#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4q n PRO 77 N 0.00 0.57 -2.15 3.44 -0.02 -1.26 -4.99 135.00 130.59 1a4q n PRO 77 Ca 0.00 0.20 -0.35 0.00 -2.02 0.00 0.00 63.50 61.33 1a4q n PRO 77 Cb 0.00 -1.46 0.01 0.00 -0.02 0.00 0.00 33.50 32.03 1a4q n PRO 77 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1a4q s GLU 78 N -0.84 3.22 0.53 -0.52 2.12 -1.26 -4.81 118.70 117.14 1a4q s GLU 78 Ca 0.69 1.58 -0.20 0.00 0.36 0.00 0.00 54.97 57.40 1a4q s GLU 78 Cb -0.91 -1.99 -0.07 0.00 0.26 0.00 0.00 34.13 31.43 1a4q s GLU 78 CO 0.56 -0.95 1.10 -1.58 -0.54 0.00 0.00 175.26 173.85 1a4q s TRP 79 N -1.87 2.78 0.29 5.30 0.52 -1.26 -4.30 118.94 120.40 1a4q s TRP 79 Ca 0.72 1.55 -0.17 0.00 0.02 0.00 0.00 56.10 58.22 1a4q s TRP 79 Cb -0.24 -3.21 -0.09 0.00 -1.15 0.00 0.00 33.47 28.78 1a4q s TRP 79 CO 0.30 -1.33 0.74 0.99 0.02 0.00 0.00 176.95 177.67 1a4q s THR 80 N -1.86 4.62 0.04 2.01 2.01 -0.39 -4.80 115.64 117.26 1a4q s THR 80 Ca 0.71 1.10 0.01 0.00 0.31 0.00 0.00 61.69 63.82 1a4q s THR 80 Cb -0.21 -3.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 1a4q s THR 80 CO 0.25 -0.05 -0.06 -0.31 -0.69 0.00 0.00 174.62 173.77 1a4q s TYR 81 N -1.82 0.51 0.39 4.92 1.51 -1.26 -1.48 117.35 120.12 1a4q s TYR 81 Ca 0.50 -0.57 -0.27 0.00 -1.01 0.00 0.00 57.07 55.72 1a4q s TYR 81 Cb -0.13 -0.32 -0.11 0.00 -0.11 0.00 0.00 41.96 41.29 1a4q s TYR 81 CO 0.19 -0.15 1.39 -0.35 -1.11 0.00 0.00 175.55 175.52 1a4q n PRO 82 N 1.35 2.33 -4.58 -1.71 -0.04 -1.26 -5.04 135.00 126.05 1a4q n PRO 82 Ca -0.22 0.82 -0.26 0.00 -0.04 0.00 0.00 63.50 63.80 1a4q n PRO 82 Cb 0.56 -2.53 -0.11 0.00 -0.04 0.00 0.00 33.50 31.38 1a4q n PRO 82 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1a4q s ARG 83 N -2.13 1.89 0.51 0.54 0.52 -1.26 -4.84 118.95 114.17 1a4q s ARG 83 Ca 0.57 -2.06 -0.22 0.00 -0.52 0.00 0.00 55.73 53.49 1a4q s ARG 83 Cb -0.50 -1.47 -0.06 0.00 0.52 0.00 0.00 34.95 33.45 1a4q s ARG 83 CO 0.61 -0.08 1.31 -0.51 0.02 0.00 0.00 175.30 176.66 1a4q s LEU 84 N -3.66 3.92 0.63 2.53 1.43 -1.26 -4.58 118.68 117.69 1a4q s LEU 84 Ca 0.35 2.66 -0.16 0.00 -1.03 0.00 0.00 54.13 55.95 1a4q s LEU 84 Cb 0.10 -4.23 -0.01 0.00 0.03 0.00 0.00 46.19 42.07 1a4q s LEU 84 CO 0.17 -1.36 1.12 -0.44 0.23 0.00 0.00 176.35 176.07 1a4q s SER 85 N -1.02 5.23 0.68 2.29 0.01 0.04 -2.21 113.70 118.74 1a4q s SER 85 Ca 0.68 2.06 -0.16 0.00 1.31 0.00 0.00 55.95 59.85 1a4q s SER 85 Cb -0.38 -2.56 0.01 0.00 0.21 0.00 0.00 66.02 63.30 1a4q s SER 85 CO 0.45 -1.55 1.17 0.00 0.41 0.00 0.00 173.24 173.73 1a4q s GLN 87 N -3.86 4.07 0.00 0.00 2.00 -1.26 -4.97 119.66 115.64 1a4q s GLN 87 Ca 0.72 2.37 0.00 0.00 -2.00 0.00 0.00 55.36 56.45 1a4q s GLN 87 Cb -0.26 -2.90 0.00 0.00 0.80 0.00 0.00 33.01 30.65 1a4q s GLN 87 CO 0.41 -0.48 0.00 0.41 -0.50 0.00 0.00 175.29 175.13 1a4q n GLY 88 N 0.61 1.88 0.00 2.59 0.00 -1.26 -4.59 105.19 104.42 1a4q n GLY 88 Ca 0.02 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1a4q n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4q n SER 89 N 0.00 0.00 -3.82 1.61 3.41 -0.31 -4.99 113.62 109.53 1a4q n SER 89 Ca 0.00 -1.00 -0.11 0.00 -0.26 0.00 0.00 58.87 57.50 1a4q n SER 89 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1a4q n SER 89 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1a4q s THR 90 N 0.00 0.10 0.39 6.66 -1.32 -1.19 -4.80 115.64 115.47 1a4q s THR 90 Ca 0.00 -0.82 -0.02 0.00 -1.21 0.00 0.00 61.69 59.64 1a4q s THR 90 Cb 0.00 -0.91 -0.04 0.00 -1.51 0.00 0.00 72.50 70.04 1a4q s THR 90 CO 0.00 -0.45 0.63 -0.36 -2.21 0.00 0.00 174.62 172.23 1a4q s PHE 91 N -2.54 3.52 0.03 9.09 0.40 -1.26 -1.02 117.98 126.21 1a4q s PHE 91 Ca -0.05 0.54 -0.01 0.00 -0.60 0.00 0.00 56.93 56.81 1a4q s PHE 91 Cb -0.01 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.43 1a4q s PHE 91 CO -0.04 -0.02 -0.02 -0.65 0.70 0.00 0.00 175.22 175.19 1a4q s GLN 92 N -4.40 0.46 0.14 0.44 -1.52 0.17 -3.89 119.66 111.05 1a4q s GLN 92 Ca 0.43 -0.89 -0.31 0.00 -1.95 0.00 0.00 55.36 52.64 1a4q s GLN 92 Cb -0.10 0.16 -0.10 0.00 -0.22 0.00 0.00 33.01 32.75 1a4q s GLN 92 CO 0.39 -0.08 1.78 0.21 -0.25 0.00 0.00 175.29 177.34 1a4q s LYS 93 N -2.62 4.14 -0.14 2.91 2.20 -1.26 -1.78 119.74 123.19 1a4q s LYS 93 Ca -0.05 2.56 -0.09 0.00 -0.36 0.00 0.00 55.97 58.03 1a4q s LYS 93 Cb -0.02 -3.48 -0.06 0.00 -1.51 0.00 0.00 37.83 32.76 1a4q s LYS 93 CO -0.05 -0.80 -0.21 0.00 -0.36 0.00 0.00 175.35 173.92 1a4q n ALA 94 N 5.29 1.88 -3.60 3.13 0.00 0.11 -4.92 120.51 122.39 1a4q n ALA 94 Ca 0.17 -0.62 -0.14 0.00 0.00 0.00 0.00 53.44 52.85 1a4q n ALA 94 Cb 0.38 0.24 -0.07 0.00 0.00 0.00 0.00 19.45 20.00 1a4q n ALA 94 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1a4q s LEU 95 N -7.07 -0.68 -0.10 0.00 2.96 -1.13 -5.02 118.68 107.64 1a4q s LEU 95 Ca -0.22 1.16 0.04 0.00 -0.22 0.00 0.00 54.13 54.89 1a4q s LEU 95 Cb 0.07 2.41 0.00 0.00 0.50 0.00 0.00 46.19 49.17 1a4q s LEU 95 CO 0.28 -0.34 -0.24 -0.22 -1.32 0.00 0.00 176.35 174.52 1a4q s LEU 96 N -0.11 2.09 -0.34 -0.68 2.96 -1.26 -0.66 118.68 120.68 1a4q s LEU 96 Ca -0.03 -0.56 -0.05 0.00 -0.22 0.00 0.00 54.13 53.27 1a4q s LEU 96 Cb -0.03 -1.41 0.05 0.00 0.50 0.00 0.00 46.19 45.29 1a4q s LEU 96 CO 0.03 0.15 0.10 -0.63 -1.32 0.00 0.00 176.35 174.68 1a4q s ILE 97 N 0.39 3.61 -0.58 6.68 -1.09 0.70 -5.00 121.20 125.91 1a4q s ILE 97 Ca -0.18 -1.26 0.04 0.00 -2.23 0.00 0.00 60.65 57.03 1a4q s ILE 97 Cb -0.18 -3.09 0.16 0.00 -1.58 0.00 0.00 42.46 37.77 1a4q s ILE 97 CO 0.08 -0.21 0.38 -0.55 -1.23 0.00 0.00 174.94 173.40 1a4q s SER 98 N 1.45 3.98 0.42 3.58 0.15 -1.26 -0.94 113.70 121.08 1a4q s SER 98 Ca -0.02 -3.35 0.13 0.00 0.70 0.00 0.00 55.95 53.42 1a4q s SER 98 Cb -0.20 -1.34 0.91 0.00 -1.71 0.00 0.00 66.02 63.69 1a4q s SER 98 CO 0.02 -0.16 1.95 -0.65 1.20 0.00 0.00 173.24 175.60 1a4q h PRO 99 N 5.89 0.06 -0.00 5.44 0.11 -1.96 -2.28 132.00 139.26 1a4q h PRO 99 Ca 0.09 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1a4q h PRO 99 Cb 0.84 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1a4q h PRO 99 CO 0.61 0.25 0.00 0.72 -0.21 0.00 0.00 178.00 179.38 1a4q n HIS 100 N -4.29 0.00 0.28 0.65 8.25 -1.26 -1.41 115.22 117.45 1a4q n HIS 100 Ca -0.02 -0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.59 1a4q n HIS 100 Cb 0.27 0.00 0.73 0.00 1.12 0.00 0.00 29.99 32.10 1a4q n HIS 100 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a4q h ARG 101 N 0.17 0.00 -0.05 -0.41 3.08 -1.73 -2.35 114.38 113.09 1a4q h ARG 101 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1a4q h ARG 101 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1a4q h ARG 101 CO 0.00 0.00 -0.01 1.19 -1.07 0.00 0.00 179.97 180.08 1a4q n PHE 102 N -2.58 0.20 -0.43 3.04 3.72 -0.50 -4.77 117.46 116.13 1a4q n PHE 102 Ca -0.01 -0.98 0.07 0.00 -0.05 0.00 0.00 57.45 56.48 1a4q n PHE 102 Cb 0.14 -0.19 0.32 0.00 -0.94 0.00 0.00 39.48 38.82 1a4q n PHE 102 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a4q n GLY 103 N -1.24 2.53 3.75 1.37 0.00 -0.88 -4.01 105.19 106.71 1a4q n GLY 103 Ca 0.17 -0.75 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 1a4q n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a4q s GLU 104 N -2.14 2.86 0.48 1.61 8.01 -1.26 -3.41 118.70 124.85 1a4q s GLU 104 Ca 0.45 1.74 0.22 0.00 0.01 0.00 0.00 54.97 57.39 1a4q s GLU 104 Cb 0.31 -1.92 1.24 0.00 -4.31 0.00 0.00 34.13 29.45 1a4q s GLU 104 CO 0.17 -1.27 2.02 0.00 0.01 0.00 0.00 175.26 176.19 1a4q h ALA 105 N 0.63 1.39 -0.01 5.21 0.00 -1.95 -1.23 119.26 123.29 1a4q h ALA 105 Ca -0.50 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1a4q h ALA 105 Cb 1.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1a4q h ALA 105 CO 0.54 0.21 -0.05 2.89 0.00 0.00 0.00 179.25 182.85 1a4q n ARG 106 N -3.85 1.49 -0.93 0.00 1.85 -1.26 -4.91 116.66 109.05 1a4q n ARG 106 Ca -0.02 -0.85 -0.05 0.00 -1.00 0.00 0.00 57.85 55.94 1a4q n ARG 106 Cb 0.26 -1.48 0.03 0.00 -1.05 0.00 0.00 32.46 30.22 1a4q n ARG 106 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1a4q n GLY 107 N 1.20 0.48 0.16 2.89 0.00 -0.47 -5.05 105.19 104.41 1a4q n GLY 107 Ca 0.18 -1.93 0.06 0.00 0.00 0.00 0.00 46.02 44.33 1a4q n GLY 107 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1a4q n ASN 108 N -3.01 1.63 -4.84 1.61 3.02 -1.26 -4.93 115.26 107.48 1a4q n ASN 108 Ca 0.03 -2.60 -0.22 0.00 -0.03 0.00 0.00 54.58 51.77 1a4q n ASN 108 Cb 0.12 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 38.94 1a4q n ASN 108 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1a4q s SER 109 N -2.07 4.98 -0.43 6.41 0.01 -1.26 -5.09 113.70 116.25 1a4q s SER 109 Ca 0.19 -0.75 0.09 0.00 1.31 0.00 0.00 55.95 56.80 1a4q s SER 109 Cb 0.17 -0.64 0.31 0.00 0.21 0.00 0.00 66.02 66.07 1a4q s SER 109 CO 0.02 -0.56 0.71 0.00 0.41 0.00 0.00 173.24 173.82 1a4q n ALA 110 N -1.45 2.74 -1.73 1.44 0.00 -1.26 -4.22 120.51 116.04 1a4q n ALA 110 Ca 0.02 -3.74 -0.42 0.00 0.00 0.00 0.00 53.44 49.29 1a4q n ALA 110 Cb 0.62 -0.86 -0.01 0.00 0.00 0.00 0.00 19.45 19.19 1a4q n ALA 110 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1a4q n PRO 111 N 0.54 2.45 -2.61 0.00 -0.04 -1.24 -1.62 135.00 132.47 1a4q n PRO 111 Ca 0.25 0.87 -0.40 0.00 -0.04 0.00 0.00 63.50 64.18 1a4q n PRO 111 Cb 0.56 -2.58 -0.05 0.00 -0.04 0.00 0.00 33.50 31.39 1a4q n PRO 111 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1a4q s LEU 112 N -0.70 4.58 -0.15 1.53 1.43 -0.97 -1.43 118.68 122.97 1a4q s LEU 112 Ca 0.62 2.08 -0.29 0.00 -1.03 0.00 0.00 54.13 55.51 1a4q s LEU 112 Cb -0.54 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.06 1a4q s LEU 112 CO 0.54 -0.02 0.99 -0.63 0.23 0.00 0.00 176.35 177.46 1a4q s ILE 113 N -0.96 4.77 0.19 -0.59 1.01 0.21 -4.89 121.20 120.93 1a4q s ILE 113 Ca 0.44 1.98 -0.03 0.00 0.00 0.00 0.00 60.65 63.03 1a4q s ILE 113 Cb -0.28 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 37.87 1a4q s ILE 113 CO 0.36 -0.04 0.17 0.27 0.00 0.00 0.00 174.94 175.70 1a4q s ILE 114 N 2.35 0.02 0.38 2.92 -5.25 -1.26 -1.26 121.20 119.10 1a4q s ILE 114 Ca 0.46 -1.86 -0.07 0.00 -0.99 0.00 0.00 60.65 58.18 1a4q s ILE 114 Cb -0.17 -2.33 0.03 0.00 2.95 0.00 0.00 42.46 42.94 1a4q s ILE 114 CO 0.14 -0.11 0.62 0.54 -1.79 0.00 0.00 174.94 174.34 1a4q n ARG 115 N -0.25 0.89 -4.01 0.37 1.74 -0.83 -3.44 116.66 111.14 1a4q n ARG 115 Ca -0.01 -2.65 -0.33 0.00 -0.77 0.00 0.00 57.85 54.10 1a4q n ARG 115 Cb 0.65 2.80 -0.02 0.00 -1.02 0.00 0.00 32.46 34.87 1a4q n ARG 115 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1a4q n GLU 116 N -0.58 -1.64 -1.89 5.56 4.71 -1.26 -1.90 120.64 123.65 1a4q n GLU 116 Ca -0.03 0.27 -0.34 0.00 -0.01 0.00 0.00 57.16 57.04 1a4q n GLU 116 Cb 0.60 -3.78 0.04 0.00 -1.01 0.00 0.00 31.44 27.30 1a4q n GLU 116 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1a4q s PRO 117 N -6.83 2.86 0.25 3.49 0.04 -1.26 -4.16 135.00 129.40 1a4q s PRO 117 Ca 0.21 1.61 -0.19 0.00 0.04 0.00 0.00 61.00 62.67 1a4q s PRO 117 Cb -0.10 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.53 1a4q s PRO 117 CO 0.93 -1.24 0.63 -0.59 0.04 0.00 0.00 177.00 176.77 1a4q s PHE 118 N -1.96 -0.13 0.03 0.56 -0.71 -0.63 -4.89 117.98 110.25 1a4q s PHE 118 Ca 0.72 -0.27 0.04 0.00 -1.04 0.00 0.00 56.93 56.39 1a4q s PHE 118 Cb -0.25 0.55 -0.02 0.00 -1.21 0.00 0.00 43.02 42.09 1a4q s PHE 118 CO 0.36 -1.10 -0.13 0.42 -1.34 0.00 0.00 175.22 173.44 1a4q s ILE 119 N -3.91 0.98 -0.01 -4.49 1.01 -1.26 -0.82 121.20 112.70 1a4q s ILE 119 Ca 0.11 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 1a4q s ILE 119 Cb -0.04 -0.90 -0.00 0.00 0.01 0.00 0.00 42.46 41.53 1a4q s ILE 119 CO 0.03 -0.02 0.05 0.00 0.00 0.00 0.00 174.94 175.01 1a4q s ALA 120 N -0.82 -0.12 0.09 9.38 0.00 -0.97 -4.42 121.76 124.89 1a4q s ALA 120 Ca 0.00 -0.05 0.09 0.00 0.00 0.00 0.00 51.96 52.01 1a4q s ALA 120 Cb -0.07 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1a4q s ALA 120 CO 0.01 -0.09 -0.23 0.00 0.00 0.00 0.00 175.76 175.44 1a4q n GLY 122 N 1.22 2.58 0.22 0.00 0.00 0.08 -4.50 105.19 104.80 1a4q n GLY 122 Ca -0.17 -2.09 0.07 0.00 0.00 0.00 0.00 46.02 43.84 1a4q n GLY 122 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a4q h PRO 123 N 0.00 0.00 -0.00 1.61 0.13 -1.95 -3.35 132.00 128.44 1a4q h PRO 123 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1a4q h PRO 123 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1a4q h PRO 123 CO 0.00 0.27 -0.02 1.63 -0.23 0.00 0.00 178.00 179.65 1a4q n LYS 124 N -3.74 4.93 -3.50 0.86 4.76 -1.26 -4.80 118.16 115.40 1a4q n LYS 124 Ca -0.01 -0.13 -0.15 0.00 -2.87 0.00 0.00 58.31 55.14 1a4q n LYS 124 Cb 0.38 -0.65 -0.05 0.00 -1.84 0.00 0.00 35.03 32.87 1a4q n LYS 124 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1a4q s GLU 125 N -0.82 1.04 0.13 1.97 2.12 -1.26 -5.13 118.70 116.76 1a4q s GLU 125 Ca 0.00 0.05 0.07 0.00 0.36 0.00 0.00 54.97 55.46 1a4q s GLU 125 Cb 0.01 0.49 -0.04 0.00 0.26 0.00 0.00 34.13 34.84 1a4q s GLU 125 CO 0.02 -0.37 -0.08 0.00 -0.54 0.00 0.00 175.26 174.30 1a4q s LYS 127 N -2.42 1.69 -0.35 0.00 1.02 -0.57 -1.16 119.74 117.94 1a4q s LYS 127 Ca 0.23 -0.84 -0.07 0.00 0.02 0.00 0.00 55.97 55.31 1a4q s LYS 127 Cb -0.10 -1.69 0.05 0.00 -0.52 0.00 0.00 37.83 35.57 1a4q s LYS 127 CO 0.15 0.45 0.13 -1.58 -0.92 0.00 0.00 175.35 173.59 1a4q s HIS 128 N -0.60 3.29 0.23 3.18 5.65 0.58 -2.29 115.29 125.33 1a4q s HIS 128 Ca 0.08 -1.50 0.02 0.00 0.25 0.00 0.00 55.06 53.92 1a4q s HIS 128 Cb -0.09 -2.43 -0.03 0.00 -1.18 0.00 0.00 32.58 28.85 1a4q s HIS 128 CO -0.00 -0.76 0.38 -0.06 -0.65 0.00 0.00 174.74 173.65 1a4q s PHE 129 N 1.39 3.47 0.13 3.88 0.08 -0.00 -2.09 117.98 124.85 1a4q s PHE 129 Ca -0.00 0.15 -0.26 0.00 0.12 0.00 0.00 56.93 56.94 1a4q s PHE 129 Cb -0.20 -1.71 0.07 0.00 -0.57 0.00 0.00 43.02 40.61 1a4q s PHE 129 CO 0.02 0.39 1.00 0.00 -0.10 0.00 0.00 175.22 176.53 1a4q s ALA 130 N -1.96 -1.72 -0.44 5.36 0.00 -1.00 -1.61 121.76 120.39 1a4q s ALA 130 Ca 0.36 0.18 -0.11 0.00 0.00 0.00 0.00 51.96 52.40 1a4q s ALA 130 Cb -0.10 0.61 0.09 0.00 0.00 0.00 0.00 23.12 23.71 1a4q s ALA 130 CO 0.30 -1.05 0.31 -0.51 0.00 0.00 0.00 175.76 174.82 1a4q s LEU 131 N -2.95 5.39 0.51 0.00 1.02 -0.80 -1.35 118.68 120.50 1a4q s LEU 131 Ca 0.13 -1.55 -0.16 0.00 0.02 0.00 0.00 54.13 52.57 1a4q s LEU 131 Cb -0.01 -2.04 -0.08 0.00 0.02 0.00 0.00 46.19 44.08 1a4q s LEU 131 CO 0.02 -0.60 0.97 0.28 0.02 0.00 0.00 176.35 177.04 1a4q s THR 132 N 1.47 4.55 -2.12 5.49 -1.32 -0.01 -1.97 115.64 121.73 1a4q s THR 132 Ca 0.04 1.18 0.16 0.00 -1.21 0.00 0.00 61.69 61.85 1a4q s THR 132 Cb -0.24 -3.72 0.39 0.00 -1.51 0.00 0.00 72.50 67.41 1a4q s THR 132 CO 0.03 -0.68 1.38 1.41 -2.21 0.00 0.00 174.62 174.55 1a4q n HIS 133 N -1.57 0.41 -3.11 9.09 8.25 -0.39 -2.31 115.22 125.59 1a4q n HIS 133 Ca 0.06 -0.21 -0.14 0.00 -0.26 0.00 0.00 57.72 57.18 1a4q n HIS 133 Cb 0.54 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.71 1a4q n HIS 133 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1a4q n TYR 134 N 0.56 -1.73 -3.73 4.41 4.19 -1.26 -4.70 117.16 114.89 1a4q n TYR 134 Ca 0.14 0.69 -0.13 0.00 3.31 0.00 0.00 57.90 61.91 1a4q n TYR 134 Cb 0.34 -4.08 -0.08 0.00 0.49 0.00 0.00 39.34 36.01 1a4q n TYR 134 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1a4q s ALA 135 N -3.25 -0.86 0.26 2.98 0.00 -1.26 -5.06 121.76 114.57 1a4q s ALA 135 Ca 0.15 0.35 0.12 0.00 0.00 0.00 0.00 51.96 52.58 1a4q s ALA 135 Cb -0.07 0.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.14 1a4q s ALA 135 CO 0.52 -0.31 -0.19 0.00 0.00 0.00 0.00 175.76 175.78 1a4q s ALA 136 N -1.61 2.75 -0.19 0.00 0.00 -1.26 -0.62 121.76 120.82 1a4q s ALA 136 Ca -0.11 -1.81 -0.03 0.00 0.00 0.00 0.00 51.96 50.01 1a4q s ALA 136 Cb -0.04 -0.32 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1a4q s ALA 136 CO 0.03 0.31 -0.06 -1.14 0.00 0.00 0.00 175.76 174.90 1a4q s GLN 137 N -3.35 3.46 0.56 0.00 0.74 -0.51 -2.89 119.66 117.65 1a4q s GLN 137 Ca 0.28 -0.61 -0.17 0.00 0.05 0.00 0.00 55.36 54.92 1a4q s GLN 137 Cb -0.06 -2.92 -0.05 0.00 1.10 0.00 0.00 33.01 31.08 1a4q s GLN 137 CO 0.14 -0.01 1.04 -1.25 -0.55 0.00 0.00 175.29 174.67 1a4q s PRO 138 N 0.98 3.54 0.00 1.67 0.04 -1.22 -3.72 135.00 136.29 1a4q s PRO 138 Ca -0.00 1.18 -0.01 0.00 0.04 0.00 0.00 61.00 62.21 1a4q s PRO 138 Cb -0.15 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1a4q s PRO 138 CO 0.00 -0.63 0.04 0.41 0.04 0.00 0.00 177.00 176.87 1a4q n GLY 139 N -0.98 0.79 0.06 0.56 0.00 -1.14 -5.01 105.19 99.46 1a4q n GLY 139 Ca 0.08 -0.86 0.07 0.00 0.00 0.00 0.00 46.02 45.31 1a4q n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4q n GLY 140 N -0.03 4.25 1.56 -0.02 0.00 -1.26 -4.68 105.19 105.01 1a4q n GLY 140 Ca 0.00 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 1a4q n GLY 140 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1a4q n TYR 141 N -1.12 1.84 0.10 1.61 4.01 -1.26 -4.75 117.16 117.59 1a4q n TYR 141 Ca 0.11 -2.01 -0.02 0.00 -0.16 0.00 0.00 57.90 55.82 1a4q n TYR 141 Cb 0.51 -0.39 0.23 0.00 -0.31 0.00 0.00 39.34 39.38 1a4q n TYR 141 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1a4q h TYR 142 N 1.72 0.27 -2.97 -0.72 0.05 -1.93 -3.42 116.97 109.98 1a4q h TYR 142 Ca 0.27 -0.07 -0.54 0.00 0.05 0.00 0.00 58.73 58.43 1a4q h TYR 142 Cb 1.36 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 39.03 1a4q h TYR 142 CO 0.88 0.61 0.78 1.21 -1.05 0.00 0.00 178.16 180.59 1a4q s ASN 143 N -6.88 6.91 0.00 3.88 3.04 -1.26 -1.49 114.94 119.14 1a4q s ASN 143 Ca -0.04 2.06 0.00 0.00 0.04 0.00 0.00 52.86 54.91 1a4q s ASN 143 Cb 0.13 -2.56 0.00 0.00 -1.54 0.00 0.00 41.25 37.28 1a4q s ASN 143 CO 0.77 -0.67 0.00 0.61 -3.04 0.00 0.00 177.10 174.77 1a4q n GLY 144 N 3.55 0.37 0.02 1.21 0.00 -1.26 -4.97 105.19 104.11 1a4q n GLY 144 Ca 0.12 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.30 1a4q n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a4q n THR 145 N -1.75 0.00 -0.31 2.61 -2.24 -0.56 -2.24 114.28 109.79 1a4q n THR 145 Ca 0.00 -0.01 0.11 0.00 -2.27 0.00 0.00 64.05 61.88 1a4q n THR 145 Cb 0.00 -0.46 0.29 0.00 -2.10 0.00 0.00 70.33 68.05 1a4q n THR 145 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1a4q n ARG 146 N -0.95 2.75 -3.80 -0.78 0.63 -1.26 -4.60 116.66 108.65 1a4q n ARG 146 Ca 0.24 -2.53 -0.31 0.00 -0.92 0.00 0.00 57.85 54.33 1a4q n ARG 146 Cb 0.12 -1.51 -0.04 0.00 0.45 0.00 0.00 32.46 31.48 1a4q n ARG 146 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 1a4q s GLU 147 N -1.01 3.52 0.04 -0.14 -1.05 -0.95 -5.04 118.70 114.06 1a4q s GLU 147 Ca 0.43 -0.30 -0.19 0.00 -0.15 0.00 0.00 54.97 54.76 1a4q s GLU 147 Cb 0.23 -2.94 -0.16 0.00 -0.44 0.00 0.00 34.13 30.82 1a4q s GLU 147 CO 0.30 0.53 1.27 -0.44 0.95 0.00 0.00 175.26 177.87 1a4q h ASP 148 N 2.83 0.49 -4.24 0.83 3.32 -1.92 -3.47 116.42 114.26 1a4q h ASP 148 Ca -0.46 -0.57 -0.39 0.00 0.02 0.00 0.00 57.03 55.62 1a4q h ASP 148 Cb 1.17 -0.14 -0.26 0.00 0.22 0.00 0.00 39.33 40.31 1a4q h ASP 148 CO 0.74 0.97 -0.78 -0.13 -1.72 0.00 0.00 179.24 178.32 1a4q s ARG 149 N -3.94 0.77 0.15 3.56 0.52 -1.26 -4.87 118.95 113.88 1a4q s ARG 149 Ca -0.14 -0.53 -0.22 0.00 -0.52 0.00 0.00 55.73 54.31 1a4q s ARG 149 Cb 0.05 -0.73 0.08 0.00 0.52 0.00 0.00 34.95 34.87 1a4q s ARG 149 CO 0.79 0.19 1.06 0.27 0.02 0.00 0.00 175.30 177.63 1a4q n ASN 150 N 2.33 -1.63 -0.14 0.23 0.23 -1.26 -5.03 115.26 109.99 1a4q n ASN 150 Ca -0.16 -1.79 0.15 0.00 -0.53 0.00 0.00 54.58 52.24 1a4q n ASN 150 Cb 0.56 2.64 0.81 0.00 -2.08 0.00 0.00 39.78 41.71 1a4q n ASN 150 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1a4q n LYS 151 N -0.75 1.19 -0.02 -3.83 5.02 -1.26 -3.90 118.16 114.61 1a4q n LYS 151 Ca -0.01 -0.28 0.03 0.00 -2.02 0.00 0.00 58.31 56.03 1a4q n LYS 151 Cb 0.58 -1.48 -0.08 0.00 -0.02 0.00 0.00 35.03 34.02 1a4q n LYS 151 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1a4q n LEU 152 N -0.66 0.00 -4.77 -0.35 4.32 -1.26 -5.03 117.00 109.26 1a4q n LEU 152 Ca 0.22 0.00 -0.41 0.00 -0.02 0.00 0.00 56.01 55.80 1a4q n LEU 152 Cb 0.18 0.06 -0.01 0.00 -1.62 0.00 0.00 43.42 42.03 1a4q n LEU 152 CO 0.17 0.06 1.10 -0.13 -1.22 0.00 0.00 177.39 177.38 1a4q s ARG 153 N -2.60 4.20 0.04 3.23 0.52 -1.25 -4.57 118.95 118.52 1a4q s ARG 153 Ca -0.04 2.45 0.02 0.00 -0.52 0.00 0.00 55.73 57.64 1a4q s ARG 153 Cb 0.06 -3.02 -0.02 0.00 0.52 0.00 0.00 34.95 32.49 1a4q s ARG 153 CO 0.42 -0.44 -0.08 -1.01 0.02 0.00 0.00 175.30 174.22 1a4q s HIS 154 N -0.85 0.67 -0.11 -0.53 3.76 -0.98 -1.22 115.29 116.03 1a4q s HIS 154 Ca 0.54 -0.45 -0.28 0.00 -0.15 0.00 0.00 55.06 54.72 1a4q s HIS 154 Cb -0.44 -0.40 -0.02 0.00 1.11 0.00 0.00 32.58 32.83 1a4q s HIS 154 CO 0.56 -0.07 0.94 -1.17 -0.85 0.00 0.00 174.74 174.15 1a4q s LEU 155 N -1.42 4.24 0.21 0.89 2.96 -0.54 -0.83 118.68 124.19 1a4q s LEU 155 Ca -0.08 1.43 0.06 0.00 -0.22 0.00 0.00 54.13 55.31 1a4q s LEU 155 Cb -0.09 -3.44 -0.05 0.00 0.50 0.00 0.00 46.19 43.11 1a4q s LEU 155 CO 0.00 -0.40 -0.08 0.27 -1.32 0.00 0.00 176.35 174.82 1a4q s ILE 156 N 1.90 1.41 0.19 6.68 -5.25 -0.46 -0.75 121.20 124.92 1a4q s ILE 156 Ca 0.45 -2.11 -0.14 0.00 -0.99 0.00 0.00 60.65 57.86 1a4q s ILE 156 Cb -0.18 -2.16 0.01 0.00 2.95 0.00 0.00 42.46 43.08 1a4q s ILE 156 CO 0.17 -0.50 0.44 -0.94 -1.79 0.00 0.00 174.94 172.32 1a4q s SER 157 N -3.31 -0.14 0.07 4.36 1.04 -0.87 -2.36 113.70 112.50 1a4q s SER 157 Ca 0.24 -0.65 -0.01 0.00 0.48 0.00 0.00 55.95 56.01 1a4q s SER 157 Cb 0.03 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 1a4q s SER 157 CO 0.07 -1.01 -0.02 0.68 0.98 0.00 0.00 173.24 173.94 1a4q s VAL 158 N -3.92 0.25 0.32 5.02 -7.23 -0.89 -1.23 120.40 112.73 1a4q s VAL 158 Ca 0.13 -1.85 -0.29 0.00 -1.81 0.00 0.00 61.98 58.17 1a4q s VAL 158 Cb 0.00 -1.65 -0.10 0.00 0.56 0.00 0.00 36.38 35.19 1a4q s VAL 158 CO -0.01 -0.87 1.34 -0.75 -0.31 0.00 0.00 175.10 174.50 1a4q s LYS 159 N -3.94 4.33 0.22 4.82 2.20 -1.26 -0.31 119.74 125.80 1a4q s LYS 159 Ca 0.11 2.25 -0.32 0.00 -0.36 0.00 0.00 55.97 57.65 1a4q s LYS 159 Cb 0.08 -3.07 -0.12 0.00 -1.51 0.00 0.00 37.83 33.21 1a4q s LYS 159 CO -0.07 -0.25 1.68 -1.17 -0.36 0.00 0.00 175.35 175.19 1a4q s LEU 160 N -1.55 4.37 0.00 5.43 2.96 -0.31 -1.49 118.68 128.08 1a4q s LEU 160 Ca 0.51 2.86 0.00 0.00 -0.22 0.00 0.00 54.13 57.28 1a4q s LEU 160 Cb -0.40 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.68 1a4q s LEU 160 CO 0.52 -0.95 0.00 0.61 -1.32 0.00 0.00 176.35 175.21 1a4q n GLY 161 N 3.61 2.60 3.89 7.98 0.00 -1.26 -4.92 105.19 117.10 1a4q n GLY 161 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1a4q n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a4q s LYS 162 N -0.79 3.68 -0.10 1.61 -0.14 -0.56 -5.06 119.74 118.39 1a4q s LYS 162 Ca 0.00 0.07 -0.26 0.00 -1.36 0.00 0.00 55.97 54.42 1a4q s LYS 162 Cb 0.00 -2.69 -0.02 0.00 -1.68 0.00 0.00 37.83 33.44 1a4q s LYS 162 CO 0.00 0.30 0.85 0.42 -0.76 0.00 0.00 175.35 176.15 1a4q s ILE 163 N -1.91 4.91 -1.17 2.17 -1.09 -1.26 -4.87 121.20 117.97 1a4q s ILE 163 Ca 0.44 1.72 -0.21 0.00 -2.23 0.00 0.00 60.65 60.37 1a4q s ILE 163 Cb -0.11 -4.17 -0.06 0.00 -1.58 0.00 0.00 42.46 36.54 1a4q s ILE 163 CO 0.26 0.12 1.90 -2.65 -1.23 0.00 0.00 174.94 173.34 1a4q n PRO 164 N 4.51 1.96 -2.99 2.79 -0.02 -1.26 -4.69 135.00 135.30 1a4q n PRO 164 Ca 0.04 -2.57 -0.20 0.00 -2.02 0.00 0.00 63.50 58.74 1a4q n PRO 164 Cb 0.50 -3.58 0.07 0.00 -0.02 0.00 0.00 33.50 30.47 1a4q n PRO 164 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1a4q s THR 165 N 8.74 2.14 0.22 3.45 -4.23 -1.26 -2.29 115.64 122.41 1a4q s THR 165 Ca 0.64 -0.96 -0.08 0.00 -1.18 0.00 0.00 61.69 60.11 1a4q s THR 165 Cb 0.02 -2.18 0.18 0.00 1.34 0.00 0.00 72.50 71.86 1a4q s THR 165 CO 0.12 0.00 1.72 0.58 -0.54 0.00 0.00 174.62 176.50 1a4q h VAL 166 N 0.10 0.67 0.13 2.29 2.07 -1.64 -2.06 116.25 117.81 1a4q h VAL 166 Ca -0.30 -0.12 -0.35 0.00 0.82 0.00 0.00 66.70 66.75 1a4q h VAL 166 Cb 1.29 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1a4q h VAL 166 CO 0.41 0.06 -1.82 -0.33 0.02 0.00 0.00 177.57 175.91 1a4q h GLU 167 N 0.36 0.29 0.00 1.57 5.08 -1.95 -3.34 114.58 116.58 1a4q h GLU 167 Ca 0.35 -0.49 -0.07 0.00 -1.00 0.00 0.00 59.36 58.15 1a4q h GLU 167 Cb 0.51 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1a4q h GLU 167 CO -0.39 1.17 -0.35 -0.91 -1.00 0.00 0.00 179.01 177.54 1a4q h ASN 168 N 0.08 0.00 -4.34 1.42 -0.26 -1.81 -3.46 115.58 107.21 1a4q h ASN 168 Ca -0.36 0.00 -0.51 0.00 -0.56 0.00 0.00 56.30 54.87 1a4q h ASN 168 Cb 2.05 0.00 0.09 0.00 -1.06 0.00 0.00 38.32 39.41 1a4q h ASN 168 CO 0.13 0.35 0.37 -0.44 -1.06 0.00 0.00 177.43 176.78 1a4q s SER 169 N -6.78 5.31 -0.09 5.81 0.01 -0.78 -4.78 113.70 112.39 1a4q s SER 169 Ca -0.02 1.51 0.01 0.00 1.31 0.00 0.00 55.95 58.76 1a4q s SER 169 Cb 0.14 -2.38 -0.02 0.00 0.21 0.00 0.00 66.02 63.97 1a4q s SER 169 CO 0.71 -1.47 -0.11 -0.63 0.41 0.00 0.00 173.24 172.14 1a4q s ILE 170 N -3.10 3.28 -0.31 1.44 -1.09 -0.36 -4.97 121.20 116.10 1a4q s ILE 170 Ca 0.58 -0.61 -0.12 0.00 -2.23 0.00 0.00 60.65 58.27 1a4q s ILE 170 Cb -0.14 -2.35 -0.04 0.00 -1.58 0.00 0.00 42.46 38.36 1a4q s ILE 170 CO 0.55 0.56 0.21 -0.36 -1.23 0.00 0.00 174.94 174.67 1a4q s PHE 171 N -0.23 3.22 -0.13 3.97 0.40 -1.26 -2.05 117.98 121.91 1a4q s PHE 171 Ca 0.02 -0.02 -0.22 0.00 -0.60 0.00 0.00 56.93 56.11 1a4q s PHE 171 Cb -0.13 -2.42 -0.26 0.00 0.51 0.00 0.00 43.02 40.72 1a4q s PHE 171 CO 0.03 -0.25 0.59 0.45 0.70 0.00 0.00 175.22 176.74 1a4q h HIS 172 N 8.42 0.22 -1.44 0.36 3.86 -1.31 -3.49 115.15 121.77 1a4q h HIS 172 Ca -0.33 -0.16 0.27 0.00 -1.16 0.00 0.00 60.37 58.98 1a4q h HIS 172 Cb 1.18 -0.01 -0.18 0.00 1.06 0.00 0.00 27.41 29.46 1a4q h HIS 172 CO 0.72 1.34 0.83 0.00 0.86 0.00 0.00 177.93 181.67 1a4q s MET 173 N -2.37 0.30 0.24 2.45 0.23 -1.24 -5.03 119.30 113.88 1a4q s MET 173 Ca -0.21 -0.12 -0.30 0.00 -1.03 0.00 0.00 55.69 54.03 1a4q s MET 173 Cb 0.02 0.13 -0.10 0.00 -1.53 0.00 0.00 34.83 33.35 1a4q s MET 173 CO 0.71 -0.13 1.41 0.00 -2.03 0.00 0.00 175.02 174.98 1a4q s ALA 174 N -2.39 3.61 -0.29 3.16 0.00 -1.26 -1.47 121.76 123.11 1a4q s ALA 174 Ca 0.10 1.28 -0.18 0.00 0.00 0.00 0.00 51.96 53.16 1a4q s ALA 174 Cb -0.00 -3.54 0.17 0.00 0.00 0.00 0.00 23.12 19.75 1a4q s ALA 174 CO -0.04 -0.70 1.14 0.00 0.00 0.00 0.00 175.76 176.16 1a4q s ALA 175 N 0.04 -2.37 -0.33 0.00 0.00 -0.35 -4.48 121.76 114.27 1a4q s ALA 175 Ca 0.59 2.02 0.05 0.00 0.00 0.00 0.00 51.96 54.61 1a4q s ALA 175 Cb -0.41 -1.79 0.13 0.00 0.00 0.00 0.00 23.12 21.05 1a4q s ALA 175 CO 0.42 -0.29 1.10 -2.67 0.00 0.00 0.00 175.76 174.32 1a4q n TRP 176 N 3.02 0.18 -3.72 0.00 4.27 0.41 -2.87 117.44 118.74 1a4q n TRP 176 Ca -0.16 -0.52 -0.13 0.00 -3.89 0.00 0.00 57.50 52.80 1a4q n TRP 176 Cb 0.57 -0.05 -0.10 0.00 -1.36 0.00 0.00 31.31 30.37 1a4q n TRP 176 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 1a4q s SER 177 N -1.08 -0.47 0.31 -0.67 0.15 -1.21 -4.87 113.70 105.86 1a4q s SER 177 Ca 0.10 0.89 -0.02 0.00 0.70 0.00 0.00 55.95 57.61 1a4q s SER 177 Cb 0.06 0.87 -0.01 0.00 -1.71 0.00 0.00 66.02 65.23 1a4q s SER 177 CO 0.06 -0.16 0.39 -0.83 1.20 0.00 0.00 173.24 173.90 1a4q s GLY 178 N 0.49 1.49 0.04 9.45 0.00 -1.26 -0.77 107.32 116.75 1a4q s GLY 178 Ca -0.02 -1.55 -0.28 0.00 0.00 0.00 0.00 44.72 42.87 1a4q s GLY 178 CO -0.02 -1.08 1.07 -0.45 0.00 0.00 0.00 173.10 172.61 1a4q s SER 179 N -3.22 -0.17 -0.03 1.64 0.15 -0.90 -0.94 113.70 110.23 1a4q s SER 179 Ca 0.32 -0.21 -0.30 0.00 0.70 0.00 0.00 55.95 56.47 1a4q s SER 179 Cb 0.01 0.34 0.11 0.00 -1.71 0.00 0.00 66.02 64.76 1a4q s SER 179 CO 0.19 -0.60 0.97 0.00 1.20 0.00 0.00 173.24 175.00 1a4q s ALA 180 N -2.91 -1.87 -0.18 5.45 0.00 -1.26 -0.88 121.76 120.11 1a4q s ALA 180 Ca 0.11 1.03 -0.33 0.00 0.00 0.00 0.00 51.96 52.78 1a4q s ALA 180 Cb 0.00 0.33 0.14 0.00 0.00 0.00 0.00 23.12 23.60 1a4q s ALA 180 CO -0.02 -0.72 1.17 0.00 0.00 0.00 0.00 175.76 176.19 1a4q s HIS 182 N -2.03 2.75 -1.90 0.00 2.46 -1.26 -0.67 115.29 114.65 1a4q s HIS 182 Ca 0.07 -0.13 0.18 0.00 0.47 0.00 0.00 55.06 55.65 1a4q s HIS 182 Cb -0.01 -1.65 0.30 0.00 -0.13 0.00 0.00 32.58 31.10 1a4q s HIS 182 CO -0.05 0.21 1.23 -0.40 -2.47 0.00 0.00 174.74 173.26 1a4q n ASP 183 N 2.31 2.96 0.00 9.88 5.68 -0.87 -4.62 116.55 131.89 1a4q n ASP 183 Ca -0.17 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.25 1a4q n ASP 183 Cb 0.52 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 1a4q n ASP 183 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a4q n GLY 184 N 1.07 2.28 0.06 6.12 0.00 -1.26 -1.26 105.19 112.19 1a4q n GLY 184 Ca 0.14 -0.55 -0.07 0.00 0.00 0.00 0.00 46.02 45.55 1a4q n GLY 184 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a4q n ARG 185 N 0.00 1.50 -3.48 1.61 1.74 -1.26 -4.68 116.66 112.10 1a4q n ARG 185 Ca 0.00 0.03 -0.11 0.00 -0.77 0.00 0.00 57.85 57.00 1a4q n ARG 185 Cb 0.00 -1.26 -0.02 0.00 -1.02 0.00 0.00 32.46 30.16 1a4q n ARG 185 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1a4q s GLU 186 N -2.25 1.20 0.10 5.56 2.56 -1.26 -5.04 118.70 119.57 1a4q s GLU 186 Ca -0.10 -0.47 -0.19 0.00 0.00 0.00 0.00 54.97 54.21 1a4q s GLU 186 Cb 0.04 0.53 -0.07 0.00 2.00 0.00 0.00 34.13 36.63 1a4q s GLU 186 CO 0.36 -0.53 0.60 -1.58 -0.56 0.00 0.00 175.26 173.55 1a4q s TRP 187 N -3.59 3.78 -0.14 5.30 0.52 -1.26 -2.05 118.94 121.50 1a4q s TRP 187 Ca 0.03 1.29 0.01 0.00 0.02 0.00 0.00 56.10 57.45 1a4q s TRP 187 Cb -0.01 -2.51 -0.00 0.00 -1.15 0.00 0.00 33.47 29.79 1a4q s TRP 187 CO -0.10 0.55 -0.17 0.99 0.02 0.00 0.00 176.95 178.24 1a4q s THR 188 N -1.19 2.59 -0.06 2.01 2.01 0.16 -0.80 115.64 120.36 1a4q s THR 188 Ca 0.32 -0.81 0.04 0.00 0.31 0.00 0.00 61.69 61.55 1a4q s THR 188 Cb -0.19 -2.08 -0.02 0.00 0.01 0.00 0.00 72.50 70.22 1a4q s THR 188 CO 0.20 0.53 -0.16 -0.31 -0.69 0.00 0.00 174.62 174.18 1a4q s TYR 189 N 0.68 2.66 -0.11 4.92 2.02 0.40 -1.56 117.35 126.37 1a4q s TYR 189 Ca -0.08 -0.32 0.02 0.00 -0.37 0.00 0.00 57.07 56.32 1a4q s TYR 189 Cb -0.16 -1.65 0.01 0.00 -0.40 0.00 0.00 41.96 39.76 1a4q s TYR 189 CO 0.02 0.06 -0.15 0.42 -1.57 0.00 0.00 175.55 174.32 1a4q s ILE 190 N -0.48 1.51 -0.02 2.71 1.01 -0.06 -1.20 121.20 124.68 1a4q s ILE 190 Ca 0.06 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1a4q s ILE 190 Cb -0.12 -1.38 0.03 0.00 0.01 0.00 0.00 42.46 40.99 1a4q s ILE 190 CO 0.02 0.44 0.02 -0.83 0.00 0.00 0.00 174.94 174.59 1a4q s GLY 191 N 1.00 0.14 -0.21 6.18 0.00 -0.73 -2.13 107.32 111.57 1a4q s GLY 191 Ca -0.06 0.24 -0.10 0.00 0.00 0.00 0.00 44.72 44.80 1a4q s GLY 191 CO -0.02 0.61 0.13 0.14 0.00 0.00 0.00 173.10 173.96 1a4q s VAL 192 N 0.98 5.29 0.00 1.40 1.01 0.05 -1.20 120.40 127.92 1a4q s VAL 192 Ca -0.09 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1a4q s VAL 192 Cb -0.12 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1a4q s VAL 192 CO -0.02 0.41 0.00 -0.90 0.00 0.00 0.00 175.10 174.59 1a4q n ASP 193 N 3.76 0.00 0.00 3.32 5.75 -0.88 -0.44 116.55 128.06 1a4q n ASP 193 Ca -0.16 -0.55 0.00 0.00 -0.01 0.00 0.00 54.79 54.07 1a4q n ASP 193 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 1a4q n ASP 193 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1a4q n GLY 194 N 0.00 1.58 3.76 6.12 0.00 -1.26 0.01 105.19 115.40 1a4q n GLY 194 Ca 0.00 -2.08 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 1a4q n GLY 194 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a4q s PRO 195 N -1.83 3.07 0.23 1.61 0.04 -1.26 -4.75 135.00 132.11 1a4q s PRO 195 Ca 0.00 1.66 -0.07 0.00 0.04 0.00 0.00 61.00 62.63 1a4q s PRO 195 Cb 0.00 -1.96 0.39 0.00 0.04 0.00 0.00 34.50 32.97 1a4q s PRO 195 CO 0.00 -1.09 1.70 -0.44 0.04 0.00 0.00 177.00 177.21 1a4q h ASP 196 N 0.82 0.07 0.63 6.66 3.32 -1.97 -0.59 116.42 125.36 1a4q h ASP 196 Ca -0.49 0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1a4q h ASP 196 Cb 1.27 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1a4q h ASP 196 CO 0.55 0.01 0.00 -1.54 -1.72 0.00 0.00 179.24 176.55 1a4q n SER 197 N -5.11 0.12 -2.75 6.45 3.41 -1.26 -0.86 113.62 113.62 1a4q n SER 197 Ca 0.12 0.53 -0.07 0.00 -0.26 0.00 0.00 58.87 59.18 1a4q n SER 197 Cb 0.39 -0.55 0.04 0.00 -0.26 0.00 0.00 64.21 63.84 1a4q n SER 197 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1a4q n ASN 198 N -1.63 -2.93 -4.60 4.04 5.15 -0.27 -4.39 115.26 110.63 1a4q n ASN 198 Ca 0.04 -3.19 -0.24 0.00 -0.60 0.00 0.00 54.58 50.59 1a4q n ASN 198 Cb 0.21 1.78 0.12 0.00 -0.53 0.00 0.00 39.78 41.36 1a4q n ASN 198 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1a4q s ALA 199 N 0.71 3.55 -0.11 5.20 0.00 -0.94 -3.97 121.76 126.19 1a4q s ALA 199 Ca 0.31 -1.70 -0.05 0.00 0.00 0.00 0.00 51.96 50.53 1a4q s ALA 199 Cb 0.20 -2.08 0.05 0.00 0.00 0.00 0.00 23.12 21.29 1a4q s ALA 199 CO -0.21 -1.60 0.23 -1.17 0.00 0.00 0.00 175.76 173.01 1a4q s LEU 200 N -5.24 0.14 -0.12 0.00 2.96 0.10 -3.19 118.68 113.33 1a4q s LEU 200 Ca 0.68 0.50 -0.29 0.00 -0.22 0.00 0.00 54.13 54.79 1a4q s LEU 200 Cb -0.05 0.62 -0.01 0.00 0.50 0.00 0.00 46.19 47.25 1a4q s LEU 200 CO 0.45 -0.20 1.03 -0.63 -1.32 0.00 0.00 176.35 175.68 1a4q s ILE 201 N 1.78 4.73 -0.05 6.68 -1.09 -0.84 -2.08 121.20 130.32 1a4q s ILE 201 Ca -0.04 2.01 0.04 0.00 -2.23 0.00 0.00 60.65 60.43 1a4q s ILE 201 Cb -0.11 -4.29 -0.02 0.00 -1.58 0.00 0.00 42.46 36.45 1a4q s ILE 201 CO -0.08 -0.03 -0.17 -0.54 -1.23 0.00 0.00 174.94 172.90 1a4q s LYS 202 N 2.25 2.54 -0.07 2.79 1.02 -0.34 -1.57 119.74 126.35 1a4q s LYS 202 Ca 0.48 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.77 1a4q s LYS 202 Cb -0.18 -2.34 -0.00 0.00 -0.52 0.00 0.00 37.83 34.79 1a4q s LYS 202 CO 0.16 0.55 -0.23 0.42 -0.92 0.00 0.00 175.35 175.34 1a4q s ILE 203 N -0.56 1.93 -0.04 2.17 1.01 0.23 -1.77 121.20 124.15 1a4q s ILE 203 Ca 0.08 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.81 1a4q s ILE 203 Cb -0.11 -1.65 -0.01 0.00 0.01 0.00 0.00 42.46 40.70 1a4q s ILE 203 CO 0.01 0.53 -0.20 -0.75 0.00 0.00 0.00 174.94 174.53 1a4q s LYS 204 N 0.11 2.00 -0.29 2.79 2.20 -0.34 -0.77 119.74 125.42 1a4q s LYS 204 Ca -0.10 -0.72 0.02 0.00 -0.36 0.00 0.00 55.97 54.81 1a4q s LYS 204 Cb -0.15 -1.74 0.07 0.00 -1.51 0.00 0.00 37.83 34.49 1a4q s LYS 204 CO 0.06 0.31 -0.04 -0.47 -0.36 0.00 0.00 175.35 174.85 1a4q s TYR 205 N -0.10 3.39 0.00 4.03 5.04 -0.31 -0.45 117.35 128.95 1a4q s TYR 205 Ca -0.02 -2.38 0.00 0.00 -2.44 0.00 0.00 57.07 52.23 1a4q s TYR 205 Cb -0.12 -2.24 0.00 0.00 0.35 0.00 0.00 41.96 39.96 1a4q s TYR 205 CO 0.02 -0.88 0.00 0.41 -1.34 0.00 0.00 175.55 173.76 1a4q n GLY 206 N 4.44 3.39 0.12 8.97 0.00 0.02 -2.50 105.19 119.64 1a4q n GLY 206 Ca -0.10 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 45.84 1a4q n GLY 206 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1a4q h GLU 207 N 0.00 0.00 -5.62 1.61 4.39 -1.93 -3.48 114.58 109.55 1a4q h GLU 207 Ca 0.00 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.11 1a4q h GLU 207 Cb 0.00 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.56 1a4q h GLU 207 CO 0.00 0.40 -0.13 0.00 -1.16 0.00 0.00 179.01 178.12 1a4q s ALA 208 N -2.98 3.51 -0.01 3.43 0.00 -1.04 -5.04 121.76 119.64 1a4q s ALA 208 Ca 0.02 -0.31 -0.30 0.00 0.00 0.00 0.00 51.96 51.36 1a4q s ALA 208 Cb 0.08 -2.68 -0.05 0.00 0.00 0.00 0.00 23.12 20.47 1a4q s ALA 208 CO 0.77 -0.16 1.30 0.71 0.00 0.00 0.00 175.76 178.38 1a4q s TYR 209 N 1.00 3.06 0.00 0.00 2.02 -1.26 -1.16 117.35 121.01 1a4q s TYR 209 Ca 0.24 1.03 0.00 0.00 -0.37 0.00 0.00 57.07 57.96 1a4q s TYR 209 Cb -0.15 -3.55 0.00 0.00 -0.40 0.00 0.00 41.96 37.86 1a4q s TYR 209 CO 0.09 -1.89 0.00 0.25 -1.57 0.00 0.00 175.55 172.43 1a4q n THR 210 N 4.53 0.00 -3.60 -0.71 -2.24 0.05 -4.95 114.28 107.35 1a4q n THR 210 Ca 0.12 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.82 1a4q n THR 210 Cb 0.45 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1a4q n THR 210 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1a4q s ASP 211 N -2.33 -0.33 0.21 3.42 2.15 -1.16 -4.82 116.67 113.81 1a4q s ASP 211 Ca 0.00 -0.18 -0.00 0.00 0.43 0.00 0.00 52.55 52.80 1a4q s ASP 211 Cb 0.00 0.48 -0.04 0.00 -0.30 0.00 0.00 42.92 43.05 1a4q s ASP 211 CO 0.00 -0.82 0.10 0.42 -0.17 0.00 0.00 175.17 174.70 1a4q s THR 212 N -3.34 0.23 -0.03 1.71 -4.23 -1.26 -0.60 115.64 108.11 1a4q s THR 212 Ca 0.07 -1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 58.57 1a4q s THR 212 Cb -0.02 -2.47 0.02 0.00 1.34 0.00 0.00 72.50 71.37 1a4q s THR 212 CO -0.05 -0.08 0.08 -0.47 -0.54 0.00 0.00 174.62 173.57 1a4q s TYR 213 N -3.99 -0.09 0.39 3.99 5.04 -0.61 -4.98 117.35 117.11 1a4q s TYR 213 Ca 0.36 0.25 -0.03 0.00 -2.44 0.00 0.00 57.07 55.21 1a4q s TYR 213 Cb 0.07 -0.02 -0.04 0.00 0.35 0.00 0.00 41.96 42.33 1a4q s TYR 213 CO 0.11 -0.07 0.64 -1.01 -1.34 0.00 0.00 175.55 173.88 1a4q s HIS 214 N 0.34 3.52 -0.13 4.97 3.76 -1.26 -2.00 115.29 124.49 1a4q s HIS 214 Ca -0.02 0.58 -0.29 0.00 -0.15 0.00 0.00 55.06 55.18 1a4q s HIS 214 Cb -0.04 -2.09 -0.04 0.00 1.11 0.00 0.00 32.58 31.52 1a4q s HIS 214 CO -0.01 -0.02 1.65 0.45 -0.85 0.00 0.00 174.74 175.97 1a4q s SER 215 N -3.88 6.51 0.00 1.40 0.15 -1.19 -4.90 113.70 111.79 1a4q s SER 215 Ca 0.44 1.98 0.24 0.00 0.70 0.00 0.00 55.95 59.31 1a4q s SER 215 Cb -0.10 -2.53 0.30 0.00 -1.71 0.00 0.00 66.02 61.98 1a4q s SER 215 CO 0.38 -1.09 1.29 0.00 1.20 0.00 0.00 173.24 175.02 1a4q n TYR 216 N 7.81 0.00 -0.85 3.44 0.18 -1.26 -4.32 117.16 122.15 1a4q n TYR 216 Ca 0.18 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.96 1a4q n TYR 216 Cb 0.44 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 39.37 1a4q n TYR 216 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1a4q n ALA 217 N 0.12 0.92 -3.94 -3.48 0.00 -1.26 -5.04 120.51 107.83 1a4q n ALA 217 Ca 0.12 -0.43 -0.32 0.00 0.00 0.00 0.00 53.44 52.81 1a4q n ALA 217 Cb 0.46 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.88 1a4q n ALA 217 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1a4q n ASN 218 N -0.05 -2.85 -3.30 0.00 4.13 -1.26 -4.57 115.26 107.36 1a4q n ASN 218 Ca 0.00 -0.78 -0.23 0.00 1.68 0.00 0.00 54.58 55.25 1a4q n ASN 218 Cb 0.39 -2.39 -0.08 0.00 -1.54 0.00 0.00 39.78 36.16 1a4q n ASN 218 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 1a4q s ASN 219 N -3.02 1.09 -0.81 6.41 3.84 -1.26 -4.40 114.94 116.80 1a4q s ASN 219 Ca 0.62 -2.61 -0.02 0.00 0.21 0.00 0.00 52.86 51.06 1a4q s ASN 219 Cb -0.34 0.04 -0.01 0.00 -0.55 0.00 0.00 41.25 40.39 1a4q s ASN 219 CO 0.76 -0.18 0.71 -0.38 -2.79 0.00 0.00 177.10 175.23 1a4q n ILE 220 N 3.13 -8.76 -1.65 -5.21 5.41 -0.04 -1.30 119.36 110.94 1a4q n ILE 220 Ca 0.24 -0.36 -0.45 0.00 1.00 0.00 0.00 62.75 63.19 1a4q n ILE 220 Cb 0.48 -6.12 -0.02 0.00 -0.71 0.00 0.00 39.64 33.27 1a4q n ILE 220 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1a4q n LEU 221 N -2.19 2.72 -3.76 1.39 7.94 -1.26 -4.53 117.00 117.31 1a4q n LEU 221 Ca -0.06 1.17 -0.09 0.00 -1.11 0.00 0.00 56.01 55.91 1a4q n LEU 221 Cb 0.55 -1.38 -0.03 0.00 0.53 0.00 0.00 43.42 43.09 1a4q n LEU 221 CO 0.56 -0.79 0.39 0.00 -1.11 0.00 0.00 177.39 176.45 1a4q s ARG 222 N -0.98 1.59 0.00 1.96 1.70 -0.26 -4.84 118.95 118.11 1a4q s ARG 222 Ca 0.64 -0.88 0.00 0.00 -0.47 0.00 0.00 55.73 55.02 1a4q s ARG 222 Cb -0.67 0.58 0.00 0.00 -0.57 0.00 0.00 34.95 34.29 1a4q s ARG 222 CO 0.55 -0.71 0.00 -2.37 -1.08 0.00 0.00 175.30 171.69 1a4q n THR 223 N -0.41 0.00 -0.18 4.99 5.66 -1.26 -1.70 114.28 121.37 1a4q n THR 223 Ca -0.08 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.90 1a4q n THR 223 Cb 0.61 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 69.47 1a4q n THR 223 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 1a4q h GLN 224 N 0.00 0.44 -2.01 1.09 4.20 -1.71 -3.41 115.11 113.71 1a4q h GLN 224 Ca 0.00 -0.03 -0.26 0.00 0.06 0.00 0.00 58.65 58.42 1a4q h GLN 224 Cb 0.00 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1a4q h GLN 224 CO 0.00 0.29 -0.34 0.39 -0.67 0.00 0.00 178.83 178.50 1a4q n GLU 225 N -4.94 -1.27 -3.86 1.46 -0.58 -0.12 -4.39 120.64 106.94 1a4q n GLU 225 Ca 0.07 0.64 -0.08 0.00 -0.42 0.00 0.00 57.16 57.36 1a4q n GLU 225 Cb 0.20 -4.87 -0.01 0.00 -0.57 0.00 0.00 31.44 26.20 1a4q n GLU 225 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1a4q s SER 226 N -2.44 -0.13 0.31 1.62 1.04 -1.25 -4.63 113.70 108.22 1a4q s SER 226 Ca 0.02 -0.84 -0.29 0.00 0.48 0.00 0.00 55.95 55.32 1a4q s SER 226 Cb -0.01 0.76 -0.12 0.00 0.10 0.00 0.00 66.02 66.75 1a4q s SER 226 CO 0.02 -1.45 1.42 0.00 0.98 0.00 0.00 173.24 174.22 1a4q n ALA 227 N -0.48 1.72 -1.95 5.32 0.00 -1.26 -4.26 120.51 119.60 1a4q n ALA 227 Ca -0.05 0.37 -0.29 0.00 0.00 0.00 0.00 53.44 53.47 1a4q n ALA 227 Cb 0.60 -2.34 0.19 0.00 0.00 0.00 0.00 19.45 17.90 1a4q n ALA 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a4q s ASN 229 N -4.93 1.92 -0.07 0.00 -0.87 -1.08 -4.69 114.94 105.21 1a4q s ASN 229 Ca 0.75 -0.29 0.01 0.00 -1.57 0.00 0.00 52.86 51.76 1a4q s ASN 229 Cb -0.03 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.25 40.76 1a4q s ASN 229 CO 0.53 -0.24 -0.10 0.00 -2.57 0.00 0.00 177.10 174.72 1a4q s ILE 231 N -0.60 -0.17 -1.76 0.00 2.07 0.44 -4.58 121.20 116.60 1a4q s ILE 231 Ca 0.09 0.40 0.00 0.00 -1.41 0.00 0.00 60.65 59.73 1a4q s ILE 231 Cb -0.11 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.27 1a4q s ILE 231 CO 0.02 0.17 0.00 0.61 -1.91 0.00 0.00 174.94 173.82 1a4q n GLY 232 N 5.28 1.10 0.75 1.50 0.00 -0.55 -0.67 105.19 112.61 1a4q n GLY 232 Ca -0.04 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1a4q n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4q n GLY 233 N -0.87 0.72 3.58 -0.02 0.00 -1.26 -4.99 105.19 102.35 1a4q n GLY 233 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1a4q n GLY 233 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a4q s ASP 234 N -2.60 6.19 -0.21 1.61 1.01 0.16 -4.32 116.67 118.51 1a4q s ASP 234 Ca 0.00 0.08 -0.07 0.00 0.71 0.00 0.00 52.55 53.27 1a4q s ASP 234 Cb 0.00 -2.19 -0.04 0.00 1.01 0.00 0.00 42.92 41.70 1a4q s ASP 234 CO 0.00 -0.21 0.07 0.00 0.21 0.00 0.00 175.17 175.24 1a4q s TYR 236 N 0.92 3.42 -0.07 0.00 1.51 -0.25 -0.36 117.35 122.53 1a4q s TYR 236 Ca 0.04 0.39 -0.03 0.00 -1.01 0.00 0.00 57.07 56.46 1a4q s TYR 236 Cb -0.14 -1.88 0.04 0.00 -0.11 0.00 0.00 41.96 39.87 1a4q s TYR 236 CO 0.03 0.63 0.16 -1.17 -1.11 0.00 0.00 175.55 174.08 1a4q s LEU 237 N -0.96 0.65 0.07 -1.29 2.96 -0.46 -2.65 118.68 117.01 1a4q s LEU 237 Ca 0.14 0.32 -0.19 0.00 -0.22 0.00 0.00 54.13 54.18 1a4q s LEU 237 Cb -0.12 0.39 -0.07 0.00 0.50 0.00 0.00 46.19 46.90 1a4q s LEU 237 CO 0.03 -0.15 0.56 -0.32 -1.32 0.00 0.00 176.35 175.15 1a4q s MET 238 N 1.24 4.18 0.10 1.98 -2.45 -1.26 -0.39 119.30 122.70 1a4q s MET 238 Ca -0.09 0.72 0.01 0.00 -1.25 0.00 0.00 55.69 55.08 1a4q s MET 238 Cb -0.12 -3.23 -0.04 0.00 1.25 0.00 0.00 34.83 32.69 1a4q s MET 238 CO -0.06 0.64 -0.03 0.96 1.05 0.00 0.00 175.02 177.57 1a4q s ILE 239 N -1.12 0.50 0.31 10.11 -4.36 -0.11 -3.66 121.20 122.87 1a4q s ILE 239 Ca 0.29 -1.91 -0.07 0.00 -0.26 0.00 0.00 60.65 58.70 1a4q s ILE 239 Cb -0.19 -1.74 0.00 0.00 1.25 0.00 0.00 42.46 41.78 1a4q s ILE 239 CO 0.19 -0.80 0.49 0.28 0.24 0.00 0.00 174.94 175.33 1a4q s THR 240 N -3.75 0.00 -0.22 8.37 -1.32 -0.69 -1.66 115.64 116.36 1a4q s THR 240 Ca 0.14 -1.50 -0.27 0.00 -1.21 0.00 0.00 61.69 58.85 1a4q s THR 240 Cb 0.06 -2.51 0.11 0.00 -1.51 0.00 0.00 72.50 68.65 1a4q s THR 240 CO -0.04 0.00 0.96 -0.62 -2.21 0.00 0.00 174.62 172.71 1a4q s ASP 241 N -3.15 -0.47 0.00 8.08 -1.08 -1.26 -1.11 116.67 117.68 1a4q s ASP 241 Ca 0.27 0.77 0.00 0.00 -0.52 0.00 0.00 52.55 53.07 1a4q s ASP 241 Cb -0.01 0.73 0.00 0.00 -1.46 0.00 0.00 42.92 42.18 1a4q s ASP 241 CO 0.15 -0.26 0.00 0.61 0.52 0.00 0.00 175.17 176.19 1a4q n GLY 242 N 1.69 0.06 3.70 2.66 0.00 -0.42 -4.00 105.19 108.89 1a4q n GLY 242 Ca -0.12 -2.29 -0.42 0.00 0.00 0.00 0.00 46.02 43.19 1a4q n GLY 242 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1a4q s SER 243 N -3.69 6.83 0.15 1.61 0.15 -0.09 -4.78 113.70 113.89 1a4q s SER 243 Ca 0.00 2.24 0.22 0.00 0.70 0.00 0.00 55.95 59.11 1a4q s SER 243 Cb 0.00 -2.57 0.88 0.00 -1.71 0.00 0.00 66.02 62.61 1a4q s SER 243 CO 0.00 -0.69 1.67 0.00 1.20 0.00 0.00 173.24 175.43 1a4q n ALA 244 N 4.62 1.82 0.37 5.45 0.00 -1.26 -2.90 120.51 128.62 1a4q n ALA 244 Ca 0.12 0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.61 1a4q n ALA 244 Cb 0.43 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.49 1a4q n ALA 244 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1a4q n SER 245 N -1.96 0.66 0.00 0.00 7.64 -1.26 -4.22 113.62 114.47 1a4q n SER 245 Ca 0.03 -0.83 0.00 0.00 1.01 0.00 0.00 58.87 59.09 1a4q n SER 245 Cb 0.25 0.79 0.00 0.00 -1.01 0.00 0.00 64.21 64.25 1a4q n SER 245 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a4q n GLY 246 N 1.04 2.64 3.80 0.23 0.00 -1.14 -4.79 105.19 106.97 1a4q n GLY 246 Ca 0.02 -0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 1a4q n GLY 246 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4q s ILE 247 N 2.64 5.39 -0.31 -0.61 1.01 -1.26 -4.77 121.20 123.29 1a4q s ILE 247 Ca 0.00 0.34 -0.02 0.00 0.00 0.00 0.00 60.65 60.97 1a4q s ILE 247 Cb 0.00 -3.50 0.11 0.00 0.01 0.00 0.00 42.46 39.08 1a4q s ILE 247 CO 0.00 0.52 0.13 -0.44 0.00 0.00 0.00 174.94 175.15 1a4q s SER 248 N -0.37 3.69 -0.33 3.58 0.01 0.43 -0.91 113.70 119.79 1a4q s SER 248 Ca 0.14 -1.59 -0.23 0.00 1.31 0.00 0.00 55.95 55.59 1a4q s SER 248 Cb -0.12 -0.60 0.00 0.00 0.21 0.00 0.00 66.02 65.51 1a4q s SER 248 CO 0.03 -0.41 0.75 -0.54 0.41 0.00 0.00 173.24 173.49 1a4q s LYS 249 N 1.71 3.86 0.76 12.44 1.02 -1.26 -3.35 119.74 134.93 1a4q s LYS 249 Ca 0.11 0.41 -0.09 0.00 0.02 0.00 0.00 55.97 56.41 1a4q s LYS 249 Cb -0.18 -3.76 0.08 0.00 -0.52 0.00 0.00 37.83 33.45 1a4q s LYS 249 CO -0.27 -0.73 1.10 0.00 -0.92 0.00 0.00 175.35 174.53 1a4q s ARG 251 N -5.41 0.92 -0.05 0.00 0.52 -0.67 -4.49 118.95 109.78 1a4q s ARG 251 Ca 0.62 -0.92 0.05 0.00 -0.52 0.00 0.00 55.73 54.95 1a4q s ARG 251 Cb -0.10 0.37 -0.02 0.00 0.52 0.00 0.00 34.95 35.72 1a4q s ARG 251 CO 0.47 -0.32 -0.19 -0.06 0.02 0.00 0.00 175.30 175.23 1a4q s PHE 252 N -3.86 2.58 -0.07 -0.53 0.40 -0.63 -0.93 117.98 114.95 1a4q s PHE 252 Ca 0.06 -0.35 -0.01 0.00 -0.60 0.00 0.00 56.93 56.02 1a4q s PHE 252 Cb 0.04 -1.61 -0.03 0.00 0.51 0.00 0.00 43.02 41.92 1a4q s PHE 252 CO -0.10 0.04 0.01 -0.51 0.70 0.00 0.00 175.22 175.35 1a4q s LEU 253 N -0.52 3.59 -0.30 -0.37 1.43 0.47 -0.77 118.68 122.22 1a4q s LEU 253 Ca 0.07 0.12 -0.08 0.00 -1.03 0.00 0.00 54.13 53.21 1a4q s LEU 253 Cb -0.11 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1a4q s LEU 253 CO 0.01 0.36 0.11 -0.75 0.23 0.00 0.00 176.35 176.30 1a4q s LYS 254 N -1.04 3.21 -0.11 1.70 2.20 -0.36 -1.35 119.74 124.00 1a4q s LYS 254 Ca 0.15 -0.79 0.02 0.00 -0.36 0.00 0.00 55.97 55.00 1a4q s LYS 254 Cb -0.11 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.76 1a4q s LYS 254 CO 0.04 -0.42 -0.20 0.42 -0.36 0.00 0.00 175.35 174.83 1a4q s ILE 255 N 1.55 2.43 -0.07 5.43 1.01 0.51 -0.32 121.20 131.73 1a4q s ILE 255 Ca 0.04 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.81 1a4q s ILE 255 Cb -0.17 -1.96 0.02 0.00 0.01 0.00 0.00 42.46 40.36 1a4q s ILE 255 CO 0.04 0.55 -0.08 -0.60 0.00 0.00 0.00 174.94 174.85 1a4q s ARG 256 N 0.34 1.32 -1.60 2.79 3.52 -0.09 -0.59 118.95 124.64 1a4q s ARG 256 Ca -0.16 -0.24 -0.12 0.00 -0.13 0.00 0.00 55.73 55.07 1a4q s ARG 256 Cb -0.17 -1.25 0.10 0.00 -1.56 0.00 0.00 34.95 32.07 1a4q s ARG 256 CO 0.08 -0.10 0.68 0.39 -0.81 0.00 0.00 175.30 175.53 1a4q n GLU 257 N 4.26 -3.35 -0.92 5.12 1.02 -1.26 -1.57 120.64 123.94 1a4q n GLU 257 Ca -0.20 0.39 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 1a4q n GLU 257 Cb 0.51 -4.92 0.00 0.00 -0.02 0.00 0.00 31.44 27.00 1a4q n GLU 257 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4q n GLY 258 N -1.63 0.85 3.30 0.62 0.00 -1.26 -4.89 105.19 102.18 1a4q n GLY 258 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 1a4q n GLY 258 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a4q s ARG 259 N -0.08 2.72 -0.16 1.61 0.52 -0.61 -3.94 118.95 119.00 1a4q s ARG 259 Ca 0.00 -0.85 -0.29 0.00 -0.52 0.00 0.00 55.73 54.07 1a4q s ARG 259 Cb 0.00 -2.26 -0.04 0.00 0.52 0.00 0.00 34.95 33.17 1a4q s ARG 259 CO 0.00 0.36 1.65 0.42 0.02 0.00 0.00 175.30 177.75 1a4q s ILE 260 N -0.09 3.64 -1.13 1.52 1.01 -1.26 -0.91 121.20 123.98 1a4q s ILE 260 Ca -0.05 0.74 0.11 0.00 0.00 0.00 0.00 60.65 61.46 1a4q s ILE 260 Cb -0.14 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1a4q s ILE 260 CO 0.04 -0.20 0.72 2.30 0.00 0.00 0.00 174.94 177.80 1a4q n ILE 261 N 6.13 0.00 -3.58 2.92 -5.35 0.56 -4.96 119.36 115.09 1a4q n ILE 261 Ca 0.19 -0.41 -0.12 0.00 -0.27 0.00 0.00 62.75 62.14 1a4q n ILE 261 Cb 0.44 1.16 -0.06 0.00 -1.74 0.00 0.00 39.64 39.44 1a4q n ILE 261 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1a4q s LYS 262 N -1.38 0.69 -0.14 6.28 2.20 -1.15 -4.99 119.74 121.26 1a4q s LYS 262 Ca 0.10 0.29 0.02 0.00 -0.36 0.00 0.00 55.97 56.02 1a4q s LYS 262 Cb 0.09 0.33 0.01 0.00 -1.51 0.00 0.00 37.83 36.75 1a4q s LYS 262 CO 0.26 -0.19 -0.20 -1.21 -0.36 0.00 0.00 175.35 173.64 1a4q s GLU 263 N -0.82 2.88 -0.22 4.03 2.02 -1.26 -1.22 118.70 124.11 1a4q s GLU 263 Ca -0.03 -0.80 -0.06 0.00 0.02 0.00 0.00 54.97 54.10 1a4q s GLU 263 Cb -0.01 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.82 1a4q s GLU 263 CO 0.02 -0.06 0.03 0.42 0.02 0.00 0.00 175.26 175.69 1a4q s ILE 264 N 0.94 4.14 -0.43 -1.63 1.01 0.05 -4.99 121.20 120.29 1a4q s ILE 264 Ca -0.05 -0.24 -0.14 0.00 0.00 0.00 0.00 60.65 60.22 1a4q s ILE 264 Cb -0.15 -2.89 0.04 0.00 0.01 0.00 0.00 42.46 39.47 1a4q s ILE 264 CO -0.04 0.40 0.31 -0.36 0.00 0.00 0.00 174.94 175.25 1a4q s PHE 265 N 1.17 3.25 0.99 3.97 0.40 -1.26 -1.60 117.98 124.90 1a4q s PHE 265 Ca 0.04 -0.83 -0.12 0.00 -0.60 0.00 0.00 56.93 55.42 1a4q s PHE 265 Cb -0.14 -2.78 0.18 0.00 0.51 0.00 0.00 43.02 40.79 1a4q s PHE 265 CO 0.02 -0.69 1.08 -2.14 0.70 0.00 0.00 175.22 174.20 1a4q s PRO 266 N 1.63 0.48 0.25 0.24 0.02 -1.26 -4.66 135.00 131.70 1a4q s PRO 266 Ca 0.04 0.98 0.08 0.00 0.02 0.00 0.00 61.00 62.12 1a4q s PRO 266 Cb -0.21 -1.71 -0.05 0.00 0.02 0.00 0.00 34.50 32.55 1a4q s PRO 266 CO 0.08 -2.82 -0.12 0.99 -0.33 0.00 0.00 177.00 174.80 1a4q s THR 267 N -2.72 1.83 0.00 0.99 2.01 0.03 -4.95 115.64 112.83 1a4q s THR 267 Ca 0.66 -2.21 0.00 0.00 0.31 0.00 0.00 61.69 60.45 1a4q s THR 267 Cb -0.21 -2.24 0.00 0.00 0.01 0.00 0.00 72.50 70.06 1a4q s THR 267 CO 0.60 -0.46 0.00 0.61 -0.69 0.00 0.00 174.62 174.68 1a4q n GLY 268 N -0.50 0.93 3.48 4.40 0.00 -1.26 -0.92 105.19 111.32 1a4q n GLY 268 Ca -0.07 -1.29 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 1a4q n GLY 268 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1a4q s ARG 269 N 0.00 3.79 0.00 1.61 3.52 0.48 -4.77 118.95 123.57 1a4q s ARG 269 Ca 0.00 -1.95 0.14 0.00 -0.13 0.00 0.00 55.73 53.79 1a4q s ARG 269 Cb 0.00 -5.08 0.33 0.00 -1.56 0.00 0.00 34.95 28.64 1a4q s ARG 269 CO 0.00 -1.87 1.24 1.33 -0.81 0.00 0.00 175.30 175.19 1a4q n VAL 270 N 5.49 0.78 0.13 7.11 0.24 -1.26 -4.60 118.33 126.22 1a4q n VAL 270 Ca 0.31 -0.89 -0.00 0.00 -2.04 0.00 0.00 64.34 61.72 1a4q n VAL 270 Cb 0.47 0.68 0.26 0.00 -1.47 0.00 0.00 33.84 33.78 1a4q n VAL 270 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1a4q h GLU 271 N 2.66 0.11 -0.95 7.34 9.09 -1.86 -3.35 114.58 127.61 1a4q h GLU 271 Ca 0.00 -0.05 -0.00 0.00 0.05 0.00 0.00 59.36 59.35 1a4q h GLU 271 Cb 0.75 -0.00 -0.20 0.00 -1.65 0.00 0.00 28.75 27.65 1a4q h GLU 271 CO 0.00 0.53 -0.39 -1.58 0.05 0.00 0.00 179.01 177.62 1a4q s HIS 272 N -4.04 -1.71 -0.13 2.06 5.04 -1.22 -0.43 115.29 114.86 1a4q s HIS 272 Ca -0.03 0.63 0.01 0.00 -1.54 0.00 0.00 55.06 54.13 1a4q s HIS 272 Cb 0.14 0.30 0.02 0.00 0.04 0.00 0.00 32.58 33.08 1a4q s HIS 272 CO 0.75 -1.08 -0.13 0.99 -2.34 0.00 0.00 174.74 172.94 1a4q s THR 273 N 2.34 1.46 0.14 0.89 2.01 -1.21 -4.26 115.64 117.02 1a4q s THR 273 Ca 0.14 -0.58 0.09 0.00 0.31 0.00 0.00 61.69 61.65 1a4q s THR 273 Cb -0.06 -1.38 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 1a4q s THR 273 CO -0.17 0.44 -0.21 -1.61 -0.69 0.00 0.00 174.62 172.39 1a4q s GLU 274 N 1.40 1.26 -1.24 4.92 0.41 0.19 -4.70 118.70 120.95 1a4q s GLU 274 Ca 0.02 -1.33 -0.25 0.00 -0.41 0.00 0.00 54.97 53.00 1a4q s GLU 274 Cb -0.13 -1.47 0.03 0.00 -1.78 0.00 0.00 34.13 30.79 1a4q s GLU 274 CO -0.08 0.32 0.46 0.39 -0.49 0.00 0.00 175.26 175.86 1a4q n GLU 275 N 0.62 -0.43 -2.13 1.61 1.02 -1.26 -0.83 120.64 119.24 1a4q n GLU 275 Ca -0.16 0.04 -0.41 0.00 -0.02 0.00 0.00 57.16 56.61 1a4q n GLU 275 Cb 0.55 -2.56 -0.02 0.00 -0.02 0.00 0.00 31.44 29.39 1a4q n GLU 275 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1a4q s THR 277 N -0.62 4.50 0.21 0.00 2.01 -0.44 -4.73 115.64 116.56 1a4q s THR 277 Ca 0.53 -0.68 0.10 0.00 0.31 0.00 0.00 61.69 61.95 1a4q s THR 277 Cb -0.39 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 1a4q s THR 277 CO 0.47 -0.08 -0.12 0.00 -0.69 0.00 0.00 174.62 174.20 1a4q s GLY 279 N -3.02 -0.28 -0.09 0.00 0.00 -0.53 -4.93 107.32 98.48 1a4q s GLY 279 Ca 0.26 0.30 -0.29 0.00 0.00 0.00 0.00 44.72 44.99 1a4q s GLY 279 CO 0.15 0.06 0.99 -1.36 0.00 0.00 0.00 173.10 172.94 1a4q s PHE 280 N -3.21 3.54 -0.13 1.90 0.08 -1.26 -1.24 117.98 117.66 1a4q s PHE 280 Ca 0.11 1.59 0.16 0.00 0.12 0.00 0.00 56.93 58.91 1a4q s PHE 280 Cb -0.01 -3.16 -0.05 0.00 -0.57 0.00 0.00 43.02 39.23 1a4q s PHE 280 CO 0.00 -0.18 1.12 0.00 -0.10 0.00 0.00 175.22 176.06 1a4q h ALA 281 N 7.05 0.65 -2.33 5.36 0.00 -0.96 -3.44 119.26 125.58 1a4q h ALA 281 Ca -0.33 -0.66 0.09 0.00 0.00 0.00 0.00 54.91 54.01 1a4q h ALA 281 Cb 1.16 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1a4q h ALA 281 CO 0.83 0.79 0.37 -1.13 0.00 0.00 0.00 179.25 180.11 1a4q n SER 282 N -3.05 -1.27 0.15 0.00 3.41 -1.14 -4.89 113.62 106.82 1a4q n SER 282 Ca -0.04 -1.72 0.12 0.00 -0.26 0.00 0.00 58.87 56.98 1a4q n SER 282 Cb 0.79 2.08 0.53 0.00 -0.26 0.00 0.00 64.21 67.35 1a4q n SER 282 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1a4q n ASN 283 N -1.13 0.68 -0.00 4.04 3.02 -1.26 -3.19 115.26 117.42 1a4q n ASN 283 Ca -0.02 0.70 0.07 0.00 -0.03 0.00 0.00 54.58 55.30 1a4q n ASN 283 Cb 0.41 -0.83 -0.09 0.00 -0.61 0.00 0.00 39.78 38.65 1a4q n ASN 283 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1a4q n LYS 284 N -2.29 1.75 -3.76 3.52 4.81 -1.26 -4.86 118.16 116.06 1a4q n LYS 284 Ca 0.01 -0.03 -0.14 0.00 -0.87 0.00 0.00 58.31 57.28 1a4q n LYS 284 Cb 0.19 -1.24 -0.15 0.00 0.02 0.00 0.00 35.03 33.84 1a4q n LYS 284 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1a4q s THR 285 N -2.54 -0.06 -0.07 3.15 2.01 -1.19 -1.64 115.64 115.29 1a4q s THR 285 Ca 0.03 0.20 -0.03 0.00 0.31 0.00 0.00 61.69 62.20 1a4q s THR 285 Cb 0.11 -0.13 -0.04 0.00 0.01 0.00 0.00 72.50 72.45 1a4q s THR 285 CO 0.62 0.08 0.08 -0.63 -0.69 0.00 0.00 174.62 174.08 1a4q s ILE 286 N 1.09 4.89 0.08 1.82 1.01 -0.19 -0.25 121.20 129.65 1a4q s ILE 286 Ca -0.09 -0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.51 1a4q s ILE 286 Cb -0.12 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.18 1a4q s ILE 286 CO -0.04 0.54 -0.19 -1.61 0.00 0.00 0.00 174.94 173.64 1a4q s GLU 287 N -1.19 1.05 0.01 2.79 2.02 -0.37 -0.49 118.70 122.51 1a4q s GLU 287 Ca 0.17 -1.06 -0.01 0.00 0.02 0.00 0.00 54.97 54.09 1a4q s GLU 287 Cb -0.12 -1.21 -0.01 0.00 0.10 0.00 0.00 34.13 32.89 1a4q s GLU 287 CO 0.07 0.28 0.01 0.00 0.02 0.00 0.00 175.26 175.64 1a4q s ALA 289 N -0.98 2.53 0.37 0.00 0.00 -0.32 -0.71 121.76 122.66 1a4q s ALA 289 Ca -0.11 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.87 1a4q s ALA 289 Cb -0.07 -1.21 -0.00 0.00 0.00 0.00 0.00 23.12 21.84 1a4q s ALA 289 CO -0.00 0.07 0.02 0.00 0.00 0.00 0.00 175.76 175.85 1a4q s ARG 291 N -3.36 2.89 -0.35 0.00 3.52 -0.01 -3.67 118.95 117.98 1a4q s ARG 291 Ca 0.03 -0.79 -0.10 0.00 -0.13 0.00 0.00 55.73 54.74 1a4q s ARG 291 Cb 0.00 -2.38 0.02 0.00 -1.56 0.00 0.00 34.95 31.03 1a4q s ARG 291 CO 0.02 0.35 0.18 0.34 -0.81 0.00 0.00 175.30 175.38 1a4q s ASP 292 N -0.03 5.62 0.00 -2.12 -1.08 -1.26 0.57 116.67 118.37 1a4q s ASP 292 Ca -0.05 -0.83 0.31 0.00 -0.52 0.00 0.00 52.55 51.46 1a4q s ASP 292 Cb -0.14 -2.00 1.75 0.00 -1.46 0.00 0.00 42.92 41.06 1a4q s ASP 292 CO 0.05 -0.31 2.15 -3.20 0.52 0.00 0.00 175.17 174.37 1a4q n ASN 293 N 4.98 0.15 0.00 -0.34 5.15 -1.26 -4.40 115.26 119.54 1a4q n ASN 293 Ca -0.13 -0.90 0.00 0.00 -0.60 0.00 0.00 54.58 52.95 1a4q n ASN 293 Cb 0.47 -0.04 0.00 0.00 -0.53 0.00 0.00 39.78 39.68 1a4q n ASN 293 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1a4q n SER 294 N -0.94 3.12 -0.02 1.20 7.64 -1.25 -0.56 113.62 122.82 1a4q n SER 294 Ca 0.22 0.00 0.03 0.00 1.01 0.00 0.00 58.87 60.13 1a4q n SER 294 Cb 0.16 0.24 -0.09 0.00 -1.01 0.00 0.00 64.21 63.51 1a4q n SER 294 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1a4q n TYR 295 N -1.69 0.00 -3.68 1.43 4.01 -1.23 -2.90 117.16 113.11 1a4q n TYR 295 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1a4q n TYR 295 Cb 0.33 -0.31 -0.06 0.00 -0.31 0.00 0.00 39.34 38.99 1a4q n TYR 295 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1a4q s THR 296 N -2.66 0.06 -2.18 -0.72 -1.32 -1.18 -4.44 115.64 103.21 1a4q s THR 296 Ca -0.04 -0.52 0.24 0.00 -1.21 0.00 0.00 61.69 60.16 1a4q s THR 296 Cb 0.06 -0.99 0.13 0.00 -1.51 0.00 0.00 72.50 70.19 1a4q s THR 296 CO 0.45 -0.29 1.27 0.00 -2.21 0.00 0.00 174.62 173.85 1a4q n ALA 297 N 0.39 3.19 -1.77 11.08 0.00 -1.26 -4.55 120.51 127.59 1a4q n ALA 297 Ca -0.18 -0.59 -0.38 0.00 0.00 0.00 0.00 53.44 52.29 1a4q n ALA 297 Cb 0.60 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 19.12 1a4q n ALA 297 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1a4q s LYS 298 N -2.36 4.40 0.00 0.00 1.02 -1.26 -2.43 119.74 119.10 1a4q s LYS 298 Ca 0.23 1.66 -0.25 0.00 0.02 0.00 0.00 55.97 57.63 1a4q s LYS 298 Cb 0.19 -2.87 -0.05 0.00 -0.52 0.00 0.00 37.83 34.58 1a4q s LYS 298 CO 0.50 0.03 0.77 1.03 -0.92 0.00 0.00 175.35 176.76 1a4q s ARG 299 N -1.96 4.48 0.21 1.68 0.52 -1.26 -4.64 118.95 117.98 1a4q s ARG 299 Ca 0.51 1.04 -0.32 0.00 -0.52 0.00 0.00 55.73 56.44 1a4q s ARG 299 Cb -0.27 -3.40 -0.13 0.00 0.52 0.00 0.00 34.95 31.66 1a4q s ARG 299 CO 0.35 0.17 1.55 -2.30 0.02 0.00 0.00 175.30 175.08 1a4q n PRO 300 N 3.28 2.26 -4.23 3.54 -0.02 -1.24 -0.94 135.00 137.65 1a4q n PRO 300 Ca -0.01 0.81 -0.31 0.00 -2.02 0.00 0.00 63.50 61.97 1a4q n PRO 300 Cb 0.51 -2.56 -0.16 0.00 -0.02 0.00 0.00 33.50 31.26 1a4q n PRO 300 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1a4q s PHE 301 N 0.54 2.35 -0.16 6.00 2.19 0.02 -0.17 117.98 128.75 1a4q s PHE 301 Ca 0.73 -1.28 -0.07 0.00 0.33 0.00 0.00 56.93 56.64 1a4q s PHE 301 Cb -0.63 -1.67 -0.04 0.00 -1.31 0.00 0.00 43.02 39.37 1a4q s PHE 301 CO 0.42 -0.66 0.09 0.08 1.83 0.00 0.00 175.22 176.98 1a4q s VAL 302 N 1.24 5.06 -0.17 3.12 1.01 0.12 -2.16 120.40 128.62 1a4q s VAL 302 Ca 0.01 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.05 1a4q s VAL 302 Cb -0.14 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.01 1a4q s VAL 302 CO -0.08 0.52 -0.18 -0.54 0.00 0.00 0.00 175.10 174.81 1a4q s LYS 303 N -0.18 3.07 -0.14 2.72 1.02 -0.82 -1.27 119.74 124.14 1a4q s LYS 303 Ca 0.09 -0.81 0.01 0.00 0.02 0.00 0.00 55.97 55.28 1a4q s LYS 303 Cb -0.12 -2.58 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 1a4q s LYS 303 CO 0.01 -0.11 -0.15 -1.17 -0.92 0.00 0.00 175.35 173.01 1a4q s LEU 304 N 1.08 1.72 -0.31 3.17 0.20 0.35 -1.54 118.68 123.36 1a4q s LEU 304 Ca -0.00 -0.48 -0.21 0.00 0.69 0.00 0.00 54.13 54.13 1a4q s LEU 304 Cb -0.14 -1.17 -0.00 0.00 -0.43 0.00 0.00 46.19 44.44 1a4q s LEU 304 CO -0.07 -0.03 0.68 0.21 -0.29 0.00 0.00 176.35 176.86 1a4q s ASN 305 N 1.31 6.54 0.42 3.68 3.84 0.37 -1.03 114.94 130.06 1a4q s ASN 305 Ca 0.01 0.47 0.22 0.00 0.21 0.00 0.00 52.86 53.77 1a4q s ASN 305 Cb -0.14 -2.35 0.82 0.00 -0.55 0.00 0.00 41.25 39.03 1a4q s ASN 305 CO -0.08 -0.54 1.79 0.58 -2.79 0.00 0.00 177.10 176.06 1a4q h VAL 306 N 5.58 0.66 0.16 -5.21 2.07 -1.61 0.17 116.25 118.08 1a4q h VAL 306 Ca -0.26 -1.27 -0.31 0.00 0.82 0.00 0.00 66.70 65.68 1a4q h VAL 306 Cb 1.11 1.83 0.01 0.00 -1.52 0.00 0.00 31.29 32.72 1a4q h VAL 306 CO 0.83 0.27 -1.46 -0.33 0.02 0.00 0.00 177.57 176.90 1a4q h GLU 307 N 0.00 0.35 0.00 1.57 5.08 -1.91 -3.33 114.58 116.34 1a4q h GLU 307 Ca -0.00 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 57.77 1a4q h GLU 307 Cb 0.81 0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1a4q h GLU 307 CO 0.04 1.25 -1.12 0.25 -1.00 0.00 0.00 179.01 178.43 1a4q n THR 308 N -3.56 0.13 -3.45 1.13 -2.24 -1.21 -5.00 114.28 100.07 1a4q n THR 308 Ca -0.15 -0.24 -0.20 0.00 -2.27 0.00 0.00 64.05 61.20 1a4q n THR 308 Cb 1.06 0.29 0.06 0.00 -2.10 0.00 0.00 70.33 69.64 1a4q n THR 308 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1a4q n ASP 309 N -1.93 -4.62 -4.17 3.42 8.00 0.04 -5.03 116.55 112.26 1a4q n ASP 309 Ca 0.02 -0.78 -0.20 0.00 0.71 0.00 0.00 54.79 54.54 1a4q n ASP 309 Cb 0.44 -4.61 -0.13 0.00 -0.02 0.00 0.00 41.12 36.80 1a4q n ASP 309 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1a4q s THR 310 N -3.45 1.17 0.02 -3.53 -4.23 -1.13 -4.83 115.64 99.65 1a4q s THR 310 Ca 0.30 -1.16 0.02 0.00 -1.18 0.00 0.00 61.69 59.68 1a4q s THR 310 Cb -0.06 -1.08 -0.02 0.00 1.34 0.00 0.00 72.50 72.68 1a4q s THR 310 CO 0.78 -0.08 -0.06 0.00 -0.54 0.00 0.00 174.62 174.71 1a4q s ALA 311 N -1.03 0.48 0.02 3.99 0.00 -1.26 -0.48 121.76 123.48 1a4q s ALA 311 Ca 0.01 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 51.46 1a4q s ALA 311 Cb -0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1a4q s ALA 311 CO 0.02 0.02 -0.13 -2.00 0.00 0.00 0.00 175.76 173.66 1a4q s GLU 312 N -1.03 0.95 -0.04 0.00 2.12 -0.59 -0.79 118.70 119.32 1a4q s GLU 312 Ca -0.06 -0.65 0.04 0.00 0.36 0.00 0.00 54.97 54.66 1a4q s GLU 312 Cb -0.07 -0.94 -0.00 0.00 0.26 0.00 0.00 34.13 33.38 1a4q s GLU 312 CO 0.00 0.24 -0.16 0.42 -0.54 0.00 0.00 175.26 175.22 1a4q s ILE 313 N -0.66 1.33 0.08 -3.70 1.01 -0.09 -1.94 121.20 117.22 1a4q s ILE 313 Ca 0.02 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 59.93 1a4q s ILE 313 Cb -0.07 -1.14 -0.01 0.00 0.01 0.00 0.00 42.46 41.25 1a4q s ILE 313 CO 0.01 0.39 0.17 -0.13 0.00 0.00 0.00 174.94 175.37 1a4q s ARG 314 N 0.04 0.82 0.57 2.79 1.81 -0.92 -0.39 118.95 123.67 1a4q s ARG 314 Ca -0.03 -0.98 -0.19 0.00 -1.72 0.00 0.00 55.73 52.81 1a4q s ARG 314 Cb -0.11 0.33 -0.05 0.00 -0.45 0.00 0.00 34.95 34.67 1a4q s ARG 314 CO 0.02 -0.25 1.15 -0.51 -0.68 0.00 0.00 175.30 175.03 1a4q s LEU 315 N -2.86 3.70 0.10 2.53 1.43 -1.26 -0.80 118.68 121.53 1a4q s LEU 315 Ca 0.05 2.23 -0.31 0.00 -1.03 0.00 0.00 54.13 55.07 1a4q s LEU 315 Cb 0.05 -4.58 -0.08 0.00 0.03 0.00 0.00 46.19 41.60 1a4q s LEU 315 CO -0.11 -1.36 1.54 -0.04 0.23 0.00 0.00 176.35 176.62 1a4q s MET 316 N -3.34 4.24 0.34 1.70 -1.94 -0.11 -4.45 119.30 115.72 1a4q s MET 316 Ca 0.74 2.25 0.23 0.00 -1.71 0.00 0.00 55.69 57.20 1a4q s MET 316 Cb -0.26 -3.39 0.30 0.00 2.01 0.00 0.00 34.83 33.50 1a4q s MET 316 CO 0.30 -0.62 1.47 0.00 -0.01 0.00 0.00 175.02 176.15 1a4q n THR 318 N -2.85 1.58 0.37 0.00 5.66 -0.88 -4.17 114.28 113.99 1a4q n THR 318 Ca 0.03 -0.40 0.10 0.00 -3.05 0.00 0.00 64.05 60.74 1a4q n THR 318 Cb 0.52 -1.20 0.44 0.00 -1.55 0.00 0.00 70.33 68.54 1a4q n THR 318 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1a4q n GLU 319 N 1.15 0.13 -2.39 1.09 0.28 -0.29 -3.99 120.64 116.61 1a4q n GLU 319 Ca 0.10 0.41 -0.43 0.00 -0.16 0.00 0.00 57.16 57.08 1a4q n GLU 319 Cb 0.31 -1.78 0.00 0.00 1.43 0.00 0.00 31.44 31.41 1a4q n GLU 319 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1a4q n THR 320 N -2.03 3.92 -1.86 3.84 -1.04 -1.26 -2.35 114.28 113.49 1a4q n THR 320 Ca 0.02 -3.97 -0.42 0.00 -2.04 0.00 0.00 64.05 57.64 1a4q n THR 320 Cb 0.18 -2.44 -0.03 0.00 -1.82 0.00 0.00 70.33 66.22 1a4q n THR 320 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1a4q s TYR 321 N 3.02 2.70 -2.11 -1.42 2.02 -1.26 -4.90 117.35 115.41 1a4q s TYR 321 Ca 0.48 0.39 0.25 0.00 -0.37 0.00 0.00 57.07 57.82 1a4q s TYR 321 Cb 0.06 -4.01 0.39 0.00 -0.40 0.00 0.00 41.96 38.00 1a4q s TYR 321 CO 0.01 -3.93 1.34 1.28 -1.57 0.00 0.00 175.55 172.69 1a4q n LEU 322 N 4.72 1.75 -4.93 -1.29 4.77 -1.22 -4.96 117.00 115.86 1a4q n LEU 322 Ca 0.15 -0.59 -0.26 0.00 -0.03 0.00 0.00 56.01 55.28 1a4q n LEU 322 Cb 0.38 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.50 1a4q n LEU 322 CO 0.63 0.32 0.62 -0.62 -1.33 0.00 0.00 177.39 177.00 1a4q s ASP 323 N -2.37 4.94 -0.06 -1.43 2.15 -1.02 -4.68 116.67 114.20 1a4q s ASP 323 Ca 0.24 0.53 -0.00 0.00 0.43 0.00 0.00 52.55 53.74 1a4q s ASP 323 Cb 0.19 -1.23 0.03 0.00 -0.30 0.00 0.00 42.92 41.61 1a4q s ASP 323 CO 0.50 -1.52 -0.02 -0.89 -0.17 0.00 0.00 175.17 173.07 1a4q s THR 324 N -3.23 0.44 1.08 1.71 2.01 -1.26 -4.19 115.64 112.19 1a4q s THR 324 Ca 0.59 0.02 -0.14 0.00 0.31 0.00 0.00 61.69 62.48 1a4q s THR 324 Cb -0.11 -0.54 0.23 0.00 0.01 0.00 0.00 72.50 72.09 1a4q s THR 324 CO 0.45 0.24 1.08 -2.16 -0.69 0.00 0.00 174.62 173.55 1a4q s PRO 325 N 1.53 -0.21 0.08 4.92 0.04 -1.26 -2.52 135.00 137.57 1a4q s PRO 325 Ca -0.02 0.42 -0.26 0.00 0.04 0.00 0.00 61.00 61.18 1a4q s PRO 325 Cb -0.13 -1.67 0.07 0.00 0.04 0.00 0.00 34.50 32.81 1a4q s PRO 325 CO -0.03 -3.14 0.63 -0.98 0.04 0.00 0.00 177.00 173.52 1a4q s ARG 326 N -4.98 1.19 0.93 4.56 1.70 -0.72 -4.67 118.95 116.98 1a4q s ARG 326 Ca 0.67 -0.20 -0.15 0.00 -0.47 0.00 0.00 55.73 55.59 1a4q s ARG 326 Cb -0.18 0.55 0.21 0.00 -0.57 0.00 0.00 34.95 34.97 1a4q s ARG 326 CO 0.58 -0.47 1.27 -0.35 -1.08 0.00 0.00 175.30 175.25 1a4q n PRO 327 N 0.10 -1.15 -1.83 3.89 -0.04 -1.26 -4.75 135.00 129.96 1a4q n PRO 327 Ca -0.18 -2.09 -0.36 0.00 -0.04 0.00 0.00 63.50 60.84 1a4q n PRO 327 Cb 0.62 -1.27 0.05 0.00 -0.04 0.00 0.00 33.50 32.86 1a4q n PRO 327 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1a4q s ASP 328 N -5.69 4.83 0.41 3.54 1.01 -1.26 -4.92 116.67 114.59 1a4q s ASP 328 Ca 0.73 2.48 -0.26 0.00 0.71 0.00 0.00 52.55 56.21 1a4q s ASP 328 Cb -0.02 -2.61 -0.10 0.00 1.01 0.00 0.00 42.92 41.20 1a4q s ASP 328 CO 0.51 -1.84 1.38 0.47 0.21 0.00 0.00 175.17 175.90 1a4q n ASP 329 N -1.85 3.14 0.00 0.27 8.00 -1.26 -2.02 116.55 122.83 1a4q n ASP 329 Ca 0.15 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.80 1a4q n ASP 329 Cb 0.49 -1.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 1a4q n ASP 329 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a4q n GLY 330 N 0.64 0.74 0.03 0.44 0.00 -0.99 -4.86 105.19 101.18 1a4q n GLY 330 Ca 0.04 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.21 1a4q n GLY 330 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4q n SER 331 N 0.00 0.12 -4.55 1.61 3.41 -0.86 -4.69 113.62 108.67 1a4q n SER 331 Ca 0.00 -0.18 -0.42 0.00 -0.26 0.00 0.00 58.87 58.01 1a4q n SER 331 Cb 0.00 -0.24 -0.07 0.00 -0.26 0.00 0.00 64.21 63.64 1a4q n SER 331 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1a4q s ILE 332 N -2.61 4.90 0.53 -1.33 1.01 -1.26 -5.00 121.20 117.45 1a4q s ILE 332 Ca 0.27 0.34 -0.06 0.00 0.00 0.00 0.00 60.65 61.19 1a4q s ILE 332 Cb 0.20 -4.10 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 1a4q s ILE 332 CO 0.48 -0.40 0.85 0.42 0.00 0.00 0.00 174.94 176.29 1a4q s THR 333 N 2.66 4.51 0.00 2.92 -4.23 -1.26 -4.97 115.64 115.27 1a4q s THR 333 Ca 0.22 0.21 0.00 0.00 -1.18 0.00 0.00 61.69 60.94 1a4q s THR 333 Cb -0.15 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 69.95 1a4q s THR 333 CO 0.16 -0.77 0.00 0.61 -0.54 0.00 0.00 174.62 174.08 1a4q n GLY 334 N -2.41 -2.86 3.51 3.99 0.00 -1.26 -4.82 105.19 101.34 1a4q n GLY 334 Ca 0.02 -2.03 -0.28 0.00 0.00 0.00 0.00 46.02 43.73 1a4q n GLY 334 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a4q s PRO 335 N -0.46 -0.75 0.37 1.61 0.04 -1.26 -4.84 135.00 129.72 1a4q s PRO 335 Ca 0.00 0.83 0.16 0.00 0.04 0.00 0.00 61.00 62.03 1a4q s PRO 335 Cb 0.00 -1.57 1.04 0.00 0.04 0.00 0.00 34.50 34.01 1a4q s PRO 335 CO 0.00 -3.61 1.75 0.00 0.04 0.00 0.00 177.00 175.18 1a4q n GLU 337 N -4.72 0.01 -1.74 0.00 0.28 -1.26 -4.69 120.64 108.53 1a4q n GLU 337 Ca 0.26 0.11 -0.42 0.00 -0.16 0.00 0.00 57.16 56.96 1a4q n GLU 337 Cb 0.85 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 32.20 1a4q n GLU 337 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1a4q n SER 338 N -1.49 3.89 0.04 -1.84 7.64 -0.33 -4.94 113.62 116.58 1a4q n SER 338 Ca 0.06 1.12 -0.20 0.00 1.01 0.00 0.00 58.87 60.86 1a4q n SER 338 Cb 0.26 -1.58 -0.11 0.00 -1.01 0.00 0.00 64.21 61.76 1a4q n SER 338 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1a4q h ASN 339 N 5.39 0.76 -3.80 6.43 -0.26 -1.89 -3.49 115.58 118.72 1a4q h ASN 339 Ca -0.46 -0.77 0.07 0.00 -0.56 0.00 0.00 56.30 54.59 1a4q h ASN 339 Cb 1.22 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 38.23 1a4q h ASN 339 CO 0.84 1.43 -0.09 0.61 -1.06 0.00 0.00 177.43 179.16 1a4q n GLY 340 N 1.14 -2.16 3.95 2.83 0.00 -1.26 -4.37 105.19 105.33 1a4q n GLY 340 Ca -0.11 -1.45 -0.23 0.00 0.00 0.00 0.00 46.02 44.23 1a4q n GLY 340 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a4q s ASP 341 N -3.15 5.88 -1.38 1.61 2.15 -1.26 -4.47 116.67 116.05 1a4q s ASP 341 Ca 0.00 0.26 -0.08 0.00 0.43 0.00 0.00 52.55 53.16 1a4q s ASP 341 Cb 0.00 -1.54 0.01 0.00 -0.30 0.00 0.00 42.92 41.09 1a4q s ASP 341 CO 0.00 -0.65 1.01 0.29 -0.17 0.00 0.00 175.17 175.65 1a4q n LYS 342 N -2.03 -7.00 0.11 4.34 5.02 -1.26 -4.27 118.16 113.09 1a4q n LYS 342 Ca 0.01 0.83 0.03 0.00 -2.02 0.00 0.00 58.31 57.16 1a4q n LYS 342 Cb 0.58 -5.77 0.00 0.00 -0.02 0.00 0.00 35.03 29.82 1a4q n LYS 342 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1a4q h GLY 343 N -2.30 0.00 -3.90 0.72 0.00 -1.78 -3.37 103.07 92.44 1a4q h GLY 343 Ca -0.54 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.27 1a4q h GLY 343 CO 0.55 0.00 0.58 -1.60 0.00 0.00 0.00 176.54 176.06 1a4q s ARG 344 N -3.01 4.47 0.00 4.80 6.06 -1.14 -3.07 118.95 127.06 1a4q s ARG 344 Ca 0.02 2.04 0.00 0.00 -2.50 0.00 0.00 55.73 55.28 1a4q s ARG 344 Cb 0.08 -3.13 0.00 0.00 0.06 0.00 0.00 34.95 31.95 1a4q s ARG 344 CO 0.76 -0.04 0.00 0.41 -2.50 0.00 0.00 175.30 173.93 1a4q n GLY 345 N 1.16 -0.49 0.00 8.12 0.00 0.28 -4.58 105.19 109.67 1a4q n GLY 345 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1a4q n GLY 345 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4q n GLY 346 N -0.53 -0.69 3.45 -0.02 0.00 -1.05 -4.25 105.19 102.11 1a4q n GLY 346 Ca 0.00 -1.21 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 1a4q n GLY 346 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1a4q s ILE 347 N -2.00 0.01 0.15 -0.61 2.07 -1.23 -4.76 121.20 114.83 1a4q s ILE 347 Ca 0.00 -0.10 -0.30 0.00 -1.41 0.00 0.00 60.65 58.83 1a4q s ILE 347 Cb 0.00 -0.87 -0.07 0.00 0.13 0.00 0.00 42.46 41.65 1a4q s ILE 347 CO 0.00 -0.06 1.18 -0.75 -1.91 0.00 0.00 174.94 173.40 1a4q s LYS 348 N -0.77 4.50 0.05 3.50 2.20 -1.26 -4.67 119.74 123.29 1a4q s LYS 348 Ca -0.08 1.81 0.08 0.00 -0.36 0.00 0.00 55.97 57.42 1a4q s LYS 348 Cb -0.02 -3.28 -0.03 0.00 -1.51 0.00 0.00 37.83 32.99 1a4q s LYS 348 CO 0.06 -0.10 -0.21 0.20 -0.36 0.00 0.00 175.35 174.93 1a4q s GLY 349 N 0.35 1.53 0.50 5.54 0.00 -1.25 -2.42 107.32 111.56 1a4q s GLY 349 Ca 0.54 -1.24 -0.21 0.00 0.00 0.00 0.00 44.72 43.80 1a4q s GLY 349 CO 0.34 -1.14 1.17 -0.32 0.00 0.00 0.00 173.10 173.15 1a4q s GLY 350 N -1.44 2.74 -0.28 0.20 0.00 -0.97 -4.54 107.32 103.03 1a4q s GLY 350 Ca 0.14 0.94 -0.20 0.00 0.00 0.00 0.00 44.72 45.60 1a4q s GLY 350 CO 0.04 1.36 0.87 -0.12 0.00 0.00 0.00 173.10 175.26 1a4q s PHE 351 N -1.60 -0.72 -0.00 1.90 5.36 -1.25 -2.49 117.98 119.18 1a4q s PHE 351 Ca 0.68 1.56 -0.23 0.00 -0.96 0.00 0.00 56.93 57.98 1a4q s PHE 351 Cb -0.28 0.41 0.05 0.00 -0.34 0.00 0.00 43.02 42.86 1a4q s PHE 351 CO 0.33 -0.35 0.52 0.54 -1.46 0.00 0.00 175.22 174.80 1a4q s VAL 352 N 0.93 0.03 -0.03 3.12 0.11 -0.24 -2.97 120.40 121.34 1a4q s VAL 352 Ca -0.04 -0.23 -0.03 0.00 -2.93 0.00 0.00 61.98 58.75 1a4q s VAL 352 Cb -0.05 -0.89 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 1a4q s VAL 352 CO -0.11 -0.12 0.15 -1.00 -3.33 0.00 0.00 175.10 170.69 1a4q s HIS 353 N -1.73 3.50 -0.35 1.54 3.76 -1.26 -1.21 115.29 119.54 1a4q s HIS 353 Ca -0.09 0.35 0.01 0.00 -0.15 0.00 0.00 55.06 55.18 1a4q s HIS 353 Cb -0.02 -1.83 0.09 0.00 1.11 0.00 0.00 32.58 31.94 1a4q s HIS 353 CO 0.04 0.64 0.08 -1.14 -0.85 0.00 0.00 174.74 173.51 1a4q s GLN 354 N -1.73 1.90 -0.34 1.40 0.74 -0.33 -4.65 119.66 116.67 1a4q s GLN 354 Ca 0.24 -1.70 -0.20 0.00 0.05 0.00 0.00 55.36 53.75 1a4q s GLN 354 Cb -0.12 -3.30 -0.00 0.00 1.10 0.00 0.00 33.01 30.69 1a4q s GLN 354 CO 0.15 -0.89 0.62 1.03 -0.55 0.00 0.00 175.29 175.65 1a4q s ARG 355 N 1.06 3.76 0.25 1.67 0.52 -1.26 -0.74 118.95 124.20 1a4q s ARG 355 Ca 0.05 0.13 0.09 0.00 -0.52 0.00 0.00 55.73 55.48 1a4q s ARG 355 Cb -0.21 -3.78 -0.04 0.00 0.52 0.00 0.00 34.95 31.45 1a4q s ARG 355 CO -0.05 -0.66 0.02 -1.64 0.02 0.00 0.00 175.30 172.98 1a4q s MET 356 N 2.64 2.38 0.40 3.54 -1.94 -0.52 -0.78 119.30 125.02 1a4q s MET 356 Ca 0.24 -1.32 0.13 0.00 -1.71 0.00 0.00 55.69 53.03 1a4q s MET 356 Cb -0.15 -2.24 0.96 0.00 2.01 0.00 0.00 34.83 35.41 1a4q s MET 356 CO 0.13 0.39 1.91 0.00 -0.01 0.00 0.00 175.02 177.44 1a4q h ALA 357 N 2.02 2.00 0.01 3.03 0.00 -1.96 -3.20 119.26 121.16 1a4q h ALA 357 Ca -0.45 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.09 1a4q h ALA 357 Cb 1.24 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 1a4q h ALA 357 CO 0.60 -0.21 -2.30 -1.13 0.00 0.00 0.00 179.25 176.21 1a4q n SER 358 N -4.51 1.01 -3.65 0.00 3.41 -1.26 -5.09 113.62 103.53 1a4q n SER 358 Ca 0.15 0.02 -0.09 0.00 -0.26 0.00 0.00 58.87 58.69 1a4q n SER 358 Cb 0.49 0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.60 1a4q n SER 358 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1a4q s LYS 359 N -2.52 1.79 -0.10 4.33 -2.85 -1.21 -5.13 119.74 114.05 1a4q s LYS 359 Ca -0.19 -1.30 -0.00 0.00 -1.00 0.00 0.00 55.97 53.48 1a4q s LYS 359 Cb 0.07 0.53 0.02 0.00 -2.06 0.00 0.00 37.83 36.40 1a4q s LYS 359 CO 0.74 -0.79 -0.07 -1.50 0.10 0.00 0.00 175.35 173.84 1a4q s ILE 360 N -3.53 0.93 -0.06 3.79 1.10 -1.26 -1.44 121.20 120.73 1a4q s ILE 360 Ca 0.19 -0.24 -0.21 0.00 -0.51 0.00 0.00 60.65 59.89 1a4q s ILE 360 Cb -0.03 -0.97 -0.04 0.00 0.15 0.00 0.00 42.46 41.57 1a4q s ILE 360 CO 0.11 0.35 0.60 -0.83 -2.11 0.00 0.00 174.94 173.06 1a4q s GLY 361 N 1.69 2.55 -0.23 1.50 0.00 0.08 -0.66 107.32 112.25 1a4q s GLY 361 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 44.72 44.76 1a4q s GLY 361 CO -0.07 0.93 -0.11 0.50 0.00 0.00 0.00 173.10 174.35 1a4q s ARG 362 N 0.46 2.79 -0.12 2.90 0.52 -0.13 -1.19 118.95 124.18 1a4q s ARG 362 Ca 0.32 -0.99 -0.04 0.00 -0.52 0.00 0.00 55.73 54.49 1a4q s ARG 362 Cb -0.17 -2.85 -0.04 0.00 0.52 0.00 0.00 34.95 32.42 1a4q s ARG 362 CO 0.15 -0.37 0.04 -1.58 0.02 0.00 0.00 175.30 173.57 1a4q s TRP 363 N 1.28 3.26 0.05 -0.53 0.52 -0.35 -1.76 118.94 121.41 1a4q s TRP 363 Ca 0.00 0.19 0.00 0.00 0.02 0.00 0.00 56.10 56.31 1a4q s TRP 363 Cb -0.16 -1.91 -0.03 0.00 -1.15 0.00 0.00 33.47 30.22 1a4q s TRP 363 CO -0.07 0.40 -0.04 0.71 0.02 0.00 0.00 176.95 177.97 1a4q s TYR 364 N -0.48 0.51 0.13 -1.98 1.51 -0.57 -1.08 117.35 115.39 1a4q s TYR 364 Ca 0.09 -0.82 0.07 0.00 -1.01 0.00 0.00 57.07 55.40 1a4q s TYR 364 Cb -0.12 -0.35 -0.04 0.00 -0.11 0.00 0.00 41.96 41.34 1a4q s TYR 364 CO 0.02 -0.25 -0.16 -1.54 -1.11 0.00 0.00 175.55 172.51 1a4q s SER 365 N -2.34 2.20 0.11 2.29 1.04 -1.04 -1.06 113.70 114.90 1a4q s SER 365 Ca -0.01 -0.81 -0.12 0.00 0.48 0.00 0.00 55.95 55.49 1a4q s SER 365 Cb 0.00 -0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.04 1a4q s SER 365 CO -0.05 -0.10 0.28 0.00 0.98 0.00 0.00 173.24 174.35 1a4q s ARG 366 N -2.63 0.96 0.91 4.02 1.70 -0.52 -4.22 118.95 119.17 1a4q s ARG 366 Ca 0.10 -0.87 -0.11 0.00 -0.47 0.00 0.00 55.73 54.38 1a4q s ARG 366 Cb -0.06 0.40 0.14 0.00 -0.57 0.00 0.00 34.95 34.86 1a4q s ARG 366 CO 0.04 -0.34 1.10 0.95 -1.08 0.00 0.00 175.30 175.96 1a4q s THR 367 N -3.84 2.55 -0.02 4.99 -4.23 -1.26 -0.86 115.64 112.97 1a4q s THR 367 Ca 0.05 0.18 -0.05 0.00 -1.18 0.00 0.00 61.69 60.69 1a4q s THR 367 Cb 0.03 -2.49 -0.28 0.00 1.34 0.00 0.00 72.50 71.11 1a4q s THR 367 CO -0.11 -0.24 0.76 -0.03 -0.54 0.00 0.00 174.62 174.46 1a4q h MET 368 N -1.70 0.28 -6.91 3.99 4.05 -0.99 -3.43 114.93 110.21 1a4q h MET 368 Ca -0.48 -0.47 -0.50 0.00 -0.28 0.00 0.00 59.70 57.96 1a4q h MET 368 Cb 1.28 0.18 0.04 0.00 -0.80 0.00 0.00 31.60 32.29 1a4q h MET 368 CO 0.50 1.14 0.50 0.45 0.23 0.00 0.00 176.91 179.73 1a4q s SER 369 N -7.02 6.75 0.27 1.39 0.15 -0.68 -4.91 113.70 109.64 1a4q s SER 369 Ca -0.12 2.31 0.25 0.00 0.70 0.00 0.00 55.95 59.10 1a4q s SER 369 Cb 0.06 -2.62 0.67 0.00 -1.71 0.00 0.00 66.02 62.43 1a4q s SER 369 CO 0.85 -0.51 1.72 0.11 1.20 0.00 0.00 173.24 176.60 1a4q h LYS 370 N 2.95 0.00 0.00 5.44 1.57 -1.90 -3.39 116.57 121.24 1a4q h LYS 370 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1a4q h LYS 370 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1a4q h LYS 370 CO 0.64 0.00 -0.93 0.25 -0.57 0.00 0.00 179.45 178.83 1a4q n THR 371 N -2.48 0.00 -4.53 -0.16 -2.24 -1.26 -1.75 114.28 101.86 1a4q n THR 371 Ca 0.05 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.58 1a4q n THR 371 Cb 0.46 0.22 -0.11 0.00 -2.10 0.00 0.00 70.33 68.81 1a4q n THR 371 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1a4q s GLU 372 N -1.88 1.78 -1.43 -0.78 2.02 -1.26 -4.53 118.70 112.63 1a4q s GLU 372 Ca 0.00 -1.94 -0.09 0.00 0.02 0.00 0.00 54.97 52.96 1a4q s GLU 372 Cb 0.00 -1.53 0.06 0.00 0.10 0.00 0.00 34.13 32.76 1a4q s GLU 372 CO 0.00 0.06 2.39 0.54 0.02 0.00 0.00 175.26 178.27 1a4q n ARG 373 N -0.78 3.74 -4.61 1.61 1.74 -1.26 -4.29 116.66 112.81 1a4q n ARG 373 Ca -0.05 -2.95 -0.23 0.00 -0.77 0.00 0.00 57.85 53.85 1a4q n ARG 373 Cb 0.64 -2.89 -0.16 0.00 -1.02 0.00 0.00 32.46 29.04 1a4q n ARG 373 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1a4q s MET 374 N 1.06 1.30 0.14 5.56 -1.94 -1.24 -1.14 119.30 123.03 1a4q s MET 374 Ca 0.53 -0.46 0.00 0.00 -1.71 0.00 0.00 55.69 54.05 1a4q s MET 374 Cb 0.15 -1.18 0.00 0.00 2.01 0.00 0.00 34.83 35.81 1a4q s MET 374 CO -0.06 0.20 0.00 0.41 -0.01 0.00 0.00 175.02 175.56 1a4q n GLY 375 N 3.11 -1.92 3.54 -0.03 0.00 -0.31 -0.88 105.19 108.71 1a4q n GLY 375 Ca -0.17 -1.38 -0.00 0.00 0.00 0.00 0.00 46.02 44.46 1a4q n GLY 375 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1a4q s MET 376 N -2.04 0.32 0.06 1.61 1.75 -0.47 -3.28 119.30 117.25 1a4q s MET 376 Ca 0.00 0.65 0.07 0.00 -1.25 0.00 0.00 55.69 55.16 1a4q s MET 376 Cb 0.00 0.23 -0.03 0.00 2.84 0.00 0.00 34.83 37.87 1a4q s MET 376 CO 0.00 -0.08 -0.20 -1.21 -0.65 0.00 0.00 175.02 172.88 1a4q s GLU 377 N 1.81 1.24 -0.05 4.11 2.02 -0.04 -0.83 118.70 126.96 1a4q s GLU 377 Ca -0.06 -0.98 -0.04 0.00 0.02 0.00 0.00 54.97 53.91 1a4q s GLU 377 Cb -0.05 -1.38 -0.04 0.00 0.10 0.00 0.00 34.13 32.77 1a4q s GLU 377 CO -0.16 0.34 0.17 -1.17 0.02 0.00 0.00 175.26 174.46 1a4q s LEU 378 N -1.39 4.38 0.03 1.80 0.20 -0.83 -1.44 118.68 121.43 1a4q s LEU 378 Ca 0.06 0.39 -0.04 0.00 0.69 0.00 0.00 54.13 55.23 1a4q s LEU 378 Cb -0.09 -2.44 -0.01 0.00 -0.43 0.00 0.00 46.19 43.22 1a4q s LEU 378 CO 0.02 0.31 0.07 -0.31 -0.29 0.00 0.00 176.35 176.15 1a4q s TYR 379 N -1.23 0.21 0.01 5.38 2.02 -0.22 -0.03 117.35 123.49 1a4q s TYR 379 Ca 0.23 -0.49 -0.07 0.00 -0.37 0.00 0.00 57.07 56.37 1a4q s TYR 379 Cb -0.12 -0.16 -0.00 0.00 -0.40 0.00 0.00 41.96 41.28 1a4q s TYR 379 CO 0.14 -0.32 0.13 0.54 -1.57 0.00 0.00 175.55 174.47 1a4q s VAL 380 N -2.28 0.09 -0.13 0.71 0.11 -0.70 -1.51 120.40 116.71 1a4q s VAL 380 Ca -0.08 -0.78 -0.10 0.00 -2.93 0.00 0.00 61.98 58.09 1a4q s VAL 380 Cb -0.03 -0.54 0.04 0.00 -1.53 0.00 0.00 36.38 34.32 1a4q s VAL 380 CO -0.03 -0.43 0.34 -0.60 -3.33 0.00 0.00 175.10 171.05 1a4q s ARG 381 N -1.67 0.37 -0.15 1.54 3.52 -0.72 -0.76 118.95 121.07 1a4q s ARG 381 Ca -0.13 0.53 -0.10 0.00 -0.13 0.00 0.00 55.73 55.90 1a4q s ARG 381 Cb -0.06 0.12 -0.05 0.00 -1.56 0.00 0.00 34.95 33.40 1a4q s ARG 381 CO 0.00 -0.08 0.18 0.71 -0.81 0.00 0.00 175.30 175.30 1a4q s TYR 382 N 0.52 3.50 0.00 5.12 2.02 -1.26 -0.96 117.35 126.29 1a4q s TYR 382 Ca -0.03 0.49 0.00 0.00 -0.37 0.00 0.00 57.07 57.16 1a4q s TYR 382 Cb -0.04 -2.13 0.00 0.00 -0.40 0.00 0.00 41.96 39.38 1a4q s TYR 382 CO -0.03 0.44 0.00 -0.25 -1.57 0.00 0.00 175.55 174.15 1a4q n ASP 383 N 2.94 -3.60 0.00 2.29 8.00 0.17 -4.97 116.55 121.38 1a4q n ASP 383 Ca -0.16 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.34 1a4q n ASP 383 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1a4q n ASP 383 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a4q n GLY 384 N 0.00 -2.28 3.18 0.44 0.00 -1.26 -4.78 105.19 100.48 1a4q n GLY 384 Ca 0.00 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 44.14 1a4q n GLY 384 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a4q s ASP 385 N -2.70 4.09 0.59 1.61 -1.08 -1.26 -4.97 116.67 112.94 1a4q s ASP 385 Ca 0.00 -0.85 0.29 0.00 -0.52 0.00 0.00 52.55 51.47 1a4q s ASP 385 Cb 0.00 -1.62 1.48 0.00 -1.46 0.00 0.00 42.92 41.32 1a4q s ASP 385 CO 0.00 -0.10 1.90 -0.65 0.52 0.00 0.00 175.17 176.84 1a4q h PRO 386 N 7.98 0.00 0.00 4.34 0.11 -1.91 -1.01 132.00 141.50 1a4q h PRO 386 Ca -0.35 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 1a4q h PRO 386 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1a4q h PRO 386 CO 0.58 0.00 -0.10 -1.49 -0.21 0.00 0.00 178.00 176.78 1a4q h TRP 387 N 0.00 0.00 0.00 0.65 6.55 -1.93 -0.31 115.95 120.90 1a4q h TRP 387 Ca 0.22 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.06 1a4q h TRP 387 Cb 1.19 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.49 1a4q h TRP 387 CO 0.00 0.10 -0.96 0.25 -1.05 0.00 0.00 178.44 176.78 1a4q n THR 388 N -3.13 0.00 -2.93 1.49 -2.24 -0.45 -4.38 114.28 102.65 1a4q n THR 388 Ca 0.03 -0.16 -0.43 0.00 -2.27 0.00 0.00 64.05 61.22 1a4q n THR 388 Cb 0.56 0.54 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1a4q n THR 388 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1a4q s ASP 389 N -2.21 6.44 0.00 3.42 1.01 -0.82 -4.92 116.67 119.59 1a4q s ASP 389 Ca -0.01 -0.03 0.29 0.00 0.71 0.00 0.00 52.55 53.51 1a4q s ASP 389 Cb 0.03 -2.40 1.25 0.00 1.01 0.00 0.00 42.92 42.81 1a4q s ASP 389 CO 0.16 -0.94 1.90 -1.54 0.21 0.00 0.00 175.17 174.96 1a4q n SER 390 N 6.82 0.18 -4.70 0.27 3.41 -1.26 -2.07 113.62 116.27 1a4q n SER 390 Ca 0.03 -0.09 -0.42 0.00 -0.26 0.00 0.00 58.87 58.14 1a4q n SER 390 Cb 0.48 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 1a4q n SER 390 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1a4q n ASP 391 N -1.28 2.65 -4.77 4.04 9.92 -1.26 -1.14 116.55 124.70 1a4q n ASP 391 Ca 0.11 1.15 -0.40 0.00 -0.53 0.00 0.00 54.79 55.12 1a4q n ASP 391 Cb 0.29 -1.50 0.01 0.00 -0.64 0.00 0.00 41.12 39.28 1a4q n ASP 391 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1a4q s ALA 392 N -1.16 3.41 0.63 2.24 0.00 -1.26 -4.11 121.76 121.51 1a4q s ALA 392 Ca 0.59 1.51 -0.13 0.00 0.00 0.00 0.00 51.96 53.92 1a4q s ALA 392 Cb -0.53 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 18.97 1a4q s ALA 392 CO 0.60 -1.10 1.05 -0.51 0.00 0.00 0.00 175.76 175.79 1a4q s LEU 393 N -2.38 3.34 -0.30 0.00 1.02 -1.26 -4.99 118.68 114.11 1a4q s LEU 393 Ca 0.56 1.67 -0.26 0.00 0.02 0.00 0.00 54.13 56.12 1a4q s LEU 393 Cb -0.45 -4.51 0.01 0.00 0.02 0.00 0.00 46.19 41.26 1a4q s LEU 393 CO 0.59 -1.18 0.93 0.00 0.02 0.00 0.00 176.35 176.71 1a4q s ALA 394 N -2.79 3.54 0.08 4.21 0.00 0.06 -4.84 121.76 122.02 1a4q s ALA 394 Ca 0.60 -0.20 -0.33 0.00 0.00 0.00 0.00 51.96 52.03 1a4q s ALA 394 Cb -0.14 -3.47 -0.12 0.00 0.00 0.00 0.00 23.12 19.39 1a4q s ALA 394 CO 0.45 -1.28 1.76 1.58 0.00 0.00 0.00 175.76 178.27 1a4q n HIS 395 N 6.47 2.43 -1.74 0.00 -0.00 -1.26 -1.71 115.22 119.40 1a4q n HIS 395 Ca 0.08 0.03 0.06 0.00 0.46 0.00 0.00 57.72 58.35 1a4q n HIS 395 Cb 0.47 -2.65 0.13 0.00 -0.12 0.00 0.00 29.99 27.82 1a4q n HIS 395 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1a4q n SER 396 N 5.13 1.48 0.00 0.26 7.64 0.96 -4.93 113.62 124.16 1a4q n SER 396 Ca 0.19 -3.07 0.00 0.00 1.01 0.00 0.00 58.87 57.00 1a4q n SER 396 Cb 0.32 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 1a4q n SER 396 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a4q n GLY 397 N -0.68 3.62 3.57 0.23 0.00 -1.24 -4.46 105.19 106.24 1a4q n GLY 397 Ca 0.13 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 1a4q n GLY 397 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4q s VAL 398 N -2.09 4.89 -0.01 1.61 1.01 -1.26 -1.96 120.40 122.59 1a4q s VAL 398 Ca 0.00 0.56 0.09 0.00 0.00 0.00 0.00 61.98 62.63 1a4q s VAL 398 Cb 0.00 -4.08 -0.23 0.00 0.00 0.00 0.00 36.38 32.07 1a4q s VAL 398 CO 0.00 -0.32 0.77 0.24 0.00 0.00 0.00 175.10 175.79 1a4q h MET 399 N 8.48 0.04 -3.35 2.72 2.86 -1.29 -3.36 114.93 121.03 1a4q h MET 399 Ca -0.26 -0.06 -0.31 0.00 -2.06 0.00 0.00 59.70 57.01 1a4q h MET 399 Cb 1.11 0.02 -0.35 0.00 0.06 0.00 0.00 31.60 32.44 1a4q h MET 399 CO 0.84 0.68 -0.69 0.08 1.06 0.00 0.00 176.91 178.88 1a4q s VAL 400 N -2.62 -0.10 0.94 -2.22 1.01 -0.71 -0.60 120.40 116.11 1a4q s VAL 400 Ca -0.05 0.29 -0.12 0.00 0.00 0.00 0.00 61.98 62.09 1a4q s VAL 400 Cb 0.08 -0.16 0.16 0.00 0.00 0.00 0.00 36.38 36.45 1a4q s VAL 400 CO 0.82 0.12 1.12 -0.94 0.00 0.00 0.00 175.10 176.22 1a4q s SER 401 N 1.56 3.19 0.56 3.32 1.04 -1.26 -1.37 113.70 120.74 1a4q s SER 401 Ca -0.04 1.04 0.26 0.00 0.48 0.00 0.00 55.95 57.69 1a4q s SER 401 Cb -0.12 -1.65 1.48 0.00 0.10 0.00 0.00 66.02 65.83 1a4q s SER 401 CO -0.04 -2.76 2.03 -0.03 0.98 0.00 0.00 173.24 173.42 1a4q h MET 402 N -1.64 0.00 0.00 4.02 4.05 -1.94 -1.81 114.93 117.62 1a4q h MET 402 Ca -0.52 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.90 1a4q h MET 402 Cb 1.33 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.13 1a4q h MET 402 CO 0.60 0.00 0.00 1.63 0.23 0.00 0.00 176.91 179.37 1a4q n LYS 403 N -4.12 0.08 -4.29 0.39 5.02 -1.26 -4.30 118.16 109.68 1a4q n LYS 403 Ca 0.06 0.19 -0.29 0.00 -2.02 0.00 0.00 58.31 56.25 1a4q n LYS 403 Cb 0.48 -1.61 -0.10 0.00 -0.02 0.00 0.00 35.03 33.77 1a4q n LYS 403 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1a4q s GLU 404 N -3.07 1.91 0.25 1.97 0.41 -0.69 -5.01 118.70 114.48 1a4q s GLU 404 Ca 0.09 -1.19 -0.30 0.00 -0.41 0.00 0.00 54.97 53.16 1a4q s GLU 404 Cb 0.13 -2.15 -0.10 0.00 -1.78 0.00 0.00 34.13 30.23 1a4q s GLU 404 CO 0.43 0.47 1.48 -1.25 -0.49 0.00 0.00 175.26 175.89 1a4q s PRO 405 N -2.37 4.24 -0.29 0.39 0.04 -1.26 -1.16 135.00 134.58 1a4q s PRO 405 Ca 0.21 2.36 -0.02 0.00 0.04 0.00 0.00 61.00 63.59 1a4q s PRO 405 Cb -0.10 -3.09 0.09 0.00 0.04 0.00 0.00 34.50 31.44 1a4q s PRO 405 CO 0.12 -0.47 0.09 0.20 0.04 0.00 0.00 177.00 176.98 1a4q s GLY 406 N 0.42 0.93 0.00 0.56 0.00 -0.29 -4.54 107.32 104.40 1a4q s GLY 406 Ca 0.61 -1.43 0.00 0.00 0.00 0.00 0.00 44.72 43.89 1a4q s GLY 406 CO 0.44 1.65 0.00 0.79 0.00 0.00 0.00 173.10 175.98 1a4q n TRP 407 N 4.94 0.00 -2.08 1.90 7.02 -0.16 -3.74 117.44 125.32 1a4q n TRP 407 Ca -0.04 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.06 1a4q n TRP 407 Cb 0.43 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 29.32 1a4q n TRP 407 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1a4q s TYR 408 N 3.42 2.70 0.18 -5.99 1.51 -1.26 -4.71 117.35 113.20 1a4q s TYR 408 Ca 0.00 1.46 0.04 0.00 -1.01 0.00 0.00 57.07 57.57 1a4q s TYR 408 Cb 0.00 -3.56 -0.05 0.00 -0.11 0.00 0.00 41.96 38.24 1a4q s TYR 408 CO 0.00 -2.02 -0.07 -1.54 -1.11 0.00 0.00 175.55 170.81 1a4q s SER 409 N -1.11 1.87 -0.05 2.29 1.04 -1.02 -0.16 113.70 116.57 1a4q s SER 409 Ca 0.64 -1.08 -0.19 0.00 0.48 0.00 0.00 55.95 55.80 1a4q s SER 409 Cb -0.34 -0.01 0.04 0.00 0.10 0.00 0.00 66.02 65.80 1a4q s SER 409 CO 0.42 -0.38 0.43 0.72 0.98 0.00 0.00 173.24 175.40 1a4q s PHE 410 N -3.33 -0.35 0.36 5.02 -0.12 -0.65 -2.29 117.98 116.61 1a4q s PHE 410 Ca 0.21 0.63 -0.02 0.00 -0.05 0.00 0.00 56.93 57.70 1a4q s PHE 410 Cb 0.03 0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.58 1a4q s PHE 410 CO 0.04 -0.43 0.60 0.20 -0.05 0.00 0.00 175.22 175.58 1a4q s GLY 411 N -1.07 1.52 0.27 1.99 0.00 -1.16 -1.13 107.32 107.75 1a4q s GLY 411 Ca -0.11 -0.72 -0.21 0.00 0.00 0.00 0.00 44.72 43.68 1a4q s GLY 411 CO 0.05 -0.63 0.71 -0.11 0.00 0.00 0.00 173.10 173.13 1a4q s PHE 412 N -2.35 -0.22 -0.04 1.90 -0.71 -0.38 -4.72 117.98 111.47 1a4q s PHE 412 Ca 0.43 -0.22 0.02 0.00 -1.04 0.00 0.00 56.93 56.12 1a4q s PHE 412 Cb -0.10 0.70 0.01 0.00 -1.21 0.00 0.00 43.02 42.42 1a4q s PHE 412 CO 0.36 -1.21 -0.09 -1.21 -1.34 0.00 0.00 175.22 171.73 1a4q s GLU 413 N -3.91 1.17 -0.02 1.99 2.02 -1.26 -0.38 118.70 118.31 1a4q s GLU 413 Ca 0.10 -0.31 -0.05 0.00 0.02 0.00 0.00 54.97 54.73 1a4q s GLU 413 Cb -0.06 -1.05 -0.04 0.00 0.10 0.00 0.00 34.13 33.08 1a4q s GLU 413 CO 0.05 0.07 0.22 0.42 0.02 0.00 0.00 175.26 176.04 1a4q s ILE 414 N 0.43 5.38 -0.35 -1.63 1.01 -0.16 -4.36 121.20 121.51 1a4q s ILE 414 Ca -0.08 0.06 -0.16 0.00 0.00 0.00 0.00 60.65 60.48 1a4q s ILE 414 Cb -0.12 -3.53 -0.01 0.00 0.01 0.00 0.00 42.46 38.81 1a4q s ILE 414 CO 0.01 0.39 0.40 -0.54 0.00 0.00 0.00 174.94 175.20 1a4q s LYS 415 N -1.71 3.50 0.85 2.79 -0.14 -1.26 -0.47 119.74 123.30 1a4q s LYS 415 Ca 0.26 -0.43 -0.08 0.00 -1.36 0.00 0.00 55.97 54.36 1a4q s LYS 415 Cb -0.13 -3.83 0.18 0.00 -1.68 0.00 0.00 37.83 32.38 1a4q s LYS 415 CO 0.15 -0.59 1.16 -3.47 -0.76 0.00 0.00 175.35 171.84 1a4q n ASP 416 N 5.47 0.74 -0.29 2.83 2.03 -0.19 -4.91 116.55 122.23 1a4q n ASP 416 Ca -0.08 -1.82 -0.04 0.00 0.52 0.00 0.00 54.79 53.37 1a4q n ASP 416 Cb 0.49 -0.82 0.07 0.00 -0.72 0.00 0.00 41.12 40.14 1a4q n ASP 416 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1a4q h LYS 417 N 0.00 1.08 0.00 -0.67 1.79 -1.97 -3.31 116.57 113.48 1a4q h LYS 417 Ca -0.38 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 1a4q h LYS 417 Cb 1.20 -0.23 0.00 0.00 -1.58 0.00 0.00 32.23 31.62 1a4q h LYS 417 CO 0.33 0.74 0.00 1.63 -1.08 0.00 0.00 179.45 181.07 1a4q n LYS 418 N -4.49 -0.72 -3.85 3.15 5.02 -1.26 -5.08 118.16 110.93 1a4q n LYS 418 Ca 0.08 -0.43 -0.09 0.00 -2.02 0.00 0.00 58.31 55.85 1a4q n LYS 418 Cb 0.04 -0.91 -0.04 0.00 -0.02 0.00 0.00 35.03 34.10 1a4q n LYS 418 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a4q s ASP 420 N -2.93 5.50 -0.32 0.00 1.01 -0.94 -1.02 116.67 117.96 1a4q s ASP 420 Ca 0.14 0.16 -0.11 0.00 0.71 0.00 0.00 52.55 53.44 1a4q s ASP 420 Cb -0.02 -1.74 -0.01 0.00 1.01 0.00 0.00 42.92 42.16 1a4q s ASP 420 CO 0.02 0.31 0.19 -0.69 0.21 0.00 0.00 175.17 175.21 1a4q s VAL 421 N -0.44 4.87 0.19 -1.27 1.01 0.38 -0.99 120.40 124.15 1a4q s VAL 421 Ca 0.09 -0.36 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 1a4q s VAL 421 Cb -0.12 -3.50 -0.08 0.00 0.00 0.00 0.00 36.38 32.68 1a4q s VAL 421 CO 0.02 0.02 1.12 -2.16 0.00 0.00 0.00 175.10 174.11 1a4q s PRO 422 N 1.65 4.58 0.04 2.72 0.04 -1.26 -0.99 135.00 141.78 1a4q s PRO 422 Ca 0.05 1.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.85 1a4q s PRO 422 Cb -0.17 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.08 1a4q s PRO 422 CO 0.08 0.06 -0.03 0.00 0.04 0.00 0.00 177.00 177.15 1a4q s ILE 424 N -3.13 1.64 0.13 0.00 1.01 -0.20 -1.24 121.20 119.40 1a4q s ILE 424 Ca -0.00 -0.82 0.05 0.00 0.00 0.00 0.00 60.65 59.88 1a4q s ILE 424 Cb 0.02 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 1a4q s ILE 424 CO -0.07 0.47 0.04 -0.83 0.00 0.00 0.00 174.94 174.54 1a4q s GLY 425 N 0.06 1.82 -0.07 6.18 0.00 -0.28 -1.07 107.32 113.96 1a4q s GLY 425 Ca -0.06 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.45 1a4q s GLY 425 CO 0.03 -1.20 -0.05 -0.42 0.00 0.00 0.00 173.10 171.46 1a4q s ILE 426 N -1.54 0.69 -0.10 0.90 1.01 0.61 -1.64 121.20 121.12 1a4q s ILE 426 Ca 0.28 -0.13 -0.28 0.00 0.00 0.00 0.00 60.65 60.52 1a4q s ILE 426 Cb -0.11 -0.74 -0.02 0.00 0.01 0.00 0.00 42.46 41.61 1a4q s ILE 426 CO 0.20 0.29 0.91 -0.70 0.00 0.00 0.00 174.94 175.64 1a4q s GLU 427 N 1.44 4.41 -0.47 2.79 2.12 0.78 -0.68 118.70 129.09 1a4q s GLU 427 Ca -0.02 1.22 0.04 0.00 0.36 0.00 0.00 54.97 56.57 1a4q s GLU 427 Cb -0.13 -3.52 0.12 0.00 0.26 0.00 0.00 34.13 30.86 1a4q s GLU 427 CO -0.03 -0.22 0.21 -1.64 -0.54 0.00 0.00 175.26 173.04 1a4q s MET 428 N 1.71 1.73 0.20 4.30 -1.94 0.22 -0.99 119.30 124.54 1a4q s MET 428 Ca 0.45 -2.34 -0.30 0.00 -1.71 0.00 0.00 55.69 51.79 1a4q s MET 428 Cb -0.18 -3.09 -0.08 0.00 2.01 0.00 0.00 34.83 33.49 1a4q s MET 428 CO 0.18 -1.09 1.17 0.08 -0.01 0.00 0.00 175.02 175.36 1a4q s VAL 429 N 0.08 3.58 -0.62 -6.03 1.01 -1.26 -1.26 120.40 115.90 1a4q s VAL 429 Ca 0.16 1.37 -0.20 0.00 0.00 0.00 0.00 61.98 63.31 1a4q s VAL 429 Cb -0.24 -3.88 0.10 0.00 0.00 0.00 0.00 36.38 32.36 1a4q s VAL 429 CO -0.02 0.24 0.78 -1.00 0.00 0.00 0.00 175.10 175.10 1a4q s HIS 430 N -0.28 2.93 -0.20 5.22 3.76 0.66 -4.70 115.29 122.67 1a4q s HIS 430 Ca 0.51 -0.88 -0.02 0.00 -0.15 0.00 0.00 55.06 54.51 1a4q s HIS 430 Cb -0.32 -4.09 -0.00 0.00 1.11 0.00 0.00 32.58 29.28 1a4q s HIS 430 CO 0.38 -1.39 -0.09 0.34 -0.85 0.00 0.00 174.74 173.13 1a4q s ASP 431 N 3.63 3.96 -0.12 1.40 2.15 -1.26 -3.08 116.67 123.35 1a4q s ASP 431 Ca 0.15 -0.46 0.16 0.00 0.43 0.00 0.00 52.55 52.82 1a4q s ASP 431 Cb -0.22 -1.66 0.28 0.00 -0.30 0.00 0.00 42.92 41.02 1a4q s ASP 431 CO 0.07 -0.00 1.14 0.61 -0.17 0.00 0.00 175.17 176.82 1a4q n GLY 432 N 4.67 4.29 4.71 2.66 0.00 -1.26 -5.11 105.19 115.16 1a4q n GLY 432 Ca -0.19 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1a4q n GLY 432 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4q n GLY 433 N -1.16 -2.17 0.10 -0.02 0.00 -1.26 -4.46 105.19 96.22 1a4q n GLY 433 Ca 0.14 -1.47 0.13 0.00 0.00 0.00 0.00 46.02 44.82 1a4q n GLY 433 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1a4q n LYS 434 N -0.31 0.25 -0.02 1.61 0.00 -1.26 -3.33 118.16 115.10 1a4q n LYS 434 Ca 0.00 0.22 0.12 0.00 -0.00 0.00 0.00 58.31 58.65 1a4q n LYS 434 Cb 0.00 -1.80 0.61 0.00 -0.00 0.00 0.00 35.03 33.84 1a4q n LYS 434 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1a4q n LYS 435 N -2.23 1.27 -4.01 -1.58 2.85 -1.26 -4.72 118.16 108.48 1a4q n LYS 435 Ca 0.05 -0.40 -0.17 0.00 -1.05 0.00 0.00 58.31 56.74 1a4q n LYS 435 Cb 0.41 -1.40 -0.07 0.00 -0.65 0.00 0.00 35.03 33.32 1a4q n LYS 435 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 1a4q n THR 436 N -0.44 0.00 -1.63 0.58 5.66 -1.21 -5.02 114.28 112.22 1a4q n THR 436 Ca 0.18 -2.18 -0.34 0.00 -3.05 0.00 0.00 64.05 58.66 1a4q n THR 436 Cb 0.18 1.10 0.07 0.00 -1.55 0.00 0.00 70.33 70.13 1a4q n THR 436 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 175.07 170.36 1a4q s TRP 437 N -3.22 2.25 -0.09 1.09 1.48 -1.26 -4.81 118.94 114.38 1a4q s TRP 437 Ca 0.36 1.57 -0.01 0.00 -1.06 0.00 0.00 56.10 56.96 1a4q s TRP 437 Cb 0.02 -3.41 0.03 0.00 -1.16 0.00 0.00 33.47 28.95 1a4q s TRP 437 CO 0.25 -2.32 -0.01 -1.58 -4.06 0.00 0.00 176.95 169.23 1a4q s HIS 438 N -1.98 0.82 0.00 1.66 2.46 -1.26 -4.43 115.29 112.55 1a4q s HIS 438 Ca 0.73 -0.31 0.00 0.00 0.47 0.00 0.00 55.06 55.95 1a4q s HIS 438 Cb -0.27 -0.88 0.00 0.00 -0.13 0.00 0.00 32.58 31.29 1a4q s HIS 438 CO 0.42 -0.38 0.00 0.45 -2.47 0.00 0.00 174.74 172.76 1a4q n SER 439 N 5.11 0.00 -3.68 9.88 2.88 -1.18 -4.46 113.62 122.17 1a4q n SER 439 Ca -0.08 -0.71 -0.12 0.00 -1.33 0.00 0.00 58.87 56.64 1a4q n SER 439 Cb 0.50 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.90 1a4q n SER 439 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1a4q s ALA 440 N -1.15 -0.89 0.33 -1.46 0.00 -1.22 -0.24 121.76 117.13 1a4q s ALA 440 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.14 1a4q s ALA 440 Cb 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 23.12 23.55 1a4q s ALA 440 CO 0.00 -0.50 0.47 0.00 0.00 0.00 0.00 175.76 175.73 1a4q s ALA 441 N -2.91 4.22 -0.12 0.00 0.00 -0.38 -4.69 121.76 117.87 1a4q s ALA 441 Ca -0.03 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.49 1a4q s ALA 441 Cb 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 23.12 21.45 1a4q s ALA 441 CO -0.06 -0.03 -0.10 0.99 0.00 0.00 0.00 175.76 176.56 1a4q s THR 442 N -2.18 1.24 -0.05 0.00 2.01 -0.11 -0.61 115.64 115.95 1a4q s THR 442 Ca 0.45 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 62.00 1a4q s THR 442 Cb -0.10 -1.21 -0.04 0.00 0.01 0.00 0.00 72.50 71.17 1a4q s THR 442 CO 0.31 0.40 0.05 0.00 -0.69 0.00 0.00 174.62 174.69 1a4q s ALA 443 N 1.55 3.46 -0.08 7.40 0.00 0.14 -0.22 121.76 134.01 1a4q s ALA 443 Ca 0.04 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.20 1a4q s ALA 443 Cb -0.13 -1.55 -0.00 0.00 0.00 0.00 0.00 23.12 21.44 1a4q s ALA 443 CO -0.08 0.64 -0.22 0.42 0.00 0.00 0.00 175.76 176.52 1a4q s ILE 444 N -1.04 1.85 -0.00 0.00 1.09 0.17 -0.28 121.20 122.98 1a4q s ILE 444 Ca 0.18 -0.91 0.06 0.00 -1.10 0.00 0.00 60.65 58.88 1a4q s ILE 444 Cb -0.12 -1.60 -0.02 0.00 -1.06 0.00 0.00 42.46 39.67 1a4q s ILE 444 CO 0.08 0.51 -0.20 -0.31 -0.10 0.00 0.00 174.94 174.92 1a4q s TYR 445 N 0.25 1.81 0.07 3.97 1.51 -0.23 -0.71 117.35 124.02 1a4q s TYR 445 Ca -0.13 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 55.58 1a4q s TYR 445 Cb -0.16 -1.14 -0.04 0.00 -0.11 0.00 0.00 41.96 40.51 1a4q s TYR 445 CO 0.06 -0.00 -0.05 0.00 -1.11 0.00 0.00 175.55 174.45 1a4q s LEU 447 N -2.91 4.39 -0.28 0.00 2.96 -0.41 -0.66 118.68 121.76 1a4q s LEU 447 Ca 0.08 2.77 -0.03 0.00 -0.22 0.00 0.00 54.13 56.73 1a4q s LEU 447 Cb 0.06 -3.58 0.16 0.00 0.50 0.00 0.00 46.19 43.34 1a4q s LEU 447 CO -0.07 -0.98 0.56 -0.32 -1.32 0.00 0.00 176.35 174.22 1a4q s MET 448 N 2.17 0.52 3.07 1.98 1.75 -0.18 -4.85 119.30 123.75 1a4q s MET 448 Ca 0.78 1.00 0.00 0.00 -1.25 0.00 0.00 55.69 56.22 1a4q s MET 448 Cb -0.47 0.41 0.00 0.00 2.84 0.00 0.00 34.83 37.61 1a4q s MET 448 CO 0.34 -0.53 0.00 0.41 -0.65 0.00 0.00 175.02 174.59 1a4q n GLY 449 N 5.42 0.82 3.26 2.11 0.00 -1.26 -4.61 105.19 110.93 1a4q n GLY 449 Ca -0.04 -0.83 -0.28 0.00 0.00 0.00 0.00 46.02 44.87 1a4q n GLY 449 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4q n SER 450 N -2.81 3.15 0.00 1.61 3.41 -1.26 -1.16 113.62 116.56 1a4q n SER 450 Ca 0.00 -2.94 0.00 0.00 -0.26 0.00 0.00 58.87 55.67 1a4q n SER 450 Cb 0.00 0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1a4q n SER 450 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a4q n GLY 451 N -0.47 0.46 3.27 5.00 0.00 -1.26 -4.82 105.19 107.37 1a4q n GLY 451 Ca -0.16 -1.57 -0.15 0.00 0.00 0.00 0.00 46.02 44.14 1a4q n GLY 451 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1a4q s GLN 452 N 0.00 1.12 0.25 1.61 -2.07 -1.26 -4.59 119.66 114.72 1a4q s GLN 452 Ca 0.00 -1.49 -0.31 0.00 -1.82 0.00 0.00 55.36 51.74 1a4q s GLN 452 Cb 0.00 -0.63 -0.11 0.00 -1.09 0.00 0.00 33.01 31.18 1a4q s GLN 452 CO 0.00 0.05 1.58 -1.17 -1.32 0.00 0.00 175.29 174.42 1a4q s LEU 453 N -3.20 4.36 -0.15 2.60 0.20 -1.25 -4.96 118.68 116.29 1a4q s LEU 453 Ca 0.19 2.82 0.13 0.00 0.69 0.00 0.00 54.13 57.96 1a4q s LEU 453 Cb 0.03 -3.62 -0.18 0.00 -0.43 0.00 0.00 46.19 41.99 1a4q s LEU 453 CO 0.02 -0.86 0.04 0.18 -0.29 0.00 0.00 176.35 175.44 1a4q n LEU 454 N 2.79 0.12 -3.90 -0.68 4.32 -1.26 -4.88 117.00 113.51 1a4q n LEU 454 Ca 0.10 -0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.99 1a4q n LEU 454 Cb 0.38 0.32 -0.09 0.00 -1.62 0.00 0.00 43.42 42.41 1a4q n LEU 454 CO 0.63 0.38 -0.18 0.86 -1.22 0.00 0.00 177.39 177.85 1a4q s TRP 455 N -2.35 0.13 0.43 -1.77 -0.00 -1.26 -5.10 118.94 109.02 1a4q s TRP 455 Ca -0.08 -0.37 0.08 0.00 -0.00 0.00 0.00 56.10 55.73 1a4q s TRP 455 Cb 0.04 -0.10 0.01 0.00 -0.00 0.00 0.00 33.47 33.43 1a4q s TRP 455 CO 0.59 -0.36 0.54 0.16 -0.00 0.00 0.00 176.95 177.88 1a4q s ASP 456 N -1.95 5.45 -0.05 5.86 -4.77 -1.26 -4.54 116.67 115.41 1a4q s ASP 456 Ca -0.07 -0.55 0.05 0.00 -3.30 0.00 0.00 52.55 48.68 1a4q s ASP 456 Cb -0.03 -0.53 -0.02 0.00 -1.09 0.00 0.00 42.92 41.25 1a4q s ASP 456 CO -0.03 -0.79 -0.20 -0.89 0.70 0.00 0.00 175.17 173.96 1a4q s THR 457 N -2.41 2.54 0.13 2.11 2.01 0.23 -4.97 115.64 115.27 1a4q s THR 457 Ca 0.54 -0.91 0.10 0.00 0.31 0.00 0.00 61.69 61.73 1a4q s THR 457 Cb -0.08 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.43 1a4q s THR 457 CO 0.32 0.58 -0.24 0.68 -0.69 0.00 0.00 174.62 175.27 1a4q s VAL 458 N -0.43 2.07 -0.12 3.82 -7.23 -1.26 -4.53 120.40 112.72 1a4q s VAL 458 Ca 0.05 -1.75 0.15 0.00 -1.81 0.00 0.00 61.98 58.61 1a4q s VAL 458 Cb -0.12 -1.87 0.06 0.00 0.56 0.00 0.00 36.38 35.00 1a4q s VAL 458 CO 0.02 -0.02 1.46 0.71 -0.31 0.00 0.00 175.10 176.95 1a4q h THR 459 N 3.78 0.90 0.00 5.32 1.35 -1.97 -3.47 112.91 118.81 1a4q h THR 459 Ca -0.48 -2.23 0.00 0.00 -0.55 0.00 0.00 66.41 63.15 1a4q h THR 459 Cb 1.18 2.41 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 1a4q h THR 459 CO 0.42 0.51 0.00 0.61 -0.25 0.00 0.00 175.52 176.80 1a4q n GLY 460 N 1.17 0.45 3.75 5.82 0.00 -1.26 -4.83 105.19 110.29 1a4q n GLY 460 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1a4q n GLY 460 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4q s VAL 461 N -2.11 5.30 -0.35 1.61 1.01 -1.26 -4.95 120.40 119.66 1a4q s VAL 461 Ca 0.00 0.52 -0.11 0.00 0.00 0.00 0.00 61.98 62.39 1a4q s VAL 461 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1a4q s VAL 461 CO 0.00 0.43 0.21 -0.62 0.00 0.00 0.00 175.10 175.11 1a4q s ASP 462 N 0.21 5.80 0.16 3.32 2.15 -1.26 -4.97 116.67 122.08 1a4q s ASP 462 Ca 0.16 -0.65 0.17 0.00 0.43 0.00 0.00 52.55 52.67 1a4q s ASP 462 Cb -0.13 -2.06 0.78 0.00 -0.30 0.00 0.00 42.92 41.21 1a4q s ASP 462 CO 0.04 -0.28 1.53 0.23 -0.17 0.00 0.00 175.17 176.53 1a4q n MET 463 N 5.04 0.10 0.25 4.34 2.81 -1.26 -2.47 117.12 125.93 1a4q n MET 463 Ca -0.13 0.43 0.14 0.00 -1.81 0.00 0.00 57.70 56.34 1a4q n MET 463 Cb 0.48 -1.74 0.42 0.00 -0.71 0.00 0.00 33.22 31.68 1a4q n MET 463 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1a4q h ALA 464 N 2.24 1.00 -0.00 3.04 0.00 -2.04 -3.50 119.26 120.00 1a4q h ALA 464 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1a4q h ALA 464 Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1a4q h ALA 464 CO 0.00 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.55