#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r43 n THR 19 N 0.00 0.00 -1.59 2.61 5.66 -1.26 -4.10 114.28 115.60 1r43 n THR 19 Ca 0.00 0.00 -0.46 0.00 -3.05 0.00 0.00 64.05 60.54 1r43 n THR 19 Cb 0.00 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.74 1r43 n THR 19 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1r43 n LEU 20 N -0.70 3.16 -4.60 1.09 0.00 -1.26 -4.71 117.00 109.98 1r43 n LEU 20 Ca 0.00 0.50 -0.43 0.00 0.00 0.00 0.00 56.01 56.08 1r43 n LEU 20 Cb 0.00 -1.45 -0.03 0.00 0.00 0.00 0.00 43.42 41.94 1r43 n LEU 20 CO 0.00 -0.45 1.84 -0.46 0.00 0.00 0.00 177.39 178.32 1r43 n ASN 21 N 9.69 3.27 -4.65 1.96 2.04 -1.26 -4.96 115.26 121.35 1r43 n ASN 21 Ca 0.30 0.25 -0.33 0.00 -0.44 0.00 0.00 54.58 54.35 1r43 n ASN 21 Cb 0.36 -1.54 0.14 0.00 -2.53 0.00 0.00 39.78 36.20 1r43 n ASN 21 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1r43 n LEU 22 N 11.41 3.57 -4.65 -4.53 4.77 -1.26 -4.97 117.00 121.33 1r43 n LEU 22 Ca 0.30 0.52 -0.32 0.00 -0.03 0.00 0.00 56.01 56.49 1r43 n LEU 22 Cb 0.44 -1.46 0.16 0.00 -2.33 0.00 0.00 43.42 40.23 1r43 n LEU 22 CO 0.67 -2.05 0.63 -2.65 -1.33 0.00 0.00 177.39 172.65 1r43 n PRO 23 N -3.27 -0.37 -1.23 3.23 -0.02 -1.26 -4.94 135.00 127.14 1r43 n PRO 23 Ca 0.12 -0.04 -0.34 0.00 -2.02 0.00 0.00 63.50 61.22 1r43 n PRO 23 Cb 0.51 -2.34 0.11 0.00 -0.02 0.00 0.00 33.50 31.76 1r43 n PRO 23 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r43 n ALA 24 N -4.08 -0.10 -1.42 3.55 0.00 -1.26 -4.78 120.51 112.42 1r43 n ALA 24 Ca 0.12 -0.27 -0.51 0.00 0.00 0.00 0.00 53.44 52.78 1r43 n ALA 24 Cb 0.52 -2.19 -0.08 0.00 0.00 0.00 0.00 19.45 17.69 1r43 n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r43 n ALA 25 N -2.93 0.88 -2.08 0.00 0.00 -1.26 -4.83 120.51 110.29 1r43 n ALA 25 Ca 0.13 -0.07 -0.37 0.00 0.00 0.00 0.00 53.44 53.13 1r43 n ALA 25 Cb 0.50 -2.49 -0.03 0.00 0.00 0.00 0.00 19.45 17.43 1r43 n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r43 s ALA 26 N 7.45 2.13 -0.98 0.00 0.00 -1.26 -4.92 121.76 124.17 1r43 s ALA 26 Ca 1.12 -0.85 -0.19 0.00 0.00 0.00 0.00 51.96 52.04 1r43 s ALA 26 Cb -0.95 -4.35 0.12 0.00 0.00 0.00 0.00 23.12 17.94 1r43 s ALA 26 CO 0.51 -4.01 1.23 -1.25 0.00 0.00 0.00 175.76 172.24 1r43 s PRO 27 N 6.94 3.65 0.19 0.00 0.04 -1.26 -4.98 135.00 139.58 1r43 s PRO 27 Ca 0.66 -1.72 -0.30 0.00 0.04 0.00 0.00 61.00 59.68 1r43 s PRO 27 Cb -0.11 -5.03 -0.08 0.00 0.04 0.00 0.00 34.50 29.32 1r43 s PRO 27 CO 0.16 -1.87 1.13 -0.51 0.04 0.00 0.00 177.00 175.95 1r43 s LEU 28 N 3.07 4.48 -0.15 -3.56 1.43 -1.26 -4.94 118.68 117.76 1r43 s LEU 28 Ca 0.37 2.15 -0.29 0.00 -1.03 0.00 0.00 54.13 55.33 1r43 s LEU 28 Cb -0.03 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.52 1r43 s LEU 28 CO -0.08 -0.26 2.10 -0.94 0.23 0.00 0.00 176.35 177.40 1r43 s SER 29 N -0.11 5.81 -0.05 2.29 1.04 -1.26 -4.96 113.70 116.47 1r43 s SER 29 Ca 0.50 2.09 -0.19 0.00 0.48 0.00 0.00 55.95 58.82 1r43 s SER 29 Cb -0.31 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.25 1r43 s SER 29 CO 0.36 -1.65 0.54 -0.63 0.98 0.00 0.00 173.24 172.84 1r43 s ILE 30 N 6.96 5.04 -1.12 -1.02 1.01 -1.26 -4.86 121.20 125.95 1r43 s ILE 30 Ca 0.95 1.10 -0.22 0.00 0.00 0.00 0.00 60.65 62.48 1r43 s ILE 30 Cb -0.35 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 1r43 s ILE 30 CO 0.37 0.39 1.80 0.00 0.00 0.00 0.00 174.94 177.50 1r43 s ALA 31 N 0.09 2.30 0.28 9.38 0.00 -1.26 -4.95 121.76 127.60 1r43 s ALA 31 Ca 0.29 -2.20 -0.27 0.00 0.00 0.00 0.00 51.96 49.78 1r43 s ALA 31 Cb -0.17 -4.62 -0.15 0.00 0.00 0.00 0.00 23.12 18.19 1r43 s ALA 31 CO 0.14 -4.38 0.67 0.45 0.00 0.00 0.00 175.76 172.64 1r43 n SER 32 N 11.86 -0.41 0.00 0.00 2.88 -1.26 -2.77 113.62 123.92 1r43 n SER 32 Ca 0.43 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 59.05 1r43 n SER 32 Cb 0.47 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.84 1r43 n SER 32 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1r43 n GLY 33 N 1.71 0.69 0.01 0.46 0.00 -1.26 -4.84 105.19 101.96 1r43 n GLY 33 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 1r43 n GLY 33 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1r43 n ARG 34 N -2.00 0.11 0.06 1.61 -4.01 -1.11 -1.92 116.66 109.40 1r43 n ARG 34 Ca 0.00 -0.01 -0.21 0.00 -1.04 0.00 0.00 57.85 56.59 1r43 n ARG 34 Cb 0.00 -1.52 -0.11 0.00 -3.04 0.00 0.00 32.46 27.78 1r43 n ARG 34 CO 0.00 0.00 0.00 1.25 -3.04 0.00 0.00 177.63 175.84 1r43 h LEU 35 N 0.00 0.91 -0.35 2.89 5.85 -1.88 -1.76 115.31 120.97 1r43 h LEU 35 Ca 0.00 -0.77 -0.03 0.00 0.84 0.00 0.00 57.88 57.93 1r43 h LEU 35 Cb 0.59 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1r43 h LEU 35 CO 0.00 1.57 0.12 -1.13 -0.34 0.00 0.00 178.44 178.66 1r43 h ASN 36 N 0.36 0.50 -0.99 1.25 -1.24 -1.91 -1.79 115.58 111.75 1r43 h ASN 36 Ca -0.15 -0.19 0.04 0.00 0.71 0.00 0.00 56.30 56.71 1r43 h ASN 36 Cb 1.77 -0.13 -0.06 0.00 0.73 0.00 0.00 38.32 40.63 1r43 h ASN 36 CO 0.22 0.56 0.65 -0.61 -1.29 0.00 0.00 177.43 176.96 1r43 h GLN 37 N 0.42 1.20 -0.31 6.67 5.75 -1.48 -1.83 115.11 125.53 1r43 h GLN 37 Ca 0.11 -0.07 -0.10 0.00 -0.15 0.00 0.00 58.65 58.44 1r43 h GLN 37 Cb 0.23 -0.27 -0.01 0.00 1.07 0.00 0.00 27.48 28.50 1r43 h GLN 37 CO -0.01 0.79 -0.23 1.15 -2.65 0.00 0.00 178.83 177.89 1r43 h THR 38 N 1.24 1.27 -0.33 2.39 2.02 -1.06 -1.30 112.91 117.14 1r43 h THR 38 Ca 0.40 -1.28 -0.02 0.00 0.77 0.00 0.00 66.41 66.29 1r43 h THR 38 Cb 0.04 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1r43 h THR 38 CO -0.14 0.41 0.14 0.40 0.37 0.00 0.00 175.52 176.71 1r43 h ILE 39 N 0.52 1.18 -0.37 3.11 2.04 -0.80 -2.60 117.51 120.59 1r43 h ILE 39 Ca 0.08 -0.53 -0.07 0.00 1.00 0.00 0.00 64.86 65.34 1r43 h ILE 39 Cb 0.68 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1r43 h ILE 39 CO 0.05 0.19 -0.04 -0.07 0.00 0.00 0.00 178.15 178.28 1r43 h LEU 40 N 0.38 0.68 -0.43 1.44 3.38 -1.21 -2.05 115.31 117.51 1r43 h LEU 40 Ca 0.11 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1r43 h LEU 40 Cb 0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1r43 h LEU 40 CO -0.01 0.85 0.18 -0.33 0.09 0.00 0.00 178.44 179.22 1r43 h GLU 41 N 0.49 0.63 0.00 1.13 5.08 -1.18 -0.01 114.58 120.72 1r43 h GLU 41 Ca 0.10 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1r43 h GLU 41 Cb 0.52 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1r43 h GLU 41 CO 0.03 0.57 -0.40 1.79 -1.00 0.00 0.00 179.01 179.99 1r43 h THR 42 N 0.55 0.00 -0.09 1.13 1.35 -1.56 -2.70 112.91 111.59 1r43 h THR 42 Ca 0.14 -0.76 -0.23 0.00 -0.55 0.00 0.00 66.41 65.01 1r43 h THR 42 Cb 0.17 1.52 0.01 0.00 -1.73 0.00 0.00 68.15 68.12 1r43 h THR 42 CO -0.01 0.00 -0.87 1.23 -0.25 0.00 0.00 175.52 175.61 1r43 h GLY 43 N 4.24 0.77 1.38 5.82 0.00 -1.03 -2.02 103.07 112.23 1r43 h GLY 43 Ca 0.00 -1.19 -0.07 0.00 0.00 0.00 0.00 47.33 46.07 1r43 h GLY 43 CO 0.00 1.06 -0.01 0.23 0.00 0.00 0.00 176.54 177.82 1r43 h SER 44 N 0.45 0.72 0.77 0.19 0.87 -0.96 0.19 113.55 115.78 1r43 h SER 44 Ca -0.08 -0.17 -0.22 0.00 -1.23 0.00 0.00 61.79 60.09 1r43 h SER 44 Cb 1.51 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 63.24 1r43 h SER 44 CO 0.17 0.80 -1.34 -0.61 -0.53 0.00 0.00 176.83 175.32 1r43 h GLN 45 N 0.70 0.00 0.00 2.24 4.15 -1.41 -3.35 115.11 117.44 1r43 h GLN 45 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.56 1r43 h GLN 45 Cb 0.45 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.14 1r43 h GLN 45 CO 0.02 0.53 0.00 1.19 -1.93 0.00 0.00 178.83 178.64 1r43 n PHE 46 N -3.08 0.00 0.15 3.99 3.01 -0.77 -4.86 117.46 115.91 1r43 n PHE 46 Ca -0.09 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.56 1r43 n PHE 46 Cb 0.93 0.00 0.78 0.00 -0.01 0.00 0.00 39.48 41.18 1r43 n PHE 46 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1r43 h GLY 47 N 0.00 0.00 -5.93 1.37 0.00 -1.73 -3.47 103.07 93.31 1r43 h GLY 47 Ca 0.00 0.00 -0.76 0.00 0.00 0.00 0.00 47.33 46.57 1r43 h GLY 47 CO 0.00 0.00 0.29 0.61 0.00 0.00 0.00 176.54 177.44 1r43 n GLY 48 N -1.44 0.07 3.51 4.60 0.00 0.65 -2.37 105.19 110.22 1r43 n GLY 48 Ca 0.04 0.77 -0.11 0.00 0.00 0.00 0.00 46.02 46.73 1r43 n GLY 48 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r43 s VAL 49 N 0.63 0.00 -1.20 1.61 -7.23 -0.85 -4.89 120.40 108.47 1r43 s VAL 49 Ca 0.91 -0.29 -0.06 0.00 -1.81 0.00 0.00 61.98 60.73 1r43 s VAL 49 Cb -1.18 -1.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.49 1r43 s VAL 49 CO 0.56 -0.02 0.81 0.00 -0.31 0.00 0.00 175.10 176.14 1r43 n ALA 50 N -0.39 -2.24 -1.84 1.32 0.00 -1.26 -1.47 120.51 114.63 1r43 n ALA 50 Ca -0.14 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.79 1r43 n ALA 50 Cb 0.64 -3.35 -0.02 0.00 0.00 0.00 0.00 19.45 16.71 1r43 n ALA 50 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1r43 s ARG 51 N -5.53 4.33 0.00 0.00 3.52 -1.26 -4.19 118.95 115.82 1r43 s ARG 51 Ca 0.21 2.22 0.00 0.00 -0.13 0.00 0.00 55.73 58.02 1r43 s ARG 51 Cb -0.05 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.24 1r43 s ARG 51 CO 0.80 -0.26 0.00 -2.67 -0.81 0.00 0.00 175.30 172.35 1r43 n TRP 52 N 1.52 0.00 -3.86 5.12 2.14 -1.09 -5.04 117.44 116.23 1r43 n TRP 52 Ca 0.03 0.00 -0.17 0.00 2.07 0.00 0.00 57.50 59.43 1r43 n TRP 52 Cb 0.41 0.00 -0.01 0.00 -0.81 0.00 0.00 31.31 30.91 1r43 n TRP 52 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1r43 n GLY 53 N 2.49 3.03 0.00 -1.67 0.00 -1.23 -5.07 105.19 102.74 1r43 n GLY 53 Ca 0.00 -2.26 0.08 0.00 0.00 0.00 0.00 46.02 43.84 1r43 n GLY 53 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1r43 n GLN 54 N -1.19 1.60 -3.07 1.61 6.02 -1.26 -4.89 117.38 116.20 1r43 n GLN 54 Ca -0.03 -0.03 -0.37 0.00 -0.01 0.00 0.00 57.00 56.57 1r43 n GLN 54 Cb 0.38 -1.26 -0.06 0.00 1.02 0.00 0.00 30.24 30.32 1r43 n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1r43 s GLU 55 N -2.59 4.30 0.28 -1.09 0.41 -1.26 -4.98 118.70 113.77 1r43 s GLU 55 Ca 0.04 0.92 0.01 0.00 -0.41 0.00 0.00 54.97 55.53 1r43 s GLU 55 Cb 0.12 -2.92 0.67 0.00 -1.78 0.00 0.00 34.13 30.22 1r43 s GLU 55 CO 0.65 0.41 1.67 0.66 -0.49 0.00 0.00 175.26 178.16 1r43 h SER 56 N 3.52 0.10 0.16 -0.19 4.64 -2.05 0.70 113.55 120.43 1r43 h SER 56 Ca -0.48 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1r43 h SER 56 Cb 1.19 0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1r43 h SER 56 CO 0.65 -0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.52 1r43 n HIS 57 N -5.16 0.00 -1.54 4.77 1.44 -1.26 -4.26 115.22 109.21 1r43 n HIS 57 Ca 0.20 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.63 1r43 n HIS 57 Cb 0.63 -0.13 -0.06 0.00 0.12 0.00 0.00 29.99 30.55 1r43 n HIS 57 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1r43 n GLU 58 N -1.13 2.88 -4.30 -1.40 1.02 0.24 -4.85 120.64 113.09 1r43 n GLU 58 Ca 0.12 -2.43 -0.16 0.00 -0.02 0.00 0.00 57.16 54.67 1r43 n GLU 58 Cb 0.10 -2.25 -0.10 0.00 -0.02 0.00 0.00 31.44 29.17 1r43 n GLU 58 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1r43 s PHE 59 N -1.16 1.46 0.00 -0.32 -0.12 -1.26 -2.69 117.98 113.89 1r43 s PHE 59 Ca 0.59 -0.79 0.00 0.00 -0.05 0.00 0.00 56.93 56.68 1r43 s PHE 59 Cb 0.33 -0.78 0.00 0.00 -0.63 0.00 0.00 43.02 41.94 1r43 s PHE 59 CO -0.17 0.08 0.00 0.41 -0.05 0.00 0.00 175.22 175.50 1r43 n GLY 60 N -0.32 2.49 0.00 1.99 0.00 -0.54 -4.68 105.19 104.13 1r43 n GLY 60 Ca -0.08 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1r43 n GLY 60 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1r43 n ARG 62 N 0.00 0.00 -3.82 1.61 0.63 -1.00 -2.01 116.66 112.08 1r43 n ARG 62 Ca 0.00 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.63 1r43 n ARG 62 Cb 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 32.77 1r43 n ARG 62 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1r43 s ARG 63 N 0.00 1.35 0.40 -0.14 3.52 -1.26 -4.62 118.95 118.20 1r43 s ARG 63 Ca 0.00 -1.93 -0.19 0.00 -0.13 0.00 0.00 55.73 53.48 1r43 s ARG 63 Cb 0.00 -2.61 -0.10 0.00 -1.56 0.00 0.00 34.95 30.67 1r43 s ARG 63 CO 0.00 -1.08 0.89 -0.51 -0.81 0.00 0.00 175.30 173.79 1r43 s LEU 64 N 0.55 3.96 0.07 -0.88 1.43 -1.26 -1.42 118.68 121.12 1r43 s LEU 64 Ca 0.15 1.55 -0.37 0.00 -1.03 0.00 0.00 54.13 54.43 1r43 s LEU 64 Cb -0.23 -4.40 -0.17 0.00 0.03 0.00 0.00 46.19 41.43 1r43 s LEU 64 CO -0.06 -0.33 1.37 0.00 0.23 0.00 0.00 176.35 177.56 1r43 n ALA 65 N -0.63 -0.89 -0.54 4.21 0.00 -1.26 -2.58 120.51 118.82 1r43 n ALA 65 Ca 0.06 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1r43 n ALA 65 Cb 0.54 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.90 1r43 n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r43 n GLY 66 N 2.63 1.50 3.70 0.00 0.00 -1.26 -4.90 105.19 106.86 1r43 n GLY 66 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1r43 n GLY 66 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1r43 s THR 67 N -3.14 2.03 0.44 2.61 -1.32 -1.06 -4.68 115.64 110.51 1r43 s THR 67 Ca 0.00 0.01 0.30 0.00 -1.21 0.00 0.00 61.69 60.79 1r43 s THR 67 Cb 0.00 -2.56 0.32 0.00 -1.51 0.00 0.00 72.50 68.75 1r43 s THR 67 CO 0.00 -0.01 2.12 0.00 -2.21 0.00 0.00 174.62 174.52 1r43 h ALA 68 N -1.82 1.26 0.06 11.08 0.00 -1.94 -2.58 119.26 125.33 1r43 h ALA 68 Ca -0.54 -0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.02 1r43 h ALA 68 Cb 1.33 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.13 1r43 h ALA 68 CO 0.59 0.10 -1.13 -0.07 0.00 0.00 0.00 179.25 178.74 1r43 h LEU 69 N 0.00 0.79 -0.62 0.00 4.07 -1.92 -2.30 115.31 115.34 1r43 h LEU 69 Ca -0.00 -0.69 -0.00 0.00 0.08 0.00 0.00 57.88 57.26 1r43 h LEU 69 Cb 0.27 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.74 1r43 h LEU 69 CO 0.01 1.50 0.37 -0.78 -1.08 0.00 0.00 178.44 178.46 1r43 h ASP 70 N 0.29 0.74 0.06 -0.43 3.58 -1.70 -3.11 116.42 115.85 1r43 h ASP 70 Ca -0.15 -0.06 0.02 0.00 0.42 0.00 0.00 57.03 57.26 1r43 h ASP 70 Cb 1.79 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 42.63 1r43 h ASP 70 CO 0.21 0.59 -0.15 1.23 -2.88 0.00 0.00 179.24 178.24 1r43 h GLY 71 N 0.84 -0.25 -2.24 -0.78 0.00 -1.45 -0.94 103.07 98.24 1r43 h GLY 71 Ca 0.22 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1r43 h GLY 71 CO -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 176.54 176.35 1r43 n ALA 72 N -2.43 2.06 0.00 3.60 0.00 -0.87 -0.05 120.51 122.83 1r43 n ALA 72 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1r43 n ALA 72 Cb 0.20 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1r43 n ALA 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1r43 n ARG 74 N 0.93 0.00 -0.13 0.00 1.74 -0.36 -0.85 116.66 117.98 1r43 n ARG 74 Ca 0.00 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.00 1r43 n ARG 74 Cb 0.23 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.61 1r43 n ARG 74 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1r43 h ASP 75 N 0.00 -1.16 -0.52 0.55 5.19 -0.72 0.17 116.42 119.93 1r43 h ASP 75 Ca 0.00 0.16 0.10 0.00 -0.62 0.00 0.00 57.03 56.67 1r43 h ASP 75 Cb 0.00 0.49 -0.10 0.00 0.18 0.00 0.00 39.33 39.90 1r43 h ASP 75 CO 0.00 -0.21 -0.13 -0.25 -3.12 0.00 0.00 179.24 175.54 1r43 h TRP 76 N -0.16 -0.27 -0.69 4.55 7.01 -1.27 -0.71 115.95 124.42 1r43 h TRP 76 Ca 0.06 0.05 0.10 0.00 2.11 0.00 0.00 58.89 61.21 1r43 h TRP 76 Cb 0.32 0.20 -0.07 0.00 -2.10 0.00 0.00 29.16 27.50 1r43 h TRP 76 CO -0.78 -0.22 0.31 0.35 -2.79 0.00 0.00 178.44 175.32 1r43 h PHE 77 N 0.00 0.55 -0.37 2.65 3.57 -1.54 -0.79 116.94 121.01 1r43 h PHE 77 Ca 0.25 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.64 1r43 h PHE 77 Cb 0.38 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1r43 h PHE 77 CO -0.44 0.17 -0.34 1.79 -2.23 0.00 0.00 178.31 177.26 1r43 h THR 78 N 0.53 1.28 0.00 4.41 1.35 0.51 -1.43 112.91 119.55 1r43 h THR 78 Ca 0.35 -1.51 -0.03 0.00 -0.55 0.00 0.00 66.41 64.67 1r43 h THR 78 Cb 0.41 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1r43 h THR 78 CO -0.30 0.50 -0.15 0.78 -0.25 0.00 0.00 175.52 176.10 1r43 h ASN 79 N 0.70 0.00 0.59 5.36 4.21 -1.05 0.19 115.58 125.58 1r43 h ASN 79 Ca 0.07 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.55 1r43 h ASN 79 Cb 0.91 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.11 1r43 h ASN 79 CO 0.08 0.15 -0.28 -0.33 -1.29 0.00 0.00 177.43 175.76 1r43 h GLU 80 N 0.00 -0.76 -0.36 0.81 4.39 -0.71 -2.77 114.58 115.18 1r43 h GLU 80 Ca -0.00 0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.77 1r43 h GLU 80 Cb 0.28 0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1r43 h GLU 80 CO 0.02 -0.45 0.21 0.00 -1.16 0.00 0.00 179.01 177.63 1r43 h GLU 82 N 0.43 1.14 0.00 0.00 5.08 -0.72 -0.39 114.58 120.11 1r43 h GLU 82 Ca 0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1r43 h GLU 82 Cb 0.01 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.00 1r43 h GLU 82 CO -0.07 0.75 0.00 -1.13 -1.00 0.00 0.00 179.01 177.56 1r43 n SER 83 N -4.50 0.20 -0.31 1.42 3.41 -1.03 -0.81 113.62 112.01 1r43 n SER 83 Ca 0.12 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.41 1r43 n SER 83 Cb 0.09 -0.60 0.02 0.00 -0.26 0.00 0.00 64.21 63.46 1r43 n SER 83 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1r43 n LEU 84 N -1.74 1.57 0.00 1.04 7.94 -0.22 -4.96 117.00 120.63 1r43 n LEU 84 Ca 0.02 -0.60 0.00 0.00 -1.11 0.00 0.00 56.01 54.32 1r43 n LEU 84 Cb 0.12 -0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.04 1r43 n LEU 84 CO 0.11 0.31 0.00 0.61 -1.11 0.00 0.00 177.39 177.31 1r43 n GLY 85 N 1.44 0.63 3.77 -3.96 0.00 0.01 -5.00 105.19 102.09 1r43 n GLY 85 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1r43 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r43 s LYS 87 N -3.03 3.71 -0.32 0.00 2.20 -0.67 -4.29 119.74 117.33 1r43 s LYS 87 Ca 0.70 -0.31 -0.22 0.00 -0.36 0.00 0.00 55.97 55.78 1r43 s LYS 87 Cb -0.29 -3.76 0.00 0.00 -1.51 0.00 0.00 37.83 32.28 1r43 s LYS 87 CO 0.33 -0.43 0.74 0.08 -0.36 0.00 0.00 175.35 175.71 1r43 s VAL 88 N 1.99 4.82 -0.17 4.02 1.01 -1.26 -0.11 120.40 130.70 1r43 s VAL 88 Ca 0.12 1.00 -0.07 0.00 0.00 0.00 0.00 61.98 63.03 1r43 s VAL 88 Cb -0.16 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 1r43 s VAL 88 CO 0.11 -0.27 0.06 -0.54 0.00 0.00 0.00 175.10 174.47 1r43 s LYS 89 N 2.89 3.89 -0.11 2.72 1.02 -0.33 -4.96 119.74 124.85 1r43 s LYS 89 Ca 0.30 -0.34 0.03 0.00 0.02 0.00 0.00 55.97 55.98 1r43 s LYS 89 Cb -0.14 -3.18 -0.00 0.00 -0.52 0.00 0.00 37.83 33.99 1r43 s LYS 89 CO 0.13 0.33 -0.22 0.08 -0.92 0.00 0.00 175.35 174.75 1r43 s VAL 90 N 0.22 2.21 0.50 3.17 1.01 -1.26 -0.25 120.40 126.00 1r43 s VAL 90 Ca 0.04 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.13 1r43 s VAL 90 Cb -0.12 -1.86 0.04 0.00 0.00 0.00 0.00 36.38 34.43 1r43 s VAL 90 CO 0.00 0.55 0.69 1.51 0.00 0.00 0.00 175.10 177.85 1r43 s ASP 91 N 0.41 5.37 0.50 3.32 1.47 -0.61 -2.72 116.67 124.41 1r43 s ASP 91 Ca -0.16 -0.45 0.27 0.00 1.18 0.00 0.00 52.55 53.39 1r43 s ASP 91 Cb -0.17 -0.43 1.47 0.00 -0.34 0.00 0.00 42.92 43.45 1r43 s ASP 91 CO 0.07 -1.04 1.80 0.11 0.68 0.00 0.00 175.17 176.80 1r43 h LYS 92 N 0.36 0.00 -0.04 2.11 1.57 -1.32 0.32 116.57 119.57 1r43 h LYS 92 Ca -0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1r43 h LYS 92 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 1r43 h LYS 92 CO 0.45 0.00 0.00 1.51 -0.57 0.00 0.00 179.45 180.84 1r43 n ILE 93 N -2.57 0.07 -0.21 1.86 0.13 -1.26 -4.45 119.36 112.93 1r43 n ILE 93 Ca -0.02 -0.54 0.00 0.00 -1.10 0.00 0.00 62.75 61.10 1r43 n ILE 93 Cb 0.21 1.17 0.00 0.00 -0.84 0.00 0.00 39.64 40.18 1r43 n ILE 93 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1r43 n GLY 94 N 0.58 0.91 0.00 4.50 0.00 0.11 -4.76 105.19 106.53 1r43 n GLY 94 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1r43 n GLY 94 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1r43 n ASN 95 N 0.41 -0.01 0.00 1.61 3.02 -1.26 -4.29 115.26 114.74 1r43 n ASN 95 Ca 0.00 -0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1r43 n ASN 95 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1r43 n ASN 95 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1r43 n PHE 97 N -0.27 0.00 -2.69 3.10 3.01 0.65 -1.58 117.46 119.68 1r43 n PHE 97 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 1r43 n PHE 97 Cb 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 1r43 n PHE 97 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1r43 s ALA 98 N 0.00 2.95 -0.40 4.37 0.00 -0.44 -1.19 121.76 127.04 1r43 s ALA 98 Ca 0.00 -1.47 -0.20 0.00 0.00 0.00 0.00 51.96 50.29 1r43 s ALA 98 Cb 0.00 -4.04 0.01 0.00 0.00 0.00 0.00 23.12 19.09 1r43 s ALA 98 CO 0.00 -2.95 0.61 0.08 0.00 0.00 0.00 175.76 173.50 1r43 s VAL 99 N 4.88 4.89 -0.08 0.00 1.01 0.84 -2.64 120.40 129.30 1r43 s VAL 99 Ca 0.31 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.34 1r43 s VAL 99 Cb -0.12 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1r43 s VAL 99 CO 0.15 -0.45 0.46 -0.47 0.00 0.00 0.00 175.10 174.79 1r43 s TYR 100 N 2.68 3.58 -0.32 5.22 5.04 -0.34 -1.66 117.35 131.54 1r43 s TYR 100 Ca 0.22 0.93 -0.25 0.00 -2.44 0.00 0.00 57.07 55.53 1r43 s TYR 100 Cb -0.15 -2.49 0.01 0.00 0.35 0.00 0.00 41.96 39.68 1r43 s TYR 100 CO 0.17 0.30 0.85 -1.25 -1.34 0.00 0.00 175.55 174.28 1r43 s PRO 101 N 0.15 3.96 0.00 4.97 0.04 -1.26 -2.08 135.00 140.77 1r43 s PRO 101 Ca 0.25 0.66 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1r43 s PRO 101 Cb -0.16 -3.74 0.00 0.00 0.04 0.00 0.00 34.50 30.64 1r43 s PRO 101 CO 0.11 -0.75 0.00 0.41 0.04 0.00 0.00 177.00 176.81 1r43 n GLY 102 N 4.16 0.04 0.08 0.56 0.00 -1.26 -4.67 105.19 104.10 1r43 n GLY 102 Ca 0.05 -1.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.09 1r43 n GLY 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r43 h LYS 103 N 0.00 0.11 0.00 1.61 1.57 -0.89 -3.38 116.57 115.60 1r43 h LYS 103 Ca 0.00 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1r43 h LYS 103 Cb 0.00 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1r43 h LYS 103 CO 0.00 0.77 -1.60 0.09 -0.57 0.00 0.00 179.45 178.15 1r43 n ASN 104 N -4.64 0.43 -3.56 0.86 3.02 -0.26 -5.01 115.26 106.10 1r43 n ASN 104 Ca -0.09 0.17 -0.21 0.00 -0.03 0.00 0.00 54.58 54.42 1r43 n ASN 104 Cb 0.40 1.09 0.05 0.00 -0.61 0.00 0.00 39.78 40.71 1r43 n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r43 n GLY 105 N 1.30 -0.65 0.00 7.41 0.00 -1.26 -4.96 105.19 107.02 1r43 n GLY 105 Ca -0.06 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1r43 n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r43 n GLY 106 N -1.46 1.69 3.68 -0.02 0.00 -1.26 -4.90 105.19 102.92 1r43 n GLY 106 Ca -0.20 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 1r43 n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r43 s LYS 107 N 3.91 4.19 0.61 1.61 1.02 -1.26 -4.71 119.74 125.11 1r43 s LYS 107 Ca 0.00 2.31 -0.19 0.00 0.02 0.00 0.00 55.97 58.11 1r43 s LYS 107 Cb 0.00 -3.71 -0.03 0.00 -0.52 0.00 0.00 37.83 33.58 1r43 s LYS 107 CO 0.00 -0.76 1.31 -2.14 -0.92 0.00 0.00 175.35 172.83 1r43 s PRO 108 N 3.01 2.81 -0.45 -1.68 0.02 -1.26 -4.23 135.00 133.22 1r43 s PRO 108 Ca 0.74 2.10 -0.29 0.00 0.02 0.00 0.00 61.00 63.58 1r43 s PRO 108 Cb -0.38 -2.00 0.01 0.00 0.02 0.00 0.00 34.50 32.15 1r43 s PRO 108 CO 0.32 -1.41 1.36 0.99 -0.33 0.00 0.00 177.00 177.93 1r43 s THR 109 N -1.38 3.94 0.21 0.99 2.01 0.34 -0.01 115.64 121.74 1r43 s THR 109 Ca 0.78 0.93 -0.11 0.00 0.31 0.00 0.00 61.69 63.60 1r43 s THR 109 Cb -0.38 -4.32 -0.07 0.00 0.01 0.00 0.00 72.50 67.74 1r43 s THR 109 CO 0.42 -0.88 0.55 0.00 -0.69 0.00 0.00 174.62 174.02 1r43 s ALA 110 N 5.37 3.56 -0.10 7.40 0.00 -0.33 -1.02 121.76 136.64 1r43 s ALA 110 Ca 0.57 -0.23 -0.09 0.00 0.00 0.00 0.00 51.96 52.21 1r43 s ALA 110 Cb -0.12 -2.47 0.03 0.00 0.00 0.00 0.00 23.12 20.56 1r43 s ALA 110 CO 0.31 0.49 0.27 -0.08 0.00 0.00 0.00 175.76 176.75 1r43 s THR 111 N -1.73 0.00 0.00 0.00 -1.32 -0.52 -1.90 115.64 110.18 1r43 s THR 111 Ca 0.45 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.90 1r43 s THR 111 Cb -0.12 -0.39 0.00 0.00 -1.51 0.00 0.00 72.50 70.48 1r43 s THR 111 CO 0.20 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.21 1r43 n GLY 112 N 2.85 0.09 0.00 6.08 0.00 -0.52 -0.37 105.19 113.32 1r43 n GLY 112 Ca -0.13 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1r43 n GLY 112 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1r43 n SER 113 N 0.00 0.78 -4.46 1.61 2.88 -1.04 -4.50 113.62 108.88 1r43 n SER 113 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 1r43 n SER 113 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 1r43 n SER 113 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1r43 s HIS 114 N -0.02 2.46 -0.29 0.66 -3.43 -1.26 -1.39 115.29 112.02 1r43 s HIS 114 Ca 0.00 -0.30 0.19 0.00 -0.80 0.00 0.00 55.06 54.15 1r43 s HIS 114 Cb 0.00 -1.29 -0.27 0.00 -1.43 0.00 0.00 32.58 29.58 1r43 s HIS 114 CO 0.00 0.40 0.55 1.28 -2.00 0.00 0.00 174.74 174.96 1r43 n LEU 115 N 0.70 0.27 -4.89 5.38 4.77 -1.26 -2.71 117.00 119.26 1r43 n LEU 115 Ca -0.15 -0.15 -0.29 0.00 -0.03 0.00 0.00 56.01 55.38 1r43 n LEU 115 Cb 0.53 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.64 1r43 n LEU 115 CO 0.28 0.07 0.59 1.51 -1.33 0.00 0.00 177.39 178.50 1r43 s ASP 116 N -3.81 6.06 0.31 -1.43 -4.77 -1.26 -4.83 116.67 106.94 1r43 s ASP 116 Ca -0.03 1.08 0.04 0.00 -3.30 0.00 0.00 52.55 50.35 1r43 s ASP 116 Cb 0.13 -2.20 -0.03 0.00 -1.09 0.00 0.00 42.92 39.72 1r43 s ASP 116 CO 0.80 -0.84 0.19 0.42 0.70 0.00 0.00 175.17 176.44 1r43 s THR 117 N -3.00 0.22 0.90 2.11 -4.23 -0.51 -4.73 115.64 106.41 1r43 s THR 117 Ca 0.52 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.89 1r43 s THR 117 Cb -0.11 -2.49 0.15 0.00 1.34 0.00 0.00 72.50 71.40 1r43 s THR 117 CO 0.49 0.00 1.25 -1.58 -0.54 0.00 0.00 174.62 174.24 1r43 s GLN 118 N -3.73 1.15 0.38 3.99 2.00 -1.26 -4.56 119.66 117.63 1r43 s GLN 118 Ca 0.36 -0.15 -0.16 0.00 -2.00 0.00 0.00 55.36 53.41 1r43 s GLN 118 Cb 0.04 -1.88 -0.09 0.00 0.80 0.00 0.00 33.01 31.88 1r43 s GLN 118 CO 0.20 -2.11 0.81 -1.25 -0.50 0.00 0.00 175.29 172.44 1r43 s PRO 119 N -5.72 4.01 -0.81 1.67 0.04 -1.26 -3.96 135.00 128.97 1r43 s PRO 119 Ca 0.68 0.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.47 1r43 s PRO 119 Cb -0.07 -2.34 -0.00 0.00 0.04 0.00 0.00 34.50 32.12 1r43 s PRO 119 CO 0.51 0.05 0.66 0.39 0.04 0.00 0.00 177.00 178.65 1r43 n GLU 120 N -0.68 -1.42 -4.40 4.56 4.71 -1.26 -4.85 120.64 117.30 1r43 n GLU 120 Ca 0.04 1.07 -0.24 0.00 -0.01 0.00 0.00 57.16 58.02 1r43 n GLU 120 Cb 0.54 -3.97 -0.09 0.00 -1.01 0.00 0.00 31.44 26.90 1r43 n GLU 120 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1r43 s ALA 121 N -3.03 3.02 0.41 0.62 0.00 -1.25 -1.80 121.76 119.73 1r43 s ALA 121 Ca 0.03 -1.89 0.03 0.00 0.00 0.00 0.00 51.96 50.14 1r43 s ALA 121 Cb -0.01 -0.37 -0.00 0.00 0.00 0.00 0.00 23.12 22.73 1r43 s ALA 121 CO 0.83 0.18 0.59 0.20 0.00 0.00 0.00 175.76 177.56 1r43 s GLY 122 N -3.63 1.62 0.50 0.00 0.00 -1.13 -3.60 107.32 101.08 1r43 s GLY 122 Ca 0.32 -1.28 0.29 0.00 0.00 0.00 0.00 44.72 44.05 1r43 s GLY 122 CO 0.18 -1.14 1.90 0.50 0.00 0.00 0.00 173.10 174.54 1r43 h LYS 123 N 0.58 0.00 0.00 2.90 1.57 -1.83 -3.38 116.57 116.42 1r43 h LYS 123 Ca -0.45 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.12 1r43 h LYS 123 Cb 1.26 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.53 1r43 h LYS 123 CO 0.54 0.10 -1.79 0.66 -0.57 0.00 0.00 179.45 178.39 1r43 n TYR 124 N -3.24 0.00 -1.68 -1.35 4.02 -1.26 -4.73 117.16 108.93 1r43 n TYR 124 Ca 0.00 0.00 -0.49 0.00 -0.01 0.00 0.00 57.90 57.40 1r43 n TYR 124 Cb 0.37 -0.55 -0.05 0.00 -0.02 0.00 0.00 39.34 39.09 1r43 n TYR 124 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1r43 n ASP 125 N -2.74 3.12 0.00 7.72 4.64 -1.26 -1.26 116.55 126.78 1r43 n ASP 125 Ca -0.23 1.02 0.00 0.00 -1.38 0.00 0.00 54.79 54.20 1r43 n ASP 125 Cb 0.80 -1.34 0.00 0.00 -1.04 0.00 0.00 41.12 39.54 1r43 n ASP 125 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1r43 n GLY 126 N 4.06 1.42 0.35 0.27 0.00 -1.26 -4.58 105.19 105.45 1r43 n GLY 126 Ca 0.22 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.33 1r43 n GLY 126 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1r43 h ILE 127 N 0.00 0.78 -0.09 -0.61 2.04 -1.31 -1.30 117.51 117.02 1r43 h ILE 127 Ca 0.00 -0.29 0.03 0.00 1.00 0.00 0.00 64.86 65.61 1r43 h ILE 127 Cb 0.00 -0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 35.91 1r43 h ILE 127 CO 0.00 0.15 -0.14 0.25 0.00 0.00 0.00 178.15 178.41 1r43 h LEU 128 N 0.84 -0.42 -0.76 1.44 5.85 -1.43 0.31 115.31 121.14 1r43 h LEU 128 Ca 0.55 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 59.27 1r43 h LEU 128 Cb 0.74 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 1r43 h LEU 128 CO -0.34 -0.19 0.16 1.23 -0.34 0.00 0.00 178.44 178.96 1r43 h GLY 129 N -0.19 1.18 0.70 3.75 0.00 -1.17 0.19 103.07 107.54 1r43 h GLY 129 Ca 0.08 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 1r43 h GLY 129 CO -0.20 0.69 -0.07 -2.08 0.00 0.00 0.00 176.54 174.87 1r43 h VAL 130 N 1.04 0.97 -0.49 4.60 2.07 -1.30 -0.93 116.25 122.21 1r43 h VAL 130 Ca 0.22 -0.61 -0.10 0.00 0.82 0.00 0.00 66.70 67.02 1r43 h VAL 130 Cb 0.37 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1r43 h VAL 130 CO 0.00 0.14 -0.10 -0.07 0.02 0.00 0.00 177.57 177.57 1r43 h LEU 131 N -0.51 0.88 -0.94 2.57 3.38 -0.84 -0.90 115.31 118.95 1r43 h LEU 131 Ca -0.02 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 1r43 h LEU 131 Cb 0.39 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1r43 h LEU 131 CO 0.04 0.99 0.41 0.00 0.09 0.00 0.00 178.44 179.97 1r43 h ALA 132 N 1.09 1.18 -0.00 1.53 0.00 -0.61 -0.25 119.26 122.19 1r43 h ALA 132 Ca 0.13 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1r43 h ALA 132 Cb 0.61 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1r43 h ALA 132 CO 0.04 0.64 -0.13 0.78 0.00 0.00 0.00 179.25 180.57 1r43 h GLY 133 N 1.18 -0.16 2.00 0.00 0.00 0.13 -1.71 103.07 104.51 1r43 h GLY 133 Ca 0.29 0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.74 1r43 h GLY 133 CO -0.04 -0.13 -0.16 -2.00 0.00 0.00 0.00 176.54 174.20 1r43 h LEU 134 N -0.22 0.00 -1.18 3.11 5.85 -0.64 -1.61 115.31 120.62 1r43 h LEU 134 Ca 0.05 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 1r43 h LEU 134 Cb 0.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1r43 h LEU 134 CO -0.13 0.16 -0.26 -0.33 -0.34 0.00 0.00 178.44 177.54 1r43 h GLU 135 N 0.00 0.24 -0.16 1.25 4.39 -0.20 0.17 114.58 120.27 1r43 h GLU 135 Ca -0.00 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 1r43 h GLU 135 Cb 0.37 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1r43 h GLU 135 CO 0.02 0.49 0.09 0.28 -1.16 0.00 0.00 179.01 178.73 1r43 h VAL 136 N 0.22 1.09 -0.49 3.13 2.07 -0.54 0.24 116.25 121.97 1r43 h VAL 136 Ca 0.03 -0.24 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1r43 h VAL 136 Cb 0.58 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1r43 h VAL 136 CO 0.04 0.08 -0.21 -0.07 0.02 0.00 0.00 177.57 177.44 1r43 h LEU 137 N 0.16 1.03 -0.38 2.57 3.38 -1.41 0.41 115.31 121.07 1r43 h LEU 137 Ca 0.06 -0.39 0.08 0.00 0.09 0.00 0.00 57.88 57.71 1r43 h LEU 137 Cb 0.06 -0.28 -0.09 0.00 0.09 0.00 0.00 40.66 40.44 1r43 h LEU 137 CO -0.01 1.19 -0.25 0.03 0.09 0.00 0.00 178.44 179.49 1r43 h ARG 138 N 0.86 -0.18 -0.43 1.13 3.08 -0.53 -2.28 114.38 116.03 1r43 h ARG 138 Ca 0.11 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 1r43 h ARG 138 Cb 0.79 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 1r43 h ARG 138 CO 0.07 -0.12 0.18 1.15 -1.07 0.00 0.00 179.97 180.17 1r43 h THR 139 N -0.19 1.20 -0.08 2.04 2.02 -0.15 -0.20 112.91 117.55 1r43 h THR 139 Ca 0.18 -0.61 0.04 0.00 0.77 0.00 0.00 66.41 66.79 1r43 h THR 139 Cb 0.48 0.80 -0.06 0.00 -1.74 0.00 0.00 68.15 67.62 1r43 h THR 139 CO -0.49 0.22 -0.37 -0.26 0.37 0.00 0.00 175.52 174.99 1r43 h PHE 140 N 0.55 -1.05 -0.26 3.16 0.05 0.17 -1.59 116.94 117.97 1r43 h PHE 140 Ca 0.14 0.04 -0.03 0.00 3.82 0.00 0.00 57.97 61.94 1r43 h PHE 140 Cb 0.18 0.47 -0.01 0.00 2.00 0.00 0.00 35.95 38.60 1r43 h PHE 140 CO -0.00 -0.45 0.04 -0.22 -0.18 0.00 0.00 178.31 177.50 1r43 h LYS 141 N -0.48 0.43 -0.14 1.51 3.64 -1.42 0.37 116.57 120.48 1r43 h LYS 141 Ca 0.07 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1r43 h LYS 141 Cb 0.60 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 1r43 h LYS 141 CO -0.35 0.55 0.37 -0.44 -2.27 0.00 0.00 179.45 177.31 1r43 h ASP 142 N 0.24 0.00 0.00 4.20 3.45 -0.83 -1.60 116.42 121.87 1r43 h ASP 142 Ca 0.08 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.54 1r43 h ASP 142 Cb 0.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.10 1r43 h ASP 142 CO 0.01 0.00 -0.65 0.59 -1.57 0.00 0.00 179.24 177.62 1r43 n ASN 143 N -3.18 1.03 -1.07 6.45 3.02 -0.62 -5.00 115.26 115.89 1r43 n ASN 143 Ca 0.01 -0.53 -0.09 0.00 -0.03 0.00 0.00 54.58 53.94 1r43 n ASN 143 Cb 0.46 1.10 -0.00 0.00 -0.61 0.00 0.00 39.78 40.73 1r43 n ASN 143 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1r43 n ASN 144 N -1.35 -3.13 -4.55 6.41 3.02 0.53 -5.00 115.26 111.19 1r43 n ASN 144 Ca 0.01 -0.03 -0.43 0.00 -0.03 0.00 0.00 54.58 54.10 1r43 n ASN 144 Cb 0.16 -2.36 -0.05 0.00 -0.61 0.00 0.00 39.78 36.92 1r43 n ASN 144 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1r43 s TYR 145 N -2.50 2.97 -0.32 3.10 6.14 0.10 -4.99 117.35 121.85 1r43 s TYR 145 Ca 0.02 0.21 -0.21 0.00 0.64 0.00 0.00 57.07 57.73 1r43 s TYR 145 Cb -0.01 -3.76 -0.00 0.00 0.42 0.00 0.00 41.96 38.61 1r43 s TYR 145 CO 0.03 -1.03 0.68 0.14 0.64 0.00 0.00 175.55 176.01 1r43 s VAL 146 N 3.43 4.88 0.51 3.14 -7.23 -1.26 -4.55 120.40 119.32 1r43 s VAL 146 Ca 0.32 0.88 -0.21 0.00 -1.81 0.00 0.00 61.98 61.16 1r43 s VAL 146 Cb -0.12 -4.07 -0.06 0.00 0.56 0.00 0.00 36.38 32.70 1r43 s VAL 146 CO 0.24 -0.22 1.15 -2.84 -0.31 0.00 0.00 175.10 173.12 1r43 s PRO 147 N 2.75 3.50 0.26 4.82 0.02 -1.26 -4.80 135.00 140.28 1r43 s PRO 147 Ca 0.27 1.71 -0.03 0.00 0.02 0.00 0.00 61.00 62.97 1r43 s PRO 147 Cb -0.14 -2.17 0.40 0.00 0.02 0.00 0.00 34.50 32.60 1r43 s PRO 147 CO 0.13 -0.75 1.86 -0.91 -0.33 0.00 0.00 177.00 177.00 1r43 h ASN 148 N 1.54 0.94 -2.89 2.53 2.35 -1.95 -0.86 115.58 117.25 1r43 h ASN 148 Ca -0.50 0.02 -0.50 0.00 -0.55 0.00 0.00 56.30 54.77 1r43 h ASN 148 Cb 1.26 -0.18 -0.14 0.00 0.05 0.00 0.00 38.32 39.31 1r43 h ASN 148 CO 0.58 0.59 -0.66 -0.31 -1.65 0.00 0.00 177.43 175.97 1r43 s TYR 149 N -6.04 1.99 0.49 1.19 1.51 -1.26 -1.10 117.35 114.13 1r43 s TYR 149 Ca -0.12 -0.72 -0.22 0.00 -1.01 0.00 0.00 57.07 55.00 1r43 s TYR 149 Cb 0.20 -1.17 -0.09 0.00 -0.11 0.00 0.00 41.96 40.79 1r43 s TYR 149 CO 0.80 0.26 0.92 -0.25 -1.11 0.00 0.00 175.55 176.18 1r43 n ASP 150 N -0.62 0.77 -4.01 2.29 8.00 -1.26 -4.16 116.55 117.57 1r43 n ASP 150 Ca -0.05 0.93 -0.25 0.00 0.71 0.00 0.00 54.79 56.13 1r43 n ASP 150 Cb 0.64 -1.34 -0.17 0.00 -0.02 0.00 0.00 41.12 40.24 1r43 n ASP 150 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r43 s VAL 151 N -1.41 1.10 0.07 2.53 1.01 -0.89 -0.51 120.40 122.31 1r43 s VAL 151 Ca 0.67 -0.44 0.10 0.00 0.00 0.00 0.00 61.98 62.31 1r43 s VAL 151 Cb -0.50 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1r43 s VAL 151 CO 0.54 0.35 -0.26 0.00 0.00 0.00 0.00 175.10 175.73 1r43 s VAL 153 N -0.88 5.31 0.02 0.00 1.01 -1.08 -1.43 120.40 123.34 1r43 s VAL 153 Ca 0.12 0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.69 1r43 s VAL 153 Cb -0.10 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1r43 s VAL 153 CO 0.03 0.43 -0.23 0.54 0.00 0.00 0.00 175.10 175.87 1r43 s VAL 154 N 0.20 2.37 -0.21 2.92 0.11 0.50 -1.33 120.40 124.96 1r43 s VAL 154 Ca 0.16 -1.20 0.02 0.00 -2.93 0.00 0.00 61.98 58.02 1r43 s VAL 154 Cb -0.13 -1.92 0.04 0.00 -1.53 0.00 0.00 36.38 32.84 1r43 s VAL 154 CO 0.04 0.43 -0.13 0.54 -3.33 0.00 0.00 175.10 172.65 1r43 s VAL 155 N -0.78 1.93 0.17 2.04 0.11 -1.26 -2.50 120.40 120.11 1r43 s VAL 155 Ca 0.12 -1.19 -0.30 0.00 -2.93 0.00 0.00 61.98 57.68 1r43 s VAL 155 Cb -0.10 -1.94 -0.08 0.00 -1.53 0.00 0.00 36.38 32.73 1r43 s VAL 155 CO 0.02 0.21 1.22 0.26 -3.33 0.00 0.00 175.10 173.48 1r43 s TRP 156 N 1.27 3.40 0.24 1.54 0.52 -0.49 -4.47 118.94 120.95 1r43 s TRP 156 Ca -0.02 1.37 -0.30 0.00 0.02 0.00 0.00 56.10 57.17 1r43 s TRP 156 Cb -0.16 -3.46 -0.10 0.00 -1.15 0.00 0.00 33.47 28.60 1r43 s TRP 156 CO -0.09 -1.34 1.40 0.12 0.02 0.00 0.00 176.95 177.07 1r43 s PHE 157 N 0.11 3.08 -0.48 -1.98 5.36 -1.26 -4.41 117.98 118.40 1r43 s PHE 157 Ca 0.54 1.10 -0.33 0.00 -0.96 0.00 0.00 56.93 57.28 1r43 s PHE 157 Cb -0.33 -3.75 0.05 0.00 -0.34 0.00 0.00 43.02 38.65 1r43 s PHE 157 CO 0.36 -2.41 0.63 -1.71 -1.46 0.00 0.00 175.22 170.63 1r43 n ASN 158 N 2.33 -5.13 -0.05 6.13 5.15 -1.26 -0.82 115.26 121.61 1r43 n ASN 158 Ca 0.06 -0.26 -0.15 0.00 -0.60 0.00 0.00 54.58 53.62 1r43 n ASN 158 Cb 0.41 -1.52 -0.13 0.00 -0.53 0.00 0.00 39.78 38.01 1r43 n ASN 158 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1r43 h GLU 159 N 1.71 0.05 0.00 1.20 4.22 -1.90 -0.04 114.58 119.83 1r43 h GLU 159 Ca -0.56 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 58.80 1r43 h GLU 159 Cb 1.35 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.63 1r43 h GLU 159 CO 0.24 1.04 0.00 0.93 -2.18 0.00 0.00 179.01 179.04 1r43 h GLU 160 N -0.90 0.00 -4.13 1.92 4.39 -1.87 0.14 114.58 114.14 1r43 h GLU 160 Ca -0.05 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.37 1r43 h GLU 160 Cb 1.13 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.86 1r43 h GLU 160 CO 0.01 0.00 -0.46 0.41 -1.16 0.00 0.00 179.01 177.80 1r43 n GLY 161 N -0.71 -0.11 0.34 -3.84 0.00 -1.26 -4.80 105.19 94.80 1r43 n GLY 161 Ca -0.01 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.89 1r43 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r43 n ALA 162 N -3.97 1.44 0.14 4.61 0.00 -1.26 -4.16 120.51 117.32 1r43 n ALA 162 Ca -0.01 -0.61 -0.00 0.00 0.00 0.00 0.00 53.44 52.81 1r43 n ALA 162 Cb 0.55 0.09 0.19 0.00 0.00 0.00 0.00 19.45 20.29 1r43 n ALA 162 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1r43 h ARG 163 N -0.74 0.00 -5.10 0.00 2.43 -1.91 -3.38 114.38 105.67 1r43 h ARG 163 Ca -0.02 0.00 -0.66 0.00 -0.81 0.00 0.00 59.98 58.49 1r43 h ARG 163 Cb 0.76 0.00 -0.31 0.00 -0.42 0.00 0.00 29.97 30.00 1r43 h ARG 163 CO -0.01 0.58 -0.80 -0.06 -1.51 0.00 0.00 179.97 178.17 1r43 s PHE 164 N -3.60 2.83 0.00 2.20 0.40 -1.26 -1.76 117.98 116.79 1r43 s PHE 164 Ca -0.01 -1.20 0.00 0.00 -0.60 0.00 0.00 56.93 55.12 1r43 s PHE 164 Cb 0.12 -1.95 0.00 0.00 0.51 0.00 0.00 43.02 41.70 1r43 s PHE 164 CO 0.75 -0.59 0.97 0.00 0.70 0.00 0.00 175.22 177.05 1r43 n ALA 165 N 4.42 2.66 -3.90 5.36 0.00 -1.26 -4.36 120.51 123.43 1r43 n ALA 165 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.97 1r43 n ALA 165 Cb 0.51 -1.24 -0.17 0.00 0.00 0.00 0.00 19.45 18.56 1r43 n ALA 165 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1r43 s ARG 166 N 0.63 1.49 0.51 0.00 6.06 -1.26 -5.02 118.95 121.37 1r43 s ARG 166 Ca 0.00 -0.47 -0.12 0.00 -2.50 0.00 0.00 55.73 52.64 1r43 s ARG 166 Cb 0.00 -1.93 -0.06 0.00 0.06 0.00 0.00 34.95 33.02 1r43 s ARG 166 CO 0.00 -0.39 0.91 -1.54 -2.50 0.00 0.00 175.30 171.78 1r43 s SER 167 N 1.64 6.45 -1.50 -2.12 1.04 -1.26 -3.85 113.70 114.09 1r43 s SER 167 Ca 0.02 1.33 -0.08 0.00 0.48 0.00 0.00 55.95 57.69 1r43 s SER 167 Cb -0.15 -2.41 0.06 0.00 0.10 0.00 0.00 66.02 63.62 1r43 s SER 167 CO -0.08 -0.61 0.71 0.00 0.98 0.00 0.00 173.24 174.25 1r43 h THR 169 N -1.83 0.53 -0.34 0.00 2.02 -1.10 0.20 112.91 112.39 1r43 h THR 169 Ca -0.60 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.54 1r43 h THR 169 Cb 1.37 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 1r43 h THR 169 CO 0.67 0.00 0.08 1.23 0.37 0.00 0.00 175.52 177.86 1r43 h GLY 170 N -0.52 0.59 1.75 2.16 0.00 -1.11 -2.18 103.07 103.76 1r43 h GLY 170 Ca -0.02 -0.38 -0.21 0.00 0.00 0.00 0.00 47.33 46.72 1r43 h GLY 170 CO -0.00 0.35 -0.94 1.48 0.00 0.00 0.00 176.54 177.43 1r43 h SER 171 N 0.39 0.29 -0.84 0.19 4.64 -1.76 -2.03 113.55 114.44 1r43 h SER 171 Ca 0.11 -0.25 0.08 0.00 -0.47 0.00 0.00 61.79 61.26 1r43 h SER 171 Cb 0.31 -0.09 -0.07 0.00 -0.31 0.00 0.00 62.40 62.24 1r43 h SER 171 CO 0.00 1.08 0.50 0.28 -0.87 0.00 0.00 176.83 177.82 1r43 h SER 172 N 0.11 0.74 -0.09 4.97 0.02 -0.51 0.44 113.55 119.22 1r43 h SER 172 Ca -0.06 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 1r43 h SER 172 Cb 1.59 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 64.02 1r43 h SER 172 CO 0.15 0.44 -0.09 0.58 -1.14 0.00 0.00 176.83 176.77 1r43 h VAL 173 N 0.86 1.36 -0.26 2.27 2.07 -1.09 0.25 116.25 121.70 1r43 h VAL 173 Ca 0.39 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.70 1r43 h VAL 173 Cb 0.30 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1r43 h VAL 173 CO -0.22 0.35 0.17 -0.25 0.02 0.00 0.00 177.57 177.64 1r43 h TRP 174 N -0.19 0.27 -0.00 1.57 7.01 -1.25 -1.48 115.95 121.88 1r43 h TRP 174 Ca 0.02 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.02 1r43 h TRP 174 Cb 0.59 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.56 1r43 h TRP 174 CO 0.09 0.17 -0.11 0.45 -2.79 0.00 0.00 178.44 176.25 1r43 n SER 175 N -4.50 0.14 -0.72 2.65 2.88 0.15 -1.78 113.62 112.44 1r43 n SER 175 Ca 0.01 0.21 -0.08 0.00 -1.33 0.00 0.00 58.87 57.68 1r43 n SER 175 Cb 0.12 -0.30 -0.02 0.00 -0.75 0.00 0.00 64.21 63.26 1r43 n SER 175 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1r43 n HIS 176 N -1.44 -0.15 -0.04 0.66 8.25 -0.56 -4.91 115.22 117.03 1r43 n HIS 176 Ca 0.08 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.44 1r43 n HIS 176 Cb 0.32 -1.82 -0.14 0.00 1.12 0.00 0.00 29.99 29.47 1r43 n HIS 176 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1r43 n ASP 177 N 0.63 0.79 -4.54 0.41 9.92 0.77 -4.80 116.55 119.73 1r43 n ASP 177 Ca -0.08 0.28 -0.34 0.00 -0.53 0.00 0.00 54.79 54.12 1r43 n ASP 177 Cb 0.38 0.13 -0.12 0.00 -0.64 0.00 0.00 41.12 40.87 1r43 n ASP 177 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1r43 s LEU 178 N -6.03 3.28 0.33 0.64 2.96 -0.85 -4.97 118.68 114.05 1r43 s LEU 178 Ca -0.08 -0.07 -0.26 0.00 -0.22 0.00 0.00 54.13 53.50 1r43 s LEU 178 Cb 0.07 -1.77 -0.09 0.00 0.50 0.00 0.00 46.19 44.90 1r43 s LEU 178 CO 0.82 0.24 1.00 -0.94 -1.32 0.00 0.00 176.35 176.15 1r43 s SER 179 N -0.07 7.16 0.29 3.68 1.04 -1.26 -4.04 113.70 120.50 1r43 s SER 179 Ca 0.02 1.99 0.03 0.00 0.48 0.00 0.00 55.95 58.46 1r43 s SER 179 Cb -0.13 -2.59 0.63 0.00 0.10 0.00 0.00 66.02 64.02 1r43 s SER 179 CO 0.03 -0.20 1.81 0.25 0.98 0.00 0.00 173.24 176.11 1r43 h LEU 180 N 3.14 0.87 -0.20 2.42 5.85 -1.95 -1.68 115.31 123.77 1r43 h LEU 180 Ca -0.47 0.07 -0.19 0.00 0.84 0.00 0.00 57.88 58.13 1r43 h LEU 180 Cb 1.20 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1r43 h LEU 180 CO 0.65 0.40 -0.90 1.05 -0.34 0.00 0.00 178.44 179.30 1r43 h GLU 181 N 0.90 0.00 -0.20 1.25 9.09 -1.99 0.56 114.58 124.20 1r43 h GLU 181 Ca 0.53 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.79 1r43 h GLU 181 Cb 0.65 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.74 1r43 h GLU 181 CO -0.31 0.90 -0.50 1.49 0.05 0.00 0.00 179.01 180.64 1r43 h GLU 182 N 0.00 0.54 0.02 1.06 4.81 -1.81 -2.99 114.58 116.20 1r43 h GLU 182 Ca -0.01 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1r43 h GLU 182 Cb 1.59 0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.00 1r43 h GLU 182 CO 0.12 0.91 -0.01 0.00 -0.73 0.00 0.00 179.01 179.30 1r43 h ALA 183 N 1.03 -0.02 -1.15 2.92 0.00 -1.18 -2.87 119.26 117.98 1r43 h ALA 183 Ca 0.02 -0.20 0.34 0.00 0.00 0.00 0.00 54.91 55.06 1r43 h ALA 183 Cb 1.02 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 1r43 h ALA 183 CO 0.09 -0.31 0.75 1.88 0.00 0.00 0.00 179.25 181.66 1r43 h TYR 184 N -0.43 0.58 -0.14 0.00 0.99 -0.87 -2.24 116.97 114.86 1r43 h TYR 184 Ca -0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1r43 h TYR 184 Cb 0.41 -0.16 0.00 0.00 1.00 0.00 0.00 36.73 37.98 1r43 h TYR 184 CO 0.06 -0.05 0.00 0.41 -0.00 0.00 0.00 178.16 178.59 1r43 n GLY 185 N -1.50 0.37 0.00 3.88 0.00 -1.09 -2.08 105.19 104.76 1r43 n GLY 185 Ca 0.30 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1r43 n GLY 185 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r43 n LEU 186 N 0.43 0.00 -4.71 0.99 4.77 -0.84 -4.84 117.00 112.80 1r43 n LEU 186 Ca 0.17 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.87 1r43 n LEU 186 Cb 0.37 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 1r43 n LEU 186 CO 0.14 -1.13 -0.31 -0.94 -1.33 0.00 0.00 177.39 173.83 1r43 s SER 188 N -1.76 5.05 -0.14 -1.43 1.04 -0.68 -1.76 113.70 114.02 1r43 s SER 188 Ca 0.00 -0.24 -0.10 0.00 0.48 0.00 0.00 55.95 56.08 1r43 s SER 188 Cb 0.00 -1.19 -0.07 0.00 0.10 0.00 0.00 66.02 64.86 1r43 s SER 188 CO 0.00 0.12 0.00 -0.37 0.98 0.00 0.00 173.24 173.97 1r43 h VAL 189 N 2.53 0.28 -2.29 5.02 -1.51 -1.62 -3.44 116.25 115.22 1r43 h VAL 189 Ca -0.47 -1.29 -0.63 0.00 -1.23 0.00 0.00 66.70 63.07 1r43 h VAL 189 Cb 1.19 0.61 -0.39 0.00 -2.13 0.00 0.00 31.29 30.57 1r43 h VAL 189 CO 0.60 0.10 -0.31 0.61 -1.23 0.00 0.00 177.57 177.33 1r43 n GLY 190 N 1.63 5.55 2.87 5.19 0.00 -1.26 -4.99 105.19 114.19 1r43 n GLY 190 Ca -0.09 -2.75 -0.13 0.00 0.00 0.00 0.00 46.02 43.05 1r43 n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r43 s GLU 191 N -3.42 0.05 0.06 1.61 2.02 -1.26 -5.07 118.70 112.69 1r43 s GLU 191 Ca 0.45 -0.01 -0.25 0.00 0.02 0.00 0.00 54.97 55.18 1r43 s GLU 191 Cb 0.24 -0.07 -0.17 0.00 0.10 0.00 0.00 34.13 34.23 1r43 s GLU 191 CO -0.11 -0.00 1.59 -0.44 0.02 0.00 0.00 175.26 176.32 1r43 h ASP 192 N 6.24 -0.18 -3.21 -0.19 5.19 -1.99 -3.24 116.42 119.04 1r43 h ASP 192 Ca -0.26 -0.09 -0.74 0.00 -0.62 0.00 0.00 57.03 55.31 1r43 h ASP 192 Cb 1.20 0.05 -0.25 0.00 0.18 0.00 0.00 39.33 40.51 1r43 h ASP 192 CO 0.51 -0.02 -0.30 -0.54 -3.12 0.00 0.00 179.24 175.76 1r43 s LYS 193 N -5.70 2.87 0.36 3.56 -0.14 -1.26 -5.08 119.74 114.35 1r43 s LYS 193 Ca -0.14 -1.60 -0.19 0.00 -1.36 0.00 0.00 55.97 52.68 1r43 s LYS 193 Cb 0.04 -4.15 -0.10 0.00 -1.68 0.00 0.00 37.83 31.95 1r43 s LYS 193 CO 0.64 -1.19 0.84 -2.14 -0.76 0.00 0.00 175.35 172.74 1r43 s PRO 194 N 1.56 4.16 0.28 -1.68 0.02 -1.22 -5.08 135.00 133.03 1r43 s PRO 194 Ca 0.04 0.93 0.06 0.00 0.02 0.00 0.00 61.00 62.05 1r43 s PRO 194 Cb -0.27 -2.38 -0.06 0.00 0.02 0.00 0.00 34.50 31.82 1r43 s PRO 194 CO 0.03 0.10 -0.04 -1.83 -0.33 0.00 0.00 177.00 174.93 1r43 s GLU 195 N -2.94 1.54 0.51 5.54 -1.05 -1.26 -4.90 118.70 116.14 1r43 s GLU 195 Ca 0.57 -1.79 -0.11 0.00 -0.15 0.00 0.00 54.97 53.49 1r43 s GLU 195 Cb -0.11 -1.08 -0.06 0.00 -0.44 0.00 0.00 34.13 32.45 1r43 s GLU 195 CO 0.16 0.01 0.90 -1.54 0.95 0.00 0.00 175.26 175.74 1r43 s SER 196 N -3.43 6.41 0.40 0.83 1.04 -1.26 -1.69 113.70 116.00 1r43 s SER 196 Ca 0.30 1.29 0.09 0.00 0.48 0.00 0.00 55.95 58.11 1r43 s SER 196 Cb 0.04 -2.40 0.88 0.00 0.10 0.00 0.00 66.02 64.64 1r43 s SER 196 CO 0.12 -0.62 2.00 0.58 0.98 0.00 0.00 173.24 176.30 1r43 h VAL 197 N 0.47 1.01 -0.15 5.02 2.07 -0.96 -0.13 116.25 123.59 1r43 h VAL 197 Ca -0.46 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1r43 h VAL 197 Cb 1.19 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1r43 h VAL 197 CO 0.62 0.10 0.07 0.22 0.02 0.00 0.00 177.57 178.60 1r43 h TYR 198 N 0.57 0.22 -0.60 1.57 3.20 -1.72 -2.39 116.97 117.82 1r43 h TYR 198 Ca 0.24 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.15 1r43 h TYR 198 Cb 0.23 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.38 1r43 h TYR 198 CO -0.00 0.27 0.32 -0.44 -1.64 0.00 0.00 178.16 176.66 1r43 h ASP 199 N 0.10 0.46 -0.84 -2.11 3.32 -1.38 -1.85 116.42 114.12 1r43 h ASP 199 Ca 0.05 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1r43 h ASP 199 Cb 0.13 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 1r43 h ASP 199 CO -0.01 0.30 0.40 0.28 -1.72 0.00 0.00 179.24 178.50 1r43 h SER 200 N 0.60 1.10 -0.10 6.45 0.02 -1.13 -1.96 113.55 118.53 1r43 h SER 200 Ca 0.27 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1r43 h SER 200 Cb 0.17 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 1r43 h SER 200 CO -0.18 0.93 -0.03 -0.07 -1.14 0.00 0.00 176.83 176.34 1r43 h LEU 201 N 1.20 0.21 -0.83 5.07 3.38 -0.87 -2.36 115.31 121.11 1r43 h LEU 201 Ca 0.29 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1r43 h LEU 201 Cb 0.12 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1r43 h LEU 201 CO -0.04 0.54 0.18 0.50 0.09 0.00 0.00 178.44 179.71 1r43 h LYS 202 N -0.13 1.05 -0.18 1.13 3.64 -1.39 0.90 116.57 121.59 1r43 h LYS 202 Ca 0.03 -0.23 0.05 0.00 -1.27 0.00 0.00 60.65 59.22 1r43 h LYS 202 Cb 0.46 -0.15 -0.07 0.00 -0.41 0.00 0.00 32.23 32.06 1r43 h LYS 202 CO 0.01 0.92 -0.40 -0.97 -2.27 0.00 0.00 179.45 176.74 1r43 h ASN 203 N 1.00 -1.28 -0.00 4.20 -1.24 -1.30 -1.98 115.58 114.98 1r43 h ASN 203 Ca 0.21 0.18 0.00 0.00 0.71 0.00 0.00 56.30 57.40 1r43 h ASN 203 Cb 0.33 0.53 0.00 0.00 0.73 0.00 0.00 38.32 39.91 1r43 h ASN 203 CO -0.00 -0.41 -0.01 2.30 -1.29 0.00 0.00 177.43 178.02 1r43 n ILE 204 N -5.43 0.00 -2.61 2.57 -5.35 -0.90 -4.96 119.36 102.69 1r43 n ILE 204 Ca -0.03 -0.22 -0.05 0.00 -0.27 0.00 0.00 62.75 62.18 1r43 n ILE 204 Cb 0.35 0.41 0.01 0.00 -1.74 0.00 0.00 39.64 38.68 1r43 n ILE 204 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1r43 n GLY 205 N 1.17 0.57 0.44 3.28 0.00 0.68 -4.95 105.19 106.38 1r43 n GLY 205 Ca 0.19 -0.53 0.07 0.00 0.00 0.00 0.00 46.02 45.75 1r43 n GLY 205 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1r43 n TYR 206 N -3.19 0.01 -2.79 1.61 4.02 0.28 -4.90 117.16 112.20 1r43 n TYR 206 Ca -0.01 -1.35 -0.43 0.00 -0.01 0.00 0.00 57.90 56.11 1r43 n TYR 206 Cb 0.52 -0.22 -0.04 0.00 -0.02 0.00 0.00 39.34 39.58 1r43 n TYR 206 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1r43 s ILE 207 N -3.13 4.59 0.53 -0.72 1.01 -1.24 -3.37 121.20 118.87 1r43 s ILE 207 Ca 0.36 1.27 0.05 0.00 0.00 0.00 0.00 60.65 62.33 1r43 s ILE 207 Cb 0.34 -4.33 0.05 0.00 0.01 0.00 0.00 42.46 38.52 1r43 s ILE 207 CO -0.04 -0.51 0.73 -0.83 0.00 0.00 0.00 174.94 174.29 1r43 s GLY 208 N 1.84 1.85 0.12 6.18 0.00 -1.11 -4.96 107.32 111.23 1r43 s GLY 208 Ca 0.39 -1.64 0.22 0.00 0.00 0.00 0.00 44.72 43.69 1r43 s GLY 208 CO 0.18 -1.32 0.84 1.22 0.00 0.00 0.00 173.10 174.02 1r43 n ASP 209 N -2.21 0.57 -4.73 1.64 10.43 -1.10 -3.94 116.55 117.20 1r43 n ASP 209 Ca 0.10 0.22 -0.41 0.00 2.57 0.00 0.00 54.79 57.27 1r43 n ASP 209 Cb 0.60 0.93 -0.04 0.00 1.84 0.00 0.00 41.12 44.45 1r43 n ASP 209 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1r43 s THR 210 N -3.38 4.01 0.54 -3.53 2.01 -1.15 -4.90 115.64 109.23 1r43 s THR 210 Ca -0.03 1.67 -0.22 0.00 0.31 0.00 0.00 61.69 63.42 1r43 s THR 210 Cb 0.11 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.50 1r43 s THR 210 CO 0.83 0.26 1.36 -2.65 -0.69 0.00 0.00 174.62 173.73 1r43 n PRO 211 N 2.66 1.72 -2.51 4.92 -0.02 -1.26 -1.31 135.00 139.21 1r43 n PRO 211 Ca 0.03 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.74 1r43 n PRO 211 Cb 0.47 -2.57 0.01 0.00 -0.02 0.00 0.00 33.50 31.39 1r43 n PRO 211 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r43 n ALA 212 N -0.98 6.11 -3.23 3.55 0.00 -1.26 -4.48 120.51 120.22 1r43 n ALA 212 Ca 0.10 -4.49 -0.15 0.00 0.00 0.00 0.00 53.44 48.90 1r43 n ALA 212 Cb 0.44 -2.39 -0.15 0.00 0.00 0.00 0.00 19.45 17.35 1r43 n ALA 212 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r43 s SER 213 N -0.87 0.33 0.64 0.00 0.15 -1.26 -3.40 113.70 109.29 1r43 s SER 213 Ca 0.42 -0.03 0.40 0.00 0.70 0.00 0.00 55.95 57.44 1r43 s SER 213 Cb 0.17 -0.11 2.22 0.00 -1.71 0.00 0.00 66.02 66.59 1r43 s SER 213 CO -0.08 -0.03 2.32 0.10 1.20 0.00 0.00 173.24 176.75 1r43 h TYR 214 N 6.62 0.00 0.00 3.44 -0.00 -1.58 -0.90 116.97 124.56 1r43 h TYR 214 Ca -0.34 0.00 -0.11 0.00 0.00 0.00 0.00 58.73 58.28 1r43 h TYR 214 Cb 1.17 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.88 1r43 h TYR 214 CO 0.45 0.01 -0.53 0.87 -0.00 0.00 0.00 178.16 178.96 1r43 h LYS 215 N 0.00 0.00 0.00 0.10 1.57 -1.95 -3.40 116.57 112.89 1r43 h LYS 215 Ca -0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 1r43 h LYS 215 Cb 0.04 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1r43 h LYS 215 CO 0.00 0.53 -1.67 0.39 -0.57 0.00 0.00 179.45 178.13 1r43 n GLU 216 N -3.42 0.29 -3.58 3.15 1.02 -0.88 -4.84 120.64 112.37 1r43 n GLU 216 Ca 0.00 0.08 -0.40 0.00 -0.02 0.00 0.00 57.16 56.82 1r43 n GLU 216 Cb 0.66 -1.17 -0.07 0.00 -0.02 0.00 0.00 31.44 30.83 1r43 n GLU 216 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1r43 s ASN 217 N -5.33 5.74 -0.07 1.62 2.47 -0.39 -5.03 114.94 113.95 1r43 s ASN 217 Ca -0.16 -2.57 -0.05 0.00 0.42 0.00 0.00 52.86 50.50 1r43 s ASN 217 Cb 0.05 -1.98 -0.04 0.00 -1.45 0.00 0.00 41.25 37.82 1r43 s ASN 217 CO 0.26 -0.50 0.16 -1.61 -3.72 0.00 0.00 177.10 171.69 1r43 s GLU 218 N 0.36 3.44 0.16 0.43 2.02 -1.26 -4.49 118.70 119.36 1r43 s GLU 218 Ca 0.14 -0.22 0.10 0.00 0.02 0.00 0.00 54.97 55.01 1r43 s GLU 218 Cb -0.19 -3.14 -0.04 0.00 0.10 0.00 0.00 34.13 30.85 1r43 s GLU 218 CO -0.04 0.73 -0.17 0.96 0.02 0.00 0.00 175.26 176.75 1r43 s ILE 219 N -1.17 2.80 -0.01 -1.63 -4.36 -1.26 -4.18 121.20 111.39 1r43 s ILE 219 Ca 0.21 -1.70 0.06 0.00 -0.26 0.00 0.00 60.65 58.95 1r43 s ILE 219 Cb -0.12 -2.33 -0.24 0.00 1.25 0.00 0.00 42.46 41.01 1r43 s ILE 219 CO 0.11 -0.02 0.80 -0.78 0.24 0.00 0.00 174.94 175.28 1r43 h ASP 220 N 3.34 0.14 -5.08 4.36 3.58 -0.61 -3.47 116.42 118.68 1r43 h ASP 220 Ca -0.48 -0.23 0.08 0.00 0.42 0.00 0.00 57.03 56.82 1r43 h ASP 220 Cb 1.19 -0.04 -0.04 0.00 1.72 0.00 0.00 39.33 42.15 1r43 h ASP 220 CO 0.49 1.20 0.30 0.00 -2.88 0.00 0.00 179.24 178.34 1r43 s ALA 221 N -2.62 -1.23 -0.22 -0.78 0.00 -1.25 -4.27 121.76 111.39 1r43 s ALA 221 Ca -0.06 -0.31 -0.04 0.00 0.00 0.00 0.00 51.96 51.54 1r43 s ALA 221 Cb 0.08 0.78 0.12 0.00 0.00 0.00 0.00 23.12 24.09 1r43 s ALA 221 CO 0.83 -1.03 0.39 -1.58 0.00 0.00 0.00 175.76 174.37 1r43 s HIS 222 N -3.43 -0.82 -0.14 0.00 2.46 -0.91 -1.18 115.29 111.26 1r43 s HIS 222 Ca 0.13 1.12 -0.02 0.00 0.47 0.00 0.00 55.06 56.75 1r43 s HIS 222 Cb -0.05 0.14 -0.02 0.00 -0.13 0.00 0.00 32.58 32.52 1r43 s HIS 222 CO 0.07 -0.62 -0.09 -0.06 -2.47 0.00 0.00 174.74 171.57 1r43 s PHE 223 N 2.57 2.91 -0.11 3.88 0.40 -0.80 -1.74 117.98 125.10 1r43 s PHE 223 Ca 0.07 -0.47 0.02 0.00 -0.60 0.00 0.00 56.93 55.95 1r43 s PHE 223 Cb -0.14 -1.89 0.01 0.00 0.51 0.00 0.00 43.02 41.51 1r43 s PHE 223 CO -0.15 -0.12 -0.17 -2.00 0.70 0.00 0.00 175.22 173.48 1r43 s GLU 224 N 0.34 2.44 -0.13 0.44 2.12 -0.72 -1.44 118.70 121.75 1r43 s GLU 224 Ca -0.08 -0.65 -0.12 0.00 0.36 0.00 0.00 54.97 54.48 1r43 s GLU 224 Cb -0.15 -2.01 -0.05 0.00 0.26 0.00 0.00 34.13 32.18 1r43 s GLU 224 CO 0.04 -0.01 0.26 -1.17 -0.54 0.00 0.00 175.26 173.84 1r43 s LEU 225 N 0.84 4.30 0.05 2.70 2.96 -1.26 -0.57 118.68 127.71 1r43 s LEU 225 Ca -0.09 0.54 -0.10 0.00 -0.22 0.00 0.00 54.13 54.26 1r43 s LEU 225 Cb -0.15 -2.31 0.01 0.00 0.50 0.00 0.00 46.19 44.23 1r43 s LEU 225 CO 0.00 0.21 0.22 -2.28 -1.32 0.00 0.00 176.35 173.17 1r43 s HIS 226 N -0.08 0.04 0.36 5.38 2.46 -0.49 -3.09 115.29 119.87 1r43 s HIS 226 Ca 0.16 -0.30 -0.27 0.00 0.47 0.00 0.00 55.06 55.13 1r43 s HIS 226 Cb -0.13 -0.01 -0.09 0.00 -0.13 0.00 0.00 32.58 32.22 1r43 s HIS 226 CO 0.05 -0.48 1.15 0.96 -2.47 0.00 0.00 174.74 173.95 1r43 s ILE 227 N -2.90 3.28 0.28 0.89 -4.36 -1.26 -3.29 121.20 113.85 1r43 s ILE 227 Ca -0.03 1.14 0.00 0.00 -0.26 0.00 0.00 60.65 61.51 1r43 s ILE 227 Cb 0.00 -3.67 0.30 0.00 1.25 0.00 0.00 42.46 40.34 1r43 s ILE 227 CO -0.06 0.16 1.65 -0.08 0.24 0.00 0.00 174.94 176.86 1r43 h GLU 228 N 3.03 0.21 -3.20 0.37 4.81 -1.39 -3.46 114.58 114.95 1r43 h GLU 228 Ca -0.48 -0.01 -0.41 0.00 -0.13 0.00 0.00 59.36 58.33 1r43 h GLU 228 Cb 1.22 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.54 1r43 h GLU 228 CO 0.64 0.14 -0.53 1.04 -0.73 0.00 0.00 179.01 179.57 1r43 n GLN 229 N -5.22 -2.00 -3.86 1.92 6.02 -1.26 -4.88 117.38 108.10 1r43 n GLN 229 Ca 0.20 0.98 -0.09 0.00 -0.01 0.00 0.00 57.00 58.07 1r43 n GLN 229 Cb 0.63 -5.66 -0.05 0.00 1.02 0.00 0.00 30.24 26.19 1r43 n GLN 229 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1r43 s GLY 230 N -2.10 0.20 0.28 1.08 0.00 -1.21 -4.79 107.32 100.77 1r43 s GLY 230 Ca 0.03 -0.56 0.14 0.00 0.00 0.00 0.00 44.72 44.33 1r43 s GLY 230 CO 0.03 -0.54 1.51 -0.56 0.00 0.00 0.00 173.10 173.54 1r43 h PRO 231 N 2.36 0.00 -0.20 2.90 0.13 -1.83 -3.35 132.00 132.00 1r43 h PRO 231 Ca -0.30 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.89 1r43 h PRO 231 Cb 1.25 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.31 1r43 h PRO 231 CO 0.42 0.57 -0.20 0.82 -0.23 0.00 0.00 178.00 179.39 1r43 h ILE 232 N 0.00 0.48 0.24 -3.56 2.04 -1.98 -1.23 117.51 113.51 1r43 h ILE 232 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1r43 h ILE 232 Cb 1.29 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 1r43 h ILE 232 CO 0.07 0.00 -0.24 -0.07 0.00 0.00 0.00 178.15 177.91 1r43 h LEU 233 N -0.22 -0.65 -0.96 1.44 3.38 -1.89 0.12 115.31 116.53 1r43 h LEU 233 Ca 0.12 0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.30 1r43 h LEU 233 Cb 0.40 0.22 -0.09 0.00 0.09 0.00 0.00 40.66 41.28 1r43 h LEU 233 CO -0.33 -0.35 0.58 -0.08 0.09 0.00 0.00 178.44 178.34 1r43 h GLU 234 N -0.52 0.81 -0.22 1.13 4.81 -1.70 -0.09 114.58 118.80 1r43 h GLU 234 Ca -0.00 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.02 1r43 h GLU 234 Cb 0.48 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1r43 h GLU 234 CO -0.06 0.54 -0.49 0.22 -0.73 0.00 0.00 179.01 178.49 1r43 h ASP 235 N 0.84 0.66 -0.56 1.04 1.82 -0.53 -3.10 116.42 116.58 1r43 h ASP 235 Ca 0.51 -0.33 0.00 0.00 -0.39 0.00 0.00 57.03 56.82 1r43 h ASP 235 Cb 0.65 -0.19 0.00 0.00 0.68 0.00 0.00 39.33 40.47 1r43 h ASP 235 CO -0.32 1.04 0.00 -0.62 -1.61 0.00 0.00 179.24 177.73 1r43 n GLU 236 N -3.99 2.51 -2.43 0.28 1.02 0.37 -4.92 120.64 113.48 1r43 n GLU 236 Ca -0.03 -2.11 -0.21 0.00 -0.02 0.00 0.00 57.16 54.80 1r43 n GLU 236 Cb 0.57 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 30.47 1r43 n GLU 236 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1r43 n ASN 237 N 1.11 -5.84 -4.96 1.62 4.13 -0.20 -4.99 115.26 106.13 1r43 n ASN 237 Ca 0.19 -0.02 -0.22 0.00 1.68 0.00 0.00 54.58 56.21 1r43 n ASN 237 Cb 0.54 -4.86 -0.01 0.00 -1.54 0.00 0.00 39.78 33.91 1r43 n ASN 237 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1r43 s LYS 238 N -5.08 3.36 0.00 3.52 -0.14 -0.35 -4.82 119.74 116.24 1r43 s LYS 238 Ca 0.01 -0.56 0.00 0.00 -1.36 0.00 0.00 55.97 54.06 1r43 s LYS 238 Cb -0.01 -2.73 0.00 0.00 -1.68 0.00 0.00 37.83 33.42 1r43 s LYS 238 CO 0.02 0.15 0.00 0.00 -0.76 0.00 0.00 175.35 174.76 1r43 n ALA 239 N -1.71 1.89 -3.29 5.17 0.00 0.32 -4.49 120.51 118.39 1r43 n ALA 239 Ca -0.04 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.22 1r43 n ALA 239 Cb 0.57 0.04 -0.15 0.00 0.00 0.00 0.00 19.45 19.91 1r43 n ALA 239 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1r43 s ILE 240 N -1.89 0.36 -0.30 0.00 1.09 -1.12 -4.55 121.20 114.80 1r43 s ILE 240 Ca 0.00 -0.10 -0.07 0.00 -1.10 0.00 0.00 60.65 59.38 1r43 s ILE 240 Cb 0.00 -0.37 0.01 0.00 -1.06 0.00 0.00 42.46 41.04 1r43 s ILE 240 CO 0.00 0.15 0.08 -0.83 -0.10 0.00 0.00 174.94 174.24 1r43 s GLY 241 N 0.50 1.79 -0.58 6.18 0.00 0.15 -1.85 107.32 113.51 1r43 s GLY 241 Ca -0.06 -1.48 -0.28 0.00 0.00 0.00 0.00 44.72 42.91 1r43 s GLY 241 CO -0.01 0.66 1.19 -0.42 0.00 0.00 0.00 173.10 174.53 1r43 s ILE 242 N 1.49 4.02 -0.33 0.90 1.01 -0.02 -0.67 121.20 127.60 1r43 s ILE 242 Ca 0.02 0.87 -0.27 0.00 0.00 0.00 0.00 60.65 61.28 1r43 s ILE 242 Cb -0.17 -4.73 0.01 0.00 0.01 0.00 0.00 42.46 37.58 1r43 s ILE 242 CO 0.03 -1.35 0.98 -0.69 0.00 0.00 0.00 174.94 173.90 1r43 s VAL 243 N 4.95 4.59 -0.72 2.92 1.01 -1.26 -1.60 120.40 130.30 1r43 s VAL 243 Ca 0.42 1.51 0.23 0.00 0.00 0.00 0.00 61.98 64.14 1r43 s VAL 243 Cb -0.08 -4.34 -0.13 0.00 0.00 0.00 0.00 36.38 31.83 1r43 s VAL 243 CO 0.25 -0.44 1.03 0.35 0.00 0.00 0.00 175.10 176.29 1r43 n THR 244 N 5.81 0.10 -1.14 3.92 -2.24 -0.71 -4.86 114.28 115.17 1r43 n THR 244 Ca 0.09 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1r43 n THR 244 Cb 0.47 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1r43 n THR 244 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r43 n GLY 245 N 1.41 -1.31 3.27 3.38 0.00 -1.26 -1.40 105.19 109.28 1r43 n GLY 245 Ca 0.03 -0.98 -0.32 0.00 0.00 0.00 0.00 46.02 44.74 1r43 n GLY 245 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r43 s VAL 246 N -2.36 2.30 0.19 1.61 -7.23 -0.34 -0.69 120.40 113.88 1r43 s VAL 246 Ca 0.00 -0.95 -0.32 0.00 -1.81 0.00 0.00 61.98 58.90 1r43 s VAL 246 Cb 0.00 -1.89 -0.15 0.00 0.56 0.00 0.00 36.38 34.90 1r43 s VAL 246 CO 0.00 0.56 1.21 0.00 -0.31 0.00 0.00 175.10 176.55 1r43 n GLN 247 N 3.32 1.35 -1.53 4.82 6.02 -0.18 -1.65 117.38 129.52 1r43 n GLN 247 Ca -0.18 0.48 -0.34 0.00 -0.01 0.00 0.00 57.00 56.95 1r43 n GLN 247 Cb 0.53 -2.01 0.08 0.00 1.02 0.00 0.00 30.24 29.86 1r43 n GLN 247 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1r43 s ALA 248 N -0.20 2.24 0.03 -1.58 0.00 -0.10 -4.72 121.76 117.42 1r43 s ALA 248 Ca 0.72 0.72 -0.12 0.00 0.00 0.00 0.00 51.96 53.27 1r43 s ALA 248 Cb -0.80 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 18.93 1r43 s ALA 248 CO 0.52 -1.66 0.26 1.52 0.00 0.00 0.00 175.76 176.40 1r43 s TYR 249 N -2.18 -0.06 -0.04 0.00 -0.85 0.62 -1.41 117.35 113.43 1r43 s TYR 249 Ca 0.71 -0.05 0.03 0.00 -0.52 0.00 0.00 57.07 57.24 1r43 s TYR 249 Cb -0.25 0.05 0.01 0.00 0.38 0.00 0.00 41.96 42.14 1r43 s TYR 249 CO 0.44 -0.44 -0.12 1.21 -1.52 0.00 0.00 175.55 175.12 1r43 s ASN 250 N -1.87 1.64 -0.15 -0.18 2.47 -0.48 -0.05 114.94 116.32 1r43 s ASN 250 Ca -0.07 -0.27 0.01 0.00 0.42 0.00 0.00 52.86 52.95 1r43 s ASN 250 Cb -0.02 -0.56 0.00 0.00 -1.45 0.00 0.00 41.25 39.22 1r43 s ASN 250 CO -0.02 0.08 -0.18 0.26 -3.72 0.00 0.00 177.10 173.52 1r43 s TRP 251 N 0.32 2.73 0.23 0.43 0.51 0.15 -1.23 118.94 122.08 1r43 s TRP 251 Ca -0.07 -1.18 0.10 0.00 -2.12 0.00 0.00 56.10 52.83 1r43 s TRP 251 Cb -0.12 -1.85 -0.05 0.00 -0.81 0.00 0.00 33.47 30.64 1r43 s TRP 251 CO 0.02 -0.54 -0.18 -1.14 -0.51 0.00 0.00 176.95 174.60 1r43 s GLN 252 N 0.82 1.47 -0.12 4.98 0.74 -0.09 -0.52 119.66 126.93 1r43 s GLN 252 Ca -0.06 -1.62 -0.01 0.00 0.05 0.00 0.00 55.36 53.71 1r43 s GLN 252 Cb -0.15 -1.46 0.03 0.00 1.10 0.00 0.00 33.01 32.53 1r43 s GLN 252 CO -0.01 0.27 -0.03 0.21 -0.55 0.00 0.00 175.29 175.18 1r43 s LYS 253 N -3.38 1.12 -0.18 1.67 2.20 0.14 -0.51 119.74 120.81 1r43 s LYS 253 Ca 0.24 -0.23 -0.08 0.00 -0.36 0.00 0.00 55.97 55.54 1r43 s LYS 253 Cb -0.04 -1.57 -0.04 0.00 -1.51 0.00 0.00 37.83 34.66 1r43 s LYS 253 CO 0.10 -0.37 0.09 0.08 -0.36 0.00 0.00 175.35 174.90 1r43 s VAL 254 N 1.79 5.05 -0.17 4.02 1.01 -0.32 -0.50 120.40 131.28 1r43 s VAL 254 Ca 0.03 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1r43 s VAL 254 Cb -0.14 -3.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 1r43 s VAL 254 CO -0.07 0.48 -0.11 -0.89 0.00 0.00 0.00 175.10 174.50 1r43 s THR 255 N 0.16 2.98 -0.19 3.92 2.01 0.74 -1.68 115.64 123.59 1r43 s THR 255 Ca 0.06 -0.65 -0.09 0.00 0.31 0.00 0.00 61.69 61.32 1r43 s THR 255 Cb -0.12 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 1r43 s THR 255 CO -0.00 0.49 0.09 -0.69 -0.69 0.00 0.00 174.62 173.82 1r43 s VAL 256 N 0.94 5.08 -0.20 3.82 1.01 0.40 -1.14 120.40 130.31 1r43 s VAL 256 Ca -0.02 0.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.98 1r43 s VAL 256 Cb -0.15 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 1r43 s VAL 256 CO -0.01 0.45 0.01 -1.00 0.00 0.00 0.00 175.10 174.55 1r43 s HIS 257 N 0.35 3.06 0.00 5.22 3.76 0.35 -1.72 115.29 126.31 1r43 s HIS 257 Ca 0.05 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.56 1r43 s HIS 257 Cb -0.12 -2.09 0.00 0.00 1.11 0.00 0.00 32.58 31.48 1r43 s HIS 257 CO -0.01 -0.21 0.00 0.41 -0.85 0.00 0.00 174.74 174.08 1r43 n GLY 258 N 4.22 5.38 2.81 -2.22 0.00 0.70 -3.03 105.19 113.05 1r43 n GLY 258 Ca -0.17 -1.18 -0.23 0.00 0.00 0.00 0.00 46.02 44.44 1r43 n GLY 258 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r43 s VAL 259 N 3.00 0.50 -0.17 1.61 1.01 -0.63 -4.82 120.40 120.89 1r43 s VAL 259 Ca 0.00 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.71 1r43 s VAL 259 Cb 0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 1r43 s VAL 259 CO 0.00 0.27 1.44 -0.83 0.00 0.00 0.00 175.10 175.98 1r43 s GLY 260 N 1.76 1.48 0.00 4.51 0.00 -1.26 -4.18 107.32 109.63 1r43 s GLY 260 Ca 0.02 0.53 -0.13 0.00 0.00 0.00 0.00 44.72 45.14 1r43 s GLY 260 CO -0.05 2.75 0.27 0.00 0.00 0.00 0.00 173.10 176.08 1r43 s ALA 261 N 4.14 -0.66 0.33 3.20 0.00 -1.19 -4.94 121.76 122.65 1r43 s ALA 261 Ca 0.63 0.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.44 1r43 s ALA 261 Cb -0.24 0.15 -0.12 0.00 0.00 0.00 0.00 23.12 22.91 1r43 s ALA 261 CO 0.23 -0.29 1.49 1.58 0.00 0.00 0.00 175.76 178.77 1r43 n HIS 262 N 1.11 2.78 1.39 0.00 -0.00 -1.26 -0.05 115.22 119.19 1r43 n HIS 262 Ca -0.21 0.39 0.14 0.00 0.46 0.00 0.00 57.72 58.50 1r43 n HIS 262 Cb 0.57 -2.53 0.73 0.00 -0.12 0.00 0.00 29.99 28.63 1r43 n HIS 262 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1r43 n ALA 263 N 1.15 2.41 -0.10 1.57 0.00 0.41 -2.90 120.51 123.05 1r43 n ALA 263 Ca 0.05 -0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.22 1r43 n ALA 263 Cb 0.37 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 18.27 1r43 n ALA 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r43 n GLY 264 N 1.05 -0.35 0.01 0.00 0.00 -1.26 -4.66 105.19 99.98 1r43 n GLY 264 Ca 0.14 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.13 1r43 n GLY 264 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r43 n THR 265 N -3.01 0.06 -3.55 2.61 -2.24 -1.24 -4.78 114.28 102.13 1r43 n THR 265 Ca -0.34 -0.05 -0.41 0.00 -2.27 0.00 0.00 64.05 60.98 1r43 n THR 265 Cb 0.90 0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 69.22 1r43 n THR 265 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1r43 s THR 266 N -3.04 4.92 0.52 4.28 2.01 -1.14 -5.03 115.64 118.17 1r43 s THR 266 Ca 0.10 -0.64 -0.16 0.00 0.31 0.00 0.00 61.69 61.30 1r43 s THR 266 Cb 0.17 -3.68 -0.07 0.00 0.01 0.00 0.00 72.50 68.92 1r43 s THR 266 CO 0.71 -0.19 0.98 -2.16 -0.69 0.00 0.00 174.62 173.27 1r43 s PRO 267 N 1.63 3.90 0.16 4.92 0.04 -1.26 -4.84 135.00 139.55 1r43 s PRO 267 Ca 0.04 0.91 -0.14 0.00 0.04 0.00 0.00 61.00 61.85 1r43 s PRO 267 Cb -0.19 -2.14 0.15 0.00 0.04 0.00 0.00 34.50 32.36 1r43 s PRO 267 CO 0.08 -0.30 1.14 0.91 0.04 0.00 0.00 177.00 178.88 1r43 n TRP 268 N -1.71 -0.03 0.53 0.56 7.02 -1.26 -0.51 117.44 122.05 1r43 n TRP 268 Ca 0.06 0.91 0.06 0.00 -1.02 0.00 0.00 57.50 57.51 1r43 n TRP 268 Cb 0.54 -0.74 0.29 0.00 -2.42 0.00 0.00 31.31 28.98 1r43 n TRP 268 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 1r43 n ARG 269 N -5.06 0.12 -0.06 -0.99 1.85 -1.26 -2.71 116.66 108.55 1r43 n ARG 269 Ca 0.07 0.21 0.02 0.00 -1.00 0.00 0.00 57.85 57.14 1r43 n ARG 269 Cb 0.28 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.22 1r43 n ARG 269 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1r43 n LEU 270 N -1.35 1.39 -4.93 2.89 4.77 0.33 -1.88 117.00 118.23 1r43 n LEU 270 Ca 0.05 -1.62 -0.26 0.00 -0.03 0.00 0.00 56.01 54.15 1r43 n LEU 270 Cb 0.11 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1r43 n LEU 270 CO 0.10 0.39 0.15 0.00 -1.33 0.00 0.00 177.39 176.70 1r43 s ARG 271 N -1.01 3.53 -0.48 3.23 1.70 -1.10 -4.88 118.95 119.94 1r43 s ARG 271 Ca 0.06 -0.24 0.05 0.00 -0.47 0.00 0.00 55.73 55.13 1r43 s ARG 271 Cb 0.05 -2.70 0.20 0.00 -0.57 0.00 0.00 34.95 31.93 1r43 s ARG 271 CO 0.01 0.23 0.45 1.63 -1.08 0.00 0.00 175.30 176.53 1r43 n LYS 272 N -1.29 0.84 -2.73 3.89 5.02 -1.26 -4.01 118.16 118.62 1r43 n LYS 272 Ca -0.04 -3.57 -0.43 0.00 -2.02 0.00 0.00 58.31 52.25 1r43 n LYS 272 Cb 0.55 -1.73 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 1r43 n LYS 272 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1r43 s ASP 273 N -0.76 6.63 0.39 4.39 -1.08 -1.26 -1.61 116.67 123.36 1r43 s ASP 273 Ca 0.33 0.43 0.21 0.00 -0.52 0.00 0.00 52.55 52.99 1r43 s ASP 273 Cb 0.07 -2.49 0.63 0.00 -1.46 0.00 0.00 42.92 39.67 1r43 s ASP 273 CO -0.16 -1.05 1.70 0.00 0.52 0.00 0.00 175.17 176.19 1r43 h ALA 274 N 8.88 0.93 0.09 3.66 0.00 -1.60 -3.26 119.26 127.96 1r43 h ALA 274 Ca -0.23 -0.29 -0.32 0.00 0.00 0.00 0.00 54.91 54.07 1r43 h ALA 274 Cb 1.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1r43 h ALA 274 CO 1.05 0.40 -1.70 1.25 0.00 0.00 0.00 179.25 180.24 1r43 h LEU 275 N 0.00 0.31 -1.50 0.00 5.85 -1.91 0.03 115.31 118.09 1r43 h LEU 275 Ca -0.00 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.17 1r43 h LEU 275 Cb 0.95 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.88 1r43 h LEU 275 CO 0.04 1.47 0.00 -0.11 -0.34 0.00 0.00 178.44 179.50 1r43 n LEU 276 N -3.37 0.19 0.00 2.25 7.94 -1.23 -0.89 117.00 121.89 1r43 n LEU 276 Ca -0.21 -0.10 0.00 0.00 -1.11 0.00 0.00 56.01 54.60 1r43 n LEU 276 Cb 1.05 -0.05 0.00 0.00 0.53 0.00 0.00 43.42 44.95 1r43 n LEU 276 CO 0.47 0.04 0.00 -1.20 -1.11 0.00 0.00 177.39 175.59 1r43 n SER 278 N 0.70 0.00 0.23 1.96 7.64 -0.00 -2.04 113.62 122.11 1r43 n SER 278 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 1r43 n SER 278 Cb 0.04 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.16 1r43 n SER 278 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1r43 h SER 279 N 0.00 -0.52 0.00 6.43 0.02 -1.28 -1.10 113.55 117.10 1r43 h SER 279 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1r43 h SER 279 Cb 0.00 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1r43 h SER 279 CO 0.00 -0.35 0.00 0.29 -1.14 0.00 0.00 176.83 175.63 1r43 n LYS 280 N -5.34 0.00 0.00 3.45 5.02 -0.87 -1.77 118.16 118.65 1r43 n LYS 280 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 1r43 n LYS 280 Cb 0.25 -0.87 0.00 0.00 -0.02 0.00 0.00 35.03 34.39 1r43 n LYS 280 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1r43 n ILE 282 N 0.46 0.00 -0.21 -0.18 5.41 -0.42 -1.60 119.36 122.82 1r43 n ILE 282 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.72 1r43 n ILE 282 Cb 0.00 0.00 0.07 0.00 -0.71 0.00 0.00 39.64 39.00 1r43 n ILE 282 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1r43 h VAL 283 N 0.00 1.00 -0.37 1.39 2.07 -1.62 -2.17 116.25 116.55 1r43 h VAL 283 Ca 0.00 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 1r43 h VAL 283 Cb 0.00 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1r43 h VAL 283 CO 0.00 0.12 0.22 0.00 0.02 0.00 0.00 177.57 177.93 1r43 h ALA 284 N 1.30 0.47 0.00 1.67 0.00 -1.55 -1.95 119.26 119.20 1r43 h ALA 284 Ca 0.26 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1r43 h ALA 284 Cb 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1r43 h ALA 284 CO -0.15 -0.03 -0.26 0.00 0.00 0.00 0.00 179.25 178.81 1r43 h ALA 285 N 1.10 1.51 0.07 0.00 0.00 -1.77 -2.22 119.26 117.94 1r43 h ALA 285 Ca 0.13 -0.24 -0.26 0.00 0.00 0.00 0.00 54.91 54.54 1r43 h ALA 285 Cb 0.01 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1r43 h ALA 285 CO -0.02 0.33 -1.11 1.03 0.00 0.00 0.00 179.25 179.48 1r43 h SER 286 N 0.00 0.60 -0.45 0.00 0.87 -0.87 -1.57 113.55 112.12 1r43 h SER 286 Ca -0.00 -0.54 -0.03 0.00 -1.23 0.00 0.00 61.79 59.99 1r43 h SER 286 Cb 0.48 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1r43 h SER 286 CO 0.03 1.37 0.17 -0.33 -0.53 0.00 0.00 176.83 177.54 1r43 h GLU 287 N 0.20 0.68 -0.13 2.24 5.08 -1.05 -2.16 114.58 119.44 1r43 h GLU 287 Ca -0.12 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.11 1r43 h GLU 287 Cb 1.78 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.91 1r43 h GLU 287 CO 0.20 0.63 0.06 0.82 -1.00 0.00 0.00 179.01 179.72 1r43 h ILE 288 N 0.59 0.99 -0.07 3.13 2.04 -1.25 0.24 117.51 123.18 1r43 h ILE 288 Ca 0.15 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.96 1r43 h ILE 288 Cb 0.22 0.84 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1r43 h ILE 288 CO -0.01 0.02 0.05 0.00 0.00 0.00 0.00 178.15 178.21 1r43 h ALA 289 N 1.07 0.09 -0.99 1.87 0.00 -1.27 -2.24 119.26 117.79 1r43 h ALA 289 Ca 0.05 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1r43 h ALA 289 Cb 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1r43 h ALA 289 CO -0.04 -0.42 0.65 1.96 0.00 0.00 0.00 179.25 181.40 1r43 h GLN 290 N 0.09 1.20 -0.18 0.00 4.20 -1.02 -0.49 115.11 118.91 1r43 h GLN 290 Ca 0.03 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.70 1r43 h GLN 290 Cb -0.01 -0.27 -0.04 0.00 0.30 0.00 0.00 27.48 27.46 1r43 h GLN 290 CO -0.01 0.79 -0.06 0.00 -0.67 0.00 0.00 178.83 178.88 1r43 h ARG 291 N 1.23 -0.03 -0.10 1.46 3.08 -0.61 -1.98 114.38 117.44 1r43 h ARG 291 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1r43 h ARG 291 Cb 0.05 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1r43 h ARG 291 CO -0.13 -0.02 0.00 0.72 -1.07 0.00 0.00 179.97 179.47 1r43 n HIS 292 N -5.21 0.13 -3.15 3.04 8.25 -0.83 -4.90 115.22 112.55 1r43 n HIS 292 Ca -0.03 -0.07 -0.23 0.00 -0.26 0.00 0.00 57.72 57.14 1r43 n HIS 292 Cb 0.13 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.29 1r43 n HIS 292 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1r43 n ASN 293 N -0.22 -6.24 -0.24 0.41 4.05 -0.44 -5.01 115.26 107.58 1r43 n ASN 293 Ca 0.11 -0.34 0.00 0.00 0.45 0.00 0.00 54.58 54.80 1r43 n ASN 293 Cb 0.16 -5.01 0.00 0.00 1.23 0.00 0.00 39.78 36.16 1r43 n ASN 293 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1r43 n GLY 294 N -1.64 5.17 3.15 8.20 0.00 -0.32 -4.92 105.19 114.82 1r43 n GLY 294 Ca -0.09 -2.05 -0.24 0.00 0.00 0.00 0.00 46.02 43.64 1r43 n GLY 294 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r43 s LEU 295 N 0.00 2.02 -0.03 0.99 1.43 0.21 -4.30 118.68 119.01 1r43 s LEU 295 Ca 0.00 -0.30 0.03 0.00 -1.03 0.00 0.00 54.13 52.83 1r43 s LEU 295 Cb 0.00 -0.85 -0.00 0.00 0.03 0.00 0.00 46.19 45.37 1r43 s LEU 295 CO 0.00 0.20 -0.11 0.12 0.23 0.00 0.00 176.35 176.79 1r43 s PHE 296 N -0.36 1.13 -0.02 0.29 5.36 -1.26 -0.54 117.98 122.59 1r43 s PHE 296 Ca 0.06 -0.28 0.02 0.00 -0.96 0.00 0.00 56.93 55.76 1r43 s PHE 296 Cb -0.07 -0.78 0.00 0.00 -0.34 0.00 0.00 43.02 41.84 1r43 s PHE 296 CO -0.01 -0.10 -0.06 0.99 -1.46 0.00 0.00 175.22 174.59 1r43 s THR 297 N 0.08 0.52 -0.31 0.12 2.01 0.77 -4.92 115.64 113.90 1r43 s THR 297 Ca -0.02 -0.23 -0.06 0.00 0.31 0.00 0.00 61.69 61.69 1r43 s THR 297 Cb -0.08 -0.47 0.03 0.00 0.01 0.00 0.00 72.50 71.98 1r43 s THR 297 CO 0.01 0.17 0.08 0.00 -0.69 0.00 0.00 174.62 174.19 1r43 n GLY 299 N 4.82 -0.47 2.86 0.00 0.00 -1.26 -4.92 105.19 106.21 1r43 n GLY 299 Ca -0.14 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.31 1r43 n GLY 299 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r43 s ILE 300 N -2.61 0.42 0.04 -0.61 1.01 -1.26 -5.05 121.20 113.14 1r43 s ILE 300 Ca 0.01 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 60.64 1r43 s ILE 300 Cb 0.10 -0.49 -0.02 0.00 0.01 0.00 0.00 42.46 42.06 1r43 s ILE 300 CO 0.59 0.21 -0.07 -0.51 0.00 0.00 0.00 174.94 175.16 1r43 s ILE 301 N 1.11 0.46 -0.20 2.92 2.07 -1.26 -1.64 121.20 124.66 1r43 s ILE 301 Ca -0.08 -1.00 -0.14 0.00 -1.41 0.00 0.00 60.65 58.02 1r43 s ILE 301 Cb -0.14 -0.54 0.06 0.00 0.13 0.00 0.00 42.46 41.97 1r43 s ILE 301 CO -0.01 -0.37 0.50 -1.81 -1.91 0.00 0.00 174.94 171.34 1r43 s ASP 302 N -1.47 -0.59 -0.02 4.50 1.01 0.03 -4.99 116.67 115.15 1r43 s ASP 302 Ca -0.10 1.06 0.05 0.00 0.71 0.00 0.00 52.55 54.26 1r43 s ASP 302 Cb -0.09 1.00 -0.03 0.00 1.01 0.00 0.00 42.92 44.81 1r43 s ASP 302 CO 0.00 -0.19 -0.15 0.00 0.21 0.00 0.00 175.17 175.04 1r43 s ALA 303 N 0.89 2.68 0.08 5.23 0.00 -1.26 -1.09 121.76 128.29 1r43 s ALA 303 Ca -0.05 -1.05 0.08 0.00 0.00 0.00 0.00 51.96 50.94 1r43 s ALA 303 Cb -0.05 -0.91 -0.04 0.00 0.00 0.00 0.00 23.12 22.11 1r43 s ALA 303 CO -0.07 0.57 -0.16 0.15 0.00 0.00 0.00 175.76 176.24 1r43 s LYS 304 N -1.02 1.97 0.00 0.00 1.02 0.13 -3.60 119.74 118.24 1r43 s LYS 304 Ca 0.13 -1.07 0.24 0.00 0.02 0.00 0.00 55.97 55.30 1r43 s LYS 304 Cb -0.11 -2.18 1.13 0.00 -0.52 0.00 0.00 37.83 36.15 1r43 s LYS 304 CO 0.03 0.51 1.77 -0.35 -0.92 0.00 0.00 175.35 176.39 1r43 n PRO 305 N 1.08 1.41 -2.07 -1.68 -0.04 -1.26 -1.42 135.00 131.03 1r43 n PRO 305 Ca -0.15 -0.61 -0.01 0.00 -0.04 0.00 0.00 63.50 62.69 1r43 n PRO 305 Cb 0.52 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 1r43 n PRO 305 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1r43 n TYR 306 N -0.21 -1.17 -3.83 0.54 9.36 -1.24 -5.10 117.16 115.51 1r43 n TYR 306 Ca 0.18 0.45 -0.12 0.00 3.32 0.00 0.00 57.90 61.73 1r43 n TYR 306 Cb 0.24 -2.48 -0.10 0.00 -0.63 0.00 0.00 39.34 36.37 1r43 n TYR 306 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 1r43 s SER 307 N -2.18 -0.06 0.39 2.98 0.01 -1.26 -5.04 113.70 108.54 1r43 s SER 307 Ca 0.02 -0.07 0.08 0.00 1.31 0.00 0.00 55.95 57.30 1r43 s SER 307 Cb -0.01 0.26 0.84 0.00 0.21 0.00 0.00 66.02 67.32 1r43 s SER 307 CO 0.28 -0.38 1.99 0.58 0.41 0.00 0.00 173.24 176.13 1r43 h VAL 308 N 4.17 1.02 -0.15 3.43 2.07 -2.04 -2.97 116.25 121.78 1r43 h VAL 308 Ca -0.30 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1r43 h VAL 308 Cb 1.19 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1r43 h VAL 308 CO 0.40 0.11 -0.07 -0.46 0.02 0.00 0.00 177.57 177.58 1r43 n ASN 309 N -4.47 2.83 -4.22 0.57 6.94 -1.26 -4.92 115.26 110.72 1r43 n ASN 309 Ca 0.08 -3.28 -0.31 0.00 -0.02 0.00 0.00 54.58 51.05 1r43 n ASN 309 Cb 0.21 -0.52 -0.17 0.00 -2.36 0.00 0.00 39.78 36.95 1r43 n ASN 309 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1r43 s ILE 310 N -2.97 2.01 0.15 1.53 1.01 -1.12 -0.44 121.20 121.37 1r43 s ILE 310 Ca 0.38 -1.00 -0.31 0.00 0.00 0.00 0.00 60.65 59.71 1r43 s ILE 310 Cb 0.33 -1.73 -0.10 0.00 0.01 0.00 0.00 42.46 40.97 1r43 s ILE 310 CO 0.03 0.55 1.67 -0.63 0.00 0.00 0.00 174.94 176.57 1r43 s ILE 311 N 0.24 2.53 0.10 2.92 1.01 0.93 -4.58 121.20 124.35 1r43 s ILE 311 Ca -0.15 0.27 -0.31 0.00 0.00 0.00 0.00 60.65 60.46 1r43 s ILE 311 Cb -0.17 -3.17 -0.09 0.00 0.01 0.00 0.00 42.46 39.03 1r43 s ILE 311 CO 0.08 0.01 1.71 -2.84 0.00 0.00 0.00 174.94 173.90 1r43 s PRO 312 N 1.72 4.18 0.00 2.79 0.02 -1.26 -3.16 135.00 139.29 1r43 s PRO 312 Ca 0.74 2.43 0.24 0.00 0.02 0.00 0.00 61.00 64.43 1r43 s PRO 312 Cb -0.45 -3.55 0.35 0.00 0.02 0.00 0.00 34.50 30.88 1r43 s PRO 312 CO 0.33 -0.76 1.31 0.41 -0.33 0.00 0.00 177.00 177.96 1r43 n GLY 313 N 4.06 -0.26 3.39 0.52 0.00 -0.51 -1.50 105.19 110.90 1r43 n GLY 313 Ca 0.16 -0.53 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1r43 n GLY 313 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r43 s GLU 314 N -2.48 0.54 -0.02 1.61 2.12 -1.12 -0.22 118.70 119.13 1r43 s GLU 314 Ca 0.21 0.82 0.01 0.00 0.36 0.00 0.00 54.97 56.37 1r43 s GLU 314 Cb 0.19 0.15 0.01 0.00 0.26 0.00 0.00 34.13 34.74 1r43 s GLU 314 CO 0.55 -0.11 -0.04 0.08 -0.54 0.00 0.00 175.26 175.19 1r43 s VAL 315 N 0.89 0.37 -0.10 3.70 1.01 -0.70 -0.69 120.40 124.89 1r43 s VAL 315 Ca -0.05 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1r43 s VAL 315 Cb -0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 1r43 s VAL 315 CO -0.07 0.14 -0.19 -0.44 0.00 0.00 0.00 175.10 174.54 1r43 s SER 316 N 0.38 3.51 0.05 3.32 0.01 -0.25 -0.45 113.70 120.26 1r43 s SER 316 Ca -0.04 -0.44 -0.02 0.00 1.31 0.00 0.00 55.95 56.77 1r43 s SER 316 Cb -0.08 -1.35 -0.04 0.00 0.21 0.00 0.00 66.02 64.77 1r43 s SER 316 CO -0.00 0.19 -0.01 0.72 0.41 0.00 0.00 173.24 174.54 1r43 s PHE 317 N 0.18 0.49 0.20 2.43 -0.12 -0.68 -0.79 117.98 119.69 1r43 s PHE 317 Ca -0.11 -1.03 0.06 0.00 -0.05 0.00 0.00 56.93 55.80 1r43 s PHE 317 Cb -0.16 -0.36 -0.04 0.00 -0.63 0.00 0.00 43.02 41.83 1r43 s PHE 317 CO 0.06 -0.39 0.12 0.95 -0.05 0.00 0.00 175.22 175.91 1r43 s THR 318 N -3.91 4.28 -0.08 -4.49 -4.23 -0.65 -1.17 115.64 105.39 1r43 s THR 318 Ca 0.07 -1.28 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 1r43 s THR 318 Cb 0.08 -3.22 0.02 0.00 1.34 0.00 0.00 72.50 70.71 1r43 s THR 318 CO -0.10 -0.19 -0.10 -0.76 -0.54 0.00 0.00 174.62 172.93 1r43 s LEU 319 N -3.31 1.44 -0.39 4.79 1.02 0.34 -4.23 118.68 118.33 1r43 s LEU 319 Ca 0.31 -0.28 -0.04 0.00 0.02 0.00 0.00 54.13 54.14 1r43 s LEU 319 Cb -0.09 -0.79 0.09 0.00 0.02 0.00 0.00 46.19 45.42 1r43 s LEU 319 CO 0.23 -0.03 0.19 -0.62 0.02 0.00 0.00 176.35 176.13 1r43 s ASP 320 N 1.08 5.29 -0.05 2.29 -1.08 0.91 -0.91 116.67 124.20 1r43 s ASP 320 Ca -0.07 -1.78 -0.02 0.00 -0.52 0.00 0.00 52.55 50.16 1r43 s ASP 320 Cb -0.14 -1.85 -0.04 0.00 -1.46 0.00 0.00 42.92 39.43 1r43 s ASP 320 CO -0.01 -0.50 0.06 -0.36 0.52 0.00 0.00 175.17 174.88 1r43 s PHE 321 N 1.23 3.28 -0.11 -5.34 0.40 -0.37 -0.16 117.98 116.92 1r43 s PHE 321 Ca 0.05 0.25 -0.12 0.00 -0.60 0.00 0.00 56.93 56.50 1r43 s PHE 321 Cb -0.22 -1.78 0.03 0.00 0.51 0.00 0.00 43.02 41.55 1r43 s PHE 321 CO -0.02 0.55 0.33 1.03 0.70 0.00 0.00 175.22 177.81 1r43 s ARG 322 N -1.33 0.44 -0.28 0.44 0.52 0.30 -1.38 118.95 117.65 1r43 s ARG 322 Ca 0.18 0.34 -0.24 0.00 -0.52 0.00 0.00 55.73 55.50 1r43 s ARG 322 Cb -0.12 0.21 0.13 0.00 0.52 0.00 0.00 34.95 35.70 1r43 s ARG 322 CO 0.08 -0.07 1.08 -1.58 0.02 0.00 0.00 175.30 174.83 1r43 s HIS 323 N -0.10 -0.43 0.39 -0.53 2.46 -0.50 -0.62 115.29 115.96 1r43 s HIS 323 Ca -0.03 1.02 0.19 0.00 0.47 0.00 0.00 55.06 56.71 1r43 s HIS 323 Cb -0.03 0.37 1.12 0.00 -0.13 0.00 0.00 32.58 33.92 1r43 s HIS 323 CO 0.01 -0.21 1.74 -1.35 -2.47 0.00 0.00 174.74 172.46 1r43 h PRO 324 N 4.25 0.36 -5.43 2.88 0.11 -1.91 -0.23 132.00 132.03 1r43 h PRO 324 Ca -0.28 -0.02 -0.63 0.00 0.11 0.00 0.00 66.00 65.18 1r43 h PRO 324 Cb 1.18 -0.08 -0.10 0.00 0.11 0.00 0.00 31.00 32.11 1r43 h PRO 324 CO 0.12 0.24 -0.49 0.45 -0.21 0.00 0.00 178.00 178.12 1r43 s SER 325 N -5.12 6.28 0.16 -2.05 0.15 -1.26 -4.44 113.70 107.41 1r43 s SER 325 Ca -0.09 0.33 -0.14 0.00 0.70 0.00 0.00 55.95 56.75 1r43 s SER 325 Cb 0.26 -2.08 0.04 0.00 -1.71 0.00 0.00 66.02 62.54 1r43 s SER 325 CO 0.80 0.28 1.77 0.44 1.20 0.00 0.00 173.24 177.72 1r43 h ASP 326 N 5.96 0.61 -0.75 5.45 3.45 -1.98 -1.51 116.42 127.66 1r43 h ASP 326 Ca -0.47 -0.09 -0.01 0.00 0.43 0.00 0.00 57.03 56.89 1r43 h ASP 326 Cb 1.18 -0.16 -0.04 0.00 -0.56 0.00 0.00 39.33 39.76 1r43 h ASP 326 CO 0.68 0.53 0.41 0.44 -1.57 0.00 0.00 179.24 179.73 1r43 h ASP 327 N 0.65 0.93 -0.27 6.45 3.32 -1.97 -1.41 116.42 124.12 1r43 h ASP 327 Ca 0.17 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 1r43 h ASP 327 Cb 0.05 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 1r43 h ASP 327 CO -0.03 0.76 -0.27 0.58 -1.72 0.00 0.00 179.24 178.56 1r43 h VAL 328 N 1.03 1.31 -0.82 -1.35 2.07 -1.93 -1.41 116.25 115.14 1r43 h VAL 328 Ca 0.26 -1.44 0.16 0.00 0.82 0.00 0.00 66.70 66.51 1r43 h VAL 328 Cb 0.03 1.62 -0.10 0.00 -1.52 0.00 0.00 31.29 31.32 1r43 h VAL 328 CO -0.04 0.46 0.37 0.25 0.02 0.00 0.00 177.57 178.62 1r43 h LEU 329 N 0.38 0.37 -0.81 2.57 5.85 -1.11 -0.46 115.31 122.10 1r43 h LEU 329 Ca 0.04 0.11 -0.10 0.00 0.84 0.00 0.00 57.88 58.77 1r43 h LEU 329 Cb 0.83 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 1r43 h LEU 329 CO 0.07 0.12 -0.22 0.00 -0.34 0.00 0.00 178.44 178.06 1r43 h ALA 330 N 1.59 0.99 0.00 1.25 0.00 -0.92 -2.36 119.26 119.81 1r43 h ALA 330 Ca 0.47 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1r43 h ALA 330 Cb 0.74 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1r43 h ALA 330 CO -0.42 0.60 0.00 2.41 0.00 0.00 0.00 179.25 181.83 1r43 n THR 331 N -4.12 0.04 0.00 0.00 -1.04 -0.18 -1.86 114.28 107.11 1r43 n THR 331 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1r43 n THR 331 Cb 0.41 -0.21 0.00 0.00 -1.82 0.00 0.00 70.33 68.71 1r43 n THR 331 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1r43 n LEU 333 N 0.54 0.00 -0.26 -4.42 4.77 -0.89 -1.44 117.00 115.31 1r43 n LEU 333 Ca 0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 1r43 n LEU 333 Cb 0.05 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.28 1r43 n LEU 333 CO 0.00 0.00 1.11 0.50 -1.33 0.00 0.00 177.39 177.67 1r43 h LYS 334 N 0.00 1.10 -0.07 3.23 3.64 -1.65 -0.17 116.57 122.64 1r43 h LYS 334 Ca 0.00 -0.16 -0.13 0.00 -1.27 0.00 0.00 60.65 59.10 1r43 h LYS 334 Cb 0.00 -0.20 0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1r43 h LYS 334 CO 0.00 0.85 -0.45 0.93 -2.27 0.00 0.00 179.45 178.51 1r43 h GLU 335 N 1.09 0.43 -0.22 1.90 5.08 -1.52 -1.56 114.58 119.79 1r43 h GLU 335 Ca 0.26 -0.37 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1r43 h GLU 335 Cb 0.12 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1r43 h GLU 335 CO -0.03 1.01 0.07 0.00 -1.00 0.00 0.00 179.01 179.06 1r43 h ALA 336 N 0.43 0.24 -0.91 3.43 0.00 -1.80 0.23 119.26 120.89 1r43 h ALA 336 Ca -0.04 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1r43 h ALA 336 Cb 1.11 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1r43 h ALA 336 CO 0.09 -0.35 0.60 0.00 0.00 0.00 0.00 179.25 179.60 1r43 h ALA 337 N 1.14 1.37 -0.57 0.00 0.00 -0.99 -0.15 119.26 120.07 1r43 h ALA 337 Ca 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1r43 h ALA 337 Cb 0.07 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1r43 h ALA 337 CO -0.10 0.57 0.18 0.00 0.00 0.00 0.00 179.25 179.90 1r43 h ALA 338 N 1.44 0.74 -0.34 0.00 0.00 -0.76 -1.39 119.26 118.96 1r43 h ALA 338 Ca 0.34 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1r43 h ALA 338 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1r43 h ALA 338 CO -0.08 0.40 0.13 0.93 0.00 0.00 0.00 179.25 180.62 1r43 h GLU 339 N 0.79 0.52 -0.72 0.00 4.39 0.13 -2.60 114.58 117.08 1r43 h GLU 339 Ca 0.18 -0.10 -0.03 0.00 0.34 0.00 0.00 59.36 59.75 1r43 h GLU 339 Cb 0.28 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 1r43 h GLU 339 CO -0.01 0.52 0.31 0.74 -1.16 0.00 0.00 179.01 179.42 1r43 h PHE 340 N 0.40 1.06 -0.27 4.33 0.05 -0.95 0.93 116.94 122.49 1r43 h PHE 340 Ca 0.11 -0.06 -0.02 0.00 3.82 0.00 0.00 57.97 61.82 1r43 h PHE 340 Cb 0.20 -0.33 -0.01 0.00 2.00 0.00 0.00 35.95 37.81 1r43 h PHE 340 CO -0.00 0.79 0.07 -0.44 -0.18 0.00 0.00 178.31 178.55 1r43 h ASP 341 N 1.04 0.34 0.04 2.17 3.32 -1.12 -1.49 116.42 120.72 1r43 h ASP 341 Ca 0.25 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 1r43 h ASP 341 Cb 0.16 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1r43 h ASP 341 CO -0.03 0.34 -0.02 -0.09 -1.72 0.00 0.00 179.24 177.72 1r43 h ARG 342 N 0.37 -0.06 -0.53 3.56 2.43 -0.80 -3.36 114.38 115.99 1r43 h ARG 342 Ca 0.09 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1r43 h ARG 342 Cb 0.13 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1r43 h ARG 342 CO -0.01 0.58 0.31 -0.07 -1.51 0.00 0.00 179.97 179.28 1r43 h LEU 343 N -0.89 0.65 -2.48 3.80 4.07 -0.76 -2.70 115.31 117.00 1r43 h LEU 343 Ca -0.01 -0.07 0.02 0.00 0.08 0.00 0.00 57.88 57.91 1r43 h LEU 343 Cb 0.66 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.24 1r43 h LEU 343 CO 0.01 0.52 0.13 -0.29 -1.08 0.00 0.00 178.44 177.73 1r43 h ILE 344 N 0.71 0.22 -0.02 1.22 6.09 -1.42 -1.40 117.51 122.92 1r43 h ILE 344 Ca 0.19 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.68 1r43 h ILE 344 Cb 0.00 0.88 0.00 0.00 0.47 0.00 0.00 36.82 38.17 1r43 h ILE 344 CO -0.03 0.00 -0.22 0.29 -3.07 0.00 0.00 178.15 175.11 1r43 n LYS 345 N -3.38 1.69 -3.30 2.19 4.76 -1.02 -2.11 118.16 116.99 1r43 n LYS 345 Ca -0.01 -1.35 -0.46 0.00 -2.87 0.00 0.00 58.31 53.62 1r43 n LYS 345 Cb 0.22 -1.47 -0.05 0.00 -1.84 0.00 0.00 35.03 31.88 1r43 n LYS 345 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1r43 s ILE 346 N -2.24 5.18 -0.29 -0.18 1.01 -0.53 -4.64 121.20 119.50 1r43 s ILE 346 Ca 0.25 -1.39 -0.16 0.00 0.00 0.00 0.00 60.65 59.34 1r43 s ILE 346 Cb 0.19 -4.32 0.18 0.00 0.01 0.00 0.00 42.46 38.52 1r43 s ILE 346 CO 0.43 -0.85 1.11 0.21 0.00 0.00 0.00 174.94 175.85 1r43 s ASN 347 N 3.46 -0.31 0.18 3.58 2.47 -1.26 -5.02 114.94 118.04 1r43 s ASN 347 Ca 0.04 0.48 -0.11 0.00 0.42 0.00 0.00 52.86 53.68 1r43 s ASN 347 Cb -0.29 1.18 0.10 0.00 -1.45 0.00 0.00 41.25 40.79 1r43 s ASN 347 CO 0.04 -0.07 1.76 0.44 -3.72 0.00 0.00 177.10 175.54 1r43 h ASP 348 N 5.95 0.86 0.06 -4.21 3.32 -1.87 -1.70 116.42 118.83 1r43 h ASP 348 Ca -0.25 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1r43 h ASP 348 Cb 1.16 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1r43 h ASP 348 CO 0.19 0.77 0.00 0.61 -1.72 0.00 0.00 179.24 179.09 1r43 n GLY 349 N -0.90 -0.40 0.00 2.75 0.00 -0.79 -4.86 105.19 100.99 1r43 n GLY 349 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1r43 n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r43 n GLY 350 N -0.41 2.45 3.77 -0.02 0.00 -0.64 -4.86 105.19 105.48 1r43 n GLY 350 Ca 0.07 -1.98 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 1r43 n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r43 s ALA 351 N -2.66 3.41 0.49 4.61 0.00 -1.26 -4.65 121.76 121.69 1r43 s ALA 351 Ca 0.00 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1r43 s ALA 351 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1r43 s ALA 351 CO 0.00 -1.14 0.00 1.28 0.00 0.00 0.00 175.76 175.90 1r43 n LEU 352 N 0.12 0.00 -3.71 0.00 4.77 -0.90 -5.05 117.00 112.24 1r43 n LEU 352 Ca 0.03 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.91 1r43 n LEU 352 Cb 0.40 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.44 1r43 n LEU 352 CO 0.61 -0.38 0.14 -0.94 -1.33 0.00 0.00 177.39 175.49 1r43 s SER 353 N -1.00 -0.17 -0.01 -1.43 1.04 -1.17 -4.78 113.70 106.18 1r43 s SER 353 Ca 0.00 -0.45 -0.14 0.00 0.48 0.00 0.00 55.95 55.84 1r43 s SER 353 Cb 0.00 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.62 1r43 s SER 353 CO 0.00 -0.89 0.29 -0.72 0.98 0.00 0.00 173.24 172.91 1r43 s TYR 354 N -3.84 -0.15 0.11 5.02 -0.85 -1.26 -0.49 117.35 115.88 1r43 s TYR 354 Ca 0.06 0.19 0.08 0.00 -0.52 0.00 0.00 57.07 56.88 1r43 s TYR 354 Cb 0.02 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.40 1r43 s TYR 354 CO -0.09 -0.39 -0.19 -1.21 -1.52 0.00 0.00 175.55 172.15 1r43 s GLU 355 N -1.47 1.10 0.08 -3.49 8.01 -0.29 -4.98 118.70 117.67 1r43 s GLU 355 Ca -0.13 -1.19 0.07 0.00 0.01 0.00 0.00 54.97 53.73 1r43 s GLU 355 Cb -0.05 -1.25 -0.03 0.00 -4.31 0.00 0.00 34.13 28.49 1r43 s GLU 355 CO 0.03 0.28 -0.18 -1.54 0.01 0.00 0.00 175.26 173.86 1r43 s SER 356 N -2.09 2.19 0.02 -0.19 1.04 -1.26 -0.18 113.70 113.23 1r43 s SER 356 Ca 0.07 -0.64 0.01 0.00 0.48 0.00 0.00 55.95 55.87 1r43 s SER 356 Cb -0.09 -0.11 -0.02 0.00 0.10 0.00 0.00 66.02 65.91 1r43 s SER 356 CO 0.04 0.02 -0.04 -1.83 0.98 0.00 0.00 173.24 172.41 1r43 s GLU 357 N -1.77 0.35 -0.14 4.02 -1.05 0.35 -4.95 118.70 115.51 1r43 s GLU 357 Ca 0.03 -0.55 -0.25 0.00 -0.15 0.00 0.00 54.97 54.05 1r43 s GLU 357 Cb -0.10 -0.06 -0.02 0.00 -0.44 0.00 0.00 34.13 33.51 1r43 s GLU 357 CO 0.03 -0.00 0.81 0.99 0.95 0.00 0.00 175.26 178.04 1r43 s THR 358 N -1.17 4.92 -0.18 1.83 2.01 -1.26 0.24 115.64 122.03 1r43 s THR 358 Ca -0.11 1.61 -0.17 0.00 0.31 0.00 0.00 61.69 63.33 1r43 s THR 358 Cb -0.08 -4.12 -0.22 0.00 0.01 0.00 0.00 72.50 68.09 1r43 s THR 358 CO -0.00 0.08 0.28 -0.07 -0.69 0.00 0.00 174.62 174.21 1r43 h LEU 359 N 7.92 0.15 -7.00 4.42 3.38 -1.13 -3.48 115.31 119.57 1r43 h LEU 359 Ca -0.32 -0.66 0.03 0.00 0.09 0.00 0.00 57.88 57.01 1r43 h LEU 359 Cb 1.15 -0.05 -0.18 0.00 0.09 0.00 0.00 40.66 41.67 1r43 h LEU 359 CO 0.81 1.62 0.38 -1.10 0.09 0.00 0.00 178.44 180.24 1r43 s GLN 360 N -2.43 0.90 -0.12 1.13 -0.21 -1.15 -5.03 119.66 112.75 1r43 s GLN 360 Ca -0.26 -0.04 -0.09 0.00 0.02 0.00 0.00 55.36 54.99 1r43 s GLN 360 Cb 0.06 0.42 0.04 0.00 1.00 0.00 0.00 33.01 34.53 1r43 s GLN 360 CO 0.66 -0.33 0.31 0.08 -2.12 0.00 0.00 175.29 173.88 1r43 s VAL 361 N -2.10 -0.02 -0.11 1.09 1.01 -1.26 0.32 120.40 119.34 1r43 s VAL 361 Ca -0.02 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 1r43 s VAL 361 Cb -0.01 -0.45 0.06 0.00 0.00 0.00 0.00 36.38 35.98 1r43 s VAL 361 CO -0.01 0.03 0.19 -0.55 0.00 0.00 0.00 175.10 174.76 1r43 s SER 362 N 0.73 0.70 0.85 3.32 0.15 0.92 -5.00 113.70 115.38 1r43 s SER 362 Ca -0.05 0.35 -0.11 0.00 0.70 0.00 0.00 55.95 56.85 1r43 s SER 362 Cb -0.06 0.40 0.10 0.00 -1.71 0.00 0.00 66.02 64.76 1r43 s SER 362 CO -0.05 -0.25 1.09 -2.84 1.20 0.00 0.00 173.24 172.39 1r43 s PRO 363 N 2.33 1.65 0.57 5.44 0.02 -1.26 -0.27 135.00 143.48 1r43 s PRO 363 Ca 0.03 0.95 -0.20 0.00 0.02 0.00 0.00 61.00 61.81 1r43 s PRO 363 Cb -0.12 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.51 1r43 s PRO 363 CO -0.07 -2.00 1.21 0.00 -0.33 0.00 0.00 177.00 175.80 1r43 s ALA 364 N -2.92 2.63 -0.20 -1.55 0.00 -1.26 -4.47 121.76 113.99 1r43 s ALA 364 Ca 0.62 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.57 1r43 s ALA 364 Cb -0.18 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1r43 s ALA 364 CO 0.57 -1.08 -0.10 0.08 0.00 0.00 0.00 175.76 175.23 1r43 s VAL 365 N -1.58 2.93 -0.38 0.00 1.01 -0.66 -4.92 120.40 116.80 1r43 s VAL 365 Ca 0.75 -0.65 -0.11 0.00 0.00 0.00 0.00 61.98 61.97 1r43 s VAL 365 Cb -0.30 -2.30 0.03 0.00 0.00 0.00 0.00 36.38 33.80 1r43 s VAL 365 CO 0.34 0.47 0.21 0.20 0.00 0.00 0.00 175.10 176.32 1r43 s ASN 366 N 1.34 5.76 0.68 3.32 -0.87 -1.26 -1.20 114.94 122.71 1r43 s ASN 366 Ca 0.04 -1.00 -0.14 0.00 -1.57 0.00 0.00 52.86 50.19 1r43 s ASN 366 Cb -0.14 -2.03 0.01 0.00 -0.02 0.00 0.00 41.25 39.07 1r43 s ASN 366 CO -0.06 -0.39 1.12 -0.36 -2.57 0.00 0.00 177.10 174.84 1r43 s PHE 367 N 1.56 2.52 0.23 2.20 0.08 -0.49 -4.94 117.98 119.13 1r43 s PHE 367 Ca 0.02 1.56 -0.30 0.00 0.12 0.00 0.00 56.93 58.33 1r43 s PHE 367 Cb -0.19 -3.20 -0.10 0.00 -0.57 0.00 0.00 43.02 38.96 1r43 s PHE 367 CO 0.07 -1.85 1.45 -1.58 -0.10 0.00 0.00 175.22 173.21 1r43 s HIS 368 N -2.35 3.04 0.53 0.36 2.46 -0.87 -4.90 115.29 113.57 1r43 s HIS 368 Ca 0.67 0.97 0.23 0.00 0.47 0.00 0.00 55.06 57.41 1r43 s HIS 368 Cb -0.21 -3.82 1.50 0.00 -0.13 0.00 0.00 32.58 29.92 1r43 s HIS 368 CO 0.44 -2.74 2.17 1.05 -2.47 0.00 0.00 174.74 173.19 1r43 h GLU 369 N 5.37 0.00 -0.07 2.88 4.11 -1.92 -1.36 114.58 123.58 1r43 h GLU 369 Ca -0.45 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 58.88 1r43 h GLU 369 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1r43 h GLU 369 CO 0.80 0.04 -0.33 0.28 0.07 0.00 0.00 179.01 179.87 1r43 h VAL 370 N 0.00 1.42 -0.16 -1.06 2.07 -1.98 -2.35 116.25 114.20 1r43 h VAL 370 Ca -0.00 -1.72 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 1r43 h VAL 370 Cb 0.08 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1r43 h VAL 370 CO 0.01 0.50 0.06 0.00 0.02 0.00 0.00 177.57 178.15 1r43 h ILE 372 N 0.09 0.87 -0.17 0.00 2.04 -1.37 -0.52 117.51 118.44 1r43 h ILE 372 Ca 0.05 -0.25 -0.08 0.00 1.00 0.00 0.00 64.86 65.58 1r43 h ILE 372 Cb 0.20 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 1r43 h ILE 372 CO -0.00 0.13 -0.23 -0.33 0.00 0.00 0.00 178.15 177.72 1r43 h GLU 373 N 0.73 0.30 -0.26 2.37 4.39 -0.90 0.60 114.58 121.81 1r43 h GLU 373 Ca 0.40 -0.10 -0.10 0.00 0.34 0.00 0.00 59.36 59.90 1r43 h GLU 373 Cb 0.42 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1r43 h GLU 373 CO -0.27 0.52 -0.24 0.00 -1.16 0.00 0.00 179.01 177.86 1r43 h VAL 375 N 0.35 1.18 -0.37 0.00 2.07 -0.96 -2.66 116.25 115.86 1r43 h VAL 375 Ca 0.05 -0.54 0.07 0.00 0.82 0.00 0.00 66.70 67.10 1r43 h VAL 375 Cb 0.79 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 1r43 h VAL 375 CO 0.06 0.19 -0.09 0.28 0.02 0.00 0.00 177.57 178.03 1r43 h SER 376 N 0.36 -0.34 -0.23 0.57 0.02 -0.70 -0.48 113.55 112.75 1r43 h SER 376 Ca 0.10 0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 61.04 1r43 h SER 376 Cb 0.18 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1r43 h SER 376 CO -0.01 -0.12 -0.28 0.03 -1.14 0.00 0.00 176.83 175.31 1r43 h ARG 377 N 0.00 0.72 -0.10 3.45 2.47 -1.29 -1.62 114.38 118.01 1r43 h ARG 377 Ca 0.18 -0.31 0.02 0.00 -1.26 0.00 0.00 59.98 58.61 1r43 h ARG 377 Cb 0.27 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.55 1r43 h ARG 377 CO -0.38 0.92 -0.04 1.03 0.56 0.00 0.00 179.97 182.06 1r43 h SER 378 N 0.62 -0.14 0.55 7.04 0.87 -1.08 -1.39 113.55 120.02 1r43 h SER 378 Ca 0.08 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 1r43 h SER 378 Cb 0.79 0.08 0.01 0.00 -0.44 0.00 0.00 62.40 62.84 1r43 h SER 378 CO 0.07 -0.06 -0.26 0.00 -0.53 0.00 0.00 176.83 176.05 1r43 h ALA 379 N 1.07 -1.07 -0.18 6.23 0.00 -0.89 -3.06 119.26 121.35 1r43 h ALA 379 Ca 0.05 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1r43 h ALA 379 Cb 0.11 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1r43 h ALA 379 CO -0.12 -1.01 0.27 0.74 0.00 0.00 0.00 179.25 179.12 1r43 h PHE 380 N -0.81 0.00 0.00 0.00 -1.00 -1.37 0.66 116.94 114.42 1r43 h PHE 380 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 1r43 h PHE 380 Cb 0.56 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.12 1r43 h PHE 380 CO 0.08 0.00 0.00 0.00 -1.61 0.00 0.00 178.31 176.78 1r43 h ALA 381 N 1.64 1.00 0.00 2.45 0.00 -1.24 -3.34 119.26 119.76 1r43 h ALA 381 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1r43 h ALA 381 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1r43 h ALA 381 CO -0.00 0.00 -0.16 1.04 0.00 0.00 0.00 179.25 180.13 1r43 n GLN 382 N -2.71 5.90 -4.10 0.00 6.02 0.12 -5.05 117.38 117.57 1r43 n GLN 382 Ca 0.04 -0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.91 1r43 n GLN 382 Cb 0.46 -0.58 -0.11 0.00 1.02 0.00 0.00 30.24 31.02 1r43 n GLN 382 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1r43 s PHE 383 N -1.17 0.73 0.47 1.08 0.40 0.19 -5.08 117.98 114.60 1r43 s PHE 383 Ca 0.00 -0.67 -0.22 0.00 -0.60 0.00 0.00 56.93 55.44 1r43 s PHE 383 Cb 0.00 -0.44 -0.07 0.00 0.51 0.00 0.00 43.02 43.02 1r43 s PHE 383 CO 0.01 -0.12 1.16 0.15 0.70 0.00 0.00 175.22 177.12 1r43 s LYS 384 N -2.48 3.69 0.18 0.44 1.02 -1.26 -4.41 119.74 116.92 1r43 s LYS 384 Ca -0.02 1.74 -0.10 0.00 0.02 0.00 0.00 55.97 57.61 1r43 s LYS 384 Cb -0.04 -2.33 0.23 0.00 -0.52 0.00 0.00 37.83 35.16 1r43 s LYS 384 CO -0.02 -0.60 1.12 1.63 -0.92 0.00 0.00 175.35 176.56 1r43 n LYS 385 N -0.63 -0.13 0.32 1.68 4.76 -1.26 -0.39 118.16 122.50 1r43 n LYS 385 Ca 0.08 1.11 0.21 0.00 -2.87 0.00 0.00 58.31 56.84 1r43 n LYS 385 Cb 0.49 -1.66 1.05 0.00 -1.84 0.00 0.00 35.03 33.07 1r43 n LYS 385 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 1r43 h ASP 386 N 0.00 0.00 0.72 4.39 3.32 -2.01 -2.01 116.42 120.82 1r43 h ASP 386 Ca 0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1r43 h ASP 386 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1r43 h ASP 386 CO -0.72 0.00 -0.55 0.00 -1.72 0.00 0.00 179.24 176.25 1r43 n GLN 387 N -3.09 0.16 -4.17 3.56 1.13 0.47 -4.76 117.38 110.68 1r43 n GLN 387 Ca -0.02 0.04 -0.29 0.00 -1.94 0.00 0.00 57.00 54.80 1r43 n GLN 387 Cb 0.15 -1.60 -0.08 0.00 0.11 0.00 0.00 30.24 28.82 1r43 n GLN 387 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1r43 s VAL 388 N -3.09 3.78 -0.16 5.09 1.01 -0.76 -0.52 120.40 125.74 1r43 s VAL 388 Ca 0.08 -1.20 -0.11 0.00 0.00 0.00 0.00 61.98 60.75 1r43 s VAL 388 Cb 0.15 -2.83 0.05 0.00 0.00 0.00 0.00 36.38 33.76 1r43 s VAL 388 CO 0.70 0.03 0.41 -0.60 0.00 0.00 0.00 175.10 175.65 1r43 s ARG 389 N -2.52 0.42 0.34 2.72 3.52 -0.77 -4.98 118.95 117.68 1r43 s ARG 389 Ca 0.25 0.72 -0.27 0.00 -0.13 0.00 0.00 55.73 56.30 1r43 s ARG 389 Cb -0.11 0.07 -0.09 0.00 -1.56 0.00 0.00 34.95 33.26 1r43 s ARG 389 CO 0.17 -0.12 1.15 -0.65 -0.81 0.00 0.00 175.30 175.04 1r43 s GLN 390 N 0.99 4.35 -0.00 5.12 -0.21 -1.26 -0.84 119.66 127.80 1r43 s GLN 390 Ca -0.06 1.84 -0.12 0.00 0.02 0.00 0.00 55.36 57.03 1r43 s GLN 390 Cb -0.06 -2.92 0.02 0.00 1.00 0.00 0.00 33.01 31.04 1r43 s GLN 390 CO -0.08 -0.06 0.25 -1.50 -2.12 0.00 0.00 175.29 171.78 1r43 s ILE 391 N -1.30 0.07 -0.15 1.08 2.07 -0.63 -4.86 121.20 117.47 1r43 s ILE 391 Ca 0.51 -0.57 -0.07 0.00 -1.41 0.00 0.00 60.65 59.10 1r43 s ILE 391 Cb -0.31 -0.60 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 1r43 s ILE 391 CO 0.40 -0.32 0.09 0.26 -1.91 0.00 0.00 174.94 173.47 1r43 s TRP 392 N -1.50 3.39 0.18 3.50 0.52 -1.26 -1.73 118.94 122.03 1r43 s TRP 392 Ca -0.13 0.29 -0.30 0.00 0.02 0.00 0.00 56.10 55.99 1r43 s TRP 392 Cb -0.05 -2.01 -0.08 0.00 -1.15 0.00 0.00 33.47 30.18 1r43 s TRP 392 CO 0.03 0.42 1.22 0.45 0.02 0.00 0.00 176.95 179.09 1r43 s SER 393 N -0.27 7.04 -0.08 2.95 0.15 0.14 -4.88 113.70 118.75 1r43 s SER 393 Ca 0.09 2.25 0.18 0.00 0.70 0.00 0.00 55.95 59.18 1r43 s SER 393 Cb -0.12 -2.60 0.67 0.00 -1.71 0.00 0.00 66.02 62.26 1r43 s SER 393 CO 0.01 -0.42 1.57 0.61 1.20 0.00 0.00 173.24 176.22 1r43 n GLY 394 N 2.33 2.49 3.19 9.45 0.00 -1.26 -1.01 105.19 120.37 1r43 n GLY 394 Ca 0.05 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 1r43 n GLY 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r43 s ALA 395 N -1.67 -0.04 0.46 4.61 0.00 -1.26 -4.94 121.76 118.92 1r43 s ALA 395 Ca 0.48 -0.77 -0.05 0.00 0.00 0.00 0.00 51.96 51.62 1r43 s ALA 395 Cb 0.30 0.47 -0.04 0.00 0.00 0.00 0.00 23.12 23.85 1r43 s ALA 395 CO 0.25 -0.49 0.75 0.20 0.00 0.00 0.00 175.76 176.48 1r43 s GLY 396 N -2.88 1.51 0.29 0.00 0.00 -1.26 -4.93 107.32 100.05 1r43 s GLY 396 Ca 0.06 -0.54 -0.17 0.00 0.00 0.00 0.00 44.72 44.07 1r43 s GLY 396 CO -0.10 -0.38 0.66 0.30 0.00 0.00 0.00 173.10 173.58 1r43 s HIS 397 N -2.66 0.05 0.40 1.90 3.76 -1.26 -5.04 115.29 112.44 1r43 s HIS 397 Ca 0.47 -0.51 0.09 0.00 -0.15 0.00 0.00 55.06 54.96 1r43 s HIS 397 Cb -0.10 0.57 0.87 0.00 1.11 0.00 0.00 32.58 35.03 1r43 s HIS 397 CO 0.43 -1.23 1.98 -0.44 -0.85 0.00 0.00 174.74 174.63 1r43 h ASP 398 N 2.07 0.52 -1.08 1.40 3.32 -1.96 0.17 116.42 120.85 1r43 h ASP 398 Ca -0.23 0.00 0.29 0.00 0.02 0.00 0.00 57.03 57.11 1r43 h ASP 398 Cb 1.25 -0.11 -0.10 0.00 0.22 0.00 0.00 39.33 40.59 1r43 h ASP 398 CO 0.29 0.33 0.69 0.28 -1.72 0.00 0.00 179.24 179.12 1r43 h SER 399 N 0.59 0.42 -0.93 6.45 0.02 -1.96 0.49 113.55 118.63 1r43 h SER 399 Ca 0.28 0.10 0.18 0.00 -0.84 0.00 0.00 61.79 61.50 1r43 h SER 399 Cb 0.32 0.03 -0.11 0.00 0.14 0.00 0.00 62.40 62.79 1r43 h SER 399 CO -0.08 0.04 0.51 0.00 -1.14 0.00 0.00 176.83 176.16 1r43 h GLN 401 N 0.64 0.09 0.08 0.00 1.08 -0.15 -3.31 115.11 113.55 1r43 h GLN 401 Ca 0.54 -0.12 -0.25 0.00 -1.45 0.00 0.00 58.65 57.37 1r43 h GLN 401 Cb 0.86 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.33 1r43 h GLN 401 CO -0.41 0.93 -1.14 1.79 -0.95 0.00 0.00 178.83 179.05 1r43 h THR 402 N 0.05 1.52 -0.98 -0.54 1.35 -0.92 -3.39 112.91 110.00 1r43 h THR 402 Ca -0.03 -3.02 0.22 0.00 -0.55 0.00 0.00 66.41 63.03 1r43 h THR 402 Cb 1.56 2.83 -0.09 0.00 -1.73 0.00 0.00 68.15 70.73 1r43 h THR 402 CO 0.13 0.88 0.62 0.00 -0.25 0.00 0.00 175.52 176.90 1r43 h ALA 403 N 0.70 2.03 0.00 6.62 0.00 -1.19 0.34 119.26 127.76 1r43 h ALA 403 Ca -0.10 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1r43 h ALA 403 Cb 1.85 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.61 1r43 h ALA 403 CO 0.18 -0.39 -0.12 -1.35 0.00 0.00 0.00 179.25 177.57 1r43 h PRO 404 N 0.52 0.00 0.00 0.00 0.11 -1.77 -3.38 132.00 127.48 1r43 h PRO 404 Ca 0.54 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.51 1r43 h PRO 404 Cb 1.18 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1r43 h PRO 404 CO -0.28 0.12 -1.32 0.72 -0.21 0.00 0.00 178.00 177.03 1r43 n HIS 405 N -4.05 0.00 -4.09 0.65 8.25 0.11 -5.01 115.22 111.08 1r43 n HIS 405 Ca -0.02 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.20 1r43 n HIS 405 Cb 0.21 -0.52 -0.05 0.00 1.12 0.00 0.00 29.99 30.75 1r43 n HIS 405 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1r43 s VAL 406 N -2.56 4.54 0.13 1.59 -7.23 -0.48 -5.07 120.40 111.32 1r43 s VAL 406 Ca -0.25 -1.25 -0.31 0.00 -1.81 0.00 0.00 61.98 58.36 1r43 s VAL 406 Cb 0.06 -3.41 -0.10 0.00 0.56 0.00 0.00 36.38 33.50 1r43 s VAL 406 CO 0.34 -0.26 1.74 -2.16 -0.31 0.00 0.00 175.10 174.45 1r43 s PRO 407 N -3.59 4.16 0.03 4.82 0.04 -1.26 -4.22 135.00 134.98 1r43 s PRO 407 Ca 0.32 2.51 -0.05 0.00 0.04 0.00 0.00 61.00 63.82 1r43 s PRO 407 Cb -0.09 -3.45 -0.01 0.00 0.04 0.00 0.00 34.50 30.99 1r43 s PRO 407 CO 0.25 -0.77 0.09 0.95 0.04 0.00 0.00 177.00 177.56 1r43 s THR 408 N 2.25 0.12 0.00 1.26 -4.23 -1.26 -2.14 115.64 111.64 1r43 s THR 408 Ca 0.77 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 1r43 s THR 408 Cb -0.45 -0.79 0.00 0.00 1.34 0.00 0.00 72.50 72.60 1r43 s THR 408 CO 0.34 -0.56 0.00 -0.24 -0.54 0.00 0.00 174.62 173.62 1r43 n SER 409 N 0.92 0.00 -3.68 3.99 2.88 -0.71 -2.04 113.62 114.98 1r43 n SER 409 Ca -0.20 -0.12 -0.12 0.00 -1.33 0.00 0.00 58.87 57.11 1r43 n SER 409 Cb 0.58 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.95 1r43 n SER 409 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1r43 s ILE 411 N -2.21 -0.01 -0.09 2.46 1.01 0.26 -1.75 121.20 120.88 1r43 s ILE 411 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.68 1r43 s ILE 411 Cb 0.00 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.67 1r43 s ILE 411 CO 0.00 0.01 -0.09 -0.36 0.00 0.00 0.00 174.94 174.50 1r43 s PHE 412 N 0.79 2.89 0.28 3.97 2.99 0.15 -1.40 117.98 127.65 1r43 s PHE 412 Ca -0.04 -0.18 0.08 0.00 0.00 0.00 0.00 56.93 56.79 1r43 s PHE 412 Cb -0.05 -1.76 -0.04 0.00 0.00 0.00 0.00 43.02 41.17 1r43 s PHE 412 CO -0.06 0.15 0.11 0.96 -0.00 0.00 0.00 175.22 176.37 1r43 s ILE 413 N -0.40 3.67 0.71 0.64 -4.36 -1.21 0.34 121.20 120.59 1r43 s ILE 413 Ca 0.05 -1.68 -0.15 0.00 -0.26 0.00 0.00 60.65 58.61 1r43 s ILE 413 Cb -0.12 -3.06 0.03 0.00 1.25 0.00 0.00 42.46 40.55 1r43 s ILE 413 CO 0.02 -0.31 1.21 -2.84 0.24 0.00 0.00 174.94 173.26 1r43 s PRO 414 N -3.78 2.25 -0.11 0.37 0.02 -1.26 -1.15 135.00 131.33 1r43 s PRO 414 Ca 0.34 1.77 0.02 0.00 0.02 0.00 0.00 61.00 63.15 1r43 s PRO 414 Cb -0.06 -1.84 0.01 0.00 0.02 0.00 0.00 34.50 32.63 1r43 s PRO 414 CO 0.22 -1.76 -0.17 -1.12 -0.33 0.00 0.00 177.00 173.84 1r43 s SER 415 N -1.98 2.61 -0.09 2.53 0.01 -1.26 -4.62 113.70 110.90 1r43 s SER 415 Ca 0.75 -0.47 -0.35 0.00 1.31 0.00 0.00 55.95 57.18 1r43 s SER 415 Cb -0.29 -1.18 -0.13 0.00 0.21 0.00 0.00 66.02 64.62 1r43 s SER 415 CO 0.44 0.04 1.81 1.17 0.41 0.00 0.00 173.24 177.11 1r43 n LYS 416 N 4.09 1.96 -1.06 12.44 4.81 -0.87 -2.31 118.16 137.22 1r43 n LYS 416 Ca -0.19 0.72 -0.06 0.00 -0.87 0.00 0.00 58.31 57.90 1r43 n LYS 416 Cb 0.51 -2.52 -0.03 0.00 0.02 0.00 0.00 35.03 33.02 1r43 n LYS 416 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1r43 n ASP 417 N 5.97 -4.62 0.00 3.14 8.00 -1.26 -2.28 116.55 125.50 1r43 n ASP 417 Ca 0.23 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.88 1r43 n ASP 417 Cb 0.26 -3.30 0.00 0.00 -0.02 0.00 0.00 41.12 38.06 1r43 n ASP 417 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r43 n GLY 418 N 0.37 2.37 3.51 0.44 0.00 -0.98 -4.71 105.19 106.19 1r43 n GLY 418 Ca -0.06 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.43 1r43 n GLY 418 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1r43 n LEU 419 N 0.00 0.33 -3.85 0.99 7.94 -0.97 -3.34 117.00 118.11 1r43 n LEU 419 Ca 0.00 1.14 -0.09 0.00 -1.11 0.00 0.00 56.01 55.96 1r43 n LEU 419 Cb 0.00 -1.05 -0.04 0.00 0.53 0.00 0.00 43.42 42.86 1r43 n LEU 419 CO 0.00 -1.91 0.28 -0.55 -1.11 0.00 0.00 177.39 174.10 1r43 s SER 420 N -0.23 -0.20 -0.93 1.96 0.15 -1.26 -4.62 113.70 108.57 1r43 s SER 420 Ca 0.77 -0.65 -0.05 0.00 0.70 0.00 0.00 55.95 56.73 1r43 s SER 420 Cb -1.02 0.61 -0.05 0.00 -1.71 0.00 0.00 66.02 63.85 1r43 s SER 420 CO 0.55 -1.14 0.81 1.41 1.20 0.00 0.00 173.24 176.07 1r43 n HIS 421 N -0.38 -2.12 0.00 3.44 8.25 -1.26 -4.96 115.22 118.19 1r43 n HIS 421 Ca -0.06 0.76 0.00 0.00 -0.26 0.00 0.00 57.72 58.15 1r43 n HIS 421 Cb 0.62 -4.00 0.00 0.00 1.12 0.00 0.00 29.99 27.73 1r43 n HIS 421 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1r43 n ASN 422 N -2.99 0.00 -0.25 0.41 2.85 -0.74 -4.79 115.26 109.74 1r43 n ASN 422 Ca -0.08 0.00 0.30 0.00 -0.11 0.00 0.00 54.58 54.69 1r43 n ASN 422 Cb 0.61 0.00 0.70 0.00 1.24 0.00 0.00 39.78 42.33 1r43 n ASN 422 CO 0.00 0.00 0.00 1.88 -2.11 0.00 0.00 177.26 177.03 1r43 h TYR 423 N 0.00 0.10 -0.03 1.20 0.99 -1.72 -2.30 116.97 115.21 1r43 h TYR 423 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1r43 h TYR 423 Cb 0.00 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 37.70 1r43 h TYR 423 CO 0.00 0.01 0.00 0.66 -0.00 0.00 0.00 178.16 178.83 1r43 n TYR 424 N -4.29 0.03 -1.60 4.88 4.02 -1.26 -4.45 117.16 114.49 1r43 n TYR 424 Ca 0.22 -0.01 -0.55 0.00 -0.01 0.00 0.00 57.90 57.55 1r43 n TYR 424 Cb 1.04 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 40.29 1r43 n TYR 424 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1r43 n GLU 425 N -0.20 0.93 -3.74 -0.72 2.13 -0.88 -4.98 120.64 113.19 1r43 n GLU 425 Ca 0.20 0.34 -0.12 0.00 0.66 0.00 0.00 57.16 58.23 1r43 n GLU 425 Cb 0.26 -1.96 -0.13 0.00 0.27 0.00 0.00 31.44 29.88 1r43 n GLU 425 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1r43 s TYR 426 N 0.99 -0.31 -0.04 4.31 5.04 -1.26 -4.57 117.35 121.52 1r43 s TYR 426 Ca 0.88 0.74 0.02 0.00 -2.44 0.00 0.00 57.07 56.27 1r43 s TYR 426 Cb -1.04 0.05 0.01 0.00 0.35 0.00 0.00 41.96 41.33 1r43 s TYR 426 CO 0.53 -0.21 -0.07 -1.12 -1.34 0.00 0.00 175.55 173.33 1r43 s SER 427 N 1.03 1.12 0.73 4.32 0.01 -1.26 -2.06 113.70 117.59 1r43 s SER 427 Ca -0.07 -0.17 -0.14 0.00 1.31 0.00 0.00 55.95 56.87 1r43 s SER 427 Cb -0.09 -0.41 0.04 0.00 0.21 0.00 0.00 66.02 65.77 1r43 s SER 427 CO -0.07 0.02 1.17 -0.94 0.41 0.00 0.00 173.24 173.83 1r43 s SER 428 N 0.49 4.35 0.48 2.44 1.04 -1.26 -4.70 113.70 116.54 1r43 s SER 428 Ca -0.07 2.24 0.14 0.00 0.48 0.00 0.00 55.95 58.73 1r43 s SER 428 Cb -0.11 -2.58 1.14 0.00 0.10 0.00 0.00 66.02 64.57 1r43 s SER 428 CO 0.01 -2.15 2.10 -0.65 0.98 0.00 0.00 173.24 173.52 1r43 h PRO 429 N -0.35 0.19 -0.21 4.02 0.11 -2.00 0.31 132.00 134.07 1r43 h PRO 429 Ca -0.47 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1r43 h PRO 429 Cb 1.28 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1r43 h PRO 429 CO 0.50 0.13 0.05 1.49 -0.21 0.00 0.00 178.00 179.96 1r43 h GLU 430 N 0.20 0.34 0.15 1.05 4.81 -1.99 -2.22 114.58 116.92 1r43 h GLU 430 Ca 0.09 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1r43 h GLU 430 Cb 0.10 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1r43 h GLU 430 CO -0.02 0.46 -0.07 0.93 -0.73 0.00 0.00 179.01 179.58 1r43 h GLU 431 N 0.16 -0.19 -0.32 1.92 5.08 -1.64 0.21 114.58 119.81 1r43 h GLU 431 Ca 0.07 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.51 1r43 h GLU 431 Cb 0.27 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 1r43 h GLU 431 CO 0.00 0.03 -0.13 0.82 -1.00 0.00 0.00 179.01 178.74 1r43 h ILE 432 N -0.39 0.58 -0.76 3.13 2.04 -0.53 0.04 117.51 121.62 1r43 h ILE 432 Ca -0.02 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.87 1r43 h ILE 432 Cb 0.31 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 36.93 1r43 h ILE 432 CO 0.03 0.00 0.48 -0.08 0.00 0.00 0.00 178.15 178.59 1r43 h GLU 433 N -0.07 0.92 0.29 2.37 4.81 -1.18 -0.76 114.58 120.96 1r43 h GLU 433 Ca 0.16 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1r43 h GLU 433 Cb 0.31 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1r43 h GLU 433 CO -0.37 0.61 -0.45 -0.91 -0.73 0.00 0.00 179.01 177.16 1r43 h ASN 434 N 0.94 -1.30 -0.99 1.04 2.35 0.01 -1.64 115.58 115.99 1r43 h ASN 434 Ca 0.31 0.12 0.36 0.00 -0.55 0.00 0.00 56.30 56.53 1r43 h ASN 434 Cb 0.02 0.45 -0.17 0.00 0.05 0.00 0.00 38.32 38.67 1r43 h ASN 434 CO -0.11 -0.54 0.42 1.23 -1.65 0.00 0.00 177.43 176.78 1r43 h GLY 435 N -0.78 1.97 0.85 2.83 0.00 -0.53 0.46 103.07 107.86 1r43 h GLY 435 Ca -0.03 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 1r43 h GLY 435 CO -0.14 -0.66 -0.19 -2.75 0.00 0.00 0.00 176.54 172.80 1r43 h PHE 436 N 0.08 0.62 -1.00 5.60 3.57 -0.37 -1.82 116.94 123.62 1r43 h PHE 436 Ca 0.76 -0.18 0.05 0.00 3.53 0.00 0.00 57.97 62.13 1r43 h PHE 436 Cb 1.86 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 40.40 1r43 h PHE 436 CO -0.13 0.84 0.65 0.87 -2.23 0.00 0.00 178.31 178.32 1r43 h LYS 437 N 0.21 1.18 0.21 1.11 1.57 -0.03 0.28 116.57 121.10 1r43 h LYS 437 Ca 0.04 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1r43 h LYS 437 Cb 0.72 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1r43 h LYS 437 CO 0.05 0.78 -0.10 0.28 -0.57 0.00 0.00 179.45 179.89 1r43 h VAL 438 N 1.21 0.88 -0.66 0.50 2.07 -1.30 -2.27 116.25 116.69 1r43 h VAL 438 Ca 0.42 -0.75 0.13 0.00 0.82 0.00 0.00 66.70 67.32 1r43 h VAL 438 Cb 0.10 1.30 -0.13 0.00 -1.52 0.00 0.00 31.29 31.04 1r43 h VAL 438 CO -0.15 0.16 -0.21 0.25 0.02 0.00 0.00 177.57 177.63 1r43 h LEU 439 N -0.67 -0.78 -0.06 2.57 5.85 -0.65 0.17 115.31 121.75 1r43 h LEU 439 Ca -0.03 0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1r43 h LEU 439 Cb 0.47 0.46 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1r43 h LEU 439 CO 0.05 -0.25 -0.05 0.25 -0.34 0.00 0.00 178.44 178.10 1r43 h LEU 440 N -0.05 -0.15 -1.07 2.25 5.85 -0.26 0.13 115.31 122.03 1r43 h LEU 440 Ca 0.30 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.96 1r43 h LEU 440 Cb 0.52 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1r43 h LEU 440 CO -0.70 -0.07 -0.38 1.56 -0.34 0.00 0.00 178.44 178.52 1r43 h GLN 441 N -0.05 0.16 0.25 1.25 1.08 -0.90 -1.44 115.11 115.46 1r43 h GLN 441 Ca 0.04 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1r43 h GLN 441 Cb 0.11 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1r43 h GLN 441 CO -0.09 0.52 -0.14 0.00 -0.95 0.00 0.00 178.83 178.17 1r43 h ALA 442 N 1.47 -0.36 0.31 3.87 0.00 0.62 0.35 119.26 125.52 1r43 h ALA 442 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1r43 h ALA 442 Cb 0.74 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1r43 h ALA 442 CO 0.06 -0.71 -0.38 0.82 0.00 0.00 0.00 179.25 179.04 1r43 h ILE 443 N -0.37 0.22 -1.00 0.00 2.04 -0.87 -0.53 117.51 117.00 1r43 h ILE 443 Ca -0.03 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.04 1r43 h ILE 443 Cb 0.29 0.22 -0.11 0.00 -0.74 0.00 0.00 36.82 36.49 1r43 h ILE 443 CO 0.04 0.00 0.61 0.40 0.00 0.00 0.00 178.15 179.20 1r43 h ILE 444 N -0.74 0.65 -0.33 -0.67 2.04 -1.09 0.58 117.51 117.94 1r43 h ILE 444 Ca -0.01 -0.23 -0.11 0.00 1.00 0.00 0.00 64.86 65.51 1r43 h ILE 444 Cb 0.69 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1r43 h ILE 444 CO -0.11 0.12 -0.22 0.78 0.00 0.00 0.00 178.15 178.72 1r43 h ASN 445 N 0.66 0.77 -0.46 1.72 2.35 0.40 -0.26 115.58 120.76 1r43 h ASN 445 Ca 0.59 -0.43 -0.11 0.00 -0.55 0.00 0.00 56.30 55.80 1r43 h ASN 445 Cb 1.05 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 1r43 h ASN 445 CO -0.38 1.04 -0.14 0.22 -1.65 0.00 0.00 177.43 176.52 1r43 h TYR 446 N 0.51 1.02 -0.20 1.19 3.20 0.25 -1.24 116.97 121.70 1r43 h TYR 446 Ca 0.07 -0.23 0.05 0.00 3.14 0.00 0.00 58.73 61.76 1r43 h TYR 446 Cb 0.78 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1r43 h TYR 446 CO 0.06 1.01 -0.11 0.22 -1.64 0.00 0.00 178.16 177.70 1r43 h ASP 447 N 0.74 -0.36 0.82 -2.11 3.58 -0.82 -0.93 116.42 117.33 1r43 h ASP 447 Ca 0.11 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.65 1r43 h ASP 447 Cb 0.69 0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.94 1r43 h ASP 447 CO 0.05 -0.14 0.00 0.78 -2.88 0.00 0.00 179.24 177.05 1r43 h ASN 448 N -0.09 0.00 -0.21 2.28 2.35 -0.84 -2.73 115.58 116.34 1r43 h ASN 448 Ca 0.11 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.80 1r43 h ASN 448 Cb 0.26 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 1r43 h ASN 448 CO -0.26 0.00 -0.10 0.22 -1.65 0.00 0.00 177.43 175.64 1r43 h TYR 449 N 0.00 0.50 0.00 1.19 5.03 0.05 -3.28 116.97 120.46 1r43 h TYR 449 Ca 0.00 -0.12 0.00 0.00 2.58 0.00 0.00 58.73 61.19 1r43 h TYR 449 Cb 0.41 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 38.57 1r43 h TYR 449 CO 0.00 0.72 0.00 0.07 -1.32 0.00 0.00 178.16 177.63 1r43 h ARG 450 N 0.14 0.00 0.05 1.82 0.11 -1.10 0.00 114.38 115.40 1r43 h ARG 450 Ca 0.05 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.12 1r43 h ARG 450 Cb 0.59 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.67 1r43 h ARG 450 CO 0.03 0.00 -0.03 0.28 0.10 0.00 0.00 179.97 180.35 1r43 h VAL 451 N 0.00 1.10 0.57 0.08 2.07 -1.65 -0.51 116.25 117.92 1r43 h VAL 451 Ca 0.00 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1r43 h VAL 451 Cb 0.38 1.45 0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1r43 h VAL 451 CO 0.00 0.13 -0.28 0.40 0.02 0.00 0.00 177.57 177.85 1r43 h ILE 452 N -0.30 0.00 -1.06 4.57 2.04 -1.15 -3.08 117.51 118.53 1r43 h ILE 452 Ca -0.01 -0.10 0.31 0.00 1.00 0.00 0.00 64.86 66.06 1r43 h ILE 452 Cb 0.27 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.22 1r43 h ILE 452 CO 0.01 0.00 0.64 -0.09 0.00 0.00 0.00 178.15 178.71 1r43 h ARG 453 N -0.87 0.36 -1.03 2.37 1.12 -1.28 -1.56 114.38 113.48 1r43 h ARG 453 Ca -0.08 -0.02 -0.48 0.00 -1.11 0.00 0.00 59.98 58.29 1r43 h ARG 453 Cb 0.59 -0.08 -0.26 0.00 -0.01 0.00 0.00 29.97 30.21 1r43 h ARG 453 CO 0.13 0.24 0.61 0.41 -3.11 0.00 0.00 179.97 178.25 1r43 n GLY 454 N -1.37 4.44 0.00 2.80 0.00 -0.20 -5.07 105.19 105.79 1r43 n GLY 454 Ca 0.30 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1r43 n GLY 454 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74