#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qw4 s TYR 78 N 0.00 3.36 -0.26 1.08 -0.85 -1.26 -4.83 117.35 114.58 1qw4 s TYR 78 Ca 0.00 1.50 -0.11 0.00 -0.52 0.00 0.00 57.07 57.93 1qw4 s TYR 78 Cb 0.00 -2.77 -0.05 0.00 0.38 0.00 0.00 41.96 39.52 1qw4 s TYR 78 CO 0.00 -0.13 0.20 0.08 -1.52 0.00 0.00 175.55 174.18 1qw4 s VAL 79 N -2.25 5.31 0.01 -3.49 1.01 -0.78 -4.86 120.40 115.35 1qw4 s VAL 79 Ca 0.60 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 62.50 1qw4 s VAL 79 Cb -0.09 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1qw4 s VAL 79 CO 0.18 0.28 1.33 -0.60 0.00 0.00 0.00 175.10 176.29 1qw4 s ARG 80 N 1.50 4.32 -0.06 2.72 3.52 -1.26 -2.17 118.95 127.52 1qw4 s ARG 80 Ca 0.08 1.89 0.04 0.00 -0.13 0.00 0.00 55.73 57.62 1qw4 s ARG 80 Cb -0.15 -3.51 -0.00 0.00 -1.56 0.00 0.00 34.95 29.73 1qw4 s ARG 80 CO 0.08 -0.49 -0.18 0.42 -0.81 0.00 0.00 175.30 174.32 1qw4 s ILE 81 N 2.05 1.55 0.12 4.11 1.01 0.81 -4.98 121.20 125.87 1qw4 s ILE 81 Ca 0.62 -0.77 0.10 0.00 0.00 0.00 0.00 60.65 60.60 1qw4 s ILE 81 Cb -0.30 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 1qw4 s ILE 81 CO 0.26 0.44 -0.25 -0.75 0.00 0.00 0.00 174.94 174.64 1qw4 s LYS 82 N 0.15 1.35 -0.33 2.79 2.20 -1.26 0.81 119.74 125.45 1qw4 s LYS 82 Ca -0.08 -1.28 -0.06 0.00 -0.36 0.00 0.00 55.97 54.19 1qw4 s LYS 82 Cb -0.13 -1.76 0.03 0.00 -1.51 0.00 0.00 37.83 34.46 1qw4 s LYS 82 CO 0.04 0.42 0.09 1.21 -0.36 0.00 0.00 175.35 176.75 1qw4 s ASN 83 N -1.96 5.24 0.04 1.43 3.84 -0.08 -1.35 114.94 122.09 1qw4 s ASN 83 Ca 0.12 -1.04 0.20 0.00 0.21 0.00 0.00 52.86 52.35 1qw4 s ASN 83 Cb -0.10 -1.86 0.85 0.00 -0.55 0.00 0.00 41.25 39.59 1qw4 s ASN 83 CO 0.05 -0.29 1.64 0.79 -2.79 0.00 0.00 177.10 176.51 1qw4 n TRP 84 N 4.82 0.13 0.04 0.43 7.02 0.70 0.80 117.44 131.39 1qw4 n TRP 84 Ca -0.13 0.05 -0.10 0.00 -1.02 0.00 0.00 57.50 56.30 1qw4 n TRP 84 Cb 0.45 -0.58 -0.13 0.00 -2.42 0.00 0.00 31.31 28.64 1qw4 n TRP 84 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 1qw4 h GLY 85 N 3.32 0.08 0.00 6.99 0.00 -1.93 -3.37 103.07 108.16 1qw4 h GLY 85 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 1qw4 h GLY 85 CO 0.00 0.17 -0.82 -1.14 0.00 0.00 0.00 176.54 174.75 1qw4 n SER 86 N -3.30 2.10 0.00 0.19 3.41 -1.16 -4.99 113.62 109.87 1qw4 n SER 86 Ca -0.08 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.24 1qw4 n SER 86 Cb 0.99 1.15 0.00 0.00 -0.26 0.00 0.00 64.21 66.09 1qw4 n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qw4 n GLY 87 N 1.69 0.91 3.76 5.00 0.00 0.24 -4.99 105.19 111.80 1qw4 n GLY 87 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1qw4 n GLY 87 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qw4 s GLU 88 N -0.07 4.31 -0.06 1.61 2.12 -1.17 -4.75 118.70 120.69 1qw4 s GLU 88 Ca 0.00 2.25 0.02 0.00 0.36 0.00 0.00 54.97 57.60 1qw4 s GLU 88 Cb 0.00 -3.10 -0.03 0.00 0.26 0.00 0.00 34.13 31.27 1qw4 s GLU 88 CO 0.00 -0.31 -0.11 0.42 -0.54 0.00 0.00 175.26 174.72 1qw4 s ILE 89 N -0.51 3.32 0.18 -3.70 -1.09 -1.26 -0.91 121.20 117.23 1qw4 s ILE 89 Ca 0.54 -0.62 0.08 0.00 -2.23 0.00 0.00 60.65 58.42 1qw4 s ILE 89 Cb -0.41 -2.33 -0.04 0.00 -1.58 0.00 0.00 42.46 38.10 1qw4 s ILE 89 CO 0.48 0.59 -0.16 -0.76 -1.23 0.00 0.00 174.94 173.85 1qw4 s LEU 90 N -0.69 2.49 -0.24 2.97 1.43 0.24 -4.97 118.68 119.90 1qw4 s LEU 90 Ca 0.11 -0.93 0.02 0.00 -1.03 0.00 0.00 54.13 52.30 1qw4 s LEU 90 Cb -0.11 -0.75 0.05 0.00 0.03 0.00 0.00 46.19 45.41 1qw4 s LEU 90 CO 0.01 -0.09 -0.12 -1.00 0.23 0.00 0.00 176.35 175.38 1qw4 s HIS 91 N -2.44 3.01 -0.36 0.29 3.76 -1.26 -0.13 115.29 118.15 1qw4 s HIS 91 Ca 0.18 -2.08 -0.18 0.00 -0.15 0.00 0.00 55.06 52.84 1qw4 s HIS 91 Cb -0.04 -1.86 0.00 0.00 1.11 0.00 0.00 32.58 31.79 1qw4 s HIS 91 CO 0.07 -0.84 0.49 0.34 -0.85 0.00 0.00 174.74 173.95 1qw4 s ASP 92 N 1.19 6.28 -0.06 1.40 -1.08 -0.92 -4.64 116.67 118.85 1qw4 s ASP 92 Ca -0.06 -0.16 0.10 0.00 -0.52 0.00 0.00 52.55 51.91 1qw4 s ASP 92 Cb -0.18 -2.26 -0.14 0.00 -1.46 0.00 0.00 42.92 38.88 1qw4 s ASP 92 CO -0.07 -0.50 0.13 0.35 0.52 0.00 0.00 175.17 175.61 1qw4 n THR 93 N 5.44 0.33 0.14 1.71 -2.24 -0.41 -1.86 114.28 117.39 1qw4 n THR 93 Ca -0.05 -0.33 0.17 0.00 -2.27 0.00 0.00 64.05 61.57 1qw4 n THR 93 Cb 0.49 -0.24 0.76 0.00 -2.10 0.00 0.00 70.33 69.24 1qw4 n THR 93 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1qw4 h LEU 94 N 0.00 0.00 -1.14 3.22 5.85 -1.31 -1.23 115.31 120.69 1qw4 h LEU 94 Ca -0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1qw4 h LEU 94 Cb 1.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1qw4 h LEU 94 CO 0.01 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.11 1qw4 n HIS 95 N -4.02 0.64 -0.27 1.25 1.44 -1.26 -1.63 115.22 111.37 1qw4 n HIS 95 Ca 0.04 0.32 -0.05 0.00 -2.01 0.00 0.00 57.72 56.02 1qw4 n HIS 95 Cb 0.41 -1.01 0.10 0.00 0.12 0.00 0.00 29.99 29.60 1qw4 n HIS 95 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1qw4 h HIS 96 N 0.00 1.15 0.00 -1.40 3.86 -1.56 -2.64 115.15 114.56 1qw4 h HIS 96 Ca 0.00 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1qw4 h HIS 96 Cb 0.05 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.17 1qw4 h HIS 96 CO 0.00 0.87 0.00 1.63 0.86 0.00 0.00 177.93 181.29 1qw4 n LYS 97 N -4.28 0.58 -2.03 2.45 4.01 -0.65 -4.85 118.16 113.39 1qw4 n LYS 97 Ca 0.07 0.00 -0.37 0.00 -0.51 0.00 0.00 58.31 57.50 1qw4 n LYS 97 Cb 0.18 -1.13 0.02 0.00 -0.51 0.00 0.00 35.03 33.60 1qw4 n LYS 97 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1qw4 s ALA 98 N -2.00 2.74 0.00 7.82 0.00 -1.00 -4.81 121.76 124.52 1qw4 s ALA 98 Ca 0.07 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1qw4 s ALA 98 Cb 0.03 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1qw4 s ALA 98 CO 0.05 -1.07 0.00 2.41 0.00 0.00 0.00 175.76 177.16 1qw4 n THR 99 N -1.12 0.00 0.00 0.00 -1.04 -1.13 -5.05 114.28 105.95 1qw4 n THR 99 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1qw4 n THR 99 Cb 0.48 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 1qw4 n THR 99 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1qw4 n SER 100 N 0.00 -1.73 -4.79 8.00 7.64 -1.26 -4.97 113.62 116.50 1qw4 n SER 100 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.53 1qw4 n SER 100 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 1qw4 n SER 100 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1qw4 s ASP 101 N -1.87 7.01 0.00 6.43 -0.00 -1.26 -4.95 116.67 122.02 1qw4 s ASP 101 Ca 0.00 1.84 0.00 0.00 -0.00 0.00 0.00 52.55 54.39 1qw4 s ASP 101 Cb 0.00 -2.57 0.00 0.00 -0.00 0.00 0.00 42.92 40.35 1qw4 s ASP 101 CO 0.00 -0.31 0.00 0.33 -0.00 0.00 0.00 175.17 175.19 1qw4 n PHE 102 N -0.08 0.00 -0.01 4.23 7.35 -1.26 -4.84 117.46 122.85 1qw4 n PHE 102 Ca 0.05 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.58 1qw4 n PHE 102 Cb 0.51 0.00 -0.12 0.00 0.35 0.00 0.00 39.48 40.23 1qw4 n PHE 102 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1qw4 h THR 103 N 0.00 1.51 -3.96 -2.13 2.02 -1.93 -3.45 112.91 104.97 1qw4 h THR 103 Ca 0.00 -2.04 -0.51 0.00 0.77 0.00 0.00 66.41 64.63 1qw4 h THR 103 Cb 0.00 2.75 0.06 0.00 -1.74 0.00 0.00 68.15 69.22 1qw4 h THR 103 CO 0.00 0.57 0.51 0.00 0.37 0.00 0.00 175.52 176.97 1qw4 n LYS 105 N -0.05 0.66 0.02 0.00 5.02 -1.09 -4.98 118.16 117.75 1qw4 n LYS 105 Ca 0.05 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.26 1qw4 n LYS 105 Cb 0.46 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.35 1qw4 n LYS 105 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1qw4 h SER 106 N 0.00 0.00 0.00 4.39 4.64 -2.03 -3.37 113.55 117.18 1qw4 h SER 106 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qw4 h SER 106 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1qw4 h SER 106 CO 0.00 0.98 0.00 0.29 -0.87 0.00 0.00 176.83 177.23 1qw4 n LYS 107 N -3.18 2.05 -4.21 4.77 5.02 -1.26 -5.06 118.16 116.27 1qw4 n LYS 107 Ca -0.09 -1.21 -0.12 0.00 -2.02 0.00 0.00 58.31 54.87 1qw4 n LYS 107 Cb 0.99 -0.92 -0.10 0.00 -0.02 0.00 0.00 35.03 34.98 1qw4 n LYS 107 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1qw4 s SER 108 N -0.72 0.53 -0.09 4.39 0.15 -1.26 -5.16 113.70 111.54 1qw4 s SER 108 Ca 0.00 -1.31 -0.02 0.00 0.70 0.00 0.00 55.95 55.32 1qw4 s SER 108 Cb 0.00 0.28 0.03 0.00 -1.71 0.00 0.00 66.02 64.63 1qw4 s SER 108 CO 0.00 -0.76 0.02 0.00 1.20 0.00 0.00 173.24 173.70 1qw4 n LEU 110 N 5.16 4.92 0.30 0.00 4.77 -1.26 -4.78 117.00 126.11 1qw4 n LEU 110 Ca -0.07 -4.13 0.18 0.00 -0.03 0.00 0.00 56.01 51.96 1qw4 n LEU 110 Cb 0.50 -0.61 0.94 0.00 -2.33 0.00 0.00 43.42 41.92 1qw4 n LEU 110 CO 0.10 1.53 1.08 1.23 -1.33 0.00 0.00 177.39 180.01 1qw4 h GLY 111 N 1.47 0.00 -2.09 -0.72 0.00 -1.95 -2.50 103.07 97.28 1qw4 h GLY 111 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1qw4 h GLY 111 CO 0.68 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 176.08 1qw4 n SER 112 N -3.33 3.12 -4.70 0.19 3.41 -1.26 -4.87 113.62 106.18 1qw4 n SER 112 Ca -0.02 -2.23 -0.40 0.00 -0.26 0.00 0.00 58.87 55.96 1qw4 n SER 112 Cb 0.17 -0.43 -0.04 0.00 -0.26 0.00 0.00 64.21 63.64 1qw4 n SER 112 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1qw4 s ILE 113 N -1.66 4.98 -0.00 -1.33 -1.09 -0.94 -4.98 121.20 116.18 1qw4 s ILE 113 Ca 0.33 1.53 -0.24 0.00 -2.23 0.00 0.00 60.65 60.04 1qw4 s ILE 113 Cb 0.20 -4.08 -0.16 0.00 -1.58 0.00 0.00 42.46 36.84 1qw4 s ILE 113 CO 0.17 0.17 1.12 0.24 -1.23 0.00 0.00 174.94 175.41 1qw4 h MET 114 N 6.99 -0.42 -2.64 2.79 2.86 -1.90 -3.38 114.93 119.22 1qw4 h MET 114 Ca -0.37 0.03 -0.69 0.00 -2.06 0.00 0.00 59.70 56.61 1qw4 h MET 114 Cb 1.18 0.10 -0.36 0.00 0.06 0.00 0.00 31.60 32.57 1qw4 h MET 114 CO 0.78 -0.09 -0.00 0.09 1.06 0.00 0.00 176.91 178.75 1qw4 n ASN 115 N -5.12 4.82 -4.81 1.22 4.13 -1.26 -5.05 115.26 109.19 1qw4 n ASN 115 Ca -0.09 -3.39 -0.33 0.00 1.68 0.00 0.00 54.58 52.45 1qw4 n ASN 115 Cb 0.27 -0.95 -0.05 0.00 -1.54 0.00 0.00 39.78 37.50 1qw4 n ASN 115 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1qw4 s PRO 116 N -2.43 4.05 0.64 3.52 0.04 -1.26 -4.91 135.00 134.65 1qw4 s PRO 116 Ca 0.35 1.22 0.38 0.00 0.04 0.00 0.00 61.00 62.99 1qw4 s PRO 116 Cb 0.08 -2.14 2.15 0.00 0.04 0.00 0.00 34.50 34.63 1qw4 s PRO 116 CO 0.01 -0.20 2.29 0.87 0.04 0.00 0.00 177.00 180.02 1qw4 h LYS 117 N 1.75 0.00 0.00 4.56 1.57 -1.97 0.47 116.57 122.95 1qw4 h LYS 117 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1qw4 h LYS 117 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1qw4 h LYS 117 CO 0.60 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 180.14 1qw4 h SER 118 N 0.00 0.00 -0.03 0.86 4.64 -1.88 -2.58 113.55 114.55 1qw4 h SER 118 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1qw4 h SER 118 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1qw4 h SER 118 CO -0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1qw4 n LEU 119 N -2.72 2.24 -4.69 5.97 4.32 0.14 -4.96 117.00 117.30 1qw4 n LEU 119 Ca 0.01 -1.04 -0.33 0.00 -0.02 0.00 0.00 56.01 54.64 1qw4 n LEU 119 Cb 0.27 -0.01 -0.09 0.00 -1.62 0.00 0.00 43.42 41.97 1qw4 n LEU 119 CO 0.24 0.42 -0.32 -0.89 -1.22 0.00 0.00 177.39 175.62 1qw4 s THR 120 N -1.19 4.18 -0.38 -5.08 2.01 -0.97 -1.00 115.64 113.20 1qw4 s THR 120 Ca 0.17 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 61.60 1qw4 s THR 120 Cb 0.12 -2.86 0.13 0.00 0.01 0.00 0.00 72.50 69.90 1qw4 s THR 120 CO 0.18 0.39 0.19 -0.60 -0.69 0.00 0.00 174.62 174.09 1qw4 s ARG 121 N -1.53 0.96 0.00 4.92 6.06 -0.38 -4.86 118.95 124.12 1qw4 s ARG 121 Ca 0.19 -1.59 0.00 0.00 -2.50 0.00 0.00 55.73 51.83 1qw4 s ARG 121 Cb -0.12 -2.00 0.00 0.00 0.06 0.00 0.00 34.95 32.90 1qw4 s ARG 121 CO 0.10 -1.13 0.00 0.41 -2.50 0.00 0.00 175.30 172.18 1qw4 n GLY 122 N 4.02 -2.15 3.41 8.12 0.00 -1.26 -4.62 105.19 112.70 1qw4 n GLY 122 Ca 0.06 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.29 1qw4 n GLY 122 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1qw4 n PRO 123 N -1.17 -1.57 -4.16 1.61 -0.02 -1.26 -4.99 135.00 123.43 1qw4 n PRO 123 Ca 0.00 -0.43 -0.14 0.00 -2.02 0.00 0.00 63.50 60.92 1qw4 n PRO 123 Cb 0.00 -1.95 -0.11 0.00 -0.02 0.00 0.00 33.50 31.42 1qw4 n PRO 123 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1qw4 s ARG 124 N -3.92 0.81 0.00 -0.52 6.06 -1.26 -5.06 118.95 115.06 1qw4 s ARG 124 Ca 0.62 -1.15 0.00 0.00 -2.50 0.00 0.00 55.73 52.69 1qw4 s ARG 124 Cb -0.19 -0.45 0.00 0.00 0.06 0.00 0.00 34.95 34.37 1qw4 s ARG 124 CO 0.65 0.06 0.00 -3.47 -2.50 0.00 0.00 175.30 170.04 1qw4 n ASP 125 N 0.54 3.60 -4.37 -2.12 -0.08 -1.22 -4.41 116.55 108.48 1qw4 n ASP 125 Ca -0.16 0.00 -0.18 0.00 -1.51 0.00 0.00 54.79 52.94 1qw4 n ASP 125 Cb 0.58 0.20 -0.10 0.00 2.34 0.00 0.00 41.12 44.13 1qw4 n ASP 125 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1qw4 s LYS 126 N -1.80 1.45 1.25 -0.67 3.01 -1.07 -4.71 119.74 117.20 1qw4 s LYS 126 Ca 0.00 -1.77 -0.15 0.00 -1.01 0.00 0.00 55.97 53.04 1qw4 s LYS 126 Cb 0.00 -0.64 0.32 0.00 -1.01 0.00 0.00 37.83 36.50 1qw4 s LYS 126 CO 0.00 -0.16 0.99 -2.14 0.51 0.00 0.00 175.35 174.56 1qw4 s PRO 127 N -3.90 -1.58 -0.12 -1.68 0.02 -1.26 -4.59 135.00 121.90 1qw4 s PRO 127 Ca 0.33 0.67 -0.21 0.00 0.02 0.00 0.00 61.00 61.81 1qw4 s PRO 127 Cb 0.07 -1.49 -0.03 0.00 0.02 0.00 0.00 34.50 33.06 1qw4 s PRO 127 CO 0.12 -4.12 0.62 0.95 -0.33 0.00 0.00 177.00 174.24 1qw4 s THR 128 N -2.38 5.08 0.06 0.99 -4.23 -1.26 -5.00 115.64 108.90 1qw4 s THR 128 Ca 0.69 1.23 -0.37 0.00 -1.18 0.00 0.00 61.69 62.06 1qw4 s THR 128 Cb -0.23 -3.95 -0.19 0.00 1.34 0.00 0.00 72.50 69.47 1qw4 s THR 128 CO 0.64 0.23 1.05 -2.65 -0.54 0.00 0.00 174.62 173.35 1qw4 n PRO 129 N 4.10 0.29 -0.15 3.99 -0.02 -1.26 -4.69 135.00 137.26 1qw4 n PRO 129 Ca -0.03 0.11 0.06 0.00 -2.02 0.00 0.00 63.50 61.61 1qw4 n PRO 129 Cb 0.51 -1.56 0.36 0.00 -0.02 0.00 0.00 33.50 32.79 1qw4 n PRO 129 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1qw4 h LEU 130 N 3.03 0.64 -1.47 2.45 3.38 -1.94 0.07 115.31 121.46 1qw4 h LEU 130 Ca -0.47 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1qw4 h LEU 130 Cb 1.41 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.99 1qw4 h LEU 130 CO 0.66 0.43 0.32 1.05 0.09 0.00 0.00 178.44 180.99 1qw4 h GLU 131 N 0.73 0.67 0.00 1.13 9.09 -2.01 -1.81 114.58 122.38 1qw4 h GLU 131 Ca 0.28 -0.05 -0.04 0.00 0.05 0.00 0.00 59.36 59.60 1qw4 h GLU 131 Cb 0.18 -0.15 -0.01 0.00 -1.65 0.00 0.00 28.75 27.12 1qw4 h GLU 131 CO -0.08 0.46 -0.25 0.93 0.05 0.00 0.00 179.01 180.12 1qw4 h GLU 132 N 0.69 0.00 -0.05 1.06 5.08 -1.60 -3.37 114.58 116.39 1qw4 h GLU 132 Ca 0.18 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.58 1qw4 h GLU 132 Cb -0.05 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.14 1qw4 h GLU 132 CO -0.04 0.90 -0.33 1.25 -1.00 0.00 0.00 179.01 179.80 1qw4 h LEU 133 N -1.00 -1.00 -0.47 1.33 6.46 -0.92 -3.06 115.31 116.64 1qw4 h LEU 133 Ca -0.07 0.14 0.09 0.00 -0.12 0.00 0.00 57.88 57.92 1qw4 h LEU 133 Cb 0.97 0.41 -0.08 0.00 -0.73 0.00 0.00 40.66 41.23 1qw4 h LEU 133 CO -0.04 -0.38 -0.05 0.25 -0.62 0.00 0.00 178.44 177.60 1qw4 h LEU 134 N -0.45 -0.30 -0.46 2.25 5.85 -1.53 0.24 115.31 120.91 1qw4 h LEU 134 Ca 0.07 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.96 1qw4 h LEU 134 Cb 0.56 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 1qw4 h LEU 134 CO -0.31 -0.11 0.22 -0.65 -0.34 0.00 0.00 178.44 177.25 1qw4 h PRO 135 N 0.06 0.42 -0.41 5.25 0.11 -1.70 -0.57 132.00 135.17 1qw4 h PRO 135 Ca 0.23 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 1qw4 h PRO 135 Cb 0.35 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 1qw4 h PRO 135 CO -0.43 0.28 0.05 0.45 -0.21 0.00 0.00 178.00 178.14 1qw4 h HIS 136 N 0.43 0.73 -0.46 0.65 3.86 -1.34 -1.90 115.15 117.13 1qw4 h HIS 136 Ca 0.21 -0.11 0.04 0.00 -1.16 0.00 0.00 60.37 59.34 1qw4 h HIS 136 Cb 0.14 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.37 1qw4 h HIS 136 CO -0.11 0.72 0.24 0.00 0.86 0.00 0.00 177.93 179.63 1qw4 h ALA 137 N 0.92 0.58 -0.27 2.45 0.00 -0.58 -0.18 119.26 122.18 1qw4 h ALA 137 Ca 0.12 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1qw4 h ALA 137 Cb 0.39 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1qw4 h ALA 137 CO 0.01 -0.11 0.17 0.82 0.00 0.00 0.00 179.25 180.14 1qw4 h ILE 138 N 0.47 1.05 -0.27 0.00 1.08 -0.99 -1.33 117.51 117.51 1qw4 h ILE 138 Ca 0.20 -0.12 0.04 0.00 -0.39 0.00 0.00 64.86 64.58 1qw4 h ILE 138 Cb 0.09 0.67 -0.03 0.00 -3.07 0.00 0.00 36.82 34.48 1qw4 h ILE 138 CO -0.13 0.06 0.06 -0.08 -0.69 0.00 0.00 178.15 177.37 1qw4 h GLU 139 N 0.35 0.16 -0.31 2.37 4.57 -0.77 0.06 114.58 121.01 1qw4 h GLU 139 Ca 0.10 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1qw4 h GLU 139 Cb -0.02 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 1qw4 h GLU 139 CO -0.03 0.11 0.18 0.35 -1.18 0.00 0.00 179.01 178.43 1qw4 h PHE 140 N 0.17 0.41 -0.63 0.92 3.57 -0.81 0.30 116.94 120.86 1qw4 h PHE 140 Ca 0.13 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1qw4 h PHE 140 Cb 0.13 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1qw4 h PHE 140 CO -0.16 0.31 0.42 0.82 -2.23 0.00 0.00 178.31 177.47 1qw4 h ILE 141 N 0.39 1.11 -0.35 1.41 1.08 -0.94 0.64 117.51 120.85 1qw4 h ILE 141 Ca 0.11 -0.27 -0.16 0.00 -0.39 0.00 0.00 64.86 64.15 1qw4 h ILE 141 Cb 0.02 0.26 -0.00 0.00 -3.07 0.00 0.00 36.82 34.02 1qw4 h ILE 141 CO -0.02 0.14 -0.41 0.78 -0.69 0.00 0.00 178.15 177.96 1qw4 h ASN 142 N 0.79 0.96 0.04 1.72 2.35 -0.37 -2.07 115.58 118.99 1qw4 h ASN 142 Ca 0.25 -0.48 -0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1qw4 h ASN 142 Cb 0.01 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.11 1qw4 h ASN 142 CO -0.06 1.25 -0.02 -0.61 -1.65 0.00 0.00 177.43 176.34 1qw4 h GLN 143 N 0.69 -0.05 0.01 0.81 4.15 0.12 -0.88 115.11 119.96 1qw4 h GLN 143 Ca 0.05 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.48 1qw4 h GLN 143 Cb 1.01 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.69 1qw4 h GLN 143 CO 0.10 0.11 -0.19 -0.92 -1.93 0.00 0.00 178.83 175.99 1qw4 h TYR 144 N -0.21 -0.57 -0.01 3.99 3.20 0.27 -1.34 116.97 122.30 1qw4 h TYR 144 Ca -0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1qw4 h TYR 144 Cb 0.19 0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 1qw4 h TYR 144 CO -0.02 -0.21 0.03 1.88 -1.64 0.00 0.00 178.16 178.20 1qw4 h TYR 145 N -0.25 0.00 0.00 -3.82 0.05 -1.44 -0.45 116.97 111.05 1qw4 h TYR 145 Ca 0.00 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 1qw4 h TYR 145 Cb 0.27 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.99 1qw4 h TYR 145 CO -0.40 0.00 -0.52 0.78 -1.05 0.00 0.00 178.16 176.97 1qw4 h GLY 146 N 0.00 0.00 0.54 3.88 0.00 -0.11 -3.11 103.07 104.27 1qw4 h GLY 146 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1qw4 h GLY 146 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1qw4 n SER 147 N -3.57 0.00 -4.81 0.19 3.41 -0.18 -4.81 113.62 103.85 1qw4 n SER 147 Ca -0.00 -1.01 -0.39 0.00 -0.26 0.00 0.00 58.87 57.22 1qw4 n SER 147 Cb 0.61 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.50 1qw4 n SER 147 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1qw4 s PHE 148 N -2.00 3.80 -0.03 7.33 2.99 -1.18 -5.05 117.98 123.84 1qw4 s PHE 148 Ca 0.18 1.23 -0.20 0.00 0.00 0.00 0.00 56.93 58.15 1qw4 s PHE 148 Cb 0.08 -2.47 -0.05 0.00 0.00 0.00 0.00 43.02 40.58 1qw4 s PHE 148 CO 0.14 0.59 0.56 0.21 -0.00 0.00 0.00 175.22 176.72 1qw4 s LYS 149 N -1.09 4.29 -0.11 0.44 2.36 -1.26 -4.45 119.74 119.93 1qw4 s LYS 149 Ca 0.28 0.66 -0.07 0.00 -2.55 0.00 0.00 55.97 54.29 1qw4 s LYS 149 Cb -0.19 -3.35 0.03 0.00 -1.05 0.00 0.00 37.83 33.26 1qw4 s LYS 149 CO 0.18 0.35 0.14 -0.85 1.55 0.00 0.00 175.35 176.71 1qw4 n GLU 150 N 2.86 -2.60 -1.14 4.03 0.28 -1.26 -5.00 120.64 117.82 1qw4 n GLU 150 Ca -0.07 2.18 -0.29 0.00 -0.16 0.00 0.00 57.16 58.82 1qw4 n GLU 150 Cb 0.51 -3.34 0.18 0.00 1.43 0.00 0.00 31.44 30.22 1qw4 n GLU 150 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1qw4 s ALA 151 N -0.41 0.93 -0.40 -1.84 0.00 -1.26 -5.03 121.76 113.74 1qw4 s ALA 151 Ca -0.16 -0.32 0.09 0.00 0.00 0.00 0.00 51.96 51.57 1qw4 s ALA 151 Cb 0.01 -3.13 0.29 0.00 0.00 0.00 0.00 23.12 20.29 1qw4 s ALA 151 CO 0.46 -2.85 0.69 1.63 0.00 0.00 0.00 175.76 175.68 1qw4 n LYS 152 N -4.19 0.84 -0.14 0.00 5.02 -1.26 -5.00 118.16 113.43 1qw4 n LYS 152 Ca 0.05 -3.02 -0.07 0.00 -2.02 0.00 0.00 58.31 53.26 1qw4 n LYS 152 Cb 0.57 -1.41 -0.01 0.00 -0.02 0.00 0.00 35.03 34.16 1qw4 n LYS 152 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1qw4 h ILE 153 N 1.81 0.23 -0.25 -0.18 5.03 -1.97 0.33 117.51 122.51 1qw4 h ILE 153 Ca 0.04 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.81 1qw4 h ILE 153 Cb 0.95 0.23 -0.04 0.00 -3.03 0.00 0.00 36.82 34.94 1qw4 h ILE 153 CO 0.43 0.00 -0.22 1.05 -0.68 0.00 0.00 178.15 178.74 1qw4 h GLU 154 N -0.22 -0.08 -0.89 2.37 9.09 -1.99 0.67 114.58 123.53 1qw4 h GLU 154 Ca 0.19 0.01 0.09 0.00 0.05 0.00 0.00 59.36 59.69 1qw4 h GLU 154 Cb 0.53 0.02 -0.07 0.00 -1.65 0.00 0.00 28.75 27.58 1qw4 h GLU 154 CO -0.57 -0.06 0.54 0.93 0.05 0.00 0.00 179.01 179.91 1qw4 h GLU 155 N -0.09 0.89 0.46 1.06 5.08 -1.87 0.29 114.58 120.40 1qw4 h GLU 155 Ca 0.04 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1qw4 h GLU 155 Cb 0.19 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1qw4 h GLU 155 CO -0.28 0.59 -0.51 1.25 -1.00 0.00 0.00 179.01 179.06 1qw4 h HIS 156 N 0.92 -1.41 -0.79 4.33 2.76 0.19 0.24 115.15 121.39 1qw4 h HIS 156 Ca 0.41 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.65 1qw4 h HIS 156 Cb 0.32 0.56 -0.05 0.00 1.55 0.00 0.00 27.41 29.78 1qw4 h HIS 156 CO -0.04 -0.66 0.48 -0.07 -1.30 0.00 0.00 177.93 176.35 1qw4 h LEU 157 N -0.97 0.77 -0.77 0.26 3.38 0.57 -0.61 115.31 117.93 1qw4 h LEU 157 Ca -0.06 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1qw4 h LEU 157 Cb 0.85 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 1qw4 h LEU 157 CO -0.09 0.51 0.48 0.00 0.09 0.00 0.00 178.44 179.43 1qw4 h ALA 158 N 1.36 1.03 -0.55 1.53 0.00 -0.55 -1.23 119.26 120.85 1qw4 h ALA 158 Ca 0.33 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 1qw4 h ALA 158 Cb 0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1qw4 h ALA 158 CO -0.15 0.25 -0.10 -0.09 0.00 0.00 0.00 179.25 179.16 1qw4 h ARG 159 N 0.92 1.04 -0.40 0.00 9.65 0.51 -1.26 114.38 124.85 1qw4 h ARG 159 Ca 0.32 -0.38 0.01 0.00 -1.10 0.00 0.00 59.98 58.83 1qw4 h ARG 159 Cb 0.08 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 1qw4 h ARG 159 CO -0.14 1.08 0.25 -0.07 2.80 0.00 0.00 179.97 183.89 1qw4 h LEU 160 N 0.93 0.42 -0.42 3.80 3.38 -0.56 -1.02 115.31 121.84 1qw4 h LEU 160 Ca 0.14 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1qw4 h LEU 160 Cb 0.67 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1qw4 h LEU 160 CO 0.05 0.30 0.19 -0.08 0.09 0.00 0.00 178.44 178.99 1qw4 h GLU 161 N 0.51 0.62 -0.76 1.13 4.81 -1.08 -2.44 114.58 117.36 1qw4 h GLU 161 Ca 0.15 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1qw4 h GLU 161 Cb -0.03 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 1qw4 h GLU 161 CO -0.05 0.55 0.40 0.00 -0.73 0.00 0.00 179.01 179.18 1qw4 h ALA 162 N 1.03 0.98 -0.39 2.92 0.00 -0.95 -1.64 119.26 121.21 1qw4 h ALA 162 Ca 0.14 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1qw4 h ALA 162 Cb 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1qw4 h ALA 162 CO -0.02 0.51 -0.05 0.28 0.00 0.00 0.00 179.25 179.97 1qw4 h VAL 163 N 1.06 1.27 0.26 0.00 2.07 -1.14 -1.68 116.25 118.09 1qw4 h VAL 163 Ca 0.27 -1.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1qw4 h VAL 163 Cb 0.07 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1qw4 h VAL 163 CO -0.04 0.37 -0.21 0.74 0.02 0.00 0.00 177.57 178.45 1qw4 h THR 164 N 0.55 0.55 -0.58 2.57 2.02 -1.22 0.32 112.91 117.12 1qw4 h THR 164 Ca 0.10 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.39 1qw4 h THR 164 Cb 0.55 0.55 -0.08 0.00 -1.74 0.00 0.00 68.15 67.44 1qw4 h THR 164 CO 0.03 0.00 0.13 0.11 0.37 0.00 0.00 175.52 176.16 1qw4 h LYS 165 N -0.48 0.25 -0.68 6.66 1.79 -1.28 0.11 116.57 122.94 1qw4 h LYS 165 Ca -0.01 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1qw4 h LYS 165 Cb 0.42 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.98 1qw4 h LYS 165 CO -0.02 0.17 0.43 1.49 -1.08 0.00 0.00 179.45 180.44 1qw4 h GLU 166 N 0.26 0.91 -0.34 3.15 4.81 -0.74 0.22 114.58 122.85 1qw4 h GLU 166 Ca 0.30 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 1qw4 h GLU 166 Cb 0.44 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1qw4 h GLU 166 CO -0.38 0.63 0.03 0.82 -0.73 0.00 0.00 179.01 179.37 1qw4 h ILE 167 N 0.93 1.25 -0.34 2.32 2.04 0.12 0.70 117.51 124.54 1qw4 h ILE 167 Ca 0.25 -0.90 0.03 0.00 1.00 0.00 0.00 64.86 65.25 1qw4 h ILE 167 Cb -0.07 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1qw4 h ILE 167 CO -0.05 0.30 0.13 -0.33 0.00 0.00 0.00 178.15 178.20 1qw4 h GLU 168 N 0.40 0.27 0.13 2.37 5.08 -0.38 0.17 114.58 122.62 1qw4 h GLU 168 Ca 0.10 -0.02 -0.28 0.00 -1.00 0.00 0.00 59.36 58.17 1qw4 h GLU 168 Cb 0.40 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1qw4 h GLU 168 CO 0.01 0.18 -1.27 1.79 -1.00 0.00 0.00 179.01 178.72 1qw4 h THR 169 N 0.28 1.47 0.00 1.13 1.35 -0.40 -3.40 112.91 113.33 1qw4 h THR 169 Ca 0.15 -3.03 -0.27 0.00 -0.55 0.00 0.00 66.41 62.71 1qw4 h THR 169 Cb 0.11 2.94 -0.05 0.00 -1.73 0.00 0.00 68.15 69.41 1qw4 h THR 169 CO -0.14 0.89 -2.01 0.35 -0.25 0.00 0.00 175.52 174.35 1qw4 n THR 170 N -3.53 1.01 0.00 6.82 -2.24 0.24 -5.02 114.28 111.57 1qw4 n THR 170 Ca -0.09 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 1qw4 n THR 170 Cb 1.03 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1qw4 n THR 170 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qw4 n GLY 171 N 2.39 1.08 0.00 3.38 0.00 0.59 -5.02 105.19 107.61 1qw4 n GLY 171 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1qw4 n GLY 171 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1qw4 n THR 172 N -1.82 0.00 -3.76 2.61 5.66 -1.25 -4.88 114.28 110.84 1qw4 n THR 172 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 1qw4 n THR 172 Cb 0.00 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.76 1qw4 n THR 172 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1qw4 s TYR 173 N -3.00 -0.21 -0.06 1.09 1.13 -1.26 -2.72 117.35 112.31 1qw4 s TYR 173 Ca 0.00 -0.17 0.03 0.00 -1.41 0.00 0.00 57.07 55.52 1qw4 s TYR 173 Cb 0.00 0.60 -0.02 0.00 -1.10 0.00 0.00 41.96 41.43 1qw4 s TYR 173 CO 0.00 -1.10 -0.14 -0.65 -2.51 0.00 0.00 175.55 171.15 1qw4 s GLN 174 N -3.89 2.64 0.32 -3.49 -1.52 -1.26 -5.07 119.66 107.39 1qw4 s GLN 174 Ca 0.10 -0.70 -0.18 0.00 -1.95 0.00 0.00 55.36 52.63 1qw4 s GLN 174 Cb -0.04 -2.41 -0.09 0.00 -0.22 0.00 0.00 33.01 30.24 1qw4 s GLN 174 CO 0.02 0.56 0.79 -0.51 -0.25 0.00 0.00 175.29 175.90 1qw4 s LEU 175 N -0.56 4.14 0.80 2.90 1.43 -1.26 -5.05 118.68 121.06 1qw4 s LEU 175 Ca 0.08 1.44 -0.11 0.00 -1.03 0.00 0.00 54.13 54.50 1qw4 s LEU 175 Cb -0.11 -4.03 0.07 0.00 0.03 0.00 0.00 46.19 42.14 1qw4 s LEU 175 CO 0.01 -0.16 1.09 0.42 0.23 0.00 0.00 176.35 177.94 1qw4 s THR 176 N -1.87 3.16 0.15 5.49 -4.23 -1.26 -4.84 115.64 112.24 1qw4 s THR 176 Ca 0.52 0.38 -0.16 0.00 -1.18 0.00 0.00 61.69 61.25 1qw4 s THR 176 Cb -0.12 -3.07 0.01 0.00 1.34 0.00 0.00 72.50 70.66 1qw4 s THR 176 CO 0.18 -0.49 1.78 0.25 -0.54 0.00 0.00 174.62 175.80 1qw4 h LEU 177 N -1.11 0.28 -1.72 4.79 5.85 -1.99 -1.94 115.31 119.46 1qw4 h LEU 177 Ca -0.47 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.32 1qw4 h LEU 177 Cb 1.26 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 1qw4 h LEU 177 CO 0.58 0.21 0.28 0.44 -0.34 0.00 0.00 178.44 179.60 1qw4 h ASP 178 N 0.38 0.31 0.28 1.25 5.19 -1.99 0.65 116.42 122.49 1qw4 h ASP 178 Ca 0.15 -0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.36 1qw4 h ASP 178 Cb 0.05 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 39.49 1qw4 h ASP 178 CO -0.10 0.20 -0.81 -0.33 -3.12 0.00 0.00 179.24 175.08 1qw4 h GLU 179 N 0.35 0.41 -0.17 3.56 5.08 -1.80 -1.05 114.58 120.97 1qw4 h GLU 179 Ca 0.18 -0.38 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1qw4 h GLU 179 Cb 0.26 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1qw4 h GLU 179 CO -0.04 1.03 0.02 1.25 -1.00 0.00 0.00 179.01 180.27 1qw4 h LEU 180 N 0.26 0.27 0.15 1.33 5.85 -0.38 0.32 115.31 123.10 1qw4 h LEU 180 Ca -0.05 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.42 1qw4 h LEU 180 Cb 1.42 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.34 1qw4 h LEU 180 CO 0.14 0.47 -0.29 0.40 -0.34 0.00 0.00 178.44 178.82 1qw4 h ILE 181 N 0.06 0.38 -0.76 4.05 2.04 -0.92 0.13 117.51 122.50 1qw4 h ILE 181 Ca 0.05 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.02 1qw4 h ILE 181 Cb 0.31 0.38 -0.08 0.00 -0.74 0.00 0.00 36.82 36.69 1qw4 h ILE 181 CO 0.00 0.00 0.38 0.15 0.00 0.00 0.00 178.15 178.68 1qw4 h PHE 182 N -0.52 0.67 -0.56 1.37 3.57 -1.01 -2.06 116.94 118.39 1qw4 h PHE 182 Ca 0.02 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 1qw4 h PHE 182 Cb 0.54 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1qw4 h PHE 182 CO -0.25 0.21 0.00 0.00 -2.23 0.00 0.00 178.31 176.05 1qw4 h ALA 183 N 1.47 0.94 -0.36 2.41 0.00 0.36 -1.49 119.26 122.59 1qw4 h ALA 183 Ca 0.38 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1qw4 h ALA 183 Cb 0.45 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1qw4 h ALA 183 CO -0.30 0.64 -0.27 1.79 0.00 0.00 0.00 179.25 181.10 1qw4 h THR 184 N 0.89 1.28 -0.06 0.00 1.35 -0.12 -1.39 112.91 114.85 1qw4 h THR 184 Ca 0.16 -1.40 -0.16 0.00 -0.55 0.00 0.00 66.41 64.46 1qw4 h THR 184 Cb 0.52 1.29 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1qw4 h THR 184 CO 0.03 0.46 -0.69 0.11 -0.25 0.00 0.00 175.52 175.18 1qw4 h LYS 185 N 0.64 0.27 -0.19 4.72 1.57 -1.28 -2.69 116.57 119.63 1qw4 h LYS 185 Ca 0.08 -0.21 -0.16 0.00 -1.87 0.00 0.00 60.65 58.49 1qw4 h LYS 185 Cb 0.79 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1qw4 h LYS 185 CO 0.06 0.85 -0.51 0.52 -0.57 0.00 0.00 179.45 179.81 1qw4 h MET 186 N 0.19 0.67 -0.03 3.15 2.86 -1.17 0.84 114.93 121.44 1qw4 h MET 186 Ca -0.02 -0.47 -0.02 0.00 -2.06 0.00 0.00 59.70 57.13 1qw4 h MET 186 Cb 1.23 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.96 1qw4 h MET 186 CO 0.11 1.09 -0.08 0.00 1.06 0.00 0.00 176.91 179.09 1qw4 h ALA 187 N 0.58 1.82 0.05 6.32 0.00 -1.27 0.45 119.26 127.20 1qw4 h ALA 187 Ca -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1qw4 h ALA 187 Cb 1.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1qw4 h ALA 187 CO 0.11 0.14 -0.02 2.35 0.00 0.00 0.00 179.25 181.82 1qw4 h TRP 188 N 0.04 -0.06 -0.64 0.00 7.01 -1.33 -2.92 115.95 118.05 1qw4 h TRP 188 Ca 0.01 -0.00 0.19 0.00 2.11 0.00 0.00 58.89 61.19 1qw4 h TRP 188 Cb 0.17 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.22 1qw4 h TRP 188 CO 0.00 0.57 0.50 -0.09 -2.79 0.00 0.00 178.44 176.63 1qw4 h ARG 189 N -0.82 0.00 -0.65 2.65 2.43 -0.05 0.11 114.38 118.05 1qw4 h ARG 189 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1qw4 h ARG 189 Cb 0.66 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1qw4 h ARG 189 CO 0.01 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 178.56 1qw4 n ASN 190 N -4.15 4.54 -4.48 -3.80 3.02 0.15 -4.83 115.26 105.70 1qw4 n ASN 190 Ca 0.13 -2.44 -0.43 0.00 -0.03 0.00 0.00 54.58 51.80 1qw4 n ASN 190 Cb 0.75 -0.57 -0.05 0.00 -0.61 0.00 0.00 39.78 39.30 1qw4 n ASN 190 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qw4 s ALA 191 N -1.88 3.27 0.45 5.41 0.00 0.37 -4.75 121.76 124.63 1qw4 s ALA 191 Ca 0.48 -1.50 0.17 0.00 0.00 0.00 0.00 51.96 51.11 1qw4 s ALA 191 Cb 0.31 -3.55 1.12 0.00 0.00 0.00 0.00 23.12 21.00 1qw4 s ALA 191 CO 0.23 -2.21 2.02 -1.00 0.00 0.00 0.00 175.76 174.80 1qw4 h PRO 192 N 9.16 0.00 -0.15 0.00 0.13 -1.87 -2.90 132.00 136.37 1qw4 h PRO 192 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1qw4 h PRO 192 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1qw4 h PRO 192 CO 1.03 0.16 0.00 0.54 -0.23 0.00 0.00 178.00 179.50 1qw4 n ARG 193 N -4.21 1.52 -3.70 0.86 1.74 -1.26 -1.83 116.66 109.78 1qw4 n ARG 193 Ca -0.02 -0.79 -0.36 0.00 -0.77 0.00 0.00 57.85 55.90 1qw4 n ARG 193 Cb 0.23 -1.32 -0.10 0.00 -1.02 0.00 0.00 32.46 30.25 1qw4 n ARG 193 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1qw4 n ILE 195 N 4.21 0.12 0.57 0.00 3.06 -1.26 -4.10 119.36 121.96 1qw4 n ILE 195 Ca -0.15 -0.14 0.07 0.00 -2.50 0.00 0.00 62.75 60.03 1qw4 n ILE 195 Cb 0.52 0.27 0.21 0.00 0.54 0.00 0.00 39.64 41.18 1qw4 n ILE 195 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1qw4 n GLY 196 N 1.42 1.11 0.00 4.50 0.00 -1.26 -4.36 105.19 106.61 1qw4 n GLY 196 Ca 0.03 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1qw4 n GLY 196 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qw4 n ARG 197 N 0.83 0.00 0.10 1.61 1.74 -1.26 -1.52 116.66 118.15 1qw4 n ARG 197 Ca 0.15 0.14 0.12 0.00 -0.77 0.00 0.00 57.85 57.49 1qw4 n ARG 197 Cb 0.38 -1.53 0.45 0.00 -1.02 0.00 0.00 32.46 30.75 1qw4 n ARG 197 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 1qw4 n ILE 198 N -1.07 0.70 1.29 0.55 3.06 -1.26 -2.22 119.36 120.41 1qw4 n ILE 198 Ca 0.00 0.03 0.13 0.00 -2.50 0.00 0.00 62.75 60.41 1qw4 n ILE 198 Cb 0.03 -0.90 0.36 0.00 0.54 0.00 0.00 39.64 39.68 1qw4 n ILE 198 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1qw4 n GLN 199 N -2.13 1.34 -0.40 9.51 1.13 -0.58 -4.64 117.38 121.62 1qw4 n GLN 199 Ca 0.04 -0.88 0.39 0.00 -1.94 0.00 0.00 57.00 54.61 1qw4 n GLN 199 Cb 0.30 -1.48 0.66 0.00 0.11 0.00 0.00 30.24 29.83 1qw4 n GLN 199 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 1qw4 h TRP 200 N 2.14 0.00 0.00 1.08 5.08 -1.63 0.19 115.95 122.80 1qw4 h TRP 200 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1qw4 h TRP 200 Cb 0.58 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.74 1qw4 h TRP 200 CO 0.00 0.00 -0.69 0.66 -1.28 0.00 0.00 178.44 177.13 1qw4 h SER 201 N 0.00 0.00 -2.76 0.11 4.64 -1.86 -3.41 113.55 110.26 1qw4 h SER 201 Ca 0.66 -0.02 -0.73 0.00 -0.47 0.00 0.00 61.79 61.24 1qw4 h SER 201 Cb 3.05 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 64.94 1qw4 h SER 201 CO -0.01 0.01 0.72 0.20 -0.87 0.00 0.00 176.83 176.88 1qw4 s ASN 202 N -5.50 6.76 -0.08 4.97 0.02 0.66 -4.97 114.94 116.79 1qw4 s ASN 202 Ca 0.02 -2.40 -0.04 0.00 -1.02 0.00 0.00 52.86 49.42 1qw4 s ASN 202 Cb 0.09 -2.35 0.04 0.00 0.02 0.00 0.00 41.25 39.05 1qw4 s ASN 202 CO 0.75 -0.87 0.18 -0.22 0.02 0.00 0.00 177.10 176.96 1qw4 s LEU 203 N 1.75 0.44 -0.15 0.60 2.96 -1.26 -4.66 118.68 118.36 1qw4 s LEU 203 Ca 0.31 0.38 -0.22 0.00 -0.22 0.00 0.00 54.13 54.37 1qw4 s LEU 203 Cb -0.06 0.45 -0.03 0.00 0.50 0.00 0.00 46.19 47.06 1qw4 s LEU 203 CO -0.08 -0.18 0.67 -1.58 -1.32 0.00 0.00 176.35 173.87 1qw4 s GLN 204 N 1.48 4.31 -0.23 1.98 2.00 -0.84 -4.99 119.66 123.38 1qw4 s GLN 204 Ca -0.06 0.76 -0.04 0.00 -2.00 0.00 0.00 55.36 54.01 1qw4 s GLN 204 Cb -0.11 -3.52 -0.01 0.00 0.80 0.00 0.00 33.01 30.17 1qw4 s GLN 204 CO -0.07 -0.13 -0.03 0.08 -0.50 0.00 0.00 175.29 174.64 1qw4 s VAL 205 N 1.50 3.41 -0.37 1.34 1.01 -1.26 -0.62 120.40 125.42 1qw4 s VAL 205 Ca 0.33 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.67 1qw4 s VAL 205 Cb -0.16 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1qw4 s VAL 205 CO 0.13 0.39 0.22 -0.36 0.00 0.00 0.00 175.10 175.48 1qw4 s PHE 206 N 1.48 3.23 -0.65 5.22 0.08 0.33 -4.99 117.98 122.68 1qw4 s PHE 206 Ca 0.05 -0.74 -0.26 0.00 0.12 0.00 0.00 56.93 56.10 1qw4 s PHE 206 Cb -0.15 -2.46 0.04 0.00 -0.57 0.00 0.00 43.02 39.88 1qw4 s PHE 206 CO -0.03 -0.57 1.16 0.34 -0.10 0.00 0.00 175.22 176.02 1qw4 s ASP 207 N 1.61 6.29 -0.25 1.36 -1.08 -1.26 -1.18 116.67 122.15 1qw4 s ASP 207 Ca 0.04 -0.31 0.10 0.00 -0.52 0.00 0.00 52.55 51.86 1qw4 s ASP 207 Cb -0.19 -2.52 0.46 0.00 -1.46 0.00 0.00 42.92 39.22 1qw4 s ASP 207 CO 0.08 -1.57 1.35 0.00 0.52 0.00 0.00 175.17 175.54 1qw4 n ALA 208 N 8.56 4.01 0.28 3.66 0.00 0.16 -4.71 120.51 132.47 1qw4 n ALA 208 Ca 0.04 -3.23 0.04 0.00 0.00 0.00 0.00 53.44 50.29 1qw4 n ALA 208 Cb 0.48 -0.55 0.17 0.00 0.00 0.00 0.00 19.45 19.56 1qw4 n ALA 208 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1qw4 n ARG 209 N -1.12 0.01 0.04 0.00 1.74 -0.77 -1.31 116.66 115.24 1qw4 n ARG 209 Ca 0.26 0.35 0.11 0.00 -0.77 0.00 0.00 57.85 57.81 1qw4 n ARG 209 Cb 0.87 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.84 1qw4 n ARG 209 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1qw4 n ASN 210 N -1.48 0.62 -4.48 0.55 0.23 -1.26 -4.16 115.26 105.28 1qw4 n ASN 210 Ca 0.02 -0.05 -0.41 0.00 -0.53 0.00 0.00 54.58 53.60 1qw4 n ASN 210 Cb 0.09 0.72 0.01 0.00 -2.08 0.00 0.00 39.78 38.52 1qw4 n ASN 210 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1qw4 n SER 212 N 1.11 2.30 -4.49 0.00 7.64 -1.26 -4.79 113.62 114.12 1qw4 n SER 212 Ca 0.11 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.76 1qw4 n SER 212 Cb 0.40 0.25 -0.11 0.00 -1.01 0.00 0.00 64.21 63.74 1qw4 n SER 212 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1qw4 s THR 213 N -1.41 1.77 0.12 0.44 -4.23 -1.26 -4.59 115.64 106.49 1qw4 s THR 213 Ca 0.00 -2.10 -0.15 0.00 -1.18 0.00 0.00 61.69 58.26 1qw4 s THR 213 Cb 0.00 -2.65 -0.03 0.00 1.34 0.00 0.00 72.50 71.16 1qw4 s THR 213 CO 0.00 -0.18 1.55 0.00 -0.54 0.00 0.00 174.62 175.46 1qw4 h ALA 214 N 2.10 0.52 -0.95 3.99 0.00 -1.92 -1.42 119.26 121.58 1qw4 h ALA 214 Ca -0.41 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 54.36 1qw4 h ALA 214 Cb 1.24 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.81 1qw4 h ALA 214 CO 0.71 0.32 0.60 0.37 0.00 0.00 0.00 179.25 181.25 1qw4 h GLN 215 N 0.51 0.82 -0.16 0.00 5.75 -1.97 0.41 115.11 120.47 1qw4 h GLN 215 Ca 0.11 -0.05 -0.15 0.00 -0.15 0.00 0.00 58.65 58.41 1qw4 h GLN 215 Cb 0.51 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 1qw4 h GLN 215 CO 0.02 0.54 -0.54 0.93 -2.65 0.00 0.00 178.83 177.14 1qw4 h GLU 216 N 0.84 0.45 0.28 1.69 5.08 -1.89 -1.76 114.58 119.28 1qw4 h GLU 216 Ca 0.48 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1qw4 h GLU 216 Cb 0.61 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1qw4 h GLU 216 CO -0.24 0.88 -0.13 0.52 -1.00 0.00 0.00 179.01 179.03 1qw4 h MET 217 N 0.35 -0.36 -0.85 2.33 2.86 0.36 -1.26 114.93 118.35 1qw4 h MET 217 Ca 0.01 0.02 0.19 0.00 -2.06 0.00 0.00 59.70 57.86 1qw4 h MET 217 Cb 1.06 0.08 -0.06 0.00 0.06 0.00 0.00 31.60 32.74 1qw4 h MET 217 CO 0.10 -0.16 0.57 0.35 1.06 0.00 0.00 176.91 178.83 1qw4 h PHE 218 N -0.50 0.50 -0.05 -0.22 3.57 -0.23 0.38 116.94 120.38 1qw4 h PHE 218 Ca -0.04 0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.25 1qw4 h PHE 218 Cb 0.37 -0.15 0.02 0.00 2.79 0.00 0.00 35.95 38.98 1qw4 h PHE 218 CO -0.02 0.15 -0.87 1.96 -2.23 0.00 0.00 178.31 177.30 1qw4 h GLN 219 N 0.39 0.68 -0.74 1.11 4.20 -1.04 -2.40 115.11 117.31 1qw4 h GLN 219 Ca 0.44 -0.66 -0.05 0.00 0.06 0.00 0.00 58.65 58.44 1qw4 h GLN 219 Cb 1.09 0.17 -0.03 0.00 0.30 0.00 0.00 27.48 29.01 1qw4 h GLN 219 CO -0.15 1.26 0.28 0.45 -0.67 0.00 0.00 178.83 180.00 1qw4 h HIS 220 N 0.35 1.13 -0.19 2.96 3.86 0.21 -2.20 115.15 121.27 1qw4 h HIS 220 Ca -0.09 -0.09 -0.04 0.00 -1.16 0.00 0.00 60.37 58.98 1qw4 h HIS 220 Cb 1.53 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 29.65 1qw4 h HIS 220 CO 0.11 0.87 -0.04 0.82 0.86 0.00 0.00 177.93 180.54 1qw4 h ILE 221 N 1.08 1.29 -1.00 2.45 2.04 -1.10 -1.49 117.51 120.77 1qw4 h ILE 221 Ca 0.25 -1.02 0.09 0.00 1.00 0.00 0.00 64.86 65.18 1qw4 h ILE 221 Cb 0.23 1.57 -0.07 0.00 -0.74 0.00 0.00 36.82 37.81 1qw4 h ILE 221 CO -0.02 0.31 0.64 0.00 0.00 0.00 0.00 178.15 179.08 1qw4 h ARG 223 N 1.10 0.28 0.12 0.00 1.12 -1.21 -1.26 114.38 114.54 1qw4 h ARG 223 Ca 0.46 -0.09 -0.01 0.00 -1.11 0.00 0.00 59.98 59.23 1qw4 h ARG 223 Cb 0.29 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.23 1qw4 h ARG 223 CO -0.21 0.52 -0.06 1.25 -3.11 0.00 0.00 179.97 178.37 1qw4 h HIS 224 N 0.25 -0.16 -0.87 2.20 2.76 0.26 -1.72 115.15 117.87 1qw4 h HIS 224 Ca 0.04 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.29 1qw4 h HIS 224 Cb 0.60 0.05 -0.07 0.00 1.55 0.00 0.00 27.41 29.54 1qw4 h HIS 224 CO 0.01 0.30 0.52 0.82 -1.30 0.00 0.00 177.93 178.29 1qw4 h ILE 225 N -0.72 0.96 -0.36 6.26 2.04 -0.31 0.16 117.51 125.54 1qw4 h ILE 225 Ca -0.02 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 1qw4 h ILE 225 Cb 0.53 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1qw4 h ILE 225 CO 0.03 0.16 -0.02 0.25 0.00 0.00 0.00 178.15 178.57 1qw4 h LEU 226 N 0.89 0.64 -0.22 1.44 5.85 -1.25 -0.86 115.31 121.80 1qw4 h LEU 226 Ca 0.41 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 1qw4 h LEU 226 Cb 0.32 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1qw4 h LEU 226 CO -0.23 0.81 -0.05 0.22 -0.34 0.00 0.00 178.44 178.84 1qw4 h TYR 227 N 0.45 0.47 0.08 1.25 5.03 -0.74 -2.71 116.97 120.80 1qw4 h TYR 227 Ca 0.10 -0.10 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 1qw4 h TYR 227 Cb 0.49 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 38.66 1qw4 h TYR 227 CO 0.04 0.66 -0.04 0.00 -1.32 0.00 0.00 178.16 177.50 1qw4 h ALA 228 N 0.74 -0.11 -0.23 1.82 0.00 -0.69 -3.21 119.26 117.59 1qw4 h ALA 228 Ca 0.05 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1qw4 h ALA 228 Cb 0.51 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1qw4 h ALA 228 CO 0.02 -0.51 0.05 1.15 0.00 0.00 0.00 179.25 179.96 1qw4 h THR 229 N -0.22 0.91 -6.59 0.00 2.02 -1.22 0.67 112.91 108.48 1qw4 h THR 229 Ca -0.01 -0.05 -0.52 0.00 0.77 0.00 0.00 66.41 66.60 1qw4 h THR 229 Cb 0.18 0.75 -0.14 0.00 -1.74 0.00 0.00 68.15 67.20 1qw4 h THR 229 CO 0.02 0.03 -0.83 -3.20 0.37 0.00 0.00 175.52 171.91 1qw4 n ASN 230 N -5.07 -3.05 -2.63 4.18 5.15 -1.02 -0.67 115.26 112.14 1qw4 n ASN 230 Ca -0.02 -0.95 -0.22 0.00 -0.60 0.00 0.00 54.58 52.79 1qw4 n ASN 230 Cb 0.10 -3.09 0.01 0.00 -0.53 0.00 0.00 39.78 36.26 1qw4 n ASN 230 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1qw4 n ASN 231 N -2.77 -6.03 0.00 1.20 4.05 -1.26 -2.27 115.26 108.18 1qw4 n ASN 231 Ca -0.01 -0.12 0.00 0.00 0.45 0.00 0.00 54.58 54.90 1qw4 n ASN 231 Cb 0.54 -4.96 0.00 0.00 1.23 0.00 0.00 39.78 36.59 1qw4 n ASN 231 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1qw4 n GLY 232 N -1.22 2.69 2.92 8.20 0.00 0.16 -4.92 105.19 113.02 1qw4 n GLY 232 Ca -0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 1qw4 n GLY 232 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1qw4 n ASN 233 N 0.00 4.81 -4.54 1.61 5.15 -0.96 -0.84 115.26 120.48 1qw4 n ASN 233 Ca 0.00 -3.03 -0.50 0.00 -0.60 0.00 0.00 54.58 50.45 1qw4 n ASN 233 Cb 0.00 -1.54 -0.04 0.00 -0.53 0.00 0.00 39.78 37.67 1qw4 n ASN 233 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1qw4 n ILE 234 N 3.98 0.93 -5.04 -1.44 2.08 -1.22 -4.56 119.36 114.09 1qw4 n ILE 234 Ca 0.43 -0.23 -0.28 0.00 0.56 0.00 0.00 62.75 63.22 1qw4 n ILE 234 Cb 0.38 -0.60 -0.15 0.00 -0.75 0.00 0.00 39.64 38.51 1qw4 n ILE 234 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 1qw4 s ARG 235 N -0.43 1.79 0.11 0.38 0.52 0.23 -4.97 118.95 116.57 1qw4 s ARG 235 Ca 0.74 -0.86 -0.30 0.00 -0.52 0.00 0.00 55.73 54.79 1qw4 s ARG 235 Cb -0.92 -1.77 -0.06 0.00 0.52 0.00 0.00 34.95 32.72 1qw4 s ARG 235 CO 0.54 0.48 1.00 -1.12 0.02 0.00 0.00 175.30 176.21 1qw4 s SER 236 N -0.70 7.43 0.12 0.23 0.01 -1.26 -4.55 113.70 114.98 1qw4 s SER 236 Ca 0.09 1.83 -0.18 0.00 1.31 0.00 0.00 55.95 59.00 1qw4 s SER 236 Cb -0.09 -2.59 0.04 0.00 0.21 0.00 0.00 66.02 63.60 1qw4 s SER 236 CO -0.00 -0.13 0.46 0.00 0.41 0.00 0.00 173.24 173.97 1qw4 s ALA 237 N 0.13 -1.12 -0.02 1.44 0.00 -0.88 -1.98 121.76 119.34 1qw4 s ALA 237 Ca 0.48 0.17 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 1qw4 s ALA 237 Cb -0.24 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.54 1qw4 s ALA 237 CO 0.30 -0.64 0.07 -1.50 0.00 0.00 0.00 175.76 173.99 1qw4 s ILE 238 N -3.51 0.03 -0.20 0.00 2.07 0.21 -0.35 121.20 119.45 1qw4 s ILE 238 Ca 0.01 -0.25 -0.01 0.00 -1.41 0.00 0.00 60.65 58.98 1qw4 s ILE 238 Cb 0.01 -0.18 0.01 0.00 0.13 0.00 0.00 42.46 42.42 1qw4 s ILE 238 CO -0.10 -0.14 -0.12 -0.89 -1.91 0.00 0.00 174.94 171.78 1qw4 s THR 239 N -0.41 2.70 -0.39 4.00 2.01 -0.03 -0.51 115.64 123.01 1qw4 s THR 239 Ca -0.05 -0.76 -0.13 0.00 0.31 0.00 0.00 61.69 61.07 1qw4 s THR 239 Cb -0.03 -2.20 0.02 0.00 0.01 0.00 0.00 72.50 70.29 1qw4 s THR 239 CO 0.00 0.46 0.25 -0.69 -0.69 0.00 0.00 174.62 173.95 1qw4 s VAL 240 N 1.37 4.94 0.86 3.82 1.01 -0.33 -3.11 120.40 128.97 1qw4 s VAL 240 Ca 0.05 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 1qw4 s VAL 240 Cb -0.14 -3.73 0.18 0.00 0.00 0.00 0.00 36.38 32.69 1qw4 s VAL 240 CO -0.08 -0.24 1.18 -0.36 0.00 0.00 0.00 175.10 175.60 1qw4 s PHE 241 N 1.63 1.36 0.29 5.22 0.08 -0.92 -0.67 117.98 124.96 1qw4 s PHE 241 Ca 0.04 -0.06 -0.30 0.00 0.12 0.00 0.00 56.93 56.74 1qw4 s PHE 241 Cb -0.19 -3.60 -0.13 0.00 -0.57 0.00 0.00 43.02 38.53 1qw4 s PHE 241 CO 0.08 -2.31 1.34 -2.30 -0.10 0.00 0.00 175.22 171.94 1qw4 n PRO 242 N -3.36 2.07 -0.98 0.24 -0.02 -1.25 -4.50 135.00 127.20 1qw4 n PRO 242 Ca 0.16 0.73 -0.30 0.00 -2.02 0.00 0.00 63.50 62.08 1qw4 n PRO 242 Cb 0.60 -2.35 0.16 0.00 -0.02 0.00 0.00 33.50 31.89 1qw4 n PRO 242 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1qw4 s GLN 243 N -1.12 0.97 0.34 -0.52 -2.07 -1.26 -4.65 119.66 111.35 1qw4 s GLN 243 Ca 0.62 1.05 -0.26 0.00 -1.82 0.00 0.00 55.36 54.94 1qw4 s GLN 243 Cb -0.61 -1.76 -0.09 0.00 -1.09 0.00 0.00 33.01 29.46 1qw4 s GLN 243 CO 0.56 -2.50 1.02 0.50 -1.32 0.00 0.00 175.29 173.54 1qw4 s ARG 244 N -4.78 4.44 0.00 9.60 3.52 -0.11 -4.94 118.95 126.67 1qw4 s ARG 244 Ca 0.65 1.50 0.00 0.00 -0.13 0.00 0.00 55.73 57.75 1qw4 s ARG 244 Cb -0.20 -2.79 0.00 0.00 -1.56 0.00 0.00 34.95 30.39 1qw4 s ARG 244 CO 0.58 0.11 0.00 -1.13 -0.81 0.00 0.00 175.30 174.05 1qw4 n SER 245 N 0.47 0.00 -0.66 -2.12 3.41 -1.26 -4.77 113.62 108.69 1qw4 n SER 245 Ca 0.02 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.75 1qw4 n SER 245 Cb 0.49 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.52 1qw4 n SER 245 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1qw4 n ASP 246 N -0.87 2.32 -0.06 4.04 5.75 -1.26 -4.16 116.55 122.31 1qw4 n ASP 246 Ca 0.00 -1.67 -0.01 0.00 -0.01 0.00 0.00 54.79 53.11 1qw4 n ASP 246 Cb 0.00 0.26 -0.00 0.00 -1.03 0.00 0.00 41.12 40.35 1qw4 n ASP 246 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qw4 n GLY 247 N 1.38 0.42 0.42 6.12 0.00 -1.26 -2.60 105.19 109.67 1qw4 n GLY 247 Ca 0.12 -0.10 0.06 0.00 0.00 0.00 0.00 46.02 46.10 1qw4 n GLY 247 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qw4 n LYS 248 N -1.97 1.32 -2.71 1.61 4.76 -1.26 -4.40 118.16 115.49 1qw4 n LYS 248 Ca -0.01 -1.02 -0.16 0.00 -2.87 0.00 0.00 58.31 54.24 1qw4 n LYS 248 Cb 0.15 -1.21 0.01 0.00 -1.84 0.00 0.00 35.03 32.13 1qw4 n LYS 248 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1qw4 n HIS 249 N 0.33 1.83 -2.49 2.13 8.25 -1.26 -4.56 115.22 119.45 1qw4 n HIS 249 Ca 0.07 -3.13 -0.41 0.00 -0.26 0.00 0.00 57.72 53.99 1qw4 n HIS 249 Cb 0.30 -0.32 -0.04 0.00 1.12 0.00 0.00 29.99 31.06 1qw4 n HIS 249 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1qw4 s ASP 250 N -3.15 7.24 -0.20 0.41 1.11 -1.26 -3.40 116.67 117.40 1qw4 s ASP 250 Ca 0.36 2.12 -0.17 0.00 0.18 0.00 0.00 52.55 55.03 1qw4 s ASP 250 Cb 0.41 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.76 1qw4 s ASP 250 CO -0.05 -0.24 0.47 -0.36 1.18 0.00 0.00 175.17 176.17 1qw4 s PHE 251 N -0.23 3.36 -0.09 4.23 0.40 -1.26 -1.56 117.98 122.84 1qw4 s PHE 251 Ca 0.50 0.71 -0.09 0.00 -0.60 0.00 0.00 56.93 57.44 1qw4 s PHE 251 Cb -0.30 -2.62 0.02 0.00 0.51 0.00 0.00 43.02 40.63 1qw4 s PHE 251 CO 0.35 -0.08 0.26 1.03 0.70 0.00 0.00 175.22 177.48 1qw4 s ARG 252 N 1.57 0.34 -0.35 0.44 1.81 0.51 -3.38 118.95 119.88 1qw4 s ARG 252 Ca 0.22 0.28 -0.13 0.00 -1.72 0.00 0.00 55.73 54.38 1qw4 s ARG 252 Cb -0.15 0.16 -0.01 0.00 -0.45 0.00 0.00 34.95 34.50 1qw4 s ARG 252 CO 0.09 -0.05 0.24 -0.51 -0.68 0.00 0.00 175.30 174.39 1qw4 s LEU 253 N -0.04 4.61 0.00 2.53 1.02 -1.26 -1.27 118.68 124.26 1qw4 s LEU 253 Ca -0.02 -0.55 0.14 0.00 0.02 0.00 0.00 54.13 53.72 1qw4 s LEU 253 Cb -0.02 -2.12 0.78 0.00 0.02 0.00 0.00 46.19 44.84 1qw4 s LEU 253 CO 0.01 -0.28 1.33 0.79 0.02 0.00 0.00 176.35 178.22 1qw4 n TRP 254 N 5.10 0.00 -3.07 0.29 7.02 -0.61 -4.50 117.44 121.67 1qw4 n TRP 254 Ca -0.12 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.05 1qw4 n TRP 254 Cb 0.49 -0.15 -0.04 0.00 -2.42 0.00 0.00 31.31 29.19 1qw4 n TRP 254 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1qw4 s ASN 255 N -2.30 6.56 0.03 -0.99 -0.87 -1.26 -4.94 114.94 111.17 1qw4 s ASN 255 Ca 0.17 1.04 0.12 0.00 -1.57 0.00 0.00 52.86 52.62 1qw4 s ASN 255 Cb 0.10 -2.28 -0.20 0.00 -0.02 0.00 0.00 41.25 38.84 1qw4 s ASN 255 CO 0.19 -0.29 0.88 0.77 -2.57 0.00 0.00 177.10 176.08 1qw4 h SER 256 N 1.66 0.00 -4.42 -1.22 4.64 -1.92 -3.12 113.55 109.16 1qw4 h SER 256 Ca -0.47 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.68 1qw4 h SER 256 Cb 1.18 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.04 1qw4 h SER 256 CO 0.65 0.93 -0.53 -1.10 -0.87 0.00 0.00 176.83 175.91 1qw4 s GLN 257 N -2.68 0.32 0.19 4.77 -0.21 -1.26 -1.24 119.66 119.56 1qw4 s GLN 257 Ca -0.03 -0.13 -0.13 0.00 0.02 0.00 0.00 55.36 55.09 1qw4 s GLN 257 Cb 0.09 0.14 0.21 0.00 1.00 0.00 0.00 33.01 34.44 1qw4 s GLN 257 CO 0.82 -0.07 1.67 -0.07 -2.12 0.00 0.00 175.29 175.52 1qw4 h LEU 258 N 5.07 -0.28 -8.23 2.90 4.07 -1.59 -3.39 115.31 113.86 1qw4 h LEU 258 Ca -0.28 0.13 -0.67 0.00 0.08 0.00 0.00 57.88 57.14 1qw4 h LEU 258 Cb 1.20 0.25 -0.33 0.00 1.08 0.00 0.00 40.66 42.86 1qw4 h LEU 258 CO 0.41 -0.10 -0.85 -0.63 -1.08 0.00 0.00 178.44 176.19 1qw4 s ILE 259 N -6.18 2.27 -0.06 1.22 1.01 -1.26 -4.89 121.20 113.30 1qw4 s ILE 259 Ca -0.14 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.31 1qw4 s ILE 259 Cb 0.17 -1.93 0.07 0.00 0.01 0.00 0.00 42.46 40.78 1qw4 s ILE 259 CO 0.73 0.53 0.67 -0.60 0.00 0.00 0.00 174.94 176.27 1qw4 s ARG 260 N 0.91 1.03 0.30 2.79 3.52 -1.26 -4.87 118.95 121.37 1qw4 s ARG 260 Ca -0.04 0.28 -0.18 0.00 -0.13 0.00 0.00 55.73 55.66 1qw4 s ARG 260 Cb -0.15 0.49 -0.09 0.00 -1.56 0.00 0.00 34.95 33.64 1qw4 s ARG 260 CO -0.03 -0.31 0.78 0.71 -0.81 0.00 0.00 175.30 175.63 1qw4 s TYR 261 N -1.11 3.49 0.55 5.12 2.02 -1.26 -0.07 117.35 126.09 1qw4 s TYR 261 Ca -0.10 1.38 -0.11 0.00 -0.37 0.00 0.00 57.07 57.87 1qw4 s TYR 261 Cb -0.00 -2.64 -0.05 0.00 -0.40 0.00 0.00 41.96 38.87 1qw4 s TYR 261 CO 0.09 0.16 0.94 0.00 -1.57 0.00 0.00 175.55 175.18 1qw4 s ALA 262 N -1.81 3.18 -0.07 3.71 0.00 -0.04 -4.53 121.76 122.20 1qw4 s ALA 262 Ca 0.51 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.36 1qw4 s ALA 262 Cb -0.13 -2.95 0.01 0.00 0.00 0.00 0.00 23.12 20.05 1qw4 s ALA 262 CO 0.19 -0.47 -0.15 0.20 0.00 0.00 0.00 175.76 175.53 1qw4 s GLY 263 N -3.87 0.90 -0.06 0.00 0.00 -1.21 -1.67 107.32 101.42 1qw4 s GLY 263 Ca 0.54 -0.56 0.05 0.00 0.00 0.00 0.00 44.72 44.75 1qw4 s GLY 263 CO 0.46 -0.05 -0.21 -0.19 0.00 0.00 0.00 173.10 173.11 1qw4 s TYR 264 N 0.48 2.14 -0.57 1.90 2.02 0.13 -4.32 117.35 119.12 1qw4 s TYR 264 Ca -0.13 -0.67 -0.20 0.00 -0.37 0.00 0.00 57.07 55.70 1qw4 s TYR 264 Cb -0.15 -1.42 0.08 0.00 -0.40 0.00 0.00 41.96 40.06 1qw4 s TYR 264 CO 0.04 -0.23 0.74 -1.14 -1.57 0.00 0.00 175.55 173.39 1qw4 s GLN 265 N 0.02 3.10 0.97 -0.62 0.74 -1.26 -0.17 119.66 122.44 1qw4 s GLN 265 Ca -0.06 -1.03 -0.11 0.00 0.05 0.00 0.00 55.36 54.21 1qw4 s GLN 265 Cb -0.14 -4.19 0.15 0.00 1.10 0.00 0.00 33.01 29.93 1qw4 s GLN 265 CO 0.04 -1.48 0.93 -1.33 -0.55 0.00 0.00 175.29 172.90 1qw4 n MET 266 N 6.58 -0.79 0.28 1.67 2.81 -0.91 -4.89 117.12 121.86 1qw4 n MET 266 Ca -0.07 -0.18 0.12 0.00 -1.81 0.00 0.00 57.70 55.77 1qw4 n MET 266 Cb 0.44 -2.21 0.78 0.00 -0.71 0.00 0.00 33.22 31.52 1qw4 n MET 266 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1qw4 h PRO 267 N -1.97 0.00 -0.83 0.03 0.13 -1.96 -2.75 132.00 124.66 1qw4 h PRO 267 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1qw4 h PRO 267 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1qw4 h PRO 267 CO 0.41 0.04 0.00 -0.40 -0.23 0.00 0.00 178.00 177.81 1qw4 n ASP 268 N -4.04 2.20 0.00 1.44 5.75 -1.26 -4.85 116.55 115.79 1qw4 n ASP 268 Ca -0.03 -2.23 0.00 0.00 -0.01 0.00 0.00 54.79 52.52 1qw4 n ASP 268 Cb 0.12 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 39.70 1qw4 n ASP 268 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qw4 n GLY 269 N 0.22 2.96 3.19 6.12 0.00 -1.04 -5.00 105.19 111.65 1qw4 n GLY 269 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1qw4 n GLY 269 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1qw4 n THR 270 N -1.48 0.00 -3.67 2.61 -1.04 -1.26 -4.77 114.28 104.67 1qw4 n THR 270 Ca 0.00 -0.08 -0.16 0.00 -2.04 0.00 0.00 64.05 61.76 1qw4 n THR 270 Cb 0.00 -0.83 -0.15 0.00 -1.82 0.00 0.00 70.33 67.53 1qw4 n THR 270 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1qw4 s ILE 271 N -2.14 -0.29 -0.13 12.58 1.01 -1.26 -2.14 121.20 128.83 1qw4 s ILE 271 Ca 0.58 0.34 -0.01 0.00 0.00 0.00 0.00 60.65 61.56 1qw4 s ILE 271 Cb -0.12 -0.33 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 1qw4 s ILE 271 CO 0.51 0.14 -0.09 -0.60 0.00 0.00 0.00 174.94 174.91 1qw4 s ARG 272 N 2.31 3.37 0.04 2.79 3.52 0.75 -4.94 118.95 126.79 1qw4 s ARG 272 Ca 0.03 -0.60 0.00 0.00 -0.13 0.00 0.00 55.73 55.03 1qw4 s ARG 272 Cb -0.12 -2.73 0.00 0.00 -1.56 0.00 0.00 34.95 30.54 1qw4 s ARG 272 CO -0.06 0.31 0.00 0.41 -0.81 0.00 0.00 175.30 175.15 1qw4 n GLY 273 N 3.28 0.75 3.50 8.12 0.00 -1.26 0.19 105.19 119.77 1qw4 n GLY 273 Ca -0.18 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 1qw4 n GLY 273 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qw4 s ASP 274 N -4.00 6.16 0.64 1.61 -1.08 -0.67 -4.72 116.67 114.60 1qw4 s ASP 274 Ca 0.00 -0.56 0.41 0.00 -0.52 0.00 0.00 52.55 51.88 1qw4 s ASP 274 Cb 0.00 -2.20 2.17 0.00 -1.46 0.00 0.00 42.92 41.43 1qw4 s ASP 274 CO 0.00 -0.45 2.29 0.00 0.52 0.00 0.00 175.17 177.53 1qw4 h ALA 275 N 8.61 1.06 0.00 3.66 0.00 -1.80 -2.33 119.26 128.45 1qw4 h ALA 275 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1qw4 h ALA 275 Cb 1.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1qw4 h ALA 275 CO 0.74 0.01 0.00 0.00 0.00 0.00 0.00 179.25 180.00 1qw4 h ALA 276 N 1.99 1.00 -0.59 0.00 0.00 -1.93 -3.04 119.26 116.69 1qw4 h ALA 276 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qw4 h ALA 276 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1qw4 h ALA 276 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.50 1qw4 n THR 277 N -2.99 1.30 -0.10 0.00 -2.24 -0.88 -4.70 114.28 104.67 1qw4 n THR 277 Ca 0.02 -1.10 -0.09 0.00 -2.27 0.00 0.00 64.05 60.61 1qw4 n THR 277 Cb 0.36 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.92 1qw4 n THR 277 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1qw4 h LEU 278 N 3.53 -1.16 0.90 3.22 3.38 -1.64 0.61 115.31 124.15 1qw4 h LEU 278 Ca 0.00 0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 1qw4 h LEU 278 Cb 1.08 0.53 0.01 0.00 0.09 0.00 0.00 40.66 42.36 1qw4 h LEU 278 CO 0.08 -0.34 -0.43 -0.08 0.09 0.00 0.00 178.44 177.75 1qw4 h GLU 279 N -0.30 -1.16 -0.62 1.13 4.81 -1.86 -1.75 114.58 114.82 1qw4 h GLU 279 Ca 0.15 0.08 0.13 0.00 -0.13 0.00 0.00 59.36 59.59 1qw4 h GLU 279 Cb 0.56 0.26 -0.10 0.00 0.63 0.00 0.00 28.75 30.10 1qw4 h GLU 279 CO -0.51 -0.77 0.07 0.35 -0.73 0.00 0.00 179.01 177.41 1qw4 h PHE 280 N -1.32 0.09 -0.75 0.92 3.57 -1.86 0.72 116.94 118.31 1qw4 h PHE 280 Ca -0.12 0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.52 1qw4 h PHE 280 Cb 0.92 0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.64 1qw4 h PHE 280 CO 0.00 -0.11 0.38 1.15 -2.23 0.00 0.00 178.31 177.50 1qw4 h THR 281 N 0.19 0.82 -0.27 4.41 2.02 0.29 0.18 112.91 120.54 1qw4 h THR 281 Ca 0.33 -0.21 -0.06 0.00 0.77 0.00 0.00 66.41 67.24 1qw4 h THR 281 Cb 0.53 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1qw4 h THR 281 CO -0.48 0.11 -0.09 -0.61 0.37 0.00 0.00 175.52 174.82 1qw4 h GLN 282 N 0.62 0.44 0.00 6.66 5.75 -0.00 -1.79 115.11 126.79 1qw4 h GLN 282 Ca 0.38 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.76 1qw4 h GLN 282 Cb 0.43 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.92 1qw4 h GLN 282 CO -0.29 0.55 -0.00 1.25 -2.65 0.00 0.00 178.83 177.69 1qw4 h LEU 283 N 0.42 -0.00 -0.96 -2.39 5.85 0.98 -0.70 115.31 118.51 1qw4 h LEU 283 Ca 0.08 -0.19 0.13 0.00 0.84 0.00 0.00 57.88 58.74 1qw4 h LEU 283 Cb 0.42 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.37 1qw4 h LEU 283 CO 0.02 0.19 0.59 0.00 -0.34 0.00 0.00 178.44 178.89 1qw4 h ILE 285 N 0.90 1.25 -0.31 0.00 2.04 -1.05 0.70 117.51 121.05 1qw4 h ILE 285 Ca 0.49 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1qw4 h ILE 285 Cb 0.53 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1qw4 h ILE 285 CO -0.28 0.31 0.16 0.44 0.00 0.00 0.00 178.15 178.78 1qw4 h ASP 286 N 0.52 0.37 -0.01 1.72 3.32 0.52 0.18 116.42 123.05 1qw4 h ASP 286 Ca 0.12 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1qw4 h ASP 286 Cb 0.41 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1qw4 h ASP 286 CO 0.01 0.31 0.00 0.18 -1.72 0.00 0.00 179.24 178.02 1qw4 n LEU 287 N -4.45 0.47 0.00 1.55 4.77 0.51 -4.84 117.00 115.02 1qw4 n LEU 287 Ca 0.02 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1qw4 n LEU 287 Cb 0.10 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1qw4 n LEU 287 CO 0.36 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1qw4 n GLY 288 N 0.29 0.75 3.77 -0.72 0.00 0.63 -4.85 105.19 105.07 1qw4 n GLY 288 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1qw4 n GLY 288 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1qw4 s TRP 289 N -2.83 3.02 -0.45 1.61 -0.00 0.18 -4.97 118.94 115.49 1qw4 s TRP 289 Ca 0.00 1.53 -0.20 0.00 -0.00 0.00 0.00 56.10 57.43 1qw4 s TRP 289 Cb 0.00 -3.44 0.03 0.00 -0.00 0.00 0.00 33.47 30.06 1qw4 s TRP 289 CO 0.00 -1.46 0.59 0.15 -0.00 0.00 0.00 176.95 176.23 1qw4 s LYS 290 N -2.28 3.19 -0.04 5.86 -0.14 -1.26 -4.33 119.74 120.74 1qw4 s LYS 290 Ca 0.57 -0.60 -0.30 0.00 -1.36 0.00 0.00 55.97 54.28 1qw4 s LYS 290 Cb -0.32 -3.99 -0.06 0.00 -1.68 0.00 0.00 37.83 31.78 1qw4 s LYS 290 CO 0.40 -1.04 1.62 -1.25 -0.76 0.00 0.00 175.35 174.33 1qw4 s PRO 291 N 2.63 4.19 0.00 -1.68 0.04 -1.26 -4.91 135.00 134.01 1qw4 s PRO 291 Ca 0.18 2.17 0.26 0.00 0.04 0.00 0.00 61.00 63.66 1qw4 s PRO 291 Cb -0.16 -3.89 0.77 0.00 0.04 0.00 0.00 34.50 31.26 1qw4 s PRO 291 CO 0.16 -0.80 1.60 0.54 0.04 0.00 0.00 177.00 178.54 1qw4 n ARG 292 N 6.75 0.02 -3.81 4.56 3.00 -1.26 -4.98 116.66 120.95 1qw4 n ARG 292 Ca 0.17 -0.01 -0.28 0.00 -0.01 0.00 0.00 57.85 57.72 1qw4 n ARG 292 Cb 0.43 -1.50 0.04 0.00 0.00 0.00 0.00 32.46 31.43 1qw4 n ARG 292 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1qw4 n TYR 293 N -1.48 -2.48 -4.10 -1.55 4.01 -1.26 -5.01 117.16 105.29 1qw4 n TYR 293 Ca 0.06 0.94 -0.23 0.00 -0.16 0.00 0.00 57.90 58.52 1qw4 n TYR 293 Cb 0.34 -4.34 -0.06 0.00 -0.31 0.00 0.00 39.34 34.96 1qw4 n TYR 293 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1qw4 s GLY 294 N -3.36 1.89 0.38 2.72 0.00 -1.26 -5.01 107.32 102.69 1qw4 s GLY 294 Ca 0.62 -1.79 0.16 0.00 0.00 0.00 0.00 44.72 43.71 1qw4 s GLY 294 CO 0.80 -1.73 1.80 3.21 0.00 0.00 0.00 173.10 177.18 1qw4 h ARG 295 N 1.55 0.00 -1.63 2.90 3.08 -1.91 -3.34 114.38 115.03 1qw4 h ARG 295 Ca -0.44 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.10 1qw4 h ARG 295 Cb 1.25 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.89 1qw4 h ARG 295 CO 0.63 0.37 -0.92 1.19 -1.07 0.00 0.00 179.97 180.16 1qw4 n PHE 296 N -3.82 2.36 -3.04 3.04 3.72 -1.26 -4.17 117.46 114.28 1qw4 n PHE 296 Ca -0.01 -3.35 -0.43 0.00 -0.05 0.00 0.00 57.45 53.60 1qw4 n PHE 296 Cb 0.44 -0.31 -0.06 0.00 -0.94 0.00 0.00 39.48 38.61 1qw4 n PHE 296 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1qw4 s ASP 297 N -3.21 6.28 0.18 4.37 1.01 -1.25 -4.95 116.67 119.10 1qw4 s ASP 297 Ca 0.41 -0.61 -0.33 0.00 0.71 0.00 0.00 52.55 52.73 1qw4 s ASP 297 Cb 0.38 -2.34 -0.13 0.00 1.01 0.00 0.00 42.92 41.83 1qw4 s ASP 297 CO -0.10 -0.98 1.60 0.52 0.21 0.00 0.00 175.17 176.42 1qw4 n VAL 298 N 5.86 0.12 -1.88 -1.27 0.31 -1.26 -0.86 118.33 119.34 1qw4 n VAL 298 Ca -0.03 -0.03 -0.31 0.00 -0.01 0.00 0.00 64.34 63.96 1qw4 n VAL 298 Cb 0.47 -1.65 0.01 0.00 -0.91 0.00 0.00 33.84 31.75 1qw4 n VAL 298 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1qw4 s LEU 299 N 0.85 3.28 0.65 7.52 1.43 0.90 -4.83 118.68 128.46 1qw4 s LEU 299 Ca 0.76 1.50 -0.10 0.00 -1.03 0.00 0.00 54.13 55.26 1qw4 s LEU 299 Cb -0.63 -4.48 -0.01 0.00 0.03 0.00 0.00 46.19 41.10 1qw4 s LEU 299 CO 0.38 -0.97 1.04 -2.16 0.23 0.00 0.00 176.35 174.86 1qw4 s PRO 300 N -4.95 3.19 0.08 1.29 0.04 -1.26 -4.70 135.00 128.70 1qw4 s PRO 300 Ca 0.57 0.52 -0.27 0.00 0.04 0.00 0.00 61.00 61.86 1qw4 s PRO 300 Cb -0.12 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.28 1qw4 s PRO 300 CO 0.50 -0.78 0.86 -0.51 0.04 0.00 0.00 177.00 177.11 1qw4 s LEU 301 N -5.23 4.48 -0.38 -3.56 1.02 0.29 -4.87 118.68 110.44 1qw4 s LEU 301 Ca 0.56 1.62 0.03 0.00 0.02 0.00 0.00 54.13 56.37 1qw4 s LEU 301 Cb -0.11 -3.40 0.11 0.00 0.02 0.00 0.00 46.19 42.81 1qw4 s LEU 301 CO 0.52 -0.01 0.11 -0.69 0.02 0.00 0.00 176.35 176.29 1qw4 s VAL 302 N -0.09 2.16 -0.11 -1.59 1.01 -1.26 0.41 120.40 120.93 1qw4 s VAL 302 Ca 0.42 -2.47 -0.04 0.00 0.00 0.00 0.00 61.98 59.88 1qw4 s VAL 302 Cb -0.22 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1qw4 s VAL 302 CO 0.26 -0.66 0.06 -0.76 0.00 0.00 0.00 175.10 174.00 1qw4 s LEU 303 N 0.69 3.93 -0.23 3.92 1.43 -0.64 -1.57 118.68 126.20 1qw4 s LEU 303 Ca 0.12 0.27 0.02 0.00 -1.03 0.00 0.00 54.13 53.51 1qw4 s LEU 303 Cb -0.21 -1.93 0.05 0.00 0.03 0.00 0.00 46.19 44.13 1qw4 s LEU 303 CO -0.08 0.37 -0.10 -1.58 0.23 0.00 0.00 176.35 175.19 1qw4 s GLN 304 N -0.80 2.12 -0.04 1.70 0.74 -0.40 -0.32 119.66 122.68 1qw4 s GLN 304 Ca 0.13 -1.09 0.02 0.00 0.05 0.00 0.00 55.36 54.47 1qw4 s GLN 304 Cb -0.12 -2.67 -0.03 0.00 1.10 0.00 0.00 33.01 31.29 1qw4 s GLN 304 CO 0.03 -0.50 -0.07 0.00 -0.55 0.00 0.00 175.29 174.20 1qw4 s ALA 305 N 1.26 2.99 -1.72 1.58 0.00 -1.26 -0.37 121.76 124.25 1qw4 s ALA 305 Ca -0.05 -0.95 -0.19 0.00 0.00 0.00 0.00 51.96 50.77 1qw4 s ALA 305 Cb -0.18 -1.18 0.17 0.00 0.00 0.00 0.00 23.12 21.92 1qw4 s ALA 305 CO -0.07 0.59 0.77 -3.47 0.00 0.00 0.00 175.76 173.58 1qw4 n ASP 306 N 1.94 -3.12 0.00 0.00 2.03 -1.25 0.20 116.55 116.34 1qw4 n ASP 306 Ca -0.17 -1.04 0.00 0.00 0.52 0.00 0.00 54.79 54.10 1qw4 n ASP 306 Cb 0.53 -2.63 0.00 0.00 -0.72 0.00 0.00 41.12 38.29 1qw4 n ASP 306 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qw4 n GLY 307 N -1.37 1.43 3.78 0.27 0.00 -0.60 -4.57 105.19 104.14 1qw4 n GLY 307 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1qw4 n GLY 307 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qw4 s GLN 308 N -0.11 2.98 0.88 1.61 -1.52 0.13 -4.84 119.66 118.79 1qw4 s GLN 308 Ca 0.00 1.30 -0.13 0.00 -1.95 0.00 0.00 55.36 54.58 1qw4 s GLN 308 Cb 0.00 -1.98 0.06 0.00 -0.22 0.00 0.00 33.01 30.87 1qw4 s GLN 308 CO 0.00 -1.10 0.75 -0.25 -0.25 0.00 0.00 175.29 174.44 1qw4 n ASP 309 N -2.34 -0.80 -4.76 5.90 8.00 -1.26 -4.01 116.55 117.28 1qw4 n ASP 309 Ca 0.10 0.44 -0.40 0.00 0.71 0.00 0.00 54.79 55.63 1qw4 n ASP 309 Cb 0.52 -1.33 -0.04 0.00 -0.02 0.00 0.00 41.12 40.25 1qw4 n ASP 309 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1qw4 s PRO 310 N -3.84 4.64 -0.07 -0.24 0.04 -1.26 -4.56 135.00 129.70 1qw4 s PRO 310 Ca 0.64 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.50 1qw4 s PRO 310 Cb -0.25 -3.18 -0.02 0.00 0.04 0.00 0.00 34.50 31.09 1qw4 s PRO 310 CO 0.61 0.21 -0.16 -1.21 0.04 0.00 0.00 177.00 176.49 1qw4 s GLU 311 N -1.46 2.77 -0.11 4.56 2.02 0.57 -4.90 118.70 122.14 1qw4 s GLU 311 Ca 0.45 -0.74 -0.21 0.00 0.02 0.00 0.00 54.97 54.48 1qw4 s GLU 311 Cb -0.32 -2.40 -0.04 0.00 0.10 0.00 0.00 34.13 31.47 1qw4 s GLU 311 CO 0.41 0.45 0.62 0.08 0.02 0.00 0.00 175.26 176.84 1qw4 s VAL 312 N -0.29 5.08 -0.06 2.63 1.01 -1.26 -1.62 120.40 125.89 1qw4 s VAL 312 Ca 0.02 1.24 0.03 0.00 0.00 0.00 0.00 61.98 63.27 1qw4 s VAL 312 Cb -0.13 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.31 1qw4 s VAL 312 CO 0.03 0.24 -0.15 -0.36 0.00 0.00 0.00 175.10 174.85 1qw4 s PHE 313 N 1.03 1.64 0.19 5.22 0.40 0.16 -4.95 117.98 121.67 1qw4 s PHE 313 Ca 0.32 -0.56 -0.30 0.00 -0.60 0.00 0.00 56.93 55.79 1qw4 s PHE 313 Cb -0.16 -1.15 -0.08 0.00 0.51 0.00 0.00 43.02 42.14 1qw4 s PHE 313 CO 0.14 -0.25 0.94 -2.00 0.70 0.00 0.00 175.22 174.75 1qw4 s GLU 314 N 0.39 4.78 0.02 0.44 2.56 -1.26 0.10 118.70 125.74 1qw4 s GLU 314 Ca -0.11 1.46 -0.26 0.00 0.00 0.00 0.00 54.97 56.07 1qw4 s GLU 314 Cb -0.14 -3.32 -0.05 0.00 2.00 0.00 0.00 34.13 32.62 1qw4 s GLU 314 CO 0.04 0.40 0.79 0.42 -0.56 0.00 0.00 175.26 176.35 1qw4 s ILE 315 N -0.71 4.81 -0.13 -3.70 1.01 -1.26 -4.89 121.20 116.33 1qw4 s ILE 315 Ca 0.43 1.67 -0.31 0.00 0.00 0.00 0.00 60.65 62.45 1qw4 s ILE 315 Cb -0.25 -4.14 -0.09 0.00 0.01 0.00 0.00 42.46 38.00 1qw4 s ILE 315 CO 0.31 0.31 2.07 -2.65 0.00 0.00 0.00 174.94 174.98 1qw4 n PRO 316 N 3.17 2.18 -0.33 2.79 -0.02 -1.26 -4.84 135.00 136.70 1qw4 n PRO 316 Ca -0.01 0.72 0.25 0.00 -2.02 0.00 0.00 63.50 62.45 1qw4 n PRO 316 Cb 0.50 -2.95 0.49 0.00 -0.02 0.00 0.00 33.50 31.53 1qw4 n PRO 316 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1qw4 h PRO 317 N 12.10 0.18 -0.16 0.52 0.11 -1.94 0.52 132.00 143.33 1qw4 h PRO 317 Ca -0.44 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.71 1qw4 h PRO 317 Cb 1.26 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1qw4 h PRO 317 CO 0.96 0.12 0.16 -0.44 -0.21 0.00 0.00 178.00 178.59 1qw4 h ASP 318 N 0.19 0.00 1.40 -2.05 3.32 -2.04 -1.71 116.42 115.52 1qw4 h ASP 318 Ca 0.75 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.70 1qw4 h ASP 318 Cb 1.81 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.35 1qw4 h ASP 318 CO -0.68 0.00 -0.62 -0.07 -1.72 0.00 0.00 179.24 176.15 1qw4 h LEU 319 N 0.00 0.00 -8.25 1.55 3.38 -0.31 -3.43 115.31 108.25 1qw4 h LEU 319 Ca 0.08 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.40 1qw4 h LEU 319 Cb 0.39 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.98 1qw4 h LEU 319 CO -0.00 0.45 0.42 -0.69 0.09 0.00 0.00 178.44 178.70 1qw4 s VAL 320 N -2.99 4.47 0.04 1.22 1.01 -0.64 -4.81 120.40 118.70 1qw4 s VAL 320 Ca 0.03 -0.49 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 1qw4 s VAL 320 Cb 0.08 -4.61 -0.05 0.00 0.00 0.00 0.00 36.38 31.80 1qw4 s VAL 320 CO 0.75 -1.33 0.89 -0.22 0.00 0.00 0.00 175.10 175.19 1qw4 s LEU 321 N 3.66 4.43 0.09 3.92 2.96 -1.26 -5.00 118.68 127.47 1qw4 s LEU 321 Ca 0.20 1.60 0.04 0.00 -0.22 0.00 0.00 54.13 55.75 1qw4 s LEU 321 Cb -0.19 -3.44 -0.03 0.00 0.50 0.00 0.00 46.19 43.04 1qw4 s LEU 321 CO 0.10 -0.10 -0.12 -1.61 -1.32 0.00 0.00 176.35 173.29 1qw4 s GLU 322 N 0.35 0.85 -0.17 1.98 2.02 -1.26 -1.80 118.70 120.66 1qw4 s GLU 322 Ca 0.45 -1.08 -0.01 0.00 0.02 0.00 0.00 54.97 54.35 1qw4 s GLU 322 Cb -0.21 -0.68 -0.00 0.00 0.10 0.00 0.00 34.13 33.33 1qw4 s GLU 322 CO 0.26 0.13 -0.13 0.08 0.02 0.00 0.00 175.26 175.62 1qw4 s VAL 323 N -1.95 2.78 0.02 2.63 1.01 -0.42 -4.93 120.40 119.54 1qw4 s VAL 323 Ca 0.03 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.04 1qw4 s VAL 323 Cb -0.06 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 1qw4 s VAL 323 CO 0.01 0.50 0.77 0.42 0.00 0.00 0.00 175.10 176.80 1qw4 s THR 324 N 1.02 4.80 0.13 3.92 -4.23 -1.26 -1.72 115.64 118.30 1qw4 s THR 324 Ca -0.01 1.63 -0.30 0.00 -1.18 0.00 0.00 61.69 61.82 1qw4 s THR 324 Cb -0.15 -4.12 -0.06 0.00 1.34 0.00 0.00 72.50 69.51 1qw4 s THR 324 CO -0.03 0.33 0.99 -0.04 -0.54 0.00 0.00 174.62 175.33 1qw4 s MET 325 N 0.18 4.69 -0.23 3.99 -1.94 0.25 -4.85 119.30 121.38 1qw4 s MET 325 Ca 0.39 1.51 -0.22 0.00 -1.71 0.00 0.00 55.69 55.66 1qw4 s MET 325 Cb -0.20 -3.35 0.06 0.00 2.01 0.00 0.00 34.83 33.35 1qw4 s MET 325 CO 0.22 0.20 0.63 -1.83 -0.01 0.00 0.00 175.02 174.24 1qw4 s GLU 326 N -0.16 0.75 -0.09 2.03 -1.05 -1.26 -4.25 118.70 114.67 1qw4 s GLU 326 Ca 0.47 0.84 -0.13 0.00 -0.15 0.00 0.00 54.97 56.01 1qw4 s GLU 326 Cb -0.25 0.37 -0.05 0.00 -0.44 0.00 0.00 34.13 33.76 1qw4 s GLU 326 CO 0.31 -0.10 0.30 -1.58 0.95 0.00 0.00 175.26 175.14 1qw4 s HIS 327 N 0.25 3.59 -1.75 4.83 5.65 -1.26 -4.27 115.29 122.34 1qw4 s HIS 327 Ca -0.01 0.73 0.00 0.00 0.25 0.00 0.00 55.06 56.03 1qw4 s HIS 327 Cb -0.04 -2.23 0.00 0.00 -1.18 0.00 0.00 32.58 29.13 1qw4 s HIS 327 CO 0.01 0.51 0.40 -0.35 -0.65 0.00 0.00 174.74 174.67 1qw4 n PRO 328 N 2.54 0.46 0.00 2.88 -0.04 -1.26 -3.76 135.00 135.83 1qw4 n PRO 328 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1qw4 n PRO 328 Cb 0.53 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.93 1qw4 n PRO 328 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1qw4 n LYS 329 N -0.31 0.00 -2.89 0.54 4.76 -1.26 -5.04 118.16 113.96 1qw4 n LYS 329 Ca 0.00 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.01 1qw4 n LYS 329 Cb 0.03 -0.01 -0.05 0.00 -1.84 0.00 0.00 35.03 33.16 1qw4 n LYS 329 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1qw4 s TYR 330 N -1.97 2.90 -0.93 2.13 1.51 -1.25 -4.88 117.35 114.86 1qw4 s TYR 330 Ca 0.00 0.10 0.24 0.00 -1.01 0.00 0.00 57.07 56.40 1qw4 s TYR 330 Cb 0.00 -3.89 0.99 0.00 -0.11 0.00 0.00 41.96 38.95 1qw4 s TYR 330 CO 0.00 -1.16 1.76 0.39 -1.11 0.00 0.00 175.55 175.43 1qw4 n GLU 331 N 7.09 0.05 0.06 -0.62 -0.58 -1.26 -2.42 120.64 122.95 1qw4 n GLU 331 Ca 0.02 0.13 0.13 0.00 -0.42 0.00 0.00 57.16 57.03 1qw4 n GLU 331 Cb 0.48 -1.57 0.48 0.00 -0.57 0.00 0.00 31.44 30.26 1qw4 n GLU 331 CO 0.00 0.00 0.00 -2.67 -0.48 0.00 0.00 177.13 173.98 1qw4 n TRP 332 N -1.65 0.55 -0.28 -0.32 4.27 -1.26 -3.70 117.44 115.04 1qw4 n TRP 332 Ca 0.05 0.16 -0.02 0.00 -3.89 0.00 0.00 57.50 53.80 1qw4 n TRP 332 Cb 0.30 -0.75 0.10 0.00 -1.36 0.00 0.00 31.31 29.59 1qw4 n TRP 332 CO 0.00 0.00 0.00 0.35 -2.29 0.00 0.00 177.69 175.75 1qw4 h PHE 333 N 0.00 0.92 -0.64 -2.67 3.57 -1.85 -0.79 116.94 115.48 1qw4 h PHE 333 Ca 0.00 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.57 1qw4 h PHE 333 Cb 0.64 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1qw4 h PHE 333 CO 0.00 0.52 0.43 1.96 -2.23 0.00 0.00 178.31 178.99 1qw4 h GLN 334 N 0.95 0.71 0.00 1.11 4.20 -1.74 -1.49 115.11 118.86 1qw4 h GLN 334 Ca 0.32 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.98 1qw4 h GLN 334 Cb 0.03 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1qw4 h GLN 334 CO -0.12 0.47 0.00 0.39 -0.67 0.00 0.00 178.83 178.90 1qw4 n GLU 335 N -4.47 0.01 0.16 1.46 1.02 -0.30 -0.79 120.64 117.73 1qw4 n GLU 335 Ca 0.08 0.31 0.07 0.00 -0.02 0.00 0.00 57.16 57.59 1qw4 n GLU 335 Cb 0.16 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.14 1qw4 n GLU 335 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1qw4 h LEU 336 N 0.00 0.00 -1.92 -4.62 3.38 -1.33 -3.48 115.31 107.34 1qw4 h LEU 336 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 1qw4 h LEU 336 Cb 0.01 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.88 1qw4 h LEU 336 CO 0.00 0.27 -0.53 0.61 0.09 0.00 0.00 178.44 178.88 1qw4 n GLY 337 N 1.19 -0.17 3.64 0.83 0.00 0.03 -5.03 105.19 105.68 1qw4 n GLY 337 Ca 0.01 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 1qw4 n GLY 337 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qw4 s LEU 338 N -4.89 3.34 0.14 0.99 1.43 -1.26 -5.04 118.68 113.39 1qw4 s LEU 338 Ca 0.06 -0.14 -0.25 0.00 -1.03 0.00 0.00 54.13 52.77 1qw4 s LEU 338 Cb -0.01 -1.98 0.07 0.00 0.03 0.00 0.00 46.19 44.30 1qw4 s LEU 338 CO 0.50 0.24 0.78 -1.59 0.23 0.00 0.00 176.35 176.51 1qw4 s LYS 339 N -1.79 1.24 0.05 1.70 -2.85 -1.26 0.84 119.74 117.67 1qw4 s LYS 339 Ca 0.21 -0.57 -0.15 0.00 -1.00 0.00 0.00 55.97 54.45 1qw4 s LYS 339 Cb -0.11 0.49 0.03 0.00 -2.06 0.00 0.00 37.83 36.18 1qw4 s LYS 339 CO 0.12 -0.55 0.34 -0.46 0.10 0.00 0.00 175.35 174.90 1qw4 s TRP 340 N -3.51 -0.16 0.51 1.78 -0.11 -0.70 -4.95 118.94 111.81 1qw4 s TRP 340 Ca 0.07 0.03 -0.20 0.00 1.22 0.00 0.00 56.10 57.22 1qw4 s TRP 340 Cb -0.02 0.14 -0.07 0.00 -1.50 0.00 0.00 33.47 32.02 1qw4 s TRP 340 CO -0.04 -0.54 1.09 1.52 -4.62 0.00 0.00 176.95 174.35 1qw4 s TYR 341 N -2.67 2.83 -0.48 5.86 1.13 -1.26 -1.30 117.35 121.46 1qw4 s TYR 341 Ca -0.04 1.56 0.24 0.00 -1.41 0.00 0.00 57.07 57.42 1qw4 s TYR 341 Cb -0.00 -3.19 0.34 0.00 -1.10 0.00 0.00 41.96 38.01 1qw4 s TYR 341 CO -0.04 -1.23 1.44 0.00 -2.51 0.00 0.00 175.55 173.21 1qw4 h ALA 342 N 1.41 0.78 -2.86 9.51 0.00 -1.71 -3.45 119.26 122.95 1qw4 h ALA 342 Ca -0.50 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 53.70 1qw4 h ALA 342 Cb 1.24 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.77 1qw4 h ALA 342 CO 0.58 0.00 -0.52 -1.17 0.00 0.00 0.00 179.25 178.14 1qw4 s LEU 343 N -5.27 4.76 -0.41 0.00 2.96 -1.26 -4.62 118.68 114.84 1qw4 s LEU 343 Ca 0.06 -1.14 -0.19 0.00 -0.22 0.00 0.00 54.13 52.63 1qw4 s LEU 343 Cb 0.09 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.81 1qw4 s LEU 343 CO 0.70 -0.41 0.57 -2.16 -1.32 0.00 0.00 176.35 173.72 1qw4 s PRO 344 N 1.50 3.32 -0.15 0.98 0.04 -1.26 -4.63 135.00 134.79 1qw4 s PRO 344 Ca 0.01 -0.40 -0.02 0.00 0.04 0.00 0.00 61.00 60.63 1qw4 s PRO 344 Cb -0.20 -3.92 0.05 0.00 0.04 0.00 0.00 34.50 30.47 1qw4 s PRO 344 CO 0.05 -0.89 0.01 0.00 0.04 0.00 0.00 177.00 176.21 1qw4 s ALA 345 N 2.57 1.00 -0.04 8.56 0.00 -1.26 -3.20 121.76 129.38 1qw4 s ALA 345 Ca 0.19 -0.55 -0.30 0.00 0.00 0.00 0.00 51.96 51.30 1qw4 s ALA 345 Cb -0.15 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 1qw4 s ALA 345 CO 0.16 -0.89 1.30 0.08 0.00 0.00 0.00 175.76 176.42 1qw4 s VAL 346 N 1.85 4.00 -0.10 0.00 1.01 -0.66 -1.49 120.40 125.01 1qw4 s VAL 346 Ca 0.01 1.35 0.15 0.00 0.00 0.00 0.00 61.98 63.49 1qw4 s VAL 346 Cb -0.15 -3.87 -0.22 0.00 0.00 0.00 0.00 36.38 32.14 1qw4 s VAL 346 CO -0.07 -0.01 0.18 0.00 0.00 0.00 0.00 175.10 175.19 1qw4 n ALA 347 N 5.42 2.01 -1.04 5.51 0.00 -0.37 -2.39 120.51 129.65 1qw4 n ALA 347 Ca 0.12 -0.78 0.02 0.00 0.00 0.00 0.00 53.44 52.80 1qw4 n ALA 347 Cb 0.45 -0.28 0.30 0.00 0.00 0.00 0.00 19.45 19.93 1qw4 n ALA 347 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1qw4 n ASN 348 N -2.38 4.51 -4.96 0.00 2.04 -1.18 -4.49 115.26 108.80 1qw4 n ASN 348 Ca -0.17 -3.15 -0.23 0.00 -0.44 0.00 0.00 54.58 50.60 1qw4 n ASN 348 Cb 0.78 -0.66 0.00 0.00 -2.53 0.00 0.00 39.78 37.38 1qw4 n ASN 348 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 1qw4 s MET 349 N -2.92 3.19 -0.09 -3.83 -1.94 -1.26 -4.21 119.30 108.24 1qw4 s MET 349 Ca 0.50 -0.53 0.02 0.00 -1.71 0.00 0.00 55.69 53.97 1qw4 s MET 349 Cb 0.40 -2.63 -0.02 0.00 2.01 0.00 0.00 34.83 34.59 1qw4 s MET 349 CO 0.11 -0.09 -0.16 -1.17 -0.01 0.00 0.00 175.02 173.70 1qw4 s LEU 350 N -4.42 2.58 -0.08 -0.03 0.20 0.28 -4.26 118.68 112.95 1qw4 s LEU 350 Ca 0.45 -0.33 -0.15 0.00 0.69 0.00 0.00 54.13 54.79 1qw4 s LEU 350 Cb -0.10 -1.54 -0.05 0.00 -0.43 0.00 0.00 46.19 44.07 1qw4 s LEU 350 CO 0.36 0.24 0.39 -0.22 -0.29 0.00 0.00 176.35 176.83 1qw4 s LEU 351 N -0.09 4.36 -0.08 -0.68 2.96 -0.63 0.17 118.68 124.68 1qw4 s LEU 351 Ca -0.03 0.79 0.04 0.00 -0.22 0.00 0.00 54.13 54.72 1qw4 s LEU 351 Cb -0.14 -2.55 -0.00 0.00 0.50 0.00 0.00 46.19 44.00 1qw4 s LEU 351 CO 0.04 0.18 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.32 1qw4 s GLU 352 N -0.19 2.70 -0.28 1.98 -6.30 -0.20 0.18 118.70 116.60 1qw4 s GLU 352 Ca 0.22 -0.82 -0.18 0.00 -2.50 0.00 0.00 54.97 51.69 1qw4 s GLU 352 Cb -0.15 -2.13 0.08 0.00 0.00 0.00 0.00 34.13 31.93 1qw4 s GLU 352 CO 0.10 0.22 0.71 0.54 0.02 0.00 0.00 175.26 176.85 1qw4 s VAL 353 N 0.22 0.00 -1.56 3.70 0.11 0.32 -2.23 120.40 120.95 1qw4 s VAL 353 Ca -0.13 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 58.73 1qw4 s VAL 353 Cb -0.16 -1.00 0.18 0.00 -1.53 0.00 0.00 36.38 33.86 1qw4 s VAL 353 CO 0.07 0.00 0.56 0.61 -3.33 0.00 0.00 175.10 173.01 1qw4 n GLY 354 N 3.96 -0.43 0.69 6.54 0.00 -1.26 0.55 105.19 115.23 1qw4 n GLY 354 Ca -0.19 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1qw4 n GLY 354 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qw4 n GLY 355 N -1.08 2.70 3.88 -0.02 0.00 -1.26 -2.94 105.19 106.47 1qw4 n GLY 355 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1qw4 n GLY 355 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qw4 s LEU 356 N 0.00 4.22 -0.08 0.99 1.43 0.19 -4.95 118.68 120.48 1qw4 s LEU 356 Ca 0.00 0.78 0.02 0.00 -1.03 0.00 0.00 54.13 53.90 1qw4 s LEU 356 Cb 0.00 -3.49 0.01 0.00 0.03 0.00 0.00 46.19 42.75 1qw4 s LEU 356 CO 0.00 -0.01 -0.13 -1.61 0.23 0.00 0.00 176.35 174.84 1qw4 s GLU 357 N -2.69 1.83 -0.49 1.70 2.02 -1.26 -0.52 118.70 119.29 1qw4 s GLU 357 Ca 0.44 -0.44 -0.03 0.00 0.02 0.00 0.00 54.97 54.96 1qw4 s GLU 357 Cb -0.12 -1.54 0.13 0.00 0.10 0.00 0.00 34.13 32.70 1qw4 s GLU 357 CO 0.22 -0.01 0.29 -0.06 0.02 0.00 0.00 175.26 175.73 1qw4 s PHE 358 N 0.80 3.51 -1.84 1.61 0.40 0.13 -0.94 117.98 121.65 1qw4 s PHE 358 Ca -0.12 -2.53 0.14 0.00 -0.60 0.00 0.00 56.93 53.82 1qw4 s PHE 358 Cb -0.15 -3.22 0.80 0.00 0.51 0.00 0.00 43.02 40.96 1qw4 s PHE 358 CO 0.02 -0.92 1.28 -0.35 0.70 0.00 0.00 175.22 175.95 1qw4 n PRO 359 N 4.17 0.37 -3.55 0.24 -0.04 -1.26 -1.60 135.00 133.33 1qw4 n PRO 359 Ca 0.01 0.04 -0.24 0.00 -0.04 0.00 0.00 63.50 63.28 1qw4 n PRO 359 Cb 0.40 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.21 1qw4 n PRO 359 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qw4 s ALA 360 N -2.16 0.19 -0.49 0.55 0.00 -1.22 -4.61 121.76 114.03 1qw4 s ALA 360 Ca 0.19 -0.27 0.06 0.00 0.00 0.00 0.00 51.96 51.94 1qw4 s ALA 360 Cb 0.09 -1.23 0.24 0.00 0.00 0.00 0.00 23.12 22.23 1qw4 s ALA 360 CO 0.17 -1.30 0.88 0.00 0.00 0.00 0.00 175.76 175.51 1qw4 s PRO 362 N 0.63 4.11 0.10 0.00 0.04 -1.18 -4.67 135.00 134.02 1qw4 s PRO 362 Ca 0.32 2.57 0.00 0.00 0.04 0.00 0.00 61.00 63.93 1qw4 s PRO 362 Cb 0.23 -2.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.75 1qw4 s PRO 362 CO -0.24 -0.54 -0.02 -0.59 0.04 0.00 0.00 177.00 175.66 1qw4 s PHE 363 N -1.06 0.77 0.09 0.56 -0.12 -1.01 -0.85 117.98 116.37 1qw4 s PHE 363 Ca 0.53 -1.06 -0.15 0.00 -0.05 0.00 0.00 56.93 56.20 1qw4 s PHE 363 Cb -0.46 -0.48 0.03 0.00 -0.63 0.00 0.00 43.02 41.47 1qw4 s PHE 363 CO 0.62 -0.33 0.35 0.54 -0.05 0.00 0.00 175.22 176.35 1qw4 s ASN 364 N -3.01 -0.17 0.00 1.98 4.22 0.53 -1.66 114.94 116.82 1qw4 s ASN 364 Ca 0.14 -0.27 0.00 0.00 -2.14 0.00 0.00 52.86 50.59 1qw4 s ASN 364 Cb 0.07 0.42 0.00 0.00 1.28 0.00 0.00 41.25 43.02 1qw4 s ASN 364 CO -0.04 -0.75 0.00 0.61 -2.04 0.00 0.00 177.10 174.88 1qw4 n GLY 365 N 0.11 5.47 3.38 0.45 0.00 -1.19 -2.07 105.19 111.33 1qw4 n GLY 365 Ca -0.17 -1.17 -0.21 0.00 0.00 0.00 0.00 46.02 44.47 1qw4 n GLY 365 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1qw4 s TRP 366 N 1.64 1.91 0.61 1.61 -2.14 -1.26 -4.41 118.94 116.90 1qw4 s TRP 366 Ca 0.00 -0.47 -0.18 0.00 2.66 0.00 0.00 56.10 58.11 1qw4 s TRP 366 Cb 0.00 -0.89 -0.03 0.00 -3.10 0.00 0.00 33.47 29.45 1qw4 s TRP 366 CO 0.00 0.45 1.17 0.71 -2.66 0.00 0.00 176.95 176.62 1qw4 s TYR 367 N -2.56 2.47 -0.19 1.66 2.02 -1.26 -4.94 117.35 114.56 1qw4 s TYR 367 Ca 0.23 1.54 -0.01 0.00 -0.37 0.00 0.00 57.07 58.45 1qw4 s TYR 367 Cb -0.03 -3.37 -0.00 0.00 -0.40 0.00 0.00 41.96 38.16 1qw4 s TYR 367 CO 0.09 -1.98 -0.12 1.41 -1.57 0.00 0.00 175.55 173.38 1qw4 s MET 368 N -3.52 3.24 0.14 -0.62 -2.45 -1.26 -1.81 119.30 113.02 1qw4 s MET 368 Ca 0.74 -0.71 -0.07 0.00 -1.25 0.00 0.00 55.69 54.40 1qw4 s MET 368 Cb -0.27 -2.78 0.18 0.00 1.25 0.00 0.00 34.83 33.22 1qw4 s MET 368 CO 0.34 -0.11 0.83 0.41 1.05 0.00 0.00 175.02 177.54 1qw4 n GLY 369 N 4.47 -1.01 0.32 2.11 0.00 0.17 -0.91 105.19 110.33 1qw4 n GLY 369 Ca -0.19 0.59 0.16 0.00 0.00 0.00 0.00 46.02 46.58 1qw4 n GLY 369 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1qw4 h THR 370 N 0.00 0.49 -1.01 2.61 1.35 -1.94 -0.20 112.91 114.22 1qw4 h THR 370 Ca 0.22 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 66.10 1qw4 h THR 370 Cb 0.35 0.90 -0.05 0.00 -1.73 0.00 0.00 68.15 67.61 1qw4 h THR 370 CO -0.54 0.00 0.66 -0.33 -0.25 0.00 0.00 175.52 175.06 1qw4 h GLU 371 N 0.00 1.28 0.00 4.72 5.08 -1.43 0.66 114.58 124.88 1qw4 h GLU 371 Ca 0.05 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1qw4 h GLU 371 Cb 0.31 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1qw4 h GLU 371 CO -0.00 0.85 -1.04 -0.89 -1.00 0.00 0.00 179.01 176.93 1qw4 n ILE 372 N -4.41 1.48 -0.02 3.13 5.41 -0.82 -1.19 119.36 122.94 1qw4 n ILE 372 Ca 0.13 0.06 -0.09 0.00 1.00 0.00 0.00 62.75 63.85 1qw4 n ILE 372 Cb 0.05 -2.20 -0.04 0.00 -0.71 0.00 0.00 39.64 36.74 1qw4 n ILE 372 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1qw4 h GLY 373 N -1.00 0.12 0.00 7.39 0.00 -1.11 -0.91 103.07 107.56 1qw4 h GLY 373 Ca -0.20 0.04 -0.15 0.00 0.00 0.00 0.00 47.33 47.02 1qw4 h GLY 373 CO -0.12 -0.05 -1.02 -0.62 0.00 0.00 0.00 176.54 174.72 1qw4 n VAL 374 N -5.16 1.49 0.05 4.60 0.31 0.11 -3.84 118.33 115.89 1qw4 n VAL 374 Ca -0.03 0.05 -0.03 0.00 -0.01 0.00 0.00 64.34 64.32 1qw4 n VAL 374 Cb 0.10 -2.17 -0.02 0.00 -0.91 0.00 0.00 33.84 30.84 1qw4 n VAL 374 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1qw4 h ARG 375 N -1.00 -0.20 -0.68 5.55 2.47 -1.27 -2.50 114.38 116.75 1qw4 h ARG 375 Ca -0.23 0.01 0.03 0.00 -1.26 0.00 0.00 59.98 58.54 1qw4 h ARG 375 Cb 1.02 0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 29.34 1qw4 h ARG 375 CO -0.14 -0.13 0.42 -0.44 0.56 0.00 0.00 179.97 180.24 1qw4 h ASP 376 N -0.82 0.68 0.22 7.04 3.32 -1.13 -0.63 116.42 125.10 1qw4 h ASP 376 Ca -0.02 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.68 1qw4 h ASP 376 Cb 0.16 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.58 1qw4 h ASP 376 CO 0.03 0.47 -1.70 -0.26 -1.72 0.00 0.00 179.24 176.07 1qw4 h PHE 377 N 0.82 0.75 0.00 4.55 0.04 -1.34 -2.19 116.94 119.57 1qw4 h PHE 377 Ca 0.27 -0.55 0.00 0.00 2.80 0.00 0.00 57.97 60.50 1qw4 h PHE 377 Cb 0.03 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1qw4 h PHE 377 CO -0.05 1.65 -1.25 0.00 -0.60 0.00 0.00 178.31 178.06 1qw4 n ASP 379 N -1.78 3.31 0.25 0.00 9.92 -0.25 -4.50 116.55 123.51 1qw4 n ASP 379 Ca 0.02 1.18 0.09 0.00 -0.53 0.00 0.00 54.79 55.55 1qw4 n ASP 379 Cb 0.41 -1.53 0.66 0.00 -0.64 0.00 0.00 41.12 40.02 1qw4 n ASP 379 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1qw4 h THR 380 N 2.99 0.86 -0.28 -3.53 1.03 -1.92 -1.61 112.91 110.44 1qw4 h THR 380 Ca -0.47 -0.38 0.00 0.00 -0.01 0.00 0.00 66.41 65.55 1qw4 h THR 380 Cb 1.25 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 69.55 1qw4 h THR 380 CO 0.71 0.10 0.00 0.00 -0.01 0.00 0.00 175.52 176.32 1qw4 n GLN 381 N -4.10 2.03 0.00 0.00 0.00 -1.26 -4.68 117.38 109.37 1qw4 n GLN 381 Ca -0.02 -1.56 0.00 0.00 0.00 0.00 0.00 57.00 55.42 1qw4 n GLN 381 Cb 0.19 -1.43 0.00 0.00 0.00 0.00 0.00 30.24 29.00 1qw4 n GLN 381 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1qw4 n ARG 382 N 0.78 0.45 0.23 2.61 5.12 -0.66 -4.13 116.66 121.06 1qw4 n ARG 382 Ca 0.17 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 56.20 1qw4 n ARG 382 Cb 0.43 0.00 0.50 0.00 -1.16 0.00 0.00 32.46 32.22 1qw4 n ARG 382 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1qw4 h TYR 383 N 0.00 0.00 -6.54 -1.55 -1.99 -1.52 -3.41 116.97 101.95 1qw4 h TYR 383 Ca 0.00 0.00 -0.51 0.00 2.00 0.00 0.00 58.73 60.22 1qw4 h TYR 383 Cb 0.00 0.00 0.02 0.00 2.00 0.00 0.00 36.73 38.75 1qw4 h TYR 383 CO 0.00 0.20 -0.96 -1.71 -0.00 0.00 0.00 178.16 175.69 1qw4 n ASN 384 N -3.38 -3.86 -1.29 3.88 5.15 -0.18 -4.90 115.26 110.69 1qw4 n ASN 384 Ca 0.00 -1.12 0.11 0.00 -0.60 0.00 0.00 54.58 52.97 1qw4 n ASN 384 Cb 0.41 -2.68 0.31 0.00 -0.53 0.00 0.00 39.78 37.28 1qw4 n ASN 384 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1qw4 n ILE 385 N -4.53 0.98 -0.14 -1.44 -5.35 0.33 -4.65 119.36 104.56 1qw4 n ILE 385 Ca -0.14 -0.94 -0.05 0.00 -0.27 0.00 0.00 62.75 61.35 1qw4 n ILE 385 Cb 0.60 0.44 0.14 0.00 -1.74 0.00 0.00 39.64 39.08 1qw4 n ILE 385 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1qw4 h LEU 386 N 4.03 0.82 -0.29 7.28 5.85 -1.85 -2.72 115.31 128.44 1qw4 h LEU 386 Ca 0.00 -0.19 -0.20 0.00 0.84 0.00 0.00 57.88 58.32 1qw4 h LEU 386 Cb 0.96 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1qw4 h LEU 386 CO 0.01 0.87 -0.85 -0.08 -0.34 0.00 0.00 178.44 178.05 1qw4 h GLU 387 N 0.80 0.32 -0.21 1.25 4.81 -1.98 -2.33 114.58 117.25 1qw4 h GLU 387 Ca 0.16 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1qw4 h GLU 387 Cb 0.44 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1qw4 h GLU 387 CO 0.02 1.00 0.13 1.49 -0.73 0.00 0.00 179.01 180.92 1qw4 h GLU 388 N 0.19 0.27 -0.35 1.92 4.57 -1.88 0.71 114.58 120.01 1qw4 h GLU 388 Ca -0.05 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.05 1qw4 h GLU 388 Cb 1.47 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.98 1qw4 h GLU 388 CO 0.14 0.19 -0.04 0.28 -1.18 0.00 0.00 179.01 178.41 1qw4 h VAL 389 N 0.27 1.22 -0.24 0.32 2.07 -1.52 -1.43 116.25 116.94 1qw4 h VAL 389 Ca 0.08 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.68 1qw4 h VAL 389 Cb -0.02 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1qw4 h VAL 389 CO -0.02 0.30 0.06 1.23 0.02 0.00 0.00 177.57 179.17 1qw4 h GLY 390 N 0.89 0.41 0.93 2.17 0.00 -0.81 -2.21 103.07 104.46 1qw4 h GLY 390 Ca 0.11 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.19 1qw4 h GLY 390 CO 0.02 0.24 0.05 3.21 0.00 0.00 0.00 176.54 180.05 1qw4 h ARG 391 N 0.21 0.11 0.00 4.80 3.08 -0.52 -1.03 114.38 121.02 1qw4 h ARG 391 Ca 0.08 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1qw4 h ARG 391 Cb 0.27 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1qw4 h ARG 391 CO 0.00 0.07 0.00 0.54 -1.07 0.00 0.00 179.97 179.51 1qw4 n ARG 392 N -5.05 0.14 0.00 0.04 1.74 -0.57 0.03 116.66 112.98 1qw4 n ARG 392 Ca -0.05 0.19 0.09 0.00 -0.77 0.00 0.00 57.85 57.31 1qw4 n ARG 392 Cb 0.05 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 29.96 1qw4 n ARG 392 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1qw4 n MET 393 N -1.27 1.49 -3.13 5.56 2.81 -0.45 -4.98 117.12 117.14 1qw4 n MET 393 Ca 0.04 -0.66 -0.14 0.00 -1.81 0.00 0.00 57.70 55.13 1qw4 n MET 393 Cb 0.07 -1.33 0.05 0.00 -0.71 0.00 0.00 33.22 31.30 1qw4 n MET 393 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1qw4 n GLY 394 N 1.28 -0.01 3.93 3.03 0.00 0.10 -5.03 105.19 108.49 1qw4 n GLY 394 Ca 0.06 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 1qw4 n GLY 394 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qw4 s LEU 395 N -4.96 4.18 -0.60 0.99 1.43 -0.90 -4.96 118.68 113.86 1qw4 s LEU 395 Ca 0.29 0.39 -0.10 0.00 -1.03 0.00 0.00 54.13 53.68 1qw4 s LEU 395 Cb -0.13 -3.19 -0.09 0.00 0.03 0.00 0.00 46.19 42.82 1qw4 s LEU 395 CO 0.46 -0.11 1.77 -0.62 0.23 0.00 0.00 176.35 178.08 1qw4 n GLU 396 N -1.02 1.31 0.04 1.70 1.02 -1.26 -4.67 120.64 117.76 1qw4 n GLU 396 Ca -0.05 -1.28 0.02 0.00 -0.02 0.00 0.00 57.16 55.83 1qw4 n GLU 396 Cb 0.55 -2.45 0.09 0.00 -0.02 0.00 0.00 31.44 29.61 1qw4 n GLU 396 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1qw4 n THR 397 N 4.99 1.12 0.06 2.62 -1.04 -1.26 -0.45 114.28 120.32 1qw4 n THR 397 Ca 0.35 0.56 0.06 0.00 -2.04 0.00 0.00 64.05 62.98 1qw4 n THR 397 Cb 0.18 -1.56 0.12 0.00 -1.82 0.00 0.00 70.33 67.26 1qw4 n THR 397 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1qw4 n HIS 398 N -1.49 0.32 -3.94 -1.42 8.25 -1.26 -4.79 115.22 110.89 1qw4 n HIS 398 Ca -0.00 -0.32 -0.31 0.00 -0.26 0.00 0.00 57.72 56.83 1qw4 n HIS 398 Cb 0.21 -0.02 -0.14 0.00 1.12 0.00 0.00 29.99 31.16 1qw4 n HIS 398 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1qw4 s THR 399 N -1.00 2.63 0.32 1.59 2.01 0.40 -4.97 115.64 116.61 1qw4 s THR 399 Ca 0.21 -3.20 0.08 0.00 0.31 0.00 0.00 61.69 59.09 1qw4 s THR 399 Cb 0.12 -2.83 0.31 0.00 0.01 0.00 0.00 72.50 70.11 1qw4 s THR 399 CO 0.16 -0.78 1.78 0.25 -0.69 0.00 0.00 174.62 175.34 1qw4 h LEU 400 N 6.65 0.74 0.00 4.42 5.85 -1.87 0.01 115.31 131.11 1qw4 h LEU 400 Ca -0.07 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1qw4 h LEU 400 Cb 0.91 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1qw4 h LEU 400 CO 0.67 0.26 0.00 0.00 -0.34 0.00 0.00 178.44 179.03 1qw4 n ALA 401 N -2.35 1.93 0.81 1.25 0.00 -1.26 -2.73 120.51 118.17 1qw4 n ALA 401 Ca 0.23 -0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.72 1qw4 n ALA 401 Cb 0.60 -1.26 0.52 0.00 0.00 0.00 0.00 19.45 19.31 1qw4 n ALA 401 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1qw4 n SER 402 N -1.23 0.32 -1.46 0.00 3.41 -0.01 -4.92 113.62 109.73 1qw4 n SER 402 Ca 0.09 0.53 -0.13 0.00 -0.26 0.00 0.00 58.87 59.10 1qw4 n SER 402 Cb 0.11 -0.62 -0.01 0.00 -0.26 0.00 0.00 64.21 63.43 1qw4 n SER 402 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1qw4 n LEU 403 N -1.80 -1.52 0.17 1.04 4.77 -1.10 -4.91 117.00 113.64 1qw4 n LEU 403 Ca 0.06 0.04 0.04 0.00 -0.03 0.00 0.00 56.01 56.11 1qw4 n LEU 403 Cb 0.36 -2.06 0.44 0.00 -2.33 0.00 0.00 43.42 39.82 1qw4 n LEU 403 CO 0.27 -0.22 0.90 4.11 -1.33 0.00 0.00 177.39 181.11 1qw4 h TRP 404 N 0.00 0.14 -0.50 -1.77 5.08 -1.83 -2.07 115.95 115.00 1qw4 h TRP 404 Ca -0.31 -0.01 -0.08 0.00 1.08 0.00 0.00 58.89 59.57 1qw4 h TRP 404 Cb 1.18 -0.04 -0.02 0.00 -3.00 0.00 0.00 29.16 27.28 1qw4 h TRP 404 CO 0.36 0.28 0.00 0.87 -1.28 0.00 0.00 178.44 178.67 1qw4 h LYS 405 N 0.13 0.85 -0.72 0.12 1.57 -1.91 -0.11 116.57 116.49 1qw4 h LYS 405 Ca 0.03 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.51 1qw4 h LYS 405 Cb 0.35 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1qw4 h LYS 405 CO 0.02 0.85 0.22 -0.44 -0.57 0.00 0.00 179.45 179.53 1qw4 h ASP 406 N 0.79 1.05 -0.09 0.86 5.19 -1.78 -1.94 116.42 120.50 1qw4 h ASP 406 Ca 0.15 -0.21 -0.02 0.00 -0.62 0.00 0.00 57.03 56.33 1qw4 h ASP 406 Cb 0.47 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.70 1qw4 h ASP 406 CO 0.02 0.99 -0.02 0.03 -3.12 0.00 0.00 179.24 177.14 1qw4 h ARG 407 N 1.07 0.17 0.73 3.56 3.08 -1.06 -2.91 114.38 119.01 1qw4 h ARG 407 Ca 0.23 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 1qw4 h ARG 407 Cb 0.31 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.36 1qw4 h ARG 407 CO -0.01 0.49 -0.35 0.00 -1.07 0.00 0.00 179.97 179.03 1qw4 h ALA 408 N 0.68 -0.97 -1.03 0.04 0.00 -0.99 -2.75 119.26 114.23 1qw4 h ALA 408 Ca 0.02 -0.23 0.27 0.00 0.00 0.00 0.00 54.91 54.98 1qw4 h ALA 408 Cb 0.42 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 1qw4 h ALA 408 CO 0.01 -0.96 0.70 -0.24 0.00 0.00 0.00 179.25 178.75 1qw4 h VAL 409 N -1.14 0.52 -0.24 0.00 3.04 -1.46 0.27 116.25 117.24 1qw4 h VAL 409 Ca -0.10 -0.08 -0.16 0.00 -1.01 0.00 0.00 66.70 65.35 1qw4 h VAL 409 Cb 0.77 0.27 -0.00 0.00 -2.01 0.00 0.00 31.29 30.31 1qw4 h VAL 409 CO 0.16 0.04 -0.52 0.74 -1.01 0.00 0.00 177.57 176.99 1qw4 h THR 410 N 0.24 1.30 -0.09 3.17 2.02 -1.39 -1.82 112.91 116.34 1qw4 h THR 410 Ca 0.54 -1.73 -0.14 0.00 0.77 0.00 0.00 66.41 65.85 1qw4 h THR 410 Cb 1.67 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 69.73 1qw4 h THR 410 CO -0.16 0.55 -0.56 -0.33 0.37 0.00 0.00 175.52 175.39 1qw4 h GLU 411 N 0.54 0.28 -0.47 6.66 4.39 -0.24 -2.13 114.58 123.60 1qw4 h GLU 411 Ca 0.02 -0.18 -0.10 0.00 0.34 0.00 0.00 59.36 59.44 1qw4 h GLU 411 Cb 1.08 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.73 1qw4 h GLU 411 CO 0.11 0.77 -0.11 0.82 -1.16 0.00 0.00 179.01 179.43 1qw4 h ILE 412 N 0.21 1.26 -0.05 3.13 2.04 -1.01 -0.72 117.51 122.38 1qw4 h ILE 412 Ca 0.00 -1.20 -0.08 0.00 1.00 0.00 0.00 64.86 64.58 1qw4 h ILE 412 Cb 1.05 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 1qw4 h ILE 412 CO 0.09 0.41 -0.35 0.78 0.00 0.00 0.00 178.15 179.08 1qw4 h ASN 413 N 0.77 0.10 0.37 1.72 -0.26 -1.06 -0.99 115.58 116.23 1qw4 h ASN 413 Ca 0.13 -0.03 -0.22 0.00 -0.56 0.00 0.00 56.30 55.61 1qw4 h ASN 413 Cb 0.61 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 37.85 1qw4 h ASN 413 CO 0.04 0.45 -0.92 0.58 -1.06 0.00 0.00 177.43 176.51 1qw4 h VAL 414 N 0.08 1.42 -0.09 2.81 2.07 -0.97 -2.27 116.25 119.30 1qw4 h VAL 414 Ca 0.01 -2.46 -0.01 0.00 0.82 0.00 0.00 66.70 65.06 1qw4 h VAL 414 Cb 0.66 2.41 -0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1qw4 h VAL 414 CO 0.05 0.73 0.02 0.00 0.02 0.00 0.00 177.57 178.40 1qw4 h ALA 415 N 0.79 0.11 -0.41 1.67 0.00 -0.73 -0.29 119.26 120.39 1qw4 h ALA 415 Ca -0.07 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1qw4 h ALA 415 Cb 1.55 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 1qw4 h ALA 415 CO 0.16 -0.27 0.24 0.28 0.00 0.00 0.00 179.25 179.66 1qw4 h VAL 416 N -0.06 1.04 0.15 0.00 2.07 -1.21 0.10 116.25 118.35 1qw4 h VAL 416 Ca 0.03 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1qw4 h VAL 416 Cb 0.23 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1qw4 h VAL 416 CO -0.00 0.09 -0.07 -0.07 0.02 0.00 0.00 177.57 177.53 1qw4 h LEU 417 N 0.48 -0.17 -0.41 2.57 3.38 -1.38 -2.80 115.31 116.98 1qw4 h LEU 417 Ca 0.16 -0.30 0.08 0.00 0.09 0.00 0.00 57.88 57.91 1qw4 h LEU 417 Cb 0.02 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 1qw4 h LEU 417 CO -0.08 0.23 -0.02 -0.74 0.09 0.00 0.00 178.44 177.93 1qw4 h HIS 418 N -0.61 -0.06 -0.88 1.13 2.76 -0.97 -1.44 115.15 115.07 1qw4 h HIS 418 Ca -0.02 0.03 0.04 0.00 -2.20 0.00 0.00 60.37 58.22 1qw4 h HIS 418 Cb 0.46 0.09 -0.05 0.00 1.55 0.00 0.00 27.41 29.46 1qw4 h HIS 418 CO 0.05 -0.10 0.58 0.77 -1.30 0.00 0.00 177.93 177.93 1qw4 h SER 419 N 0.09 0.93 -0.06 3.26 0.02 -0.83 0.11 113.55 117.06 1qw4 h SER 419 Ca 0.20 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.12 1qw4 h SER 419 Cb 0.30 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 1qw4 h SER 419 CO -0.36 0.63 -0.07 -0.26 -1.14 0.00 0.00 176.83 175.64 1qw4 h PHE 420 N 1.07 0.19 -0.18 3.45 -1.00 -1.15 -2.43 116.94 116.90 1qw4 h PHE 420 Ca 0.36 -0.06 0.01 0.00 2.81 0.00 0.00 57.97 61.09 1qw4 h PHE 420 Cb 0.07 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 39.58 1qw4 h PHE 420 CO -0.00 0.61 0.10 1.96 -1.61 0.00 0.00 178.31 179.37 1qw4 h GLN 421 N -0.28 0.21 -0.40 1.51 4.20 -1.04 0.22 115.11 119.52 1qw4 h GLN 421 Ca 0.01 -0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.79 1qw4 h GLN 421 Cb 0.58 -0.05 -0.08 0.00 0.30 0.00 0.00 27.48 28.23 1qw4 h GLN 421 CO 0.02 0.14 -0.16 -0.22 -0.67 0.00 0.00 178.83 177.94 1qw4 h LYS 422 N 0.21 -0.07 -0.10 1.46 1.63 -0.82 0.37 116.57 119.25 1qw4 h LYS 422 Ca 0.07 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1qw4 h LYS 422 Cb 0.00 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 1qw4 h LYS 422 CO -0.04 -0.05 0.00 1.04 -3.45 0.00 0.00 179.45 176.95 1qw4 n GLN 423 N -5.35 1.24 -3.74 1.90 6.02 -0.92 -4.91 117.38 111.62 1qw4 n GLN 423 Ca 0.02 -0.37 -0.27 0.00 -0.01 0.00 0.00 57.00 56.38 1qw4 n GLN 423 Cb 0.26 -1.11 0.06 0.00 1.02 0.00 0.00 30.24 30.46 1qw4 n GLN 423 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1qw4 n ASN 424 N -0.23 -5.71 -4.47 1.08 3.02 0.12 -4.98 115.26 104.09 1qw4 n ASN 424 Ca 0.05 -0.64 -0.37 0.00 -0.03 0.00 0.00 54.58 53.59 1qw4 n ASN 424 Cb 0.10 -4.53 -0.12 0.00 -0.61 0.00 0.00 39.78 34.61 1qw4 n ASN 424 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1qw4 s VAL 425 N -3.31 4.44 -0.06 2.41 1.01 0.60 -4.25 120.40 121.23 1qw4 s VAL 425 Ca 0.62 -0.13 -0.38 0.00 0.00 0.00 0.00 61.98 62.10 1qw4 s VAL 425 Cb -0.29 -3.08 -0.16 0.00 0.00 0.00 0.00 36.38 32.85 1qw4 s VAL 425 CO 0.77 0.33 1.56 0.41 0.00 0.00 0.00 175.10 178.17 1qw4 n THR 426 N 4.88 0.16 -3.89 3.92 -1.04 -0.02 -4.27 114.28 114.02 1qw4 n THR 426 Ca -0.16 -0.03 -0.09 0.00 -2.04 0.00 0.00 64.05 61.73 1qw4 n THR 426 Cb 0.51 -1.11 -0.06 0.00 -1.82 0.00 0.00 70.33 67.85 1qw4 n THR 426 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1qw4 s ILE 427 N 1.97 0.08 -0.01 12.58 2.07 -1.26 -4.42 121.20 132.20 1qw4 s ILE 427 Ca 0.90 -1.22 -0.01 0.00 -1.41 0.00 0.00 60.65 58.92 1qw4 s ILE 427 Cb -0.96 -1.66 0.01 0.00 0.13 0.00 0.00 42.46 39.98 1qw4 s ILE 427 CO 0.54 -0.35 0.02 -0.32 -1.91 0.00 0.00 174.94 172.92 1qw4 s MET 428 N -3.92 0.01 0.51 3.50 -2.45 -0.75 -4.99 119.30 111.21 1qw4 s MET 428 Ca 0.13 0.06 -0.14 0.00 -1.25 0.00 0.00 55.69 54.49 1qw4 s MET 428 Cb 0.03 -0.05 -0.07 0.00 1.25 0.00 0.00 34.83 36.00 1qw4 s MET 428 CO -0.03 -0.04 0.94 0.16 1.05 0.00 0.00 175.02 177.09 1qw4 s ASP 429 N 0.25 6.51 0.41 1.11 1.47 -1.26 0.46 116.67 125.61 1qw4 s ASP 429 Ca -0.02 1.42 0.09 0.00 1.18 0.00 0.00 52.55 55.22 1qw4 s ASP 429 Cb -0.03 -2.45 0.86 0.00 -0.34 0.00 0.00 42.92 40.96 1qw4 s ASP 429 CO -0.01 -0.60 1.99 1.12 0.68 0.00 0.00 175.17 178.35 1qw4 h HIS 430 N 0.72 0.31 -0.31 2.11 -0.00 -1.97 -1.47 115.15 114.53 1qw4 h HIS 430 Ca -0.46 -0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 59.86 1qw4 h HIS 430 Cb 1.19 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 28.49 1qw4 h HIS 430 CO 0.63 0.32 0.06 0.45 -0.00 0.00 0.00 177.93 179.38 1qw4 h HIS 431 N 0.30 0.53 -0.47 6.12 3.86 -1.97 -0.55 115.15 122.98 1qw4 h HIS 431 Ca 0.07 -0.07 -0.12 0.00 -1.16 0.00 0.00 60.37 59.09 1qw4 h HIS 431 Cb 0.20 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 1qw4 h HIS 431 CO 0.00 0.58 -0.17 1.15 0.86 0.00 0.00 177.93 180.36 1qw4 h THR 432 N 0.33 1.27 -0.02 2.45 2.02 -1.91 -2.28 112.91 114.77 1qw4 h THR 432 Ca 0.09 -1.30 -0.00 0.00 0.77 0.00 0.00 66.41 65.97 1qw4 h THR 432 Cb 0.33 1.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1qw4 h THR 432 CO 0.00 0.45 0.01 0.00 0.37 0.00 0.00 175.52 176.35 1qw4 h ALA 433 N 1.00 0.02 -0.88 6.16 0.00 -1.10 -1.86 119.26 122.61 1qw4 h ALA 433 Ca 0.12 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1qw4 h ALA 433 Cb 0.71 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 1qw4 h ALA 433 CO 0.05 -0.41 0.55 0.77 0.00 0.00 0.00 179.25 180.22 1qw4 h SER 434 N -0.10 0.88 -0.42 0.00 0.02 -1.04 -1.38 113.55 111.51 1qw4 h SER 434 Ca 0.01 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 1qw4 h SER 434 Cb 0.13 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1qw4 h SER 434 CO -0.00 0.57 0.04 -0.08 -1.14 0.00 0.00 176.83 176.21 1qw4 h GLU 435 N 1.02 0.72 -0.34 3.45 4.81 -1.28 -2.69 114.58 120.26 1qw4 h GLU 435 Ca 0.38 -0.21 -0.13 0.00 -0.13 0.00 0.00 59.36 59.27 1qw4 h GLU 435 Cb 0.16 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1qw4 h GLU 435 CO -0.17 0.78 -0.32 0.66 -0.73 0.00 0.00 179.01 179.23 1qw4 h SER 436 N 0.56 0.78 -0.92 1.04 4.64 -0.95 -2.82 113.55 115.89 1qw4 h SER 436 Ca 0.12 -0.32 0.01 0.00 -0.47 0.00 0.00 61.79 61.13 1qw4 h SER 436 Cb 0.43 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 62.25 1qw4 h SER 436 CO 0.01 1.04 0.61 0.15 -0.87 0.00 0.00 176.83 177.77 1qw4 h PHE 437 N 0.63 1.16 -0.77 4.77 3.57 -1.18 -0.63 116.94 124.50 1qw4 h PHE 437 Ca 0.07 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1qw4 h PHE 437 Cb 0.85 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 39.16 1qw4 h PHE 437 CO 0.04 0.73 0.41 0.52 -2.23 0.00 0.00 178.31 177.78 1qw4 h MET 438 N 1.25 1.07 -0.70 1.11 2.86 -1.30 0.32 114.93 119.54 1qw4 h MET 438 Ca 0.34 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.79 1qw4 h MET 438 Cb -0.14 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.28 1qw4 h MET 438 CO -0.07 0.79 0.17 -0.22 1.06 0.00 0.00 176.91 178.64 1qw4 h LYS 439 N 1.07 1.11 -0.04 1.72 1.63 -1.00 -2.27 116.57 118.80 1qw4 h LYS 439 Ca 0.27 -0.26 -0.01 0.00 -0.85 0.00 0.00 60.65 59.80 1qw4 h LYS 439 Cb 0.04 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 31.52 1qw4 h LYS 439 CO -0.04 0.98 -0.01 1.25 -3.45 0.00 0.00 179.45 178.18 1qw4 h HIS 440 N 1.06 0.08 -0.62 1.91 2.76 -0.15 -2.34 115.15 117.85 1qw4 h HIS 440 Ca 0.22 -0.02 0.13 0.00 -2.20 0.00 0.00 60.37 58.50 1qw4 h HIS 440 Cb 0.37 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.27 1qw4 h HIS 440 CO 0.03 0.42 0.42 1.98 -1.30 0.00 0.00 177.93 179.49 1qw4 h MET 441 N -0.28 0.26 -0.09 5.26 1.85 -0.30 0.12 114.93 121.75 1qw4 h MET 441 Ca 0.01 -0.02 -0.23 0.00 -0.61 0.00 0.00 59.70 58.85 1qw4 h MET 441 Cb 0.40 -0.06 0.01 0.00 0.43 0.00 0.00 31.60 32.38 1qw4 h MET 441 CO 0.00 0.17 -0.86 1.96 -0.40 0.00 0.00 176.91 177.79 1qw4 h GLN 442 N 0.27 0.69 -0.53 0.39 4.20 -1.29 -2.20 115.11 116.63 1qw4 h GLN 442 Ca 0.30 -0.62 -0.04 0.00 0.06 0.00 0.00 58.65 58.35 1qw4 h GLN 442 Cb 0.80 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 1qw4 h GLN 442 CO -0.07 1.22 0.19 -0.91 -0.67 0.00 0.00 178.83 178.60 1qw4 h ASN 443 N 0.44 0.75 -0.04 1.46 2.35 -0.47 -2.09 115.58 117.98 1qw4 h ASN 443 Ca -0.07 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1qw4 h ASN 443 Cb 1.49 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.66 1qw4 h ASN 443 CO 0.17 0.74 0.03 -0.33 -1.65 0.00 0.00 177.43 176.38 1qw4 h GLU 444 N 0.73 0.06 -0.41 0.81 4.39 -0.82 1.05 114.58 120.38 1qw4 h GLU 444 Ca 0.17 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.83 1qw4 h GLU 444 Cb 0.24 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1qw4 h GLU 444 CO -0.01 0.05 0.08 1.88 -1.16 0.00 0.00 179.01 179.85 1qw4 h TYR 445 N 0.05 0.64 -0.02 4.33 -1.99 -1.35 0.97 116.97 119.60 1qw4 h TYR 445 Ca 0.02 -0.05 -0.23 0.00 2.00 0.00 0.00 58.73 60.47 1qw4 h TYR 445 Cb 0.01 -0.19 0.01 0.00 2.00 0.00 0.00 36.73 38.55 1qw4 h TYR 445 CO -0.07 0.57 -0.93 -0.09 -0.00 0.00 0.00 178.16 177.64 1qw4 h ARG 446 N 0.61 0.49 0.00 4.88 2.43 -1.07 -0.33 114.38 121.38 1qw4 h ARG 446 Ca 0.14 -0.50 -0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1qw4 h ARG 446 Cb 0.27 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1qw4 h ARG 446 CO 0.00 1.14 -0.00 0.00 -1.51 0.00 0.00 179.97 179.60 1qw4 h ALA 447 N 0.69 -0.00 -0.13 2.80 0.00 0.17 -3.41 119.26 119.38 1qw4 h ALA 447 Ca -0.08 -0.48 -0.18 0.00 0.00 0.00 0.00 54.91 54.17 1qw4 h ALA 447 Cb 1.56 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 19.02 1qw4 h ALA 447 CO 0.17 -0.00 -0.94 2.89 0.00 0.00 0.00 179.25 181.36 1qw4 n ARG 448 N -4.62 0.83 -4.05 0.00 1.85 0.33 -5.03 116.66 105.98 1qw4 n ARG 448 Ca -0.10 -2.65 -0.28 0.00 -1.00 0.00 0.00 57.85 53.82 1qw4 n ARG 448 Cb 0.46 -0.74 -0.03 0.00 -1.05 0.00 0.00 32.46 31.10 1qw4 n ARG 448 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1qw4 n GLY 449 N -0.08 -0.27 0.00 2.89 0.00 -0.13 -4.39 105.19 103.21 1qw4 n GLY 449 Ca 0.11 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1qw4 n GLY 449 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qw4 n GLY 450 N -1.89 2.24 3.15 -0.02 0.00 -1.21 -1.09 105.19 106.37 1qw4 n GLY 450 Ca -0.21 -1.11 0.05 0.00 0.00 0.00 0.00 46.02 44.75 1qw4 n GLY 450 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qw4 s PRO 452 N 2.91 4.15 -0.02 0.00 0.04 -1.26 -4.64 135.00 136.18 1qw4 s PRO 452 Ca 0.11 2.56 -0.01 0.00 0.04 0.00 0.00 61.00 63.71 1qw4 s PRO 452 Cb -0.10 -4.13 0.02 0.00 0.04 0.00 0.00 34.50 30.32 1qw4 s PRO 452 CO -0.18 -0.94 0.03 0.00 0.04 0.00 0.00 177.00 175.95 1qw4 s ALA 453 N 4.39 -0.00 -0.49 8.56 0.00 0.33 -3.84 121.76 130.70 1qw4 s ALA 453 Ca 0.86 0.22 -0.13 0.00 0.00 0.00 0.00 51.96 52.92 1qw4 s ALA 453 Cb -0.42 -0.17 0.11 0.00 0.00 0.00 0.00 23.12 22.65 1qw4 s ALA 453 CO 0.40 -0.07 0.40 0.34 0.00 0.00 0.00 175.76 176.83 1qw4 s ASP 454 N 0.60 5.95 0.25 0.00 -1.08 -0.76 -3.40 116.67 118.23 1qw4 s ASP 454 Ca -0.05 -1.70 -0.03 0.00 -0.52 0.00 0.00 52.55 50.25 1qw4 s ASP 454 Cb -0.07 -2.11 0.48 0.00 -1.46 0.00 0.00 42.92 39.76 1qw4 s ASP 454 CO -0.02 -0.72 1.75 -0.25 0.52 0.00 0.00 175.17 176.45 1qw4 h TRP 455 N 8.66 0.63 0.00 -5.34 7.01 -1.91 -0.59 115.95 124.41 1qw4 h TRP 455 Ca -0.26 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 60.77 1qw4 h TRP 455 Cb 1.09 -0.16 -0.00 0.00 -2.10 0.00 0.00 29.16 27.99 1qw4 h TRP 455 CO 0.67 0.13 -0.01 0.82 -2.79 0.00 0.00 178.44 177.26 1qw4 h ILE 456 N 0.53 0.69 0.01 2.65 2.04 -1.92 -2.14 117.51 119.36 1qw4 h ILE 456 Ca 0.43 -0.02 -0.37 0.00 1.00 0.00 0.00 64.86 65.90 1qw4 h ILE 456 Cb 0.62 1.01 -0.07 0.00 -0.74 0.00 0.00 36.82 37.65 1qw4 h ILE 456 CO -0.38 0.01 -2.36 0.79 0.00 0.00 0.00 178.15 176.21 1qw4 n TRP 457 N -4.07 0.14 0.35 1.37 7.02 -0.81 -4.43 117.44 117.00 1qw4 n TRP 457 Ca -0.03 0.04 0.14 0.00 -1.02 0.00 0.00 57.50 56.63 1qw4 n TRP 457 Cb 0.09 -1.02 0.56 0.00 -2.42 0.00 0.00 31.31 28.52 1qw4 n TRP 457 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1qw4 h LEU 458 N 0.00 0.00 -9.16 -0.99 3.38 -0.92 -3.43 115.31 104.19 1qw4 h LEU 458 Ca -0.54 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 56.84 1qw4 h LEU 458 Cb 2.07 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.72 1qw4 h LEU 458 CO -0.01 0.00 -0.10 -0.69 0.09 0.00 0.00 178.44 177.72 1qw4 s VAL 459 N -3.46 5.15 0.50 1.22 1.01 -0.82 -4.97 120.40 119.03 1qw4 s VAL 459 Ca 0.03 0.88 -0.21 0.00 0.00 0.00 0.00 61.98 62.68 1qw4 s VAL 459 Cb 0.09 -3.80 -0.09 0.00 0.00 0.00 0.00 36.38 32.58 1qw4 s VAL 459 CO 0.49 0.23 0.86 -2.65 0.00 0.00 0.00 175.10 174.03 1qw4 n PRO 460 N 4.50 0.99 0.00 2.72 -0.02 -1.26 -4.85 135.00 137.07 1qw4 n PRO 460 Ca -0.06 0.37 0.06 0.00 -2.02 0.00 0.00 63.50 61.85 1qw4 n PRO 460 Cb 0.51 -1.97 0.37 0.00 -0.02 0.00 0.00 33.50 32.39 1qw4 n PRO 460 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1qw4 n PRO 461 N -0.20 0.49 -3.73 0.52 -0.04 -1.26 -4.28 135.00 126.50 1qw4 n PRO 461 Ca 0.11 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.44 1qw4 n PRO 461 Cb 0.43 -1.40 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1qw4 n PRO 461 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1qw4 s VAL 462 N -2.00 0.06 -1.17 0.52 -7.23 -1.26 -4.93 120.40 104.39 1qw4 s VAL 462 Ca 0.19 -0.50 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 1qw4 s VAL 462 Cb 0.09 -0.78 0.00 0.00 0.56 0.00 0.00 36.38 36.24 1qw4 s VAL 462 CO 0.14 -0.28 0.00 -1.20 -0.31 0.00 0.00 175.10 173.46 1qw4 n SER 463 N 0.94 -4.59 0.00 4.85 7.64 -1.26 -4.95 113.62 116.24 1qw4 n SER 463 Ca -0.20 0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1qw4 n SER 463 Cb 0.58 -3.06 0.00 0.00 -1.01 0.00 0.00 64.21 60.72 1qw4 n SER 463 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qw4 n GLY 464 N -1.29 -1.11 0.16 0.23 0.00 -1.26 0.10 105.19 102.02 1qw4 n GLY 464 Ca -0.11 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.27 1qw4 n GLY 464 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1qw4 h SER 465 N 0.00 0.00 1.15 1.61 4.64 -1.95 -1.46 113.55 117.53 1qw4 h SER 465 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qw4 h SER 465 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1qw4 h SER 465 CO 0.00 0.00 0.00 0.40 -0.87 0.00 0.00 176.83 176.36 1qw4 h ILE 466 N 0.00 0.00 -2.76 0.95 1.08 -0.73 -3.44 117.51 112.61 1qw4 h ILE 466 Ca 0.00 -0.50 -0.59 0.00 -0.39 0.00 0.00 64.86 63.39 1qw4 h ILE 466 Cb 0.17 1.41 -0.04 0.00 -3.07 0.00 0.00 36.82 35.29 1qw4 h ILE 466 CO 0.00 0.00 -0.49 0.42 -0.69 0.00 0.00 178.15 177.39 1qw4 s THR 467 N -3.41 5.32 0.35 -0.27 -4.23 -0.55 -5.04 115.64 107.81 1qw4 s THR 467 Ca 0.04 -0.54 0.14 0.00 -1.18 0.00 0.00 61.69 60.15 1qw4 s THR 467 Cb 0.09 -3.66 0.10 0.00 1.34 0.00 0.00 72.50 70.37 1qw4 s THR 467 CO 0.52 0.03 1.82 1.55 -0.54 0.00 0.00 174.62 178.01 1qw4 h PRO 468 N 2.67 0.00 0.00 3.99 0.13 -1.84 -3.22 132.00 133.73 1qw4 h PRO 468 Ca -0.47 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.62 1qw4 h PRO 468 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1qw4 h PRO 468 CO 0.72 0.37 -0.20 -0.39 -0.23 0.00 0.00 178.00 178.27 1qw4 h VAL 469 N 0.00 1.00 -0.65 1.56 -1.51 -1.89 -2.55 116.25 112.21 1qw4 h VAL 469 Ca -0.00 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1qw4 h VAL 469 Cb 0.69 1.40 -0.03 0.00 -2.13 0.00 0.00 31.29 31.22 1qw4 h VAL 469 CO 0.05 0.20 0.42 0.15 -1.23 0.00 0.00 177.57 177.16 1qw4 h PHE 470 N 0.00 0.82 -0.13 5.19 3.04 -1.77 -1.88 116.94 122.22 1qw4 h PHE 470 Ca -0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.96 1qw4 h PHE 470 Cb 0.39 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.62 1qw4 h PHE 470 CO 0.00 0.52 0.00 0.72 -2.02 0.00 0.00 178.31 177.53 1qw4 n HIS 471 N -4.43 0.16 -3.74 0.41 -0.00 -0.96 -4.83 115.22 101.83 1qw4 n HIS 471 Ca 0.07 -0.08 -0.37 0.00 -0.00 0.00 0.00 57.72 57.34 1qw4 n HIS 471 Cb 0.04 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 29.92 1qw4 n HIS 471 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 1qw4 s GLN 472 N -1.84 3.81 0.39 -0.41 2.00 -0.71 -0.21 119.66 122.68 1qw4 s GLN 472 Ca 0.31 -0.40 -0.24 0.00 -2.00 0.00 0.00 55.36 53.03 1qw4 s GLN 472 Cb 0.16 -3.42 -0.10 0.00 0.80 0.00 0.00 33.01 30.46 1qw4 s GLN 472 CO 0.25 -0.10 0.98 -1.21 -0.50 0.00 0.00 175.29 174.71 1qw4 s GLU 473 N 1.44 4.31 0.10 1.67 2.02 -0.46 -5.00 118.70 122.78 1qw4 s GLU 473 Ca 0.06 1.33 -0.12 0.00 0.02 0.00 0.00 54.97 56.26 1qw4 s GLU 473 Cb -0.15 -2.50 0.02 0.00 0.10 0.00 0.00 34.13 31.59 1qw4 s GLU 473 CO 0.05 0.02 0.29 0.00 0.02 0.00 0.00 175.26 175.64 1qw4 s MET 474 N -2.57 0.93 -0.12 1.61 0.23 -1.26 -4.63 119.30 113.48 1qw4 s MET 474 Ca 0.57 -0.81 -0.02 0.00 -1.03 0.00 0.00 55.69 54.40 1qw4 s MET 474 Cb -0.17 0.40 -0.03 0.00 -1.53 0.00 0.00 34.83 33.50 1qw4 s MET 474 CO 0.22 -0.33 -0.04 -0.51 -2.03 0.00 0.00 175.02 172.33 1qw4 s LEU 475 N -2.75 3.28 -0.23 0.18 1.02 -1.26 -4.92 118.68 114.00 1qw4 s LEU 475 Ca 0.03 -0.06 -0.03 0.00 0.02 0.00 0.00 54.13 54.10 1qw4 s LEU 475 Cb 0.03 -1.77 0.01 0.00 0.02 0.00 0.00 46.19 44.49 1qw4 s LEU 475 CO -0.11 0.25 -0.05 0.21 0.02 0.00 0.00 176.35 176.67 1qw4 s ASN 476 N -0.13 4.26 0.05 2.29 2.47 -1.22 -0.51 114.94 122.15 1qw4 s ASN 476 Ca 0.03 -0.64 -0.14 0.00 0.42 0.00 0.00 52.86 52.52 1qw4 s ASN 476 Cb -0.13 -1.70 0.02 0.00 -1.45 0.00 0.00 41.25 38.00 1qw4 s ASN 476 CO 0.02 -0.08 0.31 -0.72 -3.72 0.00 0.00 177.10 172.92 1qw4 s TYR 477 N 1.40 -0.12 -0.44 0.43 1.13 -1.26 -4.96 117.35 113.53 1qw4 s TYR 477 Ca 0.03 -0.02 -0.18 0.00 -1.41 0.00 0.00 57.07 55.49 1qw4 s TYR 477 Cb -0.15 0.11 0.03 0.00 -1.10 0.00 0.00 41.96 40.85 1qw4 s TYR 477 CO -0.04 -0.52 0.49 0.08 -2.51 0.00 0.00 175.55 173.06 1qw4 s VAL 478 N -2.60 5.03 0.00 -3.49 1.01 -1.26 -4.82 120.40 114.27 1qw4 s VAL 478 Ca -0.05 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1qw4 s VAL 478 Cb -0.01 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1qw4 s VAL 478 CO -0.04 -0.53 0.00 0.18 0.00 0.00 0.00 175.10 174.71 1qw4 n LEU 479 N 5.75 0.00 -3.73 3.92 4.77 -1.26 -2.83 117.00 123.63 1qw4 n LEU 479 Ca -0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.78 1qw4 n LEU 479 Cb 0.47 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.46 1qw4 n LEU 479 CO 0.49 -0.10 0.10 -0.55 -1.33 0.00 0.00 177.39 175.99 1qw4 s SER 480 N -1.00 -0.45 1.09 -1.43 0.15 -1.26 -4.49 113.70 106.30 1qw4 s SER 480 Ca 0.00 0.86 -0.12 0.00 0.70 0.00 0.00 55.95 57.39 1qw4 s SER 480 Cb 0.00 0.86 0.23 0.00 -1.71 0.00 0.00 66.02 65.40 1qw4 s SER 480 CO 0.00 -0.15 0.97 -2.65 1.20 0.00 0.00 173.24 172.61 1qw4 n PRO 481 N 2.96 -1.72 -3.50 5.44 -0.02 -1.26 -5.01 135.00 131.90 1qw4 n PRO 481 Ca -0.14 -0.46 -0.16 0.00 -2.02 0.00 0.00 63.50 60.72 1qw4 n PRO 481 Cb 0.57 -2.19 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 1qw4 n PRO 481 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1qw4 s PHE 482 N -2.47 -0.60 -0.40 6.00 5.36 -0.95 -4.21 117.98 120.72 1qw4 s PHE 482 Ca 0.67 0.89 -0.11 0.00 -0.96 0.00 0.00 56.93 57.42 1qw4 s PHE 482 Cb -0.24 0.45 0.05 0.00 -0.34 0.00 0.00 43.02 42.94 1qw4 s PHE 482 CO 0.63 -0.63 0.25 0.71 -1.46 0.00 0.00 175.22 174.72 1qw4 s TYR 483 N -1.77 3.27 0.47 10.12 2.02 -1.26 -1.03 117.35 129.17 1qw4 s TYR 483 Ca -0.07 -1.08 0.02 0.00 -0.37 0.00 0.00 57.07 55.57 1qw4 s TYR 483 Cb -0.00 -2.66 0.01 0.00 -0.40 0.00 0.00 41.96 38.91 1qw4 s TYR 483 CO 0.04 -0.71 0.68 0.71 -1.57 0.00 0.00 175.55 174.69 1qw4 s TYR 484 N 1.54 3.06 0.65 2.71 2.02 0.13 -4.85 117.35 122.59 1qw4 s TYR 484 Ca 0.03 0.05 -0.01 0.00 -0.37 0.00 0.00 57.07 56.77 1qw4 s TYR 484 Cb -0.21 -2.44 0.08 0.00 -0.40 0.00 0.00 41.96 38.99 1qw4 s TYR 484 CO 0.06 -0.50 0.91 0.71 -1.57 0.00 0.00 175.55 175.15 1qw4 s TYR 485 N -2.57 2.35 0.13 2.71 2.02 -0.17 -0.56 117.35 121.26 1qw4 s TYR 485 Ca 0.52 -0.04 -0.03 0.00 -0.37 0.00 0.00 57.07 57.15 1qw4 s TYR 485 Cb -0.10 -2.94 -0.03 0.00 -0.40 0.00 0.00 41.96 38.49 1qw4 s TYR 485 CO 0.37 -1.31 0.10 -0.65 -1.57 0.00 0.00 175.55 172.49 1qw4 s GLN 486 N -5.01 0.95 0.34 -0.62 -0.21 -1.26 -1.25 119.66 112.61 1qw4 s GLN 486 Ca 0.62 -1.35 -0.26 0.00 0.02 0.00 0.00 55.36 54.38 1qw4 s GLN 486 Cb -0.08 0.27 -0.09 0.00 1.00 0.00 0.00 33.01 34.11 1qw4 s GLN 486 CO 0.42 -0.29 1.03 0.42 -2.12 0.00 0.00 175.29 174.76 1qw4 s ILE 487 N -4.02 3.78 -0.31 1.08 1.01 -1.26 -4.91 121.20 116.57 1qw4 s ILE 487 Ca 0.21 1.52 -0.39 0.00 0.00 0.00 0.00 60.65 62.00 1qw4 s ILE 487 Cb 0.07 -3.87 -0.14 0.00 0.01 0.00 0.00 42.46 38.52 1qw4 s ILE 487 CO 0.00 0.16 1.92 -0.62 0.00 0.00 0.00 174.94 176.41 1qw4 n GLU 488 N 0.50 1.07 -0.34 2.79 -0.58 -1.26 -4.83 120.64 117.99 1qw4 n GLU 488 Ca 0.02 0.36 0.22 0.00 -0.42 0.00 0.00 57.16 57.35 1qw4 n GLU 488 Cb 0.48 -2.18 0.45 0.00 -0.57 0.00 0.00 31.44 29.62 1qw4 n GLU 488 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1qw4 h PRO 489 N 9.03 0.37 0.00 3.49 0.13 -1.92 0.19 132.00 143.29 1qw4 h PRO 489 Ca -0.37 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1qw4 h PRO 489 Cb 1.33 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1qw4 h PRO 489 CO 0.99 0.24 0.00 -2.67 -0.23 0.00 0.00 178.00 176.33 1qw4 n TRP 490 N -5.02 0.00 -0.01 1.56 2.14 -1.26 -2.42 117.44 112.43 1qw4 n TRP 490 Ca 0.31 0.00 -0.11 0.00 2.07 0.00 0.00 57.50 59.77 1qw4 n TRP 490 Cb 0.93 -0.41 -0.14 0.00 -0.81 0.00 0.00 31.31 30.88 1qw4 n TRP 490 CO 0.00 0.00 0.00 0.87 2.07 0.00 0.00 177.69 180.63 1qw4 h LYS 491 N 0.00 0.05 -2.25 -2.67 1.57 -0.97 -3.40 116.57 108.90 1qw4 h LYS 491 Ca 0.00 -0.09 -0.58 0.00 -1.87 0.00 0.00 60.65 58.11 1qw4 h LYS 491 Cb 0.24 0.03 -0.42 0.00 0.08 0.00 0.00 32.23 32.16 1qw4 h LYS 491 CO 0.00 0.65 -0.71 0.25 -0.57 0.00 0.00 179.45 179.07 1qw4 n THR 492 N -3.14 2.65 -3.92 -0.16 -2.24 -1.02 -5.04 114.28 101.42 1qw4 n THR 492 Ca -0.19 -5.45 -0.17 0.00 -2.27 0.00 0.00 64.05 55.97 1qw4 n THR 492 Cb 1.05 -1.26 -0.16 0.00 -2.10 0.00 0.00 70.33 67.86 1qw4 n THR 492 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1qw4 s HIS 493 N -3.33 0.32 -0.50 4.78 5.04 -1.17 -4.94 115.29 115.49 1qw4 s HIS 493 Ca 0.48 -0.00 -0.21 0.00 -1.54 0.00 0.00 55.06 53.79 1qw4 s HIS 493 Cb 0.29 -0.43 0.05 0.00 0.04 0.00 0.00 32.58 32.52 1qw4 s HIS 493 CO -0.13 -0.14 0.72 0.42 -2.34 0.00 0.00 174.74 173.27 1qw4 s ILE 494 N 1.09 4.73 -2.00 0.89 1.09 -1.26 -5.04 121.20 120.69 1qw4 s ILE 494 Ca -0.09 -0.13 0.12 0.00 -1.10 0.00 0.00 60.65 59.45 1qw4 s ILE 494 Cb -0.13 -4.34 0.35 0.00 -1.06 0.00 0.00 42.46 37.27 1qw4 s ILE 494 CO -0.02 -0.84 1.16 0.79 -0.10 0.00 0.00 174.94 175.93