.56 0.00 -1.26 -4.60 105.19 100.15 1nba n GLY 67 Ca 0.12 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.30 1nba n GLY 67 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1nba h MET 68 N 3.38 0.45 -0.29 1.61 2.86 -1.91 0.98 114.93 122.01 1nba h MET 68 Ca 0.00 -0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.70 1nba h MET 68 Cb 0.00 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1nba h MET 68 CO 0.00 0.30 0.32 1.49 1.06 0.00 0.00 176.91 180.08 1nba h GLU 69 N 0.46 0.00 0.00 1.72 4.57 -1.95 -0.47 114.58 118.91 1nba h GLU 69 Ca 0.43 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 58.32 1nba h GLU 69 Cb 0.96 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.50 1nba h GLU 69 CO -0.16 0.00 -2.12 2.41 -1.18 0.00 0.00 179.01 177.96 1nba n THR 70 N -3.75 1.10 0.07 0.32 -1.04 0.26 -4.60 114.28 106.65 1nba n THR 70 Ca 0.04 -0.69 -0.11 0.00 -2.04 0.00 0.00 64.05 61.25 1nba n THR 70 Cb 0.46 -0.55 -0.07 0.00 -1.82 0.00 0.00 70.33 68.36 1nba n THR 70 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1nba h ILE 71 N 0.00 0.76 -0.55 12.58 2.04 -0.39 -3.31 117.51 128.64 1nba h ILE 71 Ca -0.44 -1.04 0.07 0.00 1.00 0.00 0.00 64.86 64.46 1nba h ILE 71 Cb 1.99 1.27 -0.06 0.00 -0.74 0.00 0.00 36.82 39.27 1nba h ILE 71 CO 0.02 0.19 0.23 0.40 0.00 0.00 0.00 178.15 178.99 1nba h ILE 72 N -0.87 0.85 -0.72 -0.67 2.04 -1.42 -0.54 117.51 116.19 1nba h ILE 72 Ca -0.03 -0.15 0.07 0.00 1.00 0.00 0.00 64.86 65.76 1nba h ILE 72 Cb 0.51 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.93 1nba h ILE 72 CO 0.04 0.08 0.47 1.55 0.00 0.00 0.00 178.15 180.29 1nba h PRO 73 N 0.43 0.70 -0.11 2.37 0.13 -1.80 0.30 132.00 134.01 1nba h PRO 73 Ca 0.26 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 65.20 1nba h PRO 73 Cb 0.26 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.22 1nba h PRO 73 CO -0.24 0.46 -0.57 -0.91 -0.23 0.00 0.00 178.00 176.51 1nba h ASN 74 N 0.72 0.40 -0.48 1.44 2.35 -1.33 -1.39 115.58 117.30 1nba h ASN 74 Ca 0.31 -0.22 -0.09 0.00 -0.55 0.00 0.00 56.30 55.76 1nba h ASN 74 Cb 0.30 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1nba h ASN 74 CO -0.10 0.89 -0.04 0.58 -1.65 0.00 0.00 177.43 177.10 1nba h VAL 75 N 0.27 1.27 -0.70 2.81 2.07 0.22 -2.87 116.25 119.31 1nba h VAL 75 Ca -0.00 -1.14 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 1nba h VAL 75 Cb 1.09 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1nba h VAL 75 CO 0.10 0.39 0.33 1.56 0.02 0.00 0.00 177.57 179.97 1nba h GLN 76 N 0.72 1.01 -0.73 1.57 4.20 -0.61 -0.80 115.11 120.48 1nba h GLN 76 Ca 0.13 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1nba h GLN 76 Cb 0.57 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.13 1nba h GLN 76 CO 0.03 0.78 0.43 0.00 -0.67 0.00 0.00 178.83 179.41 1nba h ARG 77 N 1.00 0.99 -0.21 1.46 3.08 -1.15 -0.66 114.38 118.89 1nba h ARG 77 Ca 0.24 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 1nba h ARG 77 Cb 0.12 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1nba h ARG 77 CO -0.03 0.71 -0.03 0.82 -1.07 0.00 0.00 179.97 180.37 1nba h ILE 78 N 1.00 1.27 0.04 2.04 2.04 -1.23 -1.72 117.51 120.95 1nba h ILE 78 Ca 0.26 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 65.15 1nba h ILE 78 Cb -0.02 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1nba h ILE 78 CO -0.05 0.30 -0.07 0.78 0.00 0.00 0.00 178.15 179.11 1nba h ASN 79 N 0.13 -0.19 -0.78 1.72 2.35 -0.99 0.10 115.58 117.92 1nba h ASN 79 Ca 0.06 0.02 0.10 0.00 -0.55 0.00 0.00 56.30 55.93 1nba h ASN 79 Cb 0.46 0.07 -0.07 0.00 0.05 0.00 0.00 38.32 38.83 1nba h ASN 79 CO 0.02 -0.10 0.42 -0.08 -1.65 0.00 0.00 177.43 176.03 1nba h GLU 80 N -0.14 0.67 -0.04 0.81 4.81 -1.10 0.96 114.58 120.56 1nba h GLU 80 Ca 0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1nba h GLU 80 Cb 0.15 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 1nba h GLU 80 CO -0.04 0.44 -0.02 0.00 -0.73 0.00 0.00 179.01 178.66 1nba h ALA 81 N 1.46 0.05 -0.30 2.92 0.00 -0.75 -2.84 119.26 119.80 1nba h ALA 81 Ca 0.39 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1nba h ALA 81 Cb 0.40 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1nba h ALA 81 CO -0.27 -0.21 0.16 0.00 0.00 0.00 0.00 179.25 178.93 1nba h ALA 82 N 0.60 0.39 0.00 0.00 0.00 -0.30 -1.99 119.26 117.95 1nba h ALA 82 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1nba h ALA 82 Cb 0.45 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1nba h ALA 82 CO 0.01 -0.08 0.00 2.89 0.00 0.00 0.00 179.25 182.07 1nba n ARG 83 N -4.81 0.15 0.27 0.00 1.85 0.29 -1.10 116.66 113.30 1nba n ARG 83 Ca -0.02 0.26 0.15 0.00 -1.00 0.00 0.00 57.85 57.25 1nba n ARG 83 Cb 0.08 -1.72 0.66 0.00 -1.05 0.00 0.00 32.46 30.42 1nba n ARG 83 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1nba h ALA 84 N 2.50 1.03 -0.13 2.89 0.00 -1.10 -3.08 119.26 121.37 1nba h ALA 84 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1nba h ALA 84 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1nba h ALA 84 CO 0.00 0.08 0.00 1.63 0.00 0.00 0.00 179.25 180.96 1nba n LYS 85 N -3.20 1.48 -2.09 0.00 4.76 -0.26 -4.97 118.16 113.88 1nba n LYS 85 Ca 0.00 -1.59 -0.08 0.00 -2.87 0.00 0.00 58.31 53.78 1nba n LYS 85 Cb 0.32 -1.30 -0.01 0.00 -1.84 0.00 0.00 35.03 32.21 1nba n LYS 85 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nba n GLY 86 N 0.83 0.10 3.73 0.72 0.00 -0.86 -0.31 105.19 109.40 1nba n GLY 86 Ca 0.10 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 1nba n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nba s VAL 87 N -2.39 3.80 0.23 1.61 1.01 -0.70 -4.65 120.40 119.32 1nba s VAL 87 Ca 0.00 1.49 -0.32 0.00 0.00 0.00 0.00 61.98 63.15 1nba s VAL 87 Cb 0.00 -3.95 -0.12 0.00 0.00 0.00 0.00 36.38 32.31 1nba s VAL 87 CO 0.00 0.22 1.65 -2.65 0.00 0.00 0.00 175.10 174.33 1nba n PRO 88 N 2.70 2.64 -4.89 2.72 -0.02 -1.26 -4.59 135.00 132.30 1nba n PRO 88 Ca 0.04 0.95 -0.28 0.00 -2.02 0.00 0.00 63.50 62.19 1nba n PRO 88 Cb 0.46 -2.76 -0.17 0.00 -0.02 0.00 0.00 33.50 31.02 1nba n PRO 88 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nba s VAL 89 N 0.72 1.56 0.11 -1.45 1.01 -1.26 -1.18 120.40 119.90 1nba s VAL 89 Ca 0.72 -0.75 0.09 0.00 0.00 0.00 0.00 61.98 62.05 1nba s VAL 89 Cb -0.53 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1nba s VAL 89 CO 0.39 0.45 -0.23 -0.36 0.00 0.00 0.00 175.10 175.34 1nba s PHE 90 N 0.35 1.99 0.03 5.22 0.40 0.41 -2.41 117.98 123.96 1nba s PHE 90 Ca -0.12 -0.40 0.06 0.00 -0.60 0.00 0.00 56.93 55.87 1nba s PHE 90 Cb -0.15 -1.09 -0.02 0.00 0.51 0.00 0.00 43.02 42.26 1nba s PHE 90 CO 0.05 0.24 -0.18 0.71 0.70 0.00 0.00 175.22 176.74 1nba s TYR 91 N -1.09 1.58 0.15 0.36 1.51 0.37 -0.57 117.35 119.65 1nba s TYR 91 Ca 0.09 -0.35 0.09 0.00 -1.01 0.00 0.00 57.07 55.89 1nba s TYR 91 Cb -0.10 -0.95 -0.04 0.00 -0.11 0.00 0.00 41.96 40.76 1nba s TYR 91 CO 0.05 0.06 -0.17 0.95 -1.11 0.00 0.00 175.55 175.32 1nba s THR 92 N -0.75 2.81 -0.03 -0.71 -4.23 -0.59 -0.23 115.64 111.90 1nba s THR 92 Ca 0.05 -1.64 0.01 0.00 -1.18 0.00 0.00 61.69 58.94 1nba s THR 92 Cb -0.08 -2.32 0.02 0.00 1.34 0.00 0.00 72.50 71.45 1nba s THR 92 CO 0.01 0.01 -0.05 0.28 -0.54 0.00 0.00 174.62 174.33 1nba s THR 93 N -1.36 0.55 -0.57 3.99 -1.32 -0.51 -2.02 115.64 114.41 1nba s THR 93 Ca 0.20 -0.18 -0.17 0.00 -1.21 0.00 0.00 61.69 60.33 1nba s THR 93 Cb -0.10 -0.55 0.12 0.00 -1.51 0.00 0.00 72.50 70.47 1nba s THR 93 CO 0.11 0.21 0.60 0.21 -2.21 0.00 0.00 174.62 173.54 1nba s ASN 94 N 0.62 6.20 0.06 8.08 2.47 -1.26 -1.33 114.94 129.78 1nba s ASN 94 Ca -0.08 -1.65 -0.03 0.00 0.42 0.00 0.00 52.86 51.51 1nba s ASN 94 Cb -0.12 -2.25 -0.03 0.00 -1.45 0.00 0.00 41.25 37.40 1nba s ASN 94 CO 0.00 -0.97 0.03 0.68 -3.72 0.00 0.00 177.10 173.12 1nba s VAL 95 N 2.05 0.20 0.03 -5.21 -7.23 -1.16 -4.90 120.40 104.18 1nba s VAL 95 Ca 0.07 -1.66 0.07 0.00 -1.81 0.00 0.00 61.98 58.65 1nba s VAL 95 Cb -0.27 -1.49 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 1nba s VAL 95 CO 0.04 -0.90 -0.19 -0.31 -0.31 0.00 0.00 175.10 173.43 1nba s TYR 96 N -3.91 1.70 -0.02 2.82 2.02 0.29 -4.72 117.35 115.52 1nba s TYR 96 Ca 0.07 -0.35 0.09 0.00 -0.37 0.00 0.00 57.07 56.50 1nba s TYR 96 Cb 0.07 -1.03 -0.23 0.00 -0.40 0.00 0.00 41.96 40.36 1nba s TYR 96 CO -0.10 0.05 0.73 0.00 -1.57 0.00 0.00 175.55 174.66 1nba h ARG 97 N 5.12 0.04 -3.26 -0.62 2.47 -1.94 0.13 114.38 116.33 1nba h ARG 97 Ca -0.40 -0.07 -0.58 0.00 -1.26 0.00 0.00 59.98 57.66 1nba h ARG 97 Cb 1.16 0.03 -0.40 0.00 -1.65 0.00 0.00 29.97 29.11 1nba h ARG 97 CO 0.45 0.67 -0.77 1.21 0.56 0.00 0.00 179.97 182.10 1nba s ASN 98 N -6.33 3.80 -0.18 7.04 3.04 -1.26 -4.92 114.94 116.13 1nba s ASN 98 Ca -0.06 -1.76 0.04 0.00 0.04 0.00 0.00 52.86 51.11 1nba s ASN 98 Cb 0.08 -0.76 0.34 0.00 -1.54 0.00 0.00 41.25 39.37 1nba s ASN 98 CO 0.82 -0.39 1.31 0.54 -3.04 0.00 0.00 177.10 176.34 1nba n ARG 99 N 4.66 2.03 -3.58 0.43 1.74 -1.26 -2.94 116.66 117.74 1nba n ARG 99 Ca 0.00 -1.43 -0.40 0.00 -0.77 0.00 0.00 57.85 55.24 1nba n ARG 99 Cb 0.40 -1.66 -0.09 0.00 -1.02 0.00 0.00 32.46 30.09 1nba n ARG 99 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nba s ASP 100 N -0.18 5.67 0.00 0.55 2.15 -1.26 -4.86 116.67 118.74 1nba s ASP 100 Ca 0.26 -1.65 0.00 0.00 0.43 0.00 0.00 52.55 51.59 1nba s ASP 100 Cb 0.21 -2.00 0.00 0.00 -0.30 0.00 0.00 42.92 40.84 1nba s ASP 100 CO 0.06 -0.59 0.95 0.00 -0.17 0.00 0.00 175.17 175.42 1nba n ALA 101 N 4.92 0.97 1.16 3.66 0.00 -1.26 -1.42 120.51 128.54 1nba n ALA 101 Ca -0.09 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.47 1nba n ALA 101 Cb 0.42 -0.95 0.27 0.00 0.00 0.00 0.00 19.45 19.20 1nba n ALA 101 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1nba n SER 102 N -1.45 2.42 -4.87 0.00 3.41 -1.26 -4.94 113.62 106.91 1nba n SER 102 Ca 0.00 -1.80 -0.34 0.00 -0.26 0.00 0.00 58.87 56.46 1nba n SER 102 Cb 0.03 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 63.91 1nba n SER 102 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1nba s SER 103 N -1.96 6.61 0.00 4.04 0.15 -0.51 -4.98 113.70 117.05 1nba s SER 103 Ca 0.32 0.75 0.21 0.00 0.70 0.00 0.00 55.95 57.93 1nba s SER 103 Cb 0.20 -2.16 0.98 0.00 -1.71 0.00 0.00 66.02 63.34 1nba s SER 103 CO 0.31 0.17 1.68 0.61 1.20 0.00 0.00 173.24 177.21 1nba n GLY 104 N 0.85 -1.10 0.75 9.45 0.00 -1.26 -2.32 105.19 111.56 1nba n GLY 104 Ca -0.08 -0.09 0.07 0.00 0.00 0.00 0.00 46.02 45.93 1nba n GLY 104 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nba n THR 105 N -1.39 1.60 -2.41 2.61 -2.24 -1.26 -5.01 114.28 106.18 1nba n THR 105 Ca 0.08 -1.41 -0.36 0.00 -2.27 0.00 0.00 64.05 60.08 1nba n THR 105 Cb 0.21 0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.56 1nba n THR 105 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1nba s ASN 106 N -1.43 6.36 -0.13 3.42 2.20 -0.98 -4.70 114.94 119.68 1nba s ASN 106 Ca 0.32 2.13 0.15 0.00 -0.94 0.00 0.00 52.86 54.52 1nba s ASN 106 Cb 0.22 -2.59 0.42 0.00 -2.00 0.00 0.00 41.25 37.31 1nba s ASN 106 CO 0.12 -0.77 1.32 -0.90 -2.94 0.00 0.00 177.10 173.93 1nba n ASP 107 N -0.51 3.33 0.08 3.54 5.75 -1.15 -4.49 116.55 123.09 1nba n ASP 107 Ca 0.07 -2.83 0.08 0.00 -0.01 0.00 0.00 54.79 52.10 1nba n ASP 107 Cb 0.50 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.11 1nba n ASP 107 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 1nba n MET 108 N -0.56 0.61 0.00 0.11 2.81 -1.26 -4.91 117.12 113.92 1nba n MET 108 Ca 0.18 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.20 1nba n MET 108 Cb 0.74 -1.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.45 1nba n MET 108 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nba n GLY 109 N 1.25 2.55 0.18 3.03 0.00 -1.26 -2.42 105.19 108.51 1nba n GLY 109 Ca -0.03 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.78 1nba n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nba n LEU 110 N 0.00 0.81 0.25 0.99 4.77 -1.26 -3.87 117.00 118.70 1nba n LEU 110 Ca 0.00 -0.15 0.12 0.00 -0.03 0.00 0.00 56.01 55.94 1nba n LEU 110 Cb 0.00 -0.16 0.64 0.00 -2.33 0.00 0.00 43.42 41.56 1nba n LEU 110 CO 0.00 0.16 0.91 -0.25 -1.33 0.00 0.00 177.39 176.88 1nba h TRP 111 N 0.86 0.00 -0.17 -1.77 7.01 -1.86 0.53 115.95 120.55 1nba h TRP 111 Ca 0.00 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.01 1nba h TRP 111 Cb 0.48 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 1nba h TRP 111 CO 0.00 0.16 0.12 -0.92 -2.79 0.00 0.00 178.44 175.01 1nba h TYR 112 N 0.00 0.20 0.00 2.65 3.20 -1.67 0.12 116.97 121.47 1nba h TYR 112 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1nba h TYR 112 Cb 0.48 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.68 1nba h TYR 112 CO 0.00 0.12 0.00 0.43 -1.64 0.00 0.00 178.16 177.07 1nba n SER 113 N -4.51 0.00 0.00 -2.11 7.64 0.18 -4.08 113.62 110.74 1nba n SER 113 Ca -0.00 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.95 1nba n SER 113 Cb 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1nba n SER 113 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1nba n LYS 114 N -0.80 0.00 -4.35 1.43 4.76 0.21 -5.12 118.16 114.28 1nba n LYS 114 Ca 0.10 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.36 1nba n LYS 114 Cb 0.04 -0.55 -0.10 0.00 -1.84 0.00 0.00 35.03 32.58 1nba n LYS 114 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1nba s ILE 115 N -1.59 1.40 -1.45 -0.18 -4.36 -0.08 -5.06 121.20 109.88 1nba s ILE 115 Ca 0.00 -2.11 -0.13 0.00 -0.26 0.00 0.00 60.65 58.16 1nba s ILE 115 Cb 0.00 -2.23 -0.03 0.00 1.25 0.00 0.00 42.46 41.46 1nba s ILE 115 CO 0.00 -0.45 2.48 -0.81 0.24 0.00 0.00 174.94 176.41 1nba n PRO 116 N -0.42 3.04 -0.05 0.37 -0.04 -1.26 -4.32 135.00 132.32 1nba n PRO 116 Ca -0.07 -2.34 0.10 0.00 -0.04 0.00 0.00 63.50 61.15 1nba n PRO 116 Cb 0.62 -3.03 0.49 0.00 -0.04 0.00 0.00 33.50 31.54 1nba n PRO 116 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1nba h THR 117 N 3.62 0.96 0.00 0.52 1.35 -1.86 -1.02 112.91 116.48 1nba h THR 117 Ca 0.67 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 66.38 1nba h THR 117 Cb 0.48 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.39 1nba h THR 117 CO 1.83 0.08 0.02 -0.62 -0.25 0.00 0.00 175.52 176.58 1nba n GLU 118 N -4.47 0.07 -0.11 4.72 4.71 -1.26 -1.57 120.64 122.73 1nba n GLU 118 Ca 0.07 0.57 0.10 0.00 -0.01 0.00 0.00 57.16 57.88 1nba n GLU 118 Cb 0.27 -1.75 0.32 0.00 -1.01 0.00 0.00 31.44 29.27 1nba n GLU 118 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1nba n THR 119 N -1.89 0.29 -3.69 2.62 -2.24 -0.39 -4.65 114.28 104.32 1nba n THR 119 Ca -0.01 -0.40 -0.28 0.00 -2.27 0.00 0.00 64.05 61.09 1nba n THR 119 Cb 0.03 0.37 -0.10 0.00 -2.10 0.00 0.00 70.33 68.53 1nba n THR 119 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1nba n LEU 120 N 0.43 3.42 -4.76 3.22 4.77 -0.61 -5.00 117.00 118.48 1nba n LEU 120 Ca 0.15 -5.31 -0.40 0.00 -0.03 0.00 0.00 56.01 50.43 1nba n LEU 120 Cb 0.34 -0.74 -0.05 0.00 -2.33 0.00 0.00 43.42 40.63 1nba n LEU 120 CO 0.12 1.87 0.74 -2.84 -1.33 0.00 0.00 177.39 175.95 1nba s PRO 121 N -1.89 4.66 0.50 3.23 0.02 -1.26 -0.55 135.00 139.71 1nba s PRO 121 Ca 0.31 1.67 -0.21 0.00 0.02 0.00 0.00 61.00 62.78 1nba s PRO 121 Cb 0.03 -3.15 -0.07 0.00 0.02 0.00 0.00 34.50 31.34 1nba s PRO 121 CO -0.10 0.28 1.16 0.00 -0.33 0.00 0.00 177.00 178.01 1nba s ALA 122 N -1.23 2.85 -1.61 -1.55 0.00 0.03 -3.67 121.76 116.59 1nba s ALA 122 Ca 0.45 0.92 -0.02 0.00 0.00 0.00 0.00 51.96 53.31 1nba s ALA 122 Cb -0.29 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.45 1nba s ALA 122 CO 0.37 -0.75 0.24 -0.25 0.00 0.00 0.00 175.76 175.36 1nba n ASP 123 N -0.84 -5.67 -4.96 0.00 8.00 -1.26 -4.97 116.55 106.84 1nba n ASP 123 Ca 0.09 -0.11 -0.19 0.00 0.71 0.00 0.00 54.79 55.29 1nba n ASP 123 Cb 0.49 -4.67 0.00 0.00 -0.02 0.00 0.00 41.12 36.92 1nba n ASP 123 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1nba s SER 124 N -2.31 5.31 0.27 -2.24 1.04 -1.24 -4.98 113.70 109.55 1nba s SER 124 Ca 0.13 -0.64 -0.01 0.00 0.48 0.00 0.00 55.95 55.91 1nba s SER 124 Cb -0.06 -0.42 0.55 0.00 0.10 0.00 0.00 66.02 66.20 1nba s SER 124 CO 0.16 -0.83 1.75 0.22 0.98 0.00 0.00 173.24 175.51 1nba h TYR 125 N 0.71 0.74 0.00 5.02 3.20 -1.95 -0.97 116.97 123.71 1nba h TYR 125 Ca -0.39 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.51 1nba h TYR 125 Cb 1.28 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.35 1nba h TYR 125 CO 0.48 0.14 -0.03 -1.49 -1.64 0.00 0.00 178.16 175.62 1nba h TRP 126 N 0.58 0.00 0.00 -3.82 4.06 -1.93 -1.34 115.95 113.51 1nba h TRP 126 Ca 0.47 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.42 1nba h TRP 126 Cb 0.71 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.87 1nba h TRP 126 CO -0.10 0.03 -0.42 0.00 -3.56 0.00 0.00 178.44 174.39 1nba n ALA 127 N -2.27 3.13 -1.76 1.49 0.00 -0.37 -1.10 120.51 119.62 1nba n ALA 127 Ca -0.03 -0.27 -0.39 0.00 0.00 0.00 0.00 53.44 52.76 1nba n ALA 127 Cb 0.12 -1.21 -0.05 0.00 0.00 0.00 0.00 19.45 18.31 1nba n ALA 127 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1nba s GLN 128 N -3.04 4.64 0.40 0.00 -1.52 -0.50 -4.76 119.66 114.88 1nba s GLN 128 Ca 0.10 1.54 -0.26 0.00 -1.95 0.00 0.00 55.36 54.79 1nba s GLN 128 Cb 0.17 -3.04 -0.09 0.00 -0.22 0.00 0.00 33.01 29.83 1nba s GLN 128 CO 0.67 0.29 1.37 0.42 -0.25 0.00 0.00 175.29 177.79 1nba s ILE 129 N -1.35 2.37 0.21 1.08 -1.09 -1.26 -0.84 121.20 120.32 1nba s ILE 129 Ca 0.46 0.34 -0.32 0.00 -2.23 0.00 0.00 60.65 58.91 1nba s ILE 129 Cb -0.25 -3.21 -0.13 0.00 -1.58 0.00 0.00 42.46 37.29 1nba s ILE 129 CO 0.32 0.06 1.50 -0.67 -1.23 0.00 0.00 174.94 174.92 1nba n ASP 130 N 0.17 3.03 -0.33 3.58 -0.08 -0.67 -4.74 116.55 117.51 1nba n ASP 130 Ca 0.03 1.12 0.15 0.00 -1.51 0.00 0.00 54.79 54.58 1nba n ASP 130 Cb 0.42 -1.45 0.34 0.00 2.34 0.00 0.00 41.12 42.78 1nba n ASP 130 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1nba h ASP 131 N 5.04 0.55 0.03 1.67 3.32 -1.92 -1.23 116.42 123.88 1nba h ASP 131 Ca -0.45 0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1nba h ASP 131 Cb 1.26 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1nba h ASP 131 CO 0.82 0.08 0.00 0.03 -1.72 0.00 0.00 179.24 178.45 1nba h ARG 132 N 0.53 0.00 -0.16 3.56 3.08 -1.99 -2.28 114.38 117.13 1nba h ARG 132 Ca 0.60 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.46 1nba h ARG 132 Cb 1.11 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.83 1nba h ARG 132 CO -0.48 0.00 -0.96 0.44 -1.07 0.00 0.00 179.97 177.90 1nba n ILE 133 N -2.55 0.83 -1.56 2.04 -5.35 -0.48 -4.96 119.36 107.33 1nba n ILE 133 Ca -0.02 -2.04 -0.44 0.00 -0.27 0.00 0.00 62.75 59.97 1nba n ILE 133 Cb 0.05 0.72 -0.01 0.00 -1.74 0.00 0.00 39.64 38.67 1nba n ILE 133 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1nba n ALA 134 N -0.11 -0.57 -1.69 -1.28 0.00 -0.86 -4.87 120.51 111.13 1nba n ALA 134 Ca 0.11 0.37 -0.44 0.00 0.00 0.00 0.00 53.44 53.47 1nba n ALA 134 Cb 0.98 -1.96 -0.04 0.00 0.00 0.00 0.00 19.45 18.43 1nba n ALA 134 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1nba n PRO 135 N 0.69 2.43 -1.86 0.00 -0.02 -1.26 -5.03 135.00 129.94 1nba n PRO 135 Ca 0.11 0.87 -0.29 0.00 -2.02 0.00 0.00 63.50 62.17 1nba n PRO 135 Cb 0.32 -2.67 0.14 0.00 -0.02 0.00 0.00 33.50 31.27 1nba n PRO 135 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nba s ALA 136 N 0.95 2.36 0.13 3.55 0.00 -1.26 -4.96 121.76 122.52 1nba s ALA 136 Ca 0.76 -0.87 -0.31 0.00 0.00 0.00 0.00 51.96 51.55 1nba s ALA 136 Cb -0.60 -2.89 -0.08 0.00 0.00 0.00 0.00 23.12 19.55 1nba s ALA 136 CO 0.36 -2.08 1.31 -0.51 0.00 0.00 0.00 175.76 174.84 1nba s ASP 137 N -4.64 6.93 0.00 0.00 1.01 -1.26 -1.88 116.67 116.83 1nba s ASP 137 Ca 0.67 2.26 0.00 0.00 0.71 0.00 0.00 52.55 56.19 1nba s ASP 137 Cb -0.08 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1nba s ASP 137 CO 0.51 -0.55 0.00 0.61 0.21 0.00 0.00 175.17 175.95 1nba n GLY 138 N 3.05 1.08 3.81 0.21 0.00 -1.26 -5.05 105.19 107.04 1nba n GLY 138 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1nba n GLY 138 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nba s GLU 139 N -0.57 4.28 -0.17 1.61 2.02 -0.79 -4.87 118.70 120.21 1nba s GLU 139 Ca 0.00 1.00 -0.09 0.00 0.02 0.00 0.00 54.97 55.90 1nba s GLU 139 Cb 0.00 -2.61 -0.05 0.00 0.10 0.00 0.00 34.13 31.57 1nba s GLU 139 CO 0.00 0.22 0.12 0.08 0.02 0.00 0.00 175.26 175.70 1nba s VAL 140 N -1.79 5.33 -0.24 2.63 1.01 -1.01 -4.89 120.40 121.43 1nba s VAL 140 Ca 0.51 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.57 1nba s VAL 140 Cb -0.14 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1nba s VAL 140 CO 0.19 0.50 0.09 -0.69 0.00 0.00 0.00 175.10 175.19 1nba s VAL 141 N -0.09 4.57 -0.18 2.92 1.01 -1.26 -0.48 120.40 126.89 1nba s VAL 141 Ca 0.10 -0.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 1nba s VAL 141 Cb -0.11 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 1nba s VAL 141 CO 0.00 0.35 0.01 -0.63 0.00 0.00 0.00 175.10 174.83 1nba s ILE 142 N 1.38 4.15 -0.22 2.22 1.01 0.68 -4.94 121.20 125.47 1nba s ILE 142 Ca 0.06 -0.25 -0.19 0.00 0.00 0.00 0.00 60.65 60.26 1nba s ILE 142 Cb -0.15 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.43 1nba s ILE 142 CO 0.04 0.45 0.55 -1.61 0.00 0.00 0.00 174.94 174.37 1nba s GLU 143 N 0.69 4.16 0.25 2.79 2.02 -1.26 -1.43 118.70 125.92 1nba s GLU 143 Ca 0.00 0.44 0.10 0.00 0.02 0.00 0.00 54.97 55.54 1nba s GLU 143 Cb -0.14 -3.60 -0.05 0.00 0.10 0.00 0.00 34.13 30.45 1nba s GLU 143 CO 0.02 -0.24 -0.10 -1.59 0.02 0.00 0.00 175.26 173.37 1nba s LYS 144 N 1.94 2.00 0.00 1.61 -2.85 -0.44 -4.92 119.74 117.07 1nba s LYS 144 Ca 0.24 -1.52 0.09 0.00 -1.00 0.00 0.00 55.97 53.78 1nba s LYS 144 Cb -0.16 -2.01 -0.06 0.00 -2.06 0.00 0.00 37.83 33.55 1nba s LYS 144 CO 0.09 0.37 0.46 0.09 0.10 0.00 0.00 175.35 176.46 1nba n ASN 145 N -0.58 0.70 -4.32 0.03 5.03 -1.26 -2.99 115.26 111.86 1nba n ASN 145 Ca -0.07 -0.85 -0.19 0.00 0.87 0.00 0.00 54.58 54.34 1nba n ASN 145 Cb 0.59 0.80 -0.10 0.00 -1.02 0.00 0.00 39.78 40.04 1nba n ASN 145 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1nba s ARG 146 N -1.62 1.55 0.10 3.52 1.81 -1.26 -4.92 118.95 118.13 1nba s ARG 146 Ca 0.05 -1.86 -0.27 0.00 -1.72 0.00 0.00 55.73 51.93 1nba s ARG 146 Cb 0.07 -0.48 -0.10 0.00 -0.45 0.00 0.00 34.95 33.98 1nba s ARG 146 CO 0.31 -0.29 1.65 0.00 -0.68 0.00 0.00 175.30 176.29 1nba h ALA 147 N 2.23 -0.46 -2.67 2.13 0.00 -1.95 -3.42 119.26 115.12 1nba h ALA 147 Ca -0.38 -0.06 -0.50 0.00 0.00 0.00 0.00 54.91 53.97 1nba h ALA 147 Cb 1.25 0.37 0.04 0.00 0.00 0.00 0.00 17.79 19.45 1nba h ALA 147 CO 0.63 -0.80 0.47 0.45 0.00 0.00 0.00 179.25 180.01 1nba s SER 148 N -4.80 6.60 0.29 0.00 0.15 -1.26 -4.42 113.70 110.26 1nba s SER 148 Ca -0.16 2.25 0.22 0.00 0.70 0.00 0.00 55.95 58.97 1nba s SER 148 Cb 0.07 -2.61 1.07 0.00 -1.71 0.00 0.00 66.02 62.84 1nba s SER 148 CO 0.65 -0.61 1.67 0.00 1.20 0.00 0.00 173.24 176.15 1nba n ALA 149 N 0.06 1.33 -0.06 5.45 0.00 -1.26 -3.97 120.51 122.06 1nba n ALA 149 Ca 0.04 0.14 -0.07 0.00 0.00 0.00 0.00 53.44 53.56 1nba n ALA 149 Cb 0.47 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.53 1nba n ALA 149 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1nba h PHE 150 N 0.00 0.00 -1.93 0.00 0.04 -1.93 -3.42 116.94 109.70 1nba h PHE 150 Ca 0.00 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 60.13 1nba h PHE 150 Cb 0.17 0.00 0.04 0.00 2.20 0.00 0.00 35.95 38.36 1nba h PHE 150 CO 0.00 0.44 0.82 -0.35 -0.60 0.00 0.00 178.31 178.62 1nba n PRO 151 N -4.67 1.74 -0.97 1.51 -0.04 -1.25 -1.71 135.00 129.60 1nba n PRO 151 Ca -0.07 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1nba n PRO 151 Cb 0.25 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1nba n PRO 151 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nba n GLY 152 N 3.61 0.51 3.76 0.55 0.00 -1.26 -4.56 105.19 107.81 1nba n GLY 152 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 1nba n GLY 152 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nba s THR 153 N -2.24 1.06 -0.48 2.61 -4.23 -0.69 -4.90 115.64 106.77 1nba s THR 153 Ca 0.00 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.67 1nba s THR 153 Cb 0.00 -2.10 0.67 0.00 1.34 0.00 0.00 72.50 72.41 1nba s THR 153 CO 0.00 0.00 1.58 -0.46 -0.54 0.00 0.00 174.62 175.20 1nba n ASN 154 N -1.29 4.71 -0.29 3.99 2.04 -1.26 -4.62 115.26 118.53 1nba n ASN 154 Ca -0.20 -2.78 -0.01 0.00 -0.44 0.00 0.00 54.58 51.15 1nba n ASN 154 Cb 0.67 -0.58 0.11 0.00 -2.53 0.00 0.00 39.78 37.45 1nba n ASN 154 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 1nba h LEU 155 N 3.17 0.84 -1.13 -4.53 5.85 -1.85 -2.21 115.31 115.45 1nba h LEU 155 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 1nba h LEU 155 Cb 1.59 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 1nba h LEU 155 CO 0.31 0.57 -0.42 -0.08 -0.34 0.00 0.00 178.44 178.48 1nba h GLU 156 N 0.98 0.04 -0.73 1.25 4.81 -1.89 -1.42 114.58 117.62 1nba h GLU 156 Ca 0.33 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.48 1nba h GLU 156 Cb 0.05 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1nba h GLU 156 CO -0.13 0.45 0.22 -0.07 -0.73 0.00 0.00 179.01 178.75 1nba h LEU 157 N 0.03 1.08 0.12 1.64 3.38 -1.74 0.11 115.31 119.94 1nba h LEU 157 Ca -0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1nba h LEU 157 Cb 0.75 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1nba h LEU 157 CO 0.06 1.01 -0.06 -0.26 0.09 0.00 0.00 178.44 179.28 1nba h PHE 158 N 1.10 -0.15 -0.68 1.13 0.04 -1.15 -1.98 116.94 115.24 1nba h PHE 158 Ca 0.24 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.00 1nba h PHE 158 Cb 0.32 0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.49 1nba h PHE 158 CO 0.03 0.22 0.42 -0.07 -0.60 0.00 0.00 178.31 178.31 1nba h LEU 159 N -0.57 0.80 0.19 1.54 4.07 -1.19 -0.94 115.31 119.21 1nba h LEU 159 Ca -0.02 -0.05 -0.01 0.00 0.08 0.00 0.00 57.88 57.89 1nba h LEU 159 Cb 0.45 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 41.99 1nba h LEU 159 CO 0.03 0.61 -0.09 0.74 -1.08 0.00 0.00 178.44 178.65 1nba h THR 160 N 0.92 0.61 -0.96 0.22 2.02 -1.06 -1.39 112.91 113.27 1nba h THR 160 Ca 0.24 -1.07 0.13 0.00 0.77 0.00 0.00 66.41 66.49 1nba h THR 160 Cb -0.06 1.05 -0.08 0.00 -1.74 0.00 0.00 68.15 67.32 1nba h THR 160 CO -0.05 0.17 0.61 0.28 0.37 0.00 0.00 175.52 176.89 1nba h SER 161 N -0.95 0.82 -0.58 4.18 0.02 -1.38 -1.74 113.55 113.92 1nba h SER 161 Ca -0.03 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1nba h SER 161 Cb 0.47 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1nba h SER 161 CO 0.04 0.42 0.00 0.59 -1.14 0.00 0.00 176.83 176.75 1nba n ASN 162 N -4.60 5.20 -3.81 3.07 5.03 -0.36 -4.96 115.26 114.83 1nba n ASN 162 Ca 0.18 -2.72 -0.26 0.00 0.87 0.00 0.00 54.58 52.65 1nba n ASN 162 Cb 0.40 -0.64 0.03 0.00 -1.02 0.00 0.00 39.78 38.55 1nba n ASN 162 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1nba n ARG 163 N 0.78 -5.49 -2.58 3.52 3.00 -0.66 -4.96 116.66 110.27 1nba n ARG 163 Ca 0.26 0.62 -0.40 0.00 -0.01 0.00 0.00 57.85 58.32 1nba n ARG 163 Cb 1.05 -5.41 -0.05 0.00 0.00 0.00 0.00 32.46 28.06 1nba n ARG 163 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1nba s ILE 164 N -3.44 3.76 -0.14 0.55 -1.09 -0.54 -4.53 121.20 115.77 1nba s ILE 164 Ca 0.41 1.73 0.06 0.00 -2.23 0.00 0.00 60.65 60.61 1nba s ILE 164 Cb -0.20 -4.10 -0.07 0.00 -1.58 0.00 0.00 42.46 36.51 1nba s ILE 164 CO 0.82 0.39 0.18 -0.90 -1.23 0.00 0.00 174.94 174.20 1nba n ASP 165 N 1.49 1.94 -4.13 3.58 5.68 -0.06 -4.85 116.55 120.19 1nba n ASP 165 Ca -0.01 -0.32 -0.22 0.00 -0.50 0.00 0.00 54.79 53.74 1nba n ASP 165 Cb 0.46 1.13 -0.15 0.00 -1.14 0.00 0.00 41.12 41.42 1nba n ASP 165 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1nba s THR 166 N -1.94 1.18 -0.18 2.12 2.01 -1.15 -0.59 115.64 117.08 1nba s THR 166 Ca 0.00 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.24 1nba s THR 166 Cb 0.04 -1.01 0.04 0.00 0.01 0.00 0.00 72.50 71.58 1nba s THR 166 CO 0.23 0.24 -0.09 -0.22 -0.69 0.00 0.00 174.62 174.08 1nba s LEU 167 N -0.60 1.92 -0.26 4.42 2.96 0.24 -1.35 118.68 126.01 1nba s LEU 167 Ca 0.05 -0.72 -0.19 0.00 -0.22 0.00 0.00 54.13 53.05 1nba s LEU 167 Cb -0.06 -1.11 -0.02 0.00 0.50 0.00 0.00 46.19 45.49 1nba s LEU 167 CO 0.00 -0.14 0.58 -0.63 -1.32 0.00 0.00 176.35 174.84 1nba s ILE 168 N 1.50 5.02 -0.12 6.68 1.01 -0.26 -1.43 121.20 133.60 1nba s ILE 168 Ca 0.01 1.02 -0.02 0.00 0.00 0.00 0.00 60.65 61.66 1nba s ILE 168 Cb -0.15 -3.89 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 1nba s ILE 168 CO -0.09 0.05 -0.06 -0.69 0.00 0.00 0.00 174.94 174.16 1nba s VAL 169 N 2.42 3.72 0.35 2.92 1.01 -0.57 -0.72 120.40 129.53 1nba s VAL 169 Ca 0.24 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1nba s VAL 169 Cb -0.16 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1nba s VAL 169 CO 0.09 0.54 0.12 0.42 0.00 0.00 0.00 175.10 176.26 1nba s THR 170 N -0.05 0.66 0.00 3.92 -4.23 -0.63 -3.99 115.64 111.31 1nba s THR 170 Ca 0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 1nba s THR 170 Cb -0.13 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1nba s THR 170 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1nba n GLY 171 N -0.73 0.03 3.17 3.99 0.00 -0.50 -1.08 105.19 110.06 1nba n GLY 171 Ca -0.03 -2.25 -0.22 0.00 0.00 0.00 0.00 46.02 43.52 1nba n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nba s ALA 172 N -2.00 1.35 0.31 4.61 0.00 -0.69 -2.41 121.76 122.94 1nba s ALA 172 Ca 0.00 -0.84 0.09 0.00 0.00 0.00 0.00 51.96 51.21 1nba s ALA 172 Cb 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 1nba s ALA 172 CO 0.00 0.29 0.07 0.95 0.00 0.00 0.00 175.76 177.07 1nba s THR 173 N -0.69 3.11 0.26 0.00 -4.23 -1.26 -4.35 115.64 108.49 1nba s THR 173 Ca 0.04 -1.81 -0.03 0.00 -1.18 0.00 0.00 61.69 58.72 1nba s THR 173 Cb -0.07 -2.91 0.24 0.00 1.34 0.00 0.00 72.50 71.10 1nba s THR 173 CO 0.01 -0.25 1.83 0.00 -0.54 0.00 0.00 174.62 175.67 1nba h ALA 174 N 1.70 1.30 -0.26 3.99 0.00 -1.65 -1.08 119.26 123.27 1nba h ALA 174 Ca -0.44 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1nba h ALA 174 Cb 1.25 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1nba h ALA 174 CO 0.63 0.21 0.00 0.00 0.00 0.00 0.00 179.25 180.09 1nba n ALA 175 N -2.36 2.48 -2.18 0.00 0.00 -1.26 -3.69 120.51 113.50 1nba n ALA 175 Ca 0.15 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1nba n ALA 175 Cb 0.27 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1nba n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nba n GLY 176 N 1.26 2.25 0.34 0.00 0.00 -0.82 -4.97 105.19 103.26 1nba n GLY 176 Ca 0.17 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1nba n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nba h VAL 178 N 0.93 0.85 -0.09 0.00 2.07 -1.42 -1.82 116.25 116.77 1nba h VAL 178 Ca 0.25 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1nba h VAL 178 Cb -0.10 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1nba h VAL 178 CO -0.05 0.04 0.05 -0.09 0.02 0.00 0.00 177.57 177.53 1nba h ARG 179 N -0.33 0.12 -0.57 1.57 2.43 -1.62 -0.72 114.38 115.27 1nba h ARG 179 Ca -0.03 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1nba h ARG 179 Cb 0.25 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1nba h ARG 179 CO 0.04 0.15 0.32 1.25 -1.51 0.00 0.00 179.97 180.22 1nba h HIS 180 N 0.06 0.75 -0.24 2.20 2.76 -1.51 -0.84 115.15 118.32 1nba h HIS 180 Ca 0.03 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.18 1nba h HIS 180 Cb 0.06 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 28.77 1nba h HIS 180 CO -0.05 0.52 0.08 1.15 -1.30 0.00 0.00 177.93 178.33 1nba h THR 181 N 0.78 1.19 -0.42 6.26 2.02 -0.52 -1.87 112.91 120.36 1nba h THR 181 Ca 0.20 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 1nba h THR 181 Cb 0.01 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 1nba h THR 181 CO -0.03 0.20 0.25 0.58 0.37 0.00 0.00 175.52 176.89 1nba h VAL 182 N 0.23 1.14 -0.55 3.16 2.07 -0.58 -0.63 116.25 121.09 1nba h VAL 182 Ca 0.08 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.29 1nba h VAL 182 Cb 0.24 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1nba h VAL 182 CO -0.00 0.14 0.36 -0.33 0.02 0.00 0.00 177.57 177.75 1nba h GLU 183 N 0.55 0.71 -0.39 1.57 5.08 -1.08 -2.40 114.58 118.62 1nba h GLU 183 Ca 0.15 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1nba h GLU 183 Cb 0.01 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1nba h GLU 183 CO -0.03 0.47 0.23 -0.44 -1.00 0.00 0.00 179.01 178.24 1nba h ASP 184 N 0.73 0.48 0.23 1.42 3.32 -1.05 -2.89 116.42 118.66 1nba h ASP 184 Ca 0.20 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1nba h ASP 184 Cb -0.07 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1nba h ASP 184 CO -0.05 0.41 -0.19 0.00 -1.72 0.00 0.00 179.24 177.69 1nba h ALA 185 N 1.09 -0.41 -0.49 3.45 0.00 -0.69 0.12 119.26 122.33 1nba h ALA 185 Ca 0.14 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1nba h ALA 185 Cb 0.03 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1nba h ALA 185 CO -0.02 -0.75 0.24 0.97 0.00 0.00 0.00 179.25 179.68 1nba h ILE 186 N -0.43 1.17 -0.40 0.00 2.10 -1.33 0.88 117.51 119.50 1nba h ILE 186 Ca -0.01 -0.46 -0.16 0.00 1.08 0.00 0.00 64.86 65.31 1nba h ILE 186 Cb 0.38 0.54 -0.01 0.00 -1.09 0.00 0.00 36.82 36.65 1nba h ILE 186 CO -0.02 0.19 -0.36 0.00 -1.08 0.00 0.00 178.15 176.88 1nba h ALA 187 N 1.58 0.60 0.00 0.18 0.00 -1.20 -2.98 119.26 117.44 1nba h ALA 187 Ca 0.17 -0.45 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1nba h ALA 187 Cb 0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1nba h ALA 187 CO -0.02 0.68 -0.38 0.87 0.00 0.00 0.00 179.25 180.39 1nba h LYS 188 N 0.77 0.00 0.00 0.00 1.57 -0.14 -3.47 116.57 115.31 1nba h LYS 188 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1nba h LYS 188 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1nba h LYS 188 CO 0.09 0.38 0.00 0.41 -0.57 0.00 0.00 179.45 179.76 1nba n GLY 189 N 0.57 1.35 3.15 3.86 0.00 0.05 -5.08 105.19 109.09 1nba n GLY 189 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1nba n GLY 189 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nba s PHE 190 N -1.35 2.06 -0.34 1.61 0.08 0.09 -4.91 117.98 115.22 1nba s PHE 190 Ca 0.00 -0.75 -0.29 0.00 0.12 0.00 0.00 56.93 56.01 1nba s PHE 190 Cb 0.00 -1.40 -0.00 0.00 -0.57 0.00 0.00 43.02 41.04 1nba s PHE 190 CO 0.00 -0.30 1.53 1.03 -0.10 0.00 0.00 175.22 177.38 1nba s ARG 191 N 0.31 3.60 -0.21 0.44 0.52 0.24 -2.95 118.95 120.90 1nba s ARG 191 Ca -0.13 1.23 -0.26 0.00 -0.52 0.00 0.00 55.73 56.06 1nba s ARG 191 Cb -0.16 -4.05 -0.01 0.00 0.52 0.00 0.00 34.95 31.26 1nba s ARG 191 CO 0.06 -1.53 0.88 -2.14 0.02 0.00 0.00 175.30 172.58 1nba s PRO 192 N 4.97 4.25 -0.11 3.54 0.02 -1.26 -0.59 135.00 145.82 1nba s PRO 192 Ca 0.67 1.07 0.02 0.00 0.02 0.00 0.00 61.00 62.78 1nba s PRO 192 Cb -0.18 -3.61 -0.01 0.00 0.02 0.00 0.00 34.50 30.71 1nba s PRO 192 CO 0.31 -0.46 -0.16 0.42 -0.33 0.00 0.00 177.00 176.79 1nba s ILE 193 N 2.61 2.83 -0.24 2.83 1.09 -0.52 -1.46 121.20 128.34 1nba s ILE 193 Ca 0.38 -0.76 -0.01 0.00 -1.10 0.00 0.00 60.65 59.17 1nba s ILE 193 Cb -0.16 -2.15 0.03 0.00 -1.06 0.00 0.00 42.46 39.12 1nba s ILE 193 CO 0.09 0.54 -0.08 -0.63 -0.10 0.00 0.00 174.94 174.77 1nba s ILE 194 N 0.12 2.71 -0.59 2.92 1.09 0.06 -1.52 121.20 125.99 1nba s ILE 194 Ca -0.08 -1.06 -0.27 0.00 -1.10 0.00 0.00 60.65 58.14 1nba s ILE 194 Cb -0.15 -2.37 0.03 0.00 -1.06 0.00 0.00 42.46 38.92 1nba s ILE 194 CO 0.05 0.22 1.15 -2.16 -0.10 0.00 0.00 174.94 174.11 1nba s PRO 195 N 1.30 3.45 0.29 2.79 0.04 -1.26 -0.43 135.00 141.18 1nba s PRO 195 Ca -0.00 0.10 -0.05 0.00 0.04 0.00 0.00 61.00 61.09 1nba s PRO 195 Cb -0.16 -4.04 0.55 0.00 0.04 0.00 0.00 34.50 30.89 1nba s PRO 195 CO -0.06 -1.69 1.56 -2.13 0.04 0.00 0.00 177.00 174.73 1nba n ARG 196 N 8.33 -0.09 0.00 4.56 0.63 0.58 -1.03 116.66 129.65 1nba n ARG 196 Ca 0.07 1.54 0.07 0.00 -0.92 0.00 0.00 57.85 58.61 1nba n ARG 196 Cb 0.49 -2.34 0.37 0.00 0.45 0.00 0.00 32.46 31.43 1nba n ARG 196 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1nba n GLU 197 N -5.59 0.20 -0.20 -0.14 4.71 -1.26 -2.13 120.64 116.23 1nba n GLU 197 Ca 0.18 0.15 0.11 0.00 -0.01 0.00 0.00 57.16 57.59 1nba n GLU 197 Cb 0.58 -1.50 0.21 0.00 -1.01 0.00 0.00 31.44 29.72 1nba n GLU 197 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1nba n THR 198 N -1.29 0.58 -3.87 2.62 -2.24 -0.19 -4.19 114.28 105.70 1nba n THR 198 Ca 0.07 -0.79 -0.36 0.00 -2.27 0.00 0.00 64.05 60.70 1nba n THR 198 Cb 0.12 0.90 -0.07 0.00 -2.10 0.00 0.00 70.33 69.18 1nba n THR 198 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1nba s ILE 199 N -1.34 5.38 0.22 2.28 -1.09 -0.91 -1.41 121.20 124.34 1nba s ILE 199 Ca 0.37 0.17 0.00 0.00 -2.23 0.00 0.00 60.65 58.96 1nba s ILE 199 Cb 0.21 -3.38 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 1nba s ILE 199 CO 0.29 0.55 0.14 -0.83 -1.23 0.00 0.00 174.94 173.87 1nba s GLY 200 N -0.52 1.57 0.12 6.18 0.00 -1.01 -4.97 107.32 108.70 1nba s GLY 200 Ca 0.12 -1.75 -0.04 0.00 0.00 0.00 0.00 44.72 43.04 1nba s GLY 200 CO 0.02 -1.44 0.24 1.34 0.00 0.00 0.00 173.10 173.26 1nba n ASP 201 N -0.42 -0.70 0.00 1.64 -0.08 -1.26 -1.96 116.55 113.76 1nba n ASP 201 Ca 0.02 -1.51 0.00 0.00 -1.51 0.00 0.00 54.79 51.79 1nba n ASP 201 Cb 0.66 1.18 0.00 0.00 2.34 0.00 0.00 41.12 45.29 1nba n ASP 201 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1nba n ARG 202 N -0.17 0.54 -4.21 -0.67 1.85 -1.26 -3.96 116.66 108.77 1nba n ARG 202 Ca -0.03 -0.64 -0.12 0.00 -1.00 0.00 0.00 57.85 56.06 1nba n ARG 202 Cb 0.19 -0.75 -0.10 0.00 -1.05 0.00 0.00 32.46 30.74 1nba n ARG 202 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 1nba s VAL 203 N -0.26 0.65 0.50 8.89 -7.23 -1.26 -4.98 120.40 116.71 1nba s VAL 203 Ca 0.00 -1.96 -0.20 0.00 -1.81 0.00 0.00 61.98 58.01 1nba s VAL 203 Cb 0.00 -1.97 -0.08 0.00 0.56 0.00 0.00 36.38 34.90 1nba s VAL 203 CO 0.00 -0.61 1.07 -2.16 -0.31 0.00 0.00 175.10 173.09 1nba s PRO 204 N -3.89 3.65 0.00 4.82 0.04 -1.26 -4.22 135.00 134.13 1nba s PRO 204 Ca 0.20 1.46 0.00 0.00 0.04 0.00 0.00 61.00 62.70 1nba s PRO 204 Cb 0.06 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1nba s PRO 204 CO 0.01 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.88 1nba n GLY 205 N -0.09 1.59 0.39 0.56 0.00 -1.26 -4.83 105.19 101.56 1nba n GLY 205 Ca 0.10 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.29 1nba n GLY 205 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1nba h VAL 206 N 0.00 0.74 0.06 1.61 -1.51 -2.00 -1.17 116.25 113.99 1nba h VAL 206 Ca 0.00 -0.17 -0.00 0.00 -1.23 0.00 0.00 66.70 65.30 1nba h VAL 206 Cb 0.00 0.20 0.00 0.00 -2.13 0.00 0.00 31.29 29.36 1nba h VAL 206 CO 0.00 0.09 -0.03 0.58 -1.23 0.00 0.00 177.57 176.98 1nba h VAL 207 N 0.49 1.16 0.33 7.19 2.07 -1.88 -1.41 116.25 124.20 1nba h VAL 207 Ca 0.45 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1nba h VAL 207 Cb 1.00 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 32.40 1nba h VAL 207 CO -0.18 0.19 -0.40 1.56 0.02 0.00 0.00 177.57 178.75 1nba h GLN 208 N -0.43 -0.75 -0.08 1.57 4.20 -1.83 -0.91 115.11 116.88 1nba h GLN 208 Ca -0.01 0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.60 1nba h GLN 208 Cb 0.38 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1nba h GLN 208 CO 0.01 -0.50 -0.60 0.11 -0.67 0.00 0.00 178.83 177.18 1nba h TRP 209 N -0.78 0.35 -0.35 2.96 0.09 -1.29 -2.12 115.95 114.81 1nba h TRP 209 Ca -0.02 -0.13 -0.15 0.00 0.09 0.00 0.00 58.89 58.68 1nba h TRP 209 Cb 0.72 -0.06 -0.01 0.00 0.08 0.00 0.00 29.16 29.89 1nba h TRP 209 CO -0.26 0.81 -0.37 -0.91 0.09 0.00 0.00 178.44 177.80 1nba h ASN 210 N 0.20 0.88 -0.01 0.11 4.21 -1.22 -0.66 115.58 119.09 1nba h ASN 210 Ca -0.01 -0.39 -0.11 0.00 1.21 0.00 0.00 56.30 57.01 1nba h ASN 210 Cb 1.11 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 38.05 1nba h ASN 210 CO 0.10 1.15 -0.31 -0.07 -1.29 0.00 0.00 177.43 177.01 1nba h LEU 211 N 0.69 0.48 -0.33 1.61 3.38 -1.04 -0.51 115.31 119.58 1nba h LEU 211 Ca 0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1nba h LEU 211 Cb 0.93 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1nba h LEU 211 CO 0.09 0.76 0.13 0.22 0.09 0.00 0.00 178.44 179.73 1nba h TYR 212 N 0.40 0.51 -0.74 1.13 3.20 -1.19 0.08 116.97 120.36 1nba h TYR 212 Ca 0.05 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 1nba h TYR 212 Cb 0.74 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 1nba h TYR 212 CO 0.02 0.48 0.25 -0.44 -1.64 0.00 0.00 178.16 176.83 1nba h ASP 213 N 0.39 1.06 -0.08 -2.11 5.19 -0.68 -1.87 116.42 118.32 1nba h ASP 213 Ca 0.11 -0.19 -0.01 0.00 -0.62 0.00 0.00 57.03 56.33 1nba h ASP 213 Cb 0.18 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.41 1nba h ASP 213 CO -0.01 0.97 0.03 0.40 -3.12 0.00 0.00 179.24 177.51 1nba h ILE 214 N 1.10 1.15 0.00 0.35 2.04 -0.91 -2.50 117.51 118.75 1nba h ILE 214 Ca 0.24 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 1nba h ILE 214 Cb 0.28 1.31 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1nba h ILE 214 CO -0.01 0.13 -0.02 -0.78 0.00 0.00 0.00 178.15 177.47 1nba h ASP 215 N -0.04 0.00 0.55 1.72 3.58 -0.75 0.21 116.42 121.69 1nba h ASP 215 Ca 0.03 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.19 1nba h ASP 215 Cb 0.18 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.25 1nba h ASP 215 CO -0.00 0.02 -1.30 0.78 -2.88 0.00 0.00 179.24 175.86 1nba h ASN 216 N 0.00 0.52 0.00 2.28 2.35 -0.89 -3.43 115.58 116.41 1nba h ASN 216 Ca -0.00 -0.56 0.00 0.00 -0.55 0.00 0.00 56.30 55.19 1nba h ASN 216 Cb 0.28 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1nba h ASN 216 CO 0.00 1.44 0.00 0.29 -1.65 0.00 0.00 177.43 177.51 1nba n LYS 217 N -3.57 0.61 0.00 0.81 5.02 -1.10 -1.92 118.16 118.00 1nba n LYS 217 Ca -0.10 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 1nba n LYS 217 Cb 1.04 -0.41 0.00 0.00 -0.02 0.00 0.00 35.03 35.64 1nba n LYS 217 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1nba n PHE 218 N -0.11 0.00 -3.64 2.13 3.72 0.67 -5.07 117.46 115.15 1nba n PHE 218 Ca 0.00 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.36 1nba n PHE 218 Cb 0.11 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.63 1nba n PHE 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1nba s GLY 219 N -1.30 -0.34 -0.17 1.37 0.00 -0.75 -4.61 107.32 101.52 1nba s GLY 219 Ca 0.00 0.64 -0.13 0.00 0.00 0.00 0.00 44.72 45.23 1nba s GLY 219 CO 0.00 0.17 0.26 0.99 0.00 0.00 0.00 173.10 174.52 1nba s ASP 220 N -2.75 6.39 -0.22 1.64 1.01 -0.54 -3.62 116.67 118.59 1nba s ASP 220 Ca 0.11 0.45 -0.16 0.00 0.71 0.00 0.00 52.55 53.65 1nba s ASP 220 Cb 0.00 -2.16 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 1nba s ASP 220 CO -0.03 0.12 0.43 -0.69 0.21 0.00 0.00 175.17 175.21 1nba s VAL 221 N 0.41 5.17 0.30 -1.27 1.01 -1.26 -0.76 120.40 123.98 1nba s VAL 221 Ca 0.15 0.75 0.04 0.00 0.00 0.00 0.00 61.98 62.91 1nba s VAL 221 Cb -0.13 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 1nba s VAL 221 CO 0.03 0.21 0.03 -1.61 0.00 0.00 0.00 175.10 173.76 1nba s GLU 222 N 1.56 1.56 0.42 2.72 0.41 0.43 -4.93 118.70 120.87 1nba s GLU 222 Ca 0.20 -1.84 -0.14 0.00 -0.41 0.00 0.00 54.97 52.77 1nba s GLU 222 Cb -0.15 -0.82 -0.08 0.00 -1.78 0.00 0.00 34.13 31.30 1nba s GLU 222 CO 0.09 -0.15 0.84 -1.54 -0.49 0.00 0.00 175.26 174.01 1nba s SER 223 N -3.43 6.65 0.38 -0.19 1.04 -1.26 -0.31 113.70 116.57 1nba s SER 223 Ca 0.34 1.35 0.05 0.00 0.48 0.00 0.00 55.95 58.17 1nba s SER 223 Cb 0.07 -2.41 0.76 0.00 0.10 0.00 0.00 66.02 64.54 1nba s SER 223 CO 0.14 -0.40 2.01 0.74 0.98 0.00 0.00 173.24 176.70 1nba h THR 224 N 1.33 1.09 -0.69 2.02 2.02 -1.93 -1.50 112.91 115.26 1nba h THR 224 Ca -0.47 -0.24 0.04 0.00 0.77 0.00 0.00 66.41 66.50 1nba h THR 224 Cb 1.18 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 1nba h THR 224 CO 0.63 0.13 0.42 0.44 0.37 0.00 0.00 175.52 177.51 1nba h ASP 225 N 0.71 0.68 -0.28 4.18 3.32 -1.99 0.14 116.42 123.18 1nba h ASP 225 Ca 0.23 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 1nba h ASP 225 Cb 0.04 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1nba h ASP 225 CO -0.06 0.46 0.14 -1.28 -1.72 0.00 0.00 179.24 176.78 1nba h SER 226 N 0.81 0.37 -0.40 6.45 0.87 -1.68 -0.74 113.55 119.23 1nba h SER 226 Ca 0.28 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 1nba h SER 226 Cb 0.06 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 1nba h SER 226 CO -0.12 0.39 0.18 0.58 -0.53 0.00 0.00 176.83 177.33 1nba h VAL 227 N 0.32 1.18 -0.39 2.23 2.07 -0.66 -0.66 116.25 120.35 1nba h VAL 227 Ca 0.10 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1nba h VAL 227 Cb 0.12 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1nba h VAL 227 CO -0.01 0.19 0.16 0.58 0.02 0.00 0.00 177.57 178.52 1nba h VAL 228 N 0.50 1.19 -0.59 2.57 2.07 -0.64 -0.54 116.25 120.81 1nba h VAL 228 Ca 0.14 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.11 1nba h VAL 228 Cb 0.14 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 1nba h VAL 228 CO -0.02 0.21 0.36 -0.61 0.02 0.00 0.00 177.57 177.54 1nba h GLN 229 N 0.48 0.70 0.20 1.57 4.15 -0.89 0.18 115.11 121.51 1nba h GLN 229 Ca 0.13 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 1nba h GLN 229 Cb 0.17 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1nba h GLN 229 CO -0.01 0.46 -0.17 -0.92 -1.93 0.00 0.00 178.83 176.26 1nba h TYR 230 N 0.72 -0.43 0.00 3.99 3.20 -0.67 -1.71 116.97 122.07 1nba h TYR 230 Ca 0.24 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 1nba h TYR 230 Cb 0.01 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 1nba h TYR 230 CO -0.05 -0.26 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.11 1nba h LEU 231 N -0.38 0.00 -0.99 2.82 3.38 -0.46 -1.62 115.31 118.05 1nba h LEU 231 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1nba h LEU 231 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1nba h LEU 231 CO -0.02 0.03 -0.45 0.44 0.09 0.00 0.00 178.44 178.54 1nba h ASP 232 N 0.00 0.00 -0.23 -0.43 3.32 0.05 -2.68 116.42 116.44 1nba h ASP 232 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1nba h ASP 232 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1nba h ASP 232 CO 0.00 0.45 0.00 0.00 -1.72 0.00 0.00 179.24 177.97 1nba n ALA 233 N -2.37 2.49 -1.77 3.45 0.00 -0.63 -4.94 120.51 116.73 1nba n ALA 233 Ca -0.01 -0.65 -0.37 0.00 0.00 0.00 0.00 53.44 52.41 1nba n ALA 233 Cb 0.51 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.93 1nba n ALA 233 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1nba s LEU 234 N -1.52 4.04 1.20 0.00 1.98 -1.01 -5.05 118.68 118.32 1nba s LEU 234 Ca 0.33 2.32 -0.15 0.00 -2.89 0.00 0.00 54.13 53.74 1nba s LEU 234 Cb 0.18 -4.21 0.29 0.00 0.66 0.00 0.00 46.19 43.12 1nba s LEU 234 CO 0.27 -0.88 1.02 -2.16 -1.89 0.00 0.00 176.35 172.71 1nba s PRO 235 N -2.63 -1.18 0.28 0.98 0.04 -1.26 -4.97 135.00 126.25 1nba s PRO 235 Ca 0.63 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 61.92 1nba s PRO 235 Cb -0.29 -1.55 -0.10 0.00 0.04 0.00 0.00 34.50 32.60 1nba s PRO 235 CO 0.35 -3.82 1.47 -0.65 0.04 0.00 0.00 177.00 174.39 1nba s GLN 236 N -4.73 4.22 0.26 4.56 -1.52 -1.26 -4.87 119.66 116.32 1nba s GLN 236 Ca 0.68 2.39 -0.03 0.00 -1.95 0.00 0.00 55.36 56.45 1nba s GLN 236 Cb -0.21 -3.07 0.55 0.00 -0.22 0.00 0.00 33.01 30.06 1nba s GLN 236 CO 0.62 -0.46 1.66 0.35 -0.25 0.00 0.00 175.29 177.21 1nba h PHE 237 N 4.59 0.24 0.00 0.91 3.57 -0.93 -0.35 116.94 124.96 1nba h PHE 237 Ca -0.47 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.08 1nba h PHE 237 Cb 1.22 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1nba h PHE 237 CO 0.58 -0.16 0.23 1.05 -2.23 0.00 0.00 178.31 177.79 1nba h GLU 238 N 0.22 0.00 -0.21 1.11 4.11 -1.87 0.92 114.58 118.86 1nba h GLU 238 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.89 1nba h GLU 238 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1nba h GLU 238 CO -0.60 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.23 1nba n ASP 239 N -2.82 3.24 -4.85 3.06 8.00 -0.14 -4.98 116.55 118.05 1nba n ASP 239 Ca -0.02 -2.00 -0.33 0.00 0.71 0.00 0.00 54.79 53.15 1nba n ASP 239 Cb 0.28 -0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 1nba n ASP 239 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1nba s THR 240 N -1.74 4.75 0.01 -3.53 -4.23 0.32 -4.97 115.64 106.24 1nba s THR 240 Ca 0.33 0.85 0.07 0.00 -1.18 0.00 0.00 61.69 61.77 1nba s THR 240 Cb 0.21 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 70.38 1nba s THR 240 CO 0.31 -0.07 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.42 1nba s VAL 241 N -1.83 1.67 0.74 2.29 1.01 -1.26 -4.93 120.40 118.09 1nba s VAL 241 Ca 0.49 -1.04 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 1nba s VAL 241 Cb -0.12 -1.42 0.03 0.00 0.00 0.00 0.00 36.38 34.88 1nba s VAL 241 CO 0.19 0.35 1.08 -2.16 0.00 0.00 0.00 175.10 174.56 1nba s PRO 242 N -0.81 2.60 -0.03 2.72 0.04 -1.26 -4.26 135.00 134.00 1nba s PRO 242 Ca 0.08 0.79 -0.25 0.00 0.04 0.00 0.00 61.00 61.66 1nba s PRO 242 Cb -0.08 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 1nba s PRO 242 CO 0.00 -1.30 0.75 0.15 0.04 0.00 0.00 177.00 176.65 1nba s LYS 243 N -5.11 4.47 0.08 4.56 1.02 -1.26 -4.94 119.74 118.54 1nba s LYS 243 Ca 0.59 1.00 0.27 0.00 0.02 0.00 0.00 55.97 57.85 1nba s LYS 243 Cb -0.14 -3.42 0.98 0.00 -0.52 0.00 0.00 37.83 34.73 1nba s LYS 243 CO 0.54 0.11 1.80 0.25 -0.92 0.00 0.00 175.35 177.13 1nba n THR 244 N 3.52 0.22 -3.98 2.17 -2.24 -1.26 -4.92 114.28 107.79 1nba n THR 244 Ca -0.01 -0.11 -0.11 0.00 -2.27 0.00 0.00 64.05 61.55 1nba n THR 244 Cb 0.51 -0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 68.27 1nba n THR 244 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1nba s LEU 245 N -3.58 0.49 0.69 3.22 1.43 -1.26 -5.16 118.68 114.50 1nba s LEU 245 Ca 0.12 -1.18 -0.15 0.00 -1.03 0.00 0.00 54.13 51.90 1nba s LEU 245 Cb 0.16 1.94 0.01 0.00 0.03 0.00 0.00 46.19 48.34 1nba s LEU 245 CO 0.58 -1.33 1.14 -0.55 0.23 0.00 0.00 176.35 176.41 1nba s SER 246 N -3.11 4.80 0.28 2.29 0.15 -1.26 -4.99 113.70 111.86 1nba s SER 246 Ca 0.23 2.10 -0.29 0.00 0.70 0.00 0.00 55.95 58.69 1nba s SER 246 Cb -0.02 -2.56 -0.10 0.00 -1.71 0.00 0.00 66.02 61.63 1nba s SER 246 CO 0.14 -1.84 1.20 -1.81 1.20 0.00 0.00 173.24 172.13 1nba s ASP 247 N -2.44 7.03 0.29 5.45 1.01 -1.26 -4.97 116.67 121.79 1nba s ASP 247 Ca 0.69 2.43 -0.29 0.00 0.71 0.00 0.00 52.55 56.09 1nba s ASP 247 Cb -0.23 -2.63 -0.13 0.00 1.01 0.00 0.00 42.92 40.94 1nba s ASP 247 CO 0.43 -0.34 1.27 -0.81 0.21 0.00 0.00 175.17 175.93 1nba n PRO 248 N 1.30 1.92 -4.37 8.23 -0.04 -1.26 -5.02 135.00 135.76 1nba n PRO 248 Ca 0.00 0.68 -0.29 0.00 -0.04 0.00 0.00 63.50 63.85 1nba n PRO 248 Cb 0.43 -2.24 -0.12 0.00 -0.04 0.00 0.00 33.50 31.53 1nba n PRO 248 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1nba s GLN 249 N -1.26 1.53 -0.67 0.54 -1.52 -1.26 -5.05 119.66 111.97 1nba s GLN 249 Ca 0.61 -1.32 -0.26 0.00 -1.95 0.00 0.00 55.36 52.44 1nba s GLN 249 Cb -0.63 -1.96 -0.06 0.00 -0.22 0.00 0.00 33.01 30.14 1nba s GLN 249 CO 0.57 0.45 2.15 -1.25 -0.25 0.00 0.00 175.29 176.96 1nba s PRO 250 N -2.16 2.25 0.18 2.91 0.04 -1.26 -4.92 135.00 132.03 1nba s PRO 250 Ca 0.16 0.64 -0.30 0.00 0.04 0.00 0.00 61.00 61.54 1nba s PRO 250 Cb -0.10 -4.66 -0.08 0.00 0.04 0.00 0.00 34.50 29.70 1nba s PRO 250 CO 0.08 -3.36 1.16 -1.21 0.04 0.00 0.00 177.00 173.71 1nba s GLU 251 N 7.76 4.53 0.17 4.56 2.02 -1.26 -5.05 118.70 131.43 1nba s GLU 251 Ca 0.82 1.82 -0.01 0.00 0.02 0.00 0.00 54.97 57.62 1nba s GLU 251 Cb -0.13 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.81 1nba s GLU 251 CO 0.15 -0.03 0.35 0.14 0.02 0.00 0.00 175.26 175.90 1nba s VAL 252 N -0.11 5.24 0.04 2.63 -7.23 -1.26 -5.09 120.40 114.62 1nba s VAL 252 Ca 0.52 -0.37 -0.18 0.00 -1.81 0.00 0.00 61.98 60.13 1nba s VAL 252 Cb -0.31 -3.71 -0.06 0.00 0.56 0.00 0.00 36.38 32.85 1nba s VAL 252 CO 0.36 -0.10 0.53 -0.70 -0.31 0.00 0.00 175.10 174.87 1nba s GLU 253 N -3.15 4.14 0.11 4.82 2.12 -1.26 -5.03 118.70 120.46 1nba s GLU 253 Ca 0.38 0.64 -0.31 0.00 0.36 0.00 0.00 54.97 56.04 1nba s GLU 253 Cb -0.11 -3.25 -0.09 0.00 0.26 0.00 0.00 34.13 30.94 1nba s GLU 253 CO 0.28 0.61 1.55 0.00 -0.54 0.00 0.00 175.26 177.16 1nba s ALA 254 N -0.96 3.70 0.48 6.30 0.00 -1.26 -4.98 121.76 125.04 1nba s ALA 254 Ca 0.28 1.24 -0.24 0.00 0.00 0.00 0.00 51.96 53.23 1nba s ALA 254 Cb -0.19 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.24 1nba s ALA 254 CO 0.17 -0.85 1.42 -2.30 0.00 0.00 0.00 175.76 174.20 1nba n PRO 255 N 4.56 2.13 -3.03 0.00 -0.02 -1.26 -5.01 135.00 132.37 1nba n PRO 255 Ca 0.14 0.76 -0.30 0.00 -2.02 0.00 0.00 63.50 62.08 1nba n PRO 255 Cb 0.40 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.22 1nba n PRO 255 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nba s ALA 256 N -1.21 3.42 0.05 3.55 0.00 -1.26 -5.01 121.76 121.29 1nba s ALA 256 Ca 0.64 -0.26 -0.35 0.00 0.00 0.00 0.00 51.96 51.98 1nba s ALA 256 Cb -0.44 -2.60 -0.14 0.00 0.00 0.00 0.00 23.12 19.94 1nba s ALA 256 CO 0.55 0.11 1.63 -0.25 0.00 0.00 0.00 175.76 177.80 1nba n ASP 257 N -1.05 2.87 0.06 0.00 9.92 -1.26 -4.90 116.55 122.17 1nba n ASP 257 Ca 0.01 1.06 0.07 0.00 -0.53 0.00 0.00 54.79 55.41 1nba n ASP 257 Cb 0.54 -1.35 0.32 0.00 -0.64 0.00 0.00 41.12 39.99 1nba n ASP 257 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1nba n PRO 258 N 4.26 0.07 0.00 -0.24 -0.04 -1.26 -5.34 135.00 132.45 1nba n PRO 258 Ca 0.19 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 1nba n PRO 258 Cb 0.26 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.06 1nba n PRO 258 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01