#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nba n PHE 8 N 0.00 0.00 -4.34 1.09 7.35 -1.26 -5.16 117.46 115.14 1nba n PHE 8 Ca 0.00 0.00 -0.23 0.00 -0.76 0.00 0.00 57.45 56.46 1nba n PHE 8 Cb 0.00 0.00 -0.17 0.00 0.35 0.00 0.00 39.48 39.66 1nba n PHE 8 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1nba s ASN 9 N 0.00 1.44 -0.01 -2.13 2.47 -1.26 -5.03 114.94 110.41 1nba s ASN 9 Ca 0.00 -0.22 -0.00 0.00 0.42 0.00 0.00 52.86 53.06 1nba s ASN 9 Cb 0.00 -0.66 0.01 0.00 -1.45 0.00 0.00 41.25 39.16 1nba s ASN 9 CO 0.00 -0.02 1.79 -0.67 -3.72 0.00 0.00 177.10 174.48 1nba n ASP 10 N 4.01 4.89 -0.35 -4.21 2.03 -1.26 -4.58 116.55 117.08 1nba n ASP 10 Ca -0.23 -2.36 -0.02 0.00 0.52 0.00 0.00 54.79 52.71 1nba n ASP 10 Cb 0.51 -0.99 0.11 0.00 -0.72 0.00 0.00 41.12 40.03 1nba n ASP 10 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1nba h ILE 11 N 0.79 1.21 0.06 5.18 2.10 -1.98 0.01 117.51 124.88 1nba h ILE 11 Ca 0.01 -0.43 -0.00 0.00 1.08 0.00 0.00 64.86 65.53 1nba h ILE 11 Cb 1.01 -0.14 0.00 0.00 -1.09 0.00 0.00 36.82 36.60 1nba h ILE 11 CO 0.04 0.23 -0.03 -0.33 -1.08 0.00 0.00 178.15 176.97 1nba h GLU 12 N 1.24 -0.08 -0.23 2.19 3.07 -1.99 0.58 114.58 119.36 1nba h GLU 12 Ca 0.36 0.01 -0.14 0.00 -0.50 0.00 0.00 59.36 59.08 1nba h GLU 12 Cb -0.09 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 1nba h GLU 12 CO -0.09 0.05 -0.45 0.00 -1.40 0.00 0.00 179.01 177.12 1nba h ALA 13 N 0.74 0.78 -0.12 3.43 0.00 -1.85 -0.59 119.26 121.65 1nba h ALA 13 Ca -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1nba h ALA 13 Cb 0.17 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1nba h ALA 13 CO 0.01 0.66 0.04 -0.09 0.00 0.00 0.00 179.25 179.87 1nba h ARG 14 N 0.47 0.19 -0.62 0.00 2.43 -0.86 -2.03 114.38 113.96 1nba h ARG 14 Ca 0.03 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1nba h ARG 14 Cb 0.97 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.47 1nba h ARG 14 CO 0.09 0.33 0.26 1.25 -1.51 0.00 0.00 179.97 180.38 1nba h LEU 15 N 0.01 0.84 -0.90 3.80 5.85 -0.80 -1.82 115.31 122.29 1nba h LEU 15 Ca 0.04 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1nba h LEU 15 Cb 0.22 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 1nba h LEU 15 CO -0.00 0.77 0.50 0.00 -0.34 0.00 0.00 178.44 179.37 1nba h ALA 16 N 1.10 1.16 -0.38 1.25 0.00 -1.05 0.37 119.26 121.71 1nba h ALA 16 Ca 0.21 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1nba h ALA 16 Cb 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1nba h ALA 16 CO -0.02 0.66 -0.05 0.00 0.00 0.00 0.00 179.25 179.83 1nba h ALA 17 N 1.27 0.51 0.05 0.00 0.00 -1.08 -1.47 119.26 118.55 1nba h ALA 17 Ca 0.32 -0.29 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 1nba h ALA 17 Cb 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1nba h ALA 17 CO -0.05 0.34 -1.03 -0.24 0.00 0.00 0.00 179.25 178.26 1nba h VAL 18 N 0.51 1.54 -0.95 0.00 3.04 -1.08 -2.70 116.25 116.61 1nba h VAL 18 Ca 0.10 -2.95 0.00 0.00 -1.01 0.00 0.00 66.70 62.84 1nba h VAL 18 Cb 0.55 2.72 -0.05 0.00 -2.01 0.00 0.00 31.29 32.50 1nba h VAL 18 CO 0.03 0.86 0.60 -0.07 -1.01 0.00 0.00 177.57 177.98 1nba h LEU 19 N 0.08 1.12 -0.92 3.16 3.38 -0.94 -0.58 115.31 120.61 1nba h LEU 19 Ca -0.07 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1nba h LEU 19 Cb 1.73 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 42.15 1nba h LEU 19 CO 0.16 0.84 0.61 -0.08 0.09 0.00 0.00 178.44 180.05 1nba h GLU 20 N 1.30 1.20 -0.72 1.13 4.81 -1.12 0.21 114.58 121.39 1nba h GLU 20 Ca 0.34 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1nba h GLU 20 Cb -0.10 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 28.98 1nba h GLU 20 CO -0.07 0.79 0.45 0.93 -0.73 0.00 0.00 179.01 180.38 1nba h GLU 21 N 1.23 0.97 -0.59 1.92 5.08 -0.97 0.46 114.58 122.69 1nba h GLU 21 Ca 0.34 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.56 1nba h GLU 21 Cb -0.13 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 28.88 1nba h GLU 21 CO -0.08 0.67 0.11 0.00 -1.00 0.00 0.00 179.01 178.72 1nba h ALA 22 N 1.24 1.10 -0.60 3.43 0.00 0.26 -2.54 119.26 122.15 1nba h ALA 22 Ca 0.26 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1nba h ALA 22 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1nba h ALA 22 CO -0.05 0.59 0.03 0.74 0.00 0.00 0.00 179.25 180.56 1nba h PHE 23 N 0.88 1.13 -0.31 0.00 0.04 0.19 0.29 116.94 119.16 1nba h PHE 23 Ca 0.19 -0.19 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1nba h PHE 23 Cb 0.36 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1nba h PHE 23 CO 0.02 0.99 0.15 0.93 -0.60 0.00 0.00 178.31 179.80 1nba h GLU 24 N 0.95 0.45 0.08 1.51 3.07 -0.75 -1.06 114.58 118.82 1nba h GLU 24 Ca 0.17 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1nba h GLU 24 Cb 0.52 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1nba h GLU 24 CO 0.03 0.42 -0.04 0.00 -1.40 0.00 0.00 179.01 178.02 1nba h ALA 25 N 1.00 -0.11 -0.59 3.43 0.00 -1.01 -2.20 119.26 119.77 1nba h ALA 25 Ca 0.11 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1nba h ALA 25 Cb 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1nba h ALA 25 CO -0.01 -0.54 0.39 0.78 0.00 0.00 0.00 179.25 179.86 1nba h GLY 26 N -0.14 0.84 0.78 0.00 0.00 -0.89 -2.64 103.07 101.03 1nba h GLY 26 Ca -0.01 -0.30 0.04 0.00 0.00 0.00 0.00 47.33 47.06 1nba h GLY 26 CO 0.02 0.29 0.34 -0.84 0.00 0.00 0.00 176.54 176.34 1nba h THR 27 N 0.79 1.01 -0.61 4.70 2.02 -1.03 0.13 112.91 119.92 1nba h THR 27 Ca 0.22 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1nba h THR 27 Cb -0.07 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 66.59 1nba h THR 27 CO -0.06 0.12 0.32 0.28 0.37 0.00 0.00 175.52 176.55 1nba h SER 28 N 0.65 0.46 0.18 4.18 0.02 -1.05 0.75 113.55 118.74 1nba h SER 28 Ca 0.25 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.23 1nba h SER 28 Cb 0.10 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1nba h SER 28 CO -0.14 0.30 -0.09 0.40 -1.14 0.00 0.00 176.83 176.17 1nba h ILE 29 N 0.60 0.90 -0.68 3.27 2.04 -1.01 -1.90 117.51 120.73 1nba h ILE 29 Ca 0.28 -0.42 0.04 0.00 1.00 0.00 0.00 64.86 65.76 1nba h ILE 29 Cb 0.19 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 1nba h ILE 29 CO -0.19 0.10 0.41 1.88 0.00 0.00 0.00 178.15 180.35 1nba h TYR 30 N -0.45 0.75 -0.33 1.37 0.05 -0.55 -1.13 116.97 116.69 1nba h TYR 30 Ca -0.03 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1nba h TYR 30 Cb 0.35 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.83 1nba h TYR 30 CO -0.01 0.40 0.17 -0.91 -1.05 0.00 0.00 178.16 176.77 1nba h ASN 31 N 0.77 0.42 -0.82 3.88 2.35 -0.73 0.16 115.58 121.61 1nba h ASN 31 Ca 0.29 -0.10 0.02 0.00 -0.55 0.00 0.00 56.30 55.96 1nba h ASN 31 Cb 0.09 -0.11 -0.05 0.00 0.05 0.00 0.00 38.32 38.31 1nba h ASN 31 CO -0.14 0.40 0.53 -0.33 -1.65 0.00 0.00 177.43 176.24 1nba h GLU 32 N 0.40 1.01 0.00 0.81 5.08 -0.84 -0.91 114.58 120.14 1nba h GLU 32 Ca 0.11 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1nba h GLU 32 Cb 0.08 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1nba h GLU 32 CO -0.02 0.67 0.00 0.54 -1.00 0.00 0.00 179.01 179.20 1nba n ARG 33 N -4.56 0.15 -0.50 2.33 1.74 -0.47 -4.93 116.66 110.43 1nba n ARG 33 Ca 0.09 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1nba n ARG 33 Cb 0.06 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.82 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 1.28 0.85 2.12 -0.13 0.00 0.37 -5.02 105.19 104.65 1nba n GLY 34 Ca 0.06 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.39 -3.18 -3.60 1.61 3.01 -0.09 -4.62 117.46 108.21 1nba n PHE 35 Ca 0.00 -0.95 -0.23 0.00 1.01 0.00 0.00 57.45 57.28 1nba n PHE 35 Cb 0.04 -0.41 0.08 0.00 -0.01 0.00 0.00 39.48 39.18 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 -2.03 -7.55 -1.99 -1.08 4.81 -0.71 -4.46 118.16 105.16 1nba n LYS 36 Ca 0.09 0.81 -0.29 0.00 -0.87 0.00 0.00 58.31 58.05 1nba n LYS 36 Cb 0.32 -5.84 0.04 0.00 0.02 0.00 0.00 35.03 29.57 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 -6.20 2.84 -0.23 1.64 0.52 -1.26 -5.00 118.95 111.26 1nba s ARG 37 Ca 0.50 0.35 -0.16 0.00 -0.52 0.00 0.00 55.73 55.90 1nba s ARG 37 Cb -0.22 -2.07 -0.03 0.00 0.52 0.00 0.00 34.95 33.14 1nba s ARG 37 CO 0.74 -0.99 0.44 1.03 0.02 0.00 0.00 175.30 176.54 1nba s ARG 38 N -5.29 4.11 0.31 3.54 1.81 -1.26 -4.93 118.95 117.24 1nba s ARG 38 Ca 0.57 0.22 0.10 0.00 -1.72 0.00 0.00 55.73 54.90 1nba s ARG 38 Cb -0.11 -3.60 0.50 0.00 -0.45 0.00 0.00 34.95 31.30 1nba s ARG 38 CO 0.50 -0.19 1.71 0.97 -0.68 0.00 0.00 175.30 177.61 1nba h ILE 39 N 5.22 1.35 -0.52 1.52 2.10 -1.95 -3.49 117.51 121.74 1nba h ILE 39 Ca -0.33 -1.67 0.03 0.00 1.08 0.00 0.00 64.86 63.97 1nba h ILE 39 Cb 1.16 1.87 -0.02 0.00 -1.09 0.00 0.00 36.82 38.73 1nba h ILE 39 CO 0.70 0.48 -0.17 0.61 -1.08 0.00 0.00 178.15 178.69 1nba n GLY 40 N -0.11 -2.81 3.76 8.18 0.00 -1.26 -4.69 105.19 108.26 1nba n GLY 40 Ca -0.02 -1.34 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 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 -3.51 3.57 0.00 1.61 2.02 -1.26 -4.94 117.35 114.84 1nba s TYR 41 Ca 0.00 1.71 0.00 0.00 -0.37 0.00 0.00 57.07 58.41 1nba s TYR 41 Cb 0.00 -3.23 0.00 0.00 -0.40 0.00 0.00 41.96 38.33 1nba s TYR 41 CO 0.00 -0.46 0.00 0.41 -1.57 0.00 0.00 175.55 173.93 1nba n GLY 42 N 1.08 0.69 0.08 0.71 0.00 -1.26 -5.05 105.19 101.43 1nba n GLY 42 Ca -0.00 -1.90 0.08 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.45 1.02 -3.49 1.61 5.03 -1.26 -4.84 115.26 111.87 1nba n ASN 43 Ca 0.00 -1.01 -0.29 0.00 0.87 0.00 0.00 54.58 54.16 1nba n ASN 43 Cb 0.00 0.90 -0.12 0.00 -1.02 0.00 0.00 39.78 39.54 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 -2.55 0.79 0.34 3.52 3.52 -1.26 -4.50 118.95 118.81 1nba s ARG 44 Ca 0.08 -1.67 -0.02 0.00 -0.13 0.00 0.00 55.73 53.99 1nba s ARG 44 Cb 0.14 -1.54 -0.04 0.00 -1.56 0.00 0.00 34.95 31.95 1nba s ARG 44 CO 0.67 -1.25 0.57 -1.25 -0.81 0.00 0.00 175.30 173.23 1nba s PRO 45 N 0.65 3.54 0.11 5.12 0.04 -1.26 -1.09 135.00 142.10 1nba s PRO 45 Ca 0.22 -0.17 0.05 0.00 0.04 0.00 0.00 61.00 61.14 1nba s PRO 45 Cb -0.16 -2.63 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1nba s PRO 45 CO -0.05 0.14 -0.13 0.00 0.04 0.00 0.00 177.00 177.00 1nba s ALA 46 N -2.27 1.38 -0.09 8.56 0.00 -0.03 -4.30 121.76 125.00 1nba s ALA 46 Ca 0.42 -1.25 0.03 0.00 0.00 0.00 0.00 51.96 51.16 1nba s ALA 46 Cb -0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 1nba s ALA 46 CO 0.35 0.07 -0.18 0.08 0.00 0.00 0.00 175.76 176.08 1nba s VAL 47 N -2.19 2.69 -0.07 0.00 1.01 -0.40 -1.66 120.40 119.77 1nba s VAL 47 Ca 0.07 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.25 1nba s VAL 47 Cb -0.05 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.29 1nba s VAL 47 CO 0.02 0.56 -0.12 -0.51 0.00 0.00 0.00 175.10 175.05 1nba s ILE 48 N -0.09 1.12 -0.33 2.22 2.07 0.02 -0.78 121.20 125.43 1nba s ILE 48 Ca -0.04 -0.46 -0.11 0.00 -1.41 0.00 0.00 60.65 58.63 1nba s ILE 48 Cb -0.14 -1.04 -0.01 0.00 0.13 0.00 0.00 42.46 41.40 1nba s ILE 48 CO 0.04 0.36 0.20 -1.00 -1.91 0.00 0.00 174.94 172.63 1nba s HIS 49 N 0.74 3.21 -0.33 3.50 3.76 0.04 -1.63 115.29 124.57 1nba s HIS 49 Ca -0.13 -0.43 -0.19 0.00 -0.15 0.00 0.00 55.06 54.15 1nba s HIS 49 Cb -0.16 -2.42 -0.01 0.00 1.11 0.00 0.00 32.58 31.11 1nba s HIS 49 CO 0.03 -0.43 0.59 0.42 -0.85 0.00 0.00 174.74 174.50 1nba s ILE 50 N 1.66 4.95 -1.40 0.60 -1.09 -0.49 -1.20 121.20 124.23 1nba s ILE 50 Ca 0.05 0.64 -0.02 0.00 -2.23 0.00 0.00 60.65 59.09 1nba s ILE 50 Cb -0.17 -4.00 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 1nba s ILE 50 CO 0.08 -0.20 0.41 0.47 -1.23 0.00 0.00 174.94 174.48 1nba n ASP 51 N 5.87 -0.51 -3.25 3.58 8.00 -1.15 -0.96 116.55 128.13 1nba n ASP 51 Ca -0.02 -1.03 -0.38 0.00 0.71 0.00 0.00 54.79 54.06 1nba n ASP 51 Cb 0.49 -2.95 0.01 0.00 -0.02 0.00 0.00 41.12 38.65 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 -4.41 7.42 -4.98 0.64 4.77 -1.26 -4.59 117.00 114.59 1nba n LEU 52 Ca -0.30 -4.94 -0.18 0.00 -0.03 0.00 0.00 56.01 50.56 1nba n LEU 52 Cb 0.68 -1.20 -0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1nba n LEU 52 CO 0.75 1.93 0.09 0.00 -1.33 0.00 0.00 177.39 178.84 1nba s ALA 53 N -3.19 4.35 0.43 -1.18 0.00 -1.26 -2.08 121.76 118.83 1nba s ALA 53 Ca 0.49 -1.61 0.13 0.00 0.00 0.00 0.00 51.96 50.97 1nba s ALA 53 Cb 0.28 -1.58 1.00 0.00 0.00 0.00 0.00 23.12 22.82 1nba s ALA 53 CO -0.21 -0.17 1.98 -0.91 0.00 0.00 0.00 175.76 176.45 1nba h ASN 54 N 0.79 0.40 -0.09 0.00 -0.26 -0.64 -0.46 115.58 115.32 1nba h ASN 54 Ca -0.42 0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.35 1nba h ASN 54 Cb 1.27 -0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 38.45 1nba h ASN 54 CO 0.49 0.24 0.17 0.00 -1.06 0.00 0.00 177.43 177.28 1nba h ALA 55 N 1.69 1.51 0.00 -0.83 0.00 -1.52 0.81 119.26 120.91 1nba h ALA 55 Ca 0.28 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.92 1nba h ALA 55 Cb 0.52 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1nba h ALA 55 CO -0.08 -0.22 -2.03 0.91 0.00 0.00 0.00 179.25 177.83 1nba n TRP 56 N -3.45 0.00 0.10 0.00 8.01 -0.30 -1.94 117.44 119.86 1nba n TRP 56 Ca -0.00 0.00 0.07 0.00 -1.31 0.00 0.00 57.50 56.25 1nba n TRP 56 Cb 0.26 -0.70 -0.01 0.00 -2.01 0.00 0.00 31.31 28.85 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 0.24 -3.06 -0.99 1.35 -1.06 -0.34 112.91 109.06 1nba h THR 57 Ca -0.40 -1.44 -0.63 0.00 -0.55 0.00 0.00 66.41 63.38 1nba h THR 57 Cb 1.66 1.81 -0.07 0.00 -1.73 0.00 0.00 68.15 69.82 1nba h THR 57 CO -0.05 0.14 -0.56 -1.10 -0.25 0.00 0.00 175.52 173.70 1nba s GLN 58 N -3.17 3.13 0.63 4.72 -1.52 0.26 -4.90 119.66 118.80 1nba s GLN 58 Ca -0.00 -0.56 -0.13 0.00 -1.95 0.00 0.00 55.36 52.72 1nba s GLN 58 Cb 0.09 -2.87 -0.02 0.00 -0.22 0.00 0.00 33.01 29.98 1nba s GLN 58 CO 0.78 0.60 1.05 -1.25 -0.25 0.00 0.00 175.29 176.21 1nba s PRO 59 N -2.33 3.27 0.00 2.91 0.04 -1.26 -4.37 135.00 133.25 1nba s PRO 59 Ca 0.30 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.36 1nba s PRO 59 Cb -0.12 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.38 1nba s PRO 59 CO 0.23 -0.83 0.00 0.41 0.04 0.00 0.00 177.00 176.85 1nba n GLY 60 N -1.67 0.67 3.46 0.56 0.00 -1.26 -5.07 105.19 101.89 1nba n GLY 60 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 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 2.48 0.03 1.61 5.04 -1.26 -5.01 115.29 116.18 1nba s HIS 61 Ca 0.00 -0.29 0.12 0.00 -1.54 0.00 0.00 55.06 53.35 1nba s HIS 61 Cb 0.00 -1.33 0.65 0.00 0.04 0.00 0.00 32.58 31.95 1nba s HIS 61 CO 0.00 0.37 1.25 -0.35 -2.34 0.00 0.00 174.74 173.67 1nba n PRO 62 N 0.86 0.08 -0.15 2.88 -0.04 -1.26 -1.52 135.00 135.86 1nba n PRO 62 Ca -0.16 0.56 0.06 0.00 -0.04 0.00 0.00 63.50 63.92 1nba n PRO 62 Cb 0.53 -2.10 0.14 0.00 -0.04 0.00 0.00 33.50 32.03 1nba n PRO 62 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1nba n PHE 63 N -2.02 0.39 -2.03 0.54 3.01 -1.25 -5.02 117.46 111.09 1nba n PHE 63 Ca -0.01 -0.37 -0.41 0.00 1.01 0.00 0.00 57.45 57.67 1nba n PHE 63 Cb 0.34 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 39.77 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 6.67 -0.08 4.37 0.01 -0.57 -4.25 113.70 118.84 1nba s SER 64 Ca 0.24 2.67 0.00 0.00 1.31 0.00 0.00 55.95 60.17 1nba s SER 64 Cb 0.13 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1nba s SER 64 CO 0.18 -0.67 -0.07 0.00 0.41 0.00 0.00 173.24 173.09 1nba s PRO 66 N -0.64 0.19 0.00 0.00 0.04 -1.26 -4.44 135.00 128.89 1nba s PRO 66 Ca 0.10 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.65 1nba s PRO 66 Cb -0.11 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.72 1nba s PRO 66 CO 0.02 -2.89 0.00 0.41 0.04 0.00 0.00 177.00 174.57 1nba n GLY 67 N -0.89 0.85 0.38 0.56 0.00 -1.26 -4.67 105.19 100.16 1nba n GLY 67 Ca 0.05 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.27 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 3.35 0.00 0.00 1.61 2.86 -1.91 -0.17 114.93 120.66 1nba h MET 68 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1nba h MET 68 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 1nba h MET 68 CO 0.00 0.00 -0.11 1.49 1.06 0.00 0.00 176.91 179.35 1nba h GLU 69 N 0.00 0.00 0.10 1.72 4.57 -1.96 0.30 114.58 119.31 1nba h GLU 69 Ca 0.21 0.00 -0.36 0.00 -1.18 0.00 0.00 59.36 58.03 1nba h GLU 69 Cb 0.96 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.53 1nba h GLU 69 CO -0.00 0.11 -2.02 2.41 -1.18 0.00 0.00 179.01 178.33 1nba n THR 70 N -3.70 1.74 0.31 0.32 -1.04 -0.12 -4.50 114.28 107.28 1nba n THR 70 Ca -0.02 -0.66 -0.13 0.00 -2.04 0.00 0.00 64.05 61.20 1nba n THR 70 Cb 0.23 -1.63 -0.06 0.00 -1.82 0.00 0.00 70.33 67.05 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 0.06 0.00 -0.54 12.58 2.04 -0.89 -3.30 117.51 127.46 1nba h ILE 71 Ca -0.43 -0.37 0.11 0.00 1.00 0.00 0.00 64.86 65.17 1nba h ILE 71 Cb 2.02 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 38.01 1nba h ILE 71 CO 0.07 0.00 0.00 0.40 0.00 0.00 0.00 178.15 178.62 1nba h ILE 72 N -1.21 0.57 -0.30 -0.67 1.08 -1.22 -0.24 117.51 115.51 1nba h ILE 72 Ca -0.09 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.34 1nba h ILE 72 Cb 0.64 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 1nba h ILE 72 CO 0.14 0.02 0.17 1.55 -0.69 0.00 0.00 178.15 179.35 1nba h PRO 73 N 0.12 0.41 -0.09 2.37 0.13 -1.79 0.72 132.00 133.87 1nba h PRO 73 Ca 0.28 -0.03 -0.23 0.00 -0.87 0.00 0.00 66.00 65.14 1nba h PRO 73 Cb 0.43 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.48 1nba h PRO 73 CO -0.46 0.29 -0.87 -0.91 -0.23 0.00 0.00 178.00 175.83 1nba h ASN 74 N 0.42 0.86 -0.61 1.44 2.35 -1.33 -1.40 115.58 117.30 1nba h ASN 74 Ca 0.11 -0.61 -0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1nba h ASN 74 Cb -0.00 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.08 1nba h ASN 74 CO -0.02 1.41 0.37 0.58 -1.65 0.00 0.00 177.43 178.12 1nba h VAL 75 N 0.45 1.18 -0.82 2.81 2.07 -0.41 -2.13 116.25 119.39 1nba h VAL 75 Ca -0.08 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1nba h VAL 75 Cb 1.50 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 1nba h VAL 75 CO 0.17 0.18 0.46 1.56 0.02 0.00 0.00 177.57 179.96 1nba h GLN 76 N 0.82 1.14 -0.63 1.57 4.20 -0.79 -0.74 115.11 120.69 1nba h GLN 76 Ca 0.22 -0.12 0.01 0.00 0.06 0.00 0.00 58.65 58.81 1nba h GLN 76 Cb -0.03 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.49 1nba h GLN 76 CO -0.04 0.82 0.41 0.00 -0.67 0.00 0.00 178.83 179.36 1nba h ARG 77 N 1.15 0.82 -0.32 1.46 3.08 -0.62 -0.73 114.38 119.21 1nba h ARG 77 Ca 0.29 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.24 1nba h ARG 77 Cb 0.01 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 1nba h ARG 77 CO -0.05 0.54 -0.01 0.82 -1.07 0.00 0.00 179.97 180.20 1nba h ILE 78 N 0.85 1.26 0.00 2.04 2.04 -0.89 -1.89 117.51 120.92 1nba h ILE 78 Ca 0.23 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 65.12 1nba h ILE 78 Cb -0.09 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1nba h ILE 78 CO -0.05 0.32 -0.07 0.78 0.00 0.00 0.00 178.15 179.13 1nba h ASN 79 N 0.37 -0.20 -0.82 1.72 2.35 -0.84 0.78 115.58 118.94 1nba h ASN 79 Ca 0.09 0.03 0.08 0.00 -0.55 0.00 0.00 56.30 55.95 1nba h ASN 79 Cb 0.46 0.09 -0.07 0.00 0.05 0.00 0.00 38.32 38.85 1nba h ASN 79 CO 0.02 -0.10 0.48 -0.33 -1.65 0.00 0.00 177.43 175.85 1nba h GLU 80 N -0.12 0.81 -0.19 0.81 5.08 -1.09 0.49 114.58 120.36 1nba h GLU 80 Ca 0.03 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1nba h GLU 80 Cb 0.16 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1nba h GLU 80 CO -0.07 0.53 -0.51 0.00 -1.00 0.00 0.00 179.01 177.96 1nba h ALA 81 N 1.43 0.76 -0.02 3.43 0.00 -0.82 -3.01 119.26 121.03 1nba h ALA 81 Ca 0.38 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1nba h ALA 81 Cb 0.30 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1nba h ALA 81 CO -0.22 0.68 -0.04 0.00 0.00 0.00 0.00 179.25 179.67 1nba h ALA 82 N 1.04 0.03 0.00 0.00 0.00 0.20 -3.18 119.26 117.35 1nba h ALA 82 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1nba h ALA 82 Cb 1.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1nba h ALA 82 CO 0.09 -0.15 0.00 0.07 0.00 0.00 0.00 179.25 179.26 1nba h ARG 83 N -0.48 0.00 0.00 0.00 0.11 -1.03 -0.21 114.38 112.77 1nba h ARG 83 Ca 0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1nba h ARG 83 Cb 0.61 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.69 1nba h ARG 83 CO 0.01 0.00 -0.02 0.00 0.10 0.00 0.00 179.97 180.06 1nba h ALA 84 N 2.03 1.07 -0.13 0.08 0.00 -1.50 -3.02 119.26 117.78 1nba h ALA 84 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1nba h ALA 84 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1nba h ALA 84 CO 0.00 0.03 0.00 1.63 0.00 0.00 0.00 179.25 180.91 1nba n LYS 85 N -3.21 1.39 -1.51 0.00 4.76 -0.14 -4.98 118.16 114.47 1nba n LYS 85 Ca -0.02 -1.43 -0.09 0.00 -2.87 0.00 0.00 58.31 53.91 1nba n LYS 85 Cb 0.17 -1.19 -0.03 0.00 -1.84 0.00 0.00 35.03 32.14 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 0.43 0.75 3.74 0.72 0.00 -0.99 -0.44 105.19 109.40 1nba n GLY 86 Ca 0.07 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.35 3.61 0.24 1.61 1.01 -0.90 -4.66 120.40 118.95 1nba s VAL 87 Ca 0.00 1.35 -0.31 0.00 0.00 0.00 0.00 61.98 63.02 1nba s VAL 87 Cb 0.00 -3.86 -0.11 0.00 0.00 0.00 0.00 36.38 32.40 1nba s VAL 87 CO 0.00 0.21 1.65 -2.84 0.00 0.00 0.00 175.10 174.12 1nba s PRO 88 N -0.21 4.14 -0.10 2.72 0.02 -1.26 -4.59 135.00 135.72 1nba s PRO 88 Ca 0.53 2.56 0.02 0.00 0.02 0.00 0.00 61.00 64.13 1nba s PRO 88 Cb -0.32 -3.06 0.01 0.00 0.02 0.00 0.00 34.50 31.15 1nba s PRO 88 CO 0.36 -0.68 -0.16 0.08 -0.33 0.00 0.00 177.00 176.27 1nba s VAL 89 N 0.69 1.48 0.09 3.83 1.01 -1.26 -1.28 120.40 124.96 1nba s VAL 89 Ca 0.69 -0.65 0.09 0.00 0.00 0.00 0.00 61.98 62.11 1nba s VAL 89 Cb -0.48 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1nba s VAL 89 CO 0.38 0.43 -0.20 -0.36 0.00 0.00 0.00 175.10 175.36 1nba s PHE 90 N 0.81 2.50 0.01 5.22 0.40 0.04 -2.37 117.98 124.58 1nba s PHE 90 Ca -0.10 -0.29 0.05 0.00 -0.60 0.00 0.00 56.93 55.99 1nba s PHE 90 Cb -0.16 -1.37 -0.02 0.00 0.51 0.00 0.00 43.02 41.99 1nba s PHE 90 CO 0.01 0.33 -0.16 0.71 0.70 0.00 0.00 175.22 176.81 1nba s TYR 91 N -1.05 1.44 0.26 0.36 1.51 0.18 -0.78 117.35 119.27 1nba s TYR 91 Ca 0.16 -0.30 0.09 0.00 -1.01 0.00 0.00 57.07 56.01 1nba s TYR 91 Cb -0.10 -0.90 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 1nba s TYR 91 CO 0.08 0.01 -0.01 0.95 -1.11 0.00 0.00 175.55 175.47 1nba s THR 92 N -0.53 3.46 -0.02 -0.71 -4.23 -0.34 -0.67 115.64 112.59 1nba s THR 92 Ca 0.05 -1.88 -0.01 0.00 -1.18 0.00 0.00 61.69 58.68 1nba s THR 92 Cb -0.07 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 70.95 1nba s THR 92 CO 0.00 -0.35 0.04 0.28 -0.54 0.00 0.00 174.62 174.05 1nba s THR 93 N -2.27 -0.04 -0.71 3.99 -1.32 -0.44 -2.92 115.64 111.93 1nba s THR 93 Ca 0.31 0.14 -0.18 0.00 -1.21 0.00 0.00 61.69 60.74 1nba s THR 93 Cb -0.07 -0.09 0.12 0.00 -1.51 0.00 0.00 72.50 70.96 1nba s THR 93 CO 0.20 0.06 0.84 0.21 -2.21 0.00 0.00 174.62 173.71 1nba s ASN 94 N 0.71 6.38 0.08 8.08 2.47 -1.26 -1.14 114.94 130.26 1nba s ASN 94 Ca -0.06 -1.73 0.00 0.00 0.42 0.00 0.00 52.86 51.50 1nba s ASN 94 Cb -0.08 -2.32 -0.04 0.00 -1.45 0.00 0.00 41.25 37.35 1nba s ASN 94 CO -0.02 -1.05 -0.05 0.68 -3.72 0.00 0.00 177.10 172.94 1nba s VAL 95 N 2.44 0.48 0.02 -5.21 -7.23 -1.01 -4.90 120.40 104.97 1nba s VAL 95 Ca 0.18 -1.88 0.06 0.00 -1.81 0.00 0.00 61.98 58.54 1nba s VAL 95 Cb -0.17 -1.63 -0.02 0.00 0.56 0.00 0.00 36.38 35.12 1nba s VAL 95 CO 0.01 -0.91 -0.19 -0.31 -0.31 0.00 0.00 175.10 173.38 1nba s TYR 96 N -3.76 1.68 -0.98 2.82 2.02 -0.30 -4.67 117.35 114.16 1nba s TYR 96 Ca 0.10 -0.34 0.22 0.00 -0.37 0.00 0.00 57.07 56.68 1nba s TYR 96 Cb 0.07 -1.04 0.03 0.00 -0.40 0.00 0.00 41.96 40.61 1nba s TYR 96 CO -0.07 0.03 1.07 0.54 -1.57 0.00 0.00 175.55 175.56 1nba n ARG 97 N 2.21 0.01 -3.35 -0.62 1.74 -1.26 -1.31 116.66 114.09 1nba n ARG 97 Ca -0.16 -0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.78 1nba n ARG 97 Cb 0.54 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.40 1nba n ARG 97 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1nba s ASN 98 N -3.04 0.92 -0.15 0.55 3.04 -1.26 -4.99 114.94 110.02 1nba s ASN 98 Ca 0.09 -0.84 0.07 0.00 0.04 0.00 0.00 52.86 52.22 1nba s ASN 98 Cb 0.16 0.81 0.45 0.00 -1.54 0.00 0.00 41.25 41.14 1nba s ASN 98 CO 0.81 -0.33 1.26 0.54 -3.04 0.00 0.00 177.10 176.34 1nba n ARG 99 N 5.01 2.99 -3.34 0.43 1.74 -1.26 -2.92 116.66 119.30 1nba n ARG 99 Ca 0.03 -1.78 -0.46 0.00 -0.77 0.00 0.00 57.85 54.87 1nba n ARG 99 Cb 0.48 -1.90 -0.04 0.00 -1.02 0.00 0.00 32.46 29.97 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 -0.42 6.33 0.34 0.55 2.15 -1.26 -4.86 116.67 119.50 1nba s ASP 100 Ca 0.31 -2.14 0.20 0.00 0.43 0.00 0.00 52.55 51.36 1nba s ASP 100 Cb 0.24 -2.19 1.09 0.00 -0.30 0.00 0.00 42.92 41.76 1nba s ASP 100 CO 0.09 -0.74 1.58 0.00 -0.17 0.00 0.00 175.17 175.93 1nba h ALA 101 N 8.43 1.06 0.00 3.66 0.00 -1.99 0.10 119.26 130.52 1nba h ALA 101 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1nba h ALA 101 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1nba h ALA 101 CO 0.92 -0.06 0.00 0.43 0.00 0.00 0.00 179.25 180.54 1nba n SER 102 N -2.23 0.28 -4.84 0.00 7.64 -1.26 -4.88 113.62 108.33 1nba n SER 102 Ca -0.01 0.54 -0.35 0.00 1.01 0.00 0.00 58.87 60.05 1nba n SER 102 Cb 0.12 -0.61 -0.06 0.00 -1.01 0.00 0.00 64.21 62.65 1nba n SER 102 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1nba s SER 103 N -3.53 6.89 0.25 6.43 0.15 0.35 -4.96 113.70 119.28 1nba s SER 103 Ca 0.11 1.23 0.25 0.00 0.70 0.00 0.00 55.95 58.24 1nba s SER 103 Cb 0.15 -2.35 0.85 0.00 -1.71 0.00 0.00 66.02 62.96 1nba s SER 103 CO 0.49 0.02 1.76 1.23 1.20 0.00 0.00 173.24 177.94 1nba h GLY 104 N 3.23 0.00 -1.51 9.45 0.00 -1.90 -2.81 103.07 109.53 1nba h GLY 104 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1nba h GLY 104 CO 0.66 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.90 1nba n THR 105 N -2.34 2.08 -2.38 4.70 -2.24 -1.26 -5.00 114.28 107.84 1nba n THR 105 Ca 0.04 -1.75 -0.37 0.00 -2.27 0.00 0.00 64.05 59.70 1nba n THR 105 Cb 0.38 -0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 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 -1.81 6.49 -0.18 3.42 2.20 -1.06 -4.71 114.94 119.28 1nba s ASN 106 Ca 0.39 2.21 0.16 0.00 -0.94 0.00 0.00 52.86 54.68 1nba s ASN 106 Cb 0.31 -2.60 0.48 0.00 -2.00 0.00 0.00 41.25 37.44 1nba s ASN 106 CO 0.10 -0.69 1.38 -0.90 -2.94 0.00 0.00 177.10 174.04 1nba n ASP 107 N -0.18 3.43 0.03 3.54 5.75 -1.15 -4.53 116.55 123.45 1nba n ASP 107 Ca 0.06 -3.13 0.11 0.00 -0.01 0.00 0.00 54.79 51.82 1nba n ASP 107 Cb 0.48 -0.54 -0.00 0.00 -1.03 0.00 0.00 41.12 40.04 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 -0.76 0.35 0.00 0.11 2.81 -1.26 -4.91 117.12 113.45 1nba n MET 108 Ca 0.22 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 56.10 1nba n MET 108 Cb 0.86 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.77 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 1.34 2.06 0.27 3.03 0.00 -1.26 -2.36 105.19 108.28 1nba n GLY 109 Ca 0.01 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.85 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 0.96 0.25 0.99 4.77 -1.26 -3.80 117.00 118.91 1nba n LEU 110 Ca 0.00 -0.25 0.14 0.00 -0.03 0.00 0.00 56.01 55.87 1nba n LEU 110 Cb 0.00 -0.08 0.56 0.00 -2.33 0.00 0.00 43.42 41.56 1nba n LEU 110 CO 0.00 0.17 0.90 -0.25 -1.33 0.00 0.00 177.39 176.88 1nba h TRP 111 N 1.33 0.00 0.00 -1.77 7.01 -1.85 -0.71 115.95 119.96 1nba h TRP 111 Ca 0.00 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 1nba h TRP 111 Cb 0.42 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.48 1nba h TRP 111 CO 0.00 0.09 -0.02 -0.92 -2.79 0.00 0.00 178.44 174.80 1nba h TYR 112 N 0.00 0.00 -0.02 2.65 3.20 -1.65 -0.92 116.97 120.24 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 0.64 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.91 1nba h TYR 112 CO 0.00 0.02 0.00 0.43 -1.64 0.00 0.00 178.16 176.97 1nba n SER 113 N -4.44 0.10 0.00 -2.11 7.64 -0.27 -4.14 113.62 110.40 1nba n SER 113 Ca -0.03 -1.80 0.00 0.00 1.01 0.00 0.00 58.87 58.05 1nba n SER 113 Cb 0.10 -0.01 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 -0.55 0.00 -4.41 1.43 4.76 -0.59 -5.11 118.16 113.69 1nba n LYS 114 Ca 0.05 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.29 1nba n LYS 114 Cb 0.04 -0.53 -0.10 0.00 -1.84 0.00 0.00 35.03 32.59 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 -1.83 1.72 -1.29 -0.18 -4.36 -0.45 -5.05 121.20 109.75 1nba s ILE 115 Ca 0.00 -2.17 -0.17 0.00 -0.26 0.00 0.00 60.65 58.06 1nba s ILE 115 Cb 0.00 -2.32 0.00 0.00 1.25 0.00 0.00 42.46 41.40 1nba s ILE 115 CO 0.00 -0.39 2.06 -0.81 0.24 0.00 0.00 174.94 176.04 1nba n PRO 116 N -0.52 2.62 0.00 0.37 -0.04 -1.26 -4.31 135.00 131.85 1nba n PRO 116 Ca -0.06 -2.60 0.00 0.00 -0.04 0.00 0.00 63.50 60.81 1nba n PRO 116 Cb 0.62 -3.29 0.31 0.00 -0.04 0.00 0.00 33.50 31.11 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 4.51 1.19 0.00 0.52 1.35 -1.85 -2.05 112.91 116.57 1nba h THR 117 Ca 0.50 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1nba h THR 117 Cb 0.71 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 1nba h THR 117 CO 1.78 0.25 0.00 -1.84 -0.25 0.00 0.00 175.52 175.46 1nba n GLU 118 N -4.30 0.16 -0.14 4.72 0.00 -1.26 -1.15 120.64 118.67 1nba n GLU 118 Ca 0.02 0.11 0.11 0.00 0.00 0.00 0.00 57.16 57.39 1nba n GLU 118 Cb 0.22 -1.50 0.29 0.00 0.00 0.00 0.00 31.44 30.45 1nba n GLU 118 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1nba n THR 119 N -1.14 0.37 -3.71 3.84 -2.24 -0.77 -4.70 114.28 105.94 1nba n THR 119 Ca 0.04 -0.54 -0.30 0.00 -2.27 0.00 0.00 64.05 60.99 1nba n THR 119 Cb 0.04 0.61 -0.10 0.00 -2.10 0.00 0.00 70.33 68.78 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 0.85 3.56 -4.75 3.22 4.77 -0.30 -5.02 117.00 119.33 1nba n LEU 120 Ca 0.17 -5.26 -0.41 0.00 -0.03 0.00 0.00 56.01 50.49 1nba n LEU 120 Cb 0.45 -0.82 -0.04 0.00 -2.33 0.00 0.00 43.42 40.68 1nba n LEU 120 CO 0.14 1.79 0.82 -2.84 -1.33 0.00 0.00 177.39 175.97 1nba s PRO 121 N -1.76 4.59 0.50 3.23 0.02 -1.26 -1.15 135.00 139.18 1nba s PRO 121 Ca 0.29 1.82 -0.20 0.00 0.02 0.00 0.00 61.00 62.93 1nba s PRO 121 Cb 0.00 -3.21 -0.07 0.00 0.02 0.00 0.00 34.50 31.24 1nba s PRO 121 CO -0.11 0.11 1.09 0.00 -0.33 0.00 0.00 177.00 177.76 1nba s ALA 122 N -0.79 2.82 -1.93 -1.55 0.00 -0.43 -3.47 121.76 116.42 1nba s ALA 122 Ca 0.47 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1nba s ALA 122 Cb -0.32 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1nba s ALA 122 CO 0.40 -0.55 0.00 -0.25 0.00 0.00 0.00 175.76 175.36 1nba n ASP 123 N -1.00 -5.33 -5.00 0.00 8.00 -1.26 -4.98 116.55 106.98 1nba n ASP 123 Ca 0.10 0.36 -0.17 0.00 0.71 0.00 0.00 54.79 55.78 1nba n ASP 123 Cb 0.51 -4.48 0.00 0.00 -0.02 0.00 0.00 41.12 37.14 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 -2.65 5.62 0.27 -2.24 1.04 -1.23 -4.99 113.70 109.52 1nba s SER 124 Ca 0.00 -0.44 -0.01 0.00 0.48 0.00 0.00 55.95 55.98 1nba s SER 124 Cb 0.00 -0.69 0.59 0.00 0.10 0.00 0.00 66.02 66.02 1nba s SER 124 CO 0.00 -0.73 1.67 0.22 0.98 0.00 0.00 173.24 175.38 1nba h TYR 125 N 0.70 0.35 -0.26 5.02 3.20 -1.95 -1.61 116.97 122.42 1nba h TYR 125 Ca -0.40 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.52 1nba h TYR 125 Cb 1.28 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.51 1nba h TYR 125 CO 0.41 -0.13 0.17 -1.49 -1.64 0.00 0.00 178.16 175.49 1nba h TRP 126 N 0.27 0.32 0.00 -3.82 4.06 -1.93 -1.13 115.95 113.72 1nba h TRP 126 Ca 0.49 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.44 1nba h TRP 126 Cb 0.90 -0.11 0.00 0.00 -1.00 0.00 0.00 29.16 28.95 1nba h TRP 126 CO -0.25 0.20 0.00 0.00 -3.56 0.00 0.00 178.44 174.83 1nba n ALA 127 N -2.50 2.19 -2.37 1.49 0.00 -0.61 -1.40 120.51 117.30 1nba n ALA 127 Ca 0.01 -0.06 -0.39 0.00 0.00 0.00 0.00 53.44 52.99 1nba n ALA 127 Cb 0.08 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.04 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 4.39 0.39 0.00 1.11 -0.43 -4.80 119.66 117.28 1nba s GLN 128 Ca 0.12 0.89 -0.27 0.00 0.01 0.00 0.00 55.36 56.10 1nba s GLN 128 Cb 0.16 -3.33 -0.10 0.00 -1.01 0.00 0.00 33.01 28.73 1nba s GLN 128 CO 0.50 0.40 1.47 0.42 0.01 0.00 0.00 175.29 178.09 1nba s ILE 129 N -0.37 2.07 0.32 1.08 -1.09 -1.26 -0.66 121.20 121.29 1nba s ILE 129 Ca 0.34 0.07 -0.29 0.00 -2.23 0.00 0.00 60.65 58.53 1nba s ILE 129 Cb -0.20 -3.04 -0.11 0.00 -1.58 0.00 0.00 42.46 37.53 1nba s ILE 129 CO 0.20 0.02 1.55 -0.62 -1.23 0.00 0.00 174.94 174.86 1nba s ASP 130 N -0.23 6.36 0.36 3.58 -1.08 -0.88 -4.77 116.67 120.01 1nba s ASP 130 Ca 0.54 2.99 0.08 0.00 -0.52 0.00 0.00 52.55 55.64 1nba s ASP 130 Cb -0.46 -2.65 0.80 0.00 -1.46 0.00 0.00 42.92 39.15 1nba s ASP 130 CO 0.62 -0.90 1.90 0.44 0.52 0.00 0.00 175.17 177.74 1nba h ASP 131 N 4.16 0.65 0.10 -0.34 3.32 -1.92 -1.07 116.42 121.32 1nba h ASP 131 Ca -0.48 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.59 1nba h ASP 131 Cb 1.23 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.67 1nba h ASP 131 CO 0.74 0.36 -0.02 0.03 -1.72 0.00 0.00 179.24 178.63 1nba h ARG 132 N 0.71 0.00 -0.41 3.56 3.08 -1.99 -2.76 114.38 116.56 1nba h ARG 132 Ca 0.41 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.15 1nba h ARG 132 Cb 0.59 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.33 1nba h ARG 132 CO -0.17 0.02 -0.83 0.44 -1.07 0.00 0.00 179.97 178.35 1nba n ILE 133 N -3.54 1.88 -1.51 2.04 -5.35 -0.43 -4.97 119.36 107.48 1nba n ILE 133 Ca -0.03 -3.32 -0.52 0.00 -0.27 0.00 0.00 62.75 58.61 1nba n ILE 133 Cb 0.11 -0.14 -0.05 0.00 -1.74 0.00 0.00 39.64 37.81 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 -0.64 -2.24 -1.67 -1.28 0.00 -1.04 -4.86 120.51 108.78 1nba n ALA 134 Ca 0.26 0.51 -0.47 0.00 0.00 0.00 0.00 53.44 53.74 1nba n ALA 134 Cb 0.89 -1.85 -0.04 0.00 0.00 0.00 0.00 19.45 18.45 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 1.55 2.10 -1.98 0.00 -0.02 -1.26 -5.01 135.00 130.37 1nba n PRO 135 Ca 0.18 0.76 -0.28 0.00 -2.02 0.00 0.00 63.50 62.13 1nba n PRO 135 Cb 0.19 -2.53 0.08 0.00 -0.02 0.00 0.00 33.50 31.23 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 1.19 2.79 0.22 3.55 0.00 -1.26 -4.95 121.76 123.29 1nba s ALA 136 Ca 0.80 -0.73 -0.31 0.00 0.00 0.00 0.00 51.96 51.72 1nba s ALA 136 Cb -0.70 -2.86 -0.11 0.00 0.00 0.00 0.00 23.12 19.45 1nba s ALA 136 CO 0.40 -1.58 1.66 -0.51 0.00 0.00 0.00 175.76 175.73 1nba s ASP 137 N -4.57 6.42 0.00 0.00 1.11 -1.26 -1.63 116.67 116.74 1nba s ASP 137 Ca 0.62 2.83 0.00 0.00 0.18 0.00 0.00 52.55 56.18 1nba s ASP 137 Cb -0.11 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.28 1nba s ASP 137 CO 0.48 -0.93 0.00 0.61 1.18 0.00 0.00 175.17 176.51 1nba n GLY 138 N 3.56 2.27 3.80 0.21 0.00 -1.26 -5.04 105.19 108.74 1nba n GLY 138 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.51 3.67 -0.14 1.61 2.02 -0.65 -4.93 118.70 119.78 1nba s GLU 139 Ca 0.00 1.26 -0.07 0.00 0.02 0.00 0.00 54.97 56.18 1nba s GLU 139 Cb 0.00 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.11 1nba s GLU 139 CO 0.00 -0.53 0.12 0.08 0.02 0.00 0.00 175.26 174.95 1nba s VAL 140 N -2.21 5.34 -0.22 2.63 1.01 -1.00 -4.89 120.40 121.06 1nba s VAL 140 Ca 0.65 0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.76 1nba s VAL 140 Cb -0.15 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.88 1nba s VAL 140 CO 0.26 0.57 -0.08 -0.69 0.00 0.00 0.00 175.10 175.16 1nba s VAL 141 N -0.61 2.93 -0.26 2.92 1.01 -1.26 -0.64 120.40 124.48 1nba s VAL 141 Ca 0.12 -0.75 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 1nba s VAL 141 Cb -0.12 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 1nba s VAL 141 CO 0.02 0.38 0.16 -0.63 0.00 0.00 0.00 175.10 175.03 1nba s ILE 142 N 1.39 5.09 -0.25 2.22 1.01 0.16 -4.97 121.20 125.84 1nba s ILE 142 Ca 0.04 0.09 -0.24 0.00 0.00 0.00 0.00 60.65 60.54 1nba s ILE 142 Cb -0.15 -3.41 -0.00 0.00 0.01 0.00 0.00 42.46 38.91 1nba s ILE 142 CO -0.06 0.29 0.82 -1.61 0.00 0.00 0.00 174.94 174.38 1nba s GLU 143 N 1.57 4.14 0.24 2.79 2.02 -1.26 -1.33 118.70 126.87 1nba s GLU 143 Ca 0.07 0.87 0.09 0.00 0.02 0.00 0.00 54.97 56.02 1nba s GLU 143 Cb -0.15 -3.66 -0.04 0.00 0.10 0.00 0.00 34.13 30.37 1nba s GLU 143 CO 0.08 -0.55 -0.00 -1.59 0.02 0.00 0.00 175.26 173.22 1nba s LYS 144 N 2.86 2.32 -0.00 1.61 -2.85 -0.29 -4.92 119.74 118.47 1nba s LYS 144 Ca 0.34 -1.32 0.08 0.00 -1.00 0.00 0.00 55.97 54.07 1nba s LYS 144 Cb -0.15 -2.22 -0.09 0.00 -2.06 0.00 0.00 37.83 33.31 1nba s LYS 144 CO 0.08 0.39 0.32 0.09 0.10 0.00 0.00 175.35 176.34 1nba n ASN 145 N -0.63 0.51 -4.23 0.03 5.03 -1.26 -2.41 115.26 112.29 1nba n ASN 145 Ca -0.08 -0.65 -0.18 0.00 0.87 0.00 0.00 54.58 54.54 1nba n ASN 145 Cb 0.58 1.02 -0.10 0.00 -1.02 0.00 0.00 39.78 40.26 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 -1.78 1.51 0.13 3.52 1.81 -1.26 -4.92 118.95 117.95 1nba s ARG 146 Ca 0.03 -1.84 -0.26 0.00 -1.72 0.00 0.00 55.73 51.94 1nba s ARG 146 Cb 0.06 -0.28 -0.03 0.00 -0.45 0.00 0.00 34.95 34.25 1nba s ARG 146 CO 0.32 -0.34 1.62 0.00 -0.68 0.00 0.00 175.30 176.22 1nba h ALA 147 N 2.29 -0.37 -2.45 2.13 0.00 -1.96 -3.41 119.26 115.49 1nba h ALA 147 Ca -0.37 0.01 -0.48 0.00 0.00 0.00 0.00 54.91 54.07 1nba h ALA 147 Cb 1.25 0.54 0.01 0.00 0.00 0.00 0.00 17.79 19.59 1nba h ALA 147 CO 0.59 -0.78 0.40 0.45 0.00 0.00 0.00 179.25 179.90 1nba s SER 148 N -4.90 6.74 0.33 0.00 0.15 -1.26 -4.35 113.70 110.40 1nba s SER 148 Ca -0.15 1.99 0.25 0.00 0.70 0.00 0.00 55.95 58.74 1nba s SER 148 Cb 0.10 -2.58 1.14 0.00 -1.71 0.00 0.00 66.02 62.97 1nba s SER 148 CO 0.66 -0.50 1.76 0.00 1.20 0.00 0.00 173.24 176.36 1nba h ALA 149 N 2.37 1.00 0.00 5.45 0.00 -1.83 -3.33 119.26 122.92 1nba h ALA 149 Ca -0.48 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1nba h ALA 149 Cb 1.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1nba h ALA 149 CO 0.62 0.00 -0.25 0.74 0.00 0.00 0.00 179.25 180.36 1nba h PHE 150 N 0.00 0.00 -2.44 0.00 -1.00 -1.93 -3.41 116.94 108.16 1nba h PHE 150 Ca 0.00 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 60.21 1nba h PHE 150 Cb 0.29 0.00 0.06 0.00 3.61 0.00 0.00 35.95 39.91 1nba h PHE 150 CO 0.00 0.91 0.80 -0.35 -1.61 0.00 0.00 178.31 178.06 1nba n PRO 151 N -4.60 2.23 -1.00 1.51 -0.04 -1.25 -1.94 135.00 129.91 1nba n PRO 151 Ca -0.13 0.80 -0.00 0.00 -0.04 0.00 0.00 63.50 64.14 1nba n PRO 151 Cb 0.44 -2.56 -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 3.21 0.18 3.78 0.55 0.00 -1.26 -4.62 105.19 107.03 1nba n GLY 152 Ca 0.16 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.35 1.31 -0.88 2.61 -4.23 -0.82 -4.92 115.64 107.37 1nba s THR 153 Ca 0.00 -1.90 0.15 0.00 -1.18 0.00 0.00 61.69 58.77 1nba s THR 153 Cb 0.00 -2.20 0.70 0.00 1.34 0.00 0.00 72.50 72.34 1nba s THR 153 CO 0.00 0.00 1.59 -0.46 -0.54 0.00 0.00 174.62 175.21 1nba n ASN 154 N -1.35 4.76 -0.15 3.99 2.04 -1.26 -4.64 115.26 118.65 1nba n ASN 154 Ca -0.15 -2.57 -0.05 0.00 -0.44 0.00 0.00 54.58 51.37 1nba n ASN 154 Cb 0.66 -0.60 0.04 0.00 -2.53 0.00 0.00 39.78 37.36 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 3.76 0.33 -1.75 -4.53 5.85 -1.85 -2.18 115.31 114.94 1nba h LEU 155 Ca 0.00 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1nba h LEU 155 Cb 1.54 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.53 1nba h LEU 155 CO 0.30 0.23 0.03 -0.08 -0.34 0.00 0.00 178.44 178.58 1nba h GLU 156 N 0.46 0.18 -0.52 1.25 4.81 -1.88 -1.34 114.58 117.54 1nba h GLU 156 Ca 0.21 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 1nba h GLU 156 Cb 0.12 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1nba h GLU 156 CO -0.15 0.18 0.23 -0.07 -0.73 0.00 0.00 179.01 178.47 1nba h LEU 157 N 0.19 0.69 -0.20 1.64 3.38 -1.73 -0.13 115.31 119.15 1nba h LEU 157 Ca 0.05 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1nba h LEU 157 Cb 0.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1nba h LEU 157 CO -0.00 0.65 0.01 -0.26 0.09 0.00 0.00 178.44 178.93 1nba h PHE 158 N 0.70 0.36 -0.47 1.13 0.04 -1.17 -1.81 116.94 115.72 1nba h PHE 158 Ca 0.18 -0.06 -0.08 0.00 2.80 0.00 0.00 57.97 60.81 1nba h PHE 158 Cb 0.15 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 1nba h PHE 158 CO -0.00 0.51 -0.03 -0.07 -0.60 0.00 0.00 178.31 178.12 1nba h LEU 159 N 0.11 0.84 0.32 1.54 3.38 -1.16 -0.51 115.31 119.82 1nba h LEU 159 Ca 0.06 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1nba h LEU 159 Cb 0.36 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1nba h LEU 159 CO 0.01 0.96 -0.15 0.74 0.09 0.00 0.00 178.44 180.08 1nba h THR 160 N 0.70 0.36 -0.61 0.22 2.02 -1.11 -1.25 112.91 113.24 1nba h THR 160 Ca 0.13 -0.79 0.12 0.00 0.77 0.00 0.00 66.41 66.64 1nba h THR 160 Cb 0.55 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 1nba h THR 160 CO 0.03 0.09 0.41 0.28 0.37 0.00 0.00 175.52 176.70 1nba h SER 161 N -1.02 0.30 -0.58 4.18 0.02 -1.33 -1.79 113.55 113.33 1nba h SER 161 Ca -0.04 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1nba h SER 161 Cb 0.47 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1nba h SER 161 CO 0.07 0.17 0.00 0.59 -1.14 0.00 0.00 176.83 176.52 1nba n ASN 162 N -4.46 5.27 -3.91 3.07 5.03 -0.20 -4.96 115.26 115.10 1nba n ASN 162 Ca 0.11 -2.77 -0.26 0.00 0.87 0.00 0.00 54.58 52.53 1nba n ASN 162 Cb 0.45 -0.64 -0.00 0.00 -1.02 0.00 0.00 39.78 38.56 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 0.72 -3.86 -2.59 3.52 5.12 -0.67 -4.96 116.66 113.93 1nba n ARG 163 Ca 0.27 0.47 -0.41 0.00 -1.93 0.00 0.00 57.85 56.25 1nba n ARG 163 Cb 1.07 -4.81 -0.05 0.00 -1.16 0.00 0.00 32.46 27.51 1nba n ARG 163 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1nba s ILE 164 N -3.78 3.94 -0.31 0.55 -1.09 -0.49 -4.43 121.20 115.60 1nba s ILE 164 Ca 0.12 1.77 0.04 0.00 -2.23 0.00 0.00 60.65 60.35 1nba s ILE 164 Cb -0.06 -4.13 -0.02 0.00 -1.58 0.00 0.00 42.46 36.67 1nba s ILE 164 CO 0.87 0.35 0.32 -0.90 -1.23 0.00 0.00 174.94 174.34 1nba n ASP 165 N 2.03 0.56 -3.91 3.58 5.75 -0.25 -4.87 116.55 119.44 1nba n ASP 165 Ca 0.01 -0.78 -0.18 0.00 -0.01 0.00 0.00 54.79 53.83 1nba n ASP 165 Cb 0.47 0.69 -0.16 0.00 -1.03 0.00 0.00 41.12 41.09 1nba n ASP 165 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1nba s THR 166 N -1.08 0.43 -0.25 2.12 2.01 -1.19 -1.22 115.64 116.46 1nba s THR 166 Ca 0.03 -0.13 0.03 0.00 0.31 0.00 0.00 61.69 61.93 1nba s THR 166 Cb 0.03 -0.43 0.06 0.00 0.01 0.00 0.00 72.50 72.17 1nba s THR 166 CO 0.13 0.17 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.90 1nba s LEU 167 N 0.53 3.34 -0.19 4.42 2.96 -0.23 -0.85 118.68 128.66 1nba s LEU 167 Ca -0.06 -1.34 -0.21 0.00 -0.22 0.00 0.00 54.13 52.30 1nba s LEU 167 Cb -0.10 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 1nba s LEU 167 CO -0.00 -0.17 0.62 -0.63 -1.32 0.00 0.00 176.35 174.85 1nba s ILE 168 N 1.12 5.03 -0.11 6.68 1.01 -0.66 -1.01 121.20 133.25 1nba s ILE 168 Ca -0.08 1.18 0.02 0.00 0.00 0.00 0.00 60.65 61.77 1nba s ILE 168 Cb -0.19 -3.94 -0.01 0.00 0.01 0.00 0.00 42.46 38.32 1nba s ILE 168 CO -0.06 0.13 -0.16 -0.69 0.00 0.00 0.00 174.94 174.15 1nba s VAL 169 N 1.81 2.76 0.44 2.92 1.01 -0.44 -0.80 120.40 128.11 1nba s VAL 169 Ca 0.29 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.53 1nba s VAL 169 Cb -0.16 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 1nba s VAL 169 CO 0.11 0.54 0.11 0.42 0.00 0.00 0.00 175.10 176.27 1nba s THR 170 N 0.20 0.69 0.00 3.92 -4.23 -0.64 -4.08 115.64 111.50 1nba s THR 170 Ca -0.10 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 1nba s THR 170 Cb -0.16 -2.28 0.00 0.00 1.34 0.00 0.00 72.50 71.40 1nba s THR 170 CO 0.06 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 1nba n GLY 171 N -1.01 0.26 3.09 3.99 0.00 -0.02 -1.40 105.19 110.10 1nba n GLY 171 Ca -0.09 -2.13 -0.19 0.00 0.00 0.00 0.00 46.02 43.60 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 0.96 0.23 4.61 0.00 -0.13 -1.26 121.76 124.17 1nba s ALA 172 Ca 0.00 -0.64 0.09 0.00 0.00 0.00 0.00 51.96 51.41 1nba s ALA 172 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1nba s ALA 172 CO 0.00 0.19 -0.02 0.95 0.00 0.00 0.00 175.76 176.88 1nba s THR 173 N -0.61 3.46 0.34 0.00 -4.23 -1.26 -4.25 115.64 109.08 1nba s THR 173 Ca 0.02 -1.77 0.07 0.00 -1.18 0.00 0.00 61.69 58.82 1nba s THR 173 Cb -0.06 -2.81 0.31 0.00 1.34 0.00 0.00 72.50 71.29 1nba s THR 173 CO 0.00 -0.28 1.85 0.00 -0.54 0.00 0.00 174.62 175.66 1nba h ALA 174 N 2.22 1.75 -0.02 3.99 0.00 -1.67 -0.65 119.26 124.89 1nba h ALA 174 Ca -0.45 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1nba h ALA 174 Cb 1.23 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1nba h ALA 174 CO 0.59 -0.01 -0.01 0.00 0.00 0.00 0.00 179.25 179.82 1nba n ALA 175 N -2.41 2.57 -2.09 0.00 0.00 -1.26 -3.50 120.51 113.82 1nba n ALA 175 Ca 0.18 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1nba n ALA 175 Cb 0.45 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 1.21 2.26 0.38 0.00 0.00 -0.82 -4.96 105.19 103.26 1nba n GLY 176 Ca 0.18 -0.19 0.15 0.00 0.00 0.00 0.00 46.02 46.15 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 0.46 1.38 0.02 0.00 2.07 -1.32 -2.63 116.25 116.23 1nba h VAL 178 Ca 0.39 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 1nba h VAL 178 Cb 0.84 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1nba h VAL 178 CO -0.13 0.35 -0.01 -0.09 0.02 0.00 0.00 177.57 177.71 1nba h ARG 179 N -0.27 -0.02 -0.93 1.57 2.43 -1.57 -0.82 114.38 114.77 1nba h ARG 179 Ca 0.01 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1nba h ARG 179 Cb 0.60 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.11 1nba h ARG 179 CO 0.02 0.07 0.61 1.25 -1.51 0.00 0.00 179.97 180.41 1nba h HIS 180 N -0.11 1.16 0.03 2.20 2.76 -1.64 -1.35 115.15 118.21 1nba h HIS 180 Ca -0.00 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1nba h HIS 180 Cb 0.10 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 28.67 1nba h HIS 180 CO -0.05 0.72 -0.02 1.15 -1.30 0.00 0.00 177.93 178.43 1nba h THR 181 N 1.24 1.05 -0.24 6.26 2.02 -1.16 -1.72 112.91 120.36 1nba h THR 181 Ca 0.35 -0.27 0.04 0.00 0.77 0.00 0.00 66.41 67.30 1nba h THR 181 Cb -0.11 1.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 1nba h THR 181 CO -0.08 0.07 -0.02 0.58 0.37 0.00 0.00 175.52 176.44 1nba h VAL 182 N -0.16 0.81 0.00 3.16 2.07 -0.46 -0.08 116.25 121.58 1nba h VAL 182 Ca -0.00 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 1nba h VAL 182 Cb 0.15 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1nba h VAL 182 CO 0.01 0.01 -0.34 1.05 0.02 0.00 0.00 177.57 178.32 1nba h GLU 183 N 0.05 0.00 -0.49 1.57 4.11 -1.22 -1.29 114.58 117.31 1nba h GLU 183 Ca 0.11 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.44 1nba h GLU 183 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1nba h GLU 183 CO -0.21 0.34 -0.11 -0.44 0.07 0.00 0.00 179.01 178.66 1nba h ASP 184 N 0.00 0.91 0.01 3.06 3.32 -0.64 -2.77 116.42 120.30 1nba h ASP 184 Ca -0.00 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 1nba h ASP 184 Cb 0.96 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1nba h ASP 184 CO 0.04 1.03 -0.01 0.00 -1.72 0.00 0.00 179.24 178.58 1nba h ALA 185 N 1.05 -0.02 -0.28 3.45 0.00 0.14 -1.38 119.26 122.24 1nba h ALA 185 Ca 0.13 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1nba h ALA 185 Cb 0.63 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1nba h ALA 185 CO 0.04 -0.47 -0.20 0.97 0.00 0.00 0.00 179.25 179.60 1nba h ILE 186 N -0.09 1.25 -0.08 0.00 2.10 -1.37 0.17 117.51 119.48 1nba h ILE 186 Ca -0.00 -1.17 -0.00 0.00 1.08 0.00 0.00 64.86 64.77 1nba h ILE 186 Cb 0.09 1.26 -0.00 0.00 -1.09 0.00 0.00 36.82 37.07 1nba h ILE 186 CO 0.00 0.38 0.04 0.00 -1.08 0.00 0.00 178.15 177.49 1nba h ALA 187 N 1.34 0.10 0.00 0.18 0.00 -1.27 -2.81 119.26 116.80 1nba h ALA 187 Ca 0.07 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1nba h ALA 187 Cb 0.60 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1nba h ALA 187 CO 0.04 -0.35 -0.22 0.87 0.00 0.00 0.00 179.25 179.59 1nba h LYS 188 N 0.02 0.00 0.00 0.00 1.57 -0.98 -3.47 116.57 113.71 1nba h LYS 188 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1nba h LYS 188 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1nba h LYS 188 CO -0.00 0.22 0.00 0.41 -0.57 0.00 0.00 179.45 179.51 1nba n GLY 189 N 0.29 1.74 3.07 3.86 0.00 -0.39 -5.10 105.19 108.65 1nba n GLY 189 Ca 0.01 0.00 -0.28 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 -1.74 1.99 -0.32 1.61 0.08 -0.09 -4.90 117.98 114.60 1nba s PHE 190 Ca 0.00 -0.91 -0.28 0.00 0.12 0.00 0.00 56.93 55.86 1nba s PHE 190 Cb 0.00 -1.42 -0.02 0.00 -0.57 0.00 0.00 43.02 41.01 1nba s PHE 190 CO 0.00 -0.45 1.86 1.03 -0.10 0.00 0.00 175.22 177.56 1nba s ARG 191 N 0.88 3.28 -0.14 0.44 0.52 -0.36 -3.06 118.95 120.51 1nba s ARG 191 Ca -0.09 1.48 -0.27 0.00 -0.52 0.00 0.00 55.73 56.33 1nba s ARG 191 Cb -0.15 -4.23 -0.01 0.00 0.52 0.00 0.00 34.95 31.08 1nba s ARG 191 CO 0.00 -1.93 0.91 -2.14 0.02 0.00 0.00 175.30 172.16 1nba s PRO 192 N 5.81 4.35 -0.14 3.54 0.02 -1.26 -1.07 135.00 146.25 1nba s PRO 192 Ca 0.82 1.18 0.01 0.00 0.02 0.00 0.00 61.00 63.03 1nba s PRO 192 Cb -0.23 -3.56 0.00 0.00 0.02 0.00 0.00 34.50 30.73 1nba s PRO 192 CO 0.33 -0.33 -0.19 0.42 -0.33 0.00 0.00 177.00 176.91 1nba s ILE 193 N 2.11 2.41 -0.32 2.83 1.09 -0.18 -1.82 121.20 127.32 1nba s ILE 193 Ca 0.42 -0.87 -0.07 0.00 -1.10 0.00 0.00 60.65 59.04 1nba s ILE 193 Cb -0.17 -1.99 0.03 0.00 -1.06 0.00 0.00 42.46 39.27 1nba s ILE 193 CO 0.14 0.53 0.10 -0.63 -0.10 0.00 0.00 174.94 174.99 1nba s ILE 194 N 0.72 3.87 -0.49 2.92 1.09 -0.27 -1.32 121.20 127.72 1nba s ILE 194 Ca -0.08 -0.97 -0.28 0.00 -1.10 0.00 0.00 60.65 58.22 1nba s ILE 194 Cb -0.16 -3.12 0.01 0.00 -1.06 0.00 0.00 42.46 38.13 1nba s ILE 194 CO 0.01 -0.09 1.41 -2.16 -0.10 0.00 0.00 174.94 174.01 1nba s PRO 195 N 1.44 3.44 0.23 2.79 0.04 -1.26 -0.85 135.00 140.83 1nba s PRO 195 Ca -0.00 0.69 -0.05 0.00 0.04 0.00 0.00 61.00 61.67 1nba s PRO 195 Cb -0.19 -4.07 0.41 0.00 0.04 0.00 0.00 34.50 30.69 1nba s PRO 195 CO 0.03 -1.75 1.28 -2.13 0.04 0.00 0.00 177.00 174.46 1nba n ARG 196 N 8.35 -0.07 0.00 4.56 0.63 -0.09 -1.06 116.66 128.98 1nba n ARG 196 Ca 0.14 1.27 0.10 0.00 -0.92 0.00 0.00 57.85 58.44 1nba n ARG 196 Cb 0.49 -1.91 0.49 0.00 0.45 0.00 0.00 32.46 31.98 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 -5.31 0.20 -0.29 -0.14 4.71 -1.26 -2.66 120.64 115.89 1nba n GLU 197 Ca 0.14 0.11 0.10 0.00 -0.01 0.00 0.00 57.16 57.50 1nba n GLU 197 Cb 0.44 -1.50 0.26 0.00 -1.01 0.00 0.00 31.44 29.63 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 -1.36 0.87 -3.99 2.62 -2.24 -0.23 -4.19 114.28 105.77 1nba n THR 198 Ca 0.08 -0.94 -0.35 0.00 -2.27 0.00 0.00 64.05 60.58 1nba n THR 198 Cb 0.19 0.62 -0.09 0.00 -2.10 0.00 0.00 70.33 68.95 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 -1.09 4.93 0.25 2.28 -1.09 -1.09 -0.84 121.20 124.55 1nba s ILE 199 Ca 0.41 0.01 0.03 0.00 -2.23 0.00 0.00 60.65 58.87 1nba s ILE 199 Cb 0.22 -3.20 -0.05 0.00 -1.58 0.00 0.00 42.46 37.84 1nba s ILE 199 CO 0.29 0.50 0.02 -0.83 -1.23 0.00 0.00 174.94 173.69 1nba s GLY 200 N 0.02 1.65 0.16 6.18 0.00 -0.39 -4.97 107.32 109.98 1nba s GLY 200 Ca 0.07 -1.82 -0.06 0.00 0.00 0.00 0.00 44.72 42.91 1nba s GLY 200 CO 0.01 -1.67 0.31 1.34 0.00 0.00 0.00 173.10 173.08 1nba n ASP 201 N -0.46 -0.90 0.00 1.64 -0.08 -1.26 -2.00 116.55 113.49 1nba n ASP 201 Ca -0.04 -1.66 0.00 0.00 -1.51 0.00 0.00 54.79 51.58 1nba n ASP 201 Cb 0.65 1.51 0.00 0.00 2.34 0.00 0.00 41.12 45.62 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 -0.22 0.97 -4.22 -0.67 1.85 -1.26 -4.12 116.66 108.98 1nba n ARG 202 Ca -0.03 -0.80 -0.13 0.00 -1.00 0.00 0.00 57.85 55.89 1nba n ARG 202 Cb 0.24 -0.76 -0.10 0.00 -1.05 0.00 0.00 32.46 30.79 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 -0.37 0.61 0.68 8.89 -7.23 -1.26 -4.97 120.40 116.74 1nba s VAL 203 Ca 0.00 -1.97 -0.13 0.00 -1.81 0.00 0.00 61.98 58.07 1nba s VAL 203 Cb 0.00 -2.07 0.01 0.00 0.56 0.00 0.00 36.38 34.87 1nba s VAL 203 CO 0.00 -0.51 1.08 -2.16 -0.31 0.00 0.00 175.10 173.20 1nba s PRO 204 N -3.92 2.82 0.00 4.82 0.04 -1.26 -4.24 135.00 133.26 1nba s PRO 204 Ca 0.23 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1nba s PRO 204 Cb 0.06 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1nba s PRO 204 CO 0.03 -1.21 0.00 0.41 0.04 0.00 0.00 177.00 176.27 1nba n GLY 205 N -1.10 0.76 0.36 0.56 0.00 -1.26 -4.77 105.19 99.74 1nba n GLY 205 Ca 0.09 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.26 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 0.67 -0.22 1.61 -1.51 -1.99 -0.63 116.25 114.18 1nba h VAL 206 Ca 0.00 -0.23 -0.02 0.00 -1.23 0.00 0.00 66.70 65.22 1nba h VAL 206 Cb 0.00 -0.07 -0.01 0.00 -2.13 0.00 0.00 31.29 29.08 1nba h VAL 206 CO 0.00 0.12 0.06 0.58 -1.23 0.00 0.00 177.57 177.10 1nba h VAL 207 N 0.68 1.21 0.31 7.19 2.07 -1.86 -0.39 116.25 125.46 1nba h VAL 207 Ca 0.58 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 1nba h VAL 207 Cb 1.01 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 1nba h VAL 207 CO -0.36 0.21 -0.15 1.56 0.02 0.00 0.00 177.57 178.85 1nba h GLN 208 N 0.17 -0.40 0.00 1.57 4.20 -1.57 -1.16 115.11 117.91 1nba h GLN 208 Ca 0.07 0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.66 1nba h GLN 208 Cb 0.27 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1nba h GLN 208 CO 0.00 -0.22 -0.72 0.11 -0.67 0.00 0.00 178.83 177.33 1nba h TRP 209 N -0.49 0.00 -0.13 2.96 0.09 -1.16 -2.24 115.95 114.98 1nba h TRP 209 Ca -0.04 0.00 -0.20 0.00 0.09 0.00 0.00 58.89 58.74 1nba h TRP 209 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.61 1nba h TRP 209 CO -0.04 0.72 -0.73 -0.91 0.09 0.00 0.00 178.44 177.57 1nba h ASN 210 N 0.00 0.71 -0.48 0.11 4.21 -1.04 -1.27 115.58 117.83 1nba h ASN 210 Ca -0.01 -0.46 -0.06 0.00 1.21 0.00 0.00 56.30 56.99 1nba h ASN 210 Cb 1.27 -0.21 -0.02 0.00 -1.12 0.00 0.00 38.32 38.24 1nba h ASN 210 CO 0.09 1.22 0.09 -0.07 -1.29 0.00 0.00 177.43 177.47 1nba h LEU 211 N 0.42 0.80 0.27 1.61 3.38 -1.09 -1.29 115.31 119.41 1nba h LEU 211 Ca -0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1nba h LEU 211 Cb 1.33 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1nba h LEU 211 CO 0.14 0.82 -0.13 0.22 0.09 0.00 0.00 178.44 179.58 1nba h TYR 212 N 0.81 -0.34 -0.78 1.13 3.20 -1.29 -0.88 116.97 118.81 1nba h TYR 212 Ca 0.17 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.04 1nba h TYR 212 Cb 0.36 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1nba h TYR 212 CO 0.02 -0.18 0.51 -0.44 -1.64 0.00 0.00 178.16 176.44 1nba h ASP 213 N -0.40 0.88 0.07 -2.11 3.32 -0.99 -1.61 116.42 115.58 1nba h ASP 213 Ca -0.04 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1nba h ASP 213 Cb 0.31 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1nba h ASP 213 CO 0.06 0.63 -0.07 0.40 -1.72 0.00 0.00 179.24 178.54 1nba h ILE 214 N 1.04 0.83 0.00 0.35 2.04 -1.17 -2.65 117.51 117.96 1nba h ILE 214 Ca 0.29 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.14 1nba h ILE 214 Cb -0.10 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1nba h ILE 214 CO -0.07 0.00 -0.04 -0.78 0.00 0.00 0.00 178.15 177.26 1nba h ASP 215 N -0.16 0.00 -0.06 1.72 3.58 -0.60 0.39 116.42 121.28 1nba h ASP 215 Ca 0.01 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.21 1nba h ASP 215 Cb 0.16 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.22 1nba h ASP 215 CO -0.02 0.04 -0.92 0.78 -2.88 0.00 0.00 179.24 176.24 1nba h ASN 216 N 0.00 0.92 0.00 2.28 2.35 -0.97 -3.43 115.58 116.74 1nba h ASN 216 Ca -0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 56.30 55.07 1nba h ASN 216 Cb 0.10 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.19 1nba h ASN 216 CO 0.01 1.48 0.00 0.29 -1.65 0.00 0.00 177.43 177.55 1nba n LYS 217 N -3.89 0.62 0.00 0.81 5.02 -0.98 -1.73 118.16 118.01 1nba n LYS 217 Ca -0.09 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 1nba n LYS 217 Cb 0.82 -0.49 0.00 0.00 -0.02 0.00 0.00 35.03 35.34 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 -0.12 0.00 -3.82 2.13 3.72 0.13 -5.07 117.46 114.43 1nba n PHE 218 Ca 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1nba n PHE 218 Cb 0.11 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.65 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 -0.20 -0.14 -0.22 1.37 0.00 -0.82 -4.59 107.32 102.72 1nba s GLY 219 Ca 0.00 0.10 -0.08 0.00 0.00 0.00 0.00 44.72 44.73 1nba s GLY 219 CO 0.00 2.27 0.09 0.99 0.00 0.00 0.00 173.10 176.45 1nba s ASP 220 N -3.33 5.63 -0.22 1.64 1.01 -0.75 -3.89 116.67 116.76 1nba s ASP 220 Ca 0.20 0.01 -0.19 0.00 0.71 0.00 0.00 52.55 53.29 1nba s ASP 220 Cb 0.00 -1.99 -0.03 0.00 1.01 0.00 0.00 42.92 41.91 1nba s ASP 220 CO 0.01 0.09 0.54 -0.69 0.21 0.00 0.00 175.17 175.33 1nba s VAL 221 N 0.89 5.08 0.44 -1.27 1.01 -1.26 -1.12 120.40 124.17 1nba s VAL 221 Ca 0.05 0.98 0.03 0.00 0.00 0.00 0.00 61.98 63.04 1nba s VAL 221 Cb -0.14 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 1nba s VAL 221 CO 0.03 0.14 0.06 -1.61 0.00 0.00 0.00 175.10 173.72 1nba s GLU 222 N 1.89 2.02 0.44 2.72 0.41 -0.03 -4.94 118.70 121.20 1nba s GLU 222 Ca 0.24 -2.24 -0.06 0.00 -0.41 0.00 0.00 54.97 52.50 1nba s GLU 222 Cb -0.16 -1.08 -0.04 0.00 -1.78 0.00 0.00 34.13 31.08 1nba s GLU 222 CO 0.09 -0.38 0.75 -1.54 -0.49 0.00 0.00 175.26 173.70 1nba s SER 223 N -3.71 6.33 0.36 -0.19 1.04 -1.26 -0.92 113.70 115.35 1nba s SER 223 Ca 0.18 0.92 0.06 0.00 0.48 0.00 0.00 55.95 57.59 1nba s SER 223 Cb 0.03 -2.24 0.70 0.00 0.10 0.00 0.00 66.02 64.61 1nba s SER 223 CO 0.10 -0.50 1.92 0.74 0.98 0.00 0.00 173.24 176.48 1nba h THR 224 N 0.50 1.17 -0.53 2.02 2.02 -1.93 -2.29 112.91 113.88 1nba h THR 224 Ca -0.47 -0.67 0.08 0.00 0.77 0.00 0.00 66.41 66.12 1nba h THR 224 Cb 1.20 0.93 -0.06 0.00 -1.74 0.00 0.00 68.15 68.48 1nba h THR 224 CO 0.62 0.23 0.17 0.44 0.37 0.00 0.00 175.52 177.35 1nba h ASP 225 N 0.44 0.15 -0.65 4.18 3.32 -1.99 0.87 116.42 122.74 1nba h ASP 225 Ca 0.10 0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 1nba h ASP 225 Cb 0.27 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 1nba h ASP 225 CO 0.01 0.11 0.09 0.28 -1.72 0.00 0.00 179.24 178.01 1nba h SER 226 N 0.34 1.05 -0.09 6.45 0.02 -1.81 -0.77 113.55 118.74 1nba h SER 226 Ca 0.26 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1nba h SER 226 Cb 0.31 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 1nba h SER 226 CO -0.28 1.05 -0.01 0.58 -1.14 0.00 0.00 176.83 177.03 1nba h VAL 227 N 1.02 1.27 -0.76 2.27 2.07 -1.05 -0.29 116.25 120.79 1nba h VAL 227 Ca 0.20 -0.85 0.06 0.00 0.82 0.00 0.00 66.70 66.93 1nba h VAL 227 Cb 0.45 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1nba h VAL 227 CO 0.01 0.24 0.45 0.58 0.02 0.00 0.00 177.57 178.87 1nba h VAL 228 N -0.13 1.00 -0.44 2.57 2.07 -0.75 -0.39 116.25 120.18 1nba h VAL 228 Ca 0.02 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1nba h VAL 228 Cb 0.38 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 1nba h VAL 228 CO 0.01 0.15 0.03 -0.61 0.02 0.00 0.00 177.57 177.16 1nba h GLN 229 N 0.82 0.70 0.49 1.57 4.15 -0.98 0.15 115.11 122.01 1nba h GLN 229 Ca 0.33 -0.16 -0.02 0.00 0.77 0.00 0.00 58.65 59.57 1nba h GLN 229 Cb 0.18 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.78 1nba h GLN 229 CO -0.18 0.69 -0.23 -0.92 -1.93 0.00 0.00 178.83 176.26 1nba h TYR 230 N 0.66 -0.61 -0.44 3.99 3.20 0.06 -1.72 116.97 122.11 1nba h TYR 230 Ca 0.14 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 1nba h TYR 230 Cb 0.37 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 1nba h TYR 230 CO 0.02 -0.30 0.29 -0.07 -1.64 0.00 0.00 178.16 176.46 1nba h LEU 231 N -0.86 0.45 -0.80 2.82 3.38 -0.91 -1.04 115.31 118.35 1nba h LEU 231 Ca -0.07 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 1nba h LEU 231 Cb 0.58 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1nba h LEU 231 CO 0.11 0.32 -0.47 0.44 0.09 0.00 0.00 178.44 178.93 1nba h ASP 232 N 0.53 0.00 -0.11 -0.43 3.32 -0.57 -2.87 116.42 116.28 1nba h ASP 232 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1nba h ASP 232 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1nba h ASP 232 CO -0.04 0.47 0.00 0.00 -1.72 0.00 0.00 179.24 177.95 1nba n ALA 233 N -2.33 2.53 -1.77 3.45 0.00 -0.45 -4.94 120.51 116.99 1nba n ALA 233 Ca -0.00 -0.55 -0.34 0.00 0.00 0.00 0.00 53.44 52.55 1nba n ALA 233 Cb 0.57 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 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 -1.77 3.78 1.05 0.00 2.96 -0.88 -5.05 118.68 118.77 1nba s LEU 234 Ca 0.35 2.00 -0.13 0.00 -0.22 0.00 0.00 54.13 56.12 1nba s LEU 234 Cb 0.20 -4.56 0.22 0.00 0.50 0.00 0.00 46.19 42.54 1nba s LEU 234 CO 0.30 -0.96 1.09 -2.16 -1.32 0.00 0.00 176.35 173.29 1nba s PRO 235 N -3.33 -0.02 0.51 0.98 0.04 -1.26 -4.99 135.00 126.93 1nba s PRO 235 Ca 0.69 0.46 -0.23 0.00 0.04 0.00 0.00 61.00 61.95 1nba s PRO 235 Cb -0.19 -1.69 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 1nba s PRO 235 CO 0.24 -3.02 1.39 1.04 0.04 0.00 0.00 177.00 176.69 1nba n GLN 236 N -4.37 1.92 -0.32 4.56 1.13 -1.26 -4.87 117.38 114.17 1nba n GLN 236 Ca 0.06 0.70 0.06 0.00 -1.94 0.00 0.00 57.00 55.87 1nba n GLN 236 Cb 0.57 -2.60 0.26 0.00 0.11 0.00 0.00 30.24 28.58 1nba n GLN 236 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1nba h PHE 237 N 1.77 1.05 -0.44 1.08 3.57 -1.02 -0.32 116.94 122.63 1nba h PHE 237 Ca -0.51 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.15 1nba h PHE 237 Cb 1.29 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 1nba h PHE 237 CO 0.47 0.48 0.38 0.93 -2.23 0.00 0.00 178.31 178.34 1nba h GLU 238 N 0.97 0.00 -0.02 1.11 5.08 -1.88 -1.73 114.58 118.11 1nba h GLU 238 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1nba h GLU 238 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1nba h GLU 238 CO -0.20 0.00 -0.02 -0.25 -1.00 0.00 0.00 179.01 177.55 1nba n ASP 239 N -4.06 2.36 -4.85 1.42 8.00 -0.13 -4.96 116.55 114.33 1nba n ASP 239 Ca 0.08 -1.78 -0.32 0.00 0.71 0.00 0.00 54.79 53.49 1nba n ASP 239 Cb 0.57 0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.65 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 -2.02 4.63 0.01 -3.53 -4.23 -0.65 -4.99 115.64 104.85 1nba s THR 240 Ca 0.32 0.99 0.01 0.00 -1.18 0.00 0.00 61.69 61.83 1nba s THR 240 Cb 0.20 -3.70 -0.01 0.00 1.34 0.00 0.00 72.50 70.34 1nba s THR 240 CO 0.32 -0.53 -0.04 0.54 -0.54 0.00 0.00 174.62 174.37 1nba s VAL 241 N -2.41 0.27 0.45 2.29 0.11 -1.26 -4.97 120.40 114.87 1nba s VAL 241 Ca 0.56 -0.37 -0.22 0.00 -2.93 0.00 0.00 61.98 59.02 1nba s VAL 241 Cb -0.10 -0.27 -0.08 0.00 -1.53 0.00 0.00 36.38 34.40 1nba s VAL 241 CO 0.28 -0.07 1.09 -2.16 -3.33 0.00 0.00 175.10 170.91 1nba s PRO 242 N -0.47 3.90 0.04 1.54 0.04 -1.26 -4.34 135.00 134.45 1nba s PRO 242 Ca -0.03 1.56 -0.30 0.00 0.04 0.00 0.00 61.00 62.27 1nba s PRO 242 Cb -0.04 -2.36 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 1nba s PRO 242 CO -0.00 -0.38 1.58 0.15 0.04 0.00 0.00 177.00 178.38 1nba s LYS 243 N -2.78 4.22 0.46 4.56 1.02 -1.26 -4.92 119.74 121.04 1nba s LYS 243 Ca 0.63 2.21 0.26 0.00 0.02 0.00 0.00 55.97 59.08 1nba s LYS 243 Cb -0.23 -3.62 0.80 0.00 -0.52 0.00 0.00 37.83 34.26 1nba s LYS 243 CO 0.28 -0.70 1.77 1.79 -0.92 0.00 0.00 175.35 177.57 1nba h THR 244 N 4.91 0.26 -4.47 2.17 1.35 -2.03 -3.47 112.91 111.63 1nba h THR 244 Ca -0.41 -1.02 -0.27 0.00 -0.55 0.00 0.00 66.41 64.16 1nba h THR 244 Cb 1.19 1.83 -0.13 0.00 -1.73 0.00 0.00 68.15 69.31 1nba h THR 244 CO 0.92 0.12 -0.46 -0.76 -0.25 0.00 0.00 175.52 175.09 1nba s LEU 245 N -6.39 1.16 0.72 3.87 1.43 -1.26 -5.14 118.68 113.06 1nba s LEU 245 Ca 0.03 -1.43 -0.15 0.00 -1.03 0.00 0.00 54.13 51.55 1nba s LEU 245 Cb 0.08 0.76 0.03 0.00 0.03 0.00 0.00 46.19 47.09 1nba s LEU 245 CO 0.63 -1.00 1.19 -0.55 0.23 0.00 0.00 176.35 176.85 1nba s SER 246 N -3.20 4.37 0.32 2.29 0.15 -1.26 -4.99 113.70 111.38 1nba s SER 246 Ca 0.36 2.28 -0.28 0.00 0.70 0.00 0.00 55.95 59.01 1nba s SER 246 Cb 0.04 -2.58 -0.09 0.00 -1.71 0.00 0.00 66.02 61.67 1nba s SER 246 CO 0.16 -2.14 1.16 -1.81 1.20 0.00 0.00 173.24 171.81 1nba s ASP 247 N -2.15 6.97 0.39 5.45 1.01 -1.26 -4.98 116.67 122.09 1nba s ASP 247 Ca 0.73 2.37 -0.27 0.00 0.71 0.00 0.00 52.55 56.09 1nba s ASP 247 Cb -0.27 -2.63 -0.11 0.00 1.01 0.00 0.00 42.92 40.92 1nba s ASP 247 CO 0.45 -0.36 1.41 -0.81 0.21 0.00 0.00 175.17 176.07 1nba n PRO 248 N 0.79 2.41 -4.31 8.23 -0.04 -1.26 -5.03 135.00 135.79 1nba n PRO 248 Ca 0.01 0.85 -0.27 0.00 -0.04 0.00 0.00 63.50 64.05 1nba n PRO 248 Cb 0.45 -2.56 -0.10 0.00 -0.04 0.00 0.00 33.50 31.25 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 -2.13 1.98 -0.38 0.54 -1.52 -1.26 -5.06 119.66 111.82 1nba s GLN 249 Ca 0.56 -1.32 -0.27 0.00 -1.95 0.00 0.00 55.36 52.37 1nba s GLN 249 Cb -0.49 -2.10 -0.06 0.00 -0.22 0.00 0.00 33.01 30.14 1nba s GLN 249 CO 0.62 0.42 2.29 -1.25 -0.25 0.00 0.00 175.29 177.12 1nba s PRO 250 N -2.85 2.57 0.27 2.91 0.04 -1.26 -4.97 135.00 131.70 1nba s PRO 250 Ca 0.25 1.62 -0.25 0.00 0.04 0.00 0.00 61.00 62.65 1nba s PRO 250 Cb -0.08 -4.48 -0.09 0.00 0.04 0.00 0.00 34.50 29.88 1nba s PRO 250 CO 0.15 -2.75 0.89 -1.21 0.04 0.00 0.00 177.00 174.11 1nba s GLU 251 N 7.37 4.57 -0.03 4.56 2.02 -1.26 -5.06 118.70 130.86 1nba s GLU 251 Ca 0.97 1.25 -0.03 0.00 0.02 0.00 0.00 54.97 57.18 1nba s GLU 251 Cb -0.23 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 1nba s GLU 251 CO 0.30 0.37 0.13 0.08 0.02 0.00 0.00 175.26 176.16 1nba s VAL 252 N -1.48 5.18 0.22 2.63 1.01 -1.26 -5.09 120.40 121.61 1nba s VAL 252 Ca 0.46 -0.16 -0.25 0.00 0.00 0.00 0.00 61.98 62.02 1nba s VAL 252 Cb -0.20 -3.36 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 1nba s VAL 252 CO 0.25 0.41 0.84 -0.70 0.00 0.00 0.00 175.10 175.89 1nba s GLU 253 N -1.64 4.58 0.27 2.72 2.12 -1.26 -5.03 118.70 120.46 1nba s GLU 253 Ca 0.23 1.21 -0.30 0.00 0.36 0.00 0.00 54.97 56.47 1nba s GLU 253 Cb -0.12 -3.11 -0.11 0.00 0.26 0.00 0.00 34.13 31.06 1nba s GLU 253 CO 0.13 0.47 1.49 0.00 -0.54 0.00 0.00 175.26 176.82 1nba s ALA 254 N -1.31 3.67 0.28 6.30 0.00 -1.26 -4.97 121.76 124.46 1nba s ALA 254 Ca 0.41 1.43 -0.30 0.00 0.00 0.00 0.00 51.96 53.49 1nba s ALA 254 Cb -0.22 -3.59 -0.12 0.00 0.00 0.00 0.00 23.12 19.19 1nba s ALA 254 CO 0.26 -0.84 1.59 -2.30 0.00 0.00 0.00 175.76 174.47 1nba n PRO 255 N 2.15 2.63 -2.03 0.00 -0.02 -1.26 -4.98 135.00 131.49 1nba n PRO 255 Ca 0.07 0.94 -0.38 0.00 -2.02 0.00 0.00 63.50 62.11 1nba n PRO 255 Cb 0.39 -2.71 0.01 0.00 -0.02 0.00 0.00 33.50 31.17 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 0.10 2.92 0.30 3.55 0.00 -1.26 -5.00 121.76 122.37 1nba s ALA 256 Ca 0.66 1.13 -0.28 0.00 0.00 0.00 0.00 51.96 53.47 1nba s ALA 256 Cb -0.52 -3.47 -0.09 0.00 0.00 0.00 0.00 23.12 19.04 1nba s ALA 256 CO 0.47 -1.00 1.03 -0.51 0.00 0.00 0.00 175.76 175.76 1nba s ASP 257 N -1.14 7.24 0.47 0.00 1.11 -1.26 -4.96 116.67 118.14 1nba s ASP 257 Ca 0.67 2.09 0.13 0.00 0.18 0.00 0.00 52.55 55.62 1nba s ASP 257 Cb -0.35 -2.61 1.10 0.00 1.07 0.00 0.00 42.92 42.14 1nba s ASP 257 CO 0.41 -0.15 2.10 1.55 1.18 0.00 0.00 175.17 180.26 1nba h PRO 258 N 3.51 0.16 0.00 8.23 0.13 -2.06 -3.57 132.00 138.40 1nba h PRO 258 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1nba h PRO 258 Cb 1.21 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1nba h PRO 258 CO 0.66 0.14 0.00 1.55 -0.23 0.00 0.00 178.00 180.12