#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r43 n ALA 25 N 0.00 0.50 -2.76 0.00 0.00 -1.26 -4.91 120.51 112.08 1r43 n ALA 25 Ca 0.00 -1.24 -0.42 0.00 0.00 0.00 0.00 53.44 51.78 1r43 n ALA 25 Cb 0.00 -3.13 -0.03 0.00 0.00 0.00 0.00 19.45 16.29 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 12.31 3.02 0.21 0.00 0.00 -1.26 -5.02 121.76 131.01 1r43 s ALA 26 Ca 1.00 -1.89 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 1r43 s ALA 26 Cb -0.27 -4.05 -0.08 0.00 0.00 0.00 0.00 23.12 18.72 1r43 s ALA 26 CO 0.18 -3.02 1.00 -2.14 0.00 0.00 0.00 175.76 171.78 1r43 s PRO 27 N 4.39 4.74 0.44 0.00 0.02 -1.26 -5.01 135.00 138.32 1r43 s PRO 27 Ca 0.29 1.58 -0.23 0.00 0.02 0.00 0.00 61.00 62.67 1r43 s PRO 27 Cb -0.11 -3.28 -0.09 0.00 0.02 0.00 0.00 34.50 31.04 1r43 s PRO 27 CO 0.07 0.33 1.06 -0.51 -0.33 0.00 0.00 177.00 177.62 1r43 s LEU 28 N -0.87 4.03 -1.01 -5.54 1.43 -1.26 -4.93 118.68 110.53 1r43 s LEU 28 Ca 0.44 2.05 -0.24 0.00 -1.03 0.00 0.00 54.13 55.35 1r43 s LEU 28 Cb -0.27 -4.31 -0.07 0.00 0.03 0.00 0.00 46.19 41.57 1r43 s LEU 28 CO 0.34 -0.65 1.96 -0.55 0.23 0.00 0.00 176.35 177.68 1r43 s SER 29 N -1.66 5.01 -0.26 2.29 0.15 -1.26 -4.92 113.70 113.04 1r43 s SER 29 Ca 0.62 -1.04 -0.29 0.00 0.70 0.00 0.00 55.95 55.94 1r43 s SER 29 Cb -0.21 -2.57 -0.02 0.00 -1.71 0.00 0.00 66.02 61.51 1r43 s SER 29 CO 0.26 -2.97 1.61 -0.63 1.20 0.00 0.00 173.24 172.71 1r43 s ILE 30 N 10.80 3.71 -0.84 6.45 1.01 -1.26 -4.86 121.20 136.21 1r43 s ILE 30 Ca 0.71 0.78 -0.25 0.00 0.00 0.00 0.00 60.65 61.89 1r43 s ILE 30 Cb -0.05 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 1r43 s ILE 30 CO 0.05 -0.36 1.89 0.00 0.00 0.00 0.00 174.94 176.52 1r43 s ALA 31 N 5.42 1.85 0.69 9.38 0.00 -1.26 -4.91 121.76 132.93 1r43 s ALA 31 Ca 0.71 -1.34 -0.07 0.00 0.00 0.00 0.00 51.96 51.25 1r43 s ALA 31 Cb -0.23 -4.49 0.05 0.00 0.00 0.00 0.00 23.12 18.45 1r43 s ALA 31 CO 0.30 -4.52 1.01 -1.54 0.00 0.00 0.00 175.76 171.01 1r43 s SER 32 N 7.83 5.02 0.00 0.00 1.04 -1.26 -4.18 113.70 122.14 1r43 s SER 32 Ca 0.68 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.72 1r43 s SER 32 Cb -0.08 -1.34 0.00 0.00 0.10 0.00 0.00 66.02 64.71 1r43 s SER 32 CO 0.04 -1.48 0.00 0.61 0.98 0.00 0.00 173.24 173.39 1r43 n GLY 33 N -2.89 3.17 0.14 7.32 0.00 -1.26 -4.97 105.19 106.70 1r43 n GLY 33 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 1r43 n GLY 33 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1r43 h ARG 34 N 1.27 0.39 -0.09 1.61 3.08 -2.00 -3.11 114.38 115.53 1r43 h ARG 34 Ca 0.00 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1r43 h ARG 34 Cb 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1r43 h ARG 34 CO 0.00 0.61 0.06 1.25 -1.07 0.00 0.00 179.97 180.82 1r43 h LEU 35 N 0.13 0.10 -1.35 3.04 5.85 -1.93 0.32 115.31 121.47 1r43 h LEU 35 Ca 0.06 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1r43 h LEU 35 Cb 0.45 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 1r43 h LEU 35 CO 0.02 0.09 0.45 -1.13 -0.34 0.00 0.00 178.44 177.53 1r43 h ASN 36 N 0.11 0.74 -0.04 1.25 -1.24 -1.89 0.61 115.58 115.12 1r43 h ASN 36 Ca 0.03 -0.01 -0.17 0.00 0.71 0.00 0.00 56.30 56.85 1r43 h ASN 36 Cb 0.00 -0.18 -0.00 0.00 0.73 0.00 0.00 38.32 38.87 1r43 h ASN 36 CO -0.01 0.52 -0.58 1.56 -1.29 0.00 0.00 177.43 177.63 1r43 h GLN 37 N 0.87 0.64 -0.32 6.67 4.20 -1.36 -3.15 115.11 122.65 1r43 h GLN 37 Ca 0.26 -0.42 -0.05 0.00 0.06 0.00 0.00 58.65 58.50 1r43 h GLN 37 Cb -0.01 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1r43 h GLN 37 CO -0.07 1.04 0.02 1.15 -0.67 0.00 0.00 178.83 180.30 1r43 h THR 38 N 0.48 1.25 -0.93 -0.54 2.02 0.43 -2.84 112.91 112.78 1r43 h THR 38 Ca 0.00 -0.91 0.17 0.00 0.77 0.00 0.00 66.41 66.44 1r43 h THR 38 Cb 1.15 1.22 -0.08 0.00 -1.74 0.00 0.00 68.15 68.70 1r43 h THR 38 CO 0.11 0.30 0.59 0.40 0.37 0.00 0.00 175.52 177.30 1r43 h ILE 39 N 0.37 0.77 -0.03 3.11 2.04 -0.95 -2.11 117.51 120.71 1r43 h ILE 39 Ca 0.09 -0.22 -0.11 0.00 1.00 0.00 0.00 64.86 65.62 1r43 h ILE 39 Cb 0.41 0.06 0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1r43 h ILE 39 CO 0.01 0.12 -0.43 -0.07 0.00 0.00 0.00 178.15 177.78 1r43 h LEU 40 N 0.64 0.43 -0.20 1.44 4.07 -1.48 -2.65 115.31 117.57 1r43 h LEU 40 Ca 0.49 -0.72 -0.01 0.00 0.08 0.00 0.00 57.88 57.71 1r43 h LEU 40 Cb 0.88 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.48 1r43 h LEU 40 CO -0.24 1.09 0.07 -0.08 -1.08 0.00 0.00 178.44 178.19 1r43 h GLU 41 N -0.19 0.30 -0.25 1.13 4.22 -1.26 0.18 114.58 118.72 1r43 h GLU 41 Ca -0.05 -0.06 -0.05 0.00 0.08 0.00 0.00 59.36 59.28 1r43 h GLU 41 Cb 1.13 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1r43 h GLU 41 CO 0.09 0.40 -0.06 1.79 -2.18 0.00 0.00 179.01 179.05 1r43 h THR 42 N 0.15 1.18 0.37 0.32 1.35 -1.51 -2.52 112.91 112.25 1r43 h THR 42 Ca 0.06 -0.77 -0.02 0.00 -0.55 0.00 0.00 66.41 65.14 1r43 h THR 42 Cb 0.22 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1r43 h THR 42 CO -0.00 0.25 -0.18 1.23 -0.25 0.00 0.00 175.52 176.57 1r43 h GLY 43 N 0.78 -0.52 1.73 5.82 0.00 -1.19 -2.91 103.07 106.78 1r43 h GLY 43 Ca 0.08 0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.64 1r43 h GLY 43 CO 0.02 -0.19 0.10 0.23 0.00 0.00 0.00 176.54 176.69 1r43 h SER 44 N -1.00 0.00 0.50 0.19 0.87 -0.56 0.65 113.55 114.21 1r43 h SER 44 Ca -0.05 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.41 1r43 h SER 44 Cb 0.52 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.46 1r43 h SER 44 CO 0.08 0.00 -1.58 1.67 -0.53 0.00 0.00 176.83 176.47 1r43 n GLN 45 N -4.32 0.64 -0.00 2.24 7.27 -0.96 -3.97 117.38 118.28 1r43 n GLN 45 Ca 0.00 0.05 -0.02 0.00 0.07 0.00 0.00 57.00 57.10 1r43 n GLN 45 Cb 0.22 -1.70 -0.01 0.00 2.41 0.00 0.00 30.24 31.16 1r43 n GLN 45 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1r43 n PHE 46 N -2.65 0.00 0.90 3.69 0.99 -1.06 -4.74 117.46 114.60 1r43 n PHE 46 Ca -0.08 0.00 0.08 0.00 -0.00 0.00 0.00 57.45 57.45 1r43 n PHE 46 Cb 0.73 -0.14 0.25 0.00 -1.00 0.00 0.00 39.48 39.32 1r43 n PHE 46 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1r43 n GLY 47 N 2.68 0.68 3.58 1.37 0.00 -0.79 -4.93 105.19 107.77 1r43 n GLY 47 Ca -0.04 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 1r43 n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r43 s GLY 48 N -1.22 0.37 0.06 -0.02 0.00 0.15 -0.98 107.32 105.67 1r43 s GLY 48 Ca 0.29 0.16 -0.00 0.00 0.00 0.00 0.00 44.72 45.17 1r43 s GLY 48 CO 0.21 3.60 -0.04 -1.34 0.00 0.00 0.00 173.10 175.53 1r43 s VAL 49 N 8.71 0.34 -0.99 1.40 -7.23 -0.13 -4.96 120.40 117.54 1r43 s VAL 49 Ca 0.86 -1.71 -0.13 0.00 -1.81 0.00 0.00 61.98 59.19 1r43 s VAL 49 Cb -0.22 -1.38 -0.00 0.00 0.56 0.00 0.00 36.38 35.34 1r43 s VAL 49 CO 0.30 -0.88 0.73 0.00 -0.31 0.00 0.00 175.10 174.94 1r43 n ALA 50 N 0.30 -2.61 -1.73 1.32 0.00 -1.26 -1.06 120.51 115.47 1r43 n ALA 50 Ca -0.15 -0.22 -0.42 0.00 0.00 0.00 0.00 53.44 52.65 1r43 n ALA 50 Cb 0.60 -2.78 -0.00 0.00 0.00 0.00 0.00 19.45 17.26 1r43 n ALA 50 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1r43 n ARG 51 N -3.41 2.35 0.00 0.00 0.63 -1.26 -3.82 116.66 111.14 1r43 n ARG 51 Ca -0.13 0.82 0.00 0.00 -0.92 0.00 0.00 57.85 57.62 1r43 n ARG 51 Cb 0.60 -2.47 0.00 0.00 0.45 0.00 0.00 32.46 31.04 1r43 n ARG 51 CO 0.00 0.00 0.00 -2.67 -2.51 0.00 0.00 177.63 172.45 1r43 n TRP 52 N 0.35 0.00 -3.99 -0.14 2.14 -0.68 -5.00 117.44 110.12 1r43 n TRP 52 Ca 0.03 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.50 1r43 n TRP 52 Cb 0.37 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.83 1r43 n TRP 52 CO 0.00 0.00 0.00 0.20 2.07 0.00 0.00 177.69 179.96 1r43 s GLY 53 N -1.49 0.65 0.22 -1.67 0.00 -1.19 -5.09 107.32 98.75 1r43 s GLY 53 Ca 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 44.72 43.75 1r43 s GLY 53 CO 0.00 -0.63 1.58 1.46 0.00 0.00 0.00 173.10 175.52 1r43 h GLN 54 N 2.19 0.61 -7.19 2.90 1.08 -1.99 -3.44 115.11 109.26 1r43 h GLN 54 Ca -0.27 -0.31 -0.44 0.00 -1.45 0.00 0.00 58.65 56.18 1r43 h GLN 54 Cb 1.25 0.00 0.20 0.00 -0.05 0.00 0.00 27.48 28.88 1r43 h GLN 54 CO 0.36 0.90 0.05 -1.21 -0.95 0.00 0.00 178.83 177.98 1r43 s GLU 55 N -4.28 -0.62 0.11 1.46 0.41 -1.26 -4.96 118.70 109.55 1r43 s GLU 55 Ca -0.08 0.80 -0.15 0.00 -0.41 0.00 0.00 54.97 55.13 1r43 s GLU 55 Cb 0.12 -1.59 -0.05 0.00 -1.78 0.00 0.00 34.13 30.83 1r43 s GLU 55 CO 0.83 -3.51 1.52 0.66 -0.49 0.00 0.00 175.26 174.26 1r43 h SER 56 N -2.47 0.66 0.34 -0.19 4.64 -2.05 -3.24 113.55 111.24 1r43 h SER 56 Ca -0.60 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 60.37 1r43 h SER 56 Cb 1.33 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1r43 h SER 56 CO 0.51 0.87 -0.02 0.00 -0.87 0.00 0.00 176.83 177.32 1r43 n HIS 57 N -4.43 0.00 -1.61 4.77 1.44 -1.26 -4.55 115.22 109.59 1r43 n HIS 57 Ca -0.02 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.39 1r43 n HIS 57 Cb 0.33 -0.17 -0.05 0.00 0.12 0.00 0.00 29.99 30.22 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 -1.09 3.14 -4.24 -1.40 1.02 -1.23 -4.91 120.64 111.94 1r43 n GLU 58 Ca 0.17 -2.59 -0.17 0.00 -0.02 0.00 0.00 57.16 54.56 1r43 n GLU 58 Cb 0.21 -2.32 -0.08 0.00 -0.02 0.00 0.00 31.44 29.23 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 -1.15 1.51 0.00 -0.32 -0.12 -1.26 -1.68 117.98 114.96 1r43 s PHE 59 Ca 0.59 -1.54 0.00 0.00 -0.05 0.00 0.00 56.93 55.93 1r43 s PHE 59 Cb 0.31 -0.59 0.00 0.00 -0.63 0.00 0.00 43.02 42.10 1r43 s PHE 59 CO -0.16 -0.85 0.00 0.41 -0.05 0.00 0.00 175.22 174.58 1r43 n GLY 60 N -0.52 5.67 0.00 1.99 0.00 -0.22 -4.89 105.19 107.21 1r43 n GLY 60 Ca 0.05 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.29 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 -3.67 1.61 0.63 -0.16 -0.95 116.66 114.12 1r43 n ARG 62 Ca 0.00 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.65 1r43 n ARG 62 Cb 0.00 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 32.80 1r43 n ARG 62 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1r43 n ARG 63 N 0.00 1.15 -2.39 -0.14 0.63 -1.26 -4.46 116.66 110.18 1r43 n ARG 63 Ca 0.00 -3.93 -0.41 0.00 -0.92 0.00 0.00 57.85 52.59 1r43 n ARG 63 Cb 0.00 -2.02 -0.04 0.00 0.45 0.00 0.00 32.46 30.86 1r43 n ARG 63 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1r43 s LEU 64 N -0.86 4.51 0.28 6.15 1.43 -1.26 0.57 118.68 129.50 1r43 s LEU 64 Ca 0.29 2.34 -0.30 0.00 -1.03 0.00 0.00 54.13 55.43 1r43 s LEU 64 Cb 0.00 -3.63 -0.12 0.00 0.03 0.00 0.00 46.19 42.48 1r43 s LEU 64 CO -0.18 -0.25 1.63 0.00 0.23 0.00 0.00 176.35 177.78 1r43 s ALA 65 N -0.97 3.79 0.00 4.21 0.00 -1.26 -2.96 121.76 124.56 1r43 s ALA 65 Ca 0.47 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.02 1r43 s ALA 65 Cb -0.33 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.12 1r43 s ALA 65 CO 0.42 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.60 1r43 n GLY 66 N 2.45 0.74 3.94 0.00 0.00 -1.26 -4.91 105.19 106.14 1r43 n GLY 66 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 1r43 n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r43 s THR 67 N -2.58 4.36 0.39 2.61 -4.23 -1.16 -4.60 115.64 110.43 1r43 s THR 67 Ca 0.00 -0.32 0.16 0.00 -1.18 0.00 0.00 61.69 60.34 1r43 s THR 67 Cb 0.00 -3.63 0.37 0.00 1.34 0.00 0.00 72.50 70.58 1r43 s THR 67 CO 0.00 -0.48 1.80 0.00 -0.54 0.00 0.00 174.62 175.40 1r43 h ALA 68 N 0.39 2.11 0.00 3.99 0.00 -1.95 0.25 119.26 124.05 1r43 h ALA 68 Ca -0.47 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1r43 h ALA 68 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1r43 h ALA 68 CO 0.59 -0.46 -0.05 1.28 0.00 0.00 0.00 179.25 180.60 1r43 n LEU 69 N -4.61 0.71 0.01 0.00 4.77 -1.26 -1.08 117.00 115.54 1r43 n LEU 69 Ca 0.23 0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 56.65 1r43 n LEU 69 Cb 0.75 -0.33 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 1r43 n LEU 69 CO 0.27 -0.15 0.30 -0.78 -1.33 0.00 0.00 177.39 175.70 1r43 h ASP 70 N 0.00 -0.12 -0.62 -1.43 3.58 -0.77 -3.35 116.42 113.71 1r43 h ASP 70 Ca 0.00 -0.40 0.13 0.00 0.42 0.00 0.00 57.03 57.18 1r43 h ASP 70 Cb 0.71 0.03 -0.11 0.00 1.72 0.00 0.00 39.33 41.68 1r43 h ASP 70 CO 0.00 0.52 -0.02 1.23 -2.88 0.00 0.00 179.24 178.08 1r43 h GLY 71 N -0.94 0.63 -1.67 -0.78 0.00 -1.34 -1.80 103.07 97.17 1r43 h GLY 71 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1r43 h GLY 71 CO 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.35 1r43 n ALA 72 N -2.84 1.40 0.00 3.60 0.00 -0.24 -0.53 120.51 121.89 1r43 n ALA 72 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1r43 n ALA 72 Cb 0.36 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 0.81 0.00 -0.02 0.00 1.74 -0.68 -2.23 116.66 116.29 1r43 n ARG 74 Ca 0.00 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1r43 n ARG 74 Cb 0.02 0.00 0.12 0.00 -1.02 0.00 0.00 32.46 31.58 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 0.60 -0.43 0.55 3.32 -1.08 1.17 116.42 120.55 1r43 h ASP 75 Ca 0.00 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 56.73 1r43 h ASP 75 Cb 0.00 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1r43 h ASP 75 CO 0.00 0.90 -0.00 -0.25 -1.72 0.00 0.00 179.24 178.17 1r43 h TRP 76 N 0.49 0.83 -0.12 4.55 7.01 -1.72 -3.05 115.95 123.94 1r43 h TRP 76 Ca 0.05 -0.14 -0.10 0.00 2.11 0.00 0.00 58.89 60.81 1r43 h TRP 76 Cb 0.83 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.66 1r43 h TRP 76 CO 0.03 0.82 -0.38 0.35 -2.79 0.00 0.00 178.44 176.47 1r43 h PHE 77 N 0.60 0.29 -0.03 2.65 3.57 -1.58 -2.09 116.94 120.34 1r43 h PHE 77 Ca 0.12 -0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.46 1r43 h PHE 77 Cb 0.49 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1r43 h PHE 77 CO 0.04 0.60 -0.38 1.79 -2.23 0.00 0.00 178.31 178.13 1r43 h THR 78 N 0.22 1.28 0.09 4.41 1.35 0.13 -3.10 112.91 117.29 1r43 h THR 78 Ca 0.02 -1.35 -0.26 0.00 -0.55 0.00 0.00 66.41 64.28 1r43 h THR 78 Cb 0.77 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 68.86 1r43 h THR 78 CO 0.06 0.39 -1.22 0.78 -0.25 0.00 0.00 175.52 175.28 1r43 h ASN 79 N 0.06 0.30 -0.21 5.36 2.35 -1.32 -2.25 115.58 119.88 1r43 h ASN 79 Ca 0.00 -0.33 -0.11 0.00 -0.55 0.00 0.00 56.30 55.31 1r43 h ASN 79 Cb 0.70 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.97 1r43 h ASN 79 CO 0.05 1.26 -0.29 -0.33 -1.65 0.00 0.00 177.43 176.47 1r43 h GLU 80 N 0.05 0.56 -0.50 0.81 4.39 -1.47 -2.52 114.58 115.90 1r43 h GLU 80 Ca -0.12 -0.33 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 1r43 h GLU 80 Cb 1.93 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 30.58 1r43 h GLU 80 CO 0.18 0.93 0.27 0.00 -1.16 0.00 0.00 179.01 179.23 1r43 h GLU 82 N 0.67 0.05 -0.02 0.00 5.08 -1.44 -1.60 114.58 117.30 1r43 h GLU 82 Ca 0.18 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1r43 h GLU 82 Cb 0.06 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1r43 h GLU 82 CO -0.03 0.45 0.00 -1.13 -1.00 0.00 0.00 179.01 177.30 1r43 n SER 83 N -4.05 0.27 -0.08 1.42 3.41 -0.95 -2.53 113.62 111.11 1r43 n SER 83 Ca -0.02 -1.42 -0.06 0.00 -0.26 0.00 0.00 58.87 57.10 1r43 n SER 83 Cb 0.44 -0.01 -0.14 0.00 -0.26 0.00 0.00 64.21 64.24 1r43 n SER 83 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1r43 n LEU 84 N -0.63 0.00 0.00 1.04 4.77 -0.66 -5.03 117.00 116.49 1r43 n LEU 84 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1r43 n LEU 84 Cb 0.11 0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1r43 n LEU 84 CO 0.12 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1r43 n GLY 85 N 1.90 1.93 3.98 -0.72 0.00 -0.87 -5.05 105.19 106.36 1r43 n GLY 85 Ca -0.25 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 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 -4.09 2.92 -0.57 0.00 2.20 -1.23 -4.43 119.74 114.54 1r43 s LYS 87 Ca 0.40 -1.49 -0.27 0.00 -0.36 0.00 0.00 55.97 54.24 1r43 s LYS 87 Cb -0.09 -4.14 -0.01 0.00 -1.51 0.00 0.00 37.83 32.08 1r43 s LYS 87 CO 0.30 -1.12 1.67 0.08 -0.36 0.00 0.00 175.35 175.92 1r43 s VAL 88 N 1.59 3.53 0.09 4.02 1.01 -1.26 -3.42 120.40 125.96 1r43 s VAL 88 Ca 0.04 0.40 -0.28 0.00 0.00 0.00 0.00 61.98 62.13 1r43 s VAL 88 Cb -0.26 -4.12 -0.06 0.00 0.00 0.00 0.00 36.38 31.94 1r43 s VAL 88 CO 0.05 -0.99 0.88 -0.54 0.00 0.00 0.00 175.10 174.49 1r43 s LYS 89 N 6.29 4.62 -0.16 2.72 1.02 0.49 -4.91 119.74 129.80 1r43 s LYS 89 Ca 0.62 1.29 0.01 0.00 0.02 0.00 0.00 55.97 57.91 1r43 s LYS 89 Cb -0.13 -3.37 0.02 0.00 -0.52 0.00 0.00 37.83 33.83 1r43 s LYS 89 CO 0.23 0.26 -0.19 0.08 -0.92 0.00 0.00 175.35 174.82 1r43 s VAL 90 N -0.09 1.90 0.90 3.17 1.01 -1.26 -0.51 120.40 125.53 1r43 s VAL 90 Ca 0.43 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 1r43 s VAL 90 Cb -0.22 -1.72 0.20 0.00 0.00 0.00 0.00 36.38 34.63 1r43 s VAL 90 CO 0.27 0.52 1.23 1.51 0.00 0.00 0.00 175.10 178.62 1r43 s ASP 91 N 1.20 3.34 0.45 3.32 -4.77 -0.89 -1.63 116.67 117.70 1r43 s ASP 91 Ca 0.01 -0.10 0.21 0.00 -3.30 0.00 0.00 52.55 49.38 1r43 s ASP 91 Cb -0.14 0.03 1.09 0.00 -1.09 0.00 0.00 42.92 42.81 1r43 s ASP 91 CO -0.09 -2.56 1.94 0.11 0.70 0.00 0.00 175.17 175.28 1r43 h LYS 92 N -1.32 0.00 -0.66 2.11 1.57 -1.49 -0.71 116.57 116.08 1r43 h LYS 92 Ca -0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1r43 h LYS 92 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1r43 h LYS 92 CO 0.34 0.22 0.00 -0.89 -0.57 0.00 0.00 179.45 178.55 1r43 n ILE 93 N -3.79 1.31 -2.33 1.86 5.41 -1.26 -4.43 119.36 116.13 1r43 n ILE 93 Ca -0.02 -0.98 -0.11 0.00 1.00 0.00 0.00 62.75 62.64 1r43 n ILE 93 Cb 0.33 0.25 0.00 0.00 -0.71 0.00 0.00 39.64 39.50 1r43 n ILE 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1r43 n GLY 94 N 1.29 -0.04 0.31 7.39 0.00 -0.32 -4.65 105.19 109.18 1r43 n GLY 94 Ca 0.23 -0.40 -0.03 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.18 -1.12 0.00 1.61 3.02 -1.26 -4.12 115.26 113.21 1r43 n ASN 95 Ca -0.11 -0.55 0.00 0.00 -0.03 0.00 0.00 54.58 53.89 1r43 n ASN 95 Cb 0.59 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 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 -2.72 0.00 -3.07 3.10 3.01 0.34 -2.09 117.46 116.03 1r43 n PHE 97 Ca 0.01 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.07 1r43 n PHE 97 Cb 0.05 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.47 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 3.53 -0.67 4.37 0.00 0.41 -0.38 121.76 129.01 1r43 s ALA 98 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 51.96 51.77 1r43 s ALA 98 Cb 0.00 -3.02 0.17 0.00 0.00 0.00 0.00 23.12 20.27 1r43 s ALA 98 CO 0.00 -0.54 0.49 0.08 0.00 0.00 0.00 175.76 175.78 1r43 s VAL 99 N 1.89 3.58 -0.12 0.00 1.01 -1.22 0.44 120.40 125.96 1r43 s VAL 99 Ca 0.31 -3.36 -0.29 0.00 0.00 0.00 0.00 61.98 58.64 1r43 s VAL 99 Cb -0.16 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1r43 s VAL 99 CO 0.11 -0.92 1.73 -0.47 0.00 0.00 0.00 175.10 175.55 1r43 s TYR 100 N -0.53 1.86 0.39 5.22 5.04 0.13 -3.51 117.35 125.95 1r43 s TYR 100 Ca 0.20 0.29 -0.27 0.00 -2.44 0.00 0.00 57.07 54.84 1r43 s TYR 100 Cb -0.17 -3.98 -0.11 0.00 0.35 0.00 0.00 41.96 38.05 1r43 s TYR 100 CO -0.06 -3.72 1.39 -0.35 -1.34 0.00 0.00 175.55 171.47 1r43 n PRO 101 N 7.55 2.36 0.00 4.97 -0.04 -1.26 -2.24 135.00 146.33 1r43 n PRO 101 Ca 0.19 0.83 0.00 0.00 -0.04 0.00 0.00 63.50 64.48 1r43 n PRO 101 Cb 0.44 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 1r43 n PRO 101 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1r43 n GLY 102 N 0.61 5.05 0.11 0.55 0.00 -1.26 -4.59 105.19 105.65 1r43 n GLY 102 Ca 0.04 -2.01 -0.14 0.00 0.00 0.00 0.00 46.02 43.91 1r43 n GLY 102 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r43 n LYS 103 N 0.00 0.69 -3.64 1.61 5.02 0.13 -4.89 118.16 117.08 1r43 n LYS 103 Ca 0.00 0.22 -0.23 0.00 -2.02 0.00 0.00 58.31 56.28 1r43 n LYS 103 Cb 0.00 -1.69 -0.17 0.00 -0.02 0.00 0.00 35.03 33.15 1r43 n LYS 103 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1r43 s ASN 104 N -6.36 1.68 0.43 4.39 2.47 0.65 -5.00 114.94 113.21 1r43 s ASN 104 Ca -0.15 -0.23 0.00 0.00 0.42 0.00 0.00 52.86 52.89 1r43 s ASN 104 Cb 0.07 -0.17 0.00 0.00 -1.45 0.00 0.00 41.25 39.70 1r43 s ASN 104 CO 0.78 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 174.47 1r43 n GLY 105 N 5.29 -2.34 0.00 1.21 0.00 -1.26 -4.26 105.19 103.84 1r43 n GLY 105 Ca -0.05 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 -4.08 0.89 3.41 -0.02 0.00 -1.26 -3.70 105.19 100.42 1r43 n GLY 106 Ca -0.03 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 1r43 n GLY 106 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r43 n LYS 107 N 0.00 -1.79 -2.13 1.61 4.81 -1.26 -4.24 118.16 115.16 1r43 n LYS 107 Ca 0.00 1.42 -0.41 0.00 -0.87 0.00 0.00 58.31 58.46 1r43 n LYS 107 Cb 0.00 -2.25 -0.02 0.00 0.02 0.00 0.00 35.03 32.78 1r43 n LYS 107 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1r43 s PRO 108 N -2.28 4.36 -0.28 1.64 0.04 -1.26 -4.27 135.00 132.96 1r43 s PRO 108 Ca 0.32 2.20 -0.28 0.00 0.04 0.00 0.00 61.00 63.28 1r43 s PRO 108 Cb -0.04 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 31.44 1r43 s PRO 108 CO 0.76 -0.18 1.02 -0.08 0.04 0.00 0.00 177.00 178.57 1r43 s THR 109 N -1.08 4.62 -0.09 1.26 -1.32 0.42 -0.85 115.64 118.60 1r43 s THR 109 Ca 0.49 1.81 -0.18 0.00 -1.21 0.00 0.00 61.69 62.60 1r43 s THR 109 Cb -0.39 -4.34 -0.04 0.00 -1.51 0.00 0.00 72.50 66.22 1r43 s THR 109 CO 0.52 -0.32 0.48 0.00 -2.21 0.00 0.00 174.62 173.09 1r43 s ALA 110 N 3.37 3.50 -0.15 11.08 0.00 -0.14 -2.00 121.76 137.42 1r43 s ALA 110 Ca 0.43 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.23 1r43 s ALA 110 Cb -0.14 -2.62 0.02 0.00 0.00 0.00 0.00 23.12 20.38 1r43 s ALA 110 CO 0.11 0.07 -0.20 -0.08 0.00 0.00 0.00 175.76 175.66 1r43 s THR 111 N 0.34 1.97 -0.26 0.00 -1.32 0.42 -0.03 115.64 116.76 1r43 s THR 111 Ca 0.26 -0.90 -0.36 0.00 -1.21 0.00 0.00 61.69 59.47 1r43 s THR 111 Cb -0.16 -1.77 0.16 0.00 -1.51 0.00 0.00 72.50 69.23 1r43 s THR 111 CO 0.11 0.53 1.33 -0.83 -2.21 0.00 0.00 174.62 173.55 1r43 s GLY 112 N 1.08 -0.17 0.00 6.08 0.00 -0.94 -0.46 107.32 112.91 1r43 s GLY 112 Ca -0.01 2.01 0.00 0.00 0.00 0.00 0.00 44.72 46.72 1r43 s GLY 112 CO -0.07 0.71 0.00 -1.26 0.00 0.00 0.00 173.10 172.47 1r43 n SER 113 N 0.08 0.00 -3.94 1.64 2.88 -0.64 -4.56 113.62 109.07 1r43 n SER 113 Ca 0.03 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.48 1r43 n SER 113 Cb 0.57 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.93 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 3.03 0.21 -1.30 0.66 -3.43 -1.24 -0.87 115.29 112.35 1r43 s HIS 114 Ca 0.00 -0.47 0.14 0.00 -0.80 0.00 0.00 55.06 53.92 1r43 s HIS 114 Cb 0.00 -0.16 0.01 0.00 -1.43 0.00 0.00 32.58 31.01 1r43 s HIS 114 CO 0.00 -0.29 0.78 1.28 -2.00 0.00 0.00 174.74 174.51 1r43 n LEU 115 N 1.13 1.54 -4.84 5.38 4.77 -1.26 -2.81 117.00 120.90 1r43 n LEU 115 Ca -0.21 -0.80 -0.35 0.00 -0.03 0.00 0.00 56.01 54.62 1r43 n LEU 115 Cb 0.57 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.60 1r43 n LEU 115 CO 0.22 0.30 0.25 1.51 -1.33 0.00 0.00 177.39 178.34 1r43 s ASP 116 N -1.60 6.84 0.53 -1.43 -4.77 -1.26 -4.90 116.67 110.08 1r43 s ASP 116 Ca 0.12 1.11 0.06 0.00 -3.30 0.00 0.00 52.55 50.54 1r43 s ASP 116 Cb 0.11 -2.30 0.04 0.00 -1.09 0.00 0.00 42.92 39.68 1r43 s ASP 116 CO 0.32 0.08 0.45 0.42 0.70 0.00 0.00 175.17 177.14 1r43 s THR 117 N -1.50 1.83 1.11 2.11 -4.23 0.19 -4.71 115.64 110.45 1r43 s THR 117 Ca 0.39 -1.41 -0.19 0.00 -1.18 0.00 0.00 61.69 59.30 1r43 s THR 117 Cb -0.15 -2.24 0.27 0.00 1.34 0.00 0.00 72.50 71.72 1r43 s THR 117 CO 0.19 0.00 1.07 1.67 -0.54 0.00 0.00 174.62 177.01 1r43 n GLN 118 N -1.80 -2.68 -3.25 3.99 -0.06 -1.26 -4.42 117.38 107.90 1r43 n GLN 118 Ca 0.01 -1.70 -0.39 0.00 -2.00 0.00 0.00 57.00 52.93 1r43 n GLN 118 Cb 0.64 -1.49 -0.06 0.00 -4.06 0.00 0.00 30.24 25.27 1r43 n GLN 118 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 1r43 s PRO 119 N -5.41 4.28 -0.45 3.69 0.04 -1.26 -4.39 135.00 131.50 1r43 s PRO 119 Ca 0.68 0.66 -0.12 0.00 0.04 0.00 0.00 61.00 62.26 1r43 s PRO 119 Cb -0.06 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.16 1r43 s PRO 119 CO 0.51 0.37 0.57 0.39 0.04 0.00 0.00 177.00 178.88 1r43 n GLU 120 N 2.75 -2.02 -4.34 4.56 4.71 -1.26 -4.96 120.64 120.08 1r43 n GLU 120 Ca -0.08 1.89 -0.20 0.00 -0.01 0.00 0.00 57.16 58.77 1r43 n GLU 120 Cb 0.51 -5.37 -0.09 0.00 -1.01 0.00 0.00 31.44 25.49 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 -2.57 2.08 0.28 0.62 0.00 -1.26 -3.65 121.76 117.25 1r43 s ALA 121 Ca 0.19 -1.77 0.04 0.00 0.00 0.00 0.00 51.96 50.42 1r43 s ALA 121 Cb -0.05 1.22 -0.03 0.00 0.00 0.00 0.00 23.12 24.26 1r43 s ALA 121 CO 0.70 -0.54 0.42 0.20 0.00 0.00 0.00 175.76 176.54 1r43 s GLY 122 N -3.41 1.30 0.00 0.00 0.00 -1.22 -4.01 107.32 99.97 1r43 s GLY 122 Ca 0.35 -1.20 0.29 0.00 0.00 0.00 0.00 44.72 44.16 1r43 s GLY 122 CO 0.21 -1.19 1.85 0.58 0.00 0.00 0.00 173.10 174.55 1r43 n LYS 123 N -1.53 0.47 -0.10 2.90 2.85 -1.26 -4.05 118.16 117.43 1r43 n LYS 123 Ca -0.07 -0.14 -0.11 0.00 -1.05 0.00 0.00 58.31 56.95 1r43 n LYS 123 Cb 0.57 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 33.30 1r43 n LYS 123 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1r43 n TYR 124 N -1.15 0.00 -1.68 5.58 4.02 -1.26 -4.60 117.16 118.08 1r43 n TYR 124 Ca 0.12 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.59 1r43 n TYR 124 Cb 0.29 -0.99 -0.03 0.00 -0.02 0.00 0.00 39.34 38.59 1r43 n TYR 124 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1r43 s ASP 125 N -5.60 5.86 0.00 7.72 2.15 -1.26 -2.17 116.67 123.38 1r43 s ASP 125 Ca -0.13 2.12 0.00 0.00 0.43 0.00 0.00 52.55 54.97 1r43 s ASP 125 Cb 0.06 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 1r43 s ASP 125 CO 0.79 -1.60 0.00 0.61 -0.17 0.00 0.00 175.17 174.80 1r43 n GLY 126 N 5.26 0.89 0.36 2.66 0.00 -1.26 -4.65 105.19 108.45 1r43 n GLY 126 Ca 0.25 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.30 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 1.13 0.05 -0.61 2.04 -1.51 -2.28 117.51 116.34 1r43 h ILE 127 Ca 0.00 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.51 1r43 h ILE 127 Cb 0.00 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.04 1r43 h ILE 127 CO 0.00 0.19 -0.33 0.25 0.00 0.00 0.00 178.15 178.26 1r43 h LEU 128 N 1.05 -1.00 -1.99 1.44 6.46 -1.69 0.10 115.31 119.68 1r43 h LEU 128 Ca 0.34 0.11 0.27 0.00 -0.12 0.00 0.00 57.88 58.48 1r43 h LEU 128 Cb 0.05 0.37 -0.04 0.00 -0.73 0.00 0.00 40.66 40.31 1r43 h LEU 128 CO -0.10 -0.34 0.67 1.23 -0.62 0.00 0.00 178.44 179.28 1r43 h GLY 129 N -0.45 0.01 0.00 3.75 0.00 -0.55 0.78 103.07 106.60 1r43 h GLY 129 Ca -0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 1r43 h GLY 129 CO -0.19 -0.00 -0.49 -2.08 0.00 0.00 0.00 176.54 173.77 1r43 h VAL 130 N 0.00 0.27 0.00 4.60 2.07 -1.18 -3.26 116.25 118.75 1r43 h VAL 130 Ca 0.44 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.64 1r43 h VAL 130 Cb 1.78 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1r43 h VAL 130 CO -0.01 0.09 -0.18 -0.07 0.02 0.00 0.00 177.57 177.43 1r43 h LEU 131 N -1.00 0.00 -0.53 2.57 3.38 -0.58 -1.60 115.31 117.55 1r43 h LEU 131 Ca -0.06 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1r43 h LEU 131 Cb 0.57 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1r43 h LEU 131 CO -0.04 0.18 0.12 0.00 0.09 0.00 0.00 178.44 178.79 1r43 h ALA 132 N 1.82 0.70 -0.64 1.53 0.00 -1.03 -2.01 119.26 119.64 1r43 h ALA 132 Ca -0.00 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 54.79 1r43 h ALA 132 Cb 0.37 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1r43 h ALA 132 CO 0.02 0.40 0.24 0.78 0.00 0.00 0.00 179.25 180.69 1r43 h GLY 133 N 0.75 0.90 0.28 0.00 0.00 -1.34 0.11 103.07 103.77 1r43 h GLY 133 Ca 0.17 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.38 1r43 h GLY 133 CO 0.00 -0.04 -0.47 -2.00 0.00 0.00 0.00 176.54 174.04 1r43 h LEU 134 N 0.41 -1.38 -1.34 3.11 6.46 -1.26 -1.81 115.31 119.50 1r43 h LEU 134 Ca 0.33 0.14 0.24 0.00 -0.12 0.00 0.00 57.88 58.47 1r43 h LEU 134 Cb 0.42 0.50 -0.09 0.00 -0.73 0.00 0.00 40.66 40.77 1r43 h LEU 134 CO -0.33 -0.55 0.65 -0.33 -0.62 0.00 0.00 178.44 177.26 1r43 h GLU 135 N -0.76 0.44 -0.28 1.25 4.39 -0.54 0.41 114.58 119.49 1r43 h GLU 135 Ca -0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1r43 h GLU 135 Cb 0.75 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1r43 h GLU 135 CO -0.22 0.29 0.18 0.28 -1.16 0.00 0.00 179.01 178.38 1r43 h VAL 136 N 0.45 1.08 -0.45 3.13 2.07 0.00 0.25 116.25 122.78 1r43 h VAL 136 Ca 0.57 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.85 1r43 h VAL 136 Cb 1.35 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1r43 h VAL 136 CO -0.28 0.08 -0.02 -0.07 0.02 0.00 0.00 177.57 177.29 1r43 h LEU 137 N 0.37 0.81 -1.79 2.57 3.38 -0.55 -2.18 115.31 117.91 1r43 h LEU 137 Ca 0.10 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.82 1r43 h LEU 137 Cb -0.03 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1r43 h LEU 137 CO -0.02 0.93 0.28 0.03 0.09 0.00 0.00 178.44 179.75 1r43 h ARG 138 N 0.66 0.25 0.11 1.13 3.08 0.36 -1.31 114.38 118.66 1r43 h ARG 138 Ca 0.13 -0.01 -0.30 0.00 0.07 0.00 0.00 59.98 59.86 1r43 h ARG 138 Cb 0.53 -0.06 0.03 0.00 0.08 0.00 0.00 29.97 30.56 1r43 h ARG 138 CO 0.03 0.16 -1.24 1.15 -1.07 0.00 0.00 179.97 179.00 1r43 h THR 139 N 0.25 1.29 -0.79 2.04 2.02 -0.38 -3.22 112.91 114.12 1r43 h THR 139 Ca 0.18 -2.47 0.18 0.00 0.77 0.00 0.00 66.41 65.08 1r43 h THR 139 Cb 0.40 2.68 -0.12 0.00 -1.74 0.00 0.00 68.15 69.37 1r43 h THR 139 CO -0.04 0.75 0.18 -0.26 0.37 0.00 0.00 175.52 176.53 1r43 h PHE 140 N 0.28 0.28 -0.22 3.16 0.05 -0.59 -2.17 116.94 117.72 1r43 h PHE 140 Ca -0.18 0.05 -0.19 0.00 3.82 0.00 0.00 57.97 61.46 1r43 h PHE 140 Cb 1.91 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.86 1r43 h PHE 140 CO 0.11 -0.13 -0.63 -0.22 -0.18 0.00 0.00 178.31 177.26 1r43 h LYS 141 N 0.24 0.79 -0.87 1.51 3.64 -1.55 0.47 116.57 120.80 1r43 h LYS 141 Ca 0.46 -0.55 0.09 0.00 -1.27 0.00 0.00 60.65 59.38 1r43 h LYS 141 Cb 0.84 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.68 1r43 h LYS 141 CO -0.57 1.17 0.56 -0.44 -2.27 0.00 0.00 179.45 177.91 1r43 h ASP 142 N 0.58 0.80 0.37 4.20 5.19 -1.41 -2.52 116.42 123.63 1r43 h ASP 142 Ca -0.01 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1r43 h ASP 142 Cb 1.24 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.60 1r43 h ASP 142 CO 0.13 0.48 -0.75 0.59 -3.12 0.00 0.00 179.24 176.58 1r43 n ASN 143 N -4.51 0.66 -1.18 6.45 3.02 -0.95 -4.95 115.26 113.79 1r43 n ASN 143 Ca 0.14 -0.42 -0.10 0.00 -0.03 0.00 0.00 54.58 54.17 1r43 n ASN 143 Cb 0.28 0.56 -0.00 0.00 -0.61 0.00 0.00 39.78 40.00 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 -1.62 -3.44 -4.65 6.41 3.02 -0.83 -4.99 115.26 109.16 1r43 n ASN 144 Ca 0.04 -0.01 -0.43 0.00 -0.03 0.00 0.00 54.58 54.16 1r43 n ASN 144 Cb 0.36 -2.69 -0.03 0.00 -0.61 0.00 0.00 39.78 36.81 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 -2.52 2.22 -0.45 3.10 5.04 0.16 -4.99 117.35 119.91 1r43 s TYR 145 Ca 0.00 0.51 -0.08 0.00 -2.44 0.00 0.00 57.07 55.06 1r43 s TYR 145 Cb 0.00 -3.86 0.11 0.00 0.35 0.00 0.00 41.96 38.56 1r43 s TYR 145 CO 0.00 -3.02 0.30 0.08 -1.34 0.00 0.00 175.55 171.57 1r43 s VAL 146 N 4.38 4.05 0.51 3.14 1.01 -1.26 -4.66 120.40 127.58 1r43 s VAL 146 Ca 0.68 -1.73 -0.23 0.00 0.00 0.00 0.00 61.98 60.70 1r43 s VAL 146 Cb -0.27 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.41 1r43 s VAL 146 CO 0.26 -0.69 1.35 -0.81 0.00 0.00 0.00 175.10 175.22 1r43 n PRO 147 N 4.86 1.82 -0.30 2.72 -0.04 -1.26 -4.69 135.00 138.10 1r43 n PRO 147 Ca -0.08 0.66 -0.04 0.00 -0.04 0.00 0.00 63.50 64.00 1r43 n PRO 147 Cb 0.41 -2.56 0.07 0.00 -0.04 0.00 0.00 33.50 31.39 1r43 n PRO 147 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1r43 h ASN 148 N 1.66 0.96 -3.08 3.54 2.35 -1.94 0.38 115.58 119.45 1r43 h ASN 148 Ca -0.50 -0.06 -0.48 0.00 -0.55 0.00 0.00 56.30 54.71 1r43 h ASN 148 Cb 1.30 -0.24 -0.14 0.00 0.05 0.00 0.00 38.32 39.29 1r43 h ASN 148 CO 0.58 0.74 -0.65 -0.31 -1.65 0.00 0.00 177.43 176.13 1r43 s TYR 149 N -6.00 1.93 0.45 1.19 1.51 -1.26 -0.26 117.35 114.90 1r43 s TYR 149 Ca -0.13 -0.79 -0.25 0.00 -1.01 0.00 0.00 57.07 54.89 1r43 s TYR 149 Cb 0.16 -1.16 -0.08 0.00 -0.11 0.00 0.00 41.96 40.76 1r43 s TYR 149 CO 0.80 0.18 1.39 -0.51 -1.11 0.00 0.00 175.55 176.29 1r43 s ASP 150 N -3.45 5.94 -0.13 2.29 1.11 -1.24 -4.59 116.67 116.60 1r43 s ASP 150 Ca 0.31 2.83 0.03 0.00 0.18 0.00 0.00 52.55 55.90 1r43 s ASP 150 Cb 0.06 -2.65 0.00 0.00 1.07 0.00 0.00 42.92 41.40 1r43 s ASP 150 CO 0.13 -1.12 -0.22 -0.69 1.18 0.00 0.00 175.17 174.45 1r43 s VAL 151 N -1.23 2.18 0.16 -1.27 1.01 -0.95 -0.43 120.40 119.87 1r43 s VAL 151 Ca 0.61 -0.95 0.11 0.00 0.00 0.00 0.00 61.98 61.74 1r43 s VAL 151 Cb -0.42 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 1r43 s VAL 151 CO 0.53 0.55 -0.25 0.00 0.00 0.00 0.00 175.10 175.93 1r43 s VAL 153 N -1.36 2.14 -0.15 0.00 1.01 0.17 -0.44 120.40 121.77 1r43 s VAL 153 Ca 0.17 -1.22 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 1r43 s VAL 153 Cb -0.09 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 1r43 s VAL 153 CO 0.08 0.30 0.15 -0.69 0.00 0.00 0.00 175.10 174.94 1r43 s VAL 154 N 1.22 5.44 -0.18 2.92 1.01 0.39 -0.44 120.40 130.75 1r43 s VAL 154 Ca -0.01 0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.21 1r43 s VAL 154 Cb -0.16 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1r43 s VAL 154 CO -0.09 0.52 -0.14 0.54 0.00 0.00 0.00 175.10 175.93 1r43 s VAL 155 N -0.32 2.63 -0.04 2.92 0.11 -1.26 -1.63 120.40 122.82 1r43 s VAL 155 Ca 0.12 -0.76 -0.19 0.00 -2.93 0.00 0.00 61.98 58.22 1r43 s VAL 155 Cb -0.12 -2.14 -0.05 0.00 -1.53 0.00 0.00 36.38 32.55 1r43 s VAL 155 CO 0.02 0.50 0.55 0.26 -3.33 0.00 0.00 175.10 173.09 1r43 s TRP 156 N 1.16 3.64 0.37 1.54 0.52 -0.05 -4.30 118.94 121.82 1r43 s TRP 156 Ca 0.01 1.09 -0.28 0.00 0.02 0.00 0.00 56.10 56.94 1r43 s TRP 156 Cb -0.14 -2.57 -0.11 0.00 -1.15 0.00 0.00 33.47 29.50 1r43 s TRP 156 CO -0.05 0.32 1.49 0.12 0.02 0.00 0.00 176.95 178.85 1r43 s PHE 157 N -0.02 2.60 -1.26 -1.98 5.36 -1.26 -4.27 117.98 117.15 1r43 s PHE 157 Ca 0.29 1.16 -0.30 0.00 -0.96 0.00 0.00 56.93 57.12 1r43 s PHE 157 Cb -0.17 -4.02 0.04 0.00 -0.34 0.00 0.00 43.02 38.53 1r43 s PHE 157 CO 0.15 -3.00 0.56 -1.71 -1.46 0.00 0.00 175.22 169.77 1r43 n ASN 158 N 0.52 -3.23 -0.14 6.13 5.15 -1.26 -0.42 115.26 122.01 1r43 n ASN 158 Ca 0.01 -1.30 -0.09 0.00 -0.60 0.00 0.00 54.58 52.60 1r43 n ASN 158 Cb 0.39 -1.56 -0.01 0.00 -0.53 0.00 0.00 39.78 38.07 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 -2.49 0.64 -0.45 1.20 4.22 -1.90 -2.04 114.58 113.75 1r43 h GLU 159 Ca -0.70 -0.15 0.02 0.00 0.08 0.00 0.00 59.36 58.61 1r43 h GLU 159 Cb 1.39 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 1r43 h GLU 159 CO 0.54 0.65 0.27 0.93 -2.18 0.00 0.00 179.01 179.22 1r43 h GLU 160 N 0.51 0.52 -0.14 1.92 4.39 -1.88 0.28 114.58 120.18 1r43 h GLU 160 Ca 0.13 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.74 1r43 h GLU 160 Cb 0.29 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1r43 h GLU 160 CO -0.00 0.34 -0.05 0.41 -1.16 0.00 0.00 179.01 178.55 1r43 n GLY 161 N -1.23 0.59 0.06 -3.84 0.00 -1.25 -4.63 105.19 94.89 1r43 n GLY 161 Ca 0.02 -0.94 -0.06 0.00 0.00 0.00 0.00 46.02 45.04 1r43 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r43 h ALA 162 N 0.00 0.00 0.00 4.61 0.00 -1.88 -3.32 119.26 118.68 1r43 h ALA 162 Ca -0.06 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1r43 h ALA 162 Cb 0.21 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1r43 h ALA 162 CO 0.09 0.03 -0.28 -0.09 0.00 0.00 0.00 179.25 178.99 1r43 h ARG 163 N -1.00 0.00 -4.15 0.00 2.43 -1.91 -3.40 114.38 106.35 1r43 h ARG 163 Ca -0.01 0.00 -0.50 0.00 -0.81 0.00 0.00 59.98 58.66 1r43 h ARG 163 Cb 0.42 0.00 -0.37 0.00 -0.42 0.00 0.00 29.97 29.60 1r43 h ARG 163 CO -0.00 0.28 -0.80 -0.06 -1.51 0.00 0.00 179.97 177.88 1r43 s PHE 164 N -4.11 1.29 -0.61 2.20 0.40 -1.26 -1.38 117.98 114.50 1r43 s PHE 164 Ca -0.02 -0.58 -0.04 0.00 -0.60 0.00 0.00 56.93 55.69 1r43 s PHE 164 Cb 0.13 -1.10 -0.03 0.00 0.51 0.00 0.00 43.02 42.53 1r43 s PHE 164 CO 0.67 -0.44 1.74 0.00 0.70 0.00 0.00 175.22 177.89 1r43 n ALA 165 N 4.81 3.46 -3.29 5.36 0.00 -1.25 -4.35 120.51 125.25 1r43 n ALA 165 Ca -0.13 -1.33 0.03 0.00 0.00 0.00 0.00 53.44 52.01 1r43 n ALA 165 Cb 0.50 -2.83 -0.02 0.00 0.00 0.00 0.00 19.45 17.10 1r43 n ALA 165 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1r43 s ARG 166 N 3.95 0.47 0.46 0.00 1.81 -1.25 -5.09 118.95 119.29 1r43 s ARG 166 Ca 0.26 0.95 -0.12 0.00 -1.72 0.00 0.00 55.73 55.11 1r43 s ARG 166 Cb 0.07 0.55 -0.06 0.00 -0.45 0.00 0.00 34.95 35.05 1r43 s ARG 166 CO -0.02 -0.39 0.85 -1.54 -0.68 0.00 0.00 175.30 173.52 1r43 s SER 167 N 2.83 6.50 -1.56 0.23 1.04 -1.26 -3.90 113.70 117.58 1r43 s SER 167 Ca 0.08 1.26 -0.02 0.00 0.48 0.00 0.00 55.95 57.76 1r43 s SER 167 Cb -0.12 -2.38 0.01 0.00 0.10 0.00 0.00 66.02 63.62 1r43 s SER 167 CO -0.18 -0.51 0.17 0.00 0.98 0.00 0.00 173.24 173.70 1r43 h THR 169 N -0.38 0.74 0.26 0.00 2.02 -1.50 0.98 112.91 115.03 1r43 h THR 169 Ca -0.46 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 1r43 h THR 169 Cb 1.33 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1r43 h THR 169 CO 0.53 0.14 -0.12 1.23 0.37 0.00 0.00 175.52 177.67 1r43 h GLY 170 N 0.79 -0.36 1.22 2.16 0.00 -0.95 -2.92 103.07 103.01 1r43 h GLY 170 Ca 0.56 0.13 -0.11 0.00 0.00 0.00 0.00 47.33 47.91 1r43 h GLY 170 CO -0.36 -0.13 -0.13 1.48 0.00 0.00 0.00 176.54 177.39 1r43 h SER 171 N -0.65 0.91 -0.99 0.19 4.64 -1.72 -2.93 113.55 113.00 1r43 h SER 171 Ca -0.04 -0.30 0.17 0.00 -0.47 0.00 0.00 61.79 61.16 1r43 h SER 171 Cb 0.46 -0.25 -0.10 0.00 -0.31 0.00 0.00 62.40 62.20 1r43 h SER 171 CO 0.06 1.05 0.62 0.28 -0.87 0.00 0.00 176.83 177.96 1r43 h SER 172 N 0.81 0.79 0.39 4.97 0.02 -0.78 0.46 113.55 120.21 1r43 h SER 172 Ca 0.13 0.08 -0.29 0.00 -0.84 0.00 0.00 61.79 60.86 1r43 h SER 172 Cb 0.67 -0.07 0.02 0.00 0.14 0.00 0.00 62.40 63.16 1r43 h SER 172 CO 0.05 0.32 -1.28 0.58 -1.14 0.00 0.00 176.83 175.37 1r43 h VAL 173 N 0.79 1.38 -0.86 2.27 2.07 -1.49 0.19 116.25 120.60 1r43 h VAL 173 Ca 0.55 -2.77 0.06 0.00 0.82 0.00 0.00 66.70 65.36 1r43 h VAL 173 Cb 0.81 2.86 -0.06 0.00 -1.52 0.00 0.00 31.29 33.38 1r43 h VAL 173 CO -0.33 0.82 0.54 -0.25 0.02 0.00 0.00 177.57 178.37 1r43 h TRP 174 N 0.15 1.00 -0.02 1.57 7.01 -0.94 -1.18 115.95 123.54 1r43 h TRP 174 Ca -0.17 0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.85 1r43 h TRP 174 Cb 1.97 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 28.71 1r43 h TRP 174 CO 0.09 0.52 0.00 -1.13 -2.79 0.00 0.00 178.44 175.13 1r43 n SER 175 N -4.61 0.39 -1.40 2.65 3.41 0.15 -0.66 113.62 113.55 1r43 n SER 175 Ca 0.12 -1.30 -0.17 0.00 -0.26 0.00 0.00 58.87 57.27 1r43 n SER 175 Cb 0.17 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.04 1r43 n SER 175 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1r43 n HIS 176 N -0.62 -0.12 0.14 7.33 8.25 -0.45 -4.89 115.22 124.86 1r43 n HIS 176 Ca 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.65 1r43 n HIS 176 Cb 0.15 -3.01 0.28 0.00 1.12 0.00 0.00 29.99 28.54 1r43 n HIS 176 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 1r43 h ASP 177 N 0.00 0.12 -3.90 0.41 3.58 -0.88 -3.45 116.42 112.29 1r43 h ASP 177 Ca -0.36 -0.05 -0.17 0.00 0.42 0.00 0.00 57.03 56.88 1r43 h ASP 177 Cb 1.14 -0.03 -0.25 0.00 1.72 0.00 0.00 39.33 41.90 1r43 h ASP 177 CO 0.51 0.51 -0.44 -0.22 -2.88 0.00 0.00 179.24 176.71 1r43 s LEU 178 N -8.19 1.13 0.39 2.28 2.96 -0.70 -4.98 118.68 111.57 1r43 s LEU 178 Ca -0.03 0.43 -0.19 0.00 -0.22 0.00 0.00 54.13 54.11 1r43 s LEU 178 Cb 0.14 0.80 -0.10 0.00 0.50 0.00 0.00 46.19 47.53 1r43 s LEU 178 CO 0.75 -0.10 0.88 -0.94 -1.32 0.00 0.00 176.35 175.62 1r43 s SER 179 N 0.02 6.90 0.20 3.68 1.04 -1.26 -3.89 113.70 120.39 1r43 s SER 179 Ca -0.01 1.57 -0.11 0.00 0.48 0.00 0.00 55.95 57.88 1r43 s SER 179 Cb -0.02 -2.49 0.24 0.00 0.10 0.00 0.00 66.02 63.85 1r43 s SER 179 CO 0.00 -0.30 1.74 0.25 0.98 0.00 0.00 173.24 175.91 1r43 h LEU 180 N 2.06 0.18 -1.65 2.42 5.85 -1.94 -0.13 115.31 122.10 1r43 h LEU 180 Ca -0.49 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.34 1r43 h LEU 180 Cb 1.18 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 1r43 h LEU 180 CO 0.62 0.12 0.28 1.05 -0.34 0.00 0.00 178.44 180.17 1r43 h GLU 181 N 0.37 0.45 -0.00 1.25 4.11 -1.99 -1.05 114.58 117.72 1r43 h GLU 181 Ca 0.28 -0.03 -0.13 0.00 0.07 0.00 0.00 59.36 59.56 1r43 h GLU 181 Cb 0.34 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1r43 h GLU 181 CO -0.30 0.30 -0.50 0.93 0.07 0.00 0.00 179.01 179.51 1r43 h GLU 182 N 0.46 0.34 -0.09 1.06 4.39 -1.47 -2.93 114.58 116.35 1r43 h GLU 182 Ca 0.17 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 1r43 h GLU 182 Cb 0.10 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1r43 h GLU 182 CO -0.04 1.05 0.03 0.00 -1.16 0.00 0.00 179.01 178.89 1r43 h ALA 183 N 0.30 0.12 -0.97 3.43 0.00 -1.01 -2.84 119.26 118.28 1r43 h ALA 183 Ca -0.06 -0.12 0.25 0.00 0.00 0.00 0.00 54.91 54.98 1r43 h ALA 183 Cb 1.23 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.85 1r43 h ALA 183 CO 0.10 -0.26 0.53 1.88 0.00 0.00 0.00 179.25 181.50 1r43 h TYR 184 N -0.05 0.90 0.00 0.00 0.05 -1.29 -1.48 116.97 115.10 1r43 h TYR 184 Ca 0.03 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1r43 h TYR 184 Cb 0.23 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.73 1r43 h TYR 184 CO 0.00 -0.02 0.00 0.78 -1.05 0.00 0.00 178.16 177.88 1r43 h GLY 185 N 0.48 0.00 -1.27 3.88 0.00 -1.30 -2.72 103.07 102.14 1r43 h GLY 185 Ca 0.64 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 47.53 1r43 h GLY 185 CO -0.52 0.00 -0.51 1.04 0.00 0.00 0.00 176.54 176.55 1r43 n LEU 186 N -2.53 -2.14 -4.09 3.11 4.77 -0.56 -4.81 117.00 110.75 1r43 n LEU 186 Ca 0.04 -0.19 -0.33 0.00 -0.03 0.00 0.00 56.01 55.50 1r43 n LEU 186 Cb 0.39 -1.11 -0.14 0.00 -2.33 0.00 0.00 43.42 40.23 1r43 n LEU 186 CO 0.28 -3.26 -0.37 -0.55 -1.33 0.00 0.00 177.39 172.17 1r43 s SER 188 N -2.14 4.74 0.29 -1.43 0.15 -0.34 -2.06 113.70 112.92 1r43 s SER 188 Ca 0.63 -1.64 -0.29 0.00 0.70 0.00 0.00 55.95 55.36 1r43 s SER 188 Cb -0.19 -1.64 -0.10 0.00 -1.71 0.00 0.00 66.02 62.38 1r43 s SER 188 CO 0.66 -0.30 1.11 -0.69 1.20 0.00 0.00 173.24 175.22 1r43 s VAL 189 N 1.09 3.45 -0.86 4.45 1.01 -0.48 -4.12 120.40 124.95 1r43 s VAL 189 Ca -0.01 1.43 -0.06 0.00 0.00 0.00 0.00 61.98 63.35 1r43 s VAL 189 Cb -0.20 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.29 1r43 s VAL 189 CO -0.05 0.32 0.75 0.61 0.00 0.00 0.00 175.10 176.73 1r43 n GLY 190 N 1.10 0.01 3.16 4.51 0.00 -1.26 -4.83 105.19 107.87 1r43 n GLY 190 Ca -0.01 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 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 -5.83 0.79 0.04 1.61 2.02 -1.26 -5.07 118.70 111.00 1r43 s GLU 191 Ca 0.37 -0.94 -0.27 0.00 0.02 0.00 0.00 54.97 54.16 1r43 s GLU 191 Cb -0.16 -0.77 -0.17 0.00 0.10 0.00 0.00 34.13 33.12 1r43 s GLU 191 CO 0.46 0.17 1.44 -0.44 0.02 0.00 0.00 175.26 176.91 1r43 h ASP 192 N 4.31 -0.37 -3.89 -0.19 5.19 -1.96 -3.37 116.42 116.15 1r43 h ASP 192 Ca -0.40 -0.11 -0.69 0.00 -0.62 0.00 0.00 57.03 55.21 1r43 h ASP 192 Cb 1.19 0.09 -0.36 0.00 0.18 0.00 0.00 39.33 40.44 1r43 h ASP 192 CO 0.40 -0.11 -0.31 -0.54 -3.12 0.00 0.00 179.24 175.57 1r43 s LYS 193 N -5.30 2.75 0.33 3.56 1.02 -1.26 -5.09 119.74 115.76 1r43 s LYS 193 Ca -0.15 -2.81 -0.28 0.00 0.02 0.00 0.00 55.97 52.75 1r43 s LYS 193 Cb 0.03 -3.77 -0.10 0.00 -0.52 0.00 0.00 37.83 33.48 1r43 s LYS 193 CO 0.59 -1.21 1.20 -1.25 -0.92 0.00 0.00 175.35 173.77 1r43 s PRO 194 N -0.54 4.39 0.12 -1.68 0.04 -1.26 -5.05 135.00 131.02 1r43 s PRO 194 Ca 0.20 1.98 0.04 0.00 0.04 0.00 0.00 61.00 63.27 1r43 s PRO 194 Cb -0.16 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 1r43 s PRO 194 CO -0.07 -0.08 -0.11 -1.83 0.04 0.00 0.00 177.00 174.96 1r43 s GLU 195 N -1.79 0.96 0.35 4.56 -1.05 -1.26 -4.86 118.70 115.61 1r43 s GLU 195 Ca 0.49 -1.29 -0.09 0.00 -0.15 0.00 0.00 54.97 53.93 1r43 s GLU 195 Cb -0.35 -0.63 -0.06 0.00 -0.44 0.00 0.00 34.13 32.64 1r43 s GLU 195 CO 0.45 0.09 0.69 -1.54 0.95 0.00 0.00 175.26 175.90 1r43 s SER 196 N -2.73 6.54 0.44 0.83 1.04 -1.26 -1.20 113.70 117.36 1r43 s SER 196 Ca 0.10 1.02 0.14 0.00 0.48 0.00 0.00 55.95 57.70 1r43 s SER 196 Cb -0.01 -2.27 1.05 0.00 0.10 0.00 0.00 66.02 64.88 1r43 s SER 196 CO 0.01 -0.29 1.97 -0.37 0.98 0.00 0.00 173.24 175.54 1r43 h VAL 197 N 1.36 0.87 -0.13 5.02 -1.51 -1.33 0.49 116.25 121.02 1r43 h VAL 197 Ca -0.47 -0.14 0.05 0.00 -1.23 0.00 0.00 66.70 64.91 1r43 h VAL 197 Cb 1.18 0.44 -0.05 0.00 -2.13 0.00 0.00 31.29 30.73 1r43 h VAL 197 CO 0.65 0.07 -0.20 0.22 -1.23 0.00 0.00 177.57 177.08 1r43 h TYR 198 N 0.40 -0.54 -0.57 5.19 3.20 -1.75 0.86 116.97 123.76 1r43 h TYR 198 Ca 0.29 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.16 1r43 h TYR 198 Cb 0.61 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 39.11 1r43 h TYR 198 CO -0.00 -0.28 0.23 -0.44 -1.64 0.00 0.00 178.16 176.03 1r43 h ASP 199 N -0.26 0.78 -0.13 -2.11 3.32 -1.23 -0.90 116.42 115.90 1r43 h ASP 199 Ca 0.10 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1r43 h ASP 199 Cb 0.41 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1r43 h ASP 199 CO -0.28 0.74 0.05 0.28 -1.72 0.00 0.00 179.24 178.30 1r43 h SER 200 N 0.78 0.19 -0.56 6.45 0.02 -1.07 0.94 113.55 120.30 1r43 h SER 200 Ca 0.19 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1r43 h SER 200 Cb 0.20 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1r43 h SER 200 CO -0.02 0.32 0.27 -0.07 -1.14 0.00 0.00 176.83 176.20 1r43 h LEU 201 N 0.04 0.72 -1.10 5.07 3.38 -0.79 -1.45 115.31 121.19 1r43 h LEU 201 Ca 0.04 -0.12 0.08 0.00 0.09 0.00 0.00 57.88 57.97 1r43 h LEU 201 Cb 0.20 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1r43 h LEU 201 CO -0.00 0.64 0.61 0.50 0.09 0.00 0.00 178.44 180.28 1r43 h LYS 202 N 0.75 1.01 -0.64 1.13 3.64 -1.07 0.55 116.57 121.93 1r43 h LYS 202 Ca 0.19 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1r43 h LYS 202 Cb 0.10 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 1r43 h LYS 202 CO -0.03 0.67 0.07 -0.91 -2.27 0.00 0.00 179.45 176.99 1r43 h ASN 203 N 1.04 1.05 0.49 4.20 2.35 0.20 -3.16 115.58 121.76 1r43 h ASN 203 Ca 0.42 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1r43 h ASN 203 Cb 0.28 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1r43 h ASN 203 CO -0.18 1.06 -0.64 2.30 -1.65 0.00 0.00 177.43 178.32 1r43 n ILE 204 N -4.20 0.07 -0.74 2.81 -5.35 -0.75 -4.96 119.36 106.24 1r43 n ILE 204 Ca 0.04 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 1r43 n ILE 204 Cb 0.31 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.47 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 1.46 1.24 2.24 3.28 0.00 -0.85 -4.90 105.19 107.67 1r43 n GLY 205 Ca 0.05 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.46 1.65 -3.33 1.61 4.02 0.13 -4.81 117.16 114.97 1r43 n TYR 206 Ca 0.00 -1.99 -0.46 0.00 -0.01 0.00 0.00 57.90 55.44 1r43 n TYR 206 Cb 0.17 -0.27 -0.04 0.00 -0.02 0.00 0.00 39.34 39.18 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 -3.77 5.39 0.66 -0.72 1.01 -1.24 -3.02 121.20 119.52 1r43 s ILE 207 Ca 0.38 -2.07 -0.08 0.00 0.00 0.00 0.00 60.65 58.88 1r43 s ILE 207 Cb 0.37 -4.38 0.15 0.00 0.01 0.00 0.00 42.46 38.60 1r43 s ILE 207 CO -0.02 -0.96 0.90 0.61 0.00 0.00 0.00 174.94 175.47 1r43 n GLY 208 N 4.51 -0.77 0.14 6.18 0.00 -0.88 -4.96 105.19 109.40 1r43 n GLY 208 Ca 0.02 -1.79 -0.22 0.00 0.00 0.00 0.00 46.02 44.03 1r43 n GLY 208 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1r43 h ASP 209 N -1.02 0.44 -3.96 1.61 3.32 -1.56 -3.34 116.42 111.90 1r43 h ASP 209 Ca -0.29 -0.95 -0.54 0.00 0.02 0.00 0.00 57.03 55.27 1r43 h ASP 209 Cb 0.87 -0.14 0.11 0.00 0.22 0.00 0.00 39.33 40.39 1r43 h ASP 209 CO 0.23 1.85 0.74 0.28 -1.72 0.00 0.00 179.24 180.62 1r43 s THR 210 N -2.56 2.10 0.47 0.35 -1.32 -1.06 -4.75 115.64 108.88 1r43 s THR 210 Ca -0.22 0.10 -0.22 0.00 -1.21 0.00 0.00 61.69 60.14 1r43 s THR 210 Cb 0.06 -3.06 -0.07 0.00 -1.51 0.00 0.00 72.50 67.92 1r43 s THR 210 CO 0.78 0.02 1.15 -2.84 -2.21 0.00 0.00 174.62 171.52 1r43 s PRO 211 N -2.21 3.70 -1.17 7.08 0.02 -1.26 -1.83 135.00 139.33 1r43 s PRO 211 Ca 0.56 1.72 -0.14 0.00 0.02 0.00 0.00 61.00 63.16 1r43 s PRO 211 Cb -0.45 -2.33 0.18 0.00 0.02 0.00 0.00 34.50 31.92 1r43 s PRO 211 CO 0.60 -0.59 1.36 0.00 -0.33 0.00 0.00 177.00 178.05 1r43 s ALA 212 N -1.61 4.04 -0.28 -1.55 0.00 -1.26 -4.26 121.76 116.85 1r43 s ALA 212 Ca 0.65 -3.37 -0.14 0.00 0.00 0.00 0.00 51.96 49.10 1r43 s ALA 212 Cb -0.27 -4.05 0.09 0.00 0.00 0.00 0.00 23.12 18.90 1r43 s ALA 212 CO 0.32 -2.71 0.67 0.45 0.00 0.00 0.00 175.76 174.49 1r43 s SER 213 N 2.70 -0.99 0.59 0.00 0.15 -1.26 -4.27 113.70 110.63 1r43 s SER 213 Ca 0.40 1.52 0.35 0.00 0.70 0.00 0.00 55.95 58.92 1r43 s SER 213 Cb -0.04 1.64 1.88 0.00 -1.71 0.00 0.00 66.02 67.79 1r43 s SER 213 CO -0.02 -0.23 2.21 0.10 1.20 0.00 0.00 173.24 176.50 1r43 h TYR 214 N 7.30 0.00 0.00 3.44 -0.00 -1.11 -2.10 116.97 124.50 1r43 h TYR 214 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.46 1r43 h TYR 214 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.92 1r43 h TYR 214 CO 0.09 0.03 -1.54 0.36 -0.00 0.00 0.00 178.16 177.10 1r43 n LYS 215 N -3.42 0.42 -0.03 0.10 2.85 -1.26 -4.32 118.16 112.50 1r43 n LYS 215 Ca -0.02 -0.10 -0.03 0.00 -1.05 0.00 0.00 58.31 57.11 1r43 n LYS 215 Cb 0.15 -1.54 -0.01 0.00 -0.65 0.00 0.00 35.03 32.98 1r43 n LYS 215 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1r43 n GLU 216 N -2.02 0.20 -3.27 -1.58 1.02 -0.86 -4.75 120.64 109.38 1r43 n GLU 216 Ca -0.01 0.23 -0.44 0.00 -0.02 0.00 0.00 57.16 56.92 1r43 n GLU 216 Cb 0.48 -1.01 -0.06 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 -4.59 6.18 0.09 1.62 2.47 -0.85 -5.02 114.94 114.85 1r43 s ASN 217 Ca -0.09 -1.25 0.09 0.00 0.42 0.00 0.00 52.86 52.03 1r43 s ASN 217 Cb 0.01 -2.24 -0.03 0.00 -1.45 0.00 0.00 41.25 37.54 1r43 s ASN 217 CO 0.13 -0.81 -0.23 -1.83 -3.72 0.00 0.00 177.10 170.64 1r43 s GLU 218 N 2.10 1.36 0.31 0.43 -1.05 -1.26 -4.48 118.70 116.10 1r43 s GLU 218 Ca 0.09 -1.15 0.09 0.00 -0.15 0.00 0.00 54.97 53.85 1r43 s GLU 218 Cb -0.23 -1.64 -0.05 0.00 -0.44 0.00 0.00 34.13 31.77 1r43 s GLU 218 CO 0.08 0.40 0.01 0.96 0.95 0.00 0.00 175.26 177.66 1r43 s ILE 219 N -1.00 2.94 -0.19 1.83 -4.36 -1.26 -4.16 121.20 115.00 1r43 s ILE 219 Ca 0.09 -1.95 -0.13 0.00 -0.26 0.00 0.00 60.65 58.40 1r43 s ILE 219 Cb -0.10 -2.79 -0.20 0.00 1.25 0.00 0.00 42.46 40.62 1r43 s ILE 219 CO 0.04 -0.27 0.14 -0.67 0.24 0.00 0.00 174.94 174.41 1r43 n ASP 220 N -0.93 1.98 -4.16 4.36 2.03 -0.03 -4.91 116.55 114.89 1r43 n ASP 220 Ca -0.05 0.28 -0.14 0.00 0.52 0.00 0.00 54.79 55.40 1r43 n ASP 220 Cb 0.61 -0.85 -0.10 0.00 -0.72 0.00 0.00 41.12 40.05 1r43 n ASP 220 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1r43 s ALA 221 N -2.47 1.44 -0.07 -1.67 0.00 -1.26 -4.19 121.76 113.53 1r43 s ALA 221 Ca -0.29 -1.77 -0.02 0.00 0.00 0.00 0.00 51.96 49.88 1r43 s ALA 221 Cb 0.08 1.28 0.03 0.00 0.00 0.00 0.00 23.12 24.52 1r43 s ALA 221 CO 0.64 -0.55 0.05 -1.58 0.00 0.00 0.00 175.76 174.31 1r43 s HIS 222 N -3.95 0.29 -0.10 0.00 2.46 -0.72 -0.97 115.29 112.29 1r43 s HIS 222 Ca 0.38 0.02 0.03 0.00 0.47 0.00 0.00 55.06 55.96 1r43 s HIS 222 Cb 0.07 -0.62 -0.00 0.00 -0.13 0.00 0.00 32.58 31.89 1r43 s HIS 222 CO 0.14 -0.29 -0.21 -0.06 -2.47 0.00 0.00 174.74 171.85 1r43 s PHE 223 N 2.10 2.62 -0.10 3.88 0.40 0.96 -2.12 117.98 125.71 1r43 s PHE 223 Ca 0.04 -0.92 0.01 0.00 -0.60 0.00 0.00 56.93 55.47 1r43 s PHE 223 Cb -0.13 -1.73 0.02 0.00 0.51 0.00 0.00 43.02 41.68 1r43 s PHE 223 CO -0.05 -0.35 -0.13 -2.00 0.70 0.00 0.00 175.22 173.39 1r43 s GLU 224 N 0.30 1.97 -0.42 0.44 2.12 -1.19 -2.20 118.70 119.71 1r43 s GLU 224 Ca -0.16 -0.47 -0.16 0.00 0.36 0.00 0.00 54.97 54.55 1r43 s GLU 224 Cb -0.17 -1.72 0.03 0.00 0.26 0.00 0.00 34.13 32.53 1r43 s GLU 224 CO 0.08 -0.08 0.35 -1.17 -0.54 0.00 0.00 175.26 173.90 1r43 s LEU 225 N 1.04 5.07 0.10 2.70 2.96 -1.26 -1.07 118.68 128.22 1r43 s LEU 225 Ca -0.06 -0.86 0.06 0.00 -0.22 0.00 0.00 54.13 53.04 1r43 s LEU 225 Cb -0.15 -2.24 -0.03 0.00 0.50 0.00 0.00 46.19 44.27 1r43 s LEU 225 CO -0.02 -0.51 -0.14 -2.28 -1.32 0.00 0.00 176.35 172.08 1r43 s HIS 226 N 1.83 1.33 0.60 5.38 2.46 -0.69 -1.12 115.29 125.09 1r43 s HIS 226 Ca 0.07 -0.53 -0.17 0.00 0.47 0.00 0.00 55.06 54.91 1r43 s HIS 226 Cb -0.19 -0.71 -0.03 0.00 -0.13 0.00 0.00 32.58 31.52 1r43 s HIS 226 CO 0.11 0.11 1.10 0.96 -2.47 0.00 0.00 174.74 174.54 1r43 s ILE 227 N -1.86 3.38 0.27 0.89 -4.36 -1.26 -2.77 121.20 115.49 1r43 s ILE 227 Ca 0.05 0.72 -0.04 0.00 -0.26 0.00 0.00 60.65 61.12 1r43 s ILE 227 Cb -0.06 -3.24 0.26 0.00 1.25 0.00 0.00 42.46 40.67 1r43 s ILE 227 CO 0.03 -0.33 1.94 -0.08 0.24 0.00 0.00 174.94 176.74 1r43 h GLU 228 N 0.54 1.22 0.00 0.37 4.81 -1.50 -3.44 114.58 116.56 1r43 h GLU 228 Ca -0.48 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1r43 h GLU 228 Cb 1.24 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1r43 h GLU 228 CO 0.56 0.81 0.00 1.04 -0.73 0.00 0.00 179.01 180.68 1r43 n GLN 229 N -4.40 0.00 -4.31 1.92 6.02 -1.26 -4.83 117.38 110.52 1r43 n GLN 229 Ca 0.11 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.80 1r43 n GLN 229 Cb 0.04 -1.89 -0.03 0.00 1.02 0.00 0.00 30.24 29.38 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 -1.78 2.73 -0.08 1.08 0.00 -1.26 -4.13 107.32 103.87 1r43 s GLY 230 Ca 0.00 -0.65 0.20 0.00 0.00 0.00 0.00 44.72 44.27 1r43 s GLY 230 CO 0.00 -2.08 1.60 -1.55 0.00 0.00 0.00 173.10 171.07 1r43 n PRO 231 N -1.58 3.42 0.06 2.90 -0.04 -1.26 -4.12 135.00 134.38 1r43 n PRO 231 Ca -0.11 -2.82 -0.11 0.00 -0.04 0.00 0.00 63.50 60.42 1r43 n PRO 231 Cb 0.66 -1.79 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 1r43 n PRO 231 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1r43 h ILE 232 N 4.10 0.84 -0.53 0.52 2.04 -1.98 -2.57 117.51 119.93 1r43 h ILE 232 Ca 0.00 -1.08 0.04 0.00 1.00 0.00 0.00 64.86 64.82 1r43 h ILE 232 Cb 1.30 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.73 1r43 h ILE 232 CO 0.16 0.21 0.29 -0.07 0.00 0.00 0.00 178.15 178.73 1r43 h LEU 233 N -0.85 0.42 -1.08 1.44 3.38 -1.92 -2.20 115.31 114.51 1r43 h LEU 233 Ca -0.02 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1r43 h LEU 233 Cb 0.52 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1r43 h LEU 233 CO 0.04 0.29 0.27 -0.08 0.09 0.00 0.00 178.44 179.05 1r43 h GLU 234 N 0.55 0.92 0.00 1.13 4.81 -1.81 -0.65 114.58 119.54 1r43 h GLU 234 Ca 0.23 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1r43 h GLU 234 Cb 0.11 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.33 1r43 h GLU 234 CO -0.15 0.74 0.00 -3.47 -0.73 0.00 0.00 179.01 175.41 1r43 n ASP 235 N -4.32 0.57 -0.53 1.04 2.03 -0.85 -2.35 116.55 112.14 1r43 n ASP 235 Ca 0.06 0.62 0.06 0.00 0.52 0.00 0.00 54.79 56.05 1r43 n ASP 235 Cb 0.16 -0.75 0.20 0.00 -0.72 0.00 0.00 41.12 40.01 1r43 n ASP 235 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1r43 n GLU 236 N -2.11 1.55 -2.52 -0.67 1.02 -1.00 -4.98 120.64 111.94 1r43 n GLU 236 Ca 0.03 -3.16 -0.13 0.00 -0.02 0.00 0.00 57.16 53.88 1r43 n GLU 236 Cb 0.26 -1.61 -0.03 0.00 -0.02 0.00 0.00 31.44 30.05 1r43 n GLU 236 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1r43 n ASN 237 N -1.18 -0.48 -4.83 1.62 6.94 -0.99 -4.92 115.26 111.41 1r43 n ASN 237 Ca 0.19 -0.39 -0.32 0.00 -0.02 0.00 0.00 54.58 54.04 1r43 n ASN 237 Cb 0.70 -0.50 0.02 0.00 -2.36 0.00 0.00 39.78 37.64 1r43 n ASN 237 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1r43 s LYS 238 N -3.10 3.35 -0.04 -3.83 -0.14 -0.28 -4.84 119.74 110.85 1r43 s LYS 238 Ca 0.24 0.95 0.10 0.00 -1.36 0.00 0.00 55.97 55.90 1r43 s LYS 238 Cb -0.14 -2.05 -0.14 0.00 -1.68 0.00 0.00 37.83 33.82 1r43 s LYS 238 CO 0.32 -0.77 0.17 0.00 -0.76 0.00 0.00 175.35 174.31 1r43 n ALA 239 N -2.55 2.19 -3.07 5.17 0.00 -0.53 -4.58 120.51 117.14 1r43 n ALA 239 Ca 0.07 -0.35 -0.11 0.00 0.00 0.00 0.00 53.44 53.04 1r43 n ALA 239 Cb 0.54 -0.23 -0.11 0.00 0.00 0.00 0.00 19.45 19.65 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 -2.56 0.05 -0.08 0.00 1.09 -0.93 -4.53 121.20 114.24 1r43 s ILE 240 Ca -0.04 -0.45 -0.01 0.00 -1.10 0.00 0.00 60.65 59.05 1r43 s ILE 240 Cb 0.05 -0.34 0.03 0.00 -1.06 0.00 0.00 42.46 41.14 1r43 s ILE 240 CO 0.41 -0.25 -0.03 -0.83 -0.10 0.00 0.00 174.94 174.15 1r43 s GLY 241 N -0.85 0.57 -0.47 6.18 0.00 -1.18 -2.94 107.32 108.63 1r43 s GLY 241 Ca -0.09 -0.24 -0.28 0.00 0.00 0.00 0.00 44.72 44.11 1r43 s GLY 241 CO 0.01 0.94 1.08 -0.42 0.00 0.00 0.00 173.10 174.71 1r43 s ILE 242 N 1.74 4.28 -0.33 0.90 1.01 0.13 -1.39 121.20 127.54 1r43 s ILE 242 Ca 0.03 1.09 -0.29 0.00 0.00 0.00 0.00 60.65 61.48 1r43 s ILE 242 Cb -0.13 -4.56 0.02 0.00 0.01 0.00 0.00 42.46 37.80 1r43 s ILE 242 CO -0.05 -0.96 1.06 -0.69 0.00 0.00 0.00 174.94 174.30 1r43 s VAL 243 N 4.25 4.51 -1.51 2.92 1.01 -1.26 -1.80 120.40 128.51 1r43 s VAL 243 Ca 0.45 1.68 0.17 0.00 0.00 0.00 0.00 61.98 64.27 1r43 s VAL 243 Cb -0.08 -4.41 -0.02 0.00 0.00 0.00 0.00 36.38 31.87 1r43 s VAL 243 CO 0.30 -0.50 0.88 0.35 0.00 0.00 0.00 175.10 176.13 1r43 n THR 244 N 5.90 0.00 0.00 3.92 -2.24 -0.67 -4.83 114.28 116.36 1r43 n THR 244 Ca 0.11 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1r43 n THR 244 Cb 0.47 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 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 1.21 3.42 3.87 3.38 0.00 -1.26 -2.54 105.19 113.27 1r43 n GLY 245 Ca 0.07 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 1r43 n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r43 s VAL 246 N -1.44 5.34 0.21 1.61 1.01 0.46 -1.44 120.40 126.15 1r43 s VAL 246 Ca 0.00 0.42 -0.32 0.00 0.00 0.00 0.00 61.98 62.08 1r43 s VAL 246 Cb 0.00 -3.51 -0.13 0.00 0.00 0.00 0.00 36.38 32.74 1r43 s VAL 246 CO 0.00 0.60 1.61 1.67 0.00 0.00 0.00 175.10 178.98 1r43 n GLN 247 N 1.89 2.47 -1.50 2.72 7.27 -0.40 -2.30 117.38 127.54 1r43 n GLN 247 Ca -0.18 0.89 -0.33 0.00 0.07 0.00 0.00 57.00 57.45 1r43 n GLN 247 Cb 0.54 -2.67 0.08 0.00 2.41 0.00 0.00 30.24 30.60 1r43 n GLN 247 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1r43 s ALA 248 N 0.69 2.24 0.01 1.69 0.00 0.08 -4.68 121.76 121.79 1r43 s ALA 248 Ca 0.73 0.63 -0.12 0.00 0.00 0.00 0.00 51.96 53.21 1r43 s ALA 248 Cb -0.58 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.18 1r43 s ALA 248 CO 0.39 -1.66 0.24 1.52 0.00 0.00 0.00 175.76 176.25 1r43 s TYR 249 N -2.31 -0.07 -0.06 0.00 -0.85 0.91 -1.87 117.35 113.10 1r43 s TYR 249 Ca 0.69 0.02 0.02 0.00 -0.52 0.00 0.00 57.07 57.27 1r43 s TYR 249 Cb -0.23 0.04 0.02 0.00 0.38 0.00 0.00 41.96 42.16 1r43 s TYR 249 CO 0.46 -0.39 -0.10 1.21 -1.52 0.00 0.00 175.55 175.21 1r43 s ASN 250 N -1.60 1.57 -0.22 -0.18 2.47 -0.07 -0.48 114.94 116.42 1r43 s ASN 250 Ca -0.11 -0.25 -0.02 0.00 0.42 0.00 0.00 52.86 52.90 1r43 s ASN 250 Cb -0.04 -0.72 0.01 0.00 -1.45 0.00 0.00 41.25 39.05 1r43 s ASN 250 CO 0.01 -0.00 -0.09 0.26 -3.72 0.00 0.00 177.10 173.56 1r43 s TRP 251 N 0.82 2.95 0.25 0.43 0.51 0.55 -1.00 118.94 123.45 1r43 s TRP 251 Ca -0.12 -1.33 0.11 0.00 -2.12 0.00 0.00 56.10 52.64 1r43 s TRP 251 Cb -0.15 -2.04 -0.05 0.00 -0.81 0.00 0.00 33.47 30.42 1r43 s TRP 251 CO 0.02 -0.68 -0.17 -0.65 -0.51 0.00 0.00 176.95 174.96 1r43 s GLN 252 N 1.38 1.76 -0.16 4.98 -0.21 0.02 -0.64 119.66 126.78 1r43 s GLN 252 Ca 0.04 -1.61 -0.00 0.00 0.02 0.00 0.00 55.36 53.80 1r43 s GLN 252 Cb -0.15 -1.88 0.04 0.00 1.00 0.00 0.00 33.01 32.02 1r43 s GLN 252 CO -0.06 0.36 -0.06 0.21 -2.12 0.00 0.00 175.29 173.62 1r43 s LYS 253 N -3.25 1.46 -0.16 2.91 2.20 0.63 -0.33 119.74 123.20 1r43 s LYS 253 Ca 0.27 -0.48 -0.08 0.00 -0.36 0.00 0.00 55.97 55.33 1r43 s LYS 253 Cb -0.06 -1.94 -0.04 0.00 -1.51 0.00 0.00 37.83 34.27 1r43 s LYS 253 CO 0.14 -0.40 0.12 0.08 -0.36 0.00 0.00 175.35 174.93 1r43 s VAL 254 N 1.64 5.31 -0.16 4.02 1.01 -0.32 -1.00 120.40 130.90 1r43 s VAL 254 Ca 0.01 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 1r43 s VAL 254 Cb -0.15 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 1r43 s VAL 254 CO -0.08 0.52 -0.11 -0.89 0.00 0.00 0.00 175.10 174.54 1r43 s THR 255 N -0.27 3.01 -0.12 3.92 2.01 0.78 -1.78 115.64 123.18 1r43 s THR 255 Ca 0.10 -0.65 -0.05 0.00 0.31 0.00 0.00 61.69 61.41 1r43 s THR 255 Cb -0.12 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 1r43 s THR 255 CO 0.01 0.49 0.04 -0.69 -0.69 0.00 0.00 174.62 173.79 1r43 s VAL 256 N 0.83 4.66 -0.12 3.82 1.01 0.89 -0.92 120.40 130.57 1r43 s VAL 256 Ca -0.04 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.86 1r43 s VAL 256 Cb -0.15 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 1r43 s VAL 256 CO 0.00 0.56 -0.18 -1.00 0.00 0.00 0.00 175.10 174.49 1r43 s HIS 257 N -0.50 2.70 0.00 5.22 3.76 0.09 -1.81 115.29 124.76 1r43 s HIS 257 Ca 0.10 -0.91 0.00 0.00 -0.15 0.00 0.00 55.06 54.10 1r43 s HIS 257 Cb -0.12 -1.80 0.00 0.00 1.11 0.00 0.00 32.58 31.77 1r43 s HIS 257 CO 0.02 -0.36 0.00 0.41 -0.85 0.00 0.00 174.74 173.96 1r43 n GLY 258 N 3.65 5.56 2.78 -2.22 0.00 0.19 -2.88 105.19 112.27 1r43 n GLY 258 Ca -0.19 -1.10 -0.21 0.00 0.00 0.00 0.00 46.02 44.52 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 2.57 0.29 -0.08 1.61 1.01 -0.83 -4.80 120.40 120.16 1r43 s VAL 259 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 1r43 s VAL 259 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 1r43 s VAL 259 CO 0.00 0.23 1.33 -0.83 0.00 0.00 0.00 175.10 175.83 1r43 s GLY 260 N 1.73 1.79 0.06 4.51 0.00 -1.26 -4.20 107.32 109.96 1r43 s GLY 260 Ca 0.01 0.66 -0.13 0.00 0.00 0.00 0.00 44.72 45.26 1r43 s GLY 260 CO -0.04 2.50 0.29 0.00 0.00 0.00 0.00 173.10 175.86 1r43 s ALA 261 N 2.99 -0.62 0.36 3.20 0.00 -1.20 -4.92 121.76 121.57 1r43 s ALA 261 Ca 0.60 -0.12 -0.28 0.00 0.00 0.00 0.00 51.96 52.16 1r43 s ALA 261 Cb -0.26 0.40 -0.10 0.00 0.00 0.00 0.00 23.12 23.16 1r43 s ALA 261 CO 0.21 -0.46 1.32 -1.58 0.00 0.00 0.00 175.76 175.25 1r43 s HIS 262 N -2.94 2.93 -1.02 0.00 2.46 -1.26 -0.25 115.29 115.21 1r43 s HIS 262 Ca -0.02 1.39 0.21 0.00 0.47 0.00 0.00 55.06 57.11 1r43 s HIS 262 Cb 0.00 -3.70 0.90 0.00 -0.13 0.00 0.00 32.58 29.65 1r43 s HIS 262 CO -0.06 -2.03 1.67 0.00 -2.47 0.00 0.00 174.74 171.85 1r43 n ALA 263 N 0.54 1.96 -0.08 1.58 0.00 -0.24 -2.84 120.51 121.43 1r43 n ALA 263 Ca 0.01 -0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.28 1r43 n ALA 263 Cb 0.42 -1.34 -0.09 0.00 0.00 0.00 0.00 19.45 18.45 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 0.65 -0.39 0.05 0.00 0.00 -1.26 -4.68 105.19 99.55 1r43 n GLY 264 Ca 0.05 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.80 0.26 -3.39 2.61 -2.24 -1.24 -4.76 114.28 102.72 1r43 n THR 265 Ca -0.27 -0.19 -0.44 0.00 -2.27 0.00 0.00 64.05 60.88 1r43 n THR 265 Cb 0.86 -0.10 -0.08 0.00 -2.10 0.00 0.00 70.33 68.91 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 -3.11 5.21 0.64 4.28 2.01 -1.13 -5.03 115.64 118.51 1r43 s THR 266 Ca 0.08 -0.90 -0.14 0.00 0.31 0.00 0.00 61.69 61.04 1r43 s THR 266 Cb 0.15 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.56 1r43 s THR 266 CO 0.69 -0.52 1.07 -2.16 -0.69 0.00 0.00 174.62 173.01 1r43 s PRO 267 N 1.73 3.05 0.27 4.92 0.04 -1.26 -4.85 135.00 138.90 1r43 s PRO 267 Ca 0.05 1.19 -0.05 0.00 0.04 0.00 0.00 61.00 62.24 1r43 s PRO 267 Cb -0.22 -2.00 0.54 0.00 0.04 0.00 0.00 34.50 32.86 1r43 s PRO 267 CO 0.08 -1.03 1.59 -1.49 0.04 0.00 0.00 177.00 176.20 1r43 h TRP 268 N -0.00 -0.19 0.00 0.56 4.06 -1.98 0.14 115.95 118.54 1r43 h TRP 268 Ca -0.46 0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.56 1r43 h TRP 268 Cb 1.22 0.22 0.00 0.00 -1.00 0.00 0.00 29.16 29.61 1r43 h TRP 268 CO 0.58 -0.36 0.00 2.89 -3.56 0.00 0.00 178.44 178.00 1r43 n ARG 269 N -5.47 0.02 -0.02 0.49 1.85 -1.26 -2.47 116.66 109.79 1r43 n ARG 269 Ca 0.17 0.23 0.01 0.00 -1.00 0.00 0.00 57.85 57.26 1r43 n ARG 269 Cb 0.57 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.50 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 -1.48 1.84 -4.88 2.89 4.77 0.02 -1.96 117.00 118.20 1r43 n LEU 270 Ca 0.04 -1.63 -0.30 0.00 -0.03 0.00 0.00 56.01 54.09 1r43 n LEU 270 Cb 0.17 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 1r43 n LEU 270 CO 0.14 0.45 0.36 -0.13 -1.33 0.00 0.00 177.39 176.88 1r43 s ARG 271 N -0.71 3.76 -0.45 3.23 0.52 -1.03 -4.88 118.95 119.39 1r43 s ARG 271 Ca 0.04 0.35 0.07 0.00 -0.52 0.00 0.00 55.73 55.68 1r43 s ARG 271 Cb 0.02 -2.48 0.24 0.00 0.52 0.00 0.00 34.95 33.25 1r43 s ARG 271 CO 0.03 0.07 0.55 1.63 0.02 0.00 0.00 175.30 177.60 1r43 n LYS 272 N -1.03 1.06 -2.83 3.54 5.02 -1.26 -3.98 118.16 118.68 1r43 n LYS 272 Ca 0.01 -3.55 -0.43 0.00 -2.02 0.00 0.00 58.31 52.33 1r43 n LYS 272 Cb 0.54 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 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 -1.32 6.61 0.37 4.39 -1.08 -1.26 -1.97 116.67 122.41 1r43 s ASP 273 Ca 0.35 0.42 0.26 0.00 -0.52 0.00 0.00 52.55 53.06 1r43 s ASP 273 Cb 0.15 -2.45 0.78 0.00 -1.46 0.00 0.00 42.92 39.93 1r43 s ASP 273 CO -0.10 -0.90 1.75 0.00 0.52 0.00 0.00 175.17 176.43 1r43 h ALA 274 N 8.66 1.00 0.07 3.66 0.00 -1.55 -3.25 119.26 127.86 1r43 h ALA 274 Ca -0.24 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.33 1r43 h ALA 274 Cb 1.08 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1r43 h ALA 274 CO 0.99 0.00 -1.94 -0.11 0.00 0.00 0.00 179.25 178.19 1r43 n LEU 275 N -2.73 2.00 -0.42 0.00 7.94 -1.26 -1.76 117.00 120.77 1r43 n LEU 275 Ca 0.03 0.25 0.00 0.00 -1.11 0.00 0.00 56.01 55.19 1r43 n LEU 275 Cb 0.41 -0.64 0.00 0.00 0.53 0.00 0.00 43.42 43.72 1r43 n LEU 275 CO 0.29 0.70 0.00 -0.11 -1.11 0.00 0.00 177.39 177.16 1r43 n LEU 276 N -3.30 0.00 0.00 -1.96 7.94 -1.23 -0.30 117.00 118.15 1r43 n LEU 276 Ca -0.28 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.62 1r43 n LEU 276 Cb 1.05 0.00 0.00 0.00 0.53 0.00 0.00 43.42 45.00 1r43 n LEU 276 CO 0.43 0.00 0.00 -0.24 -1.11 0.00 0.00 177.39 176.47 1r43 n SER 278 N 0.28 0.00 0.31 1.96 2.88 -0.72 -1.91 113.62 116.42 1r43 n SER 278 Ca 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.37 1r43 n SER 278 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 1r43 n SER 278 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1r43 h SER 279 N 0.00 -0.98 0.00 -3.46 0.02 -0.93 -1.97 113.55 106.22 1r43 h SER 279 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1r43 h SER 279 Cb 0.00 0.30 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1r43 h SER 279 CO 0.00 -0.57 0.00 0.29 -1.14 0.00 0.00 176.83 175.41 1r43 n LYS 280 N -5.51 0.00 0.00 3.45 5.02 -0.80 -2.10 118.16 118.22 1r43 n LYS 280 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 1r43 n LYS 280 Cb 0.40 -0.89 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 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 0.54 0.00 -0.13 -0.18 5.41 -0.74 -1.50 119.36 122.76 1r43 n ILE 282 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.68 1r43 n ILE 282 Cb 0.00 0.00 0.02 0.00 -0.71 0.00 0.00 39.64 38.95 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 1.02 -0.22 1.39 2.07 -1.71 -1.64 116.25 117.16 1r43 h VAL 283 Ca 0.00 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.37 1r43 h VAL 283 Cb 0.00 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1r43 h VAL 283 CO 0.00 0.09 0.14 0.00 0.02 0.00 0.00 177.57 177.81 1r43 h ALA 284 N 1.20 0.28 -0.93 1.67 0.00 -1.53 -1.96 119.26 117.99 1r43 h ALA 284 Ca 0.17 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1r43 h ALA 284 Cb 0.04 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1r43 h ALA 284 CO -0.09 -0.26 0.61 0.00 0.00 0.00 0.00 179.25 179.50 1r43 h ALA 285 N 1.09 1.40 -0.57 0.00 0.00 -1.79 -2.11 119.26 117.29 1r43 h ALA 285 Ca 0.08 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1r43 h ALA 285 Cb -0.02 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1r43 h ALA 285 CO -0.03 0.51 0.04 1.03 0.00 0.00 0.00 179.25 180.80 1r43 h SER 286 N 1.17 0.91 0.04 0.00 0.87 -0.74 -0.61 113.55 115.19 1r43 h SER 286 Ca 0.36 -0.22 -0.16 0.00 -1.23 0.00 0.00 61.79 60.54 1r43 h SER 286 Cb -0.01 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.71 1r43 h SER 286 CO -0.11 0.95 -0.55 -0.33 -0.53 0.00 0.00 176.83 176.26 1r43 h GLU 287 N 0.88 0.54 -0.36 2.24 5.08 -1.00 -1.91 114.58 120.06 1r43 h GLU 287 Ca 0.17 -0.34 -0.06 0.00 -1.00 0.00 0.00 59.36 58.13 1r43 h GLU 287 Cb 0.46 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1r43 h GLU 287 CO 0.02 0.95 0.00 0.82 -1.00 0.00 0.00 179.01 179.80 1r43 h ILE 288 N 0.41 1.26 -0.50 3.13 2.04 -0.88 -0.78 117.51 122.19 1r43 h ILE 288 Ca 0.01 -0.98 -0.02 0.00 1.00 0.00 0.00 64.86 64.87 1r43 h ILE 288 Cb 1.09 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1r43 h ILE 288 CO 0.10 0.32 0.23 0.00 0.00 0.00 0.00 178.15 178.81 1r43 h ALA 289 N 0.86 0.65 -0.90 1.87 0.00 -1.11 -2.57 119.26 118.06 1r43 h ALA 289 Ca 0.10 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1r43 h ALA 289 Cb 0.46 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1r43 h ALA 289 CO 0.02 0.22 0.59 0.37 0.00 0.00 0.00 179.25 180.45 1r43 h GLN 290 N 0.67 1.13 0.04 0.00 4.15 -1.23 0.12 115.11 119.99 1r43 h GLN 290 Ca 0.17 -0.07 0.01 0.00 0.77 0.00 0.00 58.65 59.54 1r43 h GLN 290 Cb 0.13 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 1r43 h GLN 290 CO -0.02 0.75 -0.11 0.00 -1.93 0.00 0.00 178.83 177.52 1r43 h ARG 291 N 1.17 -0.20 -0.25 1.69 3.08 -0.76 -2.64 114.38 116.47 1r43 h ARG 291 Ca 0.34 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1r43 h ARG 291 Cb -0.06 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1r43 h ARG 291 CO -0.09 -0.13 0.00 0.72 -1.07 0.00 0.00 179.97 179.40 1r43 n HIS 292 N -5.23 0.33 -2.67 3.04 8.25 -1.02 -4.91 115.22 113.00 1r43 n HIS 292 Ca -0.06 -0.17 -0.20 0.00 -0.26 0.00 0.00 57.72 57.03 1r43 n HIS 292 Cb 0.15 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.28 1r43 n HIS 292 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1r43 n ASN 293 N 0.30 -5.77 -0.23 0.41 3.02 -0.69 -5.02 115.26 107.27 1r43 n ASN 293 Ca 0.12 -0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 1r43 n ASN 293 Cb 0.26 -4.70 0.00 0.00 -0.61 0.00 0.00 39.78 34.73 1r43 n ASN 293 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r43 n GLY 294 N -1.25 2.45 3.10 7.41 0.00 0.32 -4.93 105.19 112.29 1r43 n GLY 294 Ca -0.17 -2.05 -0.22 0.00 0.00 0.00 0.00 46.02 43.58 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 -0.02 0.99 1.43 0.18 -4.35 118.68 118.94 1r43 s LEU 295 Ca 0.00 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 1r43 s LEU 295 Cb 0.00 -0.72 -0.01 0.00 0.03 0.00 0.00 46.19 45.49 1r43 s LEU 295 CO 0.00 0.17 -0.15 0.12 0.23 0.00 0.00 176.35 176.72 1r43 s PHE 296 N -0.31 1.36 -0.06 0.29 5.36 -1.26 -0.68 117.98 122.68 1r43 s PHE 296 Ca 0.05 -0.28 -0.04 0.00 -0.96 0.00 0.00 56.93 55.70 1r43 s PHE 296 Cb -0.06 -0.89 0.03 0.00 -0.34 0.00 0.00 43.02 41.77 1r43 s PHE 296 CO -0.00 -0.05 0.15 0.99 -1.46 0.00 0.00 175.22 174.84 1r43 s THR 297 N -0.25 -0.03 -0.31 0.12 2.01 -0.55 -4.93 115.64 111.70 1r43 s THR 297 Ca 0.04 0.10 -0.06 0.00 0.31 0.00 0.00 61.69 62.08 1r43 s THR 297 Cb -0.07 -0.23 0.02 0.00 0.01 0.00 0.00 72.50 72.24 1r43 s THR 297 CO -0.00 0.04 0.08 0.00 -0.69 0.00 0.00 174.62 174.05 1r43 n GLY 299 N 4.82 -0.67 2.73 0.00 0.00 -1.26 -4.93 105.19 105.88 1r43 n GLY 299 Ca -0.14 -0.50 -0.19 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.69 0.01 0.01 -0.61 1.01 -1.26 -5.04 121.20 112.62 1r43 s ILE 300 Ca 0.06 0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.99 1r43 s ILE 300 Cb 0.13 -0.20 -0.01 0.00 0.01 0.00 0.00 42.46 42.40 1r43 s ILE 300 CO 0.73 0.16 -0.01 -0.51 0.00 0.00 0.00 174.94 175.30 1r43 s ILE 301 N 1.66 0.06 -0.09 2.92 2.07 -1.26 -1.73 121.20 124.84 1r43 s ILE 301 Ca -0.01 -0.34 -0.05 0.00 -1.41 0.00 0.00 60.65 58.83 1r43 s ILE 301 Cb -0.13 -0.12 0.04 0.00 0.13 0.00 0.00 42.46 42.38 1r43 s ILE 301 CO -0.03 -0.18 0.21 -1.81 -1.91 0.00 0.00 174.94 171.22 1r43 s ASP 302 N -0.54 -0.21 -0.00 4.50 1.01 0.10 -4.98 116.67 116.55 1r43 s ASP 302 Ca -0.06 0.43 0.06 0.00 0.71 0.00 0.00 52.55 53.70 1r43 s ASP 302 Cb -0.04 0.35 -0.03 0.00 1.01 0.00 0.00 42.92 44.22 1r43 s ASP 302 CO -0.00 -0.13 -0.20 0.00 0.21 0.00 0.00 175.17 175.05 1r43 s ALA 303 N 0.87 2.48 0.06 5.23 0.00 -1.26 -0.82 121.76 128.32 1r43 s ALA 303 Ca -0.06 -1.12 0.07 0.00 0.00 0.00 0.00 51.96 50.85 1r43 s ALA 303 Cb -0.08 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 1r43 s ALA 303 CO -0.05 0.55 -0.21 0.15 0.00 0.00 0.00 175.76 176.21 1r43 s LYS 304 N -1.01 1.32 0.00 0.00 1.02 0.70 -3.80 119.74 117.97 1r43 s LYS 304 Ca 0.12 -0.98 0.24 0.00 0.02 0.00 0.00 55.97 55.37 1r43 s LYS 304 Cb -0.10 -1.46 0.88 0.00 -0.52 0.00 0.00 37.83 36.62 1r43 s LYS 304 CO 0.02 0.37 1.63 -0.35 -0.92 0.00 0.00 175.35 176.10 1r43 n PRO 305 N 1.68 1.72 -1.71 -1.68 -0.04 -1.26 -1.36 135.00 132.36 1r43 n PRO 305 Ca -0.18 -1.07 -0.00 0.00 -0.04 0.00 0.00 63.50 62.21 1r43 n PRO 305 Cb 0.53 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 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 0.29 -0.43 -3.78 0.54 9.36 -1.25 -5.11 117.16 116.79 1r43 n TYR 306 Ca 0.18 0.17 -0.12 0.00 3.32 0.00 0.00 57.90 61.44 1r43 n TYR 306 Cb 0.35 -1.86 -0.08 0.00 -0.63 0.00 0.00 39.34 37.12 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 -1.91 -0.11 0.36 2.98 0.01 -1.26 -5.03 113.70 108.74 1r43 s SER 307 Ca 0.01 -0.11 0.05 0.00 1.31 0.00 0.00 55.95 57.21 1r43 s SER 307 Cb -0.00 0.31 0.73 0.00 0.21 0.00 0.00 66.02 67.27 1r43 s SER 307 CO 0.10 -0.52 1.97 0.58 0.41 0.00 0.00 173.24 175.79 1r43 h VAL 308 N 3.61 1.05 -0.17 3.43 2.07 -2.04 -3.04 116.25 121.15 1r43 h VAL 308 Ca -0.31 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1r43 h VAL 308 Cb 1.19 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1r43 h VAL 308 CO 0.44 0.14 -0.04 -0.46 0.02 0.00 0.00 177.57 177.67 1r43 n ASN 309 N -4.47 3.05 -4.15 0.57 6.94 -1.26 -4.91 115.26 111.03 1r43 n ASN 309 Ca 0.10 -3.21 -0.32 0.00 -0.02 0.00 0.00 54.58 51.13 1r43 n ASN 309 Cb 0.19 -0.52 -0.17 0.00 -2.36 0.00 0.00 39.78 36.92 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 -2.94 1.95 0.18 1.53 1.01 -1.15 -1.08 121.20 120.70 1r43 s ILE 310 Ca 0.39 -0.91 -0.32 0.00 0.00 0.00 0.00 60.65 59.81 1r43 s ILE 310 Cb 0.33 -1.73 -0.12 0.00 0.01 0.00 0.00 42.46 40.96 1r43 s ILE 310 CO 0.05 0.53 1.74 -0.38 0.00 0.00 0.00 174.94 176.88 1r43 n ILE 311 N 4.08 0.09 -1.77 2.92 5.41 0.65 -4.61 119.36 126.13 1r43 n ILE 311 Ca -0.20 -0.02 -0.42 0.00 1.00 0.00 0.00 62.75 63.12 1r43 n ILE 311 Cb 0.51 -1.99 -0.03 0.00 -0.71 0.00 0.00 39.64 37.43 1r43 n ILE 311 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1r43 s PRO 312 N 1.55 4.15 0.00 0.38 0.02 -1.26 -3.21 135.00 136.63 1r43 s PRO 312 Ca 0.77 2.50 0.26 0.00 0.02 0.00 0.00 61.00 64.55 1r43 s PRO 312 Cb -0.51 -4.06 0.68 0.00 0.02 0.00 0.00 34.50 30.63 1r43 s PRO 312 CO 0.34 -0.91 1.54 0.41 -0.33 0.00 0.00 177.00 178.04 1r43 n GLY 313 N 4.40 -1.28 3.30 0.52 0.00 -0.46 -1.39 105.19 110.27 1r43 n GLY 313 Ca 0.19 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.98 0.45 -0.03 1.61 2.12 -0.97 -0.64 118.70 118.26 1r43 s GLU 314 Ca 0.12 0.69 0.01 0.00 0.36 0.00 0.00 54.97 56.15 1r43 s GLU 314 Cb 0.18 0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.70 1r43 s GLU 314 CO 0.66 -0.11 -0.05 0.08 -0.54 0.00 0.00 175.26 175.30 1r43 s VAL 315 N 0.78 0.48 -0.01 3.70 1.01 -0.75 -0.21 120.40 125.40 1r43 s VAL 315 Ca -0.05 -0.15 0.06 0.00 0.00 0.00 0.00 61.98 61.84 1r43 s VAL 315 Cb -0.05 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1r43 s VAL 315 CO -0.06 0.18 -0.18 -0.44 0.00 0.00 0.00 175.10 174.61 1r43 s SER 316 N 0.52 3.78 0.03 3.32 0.01 0.00 -0.08 113.70 121.28 1r43 s SER 316 Ca -0.06 -0.34 -0.15 0.00 1.31 0.00 0.00 55.95 56.71 1r43 s SER 316 Cb -0.10 -0.67 0.02 0.00 0.21 0.00 0.00 66.02 65.49 1r43 s SER 316 CO -0.00 0.30 0.33 0.72 0.41 0.00 0.00 173.24 175.00 1r43 s PHE 317 N -0.79 -0.16 0.28 2.43 -0.12 -0.74 0.01 117.98 118.90 1r43 s PHE 317 Ca 0.13 0.09 0.06 0.00 -0.05 0.00 0.00 56.93 57.16 1r43 s PHE 317 Cb -0.10 0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.38 1r43 s PHE 317 CO 0.02 -0.49 0.33 0.95 -0.05 0.00 0.00 175.22 175.98 1r43 s THR 318 N -2.27 4.45 -0.08 -4.49 -4.23 -0.70 -1.17 115.64 107.14 1r43 s THR 318 Ca -0.07 -1.17 -0.01 0.00 -1.18 0.00 0.00 61.69 59.26 1r43 s THR 318 Cb -0.02 -3.51 0.03 0.00 1.34 0.00 0.00 72.50 70.34 1r43 s THR 318 CO -0.01 -0.27 -0.02 -0.76 -0.54 0.00 0.00 174.62 173.02 1r43 s LEU 319 N -3.99 0.78 -0.47 4.79 1.43 0.55 -4.30 118.68 117.47 1r43 s LEU 319 Ca 0.38 -0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 53.27 1r43 s LEU 319 Cb -0.08 -0.54 0.12 0.00 0.03 0.00 0.00 46.19 45.72 1r43 s LEU 319 CO 0.28 -0.17 0.31 -0.62 0.23 0.00 0.00 176.35 176.38 1r43 s ASP 320 N 1.83 5.53 -0.03 2.29 -1.08 0.67 -0.80 116.67 125.08 1r43 s ASP 320 Ca 0.04 -2.04 -0.14 0.00 -0.52 0.00 0.00 52.55 49.89 1r43 s ASP 320 Cb -0.12 -1.94 -0.05 0.00 -1.46 0.00 0.00 42.92 39.34 1r43 s ASP 320 CO -0.06 -0.62 0.37 -0.36 0.52 0.00 0.00 175.17 175.03 1r43 s PHE 321 N 1.16 3.70 -0.02 -5.34 0.40 -0.17 -1.48 117.98 116.23 1r43 s PHE 321 Ca 0.08 0.91 -0.04 0.00 -0.60 0.00 0.00 56.93 57.28 1r43 s PHE 321 Cb -0.24 -2.25 0.00 0.00 0.51 0.00 0.00 43.02 41.04 1r43 s PHE 321 CO -0.02 0.63 0.10 1.03 0.70 0.00 0.00 175.22 177.65 1r43 s ARG 322 N -0.96 0.26 -0.26 0.44 3.00 0.14 -0.89 118.95 120.68 1r43 s ARG 322 Ca 0.22 -0.12 -0.26 0.00 0.00 0.00 0.00 55.73 55.57 1r43 s ARG 322 Cb -0.16 0.11 0.13 0.00 0.00 0.00 0.00 34.95 35.03 1r43 s ARG 322 CO 0.12 -0.05 1.04 -1.58 0.00 0.00 0.00 175.30 174.83 1r43 s HIS 323 N -0.58 -0.44 0.32 -0.53 2.46 -0.78 -0.65 115.29 115.09 1r43 s HIS 323 Ca -0.07 1.01 0.10 0.00 0.47 0.00 0.00 55.06 56.57 1r43 s HIS 323 Cb -0.04 0.38 0.92 0.00 -0.13 0.00 0.00 32.58 33.71 1r43 s HIS 323 CO 0.00 -0.24 1.70 -1.35 -2.47 0.00 0.00 174.74 172.38 1r43 h PRO 324 N 3.83 0.44 -5.69 2.88 0.11 -1.90 0.26 132.00 131.93 1r43 h PRO 324 Ca -0.26 -0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.15 1r43 h PRO 324 Cb 1.17 -0.10 -0.10 0.00 0.11 0.00 0.00 31.00 32.09 1r43 h PRO 324 CO 0.15 0.29 -0.52 0.45 -0.21 0.00 0.00 178.00 178.16 1r43 s SER 325 N -5.09 6.06 0.10 -2.05 0.15 -1.26 -4.46 113.70 107.14 1r43 s SER 325 Ca -0.11 0.36 -0.19 0.00 0.70 0.00 0.00 55.95 56.71 1r43 s SER 325 Cb 0.28 -1.91 -0.07 0.00 -1.71 0.00 0.00 66.02 62.61 1r43 s SER 325 CO 0.79 0.38 1.65 0.44 1.20 0.00 0.00 173.24 177.70 1r43 h ASP 326 N 5.17 0.33 -0.78 5.45 5.19 -1.98 -2.15 116.42 127.67 1r43 h ASP 326 Ca -0.53 -0.16 -0.05 0.00 -0.62 0.00 0.00 57.03 55.67 1r43 h ASP 326 Cb 1.21 -0.09 -0.03 0.00 0.18 0.00 0.00 39.33 40.60 1r43 h ASP 326 CO 0.58 0.40 0.27 0.44 -3.12 0.00 0.00 179.24 177.82 1r43 h ASP 327 N 0.25 1.10 -0.21 6.45 3.32 -1.97 -1.46 116.42 123.89 1r43 h ASP 327 Ca 0.08 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 56.87 1r43 h ASP 327 Cb 0.17 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1r43 h ASP 327 CO -0.01 1.00 -0.12 0.58 -1.72 0.00 0.00 179.24 178.98 1r43 h VAL 328 N 1.14 1.31 -1.00 -1.35 2.07 -1.96 -1.55 116.25 114.91 1r43 h VAL 328 Ca 0.25 -1.19 0.14 0.00 0.82 0.00 0.00 66.70 66.72 1r43 h VAL 328 Cb 0.27 1.63 -0.09 0.00 -1.52 0.00 0.00 31.29 31.58 1r43 h VAL 328 CO -0.01 0.36 0.63 0.25 0.02 0.00 0.00 177.57 178.82 1r43 h LEU 329 N 0.16 0.89 -1.14 2.57 5.85 -1.25 -0.02 115.31 122.38 1r43 h LEU 329 Ca 0.05 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 1r43 h LEU 329 Cb 0.61 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1r43 h LEU 329 CO 0.03 0.44 -0.19 0.00 -0.34 0.00 0.00 178.44 178.38 1r43 h ALA 330 N 1.57 1.28 0.00 1.25 0.00 -0.98 -2.31 119.26 120.07 1r43 h ALA 330 Ca 0.52 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1r43 h ALA 330 Cb 0.60 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1r43 h ALA 330 CO -0.29 0.48 0.00 2.41 0.00 0.00 0.00 179.25 181.84 1r43 n THR 331 N -4.18 0.18 0.00 0.00 -1.04 -0.02 -2.35 114.28 106.86 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 0.34 -0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 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 0.41 0.00 -0.31 -4.42 4.77 -0.87 -1.90 117.00 114.68 1r43 n LEU 333 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 1r43 n LEU 333 Cb 0.17 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.40 1r43 n LEU 333 CO 0.00 0.00 1.21 0.50 -1.33 0.00 0.00 177.39 177.77 1r43 h LYS 334 N 0.00 1.20 0.16 3.23 3.64 -1.74 -1.03 116.57 122.03 1r43 h LYS 334 Ca 0.00 -0.11 -0.29 0.00 -1.27 0.00 0.00 60.65 58.98 1r43 h LYS 334 Cb 0.00 -0.25 0.01 0.00 -0.41 0.00 0.00 32.23 31.58 1r43 h LYS 334 CO 0.00 0.85 -1.31 0.93 -2.27 0.00 0.00 179.45 177.64 1r43 h GLU 335 N 1.22 0.34 -0.11 1.90 5.08 -1.67 -2.01 114.58 119.33 1r43 h GLU 335 Ca 0.32 -0.58 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1r43 h GLU 335 Cb -0.04 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1r43 h GLU 335 CO -0.06 1.28 0.05 0.00 -1.00 0.00 0.00 179.01 179.28 1r43 h ALA 336 N 0.47 0.15 -0.93 3.43 0.00 -1.82 0.21 119.26 120.77 1r43 h ALA 336 Ca -0.17 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.75 1r43 h ALA 336 Cb 2.03 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.71 1r43 h ALA 336 CO 0.22 -0.29 0.60 0.00 0.00 0.00 0.00 179.25 179.78 1r43 h ALA 337 N 0.92 1.53 -0.50 0.00 0.00 -1.19 0.14 119.26 120.16 1r43 h ALA 337 Ca 0.04 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1r43 h ALA 337 Cb 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1r43 h ALA 337 CO -0.00 0.31 -0.16 0.00 0.00 0.00 0.00 179.25 179.40 1r43 h ALA 338 N 1.52 0.69 -0.45 0.00 0.00 -0.96 -1.32 119.26 118.73 1r43 h ALA 338 Ca 0.42 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1r43 h ALA 338 Cb 0.28 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1r43 h ALA 338 CO -0.17 0.63 -0.21 0.93 0.00 0.00 0.00 179.25 180.43 1r43 h GLU 339 N 0.84 0.92 -0.36 0.00 4.39 0.51 -2.60 114.58 118.28 1r43 h GLU 339 Ca 0.12 -0.38 -0.02 0.00 0.34 0.00 0.00 59.36 59.42 1r43 h GLU 339 Cb 0.73 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 1r43 h GLU 339 CO 0.06 1.04 0.15 0.74 -1.16 0.00 0.00 179.01 179.83 1r43 h PHE 340 N 0.80 0.54 -0.57 4.33 0.05 -0.94 0.43 116.94 121.58 1r43 h PHE 340 Ca 0.11 -0.04 0.13 0.00 3.82 0.00 0.00 57.97 61.99 1r43 h PHE 340 Cb 0.77 -0.16 -0.03 0.00 2.00 0.00 0.00 35.95 38.53 1r43 h PHE 340 CO 0.05 0.49 0.40 -0.44 -0.18 0.00 0.00 178.31 178.63 1r43 h ASP 341 N 0.43 0.16 0.01 2.17 5.19 -1.14 -0.76 116.42 122.49 1r43 h ASP 341 Ca 0.12 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.54 1r43 h ASP 341 Cb 0.18 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.66 1r43 h ASP 341 CO -0.01 0.09 -0.01 -0.09 -3.12 0.00 0.00 179.24 176.10 1r43 h ARG 342 N 0.18 -0.02 -0.92 3.56 2.43 -1.02 -3.37 114.38 115.22 1r43 h ARG 342 Ca 0.27 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1r43 h ARG 342 Cb 0.84 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.35 1r43 h ARG 342 CO -0.04 0.68 0.56 -0.07 -1.51 0.00 0.00 179.97 179.58 1r43 h LEU 343 N -0.97 1.10 -2.45 3.80 4.07 -0.58 -2.75 115.31 117.54 1r43 h LEU 343 Ca -0.00 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 57.89 1r43 h LEU 343 Cb 0.70 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 42.16 1r43 h LEU 343 CO 0.00 0.84 -0.01 -0.29 -1.08 0.00 0.00 178.44 177.91 1r43 h ILE 344 N 1.27 0.05 -0.02 1.22 6.09 -1.30 -1.55 117.51 123.27 1r43 h ILE 344 Ca 0.33 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.63 1r43 h ILE 344 Cb -0.06 1.18 0.00 0.00 0.47 0.00 0.00 36.82 38.41 1r43 h ILE 344 CO -0.06 0.01 -0.38 0.29 -3.07 0.00 0.00 178.15 174.93 1r43 n LYS 345 N -3.14 1.24 -3.20 2.19 4.76 -1.04 -2.38 118.16 116.59 1r43 n LYS 345 Ca -0.02 -0.98 -0.45 0.00 -2.87 0.00 0.00 58.31 53.99 1r43 n LYS 345 Cb 0.15 -1.48 -0.05 0.00 -1.84 0.00 0.00 35.03 31.82 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 -2.43 5.02 -0.30 -0.18 1.01 -0.58 -4.62 121.20 119.13 1r43 s ILE 346 Ca 0.21 -1.30 -0.16 0.00 0.00 0.00 0.00 60.65 59.40 1r43 s ILE 346 Cb 0.19 -4.43 0.17 0.00 0.01 0.00 0.00 42.46 38.40 1r43 s ILE 346 CO 0.53 -1.02 1.10 0.21 0.00 0.00 0.00 174.94 175.76 1r43 s ASN 347 N 3.54 -0.36 0.21 3.58 2.47 -1.26 -5.03 114.94 118.09 1r43 s ASN 347 Ca 0.09 0.52 -0.10 0.00 0.42 0.00 0.00 52.86 53.79 1r43 s ASN 347 Cb -0.25 1.30 0.20 0.00 -1.45 0.00 0.00 41.25 41.04 1r43 s ASN 347 CO 0.04 -0.08 1.84 0.44 -3.72 0.00 0.00 177.10 175.62 1r43 h ASP 348 N 6.58 0.71 0.07 -4.21 3.32 -1.88 -0.66 116.42 120.34 1r43 h ASP 348 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1r43 h ASP 348 Cb 1.15 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1r43 h ASP 348 CO 0.14 0.49 0.00 0.61 -1.72 0.00 0.00 179.24 178.75 1r43 n GLY 349 N -1.29 -0.39 0.00 2.75 0.00 -0.83 -4.87 105.19 100.56 1r43 n GLY 349 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.52 2.27 3.78 -0.02 0.00 -0.25 -4.86 105.19 105.59 1r43 n GLY 350 Ca 0.05 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 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 -2.44 3.59 0.44 4.61 0.00 -1.26 -4.65 121.76 122.05 1r43 s ALA 351 Ca 0.00 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.54 1r43 s ALA 351 Cb 0.00 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1r43 s ALA 351 CO 0.00 -1.05 0.00 1.28 0.00 0.00 0.00 175.76 175.99 1r43 n LEU 352 N 0.65 0.00 -3.76 0.00 4.32 -1.00 -5.05 117.00 112.16 1r43 n LEU 352 Ca 0.02 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.91 1r43 n LEU 352 Cb 0.39 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.13 1r43 n LEU 352 CO 0.64 -0.36 0.07 -0.94 -1.22 0.00 0.00 177.39 175.58 1r43 s SER 353 N -1.00 -0.09 -0.01 -1.43 1.04 -1.14 -4.79 113.70 106.28 1r43 s SER 353 Ca 0.00 -0.51 -0.10 0.00 0.48 0.00 0.00 55.95 55.82 1r43 s SER 353 Cb 0.00 0.44 0.01 0.00 0.10 0.00 0.00 66.02 66.57 1r43 s SER 353 CO 0.00 -0.85 0.19 -0.72 0.98 0.00 0.00 173.24 172.85 1r43 s TYR 354 N -3.85 -0.04 0.05 5.02 -0.85 -1.26 -0.73 117.35 115.69 1r43 s TYR 354 Ca 0.06 0.03 0.06 0.00 -0.52 0.00 0.00 57.07 56.70 1r43 s TYR 354 Cb 0.03 0.00 -0.02 0.00 0.38 0.00 0.00 41.96 42.34 1r43 s TYR 354 CO -0.09 -0.31 -0.16 -1.83 -1.52 0.00 0.00 175.55 171.64 1r43 s GLU 355 N -1.28 1.05 0.08 -3.49 -1.05 -0.10 -4.98 118.70 108.93 1r43 s GLU 355 Ca -0.13 -0.86 0.08 0.00 -0.15 0.00 0.00 54.97 53.90 1r43 s GLU 355 Cb -0.07 -1.11 -0.03 0.00 -0.44 0.00 0.00 34.13 32.49 1r43 s GLU 355 CO 0.02 0.27 -0.21 -1.54 0.95 0.00 0.00 175.26 174.76 1r43 s SER 356 N -1.29 2.51 0.00 0.83 1.04 -1.26 -0.16 113.70 115.38 1r43 s SER 356 Ca 0.03 -0.63 0.01 0.00 0.48 0.00 0.00 55.95 55.84 1r43 s SER 356 Cb -0.09 -0.16 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 1r43 s SER 356 CO 0.02 0.10 -0.03 -1.83 0.98 0.00 0.00 173.24 172.47 1r43 s GLU 357 N -1.64 0.27 -0.14 4.02 -1.05 -0.17 -4.96 118.70 115.03 1r43 s GLU 357 Ca 0.07 -0.21 -0.24 0.00 -0.15 0.00 0.00 54.97 54.44 1r43 s GLU 357 Cb -0.10 -0.21 -0.03 0.00 -0.44 0.00 0.00 34.13 33.36 1r43 s GLU 357 CO 0.03 0.05 0.74 0.99 0.95 0.00 0.00 175.26 178.03 1r43 s THR 358 N -0.31 4.97 -0.19 1.83 2.01 -1.26 -0.27 115.64 122.41 1r43 s THR 358 Ca -0.01 1.47 -0.16 0.00 0.31 0.00 0.00 61.69 63.29 1r43 s THR 358 Cb -0.03 -4.06 -0.20 0.00 0.01 0.00 0.00 72.50 68.22 1r43 s THR 358 CO -0.00 0.13 0.18 0.18 -0.69 0.00 0.00 174.62 174.42 1r43 n LEU 359 N 4.64 2.10 -3.47 4.42 4.77 0.19 -4.96 117.00 124.69 1r43 n LEU 359 Ca 0.01 0.34 -0.14 0.00 -0.03 0.00 0.00 56.01 56.19 1r43 n LEU 359 Cb 0.50 -0.99 -0.04 0.00 -2.33 0.00 0.00 43.42 40.56 1r43 n LEU 359 CO 0.47 0.47 0.43 -1.58 -1.33 0.00 0.00 177.39 175.85 1r43 s GLN 360 N -2.43 1.16 -0.03 3.23 0.74 -1.17 -5.04 119.66 116.12 1r43 s GLN 360 Ca -0.28 -0.15 -0.09 0.00 0.05 0.00 0.00 55.36 54.88 1r43 s GLN 360 Cb 0.07 0.54 0.01 0.00 1.10 0.00 0.00 33.01 34.73 1r43 s GLN 360 CO 0.63 -0.45 0.21 0.54 -0.55 0.00 0.00 175.29 175.66 1r43 s VAL 361 N -2.62 0.05 -0.18 1.34 0.11 -1.26 -0.33 120.40 117.51 1r43 s VAL 361 Ca -0.04 -0.41 -0.04 0.00 -2.93 0.00 0.00 61.98 58.56 1r43 s VAL 361 Cb -0.01 -0.44 0.09 0.00 -1.53 0.00 0.00 36.38 34.50 1r43 s VAL 361 CO -0.03 -0.23 0.29 -0.55 -3.33 0.00 0.00 175.10 171.25 1r43 s SER 362 N -0.87 0.54 0.96 3.54 0.15 0.36 -5.00 113.70 113.38 1r43 s SER 362 Ca -0.10 0.33 -0.11 0.00 0.70 0.00 0.00 55.95 56.78 1r43 s SER 362 Cb -0.05 0.77 0.17 0.00 -1.71 0.00 0.00 66.02 65.20 1r43 s SER 362 CO 0.02 -0.28 1.12 -2.84 1.20 0.00 0.00 173.24 172.47 1r43 s PRO 363 N 2.44 0.67 0.62 5.44 0.02 -1.26 -0.06 135.00 142.87 1r43 s PRO 363 Ca 0.05 1.42 -0.14 0.00 0.02 0.00 0.00 61.00 62.34 1r43 s PRO 363 Cb -0.14 -1.70 -0.02 0.00 0.02 0.00 0.00 34.50 32.66 1r43 s PRO 363 CO -0.11 -2.83 1.06 0.00 -0.33 0.00 0.00 177.00 174.78 1r43 s ALA 364 N -2.62 2.73 -0.09 -1.55 0.00 -1.26 -4.50 121.76 114.47 1r43 s ALA 364 Ca 0.67 0.29 0.02 0.00 0.00 0.00 0.00 51.96 52.94 1r43 s ALA 364 Cb -0.23 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 19.69 1r43 s ALA 364 CO 0.59 -0.92 -0.14 0.08 0.00 0.00 0.00 175.76 175.37 1r43 s VAL 365 N -2.64 1.34 -0.21 0.00 1.01 -0.97 -4.93 120.40 114.01 1r43 s VAL 365 Ca 0.62 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.84 1r43 s VAL 365 Cb -0.15 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 1r43 s VAL 365 CO 0.42 0.41 0.56 0.20 0.00 0.00 0.00 175.10 176.69 1r43 s ASN 366 N 0.88 6.59 0.45 3.32 0.01 -1.26 -0.41 114.94 124.53 1r43 s ASN 366 Ca -0.10 0.72 -0.22 0.00 -0.71 0.00 0.00 52.86 52.55 1r43 s ASN 366 Cb -0.15 -2.31 -0.09 0.00 0.41 0.00 0.00 41.25 39.11 1r43 s ASN 366 CO 0.01 -0.23 1.03 -0.36 -1.51 0.00 0.00 177.10 176.04 1r43 s PHE 367 N 1.83 3.13 0.24 2.20 0.08 -1.05 -4.95 117.98 119.46 1r43 s PHE 367 Ca 0.25 1.61 -0.31 0.00 0.12 0.00 0.00 56.93 58.60 1r43 s PHE 367 Cb -0.16 -3.06 -0.12 0.00 -0.57 0.00 0.00 43.02 39.11 1r43 s PHE 367 CO 0.10 -0.66 1.58 1.58 -0.10 0.00 0.00 175.22 177.72 1r43 n HIS 368 N -0.60 2.59 0.12 0.36 -0.00 0.67 -4.86 115.22 113.50 1r43 n HIS 368 Ca 0.07 0.24 -0.02 0.00 0.46 0.00 0.00 57.72 58.48 1r43 n HIS 368 Cb 0.52 -2.58 0.11 0.00 -0.12 0.00 0.00 29.99 27.92 1r43 n HIS 368 CO 0.00 0.00 0.00 1.05 0.46 0.00 0.00 176.34 177.85 1r43 h GLU 369 N 5.32 0.00 -0.57 1.57 9.09 -1.92 -0.08 114.58 127.99 1r43 h GLU 369 Ca -0.45 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 58.91 1r43 h GLU 369 Cb 1.23 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.31 1r43 h GLU 369 CO 0.84 0.69 0.15 0.28 0.05 0.00 0.00 179.01 181.02 1r43 h VAL 370 N 0.00 1.23 -0.10 -1.06 2.07 -1.97 -1.74 116.25 114.68 1r43 h VAL 370 Ca -0.01 -0.81 -0.18 0.00 0.82 0.00 0.00 66.70 66.53 1r43 h VAL 370 Cb 1.23 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1r43 h VAL 370 CO 0.09 0.30 -0.64 0.00 0.02 0.00 0.00 177.57 177.34 1r43 h ILE 372 N 0.25 1.24 -0.63 0.00 2.04 -1.00 -3.05 117.51 116.36 1r43 h ILE 372 Ca -0.05 -0.51 0.13 0.00 1.00 0.00 0.00 64.86 65.43 1r43 h ILE 372 Cb 1.29 -0.02 -0.12 0.00 -0.74 0.00 0.00 36.82 37.23 1r43 h ILE 372 CO 0.13 0.25 -0.13 -0.33 0.00 0.00 0.00 178.15 178.07 1r43 h GLU 373 N 1.22 0.02 0.06 2.37 4.39 -1.31 -0.70 114.58 120.62 1r43 h GLU 373 Ca 0.32 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 60.04 1r43 h GLU 373 Cb -0.07 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.53 1r43 h GLU 373 CO -0.06 0.01 -0.51 0.00 -1.16 0.00 0.00 179.01 177.29 1r43 h VAL 375 N -0.70 1.03 -0.14 0.00 2.07 -1.58 0.17 116.25 117.11 1r43 h VAL 375 Ca 0.01 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.39 1r43 h VAL 375 Cb 0.73 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1r43 h VAL 375 CO -0.32 0.10 -0.15 -1.28 0.02 0.00 0.00 177.57 175.94 1r43 h SER 376 N 0.54 -0.48 0.67 0.57 0.87 -0.89 0.89 113.55 115.73 1r43 h SER 376 Ca 0.19 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1r43 h SER 376 Cb 0.04 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 1r43 h SER 376 CO -0.10 -0.20 0.00 0.54 -0.53 0.00 0.00 176.83 176.54 1r43 n ARG 377 N -5.30 0.11 -0.05 2.24 1.74 0.31 -2.59 116.66 113.12 1r43 n ARG 377 Ca -0.03 0.32 -0.04 0.00 -0.77 0.00 0.00 57.85 57.34 1r43 n ARG 377 Cb 0.22 -1.69 -0.01 0.00 -1.02 0.00 0.00 32.46 29.95 1r43 n ARG 377 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1r43 n SER 378 N -1.89 1.20 -0.32 0.55 2.88 0.56 -4.13 113.62 112.48 1r43 n SER 378 Ca 0.03 0.41 0.02 0.00 -1.33 0.00 0.00 58.87 58.01 1r43 n SER 378 Cb 0.22 -0.72 0.16 0.00 -0.75 0.00 0.00 64.21 63.12 1r43 n SER 378 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1r43 h ALA 379 N -1.35 1.25 -0.17 -1.46 0.00 0.69 -0.85 119.26 117.38 1r43 h ALA 379 Ca 0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1r43 h ALA 379 Cb 0.43 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1r43 h ALA 379 CO 0.00 0.28 -0.37 0.74 0.00 0.00 0.00 179.25 179.90 1r43 h PHE 380 N 0.98 0.41 0.00 0.00 -1.00 -1.68 0.12 116.94 115.77 1r43 h PHE 380 Ca 0.40 -0.11 0.00 0.00 2.81 0.00 0.00 57.97 61.07 1r43 h PHE 380 Cb 0.23 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 39.69 1r43 h PHE 380 CO -0.03 0.68 0.00 0.00 -1.61 0.00 0.00 178.31 177.35 1r43 n ALA 381 N -2.48 1.82 0.00 2.45 0.00 -0.37 -3.51 120.51 118.42 1r43 n ALA 381 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1r43 n ALA 381 Cb 0.47 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1r43 n ALA 381 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1r43 n GLN 382 N -1.46 4.01 -3.89 0.00 6.02 -0.81 -5.06 117.38 116.18 1r43 n GLN 382 Ca 0.05 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.93 1r43 n GLN 382 Cb 0.19 -0.65 -0.13 0.00 1.02 0.00 0.00 30.24 30.68 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 -1.25 0.05 0.54 1.08 0.40 0.35 -5.08 117.98 114.06 1r43 s PHE 383 Ca 0.00 -0.09 -0.20 0.00 -0.60 0.00 0.00 56.93 56.04 1r43 s PHE 383 Cb 0.00 -0.05 -0.07 0.00 0.51 0.00 0.00 43.02 43.41 1r43 s PHE 383 CO 0.00 -0.09 0.86 1.63 0.70 0.00 0.00 175.22 178.33 1r43 n LYS 384 N 2.53 0.93 0.22 0.44 5.02 -1.26 -4.50 118.16 121.54 1r43 n LYS 384 Ca -0.16 0.35 0.18 0.00 -2.02 0.00 0.00 58.31 56.66 1r43 n LYS 384 Cb 0.58 -2.01 0.82 0.00 -0.02 0.00 0.00 35.03 34.41 1r43 n LYS 384 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1r43 h LYS 385 N 0.73 0.00 0.00 1.97 1.57 -1.94 0.16 116.57 119.06 1r43 h LYS 385 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1r43 h LYS 385 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1r43 h LYS 385 CO 0.52 0.00 -0.38 -0.40 -0.57 0.00 0.00 179.45 178.61 1r43 n ASP 386 N -3.43 0.45 -0.05 0.86 5.75 -1.26 -3.52 116.55 115.35 1r43 n ASP 386 Ca 0.02 0.06 0.13 0.00 -0.01 0.00 0.00 54.79 54.99 1r43 n ASP 386 Cb 0.43 -0.01 0.41 0.00 -1.03 0.00 0.00 41.12 40.92 1r43 n ASP 386 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1r43 n GLN 387 N -1.69 0.23 -4.63 0.11 1.13 0.56 -4.64 117.38 108.46 1r43 n GLN 387 Ca 0.05 -0.11 -0.30 0.00 -1.94 0.00 0.00 57.00 54.70 1r43 n GLN 387 Cb 0.37 -1.50 -0.13 0.00 0.11 0.00 0.00 30.24 29.09 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 -2.84 2.61 -0.15 5.09 1.01 -1.23 -1.45 120.40 123.44 1r43 s VAL 388 Ca 0.17 -1.34 -0.22 0.00 0.00 0.00 0.00 61.98 60.58 1r43 s VAL 388 Cb 0.18 -2.11 0.06 0.00 0.00 0.00 0.00 36.38 34.51 1r43 s VAL 388 CO 0.60 0.28 0.58 -0.60 0.00 0.00 0.00 175.10 175.96 1r43 s ARG 389 N -1.57 0.78 -0.30 2.72 3.52 -1.15 -5.00 118.95 117.95 1r43 s ARG 389 Ca 0.14 0.55 -0.22 0.00 -0.13 0.00 0.00 55.73 56.08 1r43 s ARG 389 Cb -0.10 0.37 -0.01 0.00 -1.56 0.00 0.00 34.95 33.65 1r43 s ARG 389 CO 0.05 -0.16 0.71 -0.65 -0.81 0.00 0.00 175.30 174.45 1r43 s GLN 390 N -0.28 3.96 0.17 5.12 -0.21 -1.26 0.17 119.66 127.33 1r43 s GLN 390 Ca -0.05 0.48 0.08 0.00 0.02 0.00 0.00 55.36 55.89 1r43 s GLN 390 Cb -0.03 -3.72 -0.04 0.00 1.00 0.00 0.00 33.01 30.22 1r43 s GLN 390 CO 0.04 -0.60 -0.04 0.42 -2.12 0.00 0.00 175.29 172.98 1r43 s ILE 391 N 2.77 3.53 -0.37 1.08 1.01 -0.74 -4.91 121.20 123.56 1r43 s ILE 391 Ca 0.29 -1.49 -0.12 0.00 0.00 0.00 0.00 60.65 59.33 1r43 s ILE 391 Cb -0.15 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.58 1r43 s ILE 391 CO 0.12 -0.09 0.23 0.26 0.00 0.00 0.00 174.94 175.45 1r43 s TRP 392 N -1.69 3.23 0.12 3.97 0.52 -1.26 -1.66 118.94 122.17 1r43 s TRP 392 Ca 0.26 -0.73 -0.33 0.00 0.02 0.00 0.00 56.10 55.32 1r43 s TRP 392 Cb -0.09 -2.48 -0.12 0.00 -1.15 0.00 0.00 33.47 29.62 1r43 s TRP 392 CO 0.17 -0.58 1.72 0.45 0.02 0.00 0.00 176.95 178.73 1r43 n SER 393 N 5.06 3.55 0.04 2.95 2.88 -0.52 -4.75 113.62 122.82 1r43 n SER 393 Ca -0.12 1.04 -0.13 0.00 -1.33 0.00 0.00 58.87 58.33 1r43 n SER 393 Cb 0.47 -1.48 -0.08 0.00 -0.75 0.00 0.00 64.21 62.38 1r43 n SER 393 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1r43 h GLY 394 N 7.24 -0.05 -3.28 0.46 0.00 -1.88 -1.06 103.07 104.51 1r43 h GLY 394 Ca -0.45 0.02 -0.50 0.00 0.00 0.00 0.00 47.33 46.40 1r43 h GLY 394 CO 0.92 -0.02 -0.48 0.00 0.00 0.00 0.00 176.54 176.97 1r43 s ALA 395 N -5.54 3.78 0.49 3.60 0.00 -1.26 -4.28 121.76 118.55 1r43 s ALA 395 Ca -0.14 -1.27 -0.19 0.00 0.00 0.00 0.00 51.96 50.36 1r43 s ALA 395 Cb 0.04 -1.55 -0.08 0.00 0.00 0.00 0.00 23.12 21.53 1r43 s ALA 395 CO 0.66 0.31 1.02 0.20 0.00 0.00 0.00 175.76 177.95 1r43 s GLY 396 N -3.74 2.39 0.19 0.00 0.00 -1.26 -4.87 107.32 100.03 1r43 s GLY 396 Ca 0.33 0.49 0.03 0.00 0.00 0.00 0.00 44.72 45.57 1r43 s GLY 396 CO 0.27 0.79 0.11 1.42 0.00 0.00 0.00 173.10 175.69 1r43 n HIS 397 N -1.10 -0.15 0.07 1.90 8.25 -1.26 -5.02 115.22 117.91 1r43 n HIS 397 Ca 0.08 -1.35 -0.04 0.00 -0.26 0.00 0.00 57.72 56.15 1r43 n HIS 397 Cb 0.53 0.07 0.18 0.00 1.12 0.00 0.00 29.99 31.89 1r43 n HIS 397 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1r43 h ASP 398 N 0.91 0.32 -0.25 0.41 3.32 -1.95 -2.52 116.42 116.66 1r43 h ASP 398 Ca -0.14 -0.15 0.07 0.00 0.02 0.00 0.00 57.03 56.84 1r43 h ASP 398 Cb 0.60 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 1r43 h ASP 398 CO 0.21 0.73 0.25 0.28 -1.72 0.00 0.00 179.24 179.00 1r43 h SER 399 N 0.25 0.00 -0.46 6.45 0.02 -1.96 -0.78 113.55 117.07 1r43 h SER 399 Ca 0.02 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1r43 h SER 399 Cb 0.90 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 1r43 h SER 399 CO 0.07 0.00 0.31 0.00 -1.14 0.00 0.00 176.83 176.07 1r43 h GLN 401 N 0.58 0.12 0.00 0.00 1.08 -1.28 -3.32 115.11 112.29 1r43 h GLN 401 Ca 0.17 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1r43 h GLN 401 Cb -0.01 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1r43 h GLN 401 CO -0.04 0.95 -0.31 0.25 -0.95 0.00 0.00 178.83 178.73 1r43 n THR 402 N -3.34 0.32 -0.14 -0.54 -2.24 -1.11 -4.16 114.28 103.06 1r43 n THR 402 Ca -0.11 -0.19 -0.09 0.00 -2.27 0.00 0.00 64.05 61.39 1r43 n THR 402 Cb 1.01 -0.27 -0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1r43 n THR 402 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r43 h ALA 403 N 2.67 0.55 0.00 6.98 0.00 -1.25 -1.61 119.26 126.59 1r43 h ALA 403 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1r43 h ALA 403 Cb 0.66 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1r43 h ALA 403 CO 0.00 0.16 0.00 -0.35 0.00 0.00 0.00 179.25 179.06 1r43 n PRO 404 N -4.62 0.96 0.01 0.00 -0.04 -1.26 -4.31 135.00 125.74 1r43 n PRO 404 Ca 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1r43 n PRO 404 Cb 0.15 -1.36 -0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1r43 n PRO 404 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1r43 n HIS 405 N -0.86 0.00 -3.92 0.54 8.25 -1.12 -5.08 115.22 113.03 1r43 n HIS 405 Ca 0.17 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.30 1r43 n HIS 405 Cb 0.08 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.13 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 -1.20 5.39 0.11 1.59 -7.23 -0.62 -5.07 120.40 113.37 1r43 s VAL 406 Ca -0.01 -0.22 -0.36 0.00 -1.81 0.00 0.00 61.98 59.58 1r43 s VAL 406 Cb 0.00 -3.54 -0.16 0.00 0.56 0.00 0.00 36.38 33.24 1r43 s VAL 406 CO 0.01 0.28 1.37 -0.81 -0.31 0.00 0.00 175.10 175.64 1r43 n PRO 407 N 0.81 1.33 -3.70 4.82 -0.04 -1.26 -4.24 135.00 132.72 1r43 n PRO 407 Ca -0.10 0.48 -0.13 0.00 -0.04 0.00 0.00 63.50 63.71 1r43 n PRO 407 Cb 0.52 -2.14 -0.07 0.00 -0.04 0.00 0.00 33.50 31.77 1r43 n PRO 407 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1r43 s THR 408 N 0.50 0.05 0.00 0.52 -1.32 -1.26 -1.76 115.64 112.37 1r43 s THR 408 Ca 0.82 -0.44 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 1r43 s THR 408 Cb -0.90 -0.83 0.00 0.00 -1.51 0.00 0.00 72.50 69.27 1r43 s THR 408 CO 0.46 -0.24 0.00 -0.24 -2.21 0.00 0.00 174.62 172.39 1r43 n SER 409 N 0.86 0.00 -3.64 8.08 2.88 -0.90 -0.24 113.62 120.66 1r43 n SER 409 Ca -0.20 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.21 1r43 n SER 409 Cb 0.58 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.97 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 -0.77 -0.00 0.23 2.46 1.01 -0.23 -3.16 121.20 120.74 1r43 s ILE 411 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 60.65 60.74 1r43 s ILE 411 Cb 0.00 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 1r43 s ILE 411 CO 0.00 0.00 -0.05 -0.36 0.00 0.00 0.00 174.94 174.53 1r43 s PHE 412 N 0.47 2.65 -0.01 3.97 2.99 -0.49 -1.70 117.98 125.86 1r43 s PHE 412 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 56.93 56.70 1r43 s PHE 412 Cb -0.05 -1.22 0.01 0.00 0.00 0.00 0.00 43.02 41.77 1r43 s PHE 412 CO -0.01 0.59 0.00 0.42 -0.00 0.00 0.00 175.22 176.22 1r43 s ILE 413 N -2.09 0.05 0.15 0.64 1.01 -1.12 -3.10 121.20 116.73 1r43 s ILE 413 Ca 0.29 0.05 -0.34 0.00 0.00 0.00 0.00 60.65 60.65 1r43 s ILE 413 Cb -0.07 -0.10 -0.16 0.00 0.01 0.00 0.00 42.46 42.15 1r43 s ILE 413 CO 0.18 0.05 1.30 -2.65 0.00 0.00 0.00 174.94 173.82 1r43 n PRO 414 N 3.51 1.36 -3.72 2.79 -0.02 -1.26 -1.30 135.00 136.35 1r43 n PRO 414 Ca -0.18 0.49 -0.38 0.00 -2.02 0.00 0.00 63.50 61.41 1r43 n PRO 414 Cb 0.56 -2.08 -0.12 0.00 -0.02 0.00 0.00 33.50 31.83 1r43 n PRO 414 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1r43 s SER 415 N 0.30 5.28 0.20 2.55 0.01 -1.26 -4.74 113.70 116.04 1r43 s SER 415 Ca 0.77 -0.61 -0.32 0.00 1.31 0.00 0.00 55.95 57.10 1r43 s SER 415 Cb -0.85 -1.93 -0.12 0.00 0.21 0.00 0.00 66.02 63.34 1r43 s SER 415 CO 0.48 -0.18 1.70 -0.75 0.41 0.00 0.00 173.24 174.90 1r43 s LYS 416 N 1.55 4.14 0.00 12.44 2.20 -1.22 -0.61 119.74 138.23 1r43 s LYS 416 Ca 0.04 2.58 0.00 0.00 -0.36 0.00 0.00 55.97 58.22 1r43 s LYS 416 Cb -0.17 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1r43 s LYS 416 CO 0.04 -0.73 0.00 -0.25 -0.36 0.00 0.00 175.35 174.05 1r43 n ASP 417 N 3.95 -3.51 -3.31 1.43 10.43 -1.26 -3.16 116.55 121.12 1r43 n ASP 417 Ca 0.15 0.00 -0.09 0.00 2.57 0.00 0.00 54.79 57.42 1r43 n ASP 417 Cb 0.36 -2.80 0.00 0.00 1.84 0.00 0.00 41.12 40.52 1r43 n ASP 417 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1r43 n GLY 418 N -0.42 -1.24 2.93 0.44 0.00 0.22 -4.76 105.19 102.35 1r43 n GLY 418 Ca 0.00 0.55 -0.22 0.00 0.00 0.00 0.00 46.02 46.35 1r43 n GLY 418 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1r43 s LEU 419 N -4.26 1.37 0.24 0.99 2.96 -1.19 -4.61 118.68 114.19 1r43 s LEU 419 Ca 0.01 -0.19 -0.04 0.00 -0.22 0.00 0.00 54.13 53.70 1r43 s LEU 419 Cb -0.00 -0.60 -0.02 0.00 0.50 0.00 0.00 46.19 46.07 1r43 s LEU 419 CO 0.80 -0.04 0.28 -0.55 -1.32 0.00 0.00 176.35 175.52 1r43 s SER 420 N 0.97 0.31 -1.49 3.68 0.15 -1.26 -4.67 113.70 111.39 1r43 s SER 420 Ca -0.10 -1.30 -0.08 0.00 0.70 0.00 0.00 55.95 55.17 1r43 s SER 420 Cb -0.14 0.49 0.06 0.00 -1.71 0.00 0.00 66.02 64.71 1r43 s SER 420 CO 0.00 -1.00 0.68 1.41 1.20 0.00 0.00 173.24 175.53 1r43 n HIS 421 N -0.37 -1.85 -3.65 3.44 8.25 -1.26 -4.94 115.22 114.84 1r43 n HIS 421 Ca 0.01 0.81 -0.14 0.00 -0.26 0.00 0.00 57.72 58.14 1r43 n HIS 421 Cb 0.64 -3.69 -0.08 0.00 1.12 0.00 0.00 29.99 27.98 1r43 n HIS 421 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1r43 s ASN 422 N -3.87 -0.66 0.34 0.41 3.84 -1.24 -4.78 114.94 108.97 1r43 s ASN 422 Ca 0.33 1.22 0.11 0.00 0.21 0.00 0.00 52.86 54.73 1r43 s ASN 422 Cb -0.17 1.23 1.03 0.00 -0.55 0.00 0.00 41.25 42.78 1r43 s ASN 422 CO 0.87 -0.26 1.56 -1.22 -2.79 0.00 0.00 177.10 175.26 1r43 n TYR 423 N 2.54 0.88 0.70 0.43 0.53 -1.26 -1.57 117.16 119.42 1r43 n TYR 423 Ca -0.14 1.18 0.06 0.00 -1.02 0.00 0.00 57.90 57.97 1r43 n TYR 423 Cb 0.56 -1.40 0.17 0.00 -1.03 0.00 0.00 39.34 37.64 1r43 n TYR 423 CO 0.00 0.00 0.00 0.66 -1.02 0.00 0.00 176.86 176.50 1r43 n TYR 424 N -5.37 0.58 -1.58 -0.72 4.02 -1.26 -4.63 117.16 108.20 1r43 n TYR 424 Ca 0.30 -0.27 -0.48 0.00 -0.01 0.00 0.00 57.90 57.44 1r43 n TYR 424 Cb 1.01 -0.05 -0.05 0.00 -0.02 0.00 0.00 39.34 40.22 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 0.54 1.72 -4.38 -0.72 2.13 -0.61 -4.95 120.64 114.38 1r43 n GLU 425 Ca 0.13 0.55 -0.22 0.00 0.66 0.00 0.00 57.16 58.28 1r43 n GLU 425 Cb 0.38 -2.69 -0.11 0.00 0.27 0.00 0.00 31.44 29.29 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 6.09 1.97 -0.28 4.31 5.04 -1.26 -4.56 117.35 128.66 1r43 s TYR 426 Ca 1.01 -0.44 -0.11 0.00 -2.44 0.00 0.00 57.07 55.08 1r43 s TYR 426 Cb -0.69 -0.94 0.11 0.00 0.35 0.00 0.00 41.96 40.79 1r43 s TYR 426 CO 0.48 0.44 0.63 -1.12 -1.34 0.00 0.00 175.55 174.64 1r43 s SER 427 N -2.96 -0.98 0.38 4.32 0.01 -1.26 -3.44 113.70 109.78 1r43 s SER 427 Ca 0.21 1.48 -0.24 0.00 1.31 0.00 0.00 55.95 58.70 1r43 s SER 427 Cb -0.05 1.89 -0.12 0.00 0.21 0.00 0.00 66.02 67.95 1r43 s SER 427 CO 0.09 -0.23 0.78 -0.24 0.41 0.00 0.00 173.24 174.05 1r43 n SER 428 N 5.06 0.17 -0.33 2.44 2.88 -1.26 -4.80 113.62 117.78 1r43 n SER 428 Ca -0.14 1.01 0.17 0.00 -1.33 0.00 0.00 58.87 58.58 1r43 n SER 428 Cb 0.52 -1.21 0.41 0.00 -0.75 0.00 0.00 64.21 63.18 1r43 n SER 428 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1r43 h PRO 429 N 1.25 0.56 0.66 -1.46 0.13 -2.01 -2.20 132.00 128.93 1r43 h PRO 429 Ca -0.41 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 1r43 h PRO 429 Cb 1.37 -0.13 0.01 0.00 0.13 0.00 0.00 31.00 32.38 1r43 h PRO 429 CO 0.55 0.37 -0.32 1.49 -0.23 0.00 0.00 178.00 179.86 1r43 h GLU 430 N 0.58 -0.85 -1.01 0.86 4.81 -2.01 -3.18 114.58 113.78 1r43 h GLU 430 Ca 0.58 0.06 0.24 0.00 -0.13 0.00 0.00 59.36 60.11 1r43 h GLU 430 Cb 1.17 0.19 -0.12 0.00 0.63 0.00 0.00 28.75 30.63 1r43 h GLU 430 CO -0.35 -0.53 0.60 0.93 -0.73 0.00 0.00 179.01 178.93 1r43 h GLU 431 N -1.04 0.58 0.10 1.92 5.08 -1.76 0.56 114.58 120.03 1r43 h GLU 431 Ca -0.09 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1r43 h GLU 431 Cb 0.72 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1r43 h GLU 431 CO 0.15 0.38 -0.24 0.82 -1.00 0.00 0.00 179.01 179.12 1r43 h ILE 432 N 0.60 0.47 -0.72 3.13 2.04 -1.48 -2.67 117.51 118.88 1r43 h ILE 432 Ca 0.63 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.53 1r43 h ILE 432 Cb 1.19 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 1r43 h ILE 432 CO -0.44 0.00 0.44 -0.08 0.00 0.00 0.00 178.15 178.07 1r43 h GLU 433 N -0.43 0.82 -0.34 2.37 4.57 -0.90 -2.33 114.58 118.33 1r43 h GLU 433 Ca 0.03 -0.05 0.06 0.00 -1.18 0.00 0.00 59.36 58.22 1r43 h GLU 433 Cb 0.46 -0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 28.81 1r43 h GLU 433 CO -0.14 0.54 0.00 -0.91 -1.18 0.00 0.00 179.01 177.32 1r43 h ASN 434 N 0.85 -0.13 -0.48 1.04 -0.26 -0.99 0.81 115.58 116.42 1r43 h ASN 434 Ca 0.29 0.08 -0.10 0.00 -0.56 0.00 0.00 56.30 56.01 1r43 h ASN 434 Cb 0.06 0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.44 1r43 h ASN 434 CO -0.13 -0.03 -0.09 1.23 -1.06 0.00 0.00 177.43 177.35 1r43 h GLY 435 N 0.10 0.98 0.57 2.83 0.00 -1.43 -1.30 103.07 104.83 1r43 h GLY 435 Ca 0.17 -0.80 0.05 0.00 0.00 0.00 0.00 47.33 46.75 1r43 h GLY 435 CO -0.28 0.73 0.09 -2.75 0.00 0.00 0.00 176.54 174.33 1r43 h PHE 436 N 0.76 0.15 -0.72 5.60 3.57 -0.69 0.37 116.94 125.98 1r43 h PHE 436 Ca 0.12 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.72 1r43 h PHE 436 Cb 0.64 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.32 1r43 h PHE 436 CO 0.05 0.03 0.47 0.87 -2.23 0.00 0.00 178.31 177.50 1r43 h LYS 437 N 0.22 0.67 0.01 1.11 1.79 0.91 -1.02 116.57 120.25 1r43 h LYS 437 Ca 0.18 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1r43 h LYS 437 Cb 0.20 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1r43 h LYS 437 CO -0.22 0.44 -0.00 0.28 -1.08 0.00 0.00 179.45 178.87 1r43 h VAL 438 N 0.69 1.37 -0.03 0.50 2.07 -0.07 -3.22 116.25 117.55 1r43 h VAL 438 Ca 0.32 -1.14 0.03 0.00 0.82 0.00 0.00 66.70 66.73 1r43 h VAL 438 Cb 0.35 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.22 1r43 h VAL 438 CO -0.11 0.29 -0.22 0.25 0.02 0.00 0.00 177.57 177.80 1r43 h LEU 439 N -0.50 -0.66 -0.20 2.57 5.85 0.63 -0.29 115.31 122.70 1r43 h LEU 439 Ca -0.00 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.86 1r43 h LEU 439 Cb 0.49 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 1r43 h LEU 439 CO 0.00 -0.29 -0.09 0.25 -0.34 0.00 0.00 178.44 177.97 1r43 h LEU 440 N -0.34 -0.31 -0.82 2.25 5.85 -1.35 0.64 115.31 121.23 1r43 h LEU 440 Ca 0.07 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 1r43 h LEU 440 Cb 0.43 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1r43 h LEU 440 CO -0.22 -0.12 0.28 1.56 -0.34 0.00 0.00 178.44 179.59 1r43 h GLN 441 N -0.07 1.15 -0.65 1.25 1.08 -1.53 -0.25 115.11 116.10 1r43 h GLN 441 Ca 0.11 -0.22 0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1r43 h GLN 441 Cb 0.23 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 1r43 h GLN 441 CO -0.25 0.95 0.43 0.00 -0.95 0.00 0.00 178.83 179.01 1r43 h ALA 442 N 1.19 0.83 -0.00 3.87 0.00 -0.30 0.49 119.26 125.34 1r43 h ALA 442 Ca 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1r43 h ALA 442 Cb 0.25 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1r43 h ALA 442 CO -0.02 0.25 0.00 0.82 0.00 0.00 0.00 179.25 180.31 1r43 h ILE 443 N 0.88 1.02 -0.93 0.00 2.04 -0.50 0.03 117.51 120.05 1r43 h ILE 443 Ca 0.24 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 66.11 1r43 h ILE 443 Cb -0.10 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 36.97 1r43 h ILE 443 CO -0.05 0.01 0.61 0.40 0.00 0.00 0.00 178.15 179.11 1r43 h ILE 444 N -0.02 1.10 -0.29 -0.67 2.04 -0.55 0.27 117.51 119.39 1r43 h ILE 444 Ca 0.00 -0.38 -0.14 0.00 1.00 0.00 0.00 64.86 65.35 1r43 h ILE 444 Cb 0.02 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 35.99 1r43 h ILE 444 CO -0.00 0.20 -0.38 0.78 0.00 0.00 0.00 178.15 178.75 1r43 h ASN 445 N 1.10 0.70 -0.23 1.72 2.35 0.35 -1.17 115.58 120.41 1r43 h ASN 445 Ca 0.39 -0.31 -0.13 0.00 -0.55 0.00 0.00 56.30 55.71 1r43 h ASN 445 Cb 0.13 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.30 1r43 h ASN 445 CO -0.14 1.01 -0.36 0.22 -1.65 0.00 0.00 177.43 176.51 1r43 h TYR 446 N 0.55 0.81 -0.93 1.19 3.20 -0.26 -1.38 116.97 120.15 1r43 h TYR 446 Ca 0.05 -0.27 0.15 0.00 3.14 0.00 0.00 58.73 61.80 1r43 h TYR 446 Cb 0.90 -0.16 -0.08 0.00 1.54 0.00 0.00 36.73 38.93 1r43 h TYR 446 CO 0.04 1.03 0.59 0.22 -1.64 0.00 0.00 178.16 178.40 1r43 h ASP 447 N 0.36 0.70 1.47 -2.11 3.58 -0.41 -2.16 116.42 117.84 1r43 h ASP 447 Ca 0.02 0.05 -0.09 0.00 0.42 0.00 0.00 57.03 57.43 1r43 h ASP 447 Cb 0.95 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.90 1r43 h ASP 447 CO 0.08 0.34 -0.54 0.78 -2.88 0.00 0.00 179.24 177.02 1r43 h ASN 448 N 0.73 0.00 -0.38 2.28 2.35 -1.03 -3.11 115.58 116.43 1r43 h ASN 448 Ca 0.48 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 56.14 1r43 h ASN 448 Cb 0.74 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 1r43 h ASN 448 CO -0.24 0.41 -0.06 0.22 -1.65 0.00 0.00 177.43 176.10 1r43 h TYR 449 N 0.00 0.86 0.00 1.19 5.03 -0.63 -3.07 116.97 120.35 1r43 h TYR 449 Ca -0.02 -0.14 -0.01 0.00 2.58 0.00 0.00 58.73 61.14 1r43 h TYR 449 Cb 1.33 -0.23 -0.00 0.00 1.55 0.00 0.00 36.73 39.38 1r43 h TYR 449 CO 0.00 0.83 -0.03 0.00 -1.32 0.00 0.00 178.16 177.64 1r43 h ARG 450 N 0.73 0.00 -0.05 1.82 3.08 -1.37 0.49 114.38 119.08 1r43 h ARG 450 Ca 0.13 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 1r43 h ARG 450 Cb 0.54 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.59 1r43 h ARG 450 CO 0.03 0.03 -0.39 0.28 -1.07 0.00 0.00 179.97 178.84 1r43 h VAL 451 N 0.00 1.43 -0.02 2.04 2.07 -1.60 -1.32 116.25 118.84 1r43 h VAL 451 Ca -0.00 -1.84 -0.16 0.00 0.82 0.00 0.00 66.70 65.52 1r43 h VAL 451 Cb 0.06 2.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1r43 h VAL 451 CO 0.00 0.53 -0.70 0.40 0.02 0.00 0.00 177.57 177.82 1r43 h ILE 452 N -0.15 1.46 -0.54 4.57 2.04 -1.42 -2.85 117.51 120.63 1r43 h ILE 452 Ca -0.04 -2.29 0.01 0.00 1.00 0.00 0.00 64.86 63.55 1r43 h ILE 452 Cb 1.07 2.22 -0.03 0.00 -0.74 0.00 0.00 36.82 39.35 1r43 h ILE 452 CO 0.08 0.66 0.34 -0.09 0.00 0.00 0.00 178.15 179.14 1r43 h ARG 453 N 0.08 0.66 -0.53 2.37 2.43 -0.10 -3.08 114.38 116.22 1r43 h ARG 453 Ca -0.01 -0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.22 1r43 h ARG 453 Cb 1.24 -0.15 -0.09 0.00 -0.42 0.00 0.00 29.97 30.55 1r43 h ARG 453 CO 0.10 0.44 0.00 0.78 -1.51 0.00 0.00 179.97 179.78 1r43 h GLY 454 N 0.68 0.55 1.00 2.80 0.00 -1.00 -3.50 103.07 103.60 1r43 h GLY 454 Ca 0.21 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1r43 h GLY 454 CO -0.07 -0.15 0.00 1.42 0.00 0.00 0.00 176.54 177.74