#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p31 h LYS 10 N 0.00 0.00 0.00 5.56 1.57 -2.01 -3.35 116.57 118.34 1p31 h LYS 10 Ca 0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 1p31 h LYS 10 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 1p31 h LYS 10 CO 0.00 0.18 -2.00 -0.89 -0.57 0.00 0.00 179.45 176.17 1p31 n ILE 11 N -4.23 0.99 -3.89 1.86 -0.00 -1.26 -4.98 119.36 107.84 1p31 n ILE 11 Ca -0.02 -0.27 -0.36 0.00 -0.00 0.00 0.00 62.75 62.10 1p31 n ILE 11 Cb 0.25 -1.63 -0.13 0.00 -0.00 0.00 0.00 39.64 38.14 1p31 n ILE 11 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 1p31 s ILE 12 N -2.33 4.09 0.66 1.39 -1.09 -1.26 -5.06 121.20 117.61 1p31 s ILE 12 Ca -0.25 -0.25 -0.11 0.00 -2.23 0.00 0.00 60.65 57.81 1p31 s ILE 12 Cb 0.09 -2.89 -0.01 0.00 -1.58 0.00 0.00 42.46 38.07 1p31 s ILE 12 CO 0.33 0.39 1.05 -2.16 -1.23 0.00 0.00 174.94 173.31 1p31 s PRO 13 N 1.33 3.21 0.00 2.79 0.04 -1.26 -4.22 135.00 136.89 1p31 s PRO 13 Ca 0.05 0.91 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1p31 s PRO 13 Cb -0.15 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1p31 s PRO 13 CO 0.02 -0.88 0.00 -1.91 0.04 0.00 0.00 177.00 174.27 1p31 n GLU 14 N -2.89 0.11 -5.20 4.56 2.13 -1.26 -5.09 120.64 113.00 1p31 n GLU 14 Ca 0.07 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.58 1p31 n GLU 14 Cb 0.54 0.00 -0.17 0.00 0.27 0.00 0.00 31.44 32.08 1p31 n GLU 14 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1p31 s ARG 16 N 0.00 2.57 0.00 5.31 1.70 -1.26 -5.06 118.95 122.21 1p31 s ARG 16 Ca 0.00 -0.86 0.00 0.00 -0.47 0.00 0.00 55.73 54.40 1p31 s ARG 16 Cb 0.00 -2.12 0.00 0.00 -0.57 0.00 0.00 34.95 32.26 1p31 s ARG 16 CO 0.00 0.31 0.00 0.54 -1.08 0.00 0.00 175.30 175.07 1p31 n ARG 17 N 3.12 -1.66 -2.99 3.89 1.74 -1.26 -4.93 116.66 114.56 1p31 n ARG 17 Ca -0.18 0.42 -0.43 0.00 -0.77 0.00 0.00 57.85 56.88 1p31 n ARG 17 Cb 0.52 -4.75 -0.05 0.00 -1.02 0.00 0.00 32.46 27.16 1p31 n ARG 17 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1p31 s VAL 18 N -1.13 4.64 -0.25 1.55 1.01 -1.26 -4.86 120.40 120.09 1p31 s VAL 18 Ca 0.00 0.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.84 1p31 s VAL 18 Cb 0.00 -4.39 -0.12 0.00 0.00 0.00 0.00 36.38 31.87 1p31 s VAL 18 CO 0.00 -0.90 -0.28 0.00 0.00 0.00 0.00 175.10 173.91 1p31 n GLN 19 N 6.79 0.58 -4.69 2.72 6.02 -1.26 -4.95 117.38 122.60 1p31 n GLN 19 Ca -0.01 0.30 -0.25 0.00 -0.01 0.00 0.00 57.00 57.03 1p31 n GLN 19 Cb 0.47 -1.52 -0.16 0.00 1.02 0.00 0.00 30.24 30.05 1p31 n GLN 19 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 1p31 s GLN 20 N -2.54 1.65 -0.18 -1.09 0.74 -1.26 -2.09 119.66 114.89 1p31 s GLN 20 Ca -0.36 -0.50 -0.02 0.00 0.05 0.00 0.00 55.36 54.53 1p31 s GLN 20 Cb 0.12 -1.41 -0.01 0.00 1.10 0.00 0.00 33.01 32.81 1p31 s GLN 20 CO 0.49 0.15 -0.08 0.42 -0.55 0.00 0.00 175.29 175.72 1p31 s ILE 21 N 0.27 3.26 -0.16 -2.34 1.01 0.05 -0.21 121.20 123.08 1p31 s ILE 21 Ca -0.08 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 59.96 1p31 s ILE 21 Cb -0.13 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 1p31 s ILE 21 CO 0.03 0.48 0.02 -2.28 0.00 0.00 0.00 174.94 173.19 1p31 s HIS 22 N 0.89 3.18 -0.21 3.97 2.46 -0.36 -1.23 115.29 123.99 1p31 s HIS 22 Ca -0.02 -0.02 -0.04 0.00 0.47 0.00 0.00 55.06 55.45 1p31 s HIS 22 Cb -0.15 -2.00 -0.01 0.00 -0.13 0.00 0.00 32.58 30.29 1p31 s HIS 22 CO 0.00 0.15 -0.04 -0.06 -2.47 0.00 0.00 174.74 172.32 1p31 s PHE 23 N 0.18 2.96 -0.48 3.88 0.08 -0.11 0.37 117.98 124.86 1p31 s PHE 23 Ca 0.02 -0.83 -0.19 0.00 0.12 0.00 0.00 56.93 56.05 1p31 s PHE 23 Cb -0.13 -2.09 0.04 0.00 -0.57 0.00 0.00 43.02 40.28 1p31 s PHE 23 CO 0.01 -0.47 0.62 0.42 -0.10 0.00 0.00 175.22 175.70 1p31 s ILE 24 N 1.33 4.87 0.00 0.64 1.01 0.27 -1.12 121.20 128.20 1p31 s ILE 24 Ca 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.39 1p31 s ILE 24 Cb -0.14 -4.25 0.00 0.00 0.01 0.00 0.00 42.46 38.07 1p31 s ILE 24 CO -0.02 -0.72 0.00 0.61 0.00 0.00 0.00 174.94 174.81 1p31 n GLY 25 N 5.13 1.18 0.28 6.18 0.00 0.64 -2.40 105.19 116.19 1p31 n GLY 25 Ca -0.05 -0.01 0.16 0.00 0.00 0.00 0.00 46.02 46.12 1p31 n GLY 25 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1p31 h ILE 26 N 0.00 0.32 0.00 -0.61 2.10 -1.45 -1.67 117.51 116.21 1p31 h ILE 26 Ca 0.00 -0.42 0.00 0.00 1.08 0.00 0.00 64.86 65.52 1p31 h ILE 26 Cb 0.02 1.31 0.00 0.00 -1.09 0.00 0.00 36.82 37.06 1p31 h ILE 26 CO 0.00 0.07 0.00 0.61 -1.08 0.00 0.00 178.15 177.75 1p31 n GLY 27 N -0.60 -0.93 3.72 8.18 0.00 -1.26 -2.51 105.19 111.78 1p31 n GLY 27 Ca -0.01 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1p31 n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p31 s GLY 28 N -2.44 2.47 0.24 -0.02 0.00 -0.63 -4.73 107.32 102.21 1p31 s GLY 28 Ca 0.23 0.99 -0.06 0.00 0.00 0.00 0.00 44.72 45.88 1p31 s GLY 28 CO 0.31 1.40 1.85 0.00 0.00 0.00 0.00 173.10 176.66 1p31 h ALA 29 N -0.17 1.16 -0.37 3.20 0.00 -1.90 0.15 119.26 121.32 1p31 h ALA 29 Ca -0.48 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.25 1p31 h ALA 29 Cb 1.31 -0.22 -0.10 0.00 0.00 0.00 0.00 17.79 18.78 1p31 h ALA 29 CO 0.50 0.25 0.22 0.41 0.00 0.00 0.00 179.25 180.62 1p31 n GLY 30 N -1.32 2.84 1.02 0.00 0.00 -1.26 -4.07 105.19 102.39 1p31 n GLY 30 Ca 0.12 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1p31 n GLY 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p31 n SER 32 N -0.09 0.00 -0.17 1.61 3.41 0.04 -2.65 113.62 115.77 1p31 n SER 32 Ca 0.22 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.74 1p31 n SER 32 Cb 0.91 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.87 1p31 n SER 32 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1p31 h GLY 33 N 0.00 0.85 0.98 5.00 0.00 -1.78 0.99 103.07 109.12 1p31 h GLY 33 Ca 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 1p31 h GLY 33 CO 0.00 0.50 0.20 -2.22 0.00 0.00 0.00 176.54 175.01 1p31 h ILE 34 N 0.68 1.22 -0.85 2.60 2.04 -1.85 -0.97 117.51 120.38 1p31 h ILE 34 Ca 0.16 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 1p31 h ILE 34 Cb 0.33 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1p31 h ILE 34 CO 0.00 0.27 0.43 0.00 0.00 0.00 0.00 178.15 178.85 1p31 h ALA 35 N 1.05 1.15 -0.00 1.87 0.00 -1.80 -1.28 119.26 120.25 1p31 h ALA 35 Ca 0.17 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1p31 h ALA 35 Cb 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1p31 h ALA 35 CO -0.01 0.65 -0.12 1.49 0.00 0.00 0.00 179.25 181.26 1p31 h GLU 36 N 1.20 -0.20 0.01 0.00 4.57 -0.44 0.36 114.58 120.08 1p31 h GLU 36 Ca 0.29 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.51 1p31 h GLU 36 Cb 0.09 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 1p31 h GLU 36 CO -0.04 -0.13 -0.15 0.82 -1.18 0.00 0.00 179.01 178.33 1p31 h ILE 37 N -0.20 0.63 -0.46 2.32 1.08 -0.84 -1.58 117.51 118.46 1p31 h ILE 37 Ca 0.04 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.43 1p31 h ILE 37 Cb 0.26 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 34.62 1p31 h ILE 37 CO -0.12 0.00 -0.06 -0.07 -0.69 0.00 0.00 178.15 177.20 1p31 h LEU 38 N -0.26 0.79 -0.44 1.44 3.38 -1.10 -0.35 115.31 118.77 1p31 h LEU 38 Ca 0.05 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.81 1p31 h LEU 38 Cb 0.32 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1p31 h LEU 38 CO -0.14 0.89 0.28 0.25 0.09 0.00 0.00 178.44 179.81 1p31 h LEU 39 N 0.74 0.48 -1.08 1.67 5.85 -0.73 -2.01 115.31 120.23 1p31 h LEU 39 Ca 0.13 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1p31 h LEU 39 Cb 0.54 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 1p31 h LEU 39 CO 0.03 0.35 -0.05 0.78 -0.34 0.00 0.00 178.44 179.21 1p31 h ASN 40 N 0.57 0.00 1.36 1.25 2.35 -0.76 -2.12 115.58 118.23 1p31 h ASN 40 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1p31 h ASN 40 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 1p31 h ASN 40 CO -0.05 0.05 0.00 -0.33 -1.65 0.00 0.00 177.43 175.45 1p31 h GLU 41 N 0.00 0.00 0.00 0.81 5.08 -0.64 -3.47 114.58 116.36 1p31 h GLU 41 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1p31 h GLU 41 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1p31 h GLU 41 CO 0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 1p31 n GLY 42 N 0.48 0.90 3.79 -3.84 0.00 -0.79 -4.98 105.19 100.74 1p31 n GLY 42 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1p31 n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1p31 s TYR 43 N -2.00 2.88 0.12 1.61 2.02 -0.80 -5.01 117.35 116.17 1p31 s TYR 43 Ca 0.00 1.57 -0.30 0.00 -0.37 0.00 0.00 57.07 57.96 1p31 s TYR 43 Cb 0.00 -3.15 -0.06 0.00 -0.40 0.00 0.00 41.96 38.35 1p31 s TYR 43 CO 0.00 -1.10 1.12 -0.65 -1.57 0.00 0.00 175.55 173.35 1p31 s GLN 44 N -3.23 4.54 -0.07 -0.62 -1.52 -0.89 -4.45 119.66 113.42 1p31 s GLN 44 Ca 0.69 1.69 0.04 0.00 -1.95 0.00 0.00 55.36 55.83 1p31 s GLN 44 Cb -0.19 -3.32 0.00 0.00 -0.22 0.00 0.00 33.01 29.28 1p31 s GLN 44 CO 0.23 -0.05 -0.19 0.42 -0.25 0.00 0.00 175.29 175.45 1p31 s ILE 45 N 0.36 1.60 0.24 1.08 -1.09 -1.26 -0.77 121.20 121.35 1p31 s ILE 45 Ca 0.53 -0.77 0.04 0.00 -2.23 0.00 0.00 60.65 58.22 1p31 s ILE 45 Cb -0.28 -1.40 -0.05 0.00 -1.58 0.00 0.00 42.46 39.15 1p31 s ILE 45 CO 0.32 0.46 -0.03 -0.94 -1.23 0.00 0.00 174.94 173.52 1p31 s SER 46 N 0.33 2.10 -0.17 3.58 1.04 -0.36 -1.02 113.70 119.19 1p31 s SER 46 Ca -0.12 -1.19 -0.34 0.00 0.48 0.00 0.00 55.95 54.77 1p31 s SER 46 Cb -0.15 -0.04 0.14 0.00 0.10 0.00 0.00 66.02 66.06 1p31 s SER 46 CO 0.05 -0.45 1.16 -0.83 0.98 0.00 0.00 173.24 174.15 1p31 s GLY 47 N -3.33 -0.30 0.10 7.32 0.00 -0.38 -0.93 107.32 109.80 1p31 s GLY 47 Ca 0.28 1.59 0.07 0.00 0.00 0.00 0.00 44.72 46.66 1p31 s GLY 47 CO 0.09 0.55 -0.18 -1.35 0.00 0.00 0.00 173.10 172.20 1p31 s SER 48 N -2.13 2.29 0.11 1.64 1.04 -0.28 -0.38 113.70 116.00 1p31 s SER 48 Ca 0.08 -0.70 -0.14 0.00 0.48 0.00 0.00 55.95 55.67 1p31 s SER 48 Cb -0.01 -0.11 0.03 0.00 0.10 0.00 0.00 66.02 66.02 1p31 s SER 48 CO -0.05 -0.00 0.35 -0.62 0.98 0.00 0.00 173.24 173.89 1p31 s ASP 49 N -1.99 -0.15 0.00 7.02 2.15 -0.58 -0.26 116.67 122.86 1p31 s ASP 49 Ca 0.05 -0.38 0.28 0.00 0.43 0.00 0.00 52.55 52.93 1p31 s ASP 49 Cb -0.09 0.43 1.01 0.00 -0.30 0.00 0.00 42.92 43.97 1p31 s ASP 49 CO 0.04 -0.81 1.72 2.30 -0.17 0.00 0.00 175.17 178.25 1p31 n ILE 50 N -0.12 0.00 -4.05 4.11 -5.35 -1.26 -0.36 119.36 112.32 1p31 n ILE 50 Ca -0.16 -0.12 -0.17 0.00 -0.27 0.00 0.00 62.75 62.03 1p31 n ILE 50 Cb 0.63 0.21 -0.15 0.00 -1.74 0.00 0.00 39.64 38.59 1p31 n ILE 50 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1p31 s ALA 51 N -2.39 0.40 -0.21 -1.28 0.00 -1.26 -4.72 121.76 112.30 1p31 s ALA 51 Ca 0.29 -0.02 -0.11 0.00 0.00 0.00 0.00 51.96 52.12 1p31 s ALA 51 Cb 0.20 -0.24 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 1p31 s ALA 51 CO 0.47 0.01 0.17 0.34 0.00 0.00 0.00 175.76 176.75 1p31 s ASP 52 N 0.51 6.22 0.00 0.00 2.15 -1.26 -4.88 116.67 119.41 1p31 s ASP 52 Ca -0.06 0.24 0.00 0.00 0.43 0.00 0.00 52.55 53.16 1p31 s ASP 52 Cb -0.09 -2.11 0.00 0.00 -0.30 0.00 0.00 42.92 40.42 1p31 s ASP 52 CO -0.01 0.13 0.00 0.61 -0.17 0.00 0.00 175.17 175.73 1p31 n GLY 53 N 3.74 3.48 0.28 2.66 0.00 -1.26 -5.03 105.19 109.06 1p31 n GLY 53 Ca -0.15 -1.31 0.08 0.00 0.00 0.00 0.00 46.02 44.63 1p31 n GLY 53 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1p31 h VAL 54 N 0.72 0.50 0.25 1.61 2.07 -1.98 -1.29 116.25 118.12 1p31 h VAL 54 Ca 0.00 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1p31 h VAL 54 Cb 0.00 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1p31 h VAL 54 CO 0.00 0.06 -0.12 0.58 0.02 0.00 0.00 177.57 178.10 1p31 h VAL 55 N 0.30 0.81 -0.26 2.57 2.07 -1.96 -0.76 116.25 119.01 1p31 h VAL 55 Ca 0.46 -0.41 -0.08 0.00 0.82 0.00 0.00 66.70 67.48 1p31 h VAL 55 Cb 0.80 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1p31 h VAL 55 CO -0.52 0.09 -0.20 0.71 0.02 0.00 0.00 177.57 177.67 1p31 h THR 56 N -0.55 1.25 -0.53 2.57 1.35 -1.86 -2.02 112.91 113.12 1p31 h THR 56 Ca -0.03 -1.16 -0.04 0.00 -0.55 0.00 0.00 66.41 64.63 1p31 h THR 56 Cb 0.40 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 1p31 h THR 56 CO 0.06 0.37 0.19 1.56 -0.25 0.00 0.00 175.52 177.45 1p31 h GLN 57 N 0.43 0.81 -0.75 4.72 4.20 -1.13 0.51 115.11 123.90 1p31 h GLN 57 Ca 0.07 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1p31 h GLN 57 Cb 0.59 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 1p31 h GLN 57 CO 0.04 0.73 0.32 -0.09 -0.67 0.00 0.00 178.83 179.16 1p31 h ARG 58 N 0.73 1.10 -0.40 1.46 2.43 -0.87 -0.12 114.38 118.71 1p31 h ARG 58 Ca 0.18 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1p31 h ARG 58 Cb 0.23 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1p31 h ARG 58 CO -0.01 0.89 0.10 -0.07 -1.51 0.00 0.00 179.97 179.37 1p31 h LEU 59 N 1.07 0.61 -0.90 3.80 3.38 -1.15 -2.35 115.31 119.77 1p31 h LEU 59 Ca 0.25 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1p31 h LEU 59 Cb 0.18 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1p31 h LEU 59 CO -0.02 0.67 0.16 0.00 0.09 0.00 0.00 178.44 179.34 1p31 h ALA 60 N 0.95 1.10 -0.21 1.53 0.00 -0.68 -1.03 119.26 120.92 1p31 h ALA 60 Ca 0.13 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1p31 h ALA 60 Cb 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1p31 h ALA 60 CO 0.00 0.60 0.04 1.96 0.00 0.00 0.00 179.25 181.85 1p31 h GLN 61 N 0.93 0.30 -0.39 0.00 4.20 -0.90 -2.22 115.11 117.02 1p31 h GLN 61 Ca 0.20 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1p31 h GLN 61 Cb 0.32 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1p31 h GLN 61 CO -0.00 0.30 0.00 0.00 -0.67 0.00 0.00 178.83 178.45 1p31 n ALA 62 N -2.50 2.44 -0.02 3.87 0.00 -0.80 -4.91 120.51 118.59 1p31 n ALA 62 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1p31 n ALA 62 Cb 0.16 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1p31 n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p31 n GLY 63 N 1.12 0.46 3.77 0.00 0.00 -0.83 -5.04 105.19 104.66 1p31 n GLY 63 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1p31 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p31 s ALA 64 N -2.04 3.44 -0.46 4.61 0.00 -0.46 -4.76 121.76 122.10 1p31 s ALA 64 Ca 0.00 1.18 -0.20 0.00 0.00 0.00 0.00 51.96 52.94 1p31 s ALA 64 Cb 0.00 -3.45 0.03 0.00 0.00 0.00 0.00 23.12 19.71 1p31 s ALA 64 CO 0.00 -0.56 0.62 0.15 0.00 0.00 0.00 175.76 175.96 1p31 s LYS 65 N -1.80 3.21 -0.13 0.00 1.02 -0.19 -4.12 119.74 117.74 1p31 s LYS 65 Ca 0.49 -0.56 -0.01 0.00 0.02 0.00 0.00 55.97 55.91 1p31 s LYS 65 Cb -0.38 -3.99 -0.02 0.00 -0.52 0.00 0.00 37.83 32.92 1p31 s LYS 65 CO 0.50 -1.06 -0.08 0.42 -0.92 0.00 0.00 175.35 174.21 1p31 s ILE 66 N 2.71 3.49 -0.06 2.17 -1.09 -1.26 -1.24 121.20 125.91 1p31 s ILE 66 Ca 0.19 -0.52 0.03 0.00 -2.23 0.00 0.00 60.65 58.13 1p31 s ILE 66 Cb -0.16 -2.48 -0.02 0.00 -1.58 0.00 0.00 42.46 38.22 1p31 s ILE 66 CO 0.16 0.53 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.93 1p31 s TYR 67 N 0.14 2.68 -0.23 3.97 2.02 0.49 -4.98 117.35 121.44 1p31 s TYR 67 Ca -0.04 -0.30 -0.09 0.00 -0.37 0.00 0.00 57.07 56.28 1p31 s TYR 67 Cb -0.14 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 39.72 1p31 s TYR 67 CO 0.04 0.07 0.10 0.42 -1.57 0.00 0.00 175.55 174.62 1p31 s ILE 68 N -0.49 4.79 0.00 2.71 -1.09 -1.26 -1.52 121.20 124.35 1p31 s ILE 68 Ca 0.06 -0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.47 1p31 s ILE 68 Cb -0.12 -3.23 0.00 0.00 -1.58 0.00 0.00 42.46 37.54 1p31 s ILE 68 CO 0.02 0.36 0.00 0.61 -1.23 0.00 0.00 174.94 174.69 1p31 n GLY 69 N 4.45 0.77 3.83 6.18 0.00 0.51 -4.95 105.19 115.99 1p31 n GLY 69 Ca -0.16 -1.70 -0.35 0.00 0.00 0.00 0.00 46.02 43.81 1p31 n GLY 69 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1p31 s HIS 70 N -2.83 3.46 -0.27 1.61 3.76 -1.26 -4.52 115.29 115.23 1p31 s HIS 70 Ca 0.00 0.38 -0.23 0.00 -0.15 0.00 0.00 55.06 55.06 1p31 s HIS 70 Cb 0.00 -1.86 0.08 0.00 1.11 0.00 0.00 32.58 31.91 1p31 s HIS 70 CO 0.00 0.64 0.75 0.00 -0.85 0.00 0.00 174.74 175.28 1p31 s ALA 71 N -1.09 -1.83 0.39 -1.40 0.00 -1.26 -4.95 121.76 111.62 1p31 s ALA 71 Ca 0.18 2.10 0.16 0.00 0.00 0.00 0.00 51.96 54.40 1p31 s ALA 71 Cb -0.12 -1.27 1.03 0.00 0.00 0.00 0.00 23.12 22.76 1p31 s ALA 71 CO 0.08 -0.34 1.82 1.05 0.00 0.00 0.00 175.76 178.38 1p31 h GLU 72 N 5.33 0.46 0.00 0.00 4.11 -1.95 -0.48 114.58 122.05 1p31 h GLU 72 Ca -0.29 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.11 1p31 h GLU 72 Cb 1.18 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 1p31 h GLU 72 CO 0.08 0.30 -0.03 0.93 0.07 0.00 0.00 179.01 180.36 1p31 h GLU 73 N 0.47 0.00 0.00 1.06 3.07 -1.97 -2.90 114.58 114.31 1p31 h GLU 73 Ca 0.52 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.37 1p31 h GLU 73 Cb 1.20 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.11 1p31 h GLU 73 CO -0.23 0.03 -0.01 0.45 -1.40 0.00 0.00 179.01 177.84 1p31 h HIS 74 N 0.00 0.00 0.00 4.33 3.86 -1.50 -2.60 115.15 119.23 1p31 h HIS 74 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1p31 h HIS 74 Cb 0.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.56 1p31 h HIS 74 CO 0.00 0.01 -0.31 0.44 0.86 0.00 0.00 177.93 178.93 1p31 n ILE 75 N -3.18 0.29 -1.54 2.45 -5.35 -1.09 -4.81 119.36 106.13 1p31 n ILE 75 Ca -0.02 -0.18 -0.55 0.00 -0.27 0.00 0.00 62.75 61.73 1p31 n ILE 75 Cb 0.15 -0.26 -0.07 0.00 -1.74 0.00 0.00 39.64 37.72 1p31 n ILE 75 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1p31 n GLU 76 N -1.93 0.53 0.00 6.28 0.00 -0.98 -1.08 120.64 123.46 1p31 n GLU 76 Ca 0.05 0.19 0.00 0.00 0.00 0.00 0.00 57.16 57.40 1p31 n GLU 76 Cb 0.40 -1.73 0.00 0.00 0.00 0.00 0.00 31.44 30.11 1p31 n GLU 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1p31 n GLY 77 N 1.96 2.88 3.73 8.31 0.00 -1.26 -5.03 105.19 115.77 1p31 n GLY 77 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1p31 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p31 s ALA 78 N -2.18 3.84 0.03 4.61 0.00 -0.24 -4.49 121.76 123.33 1p31 s ALA 78 Ca 0.00 1.50 0.10 0.00 0.00 0.00 0.00 51.96 53.55 1p31 s ALA 78 Cb 0.00 -3.66 -0.22 0.00 0.00 0.00 0.00 23.12 19.24 1p31 s ALA 78 CO 0.00 -0.87 0.95 0.77 0.00 0.00 0.00 175.76 176.61 1p31 h SER 79 N 6.40 0.01 -4.60 0.00 0.02 -0.93 -3.48 113.55 110.97 1p31 h SER 79 Ca -0.44 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.41 1p31 h SER 79 Cb 1.21 -0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.53 1p31 h SER 79 CO 0.91 1.01 -0.09 0.54 -1.14 0.00 0.00 176.83 178.06 1p31 s VAL 80 N -2.65 0.02 -0.14 2.27 0.11 -1.17 -4.32 120.40 114.52 1p31 s VAL 80 Ca -0.02 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.86 1p31 s VAL 80 Cb 0.09 -0.75 -0.00 0.00 -1.53 0.00 0.00 36.38 34.18 1p31 s VAL 80 CO 0.82 -0.09 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.65 1p31 s VAL 81 N -0.71 2.66 -0.15 2.04 1.01 0.07 -1.22 120.40 124.10 1p31 s VAL 81 Ca -0.08 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.08 1p31 s VAL 81 Cb -0.03 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1p31 s VAL 81 CO 0.04 0.52 -0.04 -0.69 0.00 0.00 0.00 175.10 174.94 1p31 s VAL 82 N 0.62 3.92 -0.08 2.92 1.01 0.16 -0.42 120.40 128.53 1p31 s VAL 82 Ca -0.09 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.57 1p31 s VAL 82 Cb -0.16 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1p31 s VAL 82 CO 0.03 0.51 -0.20 0.54 0.00 0.00 0.00 175.10 175.98 1p31 s VAL 83 N 0.20 1.70 0.53 2.92 0.11 -0.13 -0.56 120.40 125.17 1p31 s VAL 83 Ca -0.02 -0.81 -0.19 0.00 -2.93 0.00 0.00 61.98 58.03 1p31 s VAL 83 Cb -0.14 -1.49 -0.07 0.00 -1.53 0.00 0.00 36.38 33.16 1p31 s VAL 83 CO 0.03 0.48 1.05 -0.55 -3.33 0.00 0.00 175.10 172.78 1p31 s SER 84 N 0.43 6.10 0.00 3.54 0.15 -1.01 -1.74 113.70 121.17 1p31 s SER 84 Ca -0.16 1.91 0.12 0.00 0.70 0.00 0.00 55.95 58.52 1p31 s SER 84 Cb -0.17 -2.55 0.53 0.00 -1.71 0.00 0.00 66.02 62.12 1p31 s SER 84 CO 0.07 -0.95 1.38 -1.20 1.20 0.00 0.00 173.24 173.74 1p31 n SER 85 N -1.36 0.00 0.25 5.45 7.64 -1.26 -2.05 113.62 122.29 1p31 n SER 85 Ca 0.09 0.46 0.15 0.00 1.01 0.00 0.00 58.87 60.58 1p31 n SER 85 Cb 0.52 -0.48 0.48 0.00 -1.01 0.00 0.00 64.21 63.72 1p31 n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p31 h ALA 86 N 2.44 0.99 -2.62 -0.43 0.00 -1.94 -3.45 119.26 114.25 1p31 h ALA 86 Ca 0.00 -0.03 -0.52 0.00 0.00 0.00 0.00 54.91 54.36 1p31 h ALA 86 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1p31 h ALA 86 CO 0.00 0.04 0.47 0.42 0.00 0.00 0.00 179.25 180.18 1p31 s ILE 87 N -3.49 4.00 0.45 0.00 -1.09 -0.87 -5.03 121.20 115.16 1p31 s ILE 87 Ca 0.03 1.66 -0.21 0.00 -2.23 0.00 0.00 60.65 59.91 1p31 s ILE 87 Cb 0.08 -4.06 -0.10 0.00 -1.58 0.00 0.00 42.46 36.80 1p31 s ILE 87 CO 0.60 0.26 0.99 -0.54 -1.23 0.00 0.00 174.94 175.01 1p31 s LYS 88 N -0.10 4.06 0.62 2.79 -0.14 -1.26 -4.96 119.74 120.75 1p31 s LYS 88 Ca 0.50 1.23 0.36 0.00 -1.36 0.00 0.00 55.97 56.70 1p31 s LYS 88 Cb -0.28 -2.16 2.06 0.00 -1.68 0.00 0.00 37.83 35.77 1p31 s LYS 88 CO 0.33 -0.19 2.29 -0.44 -0.76 0.00 0.00 175.35 176.58 1p31 h ASP 89 N 1.79 0.00 -0.17 2.83 5.19 -1.99 -1.30 116.42 122.77 1p31 h ASP 89 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1p31 h ASP 89 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1p31 h ASP 89 CO 0.60 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.82 1p31 n ASP 90 N -3.51 2.05 -4.68 6.45 5.75 -1.26 -4.65 116.55 116.70 1p31 n ASP 90 Ca -0.03 -1.75 -0.45 0.00 -0.01 0.00 0.00 54.79 52.56 1p31 n ASP 90 Cb 0.10 -0.11 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 1p31 n ASP 90 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1p31 n ASN 91 N 0.58 3.43 -0.13 -1.12 2.85 -0.49 -4.83 115.26 115.54 1p31 n ASN 91 Ca 0.17 1.06 -0.02 0.00 -0.11 0.00 0.00 54.58 55.68 1p31 n ASN 91 Cb 0.40 -1.47 0.22 0.00 1.24 0.00 0.00 39.78 40.17 1p31 n ASN 91 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1p31 h PRO 92 N 6.61 0.83 -0.36 1.20 0.13 -1.92 0.77 132.00 139.26 1p31 h PRO 92 Ca -0.45 -0.14 -0.13 0.00 -0.87 0.00 0.00 66.00 64.41 1p31 h PRO 92 Cb 1.24 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1p31 h PRO 92 CO 0.92 0.70 -0.31 0.93 -0.23 0.00 0.00 178.00 180.00 1p31 h GLU 93 N 0.81 0.79 0.24 0.86 5.08 -1.89 -1.42 114.58 119.06 1p31 h GLU 93 Ca 0.19 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1p31 h GLU 93 Cb 0.20 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1p31 h GLU 93 CO -0.01 0.99 -0.11 1.25 -1.00 0.00 0.00 179.01 180.13 1p31 h LEU 94 N 0.67 -0.27 -0.61 1.33 5.85 -1.77 -1.65 115.31 118.85 1p31 h LEU 94 Ca 0.07 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.66 1p31 h LEU 94 Cb 0.85 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.90 1p31 h LEU 94 CO 0.07 0.06 0.31 0.58 -0.34 0.00 0.00 178.44 179.12 1p31 h VAL 95 N -0.63 0.92 -0.20 1.05 2.07 -0.86 -1.92 116.25 116.68 1p31 h VAL 95 Ca -0.03 -0.20 -0.17 0.00 0.82 0.00 0.00 66.70 67.12 1p31 h VAL 95 Cb 0.45 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1p31 h VAL 95 CO 0.05 0.10 -0.57 0.74 0.02 0.00 0.00 177.57 177.91 1p31 h THR 96 N 0.57 1.31 -0.49 2.57 2.02 -1.28 -1.56 112.91 116.05 1p31 h THR 96 Ca 0.28 -1.82 0.04 0.00 0.77 0.00 0.00 66.41 65.69 1p31 h THR 96 Cb 0.22 1.78 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 1p31 h THR 96 CO -0.20 0.57 0.25 0.28 0.37 0.00 0.00 175.52 176.78 1p31 h SER 97 N 0.48 0.36 -0.69 4.18 0.02 -0.87 0.16 113.55 117.18 1p31 h SER 97 Ca 0.00 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.92 1p31 h SER 97 Cb 1.14 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.61 1p31 h SER 97 CO 0.11 0.25 0.20 0.11 -1.14 0.00 0.00 176.83 176.36 1p31 h LYS 98 N 0.49 1.09 -0.82 3.45 1.57 -1.20 -1.43 116.57 119.71 1p31 h LYS 98 Ca 0.21 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1p31 h LYS 98 Cb 0.12 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.24 1p31 h LYS 98 CO -0.15 0.95 0.48 0.37 -0.57 0.00 0.00 179.45 180.53 1p31 h GLN 99 N 1.03 1.12 -0.03 3.15 4.15 -0.64 -2.57 115.11 121.31 1p31 h GLN 99 Ca 0.22 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1p31 h GLN 99 Cb 0.33 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.79 1p31 h GLN 99 CO -0.00 0.79 0.00 1.63 -1.93 0.00 0.00 178.83 179.32 1p31 n LYS 100 N -4.37 1.49 -2.95 1.69 4.76 0.51 -4.92 118.16 114.37 1p31 n LYS 100 Ca 0.09 -0.71 -0.22 0.00 -2.87 0.00 0.00 58.31 54.60 1p31 n LYS 100 Cb 0.07 -1.47 0.02 0.00 -1.84 0.00 0.00 35.03 31.82 1p31 n LYS 100 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1p31 n ARG 101 N -0.13 -4.21 -2.88 1.97 1.74 -0.76 -4.98 116.66 107.41 1p31 n ARG 101 Ca 0.20 0.87 -0.41 0.00 -0.77 0.00 0.00 57.85 57.74 1p31 n ARG 101 Cb 0.28 -5.69 -0.04 0.00 -1.02 0.00 0.00 32.46 25.99 1p31 n ARG 101 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1p31 s ILE 102 N -3.12 4.88 0.06 0.55 1.01 -0.61 -4.99 121.20 118.97 1p31 s ILE 102 Ca 0.26 1.77 -0.35 0.00 0.00 0.00 0.00 60.65 62.33 1p31 s ILE 102 Cb -0.12 -4.18 -0.14 0.00 0.01 0.00 0.00 42.46 38.03 1p31 s ILE 102 CO 0.32 0.24 1.61 -2.65 0.00 0.00 0.00 174.94 174.47 1p31 n PRO 103 N 3.57 1.89 -4.03 2.79 -0.02 -1.26 -4.51 135.00 133.42 1p31 n PRO 103 Ca 0.02 0.68 -0.34 0.00 -2.02 0.00 0.00 63.50 61.84 1p31 n PRO 103 Cb 0.51 -2.44 -0.15 0.00 -0.02 0.00 0.00 33.50 31.40 1p31 n PRO 103 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1p31 s VAL 104 N 1.74 2.74 0.09 -1.45 1.01 -1.26 -0.75 120.40 122.53 1p31 s VAL 104 Ca 0.85 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 62.18 1p31 s VAL 104 Cb -0.77 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1p31 s VAL 104 CO 0.45 0.48 -0.17 0.27 0.00 0.00 0.00 175.10 176.13 1p31 s ILE 105 N 1.36 1.39 0.61 2.22 -4.36 0.44 -4.98 121.20 117.87 1p31 s ILE 105 Ca 0.05 -1.45 -0.18 0.00 -0.26 0.00 0.00 60.65 58.81 1p31 s ILE 105 Cb -0.14 -1.32 -0.03 0.00 1.25 0.00 0.00 42.46 42.23 1p31 s ILE 105 CO -0.08 -0.18 1.16 -1.10 0.24 0.00 0.00 174.94 174.99 1p31 s GLN 106 N -1.90 2.96 0.27 0.37 -0.21 -1.26 -0.96 119.66 118.92 1p31 s GLN 106 Ca 0.03 1.67 -0.09 0.00 0.02 0.00 0.00 55.36 56.98 1p31 s GLN 106 Cb -0.09 -1.95 0.42 0.00 1.00 0.00 0.00 33.01 32.39 1p31 s GLN 106 CO 0.03 -1.18 1.57 -0.09 -2.12 0.00 0.00 175.29 173.50 1p31 h ARG 107 N 0.67 -0.00 0.00 2.91 2.43 -1.69 -1.15 114.38 117.56 1p31 h ARG 107 Ca -0.49 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.63 1p31 h ARG 107 Cb 1.28 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1p31 h ARG 107 CO 0.55 -0.00 -0.24 0.00 -1.51 0.00 0.00 179.97 178.77 1p31 h ALA 108 N 1.92 1.28 0.00 2.80 0.00 -1.88 -0.75 119.26 122.63 1p31 h ALA 108 Ca 0.45 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1p31 h ALA 108 Cb 0.69 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1p31 h ALA 108 CO -0.98 0.30 0.00 0.94 0.00 0.00 0.00 179.25 179.51 1p31 n GLN 109 N -3.78 0.43 0.00 0.00 7.27 -0.44 -0.35 117.38 120.51 1p31 n GLN 109 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.06 1p31 n GLN 109 Cb 0.34 -1.26 0.00 0.00 2.41 0.00 0.00 30.24 31.73 1p31 n GLN 109 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1p31 n LEU 111 N 0.60 0.00 -0.25 1.69 7.94 -0.29 -1.70 117.00 124.99 1p31 n LEU 111 Ca 0.00 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.88 1p31 n LEU 111 Cb 0.17 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.30 1p31 n LEU 111 CO 0.00 0.00 1.18 0.00 -1.11 0.00 0.00 177.39 177.46 1p31 h ALA 112 N 0.00 1.31 -0.45 1.96 0.00 -0.96 -2.23 119.26 118.90 1p31 h ALA 112 Ca 0.00 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1p31 h ALA 112 Cb 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1p31 h ALA 112 CO 0.00 0.57 -0.04 0.93 0.00 0.00 0.00 179.25 180.72 1p31 h GLU 113 N 1.09 0.76 -1.00 0.00 4.39 -1.59 0.20 114.58 118.43 1p31 h GLU 113 Ca 0.28 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1p31 h GLU 113 Cb -0.01 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 1p31 h GLU 113 CO -0.05 0.79 0.00 -0.89 -1.16 0.00 0.00 179.01 177.71 1p31 n ILE 114 N -4.20 0.10 0.00 3.13 5.41 -0.84 -4.42 119.36 118.54 1p31 n ILE 114 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1p31 n ILE 114 Cb 0.32 -0.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.90 1p31 n ILE 114 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1p31 n ARG 116 N 0.65 0.00 -0.61 0.38 0.63 0.69 -4.32 116.66 114.09 1p31 n ARG 116 Ca 0.00 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.01 1p31 n ARG 116 Cb 0.07 -0.04 0.32 0.00 0.45 0.00 0.00 32.46 33.26 1p31 n ARG 116 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1p31 n PHE 117 N 0.00 1.40 -4.25 -0.14 3.72 -1.26 -4.97 117.46 111.97 1p31 n PHE 117 Ca 0.00 -0.73 -0.24 0.00 -0.05 0.00 0.00 57.45 56.43 1p31 n PHE 117 Cb 0.00 -0.33 -0.08 0.00 -0.94 0.00 0.00 39.48 38.13 1p31 n PHE 117 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1p31 s ARG 118 N -2.39 2.18 -0.78 -1.08 0.52 -1.26 -4.94 118.95 111.20 1p31 s ARG 118 Ca 0.47 -1.70 -0.24 0.00 -0.52 0.00 0.00 55.73 53.74 1p31 s ARG 118 Cb 0.34 -2.01 0.06 0.00 0.52 0.00 0.00 34.95 33.87 1p31 s ARG 118 CO 0.16 0.10 1.17 -1.58 0.02 0.00 0.00 175.30 175.17 1p31 s HIS 119 N -2.50 2.58 -0.11 -0.53 5.65 0.20 -4.92 115.29 115.66 1p31 s HIS 119 Ca 0.36 -0.54 -0.25 0.00 0.25 0.00 0.00 55.06 54.88 1p31 s HIS 119 Cb -0.00 -4.47 -0.02 0.00 -1.18 0.00 0.00 32.58 26.90 1p31 s HIS 119 CO 0.21 -1.82 0.81 0.20 -0.65 0.00 0.00 174.74 173.48 1p31 s GLY 120 N 3.90 2.40 -0.33 1.59 0.00 -1.26 -1.17 107.32 112.46 1p31 s GLY 120 Ca 0.32 0.15 -0.03 0.00 0.00 0.00 0.00 44.72 45.15 1p31 s GLY 120 CO 0.06 1.51 0.06 -0.42 0.00 0.00 0.00 173.10 174.31 1p31 s ILE 121 N 1.51 3.26 -0.18 0.90 1.01 0.16 -1.78 121.20 126.08 1p31 s ILE 121 Ca 0.40 -1.42 -0.08 0.00 0.00 0.00 0.00 60.65 59.55 1p31 s ILE 121 Cb -0.18 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 1p31 s ILE 121 CO 0.17 -0.22 0.08 0.00 0.00 0.00 0.00 174.94 174.96 1p31 s ALA 122 N 1.28 3.47 -0.32 9.38 0.00 0.07 -1.05 121.76 134.59 1p31 s ALA 122 Ca -0.02 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.15 1p31 s ALA 122 Cb -0.20 -1.97 0.03 0.00 0.00 0.00 0.00 23.12 20.99 1p31 s ALA 122 CO -0.00 0.19 0.08 0.08 0.00 0.00 0.00 175.76 176.11 1p31 s VAL 123 N 0.34 3.73 0.51 0.00 1.01 0.14 -0.33 120.40 125.80 1p31 s VAL 123 Ca 0.04 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.00 1p31 s VAL 123 Cb -0.12 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1p31 s VAL 123 CO -0.00 -0.10 0.06 0.00 0.00 0.00 0.00 175.10 175.06 1p31 s ALA 124 N 1.41 4.12 0.00 5.51 0.00 0.46 -0.29 121.76 132.97 1p31 s ALA 124 Ca -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.36 1p31 s ALA 124 Cb -0.19 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.86 1p31 s ALA 124 CO 0.02 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1p31 n GLY 125 N -1.32 3.00 0.11 0.00 0.00 -1.26 -1.63 105.19 104.09 1p31 n GLY 125 Ca -0.16 -1.99 -0.14 0.00 0.00 0.00 0.00 46.02 43.73 1p31 n GLY 125 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1p31 h THR 126 N 0.21 1.42 -3.51 2.61 2.02 -1.60 -3.46 112.91 110.60 1p31 h THR 126 Ca 0.00 -1.52 -0.53 0.00 0.77 0.00 0.00 66.41 65.13 1p31 h THR 126 Cb 0.00 2.24 -0.19 0.00 -1.74 0.00 0.00 68.15 68.46 1p31 h THR 126 CO 0.00 0.43 -0.80 -1.00 0.37 0.00 0.00 175.52 174.52 1p31 s HIS 127 N -3.86 1.80 0.00 3.16 3.76 -1.26 -4.83 115.29 114.05 1p31 s HIS 127 Ca -0.15 -0.45 0.00 0.00 -0.15 0.00 0.00 55.06 54.31 1p31 s HIS 127 Cb 0.03 -0.93 0.00 0.00 1.11 0.00 0.00 32.58 32.80 1p31 s HIS 127 CO 0.74 0.28 0.00 0.41 -0.85 0.00 0.00 174.74 175.32 1p31 n GLY 128 N 0.56 0.76 0.27 -2.22 0.00 -1.26 -4.66 105.19 98.65 1p31 n GLY 128 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 1p31 n GLY 128 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p31 h LYS 129 N 2.81 0.95 -0.38 1.61 1.57 -1.88 -0.67 116.57 120.58 1p31 h LYS 129 Ca 0.00 -0.38 -0.11 0.00 -1.87 0.00 0.00 60.65 58.29 1p31 h LYS 129 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1p31 h LYS 129 CO 0.00 1.05 -0.18 1.15 -0.57 0.00 0.00 179.45 180.90 1p31 h THR 130 N 0.80 1.28 -0.27 -0.16 2.02 -1.93 0.09 112.91 114.74 1p31 h THR 130 Ca 0.12 -1.31 -0.04 0.00 0.77 0.00 0.00 66.41 65.94 1p31 h THR 130 Cb 0.73 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1p31 h THR 130 CO 0.06 0.44 0.00 0.74 0.37 0.00 0.00 175.52 177.12 1p31 h THR 131 N 0.60 1.25 -0.39 3.16 2.02 -1.95 -1.61 112.91 116.00 1p31 h THR 131 Ca 0.09 -0.91 -0.05 0.00 0.77 0.00 0.00 66.41 66.31 1p31 h THR 131 Cb 0.73 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.45 1p31 h THR 131 CO 0.06 0.29 0.06 0.74 0.37 0.00 0.00 175.52 177.04 1p31 h THR 132 N 0.25 1.24 -0.47 3.16 2.02 -1.03 -2.59 112.91 115.49 1p31 h THR 132 Ca 0.08 -0.85 0.03 0.00 0.77 0.00 0.00 66.41 66.44 1p31 h THR 132 Cb 0.42 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 1p31 h THR 132 CO 0.01 0.29 0.25 0.74 0.37 0.00 0.00 175.52 177.19 1p31 h THR 133 N 0.48 1.00 0.00 3.16 2.02 -0.97 -0.57 112.91 118.03 1p31 h THR 133 Ca 0.12 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1p31 h THR 133 Cb 0.36 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.22 1p31 h THR 133 CO 0.01 0.09 0.00 0.00 0.37 0.00 0.00 175.52 175.99 1p31 n ALA 134 N -2.29 1.13 0.00 6.16 0.00 -0.61 -0.87 120.51 124.03 1p31 n ALA 134 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1p31 n ALA 134 Cb 0.10 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1p31 n ALA 134 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1p31 n ILE 136 N 0.64 0.00 0.00 0.00 5.41 -0.22 -4.63 119.36 120.55 1p31 n ILE 136 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1p31 n ILE 136 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1p31 n ILE 136 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1p31 n SER 137 N 0.00 0.00 0.00 4.38 7.64 -0.05 -1.17 113.62 124.42 1p31 n SER 137 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1p31 n SER 137 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1p31 n SER 137 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1p31 n ILE 139 N 0.43 0.00 0.05 0.44 5.41 -1.26 -1.04 119.36 123.39 1p31 n ILE 139 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1p31 n ILE 139 Cb 0.00 0.00 0.31 0.00 -0.71 0.00 0.00 39.64 39.24 1p31 n ILE 139 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 176.55 178.43 1p31 h TYR 140 N 0.00 0.41 -0.31 1.39 0.05 -1.52 0.40 116.97 117.39 1p31 h TYR 140 Ca 0.00 -0.06 -0.05 0.00 0.05 0.00 0.00 58.73 58.67 1p31 h TYR 140 Cb 0.00 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.62 1p31 h TYR 140 CO 0.00 0.51 -0.01 1.15 -1.05 0.00 0.00 178.16 178.76 1p31 h THR 141 N 0.36 1.26 -0.36 -2.88 2.02 -1.33 -1.23 112.91 110.75 1p31 h THR 141 Ca 0.07 -0.97 -0.06 0.00 0.77 0.00 0.00 66.41 66.23 1p31 h THR 141 Cb 0.45 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1p31 h THR 141 CO 0.03 0.31 -0.02 -0.61 0.37 0.00 0.00 175.52 175.60 1p31 h GLN 142 N 0.34 0.57 0.00 6.66 5.75 -1.69 -1.29 115.11 125.44 1p31 h GLN 142 Ca 0.09 -0.13 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1p31 h GLN 142 Cb 0.45 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.93 1p31 h GLN 142 CO 0.02 0.61 0.00 0.00 -2.65 0.00 0.00 178.83 176.81 1p31 n ALA 143 N -2.48 2.14 -2.80 3.38 0.00 0.08 -4.87 120.51 115.97 1p31 n ALA 143 Ca 0.02 -0.11 -0.15 0.00 0.00 0.00 0.00 53.44 53.20 1p31 n ALA 143 Cb 0.27 -1.31 0.03 0.00 0.00 0.00 0.00 19.45 18.44 1p31 n ALA 143 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1p31 n LYS 144 N -1.08 -3.44 0.00 0.00 5.02 -0.49 -4.92 118.16 113.26 1p31 n LYS 144 Ca 0.13 0.61 0.11 0.00 -2.02 0.00 0.00 58.31 57.14 1p31 n LYS 144 Cb 0.09 -4.84 0.06 0.00 -0.02 0.00 0.00 35.03 30.32 1p31 n LYS 144 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1p31 n LEU 145 N -2.83 1.77 -3.70 -0.35 4.77 -0.47 -5.00 117.00 111.19 1p31 n LEU 145 Ca -0.07 -0.64 -0.28 0.00 -0.03 0.00 0.00 56.01 54.99 1p31 n LEU 145 Cb 0.58 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.68 1p31 n LEU 145 CO 0.32 0.33 -0.09 -0.67 -1.33 0.00 0.00 177.39 175.96 1p31 n ASP 146 N -0.25 -3.99 -4.79 -1.43 2.03 -1.25 -4.56 116.55 102.31 1p31 n ASP 146 Ca 0.09 -0.97 -0.33 0.00 0.52 0.00 0.00 54.79 54.11 1p31 n ASP 146 Cb 0.44 -3.56 0.02 0.00 -0.72 0.00 0.00 41.12 37.30 1p31 n ASP 146 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1p31 s PRO 147 N -5.96 3.14 0.18 -0.67 0.04 -1.26 -3.17 135.00 127.29 1p31 s PRO 147 Ca 0.33 1.24 -0.23 0.00 0.04 0.00 0.00 61.00 62.38 1p31 s PRO 147 Cb -0.11 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 1p31 s PRO 147 CO 0.85 -0.96 0.74 0.99 0.04 0.00 0.00 177.00 178.66 1p31 s THR 148 N -2.46 4.47 0.03 1.26 2.01 -0.11 -3.40 115.64 117.43 1p31 s THR 148 Ca 0.64 1.52 0.01 0.00 0.31 0.00 0.00 61.69 64.17 1p31 s THR 148 Cb -0.17 -4.02 -0.02 0.00 0.01 0.00 0.00 72.50 68.30 1p31 s THR 148 CO 0.39 0.42 -0.05 0.72 -0.69 0.00 0.00 174.62 175.42 1p31 s PHE 149 N -1.27 0.45 -0.26 4.92 -0.71 -0.46 -0.89 117.98 119.75 1p31 s PHE 149 Ca 0.37 -0.49 -0.02 0.00 -1.04 0.00 0.00 56.93 55.75 1p31 s PHE 149 Cb -0.21 -0.28 0.09 0.00 -1.21 0.00 0.00 43.02 41.41 1p31 s PHE 149 CO 0.24 -0.13 0.09 0.08 -1.34 0.00 0.00 175.22 174.15 1p31 s VAL 150 N -1.35 0.49 0.25 -2.49 1.01 0.21 -1.33 120.40 117.18 1p31 s VAL 150 Ca -0.12 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 60.99 1p31 s VAL 150 Cb -0.10 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1p31 s VAL 150 CO -0.00 -0.53 0.22 0.21 0.00 0.00 0.00 175.10 174.99 1p31 s ASN 151 N 1.83 5.60 -0.11 3.32 3.04 0.47 -1.87 114.94 127.22 1p31 s ASN 151 Ca 0.06 -0.22 0.09 0.00 0.04 0.00 0.00 52.86 52.82 1p31 s ASN 151 Cb -0.17 -1.44 0.45 0.00 -1.54 0.00 0.00 41.25 38.56 1p31 s ASN 151 CO -0.22 -0.05 1.23 0.61 -3.04 0.00 0.00 177.10 175.63 1p31 n GLY 152 N -1.21 2.12 3.71 1.21 0.00 -1.26 -4.56 105.19 105.20 1p31 n GLY 152 Ca -0.08 -0.51 -0.02 0.00 0.00 0.00 0.00 46.02 45.41 1p31 n GLY 152 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p31 s GLY 153 N -0.54 -0.29 0.26 -0.02 0.00 -1.26 -4.77 107.32 100.70 1p31 s GLY 153 Ca 0.31 0.32 -0.31 0.00 0.00 0.00 0.00 44.72 45.04 1p31 s GLY 153 CO 0.11 0.05 1.65 -0.10 0.00 0.00 0.00 173.10 174.81 1p31 n LEU 154 N -0.47 4.22 -4.50 0.66 7.94 -1.26 -4.35 117.00 119.24 1p31 n LEU 154 Ca -0.07 1.11 -0.43 0.00 -1.11 0.00 0.00 56.01 55.51 1p31 n LEU 154 Cb 0.61 -1.59 -0.06 0.00 0.53 0.00 0.00 43.42 42.91 1p31 n LEU 154 CO 0.13 0.17 0.43 -0.69 -1.11 0.00 0.00 177.39 176.32 1p31 s VAL 155 N 0.49 4.77 0.23 1.96 1.01 -0.10 -0.18 120.40 128.58 1p31 s VAL 155 Ca 0.69 0.02 -0.07 0.00 0.00 0.00 0.00 61.98 62.62 1p31 s VAL 155 Cb -0.50 -4.28 0.20 0.00 0.00 0.00 0.00 36.38 31.81 1p31 s VAL 155 CO 0.42 -0.72 1.85 0.11 0.00 0.00 0.00 175.10 176.75 1p31 h LYS 156 N 8.97 1.26 -0.44 2.72 1.57 -1.74 0.74 116.57 129.64 1p31 h LYS 156 Ca -0.26 -0.16 0.04 0.00 -1.87 0.00 0.00 60.65 58.41 1p31 h LYS 156 Cb 1.09 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 33.14 1p31 h LYS 156 CO 0.94 0.93 0.29 0.77 -0.57 0.00 0.00 179.45 181.81 1p31 h SER 157 N 1.26 0.37 0.78 0.86 0.02 -1.89 -2.71 113.55 112.23 1p31 h SER 157 Ca 0.31 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.13 1p31 h SER 157 Cb 0.05 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1p31 h SER 157 CO -0.05 0.25 -1.31 0.00 -1.14 0.00 0.00 176.83 174.58 1p31 n ALA 158 N -2.50 2.07 -1.16 3.77 0.00 -0.23 -4.98 120.51 117.47 1p31 n ALA 158 Ca 0.05 -0.46 -0.06 0.00 0.00 0.00 0.00 53.44 52.97 1p31 n ALA 158 Cb 0.19 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 1p31 n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p31 n GLY 159 N 1.34 0.80 3.39 0.00 0.00 0.09 -5.00 105.19 105.82 1p31 n GLY 159 Ca -0.07 -0.75 -0.11 0.00 0.00 0.00 0.00 46.02 45.08 1p31 n GLY 159 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p31 s LYS 160 N -2.39 1.22 0.33 1.61 -2.85 -1.22 -4.97 119.74 111.47 1p31 s LYS 160 Ca 0.00 -0.57 0.22 0.00 -1.00 0.00 0.00 55.97 54.62 1p31 s LYS 160 Cb 0.00 0.55 0.17 0.00 -2.06 0.00 0.00 37.83 36.49 1p31 s LYS 160 CO 0.00 -0.52 1.37 -0.91 0.10 0.00 0.00 175.35 175.39 1p31 h ASN 161 N 2.13 0.00 -5.05 0.03 4.21 -1.88 -0.24 115.58 114.77 1p31 h ASN 161 Ca -0.34 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.07 1p31 h ASN 161 Cb 1.29 0.00 -0.18 0.00 -1.12 0.00 0.00 38.32 38.31 1p31 h ASN 161 CO 0.41 0.09 -0.33 0.00 -1.29 0.00 0.00 177.43 176.31 1p31 s ALA 162 N -3.21 -0.54 -0.19 -0.83 0.00 -1.26 -0.39 121.76 115.34 1p31 s ALA 162 Ca 0.04 -0.08 -0.15 0.00 0.00 0.00 0.00 51.96 51.77 1p31 s ALA 162 Cb 0.07 0.25 0.05 0.00 0.00 0.00 0.00 23.12 23.49 1p31 s ALA 162 CO 0.72 -0.35 0.48 -1.58 0.00 0.00 0.00 175.76 175.03 1p31 s HIS 163 N -2.28 -0.60 -0.31 0.00 2.46 -0.44 -4.96 115.29 109.16 1p31 s HIS 163 Ca -0.07 1.37 -0.22 0.00 0.47 0.00 0.00 55.06 56.61 1p31 s HIS 163 Cb -0.02 0.25 -0.00 0.00 -0.13 0.00 0.00 32.58 32.67 1p31 s HIS 163 CO -0.02 -0.31 0.71 -1.17 -2.47 0.00 0.00 174.74 171.49 1p31 s LEU 164 N 0.71 4.12 0.34 8.88 2.96 -1.26 -1.36 118.68 133.07 1p31 s LEU 164 Ca -0.04 0.54 0.07 0.00 -0.22 0.00 0.00 54.13 54.48 1p31 s LEU 164 Cb -0.05 -2.95 -0.01 0.00 0.50 0.00 0.00 46.19 43.68 1p31 s LEU 164 CO -0.05 -0.56 0.47 -0.83 -1.32 0.00 0.00 176.35 174.06 1p31 s GLY 165 N 1.63 1.61 0.00 7.98 0.00 -1.22 -4.89 107.32 112.43 1p31 s GLY 165 Ca 0.29 -1.47 0.24 0.00 0.00 0.00 0.00 44.72 43.78 1p31 s GLY 165 CO 0.12 -1.38 1.65 0.00 0.00 0.00 0.00 173.10 173.49 1p31 n ALA 166 N -1.63 2.55 -2.84 3.20 0.00 -1.21 -4.61 120.51 115.96 1p31 n ALA 166 Ca -0.00 -0.46 -0.13 0.00 0.00 0.00 0.00 53.44 52.84 1p31 n ALA 166 Cb 0.58 -1.14 0.05 0.00 0.00 0.00 0.00 19.45 18.93 1p31 n ALA 166 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1p31 n SER 167 N 0.16 1.04 -0.07 0.00 3.41 -1.19 -4.96 113.62 112.01 1p31 n SER 167 Ca 0.17 -1.79 0.13 0.00 -0.26 0.00 0.00 58.87 57.13 1p31 n SER 167 Cb 0.32 -0.28 0.43 0.00 -0.26 0.00 0.00 64.21 64.42 1p31 n SER 167 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1p31 n ARG 168 N -1.81 0.30 -2.65 4.33 1.74 -1.26 -4.79 116.66 112.52 1p31 n ARG 168 Ca 0.09 -0.13 -0.41 0.00 -0.77 0.00 0.00 57.85 56.63 1p31 n ARG 168 Cb 0.33 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.23 1p31 n ARG 168 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1p31 s TYR 169 N -2.79 3.78 -0.09 -1.55 2.02 -1.26 0.59 117.35 118.05 1p31 s TYR 169 Ca 0.18 1.77 -0.00 0.00 -0.37 0.00 0.00 57.07 58.65 1p31 s TYR 169 Cb 0.19 -3.12 0.02 0.00 -0.40 0.00 0.00 41.96 38.65 1p31 s TYR 169 CO 0.58 -0.03 -0.05 -1.17 -1.57 0.00 0.00 175.55 173.32 1p31 s LEU 170 N -0.59 1.04 -0.22 -1.29 2.96 -0.31 -0.94 118.68 119.33 1p31 s LEU 170 Ca 0.46 -0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 54.11 1p31 s LEU 170 Cb -0.27 -0.66 -0.02 0.00 0.50 0.00 0.00 46.19 45.75 1p31 s LEU 170 CO 0.33 -0.12 0.01 -0.63 -1.32 0.00 0.00 176.35 174.62 1p31 s ILE 171 N 1.61 3.96 -0.02 6.68 -1.09 -0.07 0.39 121.20 132.64 1p31 s ILE 171 Ca 0.01 -0.30 -0.02 0.00 -2.23 0.00 0.00 60.65 58.11 1p31 s ILE 171 Cb -0.13 -2.81 0.01 0.00 -1.58 0.00 0.00 42.46 37.96 1p31 s ILE 171 CO -0.05 0.40 0.06 0.00 -1.23 0.00 0.00 174.94 174.12 1p31 s ALA 172 N 1.26 -0.10 0.18 9.38 0.00 -0.21 -0.62 121.76 131.64 1p31 s ALA 172 Ca 0.04 0.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.93 1p31 s ALA 172 Cb -0.15 -0.16 -0.09 0.00 0.00 0.00 0.00 23.12 22.73 1p31 s ALA 172 CO 0.01 -0.06 1.34 -2.00 0.00 0.00 0.00 175.76 175.05 1p31 s GLU 173 N 0.37 4.36 -0.34 0.00 2.12 -0.78 -0.68 118.70 123.75 1p31 s GLU 173 Ca -0.03 2.07 -0.00 0.00 0.36 0.00 0.00 54.97 57.37 1p31 s GLU 173 Cb -0.04 -3.21 0.08 0.00 0.26 0.00 0.00 34.13 31.23 1p31 s GLU 173 CO -0.01 -0.31 0.07 0.00 -0.54 0.00 0.00 175.26 174.46 1p31 s ALA 174 N 0.38 2.93 -0.06 6.30 0.00 0.61 -4.83 121.76 127.09 1p31 s ALA 174 Ca 0.59 -2.21 -0.30 0.00 0.00 0.00 0.00 51.96 50.04 1p31 s ALA 174 Cb -0.37 -2.07 -0.02 0.00 0.00 0.00 0.00 23.12 20.66 1p31 s ALA 174 CO 0.36 -1.55 0.99 0.34 0.00 0.00 0.00 175.76 175.91 1p31 s ASP 175 N 1.35 7.30 0.00 0.00 2.15 -1.26 -4.37 116.67 121.83 1p31 s ASP 175 Ca 0.03 1.59 0.23 0.00 0.43 0.00 0.00 52.55 54.83 1p31 s ASP 175 Cb -0.21 -2.56 0.14 0.00 -0.30 0.00 0.00 42.92 39.99 1p31 s ASP 175 CO -0.04 -0.36 1.18 -1.84 -0.17 0.00 0.00 175.17 173.94 1p31 n GLU 176 N 4.50 1.10 0.14 4.34 0.00 -1.26 -2.35 120.64 127.12 1p31 n GLU 176 Ca 0.07 -0.87 0.14 0.00 0.00 0.00 0.00 57.16 56.51 1p31 n GLU 176 Cb 0.50 -1.48 0.68 0.00 0.00 0.00 0.00 31.44 31.14 1p31 n GLU 176 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1p31 h SER 177 N 2.12 0.00 0.00 -1.84 4.64 -1.94 -1.27 113.55 115.27 1p31 h SER 177 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1p31 h SER 177 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1p31 h SER 177 CO 0.00 0.00 -0.05 -0.90 -0.87 0.00 0.00 176.83 175.01 1p31 n ASP 178 N -4.40 1.72 -0.37 4.97 5.68 -1.26 -4.69 116.55 118.20 1p31 n ASP 178 Ca 0.03 -2.31 -0.05 0.00 -0.50 0.00 0.00 54.79 51.96 1p31 n ASP 178 Cb 0.33 -0.18 -0.02 0.00 -1.14 0.00 0.00 41.12 40.11 1p31 n ASP 178 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1p31 n ALA 179 N -0.76 -0.07 0.50 2.12 0.00 -0.48 -4.88 120.51 116.95 1p31 n ALA 179 Ca 0.06 0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.71 1p31 n ALA 179 Cb 0.47 -1.51 0.45 0.00 0.00 0.00 0.00 19.45 18.86 1p31 n ALA 179 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1p31 n SER 180 N -0.95 0.77 0.24 0.00 3.41 -1.25 -2.77 113.62 113.06 1p31 n SER 180 Ca -0.05 0.63 0.15 0.00 -0.26 0.00 0.00 58.87 59.34 1p31 n SER 180 Cb 0.50 -0.81 0.81 0.00 -0.26 0.00 0.00 64.21 64.45 1p31 n SER 180 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1p31 h PHE 181 N 0.00 0.00 0.00 7.33 -0.00 -1.80 -2.05 116.94 120.42 1p31 h PHE 181 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1p31 h PHE 181 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.50 1p31 h PHE 181 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 178.31 178.24 1p31 h LEU 182 N 0.00 0.00 -1.18 2.10 3.38 -1.84 -0.77 115.31 117.00 1p31 h LEU 182 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1p31 h LEU 182 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1p31 h LEU 182 CO 0.00 0.00 -0.32 0.45 0.09 0.00 0.00 178.44 178.66 1p31 h HIS 183 N 0.00 0.00 -3.57 1.13 3.86 -1.64 -3.46 115.15 111.47 1p31 h HIS 183 Ca 0.00 0.00 -0.51 0.00 -1.16 0.00 0.00 60.37 58.70 1p31 h HIS 183 Cb 0.00 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.47 1p31 h HIS 183 CO 0.00 0.32 0.45 -0.51 0.86 0.00 0.00 177.93 179.05 1p31 s LEU 184 N -7.26 4.50 -0.68 2.43 1.43 -0.30 -4.79 118.68 114.01 1p31 s LEU 184 Ca -0.01 2.02 0.05 0.00 -1.03 0.00 0.00 54.13 55.16 1p31 s LEU 184 Cb 0.12 -3.60 0.16 0.00 0.03 0.00 0.00 46.19 42.90 1p31 s LEU 184 CO 0.67 -0.18 0.47 -1.10 0.23 0.00 0.00 176.35 176.44 1p31 s GLN 185 N -0.31 2.42 0.00 1.70 -1.52 -1.26 -4.87 119.66 115.82 1p31 s GLN 185 Ca 0.49 -3.24 0.00 0.00 -1.95 0.00 0.00 55.36 50.66 1p31 s GLN 185 Cb -0.28 -3.43 0.00 0.00 -0.22 0.00 0.00 33.01 29.08 1p31 s GLN 185 CO 0.34 -1.26 0.00 -2.30 -0.25 0.00 0.00 175.29 171.82 1p31 n PRO 186 N 2.15 3.43 -1.18 2.91 -0.02 -1.26 -4.76 135.00 136.28 1p31 n PRO 186 Ca 0.17 0.00 -0.46 0.00 -2.02 0.00 0.00 63.50 61.19 1p31 n PRO 186 Cb 0.35 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.76 1p31 n PRO 186 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1p31 n VAL 188 N 0.00 0.00 -4.52 -1.45 0.31 -0.73 -4.27 118.33 107.67 1p31 n VAL 188 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 1p31 n VAL 188 Cb 0.00 -0.03 -0.16 0.00 -0.91 0.00 0.00 33.84 32.74 1p31 n VAL 188 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1p31 s SER 189 N 0.16 2.94 -0.07 4.52 0.01 0.28 -0.75 113.70 120.80 1p31 s SER 189 Ca 0.71 -0.56 -0.15 0.00 1.31 0.00 0.00 55.95 57.26 1p31 s SER 189 Cb -1.00 -1.36 -0.05 0.00 0.21 0.00 0.00 66.02 63.83 1p31 s SER 189 CO 0.45 0.05 0.38 -0.69 0.41 0.00 0.00 173.24 173.85 1p31 s VAL 190 N 0.95 5.15 -0.21 3.43 1.01 0.55 -0.29 120.40 130.98 1p31 s VAL 190 Ca -0.05 0.77 0.01 0.00 0.00 0.00 0.00 61.98 62.71 1p31 s VAL 190 Cb -0.15 -3.70 0.05 0.00 0.00 0.00 0.00 36.38 32.58 1p31 s VAL 190 CO -0.04 0.48 -0.11 -0.69 0.00 0.00 0.00 175.10 174.75 1p31 s VAL 191 N -0.36 1.77 0.10 2.92 1.01 0.91 -0.40 120.40 126.35 1p31 s VAL 191 Ca 0.22 -1.16 -0.04 0.00 0.00 0.00 0.00 61.98 61.00 1p31 s VAL 191 Cb -0.15 -1.86 -0.24 0.00 0.00 0.00 0.00 36.38 34.13 1p31 s VAL 191 CO 0.10 0.12 1.21 0.71 0.00 0.00 0.00 175.10 177.24 1p31 h THR 192 N 6.47 1.47 0.00 3.92 1.35 -1.58 -2.63 112.91 121.91 1p31 h THR 192 Ca -0.26 -2.82 0.00 0.00 -0.55 0.00 0.00 66.41 62.77 1p31 h THR 192 Cb 1.09 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 70.24 1p31 h THR 192 CO 0.48 0.83 0.00 -0.46 -0.25 0.00 0.00 175.52 176.12 1p31 n ASN 193 N -3.61 0.00 0.00 5.36 0.23 -1.26 -4.41 115.26 111.56 1p31 n ASN 193 Ca -0.08 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.97 1p31 n ASN 193 Cb 0.95 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.65 1p31 n ASN 193 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1p31 n GLU 195 N 0.00 0.00 -1.65 -3.83 1.02 -1.26 -1.51 120.64 113.41 1p31 n GLU 195 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1p31 n GLU 195 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 1p31 n GLU 195 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1p31 s PRO 196 N -2.33 3.66 0.12 3.49 0.02 -1.26 -4.86 135.00 133.85 1p31 s PRO 196 Ca 0.00 2.33 -0.14 0.00 0.02 0.00 0.00 61.00 63.22 1p31 s PRO 196 Cb 0.00 -4.26 0.02 0.00 0.02 0.00 0.00 34.50 30.28 1p31 s PRO 196 CO 0.00 -1.50 0.34 0.34 -0.33 0.00 0.00 177.00 175.85 1p31 s ASP 197 N 6.24 -0.12 0.00 2.53 3.68 -1.26 -5.08 116.67 122.67 1p31 s ASP 197 Ca 0.94 -0.45 -0.01 0.00 2.13 0.00 0.00 52.55 55.16 1p31 s ASP 197 Cb -0.38 0.44 0.00 0.00 -1.45 0.00 0.00 42.92 41.53 1p31 s ASP 197 CO 0.38 -0.83 0.02 1.41 0.13 0.00 0.00 175.17 176.29 1p31 n HIS 198 N -0.18 -4.37 0.00 -5.34 8.25 -1.26 -4.98 115.22 107.34 1p31 n HIS 198 Ca -0.15 2.59 0.00 0.00 -0.26 0.00 0.00 57.72 59.90 1p31 n HIS 198 Cb 0.63 -3.58 0.00 0.00 1.12 0.00 0.00 29.99 28.16 1p31 n HIS 198 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1p31 n ASP 200 N 1.87 0.00 -0.03 0.41 8.00 -1.26 -3.90 116.55 121.64 1p31 n ASP 200 Ca -0.03 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.49 1p31 n ASP 200 Cb 0.05 0.00 0.37 0.00 -0.02 0.00 0.00 41.12 41.52 1p31 n ASP 200 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1p31 h THR 201 N 0.00 1.14 -0.48 -3.53 2.02 -1.94 -2.72 112.91 107.40 1p31 h THR 201 Ca 0.00 -0.35 -0.11 0.00 0.77 0.00 0.00 66.41 66.72 1p31 h THR 201 Cb 0.00 0.55 -0.06 0.00 -1.74 0.00 0.00 68.15 66.90 1p31 h THR 201 CO 0.00 0.15 0.09 -1.22 0.37 0.00 0.00 175.52 174.91 1p31 n TYR 202 N -4.42 1.62 -3.03 3.16 4.02 -1.25 -4.94 117.16 112.31 1p31 n TYR 202 Ca 0.03 -1.10 -0.21 0.00 -0.01 0.00 0.00 57.90 56.61 1p31 n TYR 202 Cb 0.10 -0.50 0.01 0.00 -0.02 0.00 0.00 39.34 38.93 1p31 n TYR 202 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1p31 n GLU 203 N -0.39 -3.73 -1.17 -0.72 4.71 -1.03 -0.76 120.64 117.57 1p31 n GLU 203 Ca 0.31 0.70 -0.06 0.00 -0.01 0.00 0.00 57.16 58.10 1p31 n GLU 203 Cb 1.13 -5.45 -0.02 0.00 -1.01 0.00 0.00 31.44 26.08 1p31 n GLU 203 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1p31 n GLY 204 N -1.25 0.72 3.17 0.62 0.00 -1.26 -4.96 105.19 102.23 1p31 n GLY 204 Ca -0.09 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 1p31 n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1p31 s ASP 205 N -2.39 5.12 0.52 1.61 -1.08 0.06 -4.97 116.67 115.54 1p31 s ASP 205 Ca 0.00 -1.53 0.20 0.00 -0.52 0.00 0.00 52.55 50.70 1p31 s ASP 205 Cb 0.00 -1.79 1.37 0.00 -1.46 0.00 0.00 42.92 41.04 1p31 s ASP 205 CO 0.00 -0.38 2.13 0.15 0.52 0.00 0.00 175.17 177.59 1p31 h PHE 206 N 8.06 0.00 0.00 -5.34 -0.00 -1.93 -1.50 116.94 116.23 1p31 h PHE 206 Ca -0.18 0.00 -0.10 0.00 -0.00 0.00 0.00 57.97 57.69 1p31 h PHE 206 Cb 1.06 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 37.00 1p31 h PHE 206 CO 0.59 0.06 -0.47 0.93 -0.00 0.00 0.00 178.31 179.42 1p31 h GLU 207 N 0.00 0.00 -1.34 1.11 4.39 -1.93 -1.04 114.58 115.77 1p31 h GLU 207 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1p31 h GLU 207 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1p31 h GLU 207 CO 0.01 0.47 0.00 1.63 -1.16 0.00 0.00 179.01 179.96 1p31 n LYS 208 N -3.90 0.43 0.00 2.33 5.02 -0.57 -1.06 118.16 120.41 1p31 n LYS 208 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1p31 n LYS 208 Cb 0.50 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1p31 n LYS 208 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1p31 n LYS 210 N 0.69 0.00 -0.14 1.97 5.02 -0.39 -1.24 118.16 124.07 1p31 n LYS 210 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1p31 n LYS 210 Cb 0.19 0.00 0.24 0.00 -0.02 0.00 0.00 35.03 35.45 1p31 n LYS 210 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p31 h ALA 211 N 0.00 1.36 -0.48 7.82 0.00 -1.37 -2.10 119.26 124.48 1p31 h ALA 211 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 1p31 h ALA 211 Cb 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1p31 h ALA 211 CO 0.00 0.49 -0.18 1.15 0.00 0.00 0.00 179.25 180.71 1p31 h THR 212 N 0.82 1.27 -0.60 0.00 2.02 -1.43 -0.53 112.91 114.46 1p31 h THR 212 Ca 0.20 -1.34 -0.06 0.00 0.77 0.00 0.00 66.41 65.98 1p31 h THR 212 Cb 0.12 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 1p31 h THR 212 CO -0.02 0.46 0.15 1.88 0.37 0.00 0.00 175.52 178.36 1p31 h TYR 213 N 0.83 0.95 -0.16 3.16 0.05 -1.77 0.08 116.97 120.12 1p31 h TYR 213 Ca 0.11 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 1p31 h TYR 213 Cb 0.76 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 38.21 1p31 h TYR 213 CO 0.05 0.79 0.07 0.28 -1.05 0.00 0.00 178.16 178.30 1p31 h VAL 214 N 0.89 1.14 -0.59 -2.88 2.07 -0.98 0.01 116.25 115.90 1p31 h VAL 214 Ca 0.19 -0.42 0.09 0.00 0.82 0.00 0.00 66.70 67.38 1p31 h VAL 214 Cb 0.31 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.14 1p31 h VAL 214 CO -0.00 0.13 0.22 0.11 0.02 0.00 0.00 177.57 178.05 1p31 h LYS 215 N 0.11 0.39 -0.31 1.57 1.57 -0.87 0.26 116.57 119.30 1p31 h LYS 215 Ca 0.05 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1p31 h LYS 215 Cb 0.15 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1p31 h LYS 215 CO -0.01 0.26 0.11 0.35 -0.57 0.00 0.00 179.45 179.59 1p31 h PHE 216 N 0.40 0.20 0.00 -1.35 3.04 -0.64 -2.22 116.94 116.36 1p31 h PHE 216 Ca 0.30 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.21 1p31 h PHE 216 Cb 0.36 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.82 1p31 h PHE 216 CO -0.17 0.09 -0.24 -0.07 -2.02 0.00 0.00 178.31 175.90 1p31 h LEU 217 N 0.25 0.00 0.00 0.59 3.38 -0.06 -1.21 115.31 118.25 1p31 h LEU 217 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1p31 h LEU 217 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1p31 h LEU 217 CO -0.14 0.24 0.00 1.41 0.09 0.00 0.00 178.44 180.04 1p31 n HIS 218 N -3.91 0.00 0.24 1.13 8.25 -0.01 -2.23 115.22 118.69 1p31 n HIS 218 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.58 1p31 n HIS 218 Cb 0.33 -0.43 0.42 0.00 1.12 0.00 0.00 29.99 31.43 1p31 n HIS 218 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 1p31 h ASN 219 N 0.00 0.00 -4.00 0.41 2.35 -1.08 -3.45 115.58 109.81 1p31 h ASN 219 Ca 0.00 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.20 1p31 h ASN 219 Cb 0.20 0.00 0.14 0.00 0.05 0.00 0.00 38.32 38.71 1p31 h ASN 219 CO 0.00 0.07 0.61 0.18 -1.65 0.00 0.00 177.43 176.64 1p31 n LEU 220 N -3.15 5.41 -4.62 1.61 4.77 -0.95 -4.56 117.00 115.52 1p31 n LEU 220 Ca 0.02 1.00 -0.30 0.00 -0.03 0.00 0.00 56.01 56.71 1p31 n LEU 220 Cb 0.44 -1.58 0.19 0.00 -2.33 0.00 0.00 43.42 40.14 1p31 n LEU 220 CO 0.31 -0.53 0.62 -2.16 -1.33 0.00 0.00 177.39 174.30 1p31 s PRO 221 N -2.80 0.37 0.53 3.23 0.04 -1.26 -4.82 135.00 130.29 1p31 s PRO 221 Ca 0.70 1.07 0.24 0.00 0.04 0.00 0.00 61.00 63.05 1p31 s PRO 221 Cb -0.42 -1.69 1.39 0.00 0.04 0.00 0.00 34.50 33.82 1p31 s PRO 221 CO 0.51 -2.92 2.02 0.27 0.04 0.00 0.00 177.00 176.92 1p31 h PHE 222 N -2.06 0.00 -0.13 0.56 -0.00 -1.94 0.97 116.94 114.35 1p31 h PHE 222 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.45 1p31 h PHE 222 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.25 1p31 h PHE 222 CO 0.39 0.00 0.00 2.48 -0.00 0.00 0.00 178.31 181.18 1p31 n TYR 223 N -4.36 0.15 -1.26 6.09 4.11 -1.26 -4.67 117.16 115.96 1p31 n TYR 223 Ca 0.07 -0.07 -0.29 0.00 -0.00 0.00 0.00 57.90 57.61 1p31 n TYR 223 Cb 0.51 0.00 0.15 0.00 -0.00 0.00 0.00 39.34 40.00 1p31 n TYR 223 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.86 177.06 1p31 s GLY 224 N -1.80 1.59 -0.07 -7.48 0.00 0.33 -4.93 107.32 94.96 1p31 s GLY 224 Ca 0.34 -0.24 0.04 0.00 0.00 0.00 0.00 44.72 44.87 1p31 s GLY 224 CO 0.30 0.30 -0.20 -2.27 0.00 0.00 0.00 173.10 171.24 1p31 s LEU 225 N -6.25 1.95 -0.18 0.66 2.96 -1.26 -3.76 118.68 112.80 1p31 s LEU 225 Ca 0.64 -0.44 -0.05 0.00 -0.22 0.00 0.00 54.13 54.05 1p31 s LEU 225 Cb -0.18 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.31 1p31 s LEU 225 CO 0.57 0.15 -0.00 0.00 -1.32 0.00 0.00 176.35 175.74 1p31 s ALA 226 N 0.23 3.11 0.06 5.97 0.00 -0.39 -0.55 121.76 130.18 1p31 s ALA 226 Ca -0.11 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.05 1p31 s ALA 226 Cb -0.15 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 1p31 s ALA 226 CO 0.05 0.08 -0.12 0.08 0.00 0.00 0.00 175.76 175.85 1p31 s VAL 227 N 0.58 3.24 -0.21 0.00 1.01 0.60 -0.64 120.40 124.99 1p31 s VAL 227 Ca -0.01 -1.14 -0.02 0.00 0.00 0.00 0.00 61.98 60.81 1p31 s VAL 227 Cb -0.14 -2.45 0.00 0.00 0.00 0.00 0.00 36.38 33.79 1p31 s VAL 227 CO 0.02 0.24 -0.10 0.00 0.00 0.00 0.00 175.10 175.27 1p31 h ALA 230 N 8.04 1.00 -0.01 0.00 0.00 -0.09 -2.86 119.26 125.35 1p31 h ALA 230 Ca -0.43 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1p31 h ALA 230 Cb 1.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1p31 h ALA 230 CO 0.61 0.00 -0.10 -0.25 0.00 0.00 0.00 179.25 179.52 1p31 n ASP 231 N -3.10 0.84 -4.43 0.00 8.00 -1.26 -4.71 116.55 111.90 1p31 n ASP 231 Ca -0.00 -0.97 -0.42 0.00 0.71 0.00 0.00 54.79 54.11 1p31 n ASP 231 Cb 0.26 0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.26 1p31 n ASP 231 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1p31 s ASP 232 N -2.29 5.99 0.45 -2.24 -1.08 -1.08 -4.97 116.67 111.44 1p31 s ASP 232 Ca 0.33 -0.95 0.11 0.00 -0.52 0.00 0.00 52.55 51.52 1p31 s ASP 232 Cb 0.20 -2.11 1.00 0.00 -1.46 0.00 0.00 42.92 40.55 1p31 s ASP 232 CO 0.43 -0.44 2.06 1.55 0.52 0.00 0.00 175.17 179.29 1p31 h PRO 233 N 8.57 0.24 -0.12 4.34 0.13 -1.88 -2.59 132.00 140.70 1p31 h PRO 233 Ca -0.26 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.82 1p31 h PRO 233 Cb 1.11 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 1p31 h PRO 233 CO 0.71 0.22 -0.02 0.28 -0.23 0.00 0.00 178.00 178.97 1p31 h VAL 234 N 0.25 1.27 0.00 1.56 2.07 -1.95 -1.29 116.25 118.15 1p31 h VAL 234 Ca 0.06 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1p31 h VAL 234 Cb 0.08 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1p31 h VAL 234 CO -0.01 0.26 0.00 0.18 0.02 0.00 0.00 177.57 178.03 1p31 n LEU 235 N -4.76 0.00 0.00 2.57 4.77 -0.98 -1.75 117.00 116.85 1p31 n LEU 235 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1p31 n LEU 235 Cb 0.23 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1p31 n LEU 235 CO 0.36 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.63 1p31 n GLU 237 N 0.58 0.00 0.09 3.23 2.13 -0.49 -2.05 120.64 124.13 1p31 n GLU 237 Ca 0.00 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.94 1p31 n GLU 237 Cb 0.00 0.00 0.25 0.00 0.27 0.00 0.00 31.44 31.96 1p31 n GLU 237 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1p31 h LEU 238 N 0.00 0.00 -0.70 4.31 3.38 -1.61 -3.39 115.31 117.29 1p31 h LEU 238 Ca 0.00 -0.11 0.14 0.00 0.09 0.00 0.00 57.88 58.00 1p31 h LEU 238 Cb 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.65 1p31 h LEU 238 CO 0.00 0.05 0.19 0.58 0.09 0.00 0.00 178.44 179.35 1p31 h VAL 239 N 0.00 0.58 -0.00 1.22 2.07 -1.70 0.10 116.25 118.52 1p31 h VAL 239 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1p31 h VAL 239 Cb 0.77 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1p31 h VAL 239 CO 0.00 0.05 0.01 -0.65 0.02 0.00 0.00 177.57 177.01 1p31 h PRO 240 N 0.30 0.00 -0.00 1.57 0.11 -1.91 -2.28 132.00 129.79 1p31 h PRO 240 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1p31 h PRO 240 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 1p31 h PRO 240 CO -0.46 0.00 -0.45 1.63 -0.21 0.00 0.00 178.00 178.51 1p31 n LYS 241 N -3.09 0.05 -0.03 1.05 5.02 0.36 -4.50 118.16 117.01 1p31 n LYS 241 Ca -0.03 -0.03 -0.14 0.00 -2.02 0.00 0.00 58.31 56.09 1p31 n LYS 241 Cb 0.08 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.48 1p31 n LYS 241 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1p31 h VAL 242 N 0.06 1.52 -0.72 -0.18 2.07 -1.38 -3.48 116.25 114.15 1p31 h VAL 242 Ca 0.00 -1.69 -0.17 0.00 0.82 0.00 0.00 66.70 65.66 1p31 h VAL 242 Cb 0.50 2.59 -0.04 0.00 -1.52 0.00 0.00 31.29 32.81 1p31 h VAL 242 CO 0.00 0.46 -0.18 0.61 0.02 0.00 0.00 177.57 178.47 1p31 n GLY 243 N 0.79 0.64 3.13 2.17 0.00 -1.26 -4.69 105.19 105.96 1p31 n GLY 243 Ca -0.09 -0.61 -0.08 0.00 0.00 0.00 0.00 46.02 45.24 1p31 n GLY 243 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p31 s ARG 244 N -3.38 0.73 0.15 1.61 1.81 -1.26 -4.99 118.95 113.61 1p31 s ARG 244 Ca 0.00 -1.23 -0.34 0.00 -1.72 0.00 0.00 55.73 52.44 1p31 s ARG 244 Cb 0.00 0.24 -0.13 0.00 -0.45 0.00 0.00 34.95 34.61 1p31 s ARG 244 CO 0.00 -0.17 1.62 0.94 -0.68 0.00 0.00 175.30 177.00 1p31 n GLN 245 N 0.03 2.22 -4.51 3.54 7.27 -1.25 -4.85 117.38 119.83 1p31 n GLN 245 Ca -0.12 0.80 -0.33 0.00 0.07 0.00 0.00 57.00 57.42 1p31 n GLN 245 Cb 0.62 -2.59 -0.14 0.00 2.41 0.00 0.00 30.24 30.54 1p31 n GLN 245 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1p31 s VAL 246 N 1.21 3.01 -0.13 1.69 1.01 -1.26 -1.26 120.40 124.67 1p31 s VAL 246 Ca 0.80 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1p31 s VAL 246 Cb -0.66 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1p31 s VAL 246 CO 0.38 0.50 -0.08 -0.63 0.00 0.00 0.00 175.10 175.28 1p31 s ILE 247 N 0.71 3.55 0.27 2.22 -1.09 0.18 -4.98 121.20 122.05 1p31 s ILE 247 Ca -0.06 -0.49 0.08 0.00 -2.23 0.00 0.00 60.65 57.96 1p31 s ILE 247 Cb -0.15 -2.52 -0.04 0.00 -1.58 0.00 0.00 42.46 38.17 1p31 s ILE 247 CO 0.02 0.52 0.09 0.42 -1.23 0.00 0.00 174.94 174.76 1p31 s THR 248 N 0.18 3.82 0.01 2.92 -4.23 -1.26 -4.11 115.64 112.97 1p31 s THR 248 Ca -0.04 -1.69 -0.08 0.00 -1.18 0.00 0.00 61.69 58.69 1p31 s THR 248 Cb -0.14 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.62 1p31 s THR 248 CO 0.04 -0.35 0.16 -0.72 -0.54 0.00 0.00 174.62 173.20 1p31 s TYR 249 N -2.26 0.05 -5.00 3.99 1.13 -1.26 -0.86 117.35 113.15 1p31 s TYR 249 Ca 0.32 -0.19 0.00 0.00 -1.41 0.00 0.00 57.07 55.79 1p31 s TYR 249 Cb -0.07 -0.05 0.00 0.00 -1.10 0.00 0.00 41.96 40.74 1p31 s TYR 249 CO 0.22 -0.34 0.00 0.41 -2.51 0.00 0.00 175.55 173.33 1p31 n GLY 250 N 1.17 -0.30 0.12 5.49 0.00 -0.76 0.69 105.19 111.59 1p31 n GLY 250 Ca -0.21 -1.49 0.12 0.00 0.00 0.00 0.00 46.02 44.44 1p31 n GLY 250 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1p31 h PHE 251 N 0.00 0.00 -2.47 1.61 0.04 -1.88 0.14 116.94 114.37 1p31 h PHE 251 Ca 0.00 0.00 -0.61 0.00 2.80 0.00 0.00 57.97 60.16 1p31 h PHE 251 Cb 0.00 0.00 0.09 0.00 2.20 0.00 0.00 35.95 38.24 1p31 h PHE 251 CO 0.00 0.00 0.37 0.45 -0.60 0.00 0.00 178.31 178.53 1p31 n SER 252 N -2.42 1.94 0.31 2.17 2.88 -1.26 -4.74 113.62 112.49 1p31 n SER 252 Ca 0.04 1.16 0.18 0.00 -1.33 0.00 0.00 58.87 58.92 1p31 n SER 252 Cb 0.47 -1.33 1.02 0.00 -0.75 0.00 0.00 64.21 63.61 1p31 n SER 252 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1p31 h GLU 253 N 3.17 0.00 -0.01 -1.46 4.57 -1.97 -1.94 114.58 116.94 1p31 h GLU 253 Ca -0.43 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 1p31 h GLU 253 Cb 1.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 1p31 h GLU 253 CO 0.68 0.00 -0.06 1.04 -1.18 0.00 0.00 179.01 179.49 1p31 n GLN 254 N -3.56 1.51 -2.05 1.92 3.00 -1.26 -4.95 117.38 111.99 1p31 n GLN 254 Ca -0.03 -0.90 -0.41 0.00 -0.01 0.00 0.00 57.00 55.65 1p31 n GLN 254 Cb 0.10 -1.48 -0.02 0.00 0.00 0.00 0.00 30.24 28.84 1p31 n GLN 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p31 s ALA 255 N -2.11 3.52 0.09 -1.58 0.00 -0.73 -4.94 121.76 116.00 1p31 s ALA 255 Ca 0.34 1.32 -0.19 0.00 0.00 0.00 0.00 51.96 53.44 1p31 s ALA 255 Cb 0.21 -3.51 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 1p31 s ALA 255 CO 0.38 -0.72 1.56 -0.44 0.00 0.00 0.00 175.76 176.53 1p31 h ASP 256 N 3.48 0.38 -3.39 0.00 3.32 -1.76 -3.35 116.42 115.10 1p31 h ASP 256 Ca -0.49 -0.26 -0.72 0.00 0.02 0.00 0.00 57.03 55.58 1p31 h ASP 256 Cb 1.23 -0.10 -0.29 0.00 0.22 0.00 0.00 39.33 40.39 1p31 h ASP 256 CO 0.66 0.54 -0.44 -0.31 -1.72 0.00 0.00 179.24 177.97 1p31 s TYR 257 N -5.18 3.38 -0.18 4.55 2.02 -0.04 -1.94 117.35 119.97 1p31 s TYR 257 Ca -0.14 -1.71 -0.09 0.00 -0.37 0.00 0.00 57.07 54.77 1p31 s TYR 257 Cb 0.07 -3.18 -0.05 0.00 -0.40 0.00 0.00 41.96 38.41 1p31 s TYR 257 CO 0.73 -0.91 0.11 0.50 -1.57 0.00 0.00 175.55 174.41 1p31 s ARG 258 N 1.39 3.98 -0.12 -0.62 3.52 0.08 -1.83 118.95 125.35 1p31 s ARG 258 Ca 0.04 -0.24 -0.18 0.00 -0.13 0.00 0.00 55.73 55.22 1p31 s ARG 258 Cb -0.24 -3.31 -0.04 0.00 -1.56 0.00 0.00 34.95 29.79 1p31 s ARG 258 CO 0.01 0.39 0.47 0.42 -0.81 0.00 0.00 175.30 175.77 1p31 s ILE 259 N 0.09 5.19 0.10 4.11 1.01 0.48 0.22 121.20 132.40 1p31 s ILE 259 Ca 0.08 0.94 0.05 0.00 0.00 0.00 0.00 60.65 61.72 1p31 s ILE 259 Cb -0.11 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1p31 s ILE 259 CO -0.00 0.33 -0.12 -1.61 0.00 0.00 0.00 174.94 173.54 1p31 s GLU 260 N 0.57 0.90 -1.29 2.79 2.02 0.15 -4.56 118.70 119.28 1p31 s GLU 260 Ca 0.26 -1.16 -0.08 0.00 0.02 0.00 0.00 54.97 54.01 1p31 s GLU 260 Cb -0.15 -0.69 0.01 0.00 0.10 0.00 0.00 34.13 33.40 1p31 s GLU 260 CO 0.10 0.12 1.12 -0.25 0.02 0.00 0.00 175.26 176.38 1p31 n ASP 261 N 0.64 -5.92 -4.72 -0.19 8.00 -1.26 -0.87 116.55 112.23 1p31 n ASP 261 Ca -0.16 -0.52 -0.42 0.00 0.71 0.00 0.00 54.79 54.39 1p31 n ASP 261 Cb 0.57 -4.84 -0.03 0.00 -0.02 0.00 0.00 41.12 36.80 1p31 n ASP 261 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1p31 s TYR 262 N -3.31 3.23 -0.01 1.24 6.14 -1.26 -4.35 117.35 119.03 1p31 s TYR 262 Ca 0.52 0.94 0.01 0.00 0.64 0.00 0.00 57.07 59.18 1p31 s TYR 262 Cb -0.23 -3.70 0.00 0.00 0.42 0.00 0.00 41.96 38.46 1p31 s TYR 262 CO 0.70 -2.44 -0.03 -2.00 0.64 0.00 0.00 175.55 172.41 1p31 s GLU 263 N 1.06 0.35 -0.22 4.97 2.12 0.26 -5.00 118.70 122.23 1p31 s GLU 263 Ca 0.65 -0.09 -0.09 0.00 0.36 0.00 0.00 54.97 55.79 1p31 s GLU 263 Cb -0.37 -0.37 -0.04 0.00 0.26 0.00 0.00 34.13 33.60 1p31 s GLU 263 CO 0.31 0.03 0.12 -1.14 -0.54 0.00 0.00 175.26 174.03 1p31 s GLN 264 N 0.20 3.98 -0.21 4.30 0.74 -1.26 -0.61 119.66 126.80 1p31 s GLN 264 Ca -0.02 -0.32 0.02 0.00 0.05 0.00 0.00 55.36 55.08 1p31 s GLN 264 Cb -0.05 -3.41 0.04 0.00 1.10 0.00 0.00 33.01 30.69 1p31 s GLN 264 CO -0.00 0.09 -0.15 0.99 -0.55 0.00 0.00 175.29 175.66 1p31 s THR 265 N 0.93 2.00 0.00 -0.34 2.01 -0.21 -4.94 115.64 115.10 1p31 s THR 265 Ca 0.06 -1.15 0.00 0.00 0.31 0.00 0.00 61.69 60.90 1p31 s THR 265 Cb -0.13 -1.95 0.00 0.00 0.01 0.00 0.00 72.50 70.43 1p31 s THR 265 CO 0.03 0.29 0.00 0.61 -0.69 0.00 0.00 174.62 174.86 1p31 n GLY 266 N 4.58 4.15 0.96 4.40 0.00 -1.26 -1.59 105.19 116.42 1p31 n GLY 266 Ca -0.17 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.91 1p31 n GLY 266 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1p31 n PHE 267 N 13.87 0.69 -4.47 1.61 3.01 -1.26 -4.00 117.46 126.90 1p31 n PHE 267 Ca 0.00 -1.65 -0.31 0.00 1.01 0.00 0.00 57.45 56.50 1p31 n PHE 267 Cb 0.00 -0.34 -0.11 0.00 -0.01 0.00 0.00 39.48 39.02 1p31 n PHE 267 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1p31 s GLN 268 N -3.30 2.26 -0.03 -1.08 -0.21 -0.62 -1.93 119.66 114.75 1p31 s GLN 268 Ca 0.42 -0.90 -0.05 0.00 0.02 0.00 0.00 55.36 54.85 1p31 s GLN 268 Cb 0.39 -2.33 -0.04 0.00 1.00 0.00 0.00 33.01 32.02 1p31 s GLN 268 CO -0.04 0.55 0.21 0.20 -2.12 0.00 0.00 175.29 174.09 1p31 s GLY 269 N -1.63 2.21 -0.07 3.09 0.00 0.48 -1.04 107.32 110.35 1p31 s GLY 269 Ca 0.17 -0.66 0.01 0.00 0.00 0.00 0.00 44.72 44.25 1p31 s GLY 269 CO 0.08 -0.48 -0.08 0.30 0.00 0.00 0.00 173.10 172.93 1p31 s HIS 270 N -1.24 1.18 0.27 1.90 0.09 0.22 -0.38 115.29 117.32 1p31 s HIS 270 Ca 0.25 -0.45 -0.20 0.00 -0.00 0.00 0.00 55.06 54.65 1p31 s HIS 270 Cb -0.13 -0.96 0.05 0.00 -0.00 0.00 0.00 32.58 31.54 1p31 s HIS 270 CO 0.14 -0.31 0.83 1.52 -0.00 0.00 0.00 174.74 176.92 1p31 s TYR 271 N 1.10 -0.06 -0.04 1.40 1.13 -0.75 -0.57 117.35 119.57 1p31 s TYR 271 Ca -0.07 -0.42 0.06 0.00 -1.41 0.00 0.00 57.07 55.23 1p31 s TYR 271 Cb -0.14 0.73 -0.02 0.00 -1.10 0.00 0.00 41.96 41.43 1p31 s TYR 271 CO -0.01 -1.21 -0.23 0.99 -2.51 0.00 0.00 175.55 172.58 1p31 s THR 272 N -3.13 2.33 -0.16 -3.49 2.01 -0.05 0.16 115.64 113.31 1p31 s THR 272 Ca 0.14 -0.99 -0.03 0.00 0.31 0.00 0.00 61.69 61.11 1p31 s THR 272 Cb -0.04 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 1p31 s THR 272 CO 0.07 0.58 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.84 1p31 s VAL 273 N -0.51 3.71 -0.29 3.82 1.01 0.49 0.31 120.40 128.94 1p31 s VAL 273 Ca 0.07 -0.42 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 1p31 s VAL 273 Cb -0.11 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1p31 s VAL 273 CO 0.01 0.49 0.17 -0.63 0.00 0.00 0.00 175.10 175.13 1p31 s ILE 274 N 0.49 4.98 0.72 2.22 -1.09 0.13 -1.35 121.20 127.30 1p31 s ILE 274 Ca -0.04 -0.07 -0.11 0.00 -2.23 0.00 0.00 60.65 58.20 1p31 s ILE 274 Cb -0.15 -3.43 0.03 0.00 -1.58 0.00 0.00 42.46 37.34 1p31 s ILE 274 CO 0.03 0.19 1.10 0.00 -1.23 0.00 0.00 174.94 175.03 1p31 h PRO 276 N -0.72 0.28 -0.63 0.00 0.11 -1.72 0.07 132.00 129.39 1p31 h PRO 276 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1p31 h PRO 276 Cb 1.28 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1p31 h PRO 276 CO 0.64 0.18 0.00 0.27 -0.21 0.00 0.00 178.00 178.88 1p31 n ASN 277 N -4.44 3.78 -0.01 -2.05 6.94 -1.26 -4.91 115.26 113.31 1p31 n ASN 277 Ca 0.15 -2.39 -0.00 0.00 -0.02 0.00 0.00 54.58 52.32 1p31 n ASN 277 Cb 0.63 -0.52 -0.00 0.00 -2.36 0.00 0.00 39.78 37.53 1p31 n ASN 277 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1p31 n ASN 278 N 0.71 -4.06 -4.71 0.53 5.15 0.01 -5.00 115.26 107.89 1p31 n ASN 278 Ca 0.19 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.75 1p31 n ASN 278 Cb 0.73 -1.57 -0.03 0.00 -0.53 0.00 0.00 39.78 38.39 1p31 n ASN 278 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1p31 s GLU 279 N -0.74 4.14 -0.21 1.20 2.12 -1.26 -4.72 118.70 119.23 1p31 s GLU 279 Ca 0.00 2.58 -0.09 0.00 0.36 0.00 0.00 54.97 57.82 1p31 s GLU 279 Cb 0.00 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 1p31 s GLU 279 CO 0.00 -0.77 0.11 1.03 -0.54 0.00 0.00 175.26 175.09 1p31 s ARG 280 N 1.72 4.00 -0.15 4.30 0.52 -1.26 -0.78 118.95 127.29 1p31 s ARG 280 Ca 0.76 -0.32 0.01 0.00 -0.52 0.00 0.00 55.73 55.66 1p31 s ARG 280 Cb -0.48 -3.37 0.02 0.00 0.52 0.00 0.00 34.95 31.65 1p31 s ARG 280 CO 0.33 0.15 -0.16 0.42 0.02 0.00 0.00 175.30 176.06 1p31 s ILE 281 N 0.76 1.69 -0.25 1.52 1.01 -0.46 -4.99 121.20 120.47 1p31 s ILE 281 Ca 0.05 -0.71 -0.20 0.00 0.00 0.00 0.00 60.65 59.79 1p31 s ILE 281 Cb -0.13 -1.56 -0.02 0.00 0.01 0.00 0.00 42.46 40.76 1p31 s ILE 281 CO 0.02 0.48 0.61 0.20 0.00 0.00 0.00 174.94 176.25 1p31 s ASN 282 N 1.37 6.56 -0.11 3.58 0.02 -1.26 -0.38 114.94 124.72 1p31 s ASN 282 Ca 0.03 0.69 -0.01 0.00 -1.02 0.00 0.00 52.86 52.55 1p31 s ASN 282 Cb -0.13 -2.33 -0.03 0.00 0.02 0.00 0.00 41.25 38.78 1p31 s ASN 282 CO -0.10 -0.36 -0.06 -0.69 0.02 0.00 0.00 177.10 175.91 1p31 s VAL 283 N 2.48 3.70 -0.24 1.60 1.01 0.12 -5.01 120.40 124.06 1p31 s VAL 283 Ca 0.26 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1p31 s VAL 283 Cb -0.16 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.64 1p31 s VAL 283 CO 0.09 0.54 0.05 -0.22 0.00 0.00 0.00 175.10 175.55 1p31 s LEU 284 N -0.14 3.33 -0.17 3.92 0.20 -1.26 -1.80 118.68 122.75 1p31 s LEU 284 Ca 0.02 -0.26 -0.01 0.00 0.69 0.00 0.00 54.13 54.56 1p31 s LEU 284 Cb -0.13 -1.88 -0.01 0.00 -0.43 0.00 0.00 46.19 43.74 1p31 s LEU 284 CO 0.03 -0.04 -0.12 -0.22 -0.29 0.00 0.00 176.35 175.72 1p31 s LEU 285 N 1.58 2.66 -0.03 -0.68 2.96 0.49 -2.50 118.68 123.17 1p31 s LEU 285 Ca 0.06 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.58 1p31 s LEU 285 Cb -0.15 -1.63 0.10 0.00 0.50 0.00 0.00 46.19 45.01 1p31 s LEU 285 CO 0.02 0.07 0.67 -3.20 -1.32 0.00 0.00 176.35 172.60 1p31 n ASN 286 N 4.14 1.49 -4.02 3.68 5.15 -0.67 -0.39 115.26 124.63 1p31 n ASN 286 Ca -0.19 -2.10 -0.12 0.00 -0.60 0.00 0.00 54.58 51.58 1p31 n ASN 286 Cb 0.52 -0.49 -0.11 0.00 -0.53 0.00 0.00 39.78 39.16 1p31 n ASN 286 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1p31 s VAL 287 N -1.25 0.36 0.60 3.44 -7.23 -1.24 -4.81 120.40 110.27 1p31 s VAL 287 Ca 0.06 -0.97 -0.08 0.00 -1.81 0.00 0.00 61.98 59.18 1p31 s VAL 287 Cb 0.05 -0.46 -0.01 0.00 0.56 0.00 0.00 36.38 36.52 1p31 s VAL 287 CO 0.02 -0.41 0.95 -2.16 -0.31 0.00 0.00 175.10 173.19 1p31 s PRO 288 N -1.46 3.19 0.00 4.82 0.04 -0.81 -3.32 135.00 137.45 1p31 s PRO 288 Ca -0.12 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.23 1p31 s PRO 288 Cb -0.10 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1p31 s PRO 288 CO -0.00 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.81 1p31 n GLY 289 N -2.64 0.91 0.27 0.56 0.00 -1.26 -4.21 105.19 98.81 1p31 n GLY 289 Ca 0.04 -1.56 0.02 0.00 0.00 0.00 0.00 46.02 44.53 1p31 n GLY 289 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p31 h LYS 290 N 0.00 0.39 -0.55 1.61 1.57 -1.95 -2.21 116.57 115.44 1p31 h LYS 290 Ca 0.00 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1p31 h LYS 290 Cb 0.00 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1p31 h LYS 290 CO 0.00 0.42 0.24 1.12 -0.57 0.00 0.00 179.45 180.66 1p31 h HIS 291 N 0.38 0.77 0.00 -1.35 2.07 -1.94 -0.59 115.15 114.50 1p31 h HIS 291 Ca 0.09 -0.03 -0.18 0.00 -2.85 0.00 0.00 60.37 57.40 1p31 h HIS 291 Cb 0.25 -0.24 -0.02 0.00 2.57 0.00 0.00 27.41 29.97 1p31 h HIS 291 CO 0.01 0.59 -0.83 -0.91 -3.07 0.00 0.00 177.93 173.71 1p31 h ASN 292 N 0.77 0.05 -0.93 3.10 2.35 -1.62 -1.79 115.58 117.51 1p31 h ASN 292 Ca 0.19 -0.04 0.06 0.00 -0.55 0.00 0.00 56.30 55.96 1p31 h ASN 292 Cb 0.12 -0.01 -0.06 0.00 0.05 0.00 0.00 38.32 38.42 1p31 h ASN 292 CO -0.02 0.85 0.59 0.00 -1.65 0.00 0.00 177.43 177.20 1p31 h ALA 293 N 1.14 1.27 -0.02 -0.83 0.00 -0.82 0.11 119.26 120.13 1p31 h ALA 293 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1p31 h ALA 293 Cb 1.46 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1p31 h ALA 293 CO 0.11 0.38 0.01 -0.07 0.00 0.00 0.00 179.25 179.68 1p31 h LEU 294 N 1.09 0.02 -0.64 0.00 3.38 -0.87 -0.62 115.31 117.67 1p31 h LEU 294 Ca 0.40 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.28 1p31 h LEU 294 Cb 0.13 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 1p31 h LEU 294 CO -0.16 0.15 0.38 0.78 0.09 0.00 0.00 178.44 179.67 1p31 h ASN 295 N -0.11 0.59 0.73 -0.43 2.35 -1.09 -0.77 115.58 116.85 1p31 h ASN 295 Ca 0.01 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.74 1p31 h ASN 295 Cb 0.13 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 1p31 h ASN 295 CO -0.00 0.39 -0.13 0.00 -1.65 0.00 0.00 177.43 176.04 1p31 h ALA 296 N 1.31 1.09 0.01 -0.83 0.00 -0.64 -1.75 119.26 118.44 1p31 h ALA 296 Ca 0.27 -0.12 -0.27 0.00 0.00 0.00 0.00 54.91 54.79 1p31 h ALA 296 Cb 0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1p31 h ALA 296 CO -0.14 0.17 -1.48 1.15 0.00 0.00 0.00 179.25 178.94 1p31 h THR 297 N 0.00 1.13 -0.40 0.00 2.02 -0.22 0.09 112.91 115.52 1p31 h THR 297 Ca -0.00 -2.93 0.01 0.00 0.77 0.00 0.00 66.41 64.26 1p31 h THR 297 Cb 0.54 2.57 -0.02 0.00 -1.74 0.00 0.00 68.15 69.49 1p31 h THR 297 CO 0.02 0.66 0.24 0.00 0.37 0.00 0.00 175.52 176.81 1p31 h ALA 298 N 0.97 0.51 -0.20 6.16 0.00 -0.96 0.41 119.26 126.15 1p31 h ALA 298 Ca -0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1p31 h ALA 298 Cb 1.94 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1p31 h ALA 298 CO 0.10 -0.08 0.12 0.00 0.00 0.00 0.00 179.25 179.38 1p31 h ALA 299 N 1.17 0.26 -0.56 0.00 0.00 -1.27 -1.08 119.26 117.78 1p31 h ALA 299 Ca 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1p31 h ALA 299 Cb -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1p31 h ALA 299 CO -0.06 -0.22 0.24 1.25 0.00 0.00 0.00 179.25 180.46 1p31 h LEU 300 N 0.23 0.76 -0.34 0.00 6.46 -0.86 -1.42 115.31 120.14 1p31 h LEU 300 Ca 0.07 -0.16 -0.00 0.00 -0.12 0.00 0.00 57.88 57.67 1p31 h LEU 300 Cb 0.05 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 39.77 1p31 h LEU 300 CO -0.01 0.71 0.21 0.00 -0.62 0.00 0.00 178.44 178.72 1p31 h ALA 301 N 1.08 0.44 -0.08 1.25 0.00 -0.67 0.30 119.26 121.58 1p31 h ALA 301 Ca 0.19 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1p31 h ALA 301 Cb 0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1p31 h ALA 301 CO -0.02 -0.06 -0.03 0.28 0.00 0.00 0.00 179.25 179.42 1p31 h VAL 302 N 0.44 0.90 -0.50 0.00 2.07 -0.97 0.25 116.25 118.45 1p31 h VAL 302 Ca 0.12 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.64 1p31 h VAL 302 Cb 0.01 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1p31 h VAL 302 CO -0.02 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.87 1p31 h ALA 303 N 1.07 0.63 -0.64 1.67 0.00 -0.89 -1.10 119.26 120.00 1p31 h ALA 303 Ca 0.04 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1p31 h ALA 303 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1p31 h ALA 303 CO -0.09 0.12 0.14 0.87 0.00 0.00 0.00 179.25 180.29 1p31 h LYS 304 N 0.66 1.02 0.00 0.00 1.79 -0.18 -0.72 116.57 119.14 1p31 h LYS 304 Ca 0.18 -0.24 -0.08 0.00 -2.18 0.00 0.00 60.65 58.33 1p31 h LYS 304 Cb -0.01 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.50 1p31 h LYS 304 CO -0.03 0.91 -0.37 0.93 -1.08 0.00 0.00 179.45 179.81 1p31 h GLU 305 N 0.96 0.00 0.00 3.15 4.39 -0.65 -2.07 114.58 120.36 1p31 h GLU 305 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1p31 h GLU 305 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1p31 h GLU 305 CO 0.00 0.37 0.00 1.49 -1.16 0.00 0.00 179.01 179.71 1p31 h GLU 306 N 0.00 0.00 0.00 2.33 4.57 -0.60 -3.47 114.58 117.41 1p31 h GLU 306 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1p31 h GLU 306 Cb 0.72 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 1p31 h GLU 306 CO 0.05 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 178.29 1p31 n GLY 307 N 0.91 0.86 3.75 1.92 0.00 -0.61 -5.07 105.19 106.96 1p31 n GLY 307 Ca 0.04 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1p31 n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p31 s ILE 308 N -2.00 3.23 0.53 -0.61 1.01 -0.38 -4.99 121.20 117.99 1p31 s ILE 308 Ca 0.00 1.16 -0.21 0.00 0.00 0.00 0.00 60.65 61.60 1p31 s ILE 308 Cb 0.00 -3.74 -0.05 0.00 0.01 0.00 0.00 42.46 38.68 1p31 s ILE 308 CO 0.00 0.24 1.22 0.00 0.00 0.00 0.00 174.94 176.41 1p31 s ALA 309 N -0.76 2.78 0.24 9.38 0.00 -1.26 -4.56 121.76 127.58 1p31 s ALA 309 Ca 0.49 1.05 -0.05 0.00 0.00 0.00 0.00 51.96 53.45 1p31 s ALA 309 Cb -0.35 -3.45 0.36 0.00 0.00 0.00 0.00 23.12 19.68 1p31 s ALA 309 CO 0.43 -1.00 1.82 -0.91 0.00 0.00 0.00 175.76 176.10 1p31 h ASN 310 N 1.48 0.69 -0.72 0.00 2.35 -1.99 -2.68 115.58 114.71 1p31 h ASN 310 Ca -0.50 0.04 0.14 0.00 -0.55 0.00 0.00 56.30 55.43 1p31 h ASN 310 Cb 1.28 -0.10 -0.10 0.00 0.05 0.00 0.00 38.32 39.45 1p31 h ASN 310 CO 0.58 0.41 0.22 -0.33 -1.65 0.00 0.00 177.43 176.66 1p31 h GLU 311 N 0.81 0.33 -0.40 0.81 5.08 -1.98 0.10 114.58 119.32 1p31 h GLU 311 Ca 0.38 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.67 1p31 h GLU 311 Cb 0.30 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1p31 h GLU 311 CO -0.22 0.22 0.05 0.00 -1.00 0.00 0.00 179.01 178.06 1p31 h ALA 312 N 1.56 0.53 0.09 3.43 0.00 -1.82 0.35 119.26 123.40 1p31 h ALA 312 Ca 0.40 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1p31 h ALA 312 Cb 0.63 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1p31 h ALA 312 CO -0.44 0.26 -0.04 0.82 0.00 0.00 0.00 179.25 179.85 1p31 h ILE 313 N 0.52 1.02 -0.66 0.00 2.04 -1.27 -2.03 117.51 117.12 1p31 h ILE 313 Ca 0.12 -0.38 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 1p31 h ILE 313 Cb 0.40 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1p31 h ILE 313 CO 0.01 0.09 0.14 -0.07 0.00 0.00 0.00 178.15 178.32 1p31 h LEU 314 N -0.29 1.02 -0.36 1.44 3.38 -0.75 -0.97 115.31 118.79 1p31 h LEU 314 Ca -0.01 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1p31 h LEU 314 Cb 0.24 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1p31 h LEU 314 CO 0.02 1.01 0.21 -0.33 0.09 0.00 0.00 178.44 179.44 1p31 h GLU 315 N 1.00 0.49 -0.52 1.13 5.08 -0.92 0.37 114.58 121.21 1p31 h GLU 315 Ca 0.20 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1p31 h GLU 315 Cb 0.40 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1p31 h GLU 315 CO 0.01 0.38 -0.06 0.00 -1.00 0.00 0.00 179.01 178.34 1p31 h ALA 316 N 1.08 0.92 -0.09 3.43 0.00 -1.09 -2.42 119.26 121.09 1p31 h ALA 316 Ca 0.13 -0.32 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 1p31 h ALA 316 Cb 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1p31 h ALA 316 CO -0.02 0.64 -0.76 -0.07 0.00 0.00 0.00 179.25 179.03 1p31 h LEU 317 N 0.84 0.62 -1.38 0.00 3.38 -1.01 -0.64 115.31 117.12 1p31 h LEU 317 Ca 0.15 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 1p31 h LEU 317 Cb 0.58 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1p31 h LEU 317 CO 0.03 1.17 -0.29 0.00 0.09 0.00 0.00 178.44 179.45 1p31 h ALA 318 N 0.81 1.28 -0.16 1.53 0.00 -0.61 -1.76 119.26 120.35 1p31 h ALA 318 Ca -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1p31 h ALA 318 Cb 1.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1p31 h ALA 318 CO 0.14 0.37 0.00 -3.47 0.00 0.00 0.00 179.25 176.28 1p31 n ASP 319 N -3.85 2.49 -4.68 0.00 2.03 -0.92 -4.34 116.55 107.29 1p31 n ASP 319 Ca -0.01 -2.11 -0.48 0.00 0.52 0.00 0.00 54.79 52.71 1p31 n ASP 319 Cb 0.38 -0.14 -0.05 0.00 -0.72 0.00 0.00 41.12 40.58 1p31 n ASP 319 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1p31 n PHE 320 N -0.13 2.27 1.09 -0.67 -0.00 -0.25 -4.86 117.46 114.90 1p31 n PHE 320 Ca 0.07 0.13 0.12 0.00 -0.00 0.00 0.00 57.45 57.76 1p31 n PHE 320 Cb 0.37 -2.61 0.20 0.00 -0.00 0.00 0.00 39.48 37.45 1p31 n PHE 320 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1p31 n GLN 321 N 5.39 0.49 0.00 -4.13 1.13 -1.26 -4.63 117.38 114.36 1p31 n GLN 321 Ca 0.21 -0.33 0.00 0.00 -1.94 0.00 0.00 57.00 54.94 1p31 n GLN 321 Cb 0.28 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.14 1p31 n GLN 321 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p31 n GLY 322 N 1.43 1.08 3.89 1.08 0.00 -1.26 -4.82 105.19 106.60 1p31 n GLY 322 Ca 0.08 -1.90 -0.31 0.00 0.00 0.00 0.00 46.02 43.89 1p31 n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p31 s ALA 323 N -2.29 3.71 0.31 4.61 0.00 -1.26 -2.26 121.76 124.58 1p31 s ALA 323 Ca 0.00 -0.50 -0.29 0.00 0.00 0.00 0.00 51.96 51.17 1p31 s ALA 323 Cb 0.00 -2.22 -0.12 0.00 0.00 0.00 0.00 23.12 20.77 1p31 s ALA 323 CO 0.00 0.56 1.41 0.41 0.00 0.00 0.00 175.76 178.14 1p31 n GLY 324 N -0.15 0.88 2.53 0.00 0.00 0.75 -2.05 105.19 107.16 1p31 n GLY 324 Ca -0.02 0.39 -0.08 0.00 0.00 0.00 0.00 46.02 46.31 1p31 n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p31 n ARG 325 N 1.27 -1.16 -3.75 1.61 1.74 -1.26 -4.62 116.66 110.48 1p31 n ARG 325 Ca 0.07 0.73 -0.37 0.00 -0.77 0.00 0.00 57.85 57.51 1p31 n ARG 325 Cb 0.35 -4.81 -0.12 0.00 -1.02 0.00 0.00 32.46 26.87 1p31 n ARG 325 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1p31 s ARG 326 N -2.45 2.31 -1.20 5.56 3.00 -0.87 0.64 118.95 125.94 1p31 s ARG 326 Ca 0.00 -1.56 -0.34 0.00 0.00 0.00 0.00 55.73 53.83 1p31 s ARG 326 Cb 0.00 -3.55 0.05 0.00 0.00 0.00 0.00 34.95 31.44 1p31 s ARG 326 CO 0.00 -0.92 0.68 0.34 0.00 0.00 0.00 175.30 175.40 1p31 n PHE 327 N 4.71 -1.41 -3.47 -0.53 -0.00 -1.15 -4.64 117.46 110.96 1p31 n PHE 327 Ca -0.07 0.09 -0.43 0.00 -0.00 0.00 0.00 57.45 57.04 1p31 n PHE 327 Cb 0.42 -2.79 -0.08 0.00 -0.00 0.00 0.00 39.48 37.03 1p31 n PHE 327 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1p31 s ASP 328 N -3.51 5.92 -0.07 -2.13 2.15 0.62 -4.89 116.67 114.77 1p31 s ASP 328 Ca 0.48 -1.51 -0.30 0.00 0.43 0.00 0.00 52.55 51.65 1p31 s ASP 328 Cb -0.27 -2.10 -0.05 0.00 -0.30 0.00 0.00 42.92 40.21 1p31 s ASP 328 CO 0.97 -0.64 1.55 -1.10 -0.17 0.00 0.00 175.17 175.78 1p31 s GLN 329 N 1.53 4.20 0.10 4.34 -0.21 -1.26 -0.71 119.66 127.65 1p31 s GLN 329 Ca 0.04 2.06 0.23 0.00 0.02 0.00 0.00 55.36 57.71 1p31 s GLN 329 Cb -0.25 -3.88 0.00 0.00 1.00 0.00 0.00 33.01 29.88 1p31 s GLN 329 CO 0.04 -0.79 0.98 1.28 -2.12 0.00 0.00 175.29 174.68 1p31 n LEU 330 N 6.78 0.61 0.00 2.90 4.77 0.15 -4.95 117.00 127.25 1p31 n LEU 330 Ca 0.16 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1p31 n LEU 330 Cb 0.43 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1p31 n LEU 330 CO 0.61 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1p31 n GLY 331 N 1.28 0.96 3.56 -0.72 0.00 -1.14 -4.94 105.19 104.20 1p31 n GLY 331 Ca 0.00 -2.10 -0.34 0.00 0.00 0.00 0.00 46.02 43.58 1p31 n GLY 331 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p31 s GLU 332 N -1.01 3.41 -0.05 1.61 2.02 -1.26 -0.43 118.70 123.00 1p31 s GLU 332 Ca 0.00 -0.48 0.03 0.00 0.02 0.00 0.00 54.97 54.53 1p31 s GLU 332 Cb 0.00 -2.86 0.01 0.00 0.10 0.00 0.00 34.13 31.37 1p31 s GLU 332 CO 0.00 0.41 -0.12 -0.06 0.02 0.00 0.00 175.26 175.51 1p31 s PHE 333 N -0.09 1.30 -0.45 1.61 0.08 0.12 -4.96 117.98 115.59 1p31 s PHE 333 Ca 0.03 -0.40 -0.24 0.00 0.12 0.00 0.00 56.93 56.44 1p31 s PHE 333 Cb -0.13 -0.93 0.03 0.00 -0.57 0.00 0.00 43.02 41.42 1p31 s PHE 333 CO 0.02 -0.18 0.84 0.42 -0.10 0.00 0.00 175.22 176.22 1p31 s ILE 334 N 0.37 4.59 0.26 0.64 1.01 -1.26 -0.74 121.20 126.07 1p31 s ILE 334 Ca -0.08 0.58 0.07 0.00 0.00 0.00 0.00 60.65 61.22 1p31 s ILE 334 Cb -0.12 -4.36 -0.03 0.00 0.01 0.00 0.00 42.46 37.96 1p31 s ILE 334 CO 0.02 -0.74 0.25 -0.13 0.00 0.00 0.00 174.94 174.34 1p31 s ARG 335 N 3.45 3.03 0.46 2.79 1.81 -0.11 -4.98 118.95 125.40 1p31 s ARG 335 Ca 0.33 -1.01 0.23 0.00 -1.72 0.00 0.00 55.73 53.56 1p31 s ARG 335 Cb -0.11 -2.64 1.24 0.00 -0.45 0.00 0.00 34.95 32.99 1p31 s ARG 335 CO 0.24 0.37 1.85 -1.35 -0.68 0.00 0.00 175.30 175.73 1p31 h PRO 336 N 1.38 0.24 -0.44 3.54 0.11 -1.96 -1.95 132.00 132.92 1p31 h PRO 336 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1p31 h PRO 336 Cb 1.24 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1p31 h PRO 336 CO 0.60 0.16 0.00 0.09 -0.21 0.00 0.00 178.00 178.64 1p31 n ASN 337 N -4.43 3.23 0.00 -2.05 3.02 -1.26 -5.04 115.26 108.72 1p31 n ASN 337 Ca 0.20 -2.04 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 1p31 n ASN 337 Cb 0.83 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 1p31 n ASN 337 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p31 n GLY 338 N 0.75 3.02 3.68 7.41 0.00 -0.73 -3.35 105.19 115.97 1p31 n GLY 338 Ca 0.15 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.63 1p31 n GLY 338 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1p31 s LYS 339 N -2.16 4.27 0.15 1.61 2.20 -1.26 -0.94 119.74 123.61 1p31 s LYS 339 Ca 0.00 0.58 0.09 0.00 -0.36 0.00 0.00 55.97 56.28 1p31 s LYS 339 Cb 0.00 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 1p31 s LYS 339 CO 0.00 -0.10 -0.20 0.14 -0.36 0.00 0.00 175.35 174.83 1p31 s VAL 340 N 1.44 1.87 -0.12 4.02 -7.23 0.08 -0.52 120.40 119.93 1p31 s VAL 340 Ca 0.29 -1.81 -0.02 0.00 -1.81 0.00 0.00 61.98 58.62 1p31 s VAL 340 Cb -0.16 -1.79 -0.03 0.00 0.56 0.00 0.00 36.38 34.96 1p31 s VAL 340 CO 0.11 -0.20 -0.04 -0.60 -0.31 0.00 0.00 175.10 174.07 1p31 s ARG 341 N -2.48 3.34 -0.17 4.82 3.52 -0.20 0.16 118.95 127.94 1p31 s ARG 341 Ca 0.13 -0.51 -0.03 0.00 -0.13 0.00 0.00 55.73 55.20 1p31 s ARG 341 Cb -0.07 -2.82 -0.02 0.00 -1.56 0.00 0.00 34.95 30.48 1p31 s ARG 341 CO 0.06 0.42 -0.05 -1.17 -0.81 0.00 0.00 175.30 173.75 1p31 s LEU 342 N -0.13 3.05 -0.04 -0.88 2.96 0.43 0.13 118.68 124.20 1p31 s LEU 342 Ca 0.03 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.71 1p31 s LEU 342 Cb -0.13 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 44.82 1p31 s LEU 342 CO 0.02 0.10 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.36 1p31 s VAL 343 N 0.76 0.94 -0.13 1.68 1.01 0.64 0.30 120.40 125.60 1p31 s VAL 343 Ca -0.02 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.47 1p31 s VAL 343 Cb -0.15 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 1p31 s VAL 343 CO 0.02 0.29 0.10 -0.62 0.00 0.00 0.00 175.10 174.89 1p31 s ASP 344 N 0.29 6.01 -0.05 3.32 -1.08 0.11 -0.18 116.67 125.09 1p31 s ASP 344 Ca -0.06 0.32 -0.03 0.00 -0.52 0.00 0.00 52.55 52.26 1p31 s ASP 344 Cb -0.11 -1.93 0.02 0.00 -1.46 0.00 0.00 42.92 39.45 1p31 s ASP 344 CO 0.01 0.34 0.12 -0.62 0.52 0.00 0.00 175.17 175.54 1p31 s ASP 345 N -0.63 -0.10 0.41 -0.34 -1.08 0.11 -0.27 116.67 114.77 1p31 s ASP 345 Ca 0.12 0.24 0.25 0.00 -0.52 0.00 0.00 52.55 52.65 1p31 s ASP 345 Cb -0.12 0.19 0.63 0.00 -1.46 0.00 0.00 42.92 42.16 1p31 s ASP 345 CO 0.02 -0.09 1.71 0.22 0.52 0.00 0.00 175.17 177.55 1p31 h TYR 346 N 6.55 0.00 -1.13 -5.34 5.03 0.05 0.86 116.97 122.99 1p31 h TYR 346 Ca -0.33 0.00 -0.82 0.00 2.58 0.00 0.00 58.73 60.16 1p31 h TYR 346 Cb 1.17 0.00 0.03 0.00 1.55 0.00 0.00 36.73 39.48 1p31 h TYR 346 CO 0.42 0.00 0.51 0.41 -1.32 0.00 0.00 178.16 178.18 1p31 n GLY 347 N 0.90 0.16 0.00 1.82 0.00 -1.26 -3.31 105.19 103.50 1p31 n GLY 347 Ca 0.04 0.90 0.00 0.00 0.00 0.00 0.00 46.02 46.95 1p31 n GLY 347 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1p31 n HIS 348 N 3.30 0.00 -3.71 1.61 1.44 -1.26 -3.13 115.22 113.48 1p31 n HIS 348 Ca 0.26 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.61 1p31 n HIS 348 Cb 0.03 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.08 1p31 n HIS 348 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1p31 s HIS 349 N -0.62 3.63 0.40 -1.40 5.04 -1.26 -4.79 115.29 116.29 1p31 s HIS 349 Ca 0.00 0.69 0.18 0.00 -1.54 0.00 0.00 55.06 54.40 1p31 s HIS 349 Cb 0.00 -2.07 1.10 0.00 0.04 0.00 0.00 32.58 31.65 1p31 s HIS 349 CO 0.00 0.65 1.79 -1.35 -2.34 0.00 0.00 174.74 173.49 1p31 h PRO 350 N 4.47 0.39 -0.27 2.88 0.11 -1.94 0.32 132.00 137.96 1p31 h PRO 350 Ca -0.52 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.56 1p31 h PRO 350 Cb 1.21 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1p31 h PRO 350 CO 0.62 0.26 0.14 1.15 -0.21 0.00 0.00 178.00 179.96 1p31 h THR 351 N 0.40 1.13 -0.35 -1.15 2.02 -1.94 0.53 112.91 113.55 1p31 h THR 351 Ca 0.57 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 67.37 1p31 h THR 351 Cb 1.44 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.71 1p31 h THR 351 CO -0.26 0.13 0.17 -0.33 0.37 0.00 0.00 175.52 175.60 1p31 h GLU 352 N 0.32 0.51 -0.70 6.66 5.08 -1.39 -0.78 114.58 124.28 1p31 h GLU 352 Ca 0.09 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1p31 h GLU 352 Cb 0.09 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 1p31 h GLU 352 CO -0.01 0.46 0.45 0.28 -1.00 0.00 0.00 179.01 179.19 1p31 h VAL 353 N 0.43 1.12 -0.35 3.13 2.07 -1.12 -1.26 116.25 120.28 1p31 h VAL 353 Ca 0.12 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 1p31 h VAL 353 Cb 0.12 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 1p31 h VAL 353 CO -0.01 0.16 0.10 1.23 0.02 0.00 0.00 177.57 179.07 1p31 h GLY 354 N 0.89 0.58 1.85 2.17 0.00 -0.49 -0.76 103.07 107.31 1p31 h GLY 354 Ca 0.28 -0.35 -0.10 0.00 0.00 0.00 0.00 47.33 47.15 1p31 h GLY 354 CO -0.09 0.33 -0.42 -0.39 0.00 0.00 0.00 176.54 175.96 1p31 h VAL 355 N 0.41 1.31 -0.17 4.60 -1.51 -0.99 -1.19 116.25 118.71 1p31 h VAL 355 Ca 0.11 -1.53 -0.02 0.00 -1.23 0.00 0.00 66.70 64.04 1p31 h VAL 355 Cb 0.27 1.73 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 1p31 h VAL 355 CO -0.00 0.45 0.04 0.74 -1.23 0.00 0.00 177.57 177.57 1p31 h THR 356 N 0.14 1.21 -0.39 7.19 2.02 -0.99 -0.24 112.91 121.85 1p31 h THR 356 Ca 0.01 -0.66 0.04 0.00 0.77 0.00 0.00 66.41 66.57 1p31 h THR 356 Cb 0.81 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1p31 h THR 356 CO 0.06 0.20 0.15 0.40 0.37 0.00 0.00 175.52 176.71 1p31 h ILE 357 N 0.08 0.91 -0.35 3.11 2.04 -0.92 -1.05 117.51 121.33 1p31 h ILE 357 Ca 0.05 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 65.84 1p31 h ILE 357 Cb 0.27 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 1p31 h ILE 357 CO 0.00 0.06 0.15 0.50 0.00 0.00 0.00 178.15 178.86 1p31 h LYS 358 N 0.32 0.30 -0.87 2.37 3.64 -1.12 0.64 116.57 121.86 1p31 h LYS 358 Ca 0.17 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1p31 h LYS 358 Cb 0.13 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1p31 h LYS 358 CO -0.16 0.20 0.45 0.00 -2.27 0.00 0.00 179.45 177.67 1p31 h ALA 359 N 1.21 1.15 -0.03 5.00 0.00 -0.76 -1.46 119.26 124.37 1p31 h ALA 359 Ca 0.16 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1p31 h ALA 359 Cb 0.10 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1p31 h ALA 359 CO -0.14 0.66 0.01 0.00 0.00 0.00 0.00 179.25 179.79 1p31 h ALA 360 N 1.27 0.04 -0.81 0.00 0.00 -0.76 -2.96 119.26 116.04 1p31 h ALA 360 Ca 0.30 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.23 1p31 h ALA 360 Cb 0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 1p31 h ALA 360 CO -0.04 -0.37 0.43 0.00 0.00 0.00 0.00 179.25 179.26 1p31 h ARG 361 N -0.13 0.67 0.00 0.00 2.47 -0.54 -0.96 114.38 115.89 1p31 h ARG 361 Ca 0.01 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1p31 h ARG 361 Cb 0.18 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 1p31 h ARG 361 CO -0.00 0.44 0.00 0.39 0.56 0.00 0.00 179.97 181.36 1p31 n GLU 362 N -4.81 0.17 0.00 0.04 -0.58 -0.58 -2.66 120.64 112.21 1p31 n GLU 362 Ca 0.14 0.34 0.05 0.00 -0.42 0.00 0.00 57.16 57.28 1p31 n GLU 362 Cb 0.33 -1.79 0.02 0.00 -0.57 0.00 0.00 31.44 29.43 1p31 n GLU 362 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1p31 n GLY 363 N 0.29 -0.24 0.25 0.62 0.00 -0.47 -4.67 105.19 100.96 1p31 n GLY 363 Ca 0.03 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.83 1p31 n GLY 363 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1p31 n TRP 364 N 0.14 0.00 -0.10 1.61 -0.00 -0.55 -4.75 117.44 113.79 1p31 n TRP 364 Ca 0.05 -1.06 0.00 0.00 -0.00 0.00 0.00 57.50 56.49 1p31 n TRP 364 Cb 0.24 -0.17 0.00 0.00 -0.00 0.00 0.00 31.31 31.38 1p31 n TRP 364 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1p31 n GLY 365 N -1.26 2.80 1.42 5.87 0.00 -1.25 -1.93 105.19 110.84 1p31 n GLY 365 Ca 0.16 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.22 1p31 n GLY 365 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1p31 n ASP 366 N 1.96 4.20 -4.95 1.61 5.75 -1.26 -4.96 116.55 118.90 1p31 n ASP 366 Ca 0.00 -2.40 -0.24 0.00 -0.01 0.00 0.00 54.79 52.15 1p31 n ASP 366 Cb 0.00 -0.54 0.03 0.00 -1.03 0.00 0.00 41.12 39.58 1p31 n ASP 366 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1p31 s LYS 367 N -1.83 2.73 0.29 0.11 -0.14 -0.81 -5.06 119.74 115.02 1p31 s LYS 367 Ca 0.44 -0.43 -0.19 0.00 -1.36 0.00 0.00 55.97 54.43 1p31 s LYS 367 Cb 0.29 -2.41 -0.09 0.00 -1.68 0.00 0.00 37.83 33.94 1p31 s LYS 367 CO 0.21 -0.66 0.78 1.03 -0.76 0.00 0.00 175.35 175.95 1p31 s ARG 368 N -4.83 4.19 -0.23 1.68 0.52 -1.26 -4.95 118.95 114.08 1p31 s ARG 368 Ca 0.54 0.87 -0.06 0.00 -0.52 0.00 0.00 55.73 56.56 1p31 s ARG 368 Cb -0.10 -2.63 -0.03 0.00 0.52 0.00 0.00 34.95 32.71 1p31 s ARG 368 CO 0.41 0.25 0.04 0.42 0.02 0.00 0.00 175.30 176.44 1p31 s ILE 369 N -1.78 4.19 0.25 1.52 1.01 -1.26 -0.86 121.20 124.26 1p31 s ILE 369 Ca 0.50 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.95 1p31 s ILE 369 Cb -0.14 -2.93 0.02 0.00 0.01 0.00 0.00 42.46 39.42 1p31 s ILE 369 CO 0.19 0.38 0.14 0.52 0.00 0.00 0.00 174.94 176.17 1p31 n VAL 370 N 4.61 0.00 -3.27 2.92 0.31 0.63 -1.00 118.33 122.53 1p31 n VAL 370 Ca -0.17 -1.02 -0.04 0.00 -0.01 0.00 0.00 64.34 63.11 1p31 n VAL 370 Cb 0.52 -0.16 -0.05 0.00 -0.91 0.00 0.00 33.84 33.24 1p31 n VAL 370 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1p31 s ILE 372 N -1.39 -0.77 -0.14 2.52 1.01 0.84 -0.23 121.20 123.04 1p31 s ILE 372 Ca 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.71 1p31 s ILE 372 Cb -0.01 -0.89 -0.02 0.00 0.01 0.00 0.00 42.46 41.55 1p31 s ILE 372 CO 0.07 -0.07 -0.11 0.12 0.00 0.00 0.00 174.94 174.95 1p31 s PHE 373 N 2.68 2.86 -0.27 3.97 2.19 0.24 -0.18 117.98 129.47 1p31 s PHE 373 Ca 0.16 -0.56 0.01 0.00 0.33 0.00 0.00 56.93 56.86 1p31 s PHE 373 Cb -0.15 -1.87 0.05 0.00 -1.31 0.00 0.00 43.02 39.74 1p31 s PHE 373 CO -0.18 -0.17 -0.06 -1.14 1.83 0.00 0.00 175.22 175.50 1p31 s GLN 374 N 0.35 2.38 0.42 10.12 0.74 -0.60 -0.73 119.66 132.34 1p31 s GLN 374 Ca -0.09 -1.27 -0.26 0.00 0.05 0.00 0.00 55.36 53.78 1p31 s GLN 374 Cb -0.16 -3.01 -0.09 0.00 1.10 0.00 0.00 33.01 30.86 1p31 s GLN 374 CO 0.05 -0.57 1.37 -2.14 -0.55 0.00 0.00 175.29 173.45 1p31 s PRO 375 N 1.19 3.88 -0.29 1.67 0.02 -1.26 -4.42 135.00 135.79 1p31 s PRO 375 Ca -0.06 2.30 -0.06 0.00 0.02 0.00 0.00 61.00 63.20 1p31 s PRO 375 Cb -0.19 -2.75 0.01 0.00 0.02 0.00 0.00 34.50 31.59 1p31 s PRO 375 CO -0.04 -0.61 0.06 -1.58 -0.33 0.00 0.00 177.00 174.50 1p31 s HIS 376 N -1.22 3.14 0.06 6.54 2.46 -1.26 -0.08 115.29 124.93 1p31 s HIS 376 Ca 0.58 -1.08 0.00 0.00 0.47 0.00 0.00 55.06 55.02 1p31 s HIS 376 Cb -0.41 -2.23 0.00 0.00 -0.13 0.00 0.00 32.58 29.81 1p31 s HIS 376 CO 0.53 -0.61 0.00 0.54 -2.47 0.00 0.00 174.74 172.74 1p31 n ARG 377 N 4.84 -0.56 -0.05 2.88 1.74 0.57 -4.53 116.66 121.55 1p31 n ARG 377 Ca -0.15 0.41 -0.09 0.00 -0.77 0.00 0.00 57.85 57.26 1p31 n ARG 377 Cb 0.48 -0.46 0.07 0.00 -1.02 0.00 0.00 32.46 31.53 1p31 n ARG 377 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1p31 h TYR 378 N 0.23 0.82 -0.37 -1.55 0.05 -1.81 -2.73 116.97 111.62 1p31 h TYR 378 Ca 0.00 -0.23 0.04 0.00 0.05 0.00 0.00 58.73 58.59 1p31 h TYR 378 Cb 0.00 -0.18 -0.04 0.00 1.01 0.00 0.00 36.73 37.52 1p31 h TYR 378 CO 0.00 0.96 0.15 0.66 -1.05 0.00 0.00 178.16 178.88 1p31 h SER 379 N 0.58 0.19 -0.38 3.88 4.64 -1.91 0.18 113.55 120.74 1p31 h SER 379 Ca 0.05 0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.26 1p31 h SER 379 Cb 0.89 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1p31 h SER 379 CO 0.08 0.15 -0.31 -0.09 -0.87 0.00 0.00 176.83 175.78 1p31 h ARG 380 N 0.32 0.89 -0.53 4.77 2.43 -1.79 -0.35 114.38 120.11 1p31 h ARG 380 Ca 0.16 -0.44 0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1p31 h ARG 380 Cb 0.11 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 1p31 h ARG 380 CO -0.15 1.09 0.34 1.15 -1.51 0.00 0.00 179.97 180.90 1p31 h THR 381 N 0.69 1.11 -0.19 0.20 2.02 -1.15 -0.85 112.91 114.74 1p31 h THR 381 Ca 0.07 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 1p31 h THR 381 Cb 0.90 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1p31 h THR 381 CO 0.08 0.13 0.10 -0.09 0.37 0.00 0.00 175.52 176.11 1p31 h ARG 382 N 0.70 0.28 -0.20 6.66 2.43 -0.49 -1.16 114.38 122.58 1p31 h ARG 382 Ca 0.20 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.27 1p31 h ARG 382 Cb -0.05 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 1p31 h ARG 382 CO -0.06 0.29 -0.18 -0.44 -1.51 0.00 0.00 179.97 178.07 1p31 h ASP 383 N 0.20 0.34 0.00 -3.80 3.32 -0.62 -3.20 116.42 112.66 1p31 h ASP 383 Ca 0.07 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 1p31 h ASP 383 Cb 0.10 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1p31 h ASP 383 CO -0.01 0.54 -0.09 0.18 -1.72 0.00 0.00 179.24 178.14 1p31 n LEU 384 N -4.20 2.25 -0.17 1.55 4.77 -0.36 -4.90 117.00 115.94 1p31 n LEU 384 Ca -0.00 -3.05 -0.12 0.00 -0.03 0.00 0.00 56.01 52.80 1p31 n LEU 384 Cb 0.33 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 40.92 1p31 n LEU 384 CO 0.40 0.76 0.51 0.15 -1.33 0.00 0.00 177.39 177.88 1p31 h PHE 385 N 0.12 -1.62 -0.46 -1.77 3.04 -1.20 -0.61 116.94 114.45 1p31 h PHE 385 Ca -0.00 0.09 -0.02 0.00 3.98 0.00 0.00 57.97 62.01 1p31 h PHE 385 Cb 1.03 0.77 -0.02 0.00 2.56 0.00 0.00 35.95 40.29 1p31 h PHE 385 CO 0.09 -0.47 0.20 -0.44 -2.02 0.00 0.00 178.31 175.67 1p31 h ASP 386 N -0.34 0.57 -0.50 0.41 3.45 -1.89 -1.39 116.42 116.74 1p31 h ASP 386 Ca 0.10 -0.05 -0.11 0.00 0.43 0.00 0.00 57.03 57.40 1p31 h ASP 386 Cb 0.58 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 39.18 1p31 h ASP 386 CO -0.64 0.51 -0.10 0.44 -1.57 0.00 0.00 179.24 177.88 1p31 h ASP 387 N 0.64 0.97 -0.28 6.45 3.32 -1.56 -1.14 116.42 124.82 1p31 h ASP 387 Ca 0.16 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1p31 h ASP 387 Cb 0.10 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1p31 h ASP 387 CO -0.02 1.08 0.18 -0.26 -1.72 0.00 0.00 179.24 178.50 1p31 h PHE 388 N 0.87 0.37 -0.63 4.55 0.04 -0.49 -0.68 116.94 120.96 1p31 h PHE 388 Ca 0.14 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.99 1p31 h PHE 388 Cb 0.65 -0.12 -0.06 0.00 2.20 0.00 0.00 35.95 38.62 1p31 h PHE 388 CO 0.04 0.26 0.31 0.28 -0.60 0.00 0.00 178.31 178.60 1p31 h VAL 389 N 0.37 0.88 -0.00 -0.55 2.07 -0.93 0.21 116.25 118.31 1p31 h VAL 389 Ca 0.10 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1p31 h VAL 389 Cb -0.01 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1p31 h VAL 389 CO -0.02 0.10 -0.00 1.56 0.02 0.00 0.00 177.57 179.23 1p31 h GLN 390 N 0.56 0.00 -0.42 1.57 4.20 -1.03 -2.82 115.11 117.18 1p31 h GLN 390 Ca 0.30 -0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.88 1p31 h GLN 390 Cb 0.27 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1p31 h GLN 390 CO -0.23 0.37 -0.24 -0.24 -0.67 0.00 0.00 178.83 177.82 1p31 h VAL 391 N -0.37 1.28 0.00 -0.54 3.04 -0.88 -2.80 116.25 115.98 1p31 h VAL 391 Ca 0.00 -1.40 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 1p31 h VAL 391 Cb 0.37 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 30.91 1p31 h VAL 391 CO 0.00 0.47 0.00 -0.07 -1.01 0.00 0.00 177.57 176.96 1p31 h LEU 392 N 0.73 0.00 -0.15 3.16 3.38 -1.03 -2.20 115.31 119.21 1p31 h LEU 392 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1p31 h LEU 392 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1p31 h LEU 392 CO 0.07 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.40 1p31 n SER 393 N -2.76 0.22 0.03 -0.43 7.64 -1.06 -3.62 113.62 113.65 1p31 n SER 393 Ca 0.01 -1.17 0.12 0.00 1.01 0.00 0.00 58.87 58.84 1p31 n SER 393 Cb 0.25 -0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.65 1p31 n SER 393 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p31 n GLN 394 N -0.78 0.18 -2.48 1.43 6.02 -0.83 -4.59 117.38 116.33 1p31 n GLN 394 Ca 0.21 0.05 -0.26 0.00 -0.01 0.00 0.00 57.00 56.99 1p31 n GLN 394 Cb 0.13 -1.61 0.03 0.00 1.02 0.00 0.00 30.24 29.82 1p31 n GLN 394 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1p31 s VAL 395 N -3.10 3.63 -0.09 5.09 -7.23 -1.24 -5.02 120.40 112.45 1p31 s VAL 395 Ca 0.08 -0.10 0.14 0.00 -1.81 0.00 0.00 61.98 60.30 1p31 s VAL 395 Cb 0.15 -3.43 -0.11 0.00 0.56 0.00 0.00 36.38 33.56 1p31 s VAL 395 CO 0.71 -0.42 1.03 0.44 -0.31 0.00 0.00 175.10 176.55 1p31 h ASP 396 N -0.10 0.00 -4.09 4.85 3.32 -1.42 -3.46 116.42 115.52 1p31 h ASP 396 Ca -0.45 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.46 1p31 h ASP 396 Cb 1.26 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.57 1p31 h ASP 396 CO 0.60 0.68 -0.34 0.00 -1.72 0.00 0.00 179.24 178.46 1p31 s ALA 397 N -2.85 -0.77 -0.06 3.45 0.00 -1.13 -4.93 121.76 115.46 1p31 s ALA 397 Ca -0.01 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.70 1p31 s ALA 397 Cb 0.08 -0.39 0.03 0.00 0.00 0.00 0.00 23.12 22.84 1p31 s ALA 397 CO 0.80 -0.17 0.01 -1.17 0.00 0.00 0.00 175.76 175.22 1p31 s LEU 398 N -0.16 0.59 0.00 0.00 2.96 -1.26 -4.33 118.68 116.48 1p31 s LEU 398 Ca -0.03 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.84 1p31 s LEU 398 Cb -0.03 -0.38 0.02 0.00 0.50 0.00 0.00 46.19 46.30 1p31 s LEU 398 CO 0.01 -0.19 0.16 -0.38 -1.32 0.00 0.00 176.35 174.63 1p31 n ILE 399 N 5.05 0.00 -3.56 6.68 5.41 -1.26 -1.23 119.36 130.45 1p31 n ILE 399 Ca -0.08 -0.50 -0.11 0.00 1.00 0.00 0.00 62.75 63.05 1p31 n ILE 399 Cb 0.50 -0.67 -0.04 0.00 -0.71 0.00 0.00 39.64 38.72 1p31 n ILE 399 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1p31 s LEU 401 N 0.00 0.05 0.66 1.39 1.43 0.09 -0.59 118.68 121.70 1p31 s LEU 401 Ca 0.12 -0.14 -0.18 0.00 -1.03 0.00 0.00 54.13 52.90 1p31 s LEU 401 Cb -0.01 2.10 -0.01 0.00 0.03 0.00 0.00 46.19 48.30 1p31 s LEU 401 CO 0.07 -0.86 1.19 0.47 0.23 0.00 0.00 176.35 177.46 1p31 n ASP 402 N -0.15 1.62 -4.65 2.29 8.00 -1.26 -4.44 116.55 117.96 1p31 n ASP 402 Ca -0.17 0.80 -0.46 0.00 0.71 0.00 0.00 54.79 55.67 1p31 n ASP 402 Cb 0.63 -1.51 -0.03 0.00 -0.02 0.00 0.00 41.12 40.19 1p31 n ASP 402 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1p31 n VAL 403 N -2.02 0.68 -2.73 2.53 0.31 -1.26 -4.51 118.33 111.34 1p31 n VAL 403 Ca 0.15 -0.17 -0.43 0.00 -0.01 0.00 0.00 64.34 63.88 1p31 n VAL 403 Cb 0.48 -1.34 -0.03 0.00 -0.91 0.00 0.00 33.84 32.04 1p31 n VAL 403 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1p31 s TYR 404 N 0.15 2.88 0.29 3.52 6.14 0.88 -4.94 117.35 126.26 1p31 s TYR 404 Ca 0.72 0.51 0.04 0.00 0.64 0.00 0.00 57.07 58.98 1p31 s TYR 404 Cb -0.71 -4.16 0.43 0.00 0.42 0.00 0.00 41.96 37.94 1p31 s TYR 404 CO 0.48 -1.17 1.71 0.00 0.64 0.00 0.00 175.55 177.20 1p31 h ALA 405 N 9.15 1.10 -6.46 3.97 0.00 -1.88 0.16 119.26 125.30 1p31 h ALA 405 Ca -0.24 -0.37 -0.50 0.00 0.00 0.00 0.00 54.91 53.80 1p31 h ALA 405 Cb 1.07 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 1p31 h ALA 405 CO 1.07 0.57 -0.82 0.00 0.00 0.00 0.00 179.25 180.07 1p31 n ALA 406 N -2.48 -1.53 -0.30 0.00 0.00 -1.26 -1.80 120.51 113.14 1p31 n ALA 406 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1p31 n ALA 406 Cb 0.44 -3.19 0.00 0.00 0.00 0.00 0.00 19.45 16.70 1p31 n ALA 406 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p31 n GLY 407 N -1.66 1.22 3.81 0.00 0.00 -1.26 -5.04 105.19 102.26 1p31 n GLY 407 Ca -0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 1p31 n GLY 407 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p31 s GLU 408 N -0.43 4.25 0.44 1.61 2.02 -0.74 -5.07 118.70 120.78 1p31 s GLU 408 Ca 0.00 0.84 -0.23 0.00 0.02 0.00 0.00 54.97 55.60 1p31 s GLU 408 Cb 0.00 -2.97 -0.08 0.00 0.10 0.00 0.00 34.13 31.19 1p31 s GLU 408 CO 0.00 0.45 1.14 0.00 0.02 0.00 0.00 175.26 176.87 1p31 s ALA 409 N -1.43 3.00 0.52 5.21 0.00 -1.26 -4.84 121.76 122.96 1p31 s ALA 409 Ca 0.40 0.87 -0.23 0.00 0.00 0.00 0.00 51.96 53.01 1p31 s ALA 409 Cb -0.17 -3.35 -0.06 0.00 0.00 0.00 0.00 23.12 19.53 1p31 s ALA 409 CO 0.21 -0.54 1.36 -2.14 0.00 0.00 0.00 175.76 174.65 1p31 s PRO 410 N -2.65 3.31 -0.17 0.00 0.02 -1.26 -4.85 135.00 129.40 1p31 s PRO 410 Ca 0.62 2.25 -0.01 0.00 0.02 0.00 0.00 61.00 63.87 1p31 s PRO 410 Cb -0.27 -2.36 -0.01 0.00 0.02 0.00 0.00 34.50 31.88 1p31 s PRO 410 CO 0.33 -1.06 -0.11 0.42 -0.33 0.00 0.00 177.00 176.25 1p31 s ILE 411 N -1.29 2.99 0.21 2.83 1.01 -1.26 -5.09 121.20 120.60 1p31 s ILE 411 Ca 0.69 -0.65 -0.32 0.00 0.00 0.00 0.00 60.65 60.36 1p31 s ILE 411 Cb -0.40 -2.30 -0.13 0.00 0.01 0.00 0.00 42.46 39.64 1p31 s ILE 411 CO 0.49 0.49 1.66 0.52 0.00 0.00 0.00 174.94 178.10 1p31 n VAL 412 N 4.18 0.16 -0.44 2.92 0.31 -1.26 -1.57 118.33 122.63 1p31 n VAL 412 Ca -0.19 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1p31 n VAL 412 Cb 0.52 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 1p31 n VAL 412 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1p31 n GLY 413 N 3.53 1.25 0.94 2.92 0.00 -1.26 -4.90 105.19 107.68 1p31 n GLY 413 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 1p31 n GLY 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p31 n ALA 414 N -0.21 3.98 -2.46 4.61 0.00 -0.61 -4.74 120.51 121.08 1p31 n ALA 414 Ca 0.00 -3.42 -0.27 0.00 0.00 0.00 0.00 53.44 49.75 1p31 n ALA 414 Cb 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 19.45 19.07 1p31 n ALA 414 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1p31 s ASP 415 N -3.32 4.53 0.32 0.00 3.84 -1.26 -4.63 116.67 116.14 1p31 s ASP 415 Ca 0.41 -1.27 0.06 0.00 -0.00 0.00 0.00 52.55 51.75 1p31 s ASP 415 Cb 0.38 0.24 0.53 0.00 -1.38 0.00 0.00 42.92 42.69 1p31 s ASP 415 CO -0.04 -0.95 1.76 0.28 -0.00 0.00 0.00 175.17 176.22 1p31 h SER 416 N 0.98 0.31 -0.61 2.11 0.02 -1.94 -1.39 113.55 113.02 1p31 h SER 416 Ca -0.39 -0.10 0.04 0.00 -0.84 0.00 0.00 61.79 60.49 1p31 h SER 416 Cb 1.30 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 1p31 h SER 416 CO 0.62 0.59 0.36 0.11 -1.14 0.00 0.00 176.83 177.38 1p31 h LYS 417 N 0.27 0.69 -0.32 3.45 1.57 -1.96 0.35 116.57 120.62 1p31 h LYS 417 Ca 0.04 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1p31 h LYS 417 Cb 0.66 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1p31 h LYS 417 CO 0.05 0.45 -0.09 0.77 -0.57 0.00 0.00 179.45 180.06 1p31 h SER 418 N 0.71 0.64 -0.26 0.86 0.02 -1.73 -1.72 113.55 112.06 1p31 h SER 418 Ca 0.25 -0.37 0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1p31 h SER 418 Cb 0.07 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 1p31 h SER 418 CO -0.12 0.86 0.11 -0.07 -1.14 0.00 0.00 176.83 176.47 1p31 h LEU 419 N 0.41 0.14 -0.68 5.07 3.38 -1.07 -1.90 115.31 120.66 1p31 h LEU 419 Ca 0.08 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1p31 h LEU 419 Cb 0.59 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 1p31 h LEU 419 CO 0.03 0.12 0.37 0.00 0.09 0.00 0.00 178.44 179.05 1p31 h ARG 421 N 0.68 0.52 -0.28 0.00 2.43 -1.05 0.75 114.38 117.44 1p31 h ARG 421 Ca 0.31 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.30 1p31 h ARG 421 Cb 0.21 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1p31 h ARG 421 CO -0.19 0.35 -0.43 0.77 -1.51 0.00 0.00 179.97 178.96 1p31 h SER 422 N 0.53 0.73 -0.14 -3.80 0.02 -0.90 0.75 113.55 110.74 1p31 h SER 422 Ca 0.14 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 1p31 h SER 422 Cb -0.06 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1p31 h SER 422 CO -0.03 1.06 0.05 0.40 -1.14 0.00 0.00 176.83 177.17 1p31 h ILE 423 N 0.55 1.17 -0.84 3.27 2.04 -0.66 -1.08 117.51 121.96 1p31 h ILE 423 Ca 0.04 -0.51 0.09 0.00 1.00 0.00 0.00 64.86 65.48 1p31 h ILE 423 Cb 0.96 1.24 -0.07 0.00 -0.74 0.00 0.00 36.82 38.21 1p31 h ILE 423 CO 0.09 0.16 0.49 -0.09 0.00 0.00 0.00 178.15 178.79 1p31 h ARG 424 N 0.06 0.79 -0.72 2.37 2.43 -0.69 -1.87 114.38 116.75 1p31 h ARG 424 Ca 0.05 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1p31 h ARG 424 Cb 0.20 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 1p31 h ARG 424 CO -0.00 0.53 0.32 -0.91 -1.51 0.00 0.00 179.97 178.39 1p31 h ASN 425 N 0.82 0.96 -0.39 -3.80 2.35 -0.51 -2.53 115.58 112.47 1p31 h ASN 425 Ca 0.40 -0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.98 1p31 h ASN 425 Cb 0.36 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1p31 h ASN 425 CO -0.24 0.83 0.08 0.25 -1.65 0.00 0.00 177.43 176.70 1p31 h LEU 426 N 1.04 0.67 0.00 1.61 5.85 -0.40 -3.47 115.31 120.60 1p31 h LEU 426 Ca 0.25 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1p31 h LEU 426 Cb 0.15 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1p31 h LEU 426 CO -0.03 0.69 0.00 0.61 -0.34 0.00 0.00 178.44 179.37 1p31 n GLY 427 N -0.87 0.71 0.13 3.75 0.00 -0.93 -4.96 105.19 103.03 1p31 n GLY 427 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1p31 n GLY 427 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p31 h LYS 428 N 4.03 0.36 -3.78 1.61 1.57 -1.85 -3.47 116.57 115.03 1p31 h LYS 428 Ca 0.00 -0.61 -0.19 0.00 -1.87 0.00 0.00 60.65 57.97 1p31 h LYS 428 Cb 0.00 0.23 -0.24 0.00 0.08 0.00 0.00 32.23 32.30 1p31 h LYS 428 CO 0.00 1.26 -0.67 0.54 -0.57 0.00 0.00 179.45 180.00 1p31 s VAL 429 N -2.60 0.05 -0.44 0.50 0.11 -1.26 -5.04 120.40 111.72 1p31 s VAL 429 Ca -0.11 -0.45 -0.10 0.00 -2.93 0.00 0.00 61.98 58.39 1p31 s VAL 429 Cb 0.06 -0.17 0.09 0.00 -1.53 0.00 0.00 36.38 34.82 1p31 s VAL 429 CO 0.88 -0.25 0.30 -0.62 -3.33 0.00 0.00 175.10 172.08 1p31 s ASP 430 N -0.74 5.73 0.50 3.54 -1.08 -1.26 -4.14 116.67 119.22 1p31 s ASP 430 Ca -0.08 -1.56 -0.18 0.00 -0.52 0.00 0.00 52.55 50.21 1p31 s ASP 430 Cb -0.05 -2.02 -0.08 0.00 -1.46 0.00 0.00 42.92 39.31 1p31 s ASP 430 CO -0.00 -0.59 0.99 -2.16 0.52 0.00 0.00 175.17 173.93 1p31 s PRO 431 N 1.44 3.94 -0.20 4.34 0.04 -1.26 -4.62 135.00 138.68 1p31 s PRO 431 Ca 0.04 1.06 -0.03 0.00 0.04 0.00 0.00 61.00 62.11 1p31 s PRO 431 Cb -0.24 -2.13 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1p31 s PRO 431 CO 0.02 -0.28 -0.05 0.42 0.04 0.00 0.00 177.00 177.15 1p31 s ILE 432 N -2.43 3.47 -0.13 0.56 1.01 -0.37 -5.02 121.20 118.30 1p31 s ILE 432 Ca 0.61 -0.47 -0.23 0.00 0.00 0.00 0.00 60.65 60.55 1p31 s ILE 432 Cb -0.11 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 1p31 s ILE 432 CO 0.26 0.45 0.73 -0.22 0.00 0.00 0.00 174.94 176.15 1p31 s LEU 433 N 1.12 4.23 -0.32 2.97 2.96 -1.26 -4.31 118.68 124.07 1p31 s LEU 433 Ca 0.02 1.10 0.02 0.00 -0.22 0.00 0.00 54.13 55.04 1p31 s LEU 433 Cb -0.15 -3.09 0.08 0.00 0.50 0.00 0.00 46.19 43.54 1p31 s LEU 433 CO -0.00 -0.25 0.02 -0.69 -1.32 0.00 0.00 176.35 174.11 1p31 s VAL 434 N 1.51 2.53 -0.05 1.68 1.01 -1.26 -4.96 120.40 120.87 1p31 s VAL 434 Ca 0.36 -1.96 0.02 0.00 0.00 0.00 0.00 61.98 60.40 1p31 s VAL 434 Cb -0.17 -2.68 -0.25 0.00 0.00 0.00 0.00 36.38 33.28 1p31 s VAL 434 CO 0.14 -0.38 0.65 0.77 0.00 0.00 0.00 175.10 176.28 1p31 h SER 435 N 7.79 0.25 -2.94 3.32 4.64 -1.97 -3.37 113.55 121.26 1p31 h SER 435 Ca -0.12 -0.46 -0.71 0.00 -0.47 0.00 0.00 61.79 60.03 1p31 h SER 435 Cb 1.04 -0.08 -0.20 0.00 -0.31 0.00 0.00 62.40 62.84 1p31 h SER 435 CO 0.54 1.40 0.10 -0.62 -0.87 0.00 0.00 176.83 177.38 1p31 s ASP 436 N -6.67 6.22 0.00 4.97 2.15 -1.26 -4.89 116.67 117.20 1p31 s ASP 436 Ca -0.11 -1.55 0.20 0.00 0.43 0.00 0.00 52.55 51.52 1p31 s ASP 436 Cb 0.07 -2.29 0.92 0.00 -0.30 0.00 0.00 42.92 41.33 1p31 s ASP 436 CO 0.82 -1.06 1.64 0.35 -0.17 0.00 0.00 175.17 176.74 1p31 n THR 437 N 5.45 0.53 0.30 1.71 -2.24 -1.26 -1.14 114.28 117.63 1p31 n THR 437 Ca -0.08 0.13 0.19 0.00 -2.27 0.00 0.00 64.05 62.02 1p31 n THR 437 Cb 0.43 -0.79 0.90 0.00 -2.10 0.00 0.00 70.33 68.76 1p31 n THR 437 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1p31 h SER 438 N 0.00 0.00 0.00 3.42 4.64 -1.98 -2.26 113.55 117.38 1p31 h SER 438 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1p31 h SER 438 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1p31 h SER 438 CO 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.89 1p31 n GLN 439 N -2.94 1.79 -0.22 4.77 6.02 -0.29 -4.48 117.38 122.04 1p31 n GLN 439 Ca -0.01 -1.29 -0.03 0.00 -0.01 0.00 0.00 57.00 55.67 1p31 n GLN 439 Cb 0.17 -1.47 0.08 0.00 1.02 0.00 0.00 30.24 30.04 1p31 n GLN 439 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1p31 h LEU 440 N 3.14 0.53 -0.79 1.08 5.85 -1.53 -1.05 115.31 122.54 1p31 h LEU 440 Ca 0.00 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.79 1p31 h LEU 440 Cb 0.71 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.60 1p31 h LEU 440 CO 0.00 0.36 0.49 1.23 -0.34 0.00 0.00 178.44 180.18 1p31 h GLY 441 N 0.67 1.18 0.95 3.75 0.00 -1.80 -0.60 103.07 107.22 1p31 h GLY 441 Ca 0.27 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 1p31 h GLY 441 CO -0.16 0.27 0.09 -0.55 0.00 0.00 0.00 176.54 176.19 1p31 h ASP 442 N 0.92 0.67 -0.32 0.19 3.32 -1.57 0.48 116.42 120.11 1p31 h ASP 442 Ca 0.34 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1p31 h ASP 442 Cb 0.11 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1p31 h ASP 442 CO -0.15 0.74 0.12 0.58 -1.72 0.00 0.00 179.24 178.81 1p31 h VAL 443 N 0.57 1.19 -0.32 -1.35 2.07 -0.97 -1.81 116.25 115.63 1p31 h VAL 443 Ca 0.13 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.07 1p31 h VAL 443 Cb 0.34 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1p31 h VAL 443 CO 0.00 0.21 0.16 -0.07 0.02 0.00 0.00 177.57 177.89 1p31 h LEU 444 N 0.37 0.25 -2.04 2.57 3.38 -0.96 -1.96 115.31 116.91 1p31 h LEU 444 Ca 0.11 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1p31 h LEU 444 Cb 0.21 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1p31 h LEU 444 CO -0.01 0.18 0.13 0.44 0.09 0.00 0.00 178.44 179.28 1p31 h ASP 445 N 0.34 0.00 0.86 -0.43 3.45 -0.72 0.16 116.42 120.08 1p31 h ASP 445 Ca 0.13 0.00 -0.13 0.00 0.43 0.00 0.00 57.03 57.47 1p31 h ASP 445 Cb 0.04 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.79 1p31 h ASP 445 CO -0.08 0.00 -0.60 1.56 -1.57 0.00 0.00 179.24 178.55 1p31 h GLN 446 N 0.00 0.00 0.00 3.56 4.20 -0.55 -3.36 115.11 118.95 1p31 h GLN 446 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1p31 h GLN 446 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1p31 h GLN 446 CO -0.00 0.60 -1.04 0.44 -0.67 0.00 0.00 178.83 178.15 1p31 n ILE 447 N -3.57 0.00 -1.73 2.54 -5.35 -0.56 -5.03 119.36 105.66 1p31 n ILE 447 Ca -0.00 -0.25 -0.41 0.00 -0.27 0.00 0.00 62.75 61.81 1p31 n ILE 447 Cb 0.65 0.59 0.00 0.00 -1.74 0.00 0.00 39.64 39.15 1p31 n ILE 447 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1p31 n ILE 448 N -1.59 2.16 -4.34 7.28 5.41 0.47 -5.04 119.36 123.71 1p31 n ILE 448 Ca -0.00 -0.50 -0.22 0.00 1.00 0.00 0.00 62.75 63.03 1p31 n ILE 448 Cb 0.23 -1.75 -0.11 0.00 -0.71 0.00 0.00 39.64 37.30 1p31 n ILE 448 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 1p31 s GLN 449 N -2.07 1.29 0.21 0.38 -0.21 -1.26 -4.72 119.66 113.27 1p31 s GLN 449 Ca 0.56 -1.43 -0.32 0.00 0.02 0.00 0.00 55.36 54.19 1p31 s GLN 449 Cb -0.51 -1.33 -0.13 0.00 1.00 0.00 0.00 33.01 32.04 1p31 s GLN 449 CO 0.62 0.27 1.58 -3.47 -2.12 0.00 0.00 175.29 172.16 1p31 n ASP 450 N 0.22 3.34 0.00 5.90 2.03 -1.21 -2.16 116.55 124.67 1p31 n ASP 450 Ca -0.13 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.28 1p31 n ASP 450 Cb 0.57 -1.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.49 1p31 n ASP 450 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1p31 n GLY 451 N 3.09 0.74 3.75 0.27 0.00 0.33 -4.87 105.19 108.51 1p31 n GLY 451 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1p31 n GLY 451 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p31 s ASP 452 N -2.44 6.47 -0.32 1.61 1.01 -0.92 -4.35 116.67 117.73 1p31 s ASP 452 Ca 0.00 2.87 -0.14 0.00 0.71 0.00 0.00 52.55 56.00 1p31 s ASP 452 Cb 0.00 -2.64 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 1p31 s ASP 452 CO 0.00 -0.83 0.29 -0.22 0.21 0.00 0.00 175.17 174.62 1p31 s LEU 453 N -0.74 4.31 -0.29 1.23 2.96 -0.04 -1.03 118.68 125.07 1p31 s LEU 453 Ca 0.60 -0.15 -0.11 0.00 -0.22 0.00 0.00 54.13 54.25 1p31 s LEU 453 Cb -0.46 -2.25 -0.03 0.00 0.50 0.00 0.00 46.19 43.95 1p31 s LEU 453 CO 0.49 -0.23 0.18 -0.63 -1.32 0.00 0.00 176.35 174.84 1p31 s ILE 454 N 1.89 5.08 -0.38 6.68 1.01 0.12 -0.27 121.20 135.33 1p31 s ILE 454 Ca 0.10 -0.03 -0.13 0.00 0.00 0.00 0.00 60.65 60.58 1p31 s ILE 454 Cb -0.17 -3.47 0.01 0.00 0.01 0.00 0.00 42.46 38.84 1p31 s ILE 454 CO 0.11 0.18 0.26 -0.76 0.00 0.00 0.00 174.94 174.73 1p31 s LEU 455 N 1.71 4.82 -0.53 2.97 1.43 0.68 -0.26 118.68 129.51 1p31 s LEU 455 Ca 0.06 -0.78 -0.25 0.00 -1.03 0.00 0.00 54.13 52.14 1p31 s LEU 455 Cb -0.16 -2.12 0.04 0.00 0.03 0.00 0.00 46.19 43.98 1p31 s LEU 455 CO 0.09 -0.37 0.94 0.00 0.23 0.00 0.00 176.35 177.25 1p31 s ALA 456 N 1.66 3.18 -0.14 4.21 0.00 0.74 -0.11 121.76 131.30 1p31 s ALA 456 Ca 0.05 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1p31 s ALA 456 Cb -0.19 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.22 1p31 s ALA 456 CO 0.09 -2.30 -0.18 -1.14 0.00 0.00 0.00 175.76 172.23 1p31 s GLN 457 N 3.91 3.15 0.00 0.00 2.00 0.75 -0.71 119.66 128.77 1p31 s GLN 457 Ca 0.32 -0.79 0.00 0.00 -2.00 0.00 0.00 55.36 52.89 1p31 s GLN 457 Cb -0.12 -2.53 0.00 0.00 0.80 0.00 0.00 33.01 31.17 1p31 s GLN 457 CO 0.21 0.05 0.00 0.41 -0.50 0.00 0.00 175.29 175.46 1p31 n GLY 458 N 3.93 3.49 0.46 2.59 0.00 0.30 -1.56 105.19 114.41 1p31 n GLY 458 Ca -0.19 -1.60 0.12 0.00 0.00 0.00 0.00 46.02 44.34 1p31 n GLY 458 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p31 n ALA 459 N -1.91 3.36 -2.11 4.61 0.00 -1.21 -4.15 120.51 119.09 1p31 n ALA 459 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1p31 n ALA 459 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1p31 n ALA 459 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p31 n GLY 460 N 1.39 2.21 0.00 0.00 0.00 -1.26 -4.93 105.19 102.60 1p31 n GLY 460 Ca 0.10 -1.65 0.10 0.00 0.00 0.00 0.00 46.02 44.58 1p31 n GLY 460 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p31 n SER 461 N 0.00 0.00 -0.17 1.61 3.41 -1.26 -3.54 113.62 113.67 1p31 n SER 461 Ca 0.00 -0.10 0.18 0.00 -0.26 0.00 0.00 58.87 58.69 1p31 n SER 461 Cb 0.00 -0.24 0.55 0.00 -0.26 0.00 0.00 64.21 64.26 1p31 n SER 461 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1p31 h VAL 462 N 0.00 0.74 -0.11 -3.33 3.04 -1.91 -0.60 116.25 114.08 1p31 h VAL 462 Ca 0.00 -0.11 -0.02 0.00 -1.01 0.00 0.00 66.70 65.56 1p31 h VAL 462 Cb 0.16 0.38 -0.00 0.00 -2.01 0.00 0.00 31.29 29.81 1p31 h VAL 462 CO 0.00 0.06 0.00 -1.28 -1.01 0.00 0.00 177.57 175.35 1p31 h SER 463 N 0.33 0.18 -0.96 3.17 0.87 -1.85 0.30 113.55 115.59 1p31 h SER 463 Ca 0.39 -0.30 0.02 0.00 -1.23 0.00 0.00 61.79 60.67 1p31 h SER 463 Cb 1.03 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.89 1p31 h SER 463 CO -0.11 0.43 0.63 0.50 -0.53 0.00 0.00 176.83 177.75 1p31 h LYS 464 N -0.08 1.24 -0.36 2.24 3.64 -1.61 -0.96 116.57 120.68 1p31 h LYS 464 Ca 0.03 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1p31 h LYS 464 Cb 0.34 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1p31 h LYS 464 CO 0.00 0.82 0.13 0.82 -2.27 0.00 0.00 179.45 178.95 1p31 h ILE 465 N 1.27 1.20 -0.19 2.00 2.04 -0.95 -1.09 117.51 121.81 1p31 h ILE 465 Ca 0.36 -0.65 -0.13 0.00 1.00 0.00 0.00 64.86 65.45 1p31 h ILE 465 Cb -0.10 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1p31 h ILE 465 CO -0.09 0.23 -0.43 0.77 0.00 0.00 0.00 178.15 178.62 1p31 h SER 466 N 0.44 0.48 0.24 1.72 4.64 -0.66 -1.06 113.55 119.35 1p31 h SER 466 Ca 0.12 -0.22 -0.18 0.00 -0.47 0.00 0.00 61.79 61.04 1p31 h SER 466 Cb 0.23 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1p31 h SER 466 CO -0.01 0.85 -0.72 0.03 -0.87 0.00 0.00 176.83 176.11 1p31 h ARG 467 N 0.37 0.42 -0.90 4.77 3.08 -1.06 0.12 114.38 121.17 1p31 h ARG 467 Ca 0.03 -0.33 0.01 0.00 0.07 0.00 0.00 59.98 59.76 1p31 h ARG 467 Cb 0.91 0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.98 1p31 h ARG 467 CO 0.08 0.97 0.59 0.78 -1.07 0.00 0.00 179.97 181.32 1p31 h GLY 468 N 1.26 1.26 0.88 0.04 0.00 -1.02 -1.27 103.07 104.23 1p31 h GLY 468 Ca -0.03 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 1p31 h GLY 468 CO 0.12 0.45 0.06 -2.00 0.00 0.00 0.00 176.54 175.17 1p31 h LEU 469 N 1.21 0.45 -0.87 3.11 6.46 -0.66 -1.10 115.31 123.91 1p31 h LEU 469 Ca 0.33 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1p31 h LEU 469 Cb -0.12 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 39.64 1p31 h LEU 469 CO -0.07 0.58 0.52 0.00 -0.62 0.00 0.00 178.44 178.84 1p31 h ALA 470 N 0.88 1.11 -0.02 1.25 0.00 -0.50 -0.93 119.26 121.06 1p31 h ALA 470 Ca 0.09 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1p31 h ALA 470 Cb 0.32 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1p31 h ALA 470 CO 0.00 0.58 -0.63 0.93 0.00 0.00 0.00 179.25 180.13 1p31 h GLU 471 N 1.20 0.07 0.00 0.00 4.39 -1.19 -2.43 114.58 116.61 1p31 h GLU 471 Ca 0.31 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.93 1p31 h GLU 471 Cb -0.03 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1p31 h GLU 471 CO -0.06 0.67 -0.18 1.03 -1.16 0.00 0.00 179.01 179.32 1p31 h SER 472 N 0.05 0.00 -0.03 1.42 0.87 -0.66 -3.51 113.55 111.68 1p31 h SER 472 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1p31 h SER 472 Cb 1.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 1p31 h SER 472 CO 0.09 0.18 0.00 0.79 -0.53 0.00 0.00 176.83 177.35