#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4q s PRO 77 N 0.00 0.80 0.42 3.49 0.02 -1.26 -5.05 135.00 133.42 1a4q s PRO 77 Ca 0.00 1.13 0.08 0.00 0.02 0.00 0.00 61.00 62.23 1a4q s PRO 77 Cb 0.00 -1.73 -0.01 0.00 0.02 0.00 0.00 34.50 32.77 1a4q s PRO 77 CO 0.00 -2.64 0.43 -1.83 -0.33 0.00 0.00 177.00 172.63 1a4q s GLU 78 N -4.72 2.62 0.34 5.54 -1.05 -1.26 -4.84 118.70 115.33 1a4q s GLU 78 Ca 0.65 -1.45 -0.29 0.00 -0.15 0.00 0.00 54.97 53.74 1a4q s GLU 78 Cb -0.21 -2.49 -0.11 0.00 -0.44 0.00 0.00 34.13 30.89 1a4q s GLU 78 CO 0.59 -0.21 1.44 -1.58 0.95 0.00 0.00 175.26 176.45 1a4q s TRP 79 N -2.44 2.78 0.31 4.83 0.23 -1.26 -4.28 118.94 119.11 1a4q s TRP 79 Ca 0.50 1.19 -0.28 0.00 -2.03 0.00 0.00 56.10 55.48 1a4q s TRP 79 Cb -0.05 -3.91 -0.09 0.00 0.03 0.00 0.00 33.47 29.45 1a4q s TRP 79 CO 0.29 -2.69 1.07 0.99 0.96 0.00 0.00 176.95 177.57 1a4q s THR 80 N -0.90 3.62 0.07 2.01 2.01 -0.38 -4.78 115.64 117.29 1a4q s THR 80 Ca 0.53 1.52 0.05 0.00 0.31 0.00 0.00 61.69 64.10 1a4q s THR 80 Cb -0.44 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.12 1a4q s THR 80 CO 0.57 0.28 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.33 1a4q s TYR 81 N -1.30 1.19 0.43 4.92 1.51 -1.26 -1.77 117.35 121.06 1a4q s TYR 81 Ca 0.48 -0.45 -0.25 0.00 -1.01 0.00 0.00 57.07 55.84 1a4q s TYR 81 Cb -0.28 -0.67 -0.10 0.00 -0.11 0.00 0.00 41.96 40.80 1a4q s TYR 81 CO 0.36 0.05 1.21 -0.35 -1.11 0.00 0.00 175.55 175.71 1a4q n PRO 82 N 1.34 1.75 -4.66 -1.71 -0.04 -1.26 -5.04 135.00 125.38 1a4q n PRO 82 Ca -0.21 0.63 -0.30 0.00 -0.04 0.00 0.00 63.50 63.58 1a4q n PRO 82 Cb 0.54 -2.30 -0.09 0.00 -0.04 0.00 0.00 33.50 31.61 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 -2.21 2.05 0.48 0.54 0.52 -1.26 -4.87 118.95 114.21 1a4q s ARG 83 Ca 0.62 -2.26 -0.22 0.00 -0.52 0.00 0.00 55.73 53.36 1a4q s ARG 83 Cb -0.51 -1.35 -0.07 0.00 0.52 0.00 0.00 34.95 33.54 1a4q s ARG 83 CO 0.57 -0.29 1.18 -0.51 0.02 0.00 0.00 175.30 176.26 1a4q s LEU 84 N -3.76 3.95 0.63 2.53 1.43 -1.26 -4.67 118.68 117.53 1a4q s LEU 84 Ca 0.18 2.33 -0.16 0.00 -1.03 0.00 0.00 54.13 55.44 1a4q s LEU 84 Cb 0.04 -4.31 -0.01 0.00 0.03 0.00 0.00 46.19 41.94 1a4q s LEU 84 CO 0.09 -1.04 1.14 -0.44 0.23 0.00 0.00 176.35 176.33 1a4q s SER 85 N -1.40 5.15 0.61 2.29 0.01 -0.30 -2.20 113.70 117.86 1a4q s SER 85 Ca 0.66 2.12 -0.19 0.00 1.31 0.00 0.00 55.95 59.86 1a4q s SER 85 Cb -0.29 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.35 1a4q s SER 85 CO 0.34 -1.61 1.26 0.00 0.41 0.00 0.00 173.24 173.65 1a4q n GLN 87 N -1.68 2.50 0.00 0.00 0.00 -1.26 -4.97 117.38 111.98 1a4q n GLN 87 Ca 0.14 0.88 0.00 0.00 0.00 0.00 0.00 57.00 58.02 1a4q n GLN 87 Cb 0.48 -2.61 0.00 0.00 0.00 0.00 0.00 30.24 28.12 1a4q n GLN 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1a4q n GLY 88 N 0.53 2.40 0.00 2.61 0.00 -1.26 -4.57 105.19 104.90 1a4q n GLY 88 Ca 0.03 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.88 1.61 3.41 0.31 -4.97 113.62 110.10 1a4q n SER 89 Ca 0.00 -1.00 -0.10 0.00 -0.26 0.00 0.00 58.87 57.51 1a4q n SER 89 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 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 0.12 0.38 6.66 -1.32 -1.20 -4.85 115.64 115.43 1a4q s THR 90 Ca 0.00 -0.95 -0.00 0.00 -1.21 0.00 0.00 61.69 59.52 1a4q s THR 90 Cb 0.00 -0.87 -0.03 0.00 -1.51 0.00 0.00 72.50 70.09 1a4q s THR 90 CO 0.00 -0.53 0.60 -0.36 -2.21 0.00 0.00 174.62 172.12 1a4q s PHE 91 N -2.49 3.47 0.03 9.09 0.40 -1.26 -0.55 117.98 126.66 1a4q s PHE 91 Ca -0.06 0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 56.58 1a4q s PHE 91 Cb -0.02 -2.01 0.00 0.00 0.51 0.00 0.00 43.02 41.50 1a4q s PHE 91 CO -0.04 -0.00 0.16 -0.65 0.70 0.00 0.00 175.22 175.39 1a4q s GLN 92 N -4.41 0.61 0.11 0.44 -1.52 0.06 -3.95 119.66 110.99 1a4q s GLN 92 Ca 0.42 -0.58 -0.31 0.00 -1.95 0.00 0.00 55.36 52.94 1a4q s GLN 92 Cb -0.10 0.25 -0.10 0.00 -0.22 0.00 0.00 33.01 32.85 1a4q s GLN 92 CO 0.37 -0.16 1.79 0.21 -0.25 0.00 0.00 175.29 177.25 1a4q s LYS 93 N -2.20 4.15 -0.16 2.91 2.20 -1.26 -1.55 119.74 123.82 1a4q s LYS 93 Ca -0.08 2.53 -0.09 0.00 -0.36 0.00 0.00 55.97 57.96 1a4q s LYS 93 Cb -0.03 -3.61 -0.07 0.00 -1.51 0.00 0.00 37.83 32.61 1a4q s LYS 93 CO -0.02 -0.82 -0.23 0.00 -0.36 0.00 0.00 175.35 173.92 1a4q n ALA 94 N 5.71 1.84 -3.59 3.13 0.00 0.12 -4.92 120.51 122.80 1a4q n ALA 94 Ca 0.17 -0.68 -0.14 0.00 0.00 0.00 0.00 53.44 52.79 1a4q n ALA 94 Cb 0.39 0.25 -0.07 0.00 0.00 0.00 0.00 19.45 20.02 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 -7.02 -0.65 -0.11 0.00 0.20 -1.07 -5.01 118.68 105.02 1a4q s LEU 95 Ca -0.24 1.33 0.03 0.00 0.69 0.00 0.00 54.13 55.94 1a4q s LEU 95 Cb 0.09 2.40 0.00 0.00 -0.43 0.00 0.00 46.19 48.24 1a4q s LEU 95 CO 0.30 -0.28 -0.23 -0.22 -0.29 0.00 0.00 176.35 175.63 1a4q s LEU 96 N 0.20 2.12 -0.41 -0.68 2.96 -1.26 -0.34 118.68 121.27 1a4q s LEU 96 Ca -0.01 -0.56 -0.05 0.00 -0.22 0.00 0.00 54.13 53.28 1a4q s LEU 96 Cb -0.04 -1.43 0.10 0.00 0.50 0.00 0.00 46.19 45.32 1a4q s LEU 96 CO 0.02 0.14 0.22 -0.63 -1.32 0.00 0.00 176.35 174.78 1a4q s ILE 97 N 0.46 3.66 -0.56 6.68 -1.09 0.21 -5.01 121.20 125.55 1a4q s ILE 97 Ca -0.16 -1.76 0.04 0.00 -2.23 0.00 0.00 60.65 56.54 1a4q s ILE 97 Cb -0.17 -3.37 0.14 0.00 -1.58 0.00 0.00 42.46 37.48 1a4q s ILE 97 CO 0.06 -0.59 0.32 -0.55 -1.23 0.00 0.00 174.94 172.95 1a4q s SER 98 N 1.99 4.38 0.33 3.58 0.15 -1.26 -1.09 113.70 121.78 1a4q s SER 98 Ca 0.05 -3.22 0.06 0.00 0.70 0.00 0.00 55.95 53.53 1a4q s SER 98 Cb -0.23 -1.59 0.58 0.00 -1.71 0.00 0.00 66.02 63.07 1a4q s SER 98 CO -0.02 -0.19 1.82 -0.65 1.20 0.00 0.00 173.24 175.40 1a4q h PRO 99 N 6.20 0.38 -0.01 5.44 0.11 -1.96 -2.63 132.00 139.53 1a4q h PRO 99 Ca -0.01 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1a4q h PRO 99 Cb 0.86 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1a4q h PRO 99 CO 0.68 0.55 0.00 0.72 -0.21 0.00 0.00 178.00 179.74 1a4q n HIS 100 N -4.19 0.01 0.29 0.65 8.25 -1.26 -1.85 115.22 117.11 1a4q n HIS 100 Ca -0.00 -0.01 0.08 0.00 -0.26 0.00 0.00 57.72 57.53 1a4q n HIS 100 Cb 0.33 0.00 0.35 0.00 1.12 0.00 0.00 29.99 31.79 1a4q n HIS 100 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1a4q n ARG 101 N -0.77 0.08 -0.07 -0.41 1.74 -0.99 -2.15 116.66 114.10 1a4q n ARG 101 Ca 0.20 0.44 0.06 0.00 -0.77 0.00 0.00 57.85 57.78 1a4q n ARG 101 Cb 0.13 -1.70 0.10 0.00 -1.02 0.00 0.00 32.46 29.96 1a4q n ARG 101 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1a4q n PHE 102 N -1.87 0.06 -0.92 -1.55 3.72 -0.77 -4.77 117.46 111.35 1a4q n PHE 102 Ca 0.01 -0.80 0.07 0.00 -0.05 0.00 0.00 57.45 56.68 1a4q n PHE 102 Cb 0.12 -0.12 0.39 0.00 -0.94 0.00 0.00 39.48 38.93 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 -1.01 3.15 3.75 1.37 0.00 -0.91 -4.02 105.19 107.51 1a4q n GLY 103 Ca 0.10 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.79 3.12 0.41 1.61 8.01 -1.26 -3.32 118.70 124.48 1a4q s GLU 104 Ca 0.53 2.03 0.08 0.00 0.01 0.00 0.00 54.97 57.63 1a4q s GLU 104 Cb 0.41 -2.14 0.87 0.00 -4.31 0.00 0.00 34.13 28.96 1a4q s GLU 104 CO 0.15 -1.14 2.03 0.00 0.01 0.00 0.00 175.26 176.30 1a4q h ALA 105 N 1.29 1.67 -0.13 5.21 0.00 -1.95 -1.75 119.26 123.60 1a4q h ALA 105 Ca -0.51 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1a4q h ALA 105 Cb 1.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1a4q h ALA 105 CO 0.57 0.27 0.00 2.89 0.00 0.00 0.00 179.25 182.97 1a4q n ARG 106 N -4.43 1.59 -2.14 0.00 1.85 -1.26 -4.89 116.66 107.38 1a4q n ARG 106 Ca 0.01 -0.88 -0.19 0.00 -1.00 0.00 0.00 57.85 55.79 1a4q n ARG 106 Cb 0.12 -1.37 0.10 0.00 -1.05 0.00 0.00 32.46 30.26 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 1.06 0.48 0.57 2.89 0.00 -0.66 -5.05 105.19 104.49 1a4q n GLY 107 Ca 0.16 -1.99 0.06 0.00 0.00 0.00 0.00 46.02 44.25 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 -3.00 1.69 -4.68 1.61 5.03 -1.26 -4.94 115.26 109.71 1a4q n ASN 108 Ca 0.13 -3.37 -0.24 0.00 0.87 0.00 0.00 54.58 51.98 1a4q n ASN 108 Cb 0.48 -0.46 -0.07 0.00 -1.02 0.00 0.00 39.78 38.70 1a4q n ASN 108 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1a4q s SER 109 N -2.88 4.43 -0.45 6.41 0.01 -1.26 -5.08 113.70 114.89 1a4q s SER 109 Ca 0.34 -0.88 0.08 0.00 1.31 0.00 0.00 55.95 56.80 1a4q s SER 109 Cb 0.33 -0.63 0.29 0.00 0.21 0.00 0.00 66.02 66.22 1a4q s SER 109 CO -0.05 -0.27 0.67 0.00 0.41 0.00 0.00 173.24 174.00 1a4q n ALA 110 N -1.05 2.88 -1.75 1.44 0.00 -1.26 -4.26 120.51 116.51 1a4q n ALA 110 Ca -0.04 -3.81 -0.42 0.00 0.00 0.00 0.00 53.44 49.18 1a4q n ALA 110 Cb 0.62 -0.85 -0.01 0.00 0.00 0.00 0.00 19.45 19.21 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 0.78 2.64 -2.71 0.00 -0.04 -1.25 -1.01 135.00 133.41 1a4q n PRO 111 Ca 0.25 0.94 -0.38 0.00 -0.04 0.00 0.00 63.50 64.26 1a4q n PRO 111 Cb 0.53 -2.69 -0.06 0.00 -0.04 0.00 0.00 33.50 31.24 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 -0.84 4.44 -0.13 1.53 1.43 -0.63 -1.82 118.68 122.67 1a4q s LEU 112 Ca 0.61 1.94 -0.28 0.00 -1.03 0.00 0.00 54.13 55.37 1a4q s LEU 112 Cb -0.50 -3.86 -0.01 0.00 0.03 0.00 0.00 46.19 41.85 1a4q s LEU 112 CO 0.53 -0.05 0.97 -0.63 0.23 0.00 0.00 176.35 177.40 1a4q s ILE 113 N -1.43 4.80 0.23 -0.59 1.01 0.08 -4.90 121.20 120.40 1a4q s ILE 113 Ca 0.47 1.94 -0.03 0.00 0.00 0.00 0.00 60.65 63.03 1a4q s ILE 113 Cb -0.23 -4.27 -0.03 0.00 0.01 0.00 0.00 42.46 37.94 1a4q s ILE 113 CO 0.29 -0.01 0.25 0.27 0.00 0.00 0.00 174.94 175.74 1a4q s ILE 114 N 2.15 0.00 0.38 2.92 -5.25 -1.26 -1.06 121.20 119.09 1a4q s ILE 114 Ca 0.45 -1.84 -0.11 0.00 -0.99 0.00 0.00 60.65 58.17 1a4q s ILE 114 Cb -0.17 -2.44 0.04 0.00 2.95 0.00 0.00 42.46 42.84 1a4q s ILE 114 CO 0.15 0.00 0.69 -0.13 -1.79 0.00 0.00 174.94 173.87 1a4q s ARG 115 N -4.00 2.18 -1.26 0.37 0.52 -0.73 -3.55 118.95 112.48 1a4q s ARG 115 Ca 0.35 -1.60 -0.21 0.00 -0.52 0.00 0.00 55.73 53.75 1a4q s ARG 115 Cb 0.04 0.57 0.02 0.00 0.52 0.00 0.00 34.95 36.10 1a4q s ARG 115 CO 0.13 -0.99 0.59 0.39 0.02 0.00 0.00 175.30 175.44 1a4q n GLU 116 N -0.56 -1.14 -1.53 3.54 4.71 -1.26 -1.33 120.64 123.08 1a4q n GLU 116 Ca -0.05 0.25 -0.32 0.00 -0.01 0.00 0.00 57.16 57.02 1a4q n GLU 116 Cb 0.60 -3.49 0.07 0.00 -1.01 0.00 0.00 31.44 27.61 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 -6.82 2.53 0.20 3.49 0.04 -1.26 -4.13 135.00 129.06 1a4q s PRO 117 Ca 0.35 1.31 -0.23 0.00 0.04 0.00 0.00 61.00 62.46 1a4q s PRO 117 Cb -0.16 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.50 1a4q s PRO 117 CO 0.93 -1.45 0.79 -0.59 0.04 0.00 0.00 177.00 176.72 1a4q s PHE 118 N -2.57 -0.23 0.01 0.56 -0.71 -0.62 -4.89 117.98 109.53 1a4q s PHE 118 Ca 0.65 -0.12 0.05 0.00 -1.04 0.00 0.00 56.93 56.46 1a4q s PHE 118 Cb -0.19 0.66 -0.02 0.00 -1.21 0.00 0.00 43.02 42.26 1a4q s PHE 118 CO 0.48 -1.01 -0.16 0.42 -1.34 0.00 0.00 175.22 173.61 1a4q s ILE 119 N -3.65 1.23 0.01 -4.49 1.01 -1.26 -0.75 121.20 113.30 1a4q s ILE 119 Ca 0.10 -0.81 -0.01 0.00 0.00 0.00 0.00 60.65 59.93 1a4q s ILE 119 Cb -0.04 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.37 1a4q s ILE 119 CO 0.02 0.23 -0.00 0.00 0.00 0.00 0.00 174.94 175.18 1a4q s ALA 120 N -0.55 0.03 0.04 9.38 0.00 -0.87 -4.49 121.76 125.30 1a4q s ALA 120 Ca 0.05 -0.30 0.07 0.00 0.00 0.00 0.00 51.96 51.79 1a4q s ALA 120 Cb -0.07 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 1a4q s ALA 120 CO 0.00 -0.09 -0.21 0.00 0.00 0.00 0.00 175.76 175.46 1a4q n GLY 122 N 1.86 2.38 0.20 0.00 0.00 -0.00 -4.59 105.19 105.04 1a4q n GLY 122 Ca -0.17 -2.06 0.06 0.00 0.00 0.00 0.00 46.02 43.84 1a4q n GLY 122 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a4q h PRO 123 N 0.00 0.00 0.00 1.61 0.11 -1.94 -3.34 132.00 128.44 1a4q h PRO 123 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1a4q h PRO 123 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1a4q h PRO 123 CO 0.00 0.32 -1.08 1.63 -0.21 0.00 0.00 178.00 178.66 1a4q n LYS 124 N -3.81 1.13 -3.45 1.05 4.76 -1.26 -4.78 118.16 111.79 1a4q n LYS 124 Ca -0.01 -0.04 -0.13 0.00 -2.87 0.00 0.00 58.31 55.25 1a4q n LYS 124 Cb 0.40 -1.07 -0.03 0.00 -1.84 0.00 0.00 35.03 32.49 1a4q n LYS 124 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1a4q s GLU 125 N -2.24 1.22 -0.02 1.97 -1.05 -1.25 -5.12 118.70 112.21 1a4q s GLU 125 Ca -0.01 -0.35 0.03 0.00 -0.15 0.00 0.00 54.97 54.48 1a4q s GLU 125 Cb 0.04 0.56 -0.03 0.00 -0.44 0.00 0.00 34.13 34.26 1a4q s GLU 125 CO 0.24 -0.51 -0.07 0.00 0.95 0.00 0.00 175.26 175.87 1a4q s LYS 127 N -1.20 2.87 -0.43 0.00 1.02 0.13 -0.95 119.74 121.17 1a4q s LYS 127 Ca 0.15 -0.50 -0.15 0.00 0.02 0.00 0.00 55.97 55.49 1a4q s LYS 127 Cb -0.11 -2.67 0.04 0.00 -0.52 0.00 0.00 37.83 34.57 1a4q s LYS 127 CO 0.05 0.66 0.34 -1.58 -0.92 0.00 0.00 175.35 173.89 1a4q s HIS 128 N -0.77 3.24 0.15 3.18 5.65 0.45 -2.06 115.29 125.13 1a4q s HIS 128 Ca 0.12 -0.72 0.01 0.00 0.25 0.00 0.00 55.06 54.71 1a4q s HIS 128 Cb -0.11 -2.81 -0.04 0.00 -1.18 0.00 0.00 32.58 28.44 1a4q s HIS 128 CO 0.02 -0.67 0.31 -0.06 -0.65 0.00 0.00 174.74 173.68 1a4q s PHE 129 N 1.66 3.49 0.29 3.88 0.08 0.07 -1.63 117.98 125.81 1a4q s PHE 129 Ca 0.05 0.22 -0.20 0.00 0.12 0.00 0.00 56.93 57.12 1a4q s PHE 129 Cb -0.21 -1.75 0.04 0.00 -0.57 0.00 0.00 43.02 40.53 1a4q s PHE 129 CO 0.09 0.48 0.81 0.00 -0.10 0.00 0.00 175.22 176.50 1a4q s ALA 130 N -1.74 -1.17 -0.38 5.36 0.00 -1.00 -1.59 121.76 121.24 1a4q s ALA 130 Ca 0.36 -0.39 -0.06 0.00 0.00 0.00 0.00 51.96 51.87 1a4q s ALA 130 Cb -0.11 0.75 0.07 0.00 0.00 0.00 0.00 23.12 23.83 1a4q s ALA 130 CO 0.28 -1.03 0.17 -0.51 0.00 0.00 0.00 175.76 174.67 1a4q s LEU 131 N -3.02 4.77 0.53 0.00 1.02 -0.44 -2.01 118.68 119.53 1a4q s LEU 131 Ca 0.14 -1.50 -0.13 0.00 0.02 0.00 0.00 54.13 52.66 1a4q s LEU 131 Cb -0.05 -1.88 -0.06 0.00 0.02 0.00 0.00 46.19 44.23 1a4q s LEU 131 CO 0.08 -0.44 0.95 0.28 0.02 0.00 0.00 176.35 177.23 1a4q s THR 132 N 1.32 4.67 -1.68 5.49 -1.32 -0.23 -1.77 115.64 122.12 1a4q s THR 132 Ca 0.02 0.92 0.12 0.00 -1.21 0.00 0.00 61.69 61.53 1a4q s THR 132 Cb -0.22 -3.79 0.39 0.00 -1.51 0.00 0.00 72.50 67.38 1a4q s THR 132 CO 0.00 -0.83 1.29 1.41 -2.21 0.00 0.00 174.62 174.28 1a4q n HIS 133 N -1.99 0.70 -3.49 9.09 8.25 -0.22 -2.45 115.22 125.11 1a4q n HIS 133 Ca 0.05 -0.31 -0.19 0.00 -0.26 0.00 0.00 57.72 57.01 1a4q n HIS 133 Cb 0.54 -0.08 0.08 0.00 1.12 0.00 0.00 29.99 31.66 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 0.64 -2.32 -3.74 4.41 4.19 -1.26 -4.72 117.16 114.36 1a4q n TYR 134 Ca 0.14 0.95 -0.13 0.00 3.31 0.00 0.00 57.90 62.17 1a4q n TYR 134 Cb 0.45 -5.03 -0.08 0.00 0.49 0.00 0.00 39.34 35.17 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 -3.37 -0.85 0.33 2.98 0.00 -1.26 -5.06 121.76 114.52 1a4q s ALA 135 Ca 0.13 0.35 0.10 0.00 0.00 0.00 0.00 51.96 52.54 1a4q s ALA 135 Cb -0.06 0.12 -0.06 0.00 0.00 0.00 0.00 23.12 23.12 1a4q s ALA 135 CO 0.74 -0.30 -0.12 0.00 0.00 0.00 0.00 175.76 176.07 1a4q s ALA 136 N -1.55 2.91 -0.17 0.00 0.00 -1.26 -0.74 121.76 120.94 1a4q s ALA 136 Ca -0.12 -2.03 -0.01 0.00 0.00 0.00 0.00 51.96 49.80 1a4q s ALA 136 Cb -0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 1a4q s ALA 136 CO 0.03 0.13 -0.11 -1.14 0.00 0.00 0.00 175.76 174.67 1a4q s GLN 137 N -3.58 3.31 0.63 0.00 0.74 -0.75 -3.28 119.66 116.72 1a4q s GLN 137 Ca 0.32 -0.69 -0.15 0.00 0.05 0.00 0.00 55.36 54.88 1a4q s GLN 137 Cb 0.00 -2.75 -0.02 0.00 1.10 0.00 0.00 33.01 31.35 1a4q s GLN 137 CO 0.16 -0.00 1.09 -1.25 -0.55 0.00 0.00 175.29 174.74 1a4q s PRO 138 N 0.91 3.01 -0.02 1.67 0.04 -1.21 -3.89 135.00 135.51 1a4q s PRO 138 Ca -0.03 1.32 -0.21 0.00 0.04 0.00 0.00 61.00 62.13 1a4q s PRO 138 Cb -0.15 -1.98 0.07 0.00 0.04 0.00 0.00 34.50 32.48 1a4q s PRO 138 CO -0.00 -1.08 0.93 0.41 0.04 0.00 0.00 177.00 177.30 1a4q n GLY 139 N -0.69 0.33 0.00 0.56 0.00 -1.20 -5.01 105.19 99.17 1a4q n GLY 139 Ca 0.10 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.67 1.95 2.03 -0.02 0.00 -1.26 -4.70 105.19 102.52 1a4q n GLY 140 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.39 2.74 0.23 1.61 4.01 -1.26 -4.74 117.16 119.36 1a4q n TYR 141 Ca 0.00 -2.41 0.12 0.00 -0.16 0.00 0.00 57.90 55.45 1a4q n TYR 141 Cb 0.21 -0.69 0.45 0.00 -0.31 0.00 0.00 39.34 39.00 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 2.02 0.00 -3.07 -0.72 0.05 -1.93 -3.42 116.97 109.90 1a4q h TYR 142 Ca 0.43 0.00 -0.54 0.00 0.05 0.00 0.00 58.73 58.67 1a4q h TYR 142 Cb 1.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.07 1a4q h TYR 142 CO 1.04 0.13 0.68 -0.80 -1.05 0.00 0.00 178.16 178.17 1a4q s ASN 143 N -6.05 6.96 0.00 3.88 0.02 -1.26 -1.82 114.94 116.68 1a4q s ASN 143 Ca 0.02 2.09 0.00 0.00 -1.02 0.00 0.00 52.86 53.95 1a4q s ASN 143 Cb 0.09 -2.57 0.00 0.00 0.02 0.00 0.00 41.25 38.78 1a4q s ASN 143 CO 0.62 -0.58 0.00 0.61 0.02 0.00 0.00 177.10 177.76 1a4q n GLY 144 N 3.40 0.57 0.00 0.66 0.00 -1.26 -4.93 105.19 103.63 1a4q n GLY 144 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.00 0.00 1.02 2.61 -2.24 -0.75 -1.96 114.28 110.96 1a4q n THR 145 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 1a4q n THR 145 Cb 0.00 -0.42 -0.00 0.00 -2.10 0.00 0.00 70.33 67.81 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 -0.88 0.91 -2.33 -0.78 0.63 -1.26 -4.57 116.66 108.39 1a4q n ARG 146 Ca 0.17 -0.74 -0.32 0.00 -0.92 0.00 0.00 57.85 56.04 1a4q n ARG 146 Cb 0.08 -1.48 -0.03 0.00 0.45 0.00 0.00 32.46 31.48 1a4q n ARG 146 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1a4q s GLU 147 N -2.60 3.88 -0.01 -0.14 2.02 -0.83 -4.99 118.70 116.03 1a4q s GLU 147 Ca 0.16 0.89 -0.11 0.00 0.02 0.00 0.00 54.97 55.93 1a4q s GLU 147 Cb 0.18 -2.14 -0.32 0.00 0.10 0.00 0.00 34.13 31.95 1a4q s GLU 147 CO 0.64 -0.31 0.84 -0.44 0.02 0.00 0.00 175.26 176.00 1a4q h ASP 148 N 0.71 0.67 -3.79 -0.19 3.32 -1.92 -3.47 116.42 111.74 1a4q h ASP 148 Ca -0.46 -0.86 -0.32 0.00 0.02 0.00 0.00 57.03 55.41 1a4q h ASP 148 Cb 1.19 -0.22 -0.29 0.00 0.22 0.00 0.00 39.33 40.22 1a4q h ASP 148 CO 0.62 1.70 -0.75 -0.13 -1.72 0.00 0.00 179.24 178.96 1a4q s ARG 149 N -2.59 0.38 0.14 3.56 0.52 -1.26 -4.90 118.95 114.79 1a4q s ARG 149 Ca -0.12 -0.12 -0.24 0.00 -0.52 0.00 0.00 55.73 54.73 1a4q s ARG 149 Cb 0.05 -0.39 0.08 0.00 0.52 0.00 0.00 34.95 35.21 1a4q s ARG 149 CO 0.89 0.05 1.07 0.54 0.02 0.00 0.00 175.30 177.88 1a4q s ASN 150 N 0.12 -0.04 0.00 0.23 2.20 -1.26 -5.05 114.94 111.15 1a4q s ASN 150 Ca -0.01 -0.51 0.28 0.00 -0.94 0.00 0.00 52.86 51.68 1a4q s ASN 150 Cb -0.04 0.43 1.64 0.00 -2.00 0.00 0.00 41.25 41.27 1a4q s ASN 150 CO -0.00 -0.83 2.02 0.29 -2.94 0.00 0.00 177.10 175.64 1a4q n LYS 151 N -0.65 0.80 -0.04 3.55 5.02 -1.26 -3.85 118.16 121.73 1a4q n LYS 151 Ca -0.03 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1a4q n LYS 151 Cb 0.60 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.98 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 -1.05 0.00 -4.77 -0.35 4.32 -1.26 -5.00 117.00 108.89 1a4q n LEU 152 Ca 0.20 0.00 -0.40 0.00 -0.02 0.00 0.00 56.01 55.79 1a4q n LEU 152 Cb 0.12 0.19 0.01 0.00 -1.62 0.00 0.00 43.42 42.11 1a4q n LEU 152 CO 0.17 0.19 1.05 -0.13 -1.22 0.00 0.00 177.39 177.45 1a4q s ARG 153 N -2.77 3.83 0.00 3.23 1.81 -1.25 -4.51 118.95 119.29 1a4q s ARG 153 Ca -0.07 2.38 -0.02 0.00 -1.72 0.00 0.00 55.73 56.30 1a4q s ARG 153 Cb 0.08 -2.74 -0.01 0.00 -0.45 0.00 0.00 34.95 31.83 1a4q s ARG 153 CO 0.67 -0.69 0.04 -1.01 -0.68 0.00 0.00 175.30 173.63 1a4q s HIS 154 N -1.20 0.11 -0.14 -0.53 3.76 -1.03 -1.19 115.29 115.07 1a4q s HIS 154 Ca 0.58 -0.24 -0.29 0.00 -0.15 0.00 0.00 55.06 54.96 1a4q s HIS 154 Cb -0.43 -0.09 -0.01 0.00 1.11 0.00 0.00 32.58 33.16 1a4q s HIS 154 CO 0.56 -0.17 1.04 -1.17 -0.85 0.00 0.00 174.74 174.14 1a4q s LEU 155 N -1.03 4.20 0.22 0.89 2.96 -0.51 -1.07 118.68 124.35 1a4q s LEU 155 Ca -0.11 1.51 0.05 0.00 -0.22 0.00 0.00 54.13 55.36 1a4q s LEU 155 Cb -0.07 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 1a4q s LEU 155 CO -0.00 -0.54 -0.06 0.27 -1.32 0.00 0.00 176.35 174.70 1a4q s ILE 156 N 2.44 1.33 0.11 6.68 -5.25 -0.85 -0.84 121.20 124.82 1a4q s ILE 156 Ca 0.48 -2.09 -0.12 0.00 -0.99 0.00 0.00 60.65 57.93 1a4q s ILE 156 Cb -0.18 -2.22 0.01 0.00 2.95 0.00 0.00 42.46 43.02 1a4q s ILE 156 CO 0.14 -0.45 0.29 -0.94 -1.79 0.00 0.00 174.94 172.19 1a4q s SER 157 N -3.32 -0.03 0.16 4.36 1.04 -0.92 -2.39 113.70 112.61 1a4q s SER 157 Ca 0.25 -0.56 0.03 0.00 0.48 0.00 0.00 55.95 56.15 1a4q s SER 157 Cb 0.03 0.41 -0.05 0.00 0.10 0.00 0.00 66.02 66.52 1a4q s SER 157 CO 0.08 -0.81 -0.04 0.68 0.98 0.00 0.00 173.24 174.13 1a4q s VAL 158 N -3.85 0.87 0.28 5.02 -7.23 -0.65 -1.48 120.40 113.35 1a4q s VAL 158 Ca 0.06 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.93 1a4q s VAL 158 Cb 0.03 -1.99 -0.11 0.00 0.56 0.00 0.00 36.38 34.87 1a4q s VAL 158 CO -0.10 -0.61 1.56 -0.75 -0.31 0.00 0.00 175.10 174.89 1a4q s LYS 159 N -3.85 4.16 0.09 4.82 2.20 -1.26 -0.41 119.74 125.49 1a4q s LYS 159 Ca 0.20 2.51 -0.33 0.00 -0.36 0.00 0.00 55.97 57.99 1a4q s LYS 159 Cb 0.05 -3.05 -0.12 0.00 -1.51 0.00 0.00 37.83 33.20 1a4q s LYS 159 CO 0.02 -0.58 1.74 -0.11 -0.36 0.00 0.00 175.35 176.06 1a4q n LEU 160 N 2.27 3.54 0.00 5.43 7.94 -0.12 -1.68 117.00 134.38 1a4q n LEU 160 Ca 0.08 1.02 0.00 0.00 -1.11 0.00 0.00 56.01 56.00 1a4q n LEU 160 Cb 0.38 -1.46 0.00 0.00 0.53 0.00 0.00 43.42 42.87 1a4q n LEU 160 CO 0.63 -0.05 0.00 0.61 -1.11 0.00 0.00 177.39 177.47 1a4q n GLY 161 N 3.95 2.22 3.86 -3.96 0.00 -1.26 -4.93 105.19 105.07 1a4q n GLY 161 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.41 3.88 -0.03 1.61 -0.14 -0.67 -5.06 119.74 118.91 1a4q s LYS 162 Ca 0.00 0.36 -0.30 0.00 -1.36 0.00 0.00 55.97 54.67 1a4q s LYS 162 Cb 0.00 -2.78 -0.03 0.00 -1.68 0.00 0.00 37.83 33.35 1a4q s LYS 162 CO 0.00 0.39 1.03 0.42 -0.76 0.00 0.00 175.35 176.43 1a4q s ILE 163 N -1.66 4.72 -1.14 2.17 -1.09 -1.26 -4.88 121.20 118.06 1a4q s ILE 163 Ca 0.43 1.96 -0.21 0.00 -2.23 0.00 0.00 60.65 60.60 1a4q s ILE 163 Cb -0.13 -4.26 0.05 0.00 -1.58 0.00 0.00 42.46 36.54 1a4q s ILE 163 CO 0.20 0.10 1.59 -2.16 -1.23 0.00 0.00 174.94 173.44 1a4q s PRO 164 N 1.41 3.70 0.42 2.79 0.04 -1.26 -4.70 135.00 137.41 1a4q s PRO 164 Ca 0.52 -1.46 0.08 0.00 0.04 0.00 0.00 61.00 60.17 1a4q s PRO 164 Cb -0.21 -5.42 -0.02 0.00 0.04 0.00 0.00 34.50 28.89 1a4q s PRO 164 CO 0.25 -2.30 0.39 -0.08 0.04 0.00 0.00 177.00 175.30 1a4q s THR 165 N 4.94 2.65 0.22 1.26 -1.32 -1.26 -1.60 115.64 120.53 1a4q s THR 165 Ca 0.50 -1.33 -0.08 0.00 -1.21 0.00 0.00 61.69 59.57 1a4q s THR 165 Cb 0.01 -2.98 0.17 0.00 -1.51 0.00 0.00 72.50 68.20 1a4q s THR 165 CO -0.02 0.00 1.71 0.58 -2.21 0.00 0.00 174.62 174.69 1a4q h VAL 166 N 1.00 0.66 0.00 5.08 2.07 -1.40 -2.23 116.25 121.43 1a4q h VAL 166 Ca -0.41 -0.11 -0.22 0.00 0.82 0.00 0.00 66.70 66.78 1a4q h VAL 166 Cb 1.27 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 1a4q h VAL 166 CO 0.57 0.06 -1.38 -0.33 0.02 0.00 0.00 177.57 176.51 1a4q h GLU 167 N 0.32 0.00 -0.03 1.57 5.08 -1.95 -3.35 114.58 116.22 1a4q h GLU 167 Ca 0.34 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.51 1a4q h GLU 167 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1a4q h GLU 167 CO -0.39 0.52 -0.79 -0.91 -1.00 0.00 0.00 179.01 176.43 1a4q h ASN 168 N 0.00 0.33 -4.26 1.42 -0.26 -1.78 -3.46 115.58 107.57 1a4q h ASN 168 Ca -0.17 -0.24 -0.50 0.00 -0.56 0.00 0.00 56.30 54.83 1a4q h ASN 168 Cb 1.78 -0.10 0.08 0.00 -1.06 0.00 0.00 38.32 39.02 1a4q h ASN 168 CO 0.08 0.99 0.37 -0.44 -1.06 0.00 0.00 177.43 177.37 1a4q s SER 169 N -6.95 5.56 0.03 5.81 0.01 -0.86 -4.82 113.70 112.48 1a4q s SER 169 Ca -0.04 1.73 0.05 0.00 1.31 0.00 0.00 55.95 59.00 1a4q s SER 169 Cb 0.10 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.78 1a4q s SER 169 CO 0.83 -1.32 -0.09 -0.63 0.41 0.00 0.00 173.24 172.44 1a4q s ILE 170 N -2.72 3.46 -0.34 1.44 -1.09 -0.55 -4.96 121.20 116.43 1a4q s ILE 170 Ca 0.61 -0.95 -0.10 0.00 -2.23 0.00 0.00 60.65 57.97 1a4q s ILE 170 Cb -0.15 -2.53 0.01 0.00 -1.58 0.00 0.00 42.46 38.21 1a4q s ILE 170 CO 0.45 0.31 0.18 -0.36 -1.23 0.00 0.00 174.94 174.30 1a4q s PHE 171 N -1.04 3.21 -0.14 3.97 0.40 -1.26 -2.16 117.98 120.95 1a4q s PHE 171 Ca 0.18 -0.75 -0.26 0.00 -0.60 0.00 0.00 56.93 55.50 1a4q s PHE 171 Cb -0.11 -2.40 -0.23 0.00 0.51 0.00 0.00 43.02 40.79 1a4q s PHE 171 CO 0.09 -0.55 0.64 0.45 0.70 0.00 0.00 175.22 176.55 1a4q h HIS 172 N 8.39 0.00 -2.37 0.36 3.86 -1.36 -3.49 115.15 120.55 1a4q h HIS 172 Ca -0.29 0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.02 1a4q h HIS 172 Cb 1.13 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.45 1a4q h HIS 172 CO 0.61 0.97 0.46 0.00 0.86 0.00 0.00 177.93 180.83 1a4q s MET 173 N -2.18 0.90 0.15 2.45 0.23 -1.23 -5.02 119.30 114.60 1a4q s MET 173 Ca -0.19 -0.35 -0.31 0.00 -1.03 0.00 0.00 55.69 53.82 1a4q s MET 173 Cb -0.02 0.40 -0.09 0.00 -1.53 0.00 0.00 34.83 33.60 1a4q s MET 173 CO 0.62 -0.40 1.41 0.00 -2.03 0.00 0.00 175.02 174.63 1a4q s ALA 174 N -3.20 3.62 -0.29 3.16 0.00 -1.26 -1.42 121.76 122.36 1a4q s ALA 174 Ca 0.05 1.18 -0.20 0.00 0.00 0.00 0.00 51.96 52.99 1a4q s ALA 174 Cb -0.01 -3.55 0.15 0.00 0.00 0.00 0.00 23.12 19.71 1a4q s ALA 174 CO -0.09 -0.64 1.07 0.00 0.00 0.00 0.00 175.76 176.10 1a4q s ALA 175 N 0.87 -2.19 -0.35 0.00 0.00 -0.34 -4.53 121.76 115.21 1a4q s ALA 175 Ca 0.64 2.01 0.04 0.00 0.00 0.00 0.00 51.96 54.65 1a4q s ALA 175 Cb -0.38 -1.64 0.10 0.00 0.00 0.00 0.00 23.12 21.19 1a4q s ALA 175 CO 0.33 -0.28 1.03 -2.67 0.00 0.00 0.00 175.76 174.17 1a4q n TRP 176 N 2.89 0.14 -3.80 0.00 4.27 0.45 -2.80 117.44 118.60 1a4q n TRP 176 Ca -0.15 -0.44 -0.13 0.00 -3.89 0.00 0.00 57.50 52.89 1a4q n TRP 176 Cb 0.57 -0.04 -0.12 0.00 -1.36 0.00 0.00 31.31 30.36 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 -0.92 -0.22 0.19 -0.67 0.15 -1.20 -4.91 113.70 106.13 1a4q s SER 177 Ca 0.08 0.42 -0.07 0.00 0.70 0.00 0.00 55.95 57.08 1a4q s SER 177 Cb 0.04 0.45 -0.02 0.00 -1.71 0.00 0.00 66.02 64.78 1a4q s SER 177 CO 0.06 -0.09 0.27 -0.83 1.20 0.00 0.00 173.24 173.84 1a4q s GLY 178 N 0.05 0.80 0.24 9.45 0.00 -1.26 -0.96 107.32 115.63 1a4q s GLY 178 Ca -0.01 -1.16 -0.22 0.00 0.00 0.00 0.00 44.72 43.33 1a4q s GLY 178 CO 0.00 -0.98 0.74 -0.45 0.00 0.00 0.00 173.10 172.41 1a4q s SER 179 N -3.04 -0.30 -0.12 1.64 0.15 -0.45 -1.23 113.70 110.35 1a4q s SER 179 Ca 0.25 -0.48 -0.30 0.00 0.70 0.00 0.00 55.95 56.12 1a4q s SER 179 Cb 0.04 0.67 0.12 0.00 -1.71 0.00 0.00 66.02 65.14 1a4q s SER 179 CO 0.06 -1.22 1.00 0.00 1.20 0.00 0.00 173.24 174.28 1a4q s ALA 180 N -3.79 -1.92 -0.10 5.45 0.00 -1.26 -0.38 121.76 119.75 1a4q s ALA 180 Ca 0.10 1.42 -0.31 0.00 0.00 0.00 0.00 51.96 53.17 1a4q s ALA 180 Cb -0.05 -0.33 0.12 0.00 0.00 0.00 0.00 23.12 22.87 1a4q s ALA 180 CO 0.03 -0.45 1.01 0.00 0.00 0.00 0.00 175.76 176.35 1a4q s HIS 182 N -2.35 3.03 -1.61 0.00 2.46 -1.26 -0.46 115.29 115.09 1a4q s HIS 182 Ca 0.04 -0.04 0.20 0.00 0.47 0.00 0.00 55.06 55.73 1a4q s HIS 182 Cb -0.01 -1.82 0.66 0.00 -0.13 0.00 0.00 32.58 31.28 1a4q s HIS 182 CO -0.05 0.25 1.56 -0.40 -2.47 0.00 0.00 174.74 173.62 1a4q n ASP 183 N 2.64 4.17 0.00 9.88 5.68 -0.95 -4.64 116.55 133.33 1a4q n ASP 183 Ca -0.18 -2.20 0.00 0.00 -0.50 0.00 0.00 54.79 51.91 1a4q n ASP 183 Cb 0.53 -0.52 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 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 1.39 2.78 0.05 6.12 0.00 -1.26 -1.24 105.19 113.02 1a4q n GLY 184 Ca 0.24 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.03 0.77 -3.61 1.61 1.74 -1.26 -4.59 116.66 111.29 1a4q n ARG 185 Ca 0.00 0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 1a4q n ARG 185 Cb 0.00 -1.20 -0.04 0.00 -1.02 0.00 0.00 32.46 30.20 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 -2.20 1.17 0.19 5.56 2.56 -1.26 -5.01 118.70 119.71 1a4q s GLU 186 Ca -0.11 -0.69 -0.21 0.00 0.00 0.00 0.00 54.97 53.95 1a4q s GLU 186 Cb 0.03 0.50 -0.08 0.00 2.00 0.00 0.00 34.13 36.59 1a4q s GLU 186 CO 0.25 -0.48 0.72 -1.58 -0.56 0.00 0.00 175.26 173.61 1a4q s TRP 187 N -3.81 3.74 -0.15 5.30 0.52 -1.26 -2.25 118.94 121.04 1a4q s TRP 187 Ca 0.04 1.45 -0.00 0.00 0.02 0.00 0.00 56.10 57.60 1a4q s TRP 187 Cb 0.01 -2.65 -0.01 0.00 -1.15 0.00 0.00 33.47 29.67 1a4q s TRP 187 CO -0.10 0.42 -0.14 0.99 0.02 0.00 0.00 176.95 178.14 1a4q s THR 188 N -1.37 2.87 -0.07 2.01 2.01 0.39 -1.27 115.64 120.21 1a4q s THR 188 Ca 0.39 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.70 1a4q s THR 188 Cb -0.19 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 1a4q s THR 188 CO 0.22 0.51 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.26 1a4q s TYR 189 N 0.64 2.85 -0.13 4.92 2.02 0.13 -1.31 117.35 126.48 1a4q s TYR 189 Ca -0.07 -0.12 0.02 0.00 -0.37 0.00 0.00 57.07 56.52 1a4q s TYR 189 Cb -0.16 -1.71 0.01 0.00 -0.40 0.00 0.00 41.96 39.70 1a4q s TYR 189 CO 0.03 0.21 -0.19 0.42 -1.57 0.00 0.00 175.55 174.44 1a4q s ILE 190 N -0.59 1.83 -0.02 2.71 -1.09 0.49 -1.44 121.20 123.08 1a4q s ILE 190 Ca 0.09 -0.84 0.01 0.00 -2.23 0.00 0.00 60.65 57.67 1a4q s ILE 190 Cb -0.12 -1.64 0.02 0.00 -1.58 0.00 0.00 42.46 39.14 1a4q s ILE 190 CO 0.02 0.51 -0.01 -0.83 -1.23 0.00 0.00 174.94 173.39 1a4q s GLY 191 N 0.91 0.24 -0.16 6.18 0.00 -0.77 -1.34 107.32 112.38 1a4q s GLY 191 Ca -0.06 0.06 -0.04 0.00 0.00 0.00 0.00 44.72 44.68 1a4q s GLY 191 CO -0.02 0.37 -0.03 0.14 0.00 0.00 0.00 173.10 173.56 1a4q s VAL 192 N 0.68 3.93 0.00 1.40 1.01 -0.14 -0.88 120.40 126.40 1a4q s VAL 192 Ca -0.07 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1a4q s VAL 192 Cb -0.10 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1a4q s VAL 192 CO -0.01 0.48 0.00 -0.90 0.00 0.00 0.00 175.10 174.67 1a4q n ASP 193 N 3.66 0.00 0.00 3.32 5.75 -0.90 -0.41 116.55 127.97 1a4q n ASP 193 Ca -0.17 -0.76 0.00 0.00 -0.01 0.00 0.00 54.79 53.84 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 2.31 3.74 6.12 0.00 -1.26 -0.77 105.19 115.33 1a4q n GLY 194 Ca 0.00 -2.05 -0.36 0.00 0.00 0.00 0.00 46.02 43.61 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 -2.28 2.74 0.31 1.61 0.04 -1.26 -4.68 135.00 131.48 1a4q s PRO 195 Ca 0.00 1.94 0.07 0.00 0.04 0.00 0.00 61.00 63.04 1a4q s PRO 195 Cb 0.00 -1.88 0.76 0.00 0.04 0.00 0.00 34.50 33.41 1a4q s PRO 195 CO 0.00 -1.42 1.78 -0.44 0.04 0.00 0.00 177.00 176.96 1a4q h ASP 196 N 0.68 0.77 0.75 6.66 3.32 -1.97 -1.13 116.42 125.50 1a4q h ASP 196 Ca -0.51 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1a4q h ASP 196 Cb 1.32 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1a4q h ASP 196 CO 0.54 0.28 -0.12 -1.54 -1.72 0.00 0.00 179.24 176.67 1a4q n SER 197 N -4.75 0.18 -2.89 6.45 3.41 -1.26 -0.39 113.62 114.37 1a4q n SER 197 Ca 0.23 0.11 -0.12 0.00 -0.26 0.00 0.00 58.87 58.83 1a4q n SER 197 Cb 0.58 -0.25 0.05 0.00 -0.26 0.00 0.00 64.21 64.32 1a4q n SER 197 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1a4q n ASN 198 N -1.39 -1.08 -4.53 4.04 4.13 -0.53 -4.35 115.26 111.55 1a4q n ASN 198 Ca 0.09 -3.38 -0.29 0.00 1.68 0.00 0.00 54.58 52.68 1a4q n ASN 198 Cb 0.32 0.91 0.13 0.00 -1.54 0.00 0.00 39.78 39.60 1a4q n ASN 198 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1a4q s ALA 199 N -0.80 2.55 -0.15 5.41 0.00 -0.61 -4.04 121.76 124.12 1a4q s ALA 199 Ca 0.29 -0.98 -0.07 0.00 0.00 0.00 0.00 51.96 51.19 1a4q s ALA 199 Cb 0.32 -2.80 0.06 0.00 0.00 0.00 0.00 23.12 20.70 1a4q s ALA 199 CO -0.06 -1.99 0.34 -1.17 0.00 0.00 0.00 175.76 172.88 1a4q s LEU 200 N -5.68 0.04 -0.04 0.00 2.96 0.05 -3.23 118.68 112.78 1a4q s LEU 200 Ca 0.68 0.75 -0.30 0.00 -0.22 0.00 0.00 54.13 55.04 1a4q s LEU 200 Cb -0.07 1.09 -0.03 0.00 0.50 0.00 0.00 46.19 47.68 1a4q s LEU 200 CO 0.50 -0.19 1.10 -0.63 -1.32 0.00 0.00 176.35 175.81 1a4q s ILE 201 N 1.49 4.50 -0.03 6.68 -1.09 -0.70 -2.13 121.20 129.93 1a4q s ILE 201 Ca -0.08 1.80 0.07 0.00 -2.23 0.00 0.00 60.65 60.20 1a4q s ILE 201 Cb -0.10 -4.15 -0.01 0.00 -1.58 0.00 0.00 42.46 36.62 1a4q s ILE 201 CO -0.11 0.05 -0.23 -0.54 -1.23 0.00 0.00 174.94 172.87 1a4q s LYS 202 N 1.76 2.08 -0.03 2.79 1.02 -0.06 -1.24 119.74 126.07 1a4q s LYS 202 Ca 0.53 -0.84 0.07 0.00 0.02 0.00 0.00 55.97 55.76 1a4q s LYS 202 Cb -0.23 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 35.16 1a4q s LYS 202 CO 0.23 0.45 -0.25 0.42 -0.92 0.00 0.00 175.35 175.27 1a4q s ILE 203 N -0.38 2.01 -0.05 2.17 1.01 -0.22 -1.85 121.20 123.90 1a4q s ILE 203 Ca 0.04 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 59.64 1a4q s ILE 203 Cb -0.11 -1.68 0.01 0.00 0.01 0.00 0.00 42.46 40.69 1a4q s ILE 203 CO 0.01 0.57 -0.14 -0.75 0.00 0.00 0.00 174.94 174.62 1a4q s LYS 204 N -0.49 1.71 -0.30 2.79 2.20 -0.52 -1.10 119.74 124.03 1a4q s LYS 204 Ca 0.07 -0.49 -0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1a4q s LYS 204 Cb -0.11 -1.44 0.04 0.00 -1.51 0.00 0.00 37.83 34.82 1a4q s LYS 204 CO 0.00 0.12 0.01 -0.47 -0.36 0.00 0.00 175.35 174.65 1a4q s TYR 205 N 0.37 3.24 0.00 4.03 5.04 0.35 -0.69 117.35 129.68 1a4q s TYR 205 Ca -0.10 -1.76 0.00 0.00 -2.44 0.00 0.00 57.07 52.78 1a4q s TYR 205 Cb -0.13 -2.13 0.00 0.00 0.35 0.00 0.00 41.96 40.05 1a4q s TYR 205 CO 0.03 -0.78 0.00 0.41 -1.34 0.00 0.00 175.55 173.87 1a4q n GLY 206 N 4.66 3.15 0.06 8.97 0.00 -0.40 -1.95 105.19 119.69 1a4q n GLY 206 Ca -0.13 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 45.83 1a4q n GLY 206 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a4q n GLU 207 N 13.24 0.36 -3.72 1.61 -0.58 -1.26 -4.94 120.64 125.35 1a4q n GLU 207 Ca 0.00 0.05 -0.36 0.00 -0.42 0.00 0.00 57.16 56.43 1a4q n GLU 207 Cb 0.00 -1.68 -0.07 0.00 -0.57 0.00 0.00 31.44 29.13 1a4q n GLU 207 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1a4q s ALA 208 N -3.23 3.73 -0.14 0.62 0.00 -0.82 -5.05 121.76 116.87 1a4q s ALA 208 Ca 0.03 -0.58 -0.29 0.00 0.00 0.00 0.00 51.96 51.12 1a4q s ALA 208 Cb 0.13 -2.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 1a4q s ALA 208 CO 0.77 0.33 1.22 0.71 0.00 0.00 0.00 175.76 178.79 1a4q s TYR 209 N -0.22 2.98 -0.05 0.00 2.02 -1.26 -0.50 117.35 120.32 1a4q s TYR 209 Ca 0.14 1.11 0.09 0.00 -0.37 0.00 0.00 57.07 58.04 1a4q s TYR 209 Cb -0.12 -3.46 -0.14 0.00 -0.40 0.00 0.00 41.96 37.84 1a4q s TYR 209 CO 0.03 -1.47 0.13 0.25 -1.57 0.00 0.00 175.55 172.91 1a4q n THR 210 N 5.18 0.33 -3.65 -0.71 -2.24 -0.26 -4.93 114.28 108.00 1a4q n THR 210 Ca 0.13 -0.32 -0.03 0.00 -2.27 0.00 0.00 64.05 61.56 1a4q n THR 210 Cb 0.45 -0.24 -0.01 0.00 -2.10 0.00 0.00 70.33 68.43 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 -3.68 -0.18 0.13 3.42 2.15 -1.19 -4.82 116.67 112.51 1a4q s ASP 211 Ca -0.04 -0.20 -0.01 0.00 0.43 0.00 0.00 52.55 52.73 1a4q s ASP 211 Cb 0.05 0.34 -0.04 0.00 -0.30 0.00 0.00 42.92 42.96 1a4q s ASP 211 CO 0.41 -0.60 0.05 0.42 -0.17 0.00 0.00 175.17 175.27 1a4q s THR 212 N -2.92 0.16 -0.02 1.71 -4.23 -1.26 -1.05 115.64 108.03 1a4q s THR 212 Ca 0.11 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.71 1a4q s THR 212 Cb 0.00 -2.05 0.02 0.00 1.34 0.00 0.00 72.50 71.81 1a4q s THR 212 CO -0.03 -0.47 -0.02 -0.47 -0.54 0.00 0.00 174.62 173.10 1a4q s TYR 213 N -4.01 0.37 0.37 3.99 5.04 -0.37 -4.97 117.35 117.78 1a4q s TYR 213 Ca 0.24 -0.05 -0.07 0.00 -2.44 0.00 0.00 57.07 54.75 1a4q s TYR 213 Cb 0.07 -0.37 -0.05 0.00 0.35 0.00 0.00 41.96 41.96 1a4q s TYR 213 CO 0.02 -0.09 0.68 -1.01 -1.34 0.00 0.00 175.55 173.81 1a4q s HIS 214 N 0.61 3.49 0.20 4.97 3.76 -1.26 -1.71 115.29 125.34 1a4q s HIS 214 Ca -0.06 0.82 -0.33 0.00 -0.15 0.00 0.00 55.06 55.34 1a4q s HIS 214 Cb -0.10 -2.27 -0.13 0.00 1.11 0.00 0.00 32.58 31.20 1a4q s HIS 214 CO -0.01 -0.02 1.62 0.45 -0.85 0.00 0.00 174.74 175.93 1a4q n SER 215 N -1.35 3.48 -0.33 1.40 2.88 -1.20 -4.94 113.62 113.56 1a4q n SER 215 Ca 0.00 1.09 0.06 0.00 -1.33 0.00 0.00 58.87 58.69 1a4q n SER 215 Cb 0.54 -1.50 0.01 0.00 -0.75 0.00 0.00 64.21 62.51 1a4q n SER 215 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1a4q n TYR 216 N 3.36 0.00 -1.00 0.66 4.11 -1.26 -4.56 117.16 118.46 1a4q n TYR 216 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.05 1a4q n TYR 216 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.66 1a4q n TYR 216 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1a4q n ALA 217 N -0.05 0.79 -4.11 -3.48 0.00 -1.26 -5.04 120.51 107.37 1a4q n ALA 217 Ca 0.06 -0.39 -0.31 0.00 0.00 0.00 0.00 53.44 52.79 1a4q n ALA 217 Cb 0.28 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.70 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 0.00 -1.58 -2.87 0.00 4.13 -1.26 -4.65 115.26 109.03 1a4q n ASN 218 Ca 0.00 -1.03 -0.06 0.00 1.68 0.00 0.00 54.58 55.16 1a4q n ASN 218 Cb 0.45 -2.78 -0.00 0.00 -1.54 0.00 0.00 39.78 35.90 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 -3.88 -1.11 -0.66 6.41 3.84 -1.25 -4.49 114.94 113.80 1a4q s ASN 219 Ca 0.34 -1.80 -0.09 0.00 0.21 0.00 0.00 52.86 51.52 1a4q s ASN 219 Cb -0.19 1.64 0.01 0.00 -0.55 0.00 0.00 41.25 42.16 1a4q s ASN 219 CO 0.92 -0.08 0.65 -0.38 -2.79 0.00 0.00 177.10 175.42 1a4q n ILE 220 N 3.07 -7.46 -1.68 -5.21 5.41 0.48 -1.34 119.36 112.63 1a4q n ILE 220 Ca 0.19 0.10 -0.43 0.00 1.00 0.00 0.00 62.75 63.61 1a4q n ILE 220 Cb 0.55 -5.35 -0.01 0.00 -0.71 0.00 0.00 39.64 34.12 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 -1.48 3.20 -3.83 1.39 7.94 -1.26 -4.53 117.00 118.42 1a4q n LEU 221 Ca -0.08 1.19 -0.06 0.00 -1.11 0.00 0.00 56.01 55.95 1a4q n LEU 221 Cb 0.58 -1.44 -0.01 0.00 0.53 0.00 0.00 43.42 43.07 1a4q n LEU 221 CO 0.56 -0.64 0.54 0.00 -1.11 0.00 0.00 177.39 176.74 1a4q s ARG 222 N -1.62 1.68 0.00 1.96 1.70 -0.43 -4.81 118.95 117.43 1a4q s ARG 222 Ca 0.58 -0.95 0.00 0.00 -0.47 0.00 0.00 55.73 54.89 1a4q s ARG 222 Cb -0.60 0.56 0.00 0.00 -0.57 0.00 0.00 34.95 34.34 1a4q s ARG 222 CO 0.60 -0.77 0.00 -2.37 -1.08 0.00 0.00 175.30 171.68 1a4q n THR 223 N -0.47 0.00 -0.21 4.99 5.66 -1.26 -1.45 114.28 121.53 1a4q n THR 223 Ca -0.05 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.88 1a4q n THR 223 Cb 0.59 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.40 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 0.90 -2.36 1.09 4.20 -1.73 -3.41 115.11 113.80 1a4q h GLN 224 Ca 0.00 -0.17 -0.28 0.00 0.06 0.00 0.00 58.65 58.26 1a4q h GLN 224 Cb 0.00 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.64 1a4q h GLN 224 CO 0.00 0.78 -0.37 0.39 -0.67 0.00 0.00 178.83 178.95 1a4q n GLU 225 N -4.45 -1.81 -3.82 1.46 -0.58 -0.36 -4.40 120.64 106.68 1a4q n GLU 225 Ca 0.03 0.66 -0.06 0.00 -0.42 0.00 0.00 57.16 57.37 1a4q n GLU 225 Cb 0.18 -4.92 -0.01 0.00 -0.57 0.00 0.00 31.44 26.11 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 -2.51 -0.20 0.33 1.62 1.04 -1.25 -4.61 113.70 108.12 1a4q s SER 226 Ca 0.07 -0.58 -0.29 0.00 0.48 0.00 0.00 55.95 55.63 1a4q s SER 226 Cb -0.03 0.64 -0.11 0.00 0.10 0.00 0.00 66.02 66.63 1a4q s SER 226 CO 0.08 -1.20 1.51 0.00 0.98 0.00 0.00 173.24 174.60 1a4q s ALA 227 N -3.51 3.63 1.01 5.32 0.00 -1.26 -4.25 121.76 122.71 1a4q s ALA 227 Ca 0.12 1.52 -0.13 0.00 0.00 0.00 0.00 51.96 53.48 1a4q s ALA 227 Cb -0.04 -3.61 0.17 0.00 0.00 0.00 0.00 23.12 19.64 1a4q s ALA 227 CO 0.06 -0.97 0.98 0.00 0.00 0.00 0.00 175.76 175.83 1a4q s ASN 229 N -4.56 1.08 -0.07 0.00 -0.87 -0.98 -4.70 114.94 104.83 1a4q s ASN 229 Ca 0.56 0.11 -0.00 0.00 -1.57 0.00 0.00 52.86 51.96 1a4q s ASN 229 Cb -0.02 0.17 -0.03 0.00 -0.02 0.00 0.00 41.25 41.36 1a4q s ASN 229 CO 0.40 -0.27 -0.04 0.00 -2.57 0.00 0.00 177.10 174.61 1a4q s ILE 231 N -0.84 -0.15 -1.57 0.00 2.07 -0.15 -4.61 121.20 115.96 1a4q s ILE 231 Ca 0.13 0.37 -0.01 0.00 -1.41 0.00 0.00 60.65 59.73 1a4q s ILE 231 Cb -0.11 -0.19 0.00 0.00 0.13 0.00 0.00 42.46 42.29 1a4q s ILE 231 CO 0.02 0.16 0.14 0.61 -1.91 0.00 0.00 174.94 173.96 1a4q n GLY 232 N 5.13 -0.50 1.15 1.50 0.00 -0.73 -1.21 105.19 110.53 1a4q n GLY 232 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.08 1.11 3.63 -0.02 0.00 -1.26 -5.00 105.19 102.57 1a4q n GLY 233 Ca -0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.79 5.98 -0.15 1.61 1.01 -0.35 -4.34 116.67 117.64 1a4q s ASP 234 Ca 0.00 0.07 -0.02 0.00 0.71 0.00 0.00 52.55 53.32 1a4q s ASP 234 Cb 0.00 -2.08 -0.01 0.00 1.01 0.00 0.00 42.92 41.84 1a4q s ASP 234 CO 0.00 0.06 -0.10 0.00 0.21 0.00 0.00 175.17 175.34 1a4q s TYR 236 N 0.60 3.10 -0.02 0.00 1.51 -0.09 -0.42 117.35 122.03 1a4q s TYR 236 Ca -0.06 0.13 0.00 0.00 -1.01 0.00 0.00 57.07 56.13 1a4q s TYR 236 Cb -0.15 -1.78 0.03 0.00 -0.11 0.00 0.00 41.96 39.95 1a4q s TYR 236 CO 0.03 0.41 0.02 -1.17 -1.11 0.00 0.00 175.55 173.74 1a4q s LEU 237 N -0.80 1.16 0.10 -1.29 2.96 -0.31 -2.33 118.68 118.17 1a4q s LEU 237 Ca 0.12 0.02 -0.24 0.00 -0.22 0.00 0.00 54.13 53.82 1a4q s LEU 237 Cb -0.11 -0.09 -0.07 0.00 0.50 0.00 0.00 46.19 46.42 1a4q s LEU 237 CO 0.02 -0.11 0.74 -0.32 -1.32 0.00 0.00 176.35 175.36 1a4q s MET 238 N 0.99 4.49 0.10 1.98 -2.45 -1.26 -0.76 119.30 122.38 1a4q s MET 238 Ca -0.09 1.06 0.02 0.00 -1.25 0.00 0.00 55.69 55.43 1a4q s MET 238 Cb -0.12 -3.30 -0.04 0.00 1.25 0.00 0.00 34.83 32.62 1a4q s MET 238 CO -0.03 0.47 -0.06 0.96 1.05 0.00 0.00 175.02 177.41 1a4q s ILE 239 N -0.71 0.68 0.21 10.11 -4.36 -0.41 -3.65 121.20 123.07 1a4q s ILE 239 Ca 0.36 -1.93 -0.13 0.00 -0.26 0.00 0.00 60.65 58.69 1a4q s ILE 239 Cb -0.22 -1.67 0.00 0.00 1.25 0.00 0.00 42.46 41.82 1a4q s ILE 239 CO 0.24 -0.87 0.43 0.28 0.24 0.00 0.00 174.94 175.25 1a4q s THR 240 N -3.62 0.03 -0.25 8.37 -1.32 -0.53 -1.26 115.64 117.06 1a4q s THR 240 Ca 0.12 -1.23 -0.19 0.00 -1.21 0.00 0.00 61.69 59.18 1a4q s THR 240 Cb 0.05 -1.92 0.07 0.00 -1.51 0.00 0.00 72.50 69.19 1a4q s THR 240 CO -0.05 -0.12 0.64 -0.62 -2.21 0.00 0.00 174.62 172.26 1a4q s ASP 241 N -2.96 -0.76 0.00 8.08 -1.08 -1.26 -1.32 116.67 117.37 1a4q s ASP 241 Ca 0.17 1.34 0.00 0.00 -0.52 0.00 0.00 52.55 53.55 1a4q s ASP 241 Cb 0.00 1.30 0.00 0.00 -1.46 0.00 0.00 42.92 42.76 1a4q s ASP 241 CO 0.03 -0.23 0.00 0.61 0.52 0.00 0.00 175.17 176.10 1a4q n GLY 242 N 3.43 1.32 3.71 2.66 0.00 -0.45 -3.85 105.19 112.00 1a4q n GLY 242 Ca -0.17 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 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 0.00 6.75 0.32 1.61 0.15 -0.87 -4.72 113.70 116.94 1a4q s SER 243 Ca 0.00 2.37 0.25 0.00 0.70 0.00 0.00 55.95 59.27 1a4q s SER 243 Cb 0.00 -2.58 1.14 0.00 -1.71 0.00 0.00 66.02 62.87 1a4q s SER 243 CO 0.00 -0.73 1.75 0.00 1.20 0.00 0.00 173.24 175.46 1a4q h ALA 244 N 7.23 1.00 -0.14 5.45 0.00 -1.92 -2.20 119.26 128.67 1a4q h ALA 244 Ca -0.42 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1a4q h ALA 244 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1a4q h ALA 244 CO 0.89 0.00 -0.05 -1.13 0.00 0.00 0.00 179.25 178.96 1a4q n SER 245 N -2.37 2.87 0.00 0.00 3.41 -1.26 -3.92 113.62 112.35 1a4q n SER 245 Ca 0.01 -3.22 0.00 0.00 -0.26 0.00 0.00 58.87 55.39 1a4q n SER 245 Cb 0.17 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 1a4q n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a4q n GLY 246 N -1.03 4.59 3.72 5.00 0.00 -0.83 -4.91 105.19 111.73 1a4q n GLY 246 Ca 0.20 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 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 2.31 5.03 -0.33 -0.61 1.01 -1.25 -4.80 121.20 122.56 1a4q s ILE 247 Ca 0.00 1.47 -0.02 0.00 0.00 0.00 0.00 60.65 62.10 1a4q s ILE 247 Cb 0.00 -4.05 0.12 0.00 0.01 0.00 0.00 42.46 38.54 1a4q s ILE 247 CO 0.00 0.26 0.17 -0.44 0.00 0.00 0.00 174.94 174.92 1a4q s SER 248 N 0.76 3.36 -0.43 3.58 0.01 -0.77 -2.04 113.70 118.16 1a4q s SER 248 Ca 0.38 -1.78 -0.22 0.00 1.31 0.00 0.00 55.95 55.64 1a4q s SER 248 Cb -0.18 -0.47 0.02 0.00 0.21 0.00 0.00 66.02 65.61 1a4q s SER 248 CO 0.19 -0.37 0.69 -0.54 0.41 0.00 0.00 173.24 173.62 1a4q s LYS 249 N 1.51 3.36 0.99 12.44 1.02 -1.25 -2.03 119.74 135.79 1a4q s LYS 249 Ca 0.13 -0.23 -0.13 0.00 0.02 0.00 0.00 55.97 55.76 1a4q s LYS 249 Cb -0.20 -3.93 0.18 0.00 -0.52 0.00 0.00 37.83 33.37 1a4q s LYS 249 CO -0.18 -1.02 1.11 0.00 -0.92 0.00 0.00 175.35 174.34 1a4q s ARG 251 N -5.08 0.88 -0.02 0.00 0.52 -0.39 -4.53 118.95 110.33 1a4q s ARG 251 Ca 0.65 -1.08 0.07 0.00 -0.52 0.00 0.00 55.73 54.86 1a4q s ARG 251 Cb -0.17 0.32 -0.02 0.00 0.52 0.00 0.00 34.95 35.60 1a4q s ARG 251 CO 0.56 -0.27 -0.25 -0.06 0.02 0.00 0.00 175.30 175.30 1a4q s PHE 252 N -3.90 2.37 -0.10 -0.53 0.40 -0.48 -1.29 117.98 114.45 1a4q s PHE 252 Ca 0.09 -0.42 -0.03 0.00 -0.60 0.00 0.00 56.93 55.97 1a4q s PHE 252 Cb 0.05 -1.52 -0.03 0.00 0.51 0.00 0.00 43.02 42.03 1a4q s PHE 252 CO -0.08 -0.02 0.03 -0.51 0.70 0.00 0.00 175.22 175.34 1a4q s LEU 253 N -0.61 3.70 -0.23 -0.37 1.43 0.06 -0.62 118.68 122.04 1a4q s LEU 253 Ca 0.10 0.17 -0.06 0.00 -1.03 0.00 0.00 54.13 53.31 1a4q s LEU 253 Cb -0.10 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1a4q s LEU 253 CO -0.01 0.35 0.02 -0.75 0.23 0.00 0.00 176.35 176.19 1a4q s LYS 254 N -0.70 3.57 -0.07 1.70 2.20 -0.23 -1.16 119.74 125.05 1a4q s LYS 254 Ca 0.11 -0.53 0.02 0.00 -0.36 0.00 0.00 55.97 55.22 1a4q s LYS 254 Cb -0.12 -3.17 0.01 0.00 -1.51 0.00 0.00 37.83 33.05 1a4q s LYS 254 CO 0.02 -0.13 -0.13 0.42 -0.36 0.00 0.00 175.35 175.18 1a4q s ILE 255 N 1.39 1.22 -0.10 5.43 1.01 0.44 -0.60 121.20 130.00 1a4q s ILE 255 Ca 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.19 1a4q s ILE 255 Cb -0.15 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.23 1a4q s ILE 255 CO 0.01 0.38 -0.09 -0.60 0.00 0.00 0.00 174.94 174.64 1a4q s ARG 256 N 0.75 1.56 -1.53 2.79 3.52 0.11 -0.42 118.95 125.73 1a4q s ARG 256 Ca -0.13 -0.30 -0.07 0.00 -0.13 0.00 0.00 55.73 55.11 1a4q s ARG 256 Cb -0.16 -1.52 0.06 0.00 -1.56 0.00 0.00 34.95 31.77 1a4q s ARG 256 CO 0.03 -0.17 0.50 0.39 -0.81 0.00 0.00 175.30 175.23 1a4q n GLU 257 N 4.58 -2.98 -1.00 5.12 1.02 -1.26 -1.70 120.64 124.41 1a4q n GLU 257 Ca -0.16 0.36 -0.00 0.00 -0.02 0.00 0.00 57.16 57.34 1a4q n GLU 257 Cb 0.51 -4.62 -0.00 0.00 -0.02 0.00 0.00 31.44 27.30 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 -1.85 0.49 3.09 0.62 0.00 -1.26 -4.89 105.19 101.39 1a4q n GLY 258 Ca -0.18 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.06 1.64 -0.14 1.61 0.52 -0.69 -3.83 118.95 118.00 1a4q s ARG 259 Ca 0.00 -0.52 -0.29 0.00 -0.52 0.00 0.00 55.73 54.40 1a4q s ARG 259 Cb 0.00 -1.42 -0.04 0.00 0.52 0.00 0.00 34.95 34.02 1a4q s ARG 259 CO 0.00 0.17 1.62 0.42 0.02 0.00 0.00 175.30 177.53 1a4q s ILE 260 N 0.21 3.68 -0.89 1.52 1.01 -1.26 -0.71 121.20 124.75 1a4q s ILE 260 Ca -0.06 0.80 0.17 0.00 0.00 0.00 0.00 60.65 61.55 1a4q s ILE 260 Cb -0.12 -3.60 -0.16 0.00 0.01 0.00 0.00 42.46 38.59 1a4q s ILE 260 CO 0.02 -0.17 0.73 2.30 0.00 0.00 0.00 174.94 177.83 1a4q n ILE 261 N 5.91 0.00 -3.62 2.92 -5.35 0.24 -4.95 119.36 114.51 1a4q n ILE 261 Ca 0.18 -0.13 -0.11 0.00 -0.27 0.00 0.00 62.75 62.41 1a4q n ILE 261 Cb 0.44 1.03 -0.07 0.00 -1.74 0.00 0.00 39.64 39.30 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 -2.50 0.64 -0.14 6.28 2.20 -1.14 -5.00 119.74 120.07 1a4q s LYS 262 Ca 0.07 0.66 -0.08 0.00 -0.36 0.00 0.00 55.97 56.26 1a4q s LYS 262 Cb 0.13 0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 36.72 1a4q s LYS 262 CO 0.65 -0.10 0.14 -1.21 -0.36 0.00 0.00 175.35 174.48 1a4q s GLU 263 N 0.08 3.66 -0.15 4.03 2.02 -1.26 -1.07 118.70 126.01 1a4q s GLU 263 Ca 0.01 -0.14 0.01 0.00 0.02 0.00 0.00 54.97 54.87 1a4q s GLU 263 Cb -0.04 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.95 1a4q s GLU 263 CO -0.03 0.64 -0.15 0.42 0.02 0.00 0.00 175.26 176.16 1a4q s ILE 264 N -0.64 1.67 -0.40 -1.63 1.01 0.21 -4.99 121.20 116.42 1a4q s ILE 264 Ca 0.13 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 59.97 1a4q s ILE 264 Cb -0.12 -1.55 0.04 0.00 0.01 0.00 0.00 42.46 40.84 1a4q s ILE 264 CO 0.03 0.47 0.25 -0.36 0.00 0.00 0.00 174.94 175.33 1a4q s PHE 265 N 1.40 3.26 0.92 3.97 0.08 -1.26 -1.38 117.98 124.98 1a4q s PHE 265 Ca 0.04 -0.97 -0.11 0.00 0.12 0.00 0.00 56.93 56.01 1a4q s PHE 265 Cb -0.13 -2.61 0.15 0.00 -0.57 0.00 0.00 43.02 39.86 1a4q s PHE 265 CO -0.10 -0.68 1.10 -2.14 -0.10 0.00 0.00 175.22 173.30 1a4q s PRO 266 N 1.57 0.98 0.24 0.24 0.02 -1.26 -4.68 135.00 132.11 1a4q s PRO 266 Ca 0.03 1.22 0.10 0.00 0.02 0.00 0.00 61.00 62.37 1a4q s PRO 266 Cb -0.20 -1.75 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 1a4q s PRO 266 CO 0.07 -2.55 -0.11 0.99 -0.33 0.00 0.00 177.00 175.07 1a4q s THR 267 N -2.72 2.96 0.00 0.99 2.01 -0.71 -4.98 115.64 113.19 1a4q s THR 267 Ca 0.65 -2.03 0.00 0.00 0.31 0.00 0.00 61.69 60.62 1a4q s THR 267 Cb -0.21 -2.53 0.00 0.00 0.01 0.00 0.00 72.50 69.77 1a4q s THR 267 CO 0.58 -0.30 0.00 0.61 -0.69 0.00 0.00 174.62 174.83 1a4q n GLY 268 N -0.47 0.52 3.44 4.40 0.00 -1.26 -1.16 105.19 110.66 1a4q n GLY 268 Ca -0.08 -1.75 -0.44 0.00 0.00 0.00 0.00 46.02 43.75 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 3.40 0.00 1.61 3.00 0.64 -4.81 118.95 122.79 1a4q s ARG 269 Ca 0.00 -1.49 0.07 0.00 -1.00 0.00 0.00 55.73 53.31 1a4q s ARG 269 Cb 0.00 -4.63 0.19 0.00 0.00 0.00 0.00 34.95 30.51 1a4q s ARG 269 CO 0.00 -1.74 1.14 0.28 0.00 0.00 0.00 175.30 174.98 1a4q n VAL 270 N 5.55 0.93 0.24 7.11 0.31 -1.26 -4.49 118.33 126.73 1a4q n VAL 270 Ca 0.12 -0.97 0.14 0.00 -0.01 0.00 0.00 64.34 63.62 1a4q n VAL 270 Cb 0.47 0.54 0.38 0.00 -0.91 0.00 0.00 33.84 34.33 1a4q n VAL 270 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1a4q h GLU 271 N 1.33 0.00 -0.78 5.55 9.09 -1.87 -3.38 114.58 124.52 1a4q h GLU 271 Ca 0.00 0.00 0.14 0.00 0.05 0.00 0.00 59.36 59.55 1a4q h GLU 271 Cb 0.63 0.00 -0.21 0.00 -1.65 0.00 0.00 28.75 27.52 1a4q h GLU 271 CO 0.00 0.01 -0.13 -1.58 0.05 0.00 0.00 179.01 177.36 1a4q s HIS 272 N -3.40 -1.23 -0.05 2.06 5.04 -1.24 -1.85 115.29 114.62 1a4q s HIS 272 Ca 0.05 1.32 -0.01 0.00 -1.54 0.00 0.00 55.06 54.88 1a4q s HIS 272 Cb 0.07 0.44 0.03 0.00 0.04 0.00 0.00 32.58 33.15 1a4q s HIS 272 CO 0.62 -0.67 0.02 0.99 -2.34 0.00 0.00 174.74 173.36 1a4q s THR 273 N 2.89 0.12 0.11 0.89 2.01 -0.86 -4.53 115.64 116.28 1a4q s THR 273 Ca 0.13 0.23 0.05 0.00 0.31 0.00 0.00 61.69 62.41 1a4q s THR 273 Cb -0.13 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.04 1a4q s THR 273 CO -0.17 0.19 -0.13 -1.61 -0.69 0.00 0.00 174.62 172.21 1a4q s GLU 274 N 1.75 0.95 -1.42 4.92 0.41 0.29 -4.34 118.70 121.26 1a4q s GLU 274 Ca 0.00 -1.20 -0.13 0.00 -0.41 0.00 0.00 54.97 53.24 1a4q s GLU 274 Cb -0.13 -0.76 0.02 0.00 -1.78 0.00 0.00 34.13 31.48 1a4q s GLU 274 CO -0.03 0.14 0.27 0.39 -0.49 0.00 0.00 175.26 175.54 1a4q n GLU 275 N 0.57 -0.77 -2.14 1.61 1.02 -1.26 -0.45 120.64 119.22 1a4q n GLU 275 Ca -0.16 0.10 -0.41 0.00 -0.02 0.00 0.00 57.16 56.67 1a4q n GLU 275 Cb 0.57 -3.22 -0.02 0.00 -0.02 0.00 0.00 31.44 28.75 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 -1.05 4.03 0.14 0.00 2.01 -0.68 -4.71 115.64 115.38 1a4q s THR 277 Ca 0.49 -1.00 0.10 0.00 0.31 0.00 0.00 61.69 61.59 1a4q s THR 277 Cb -0.39 -3.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1a4q s THR 277 CO 0.51 -0.17 -0.21 0.00 -0.69 0.00 0.00 174.62 174.07 1a4q s GLY 279 N -2.26 0.25 -0.22 0.00 0.00 -0.66 -4.93 107.32 99.51 1a4q s GLY 279 Ca 0.18 -0.60 -0.16 0.00 0.00 0.00 0.00 44.72 44.14 1a4q s GLY 279 CO 0.09 0.21 0.41 -1.36 0.00 0.00 0.00 173.10 172.45 1a4q s PHE 280 N -2.50 3.34 -0.12 1.90 0.08 -1.26 -1.04 117.98 118.37 1a4q s PHE 280 Ca 0.16 0.59 0.15 0.00 0.12 0.00 0.00 56.93 57.95 1a4q s PHE 280 Cb -0.05 -2.57 -0.06 0.00 -0.57 0.00 0.00 43.02 39.78 1a4q s PHE 280 CO 0.09 -0.09 1.14 0.00 -0.10 0.00 0.00 175.22 176.26 1a4q h ALA 281 N 7.59 0.64 -2.03 5.36 0.00 -1.15 -3.44 119.26 126.23 1a4q h ALA 281 Ca -0.34 -0.69 0.03 0.00 0.00 0.00 0.00 54.91 53.91 1a4q h ALA 281 Cb 1.16 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1a4q h ALA 281 CO 0.70 0.83 0.17 -1.13 0.00 0.00 0.00 179.25 179.82 1a4q n SER 282 N -3.08 -0.64 0.03 0.00 3.41 -1.16 -4.91 113.62 107.27 1a4q n SER 282 Ca -0.04 -1.37 0.07 0.00 -0.26 0.00 0.00 58.87 57.27 1a4q n SER 282 Cb 0.81 1.05 0.33 0.00 -0.26 0.00 0.00 64.21 66.13 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 -0.93 0.14 -0.01 4.04 3.02 -1.26 -3.28 115.26 116.98 1a4q n ASN 283 Ca -0.01 0.54 0.06 0.00 -0.03 0.00 0.00 54.58 55.13 1a4q n ASN 283 Cb 0.20 -0.57 -0.09 0.00 -0.61 0.00 0.00 39.78 38.71 1a4q n ASN 283 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1a4q n LYS 284 N -1.66 0.40 -4.14 3.52 4.76 -1.26 -4.86 118.16 114.93 1a4q n LYS 284 Ca 0.03 -0.10 -0.25 0.00 -2.87 0.00 0.00 58.31 55.11 1a4q n LYS 284 Cb 0.16 -1.28 -0.17 0.00 -1.84 0.00 0.00 35.03 31.91 1a4q n LYS 284 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1a4q s THR 285 N -2.80 0.97 -0.07 -0.18 2.01 -1.21 -0.65 115.64 113.72 1a4q s THR 285 Ca -0.04 -0.31 -0.14 0.00 0.31 0.00 0.00 61.69 61.51 1a4q s THR 285 Cb 0.07 -0.96 -0.05 0.00 0.01 0.00 0.00 72.50 71.57 1a4q s THR 285 CO 0.49 0.34 0.34 -0.63 -0.69 0.00 0.00 174.62 174.47 1a4q s ILE 286 N 1.31 5.18 0.14 1.82 1.01 0.30 -0.52 121.20 130.44 1a4q s ILE 286 Ca -0.03 0.68 0.10 0.00 0.00 0.00 0.00 60.65 61.40 1a4q s ILE 286 Cb -0.14 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1a4q s ILE 286 CO -0.03 0.52 -0.24 -1.61 0.00 0.00 0.00 174.94 173.58 1a4q s GLU 287 N -0.57 1.34 0.01 2.79 2.02 -0.21 -0.17 118.70 123.91 1a4q s GLU 287 Ca 0.21 -1.34 0.01 0.00 0.02 0.00 0.00 54.97 53.87 1a4q s GLU 287 Cb -0.15 -1.70 -0.01 0.00 0.10 0.00 0.00 34.13 32.37 1a4q s GLU 287 CO 0.09 0.39 -0.03 0.00 0.02 0.00 0.00 175.26 175.73 1a4q s ALA 289 N -0.56 2.75 0.37 0.00 0.00 -0.50 -1.25 121.76 122.57 1a4q s ALA 289 Ca -0.04 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 50.71 1a4q s ALA 289 Cb -0.04 -1.65 -0.00 0.00 0.00 0.00 0.00 23.12 21.43 1a4q s ALA 289 CO -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 175.76 175.29 1a4q s ARG 291 N -3.34 3.00 -0.25 0.00 3.52 0.40 -3.83 118.95 118.45 1a4q s ARG 291 Ca 0.00 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.91 1a4q s ARG 291 Cb 0.00 -2.57 0.00 0.00 -1.56 0.00 0.00 34.95 30.82 1a4q s ARG 291 CO 0.00 0.44 0.01 0.34 -0.81 0.00 0.00 175.30 175.28 1a4q s ASP 292 N -0.23 4.66 0.00 -2.12 -1.08 -1.26 -0.55 116.67 116.09 1a4q s ASP 292 Ca 0.02 -0.55 0.25 0.00 -0.52 0.00 0.00 52.55 51.75 1a4q s ASP 292 Cb -0.13 -1.79 0.56 0.00 -1.46 0.00 0.00 42.92 40.09 1a4q s ASP 292 CO 0.03 -0.09 1.44 -3.20 0.52 0.00 0.00 175.17 173.87 1a4q n ASN 293 N 4.81 0.88 -0.05 -0.34 5.15 -1.26 -4.50 115.26 119.95 1a4q n ASN 293 Ca -0.16 -0.68 -0.10 0.00 -0.60 0.00 0.00 54.58 53.03 1a4q n ASN 293 Cb 0.49 0.25 -0.04 0.00 -0.53 0.00 0.00 39.78 39.96 1a4q n ASN 293 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1a4q n SER 294 N -0.99 0.84 -0.06 1.20 2.88 -1.25 -0.17 113.62 116.06 1a4q n SER 294 Ca 0.09 0.11 -0.04 0.00 -1.33 0.00 0.00 58.87 57.70 1a4q n SER 294 Cb 0.35 -0.28 -0.11 0.00 -0.75 0.00 0.00 64.21 63.42 1a4q n SER 294 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1a4q n TYR 295 N -3.40 0.00 -3.91 0.66 4.01 -1.25 -3.51 117.16 109.76 1a4q n TYR 295 Ca -0.19 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.46 1a4q n TYR 295 Cb 0.64 -0.62 -0.08 0.00 -0.31 0.00 0.00 39.34 38.97 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 -2.44 0.13 -2.36 -0.72 -1.32 -1.22 -4.51 115.64 103.20 1a4q s THR 296 Ca -0.07 -1.30 0.22 0.00 -1.21 0.00 0.00 61.69 59.33 1a4q s THR 296 Cb 0.05 -1.48 0.09 0.00 -1.51 0.00 0.00 72.50 69.65 1a4q s THR 296 CO 0.57 -0.61 1.12 0.00 -2.21 0.00 0.00 174.62 173.49 1a4q n ALA 297 N -0.08 2.94 -1.84 11.08 0.00 -1.26 -4.55 120.51 126.81 1a4q n ALA 297 Ca -0.13 -0.65 -0.38 0.00 0.00 0.00 0.00 53.44 52.28 1a4q n ALA 297 Cb 0.62 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 19.27 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 -2.08 4.65 -0.08 0.00 1.02 -1.26 -2.58 119.74 119.41 1a4q s LYS 298 Ca 0.22 1.31 -0.28 0.00 0.02 0.00 0.00 55.97 57.24 1a4q s LYS 298 Cb 0.18 -3.07 -0.02 0.00 -0.52 0.00 0.00 37.83 34.40 1a4q s LYS 298 CO 0.40 0.43 0.94 1.03 -0.92 0.00 0.00 175.35 177.23 1a4q s ARG 299 N -1.56 4.45 0.21 1.68 0.52 -1.26 -4.61 118.95 118.38 1a4q s ARG 299 Ca 0.44 1.30 -0.32 0.00 -0.52 0.00 0.00 55.73 56.62 1a4q s ARG 299 Cb -0.22 -3.51 -0.14 0.00 0.52 0.00 0.00 34.95 31.59 1a4q s ARG 299 CO 0.27 -0.20 1.26 -2.30 0.02 0.00 0.00 175.30 174.36 1a4q n PRO 300 N 4.57 1.59 -3.96 3.54 -0.02 -1.25 -1.79 135.00 137.68 1a4q n PRO 300 Ca 0.06 0.56 -0.30 0.00 -2.02 0.00 0.00 63.50 61.81 1a4q n PRO 300 Cb 0.50 -2.13 -0.16 0.00 -0.02 0.00 0.00 33.50 31.69 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 -0.22 2.19 -0.08 6.00 2.19 0.34 -0.70 117.98 127.69 1a4q s PHE 301 Ca 0.69 -1.43 -0.15 0.00 0.33 0.00 0.00 56.93 56.38 1a4q s PHE 301 Cb -0.74 -1.54 -0.05 0.00 -1.31 0.00 0.00 43.02 39.38 1a4q s PHE 301 CO 0.52 -0.70 0.38 0.08 1.83 0.00 0.00 175.22 177.32 1a4q s VAL 302 N 1.47 5.18 -0.18 3.12 1.01 -0.38 -2.07 120.40 128.55 1a4q s VAL 302 Ca -0.01 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1a4q s VAL 302 Cb -0.16 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.53 1a4q s VAL 302 CO -0.08 0.46 -0.17 -0.54 0.00 0.00 0.00 175.10 174.77 1a4q s LYS 303 N -0.19 3.09 -0.15 2.72 1.02 -0.52 -1.16 119.74 124.56 1a4q s LYS 303 Ca 0.22 -0.79 0.02 0.00 0.02 0.00 0.00 55.97 55.44 1a4q s LYS 303 Cb -0.15 -2.63 0.01 0.00 -0.52 0.00 0.00 37.83 34.54 1a4q s LYS 303 CO 0.09 -0.15 -0.21 -1.17 -0.92 0.00 0.00 175.35 172.99 1a4q s LEU 304 N 1.19 2.09 -0.38 3.17 0.20 0.76 -1.64 118.68 124.06 1a4q s LEU 304 Ca 0.02 -0.61 -0.19 0.00 0.69 0.00 0.00 54.13 54.04 1a4q s LEU 304 Cb -0.14 -1.44 0.01 0.00 -0.43 0.00 0.00 46.19 44.19 1a4q s LEU 304 CO -0.08 0.06 0.55 0.21 -0.29 0.00 0.00 176.35 176.80 1a4q s ASN 305 N 0.93 6.31 0.38 3.68 3.84 0.11 -0.54 114.94 129.65 1a4q s ASN 305 Ca -0.04 -0.18 0.20 0.00 0.21 0.00 0.00 52.86 53.05 1a4q s ASN 305 Cb -0.15 -2.28 0.64 0.00 -0.55 0.00 0.00 41.25 38.91 1a4q s ASN 305 CO -0.04 -0.59 1.71 0.58 -2.79 0.00 0.00 177.10 175.97 1a4q h VAL 306 N 5.71 0.73 0.13 -5.21 2.07 -1.17 0.99 116.25 119.50 1a4q h VAL 306 Ca -0.27 -1.49 -0.28 0.00 0.82 0.00 0.00 66.70 65.48 1a4q h VAL 306 Cb 1.11 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1a4q h VAL 306 CO 0.81 0.33 -1.30 -0.33 0.02 0.00 0.00 177.57 177.10 1a4q h GLU 307 N 0.00 0.28 -0.00 1.57 5.08 -1.89 -3.32 114.58 116.29 1a4q h GLU 307 Ca -0.00 -0.48 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1a4q h GLU 307 Cb 0.94 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1a4q h GLU 307 CO 0.04 1.21 -0.86 0.25 -1.00 0.00 0.00 179.01 178.66 1a4q n THR 308 N -3.53 0.00 -3.79 1.13 -2.24 -1.19 -4.98 114.28 99.68 1a4q n THR 308 Ca -0.10 -0.02 -0.24 0.00 -2.27 0.00 0.00 64.05 61.42 1a4q n THR 308 Cb 1.03 0.88 0.01 0.00 -2.10 0.00 0.00 70.33 70.15 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 -1.37 -1.32 -4.35 3.42 8.00 0.32 -5.02 116.55 116.24 1a4q n ASP 309 Ca 0.05 -0.92 -0.24 0.00 0.71 0.00 0.00 54.79 54.39 1a4q n ASP 309 Cb 0.34 -3.60 -0.12 0.00 -0.02 0.00 0.00 41.12 37.73 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 -3.76 1.94 0.05 -3.53 -4.23 -1.10 -4.86 115.64 100.15 1a4q s THR 310 Ca 0.06 -1.84 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 1a4q s THR 310 Cb -0.02 -1.85 -0.03 0.00 1.34 0.00 0.00 72.50 71.95 1a4q s THR 310 CO 0.85 -0.18 -0.07 0.00 -0.54 0.00 0.00 174.62 174.67 1a4q s ALA 311 N -1.68 0.61 0.01 3.99 0.00 -1.26 -0.72 121.76 122.70 1a4q s ALA 311 Ca 0.14 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1a4q s ALA 311 Cb -0.08 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 1a4q s ALA 311 CO 0.07 -0.07 -0.04 -2.00 0.00 0.00 0.00 175.76 173.72 1a4q s GLU 312 N -1.99 0.30 -0.04 0.00 2.12 -0.65 -1.73 118.70 116.70 1a4q s GLU 312 Ca -0.06 -0.24 0.06 0.00 0.36 0.00 0.00 54.97 55.09 1a4q s GLU 312 Cb -0.07 -0.23 -0.01 0.00 0.26 0.00 0.00 34.13 34.08 1a4q s GLU 312 CO -0.01 0.06 -0.22 0.42 -0.54 0.00 0.00 175.26 174.97 1a4q s ILE 313 N -0.36 1.79 0.05 -3.70 1.01 -0.31 -1.44 121.20 118.26 1a4q s ILE 313 Ca -0.02 -0.94 -0.05 0.00 0.00 0.00 0.00 60.65 59.64 1a4q s ILE 313 Cb -0.03 -1.51 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 1a4q s ILE 313 CO -0.00 0.51 0.09 -0.13 0.00 0.00 0.00 174.94 175.40 1a4q s ARG 314 N -0.23 0.66 0.35 2.79 1.81 -0.88 -0.26 118.95 123.19 1a4q s ARG 314 Ca 0.00 -0.92 -0.27 0.00 -1.72 0.00 0.00 55.73 52.82 1a4q s ARG 314 Cb -0.11 0.25 -0.09 0.00 -0.45 0.00 0.00 34.95 34.55 1a4q s ARG 314 CO 0.02 -0.17 1.16 -0.51 -0.68 0.00 0.00 175.30 175.12 1a4q s LEU 315 N -2.51 4.34 0.27 2.53 1.43 -1.26 -0.50 118.68 122.97 1a4q s LEU 315 Ca 0.01 2.36 -0.30 0.00 -1.03 0.00 0.00 54.13 55.16 1a4q s LEU 315 Cb 0.03 -3.85 -0.10 0.00 0.03 0.00 0.00 46.19 42.30 1a4q s LEU 315 CO -0.08 -0.47 1.42 -0.04 0.23 0.00 0.00 176.35 177.42 1a4q s MET 316 N -1.96 4.27 0.00 1.70 -1.94 -0.74 -4.50 119.30 116.13 1a4q s MET 316 Ca 0.52 2.30 0.25 0.00 -1.71 0.00 0.00 55.69 57.05 1a4q s MET 316 Cb -0.32 -3.10 0.55 0.00 2.01 0.00 0.00 34.83 33.97 1a4q s MET 316 CO 0.41 -0.39 1.44 0.00 -0.01 0.00 0.00 175.02 176.46 1a4q n THR 318 N -1.09 1.75 0.30 0.00 5.66 -0.84 -4.12 114.28 115.93 1a4q n THR 318 Ca 0.08 -0.44 0.13 0.00 -3.05 0.00 0.00 64.05 60.78 1a4q n THR 318 Cb 0.34 -1.56 0.61 0.00 -1.55 0.00 0.00 70.33 68.18 1a4q n THR 318 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 1a4q h GLU 319 N 2.98 0.00 -5.46 1.09 4.11 -1.42 -3.37 114.58 112.51 1a4q h GLU 319 Ca -0.46 0.00 -0.69 0.00 0.07 0.00 0.00 59.36 58.28 1a4q h GLU 319 Cb 1.28 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.41 1a4q h GLU 319 CO 0.66 0.00 1.74 0.99 0.07 0.00 0.00 179.01 182.47 1a4q s THR 320 N -3.51 4.45 0.07 -1.06 2.01 -1.26 -2.08 115.64 114.26 1a4q s THR 320 Ca 0.01 -2.00 -0.31 0.00 0.31 0.00 0.00 61.69 59.70 1a4q s THR 320 Cb 0.08 -5.06 -0.08 0.00 0.01 0.00 0.00 72.50 67.46 1a4q s THR 320 CO 0.34 -1.84 1.51 -0.31 -0.69 0.00 0.00 174.62 173.63 1a4q s TYR 321 N 3.32 2.83 -0.96 4.92 2.02 -1.26 -4.90 117.35 123.31 1a4q s TYR 321 Ca 0.48 0.65 0.25 0.00 -0.37 0.00 0.00 57.07 58.08 1a4q s TYR 321 Cb 0.01 -3.81 0.60 0.00 -0.40 0.00 0.00 41.96 38.35 1a4q s TYR 321 CO 0.02 -3.06 1.48 1.28 -1.57 0.00 0.00 175.55 173.70 1a4q n LEU 322 N 4.92 0.45 -4.86 -1.29 4.77 -1.25 -4.95 117.00 114.79 1a4q n LEU 322 Ca 0.14 0.10 -0.29 0.00 -0.03 0.00 0.00 56.01 55.92 1a4q n LEU 322 Cb 0.42 -0.28 0.11 0.00 -2.33 0.00 0.00 43.42 41.33 1a4q n LEU 322 CO 0.60 0.09 0.77 -0.62 -1.33 0.00 0.00 177.39 176.90 1a4q s ASP 323 N -3.13 4.16 -0.05 -1.43 2.15 -1.07 -4.70 116.67 112.61 1a4q s ASP 323 Ca 0.11 0.83 -0.01 0.00 0.43 0.00 0.00 52.55 53.92 1a4q s ASP 323 Cb 0.17 -1.35 0.03 0.00 -0.30 0.00 0.00 42.92 41.47 1a4q s ASP 323 CO 0.68 -2.13 0.01 -0.89 -0.17 0.00 0.00 175.17 172.67 1a4q s THR 324 N -3.48 0.22 1.02 1.71 2.01 -1.26 -4.18 115.64 111.67 1a4q s THR 324 Ca 0.63 0.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.66 1a4q s THR 324 Cb -0.12 -0.36 0.20 0.00 0.01 0.00 0.00 72.50 72.23 1a4q s THR 324 CO 0.50 0.20 1.08 -2.16 -0.69 0.00 0.00 174.62 173.55 1a4q s PRO 325 N 1.61 0.22 0.01 4.92 0.04 -1.26 -2.80 135.00 137.74 1a4q s PRO 325 Ca -0.01 0.69 -0.26 0.00 0.04 0.00 0.00 61.00 61.46 1a4q s PRO 325 Cb -0.13 -1.70 0.06 0.00 0.04 0.00 0.00 34.50 32.77 1a4q s PRO 325 CO -0.03 -2.91 0.58 -0.98 0.04 0.00 0.00 177.00 173.70 1a4q s ARG 326 N -4.82 1.05 0.98 4.56 1.70 -0.70 -4.70 118.95 117.01 1a4q s ARG 326 Ca 0.66 -0.05 -0.16 0.00 -0.47 0.00 0.00 55.73 55.71 1a4q s ARG 326 Cb -0.20 0.48 0.22 0.00 -0.57 0.00 0.00 34.95 34.88 1a4q s ARG 326 CO 0.59 -0.36 1.34 -1.25 -1.08 0.00 0.00 175.30 174.54 1a4q s PRO 327 N -1.97 0.42 0.57 3.89 0.04 -1.26 -4.74 135.00 131.95 1a4q s PRO 327 Ca -0.08 -0.57 -0.21 0.00 0.04 0.00 0.00 61.00 60.19 1a4q s PRO 327 Cb -0.01 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1a4q s PRO 327 CO 0.02 -2.54 1.31 -0.51 0.04 0.00 0.00 177.00 175.33 1a4q s ASP 328 N -4.95 5.15 0.21 6.66 1.01 -1.26 -4.88 116.67 118.61 1a4q s ASP 328 Ca 0.76 2.66 -0.32 0.00 0.71 0.00 0.00 52.55 56.36 1a4q s ASP 328 Cb -0.02 -2.63 -0.13 0.00 1.01 0.00 0.00 42.92 41.15 1a4q s ASP 328 CO 0.53 -1.64 1.52 0.47 0.21 0.00 0.00 175.17 176.27 1a4q n ASP 329 N -1.27 3.09 0.00 0.27 8.00 -1.26 -1.90 116.55 123.49 1a4q n ASP 329 Ca 0.12 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.73 1a4q n ASP 329 Cb 0.46 -1.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.11 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 2.84 0.78 0.07 0.44 0.00 -0.88 -4.89 105.19 103.54 1a4q n GLY 330 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.03 0.63 -4.56 1.61 3.41 -0.80 -4.66 113.62 109.23 1a4q n SER 331 Ca 0.00 0.34 -0.43 0.00 -0.26 0.00 0.00 58.87 58.53 1a4q n SER 331 Cb 0.01 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 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 -3.10 4.28 0.73 -1.33 1.01 -1.26 -4.99 121.20 116.54 1a4q s ILE 332 Ca 0.10 0.67 -0.07 0.00 0.00 0.00 0.00 60.65 61.35 1a4q s ILE 332 Cb 0.14 -4.57 0.08 0.00 0.01 0.00 0.00 42.46 38.12 1a4q s ILE 332 CO 0.64 -1.10 1.04 -0.89 0.00 0.00 0.00 174.94 174.62 1a4q s THR 333 N 4.24 2.24 0.00 2.92 2.01 -1.26 -4.97 115.64 120.82 1a4q s THR 333 Ca 0.37 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.10 1a4q s THR 333 Cb -0.10 -2.96 0.00 0.00 0.01 0.00 0.00 72.50 69.45 1a4q s THR 333 CO 0.24 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.78 1a4q n GLY 334 N -2.99 -1.93 3.64 4.40 0.00 -1.26 -4.80 105.19 102.26 1a4q n GLY 334 Ca 0.09 -1.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.20 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 0.00 -0.17 0.41 1.61 0.04 -1.26 -4.86 135.00 130.77 1a4q s PRO 335 Ca 0.00 0.33 0.14 0.00 0.04 0.00 0.00 61.00 61.51 1a4q s PRO 335 Cb 0.00 -1.68 0.99 0.00 0.04 0.00 0.00 34.50 33.85 1a4q s PRO 335 CO 0.00 -3.09 1.91 0.00 0.04 0.00 0.00 177.00 175.86 1a4q n GLU 337 N -4.50 0.78 -1.85 0.00 0.00 -1.26 -4.70 120.64 109.11 1a4q n GLU 337 Ca 0.15 -0.03 -0.42 0.00 0.00 0.00 0.00 57.16 56.87 1a4q n GLU 337 Cb 0.51 -1.50 -0.02 0.00 0.00 0.00 0.00 31.44 30.42 1a4q n GLU 337 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1a4q s SER 338 N -2.24 6.47 0.09 -1.84 0.01 -0.53 -4.93 113.70 110.73 1a4q s SER 338 Ca 0.39 2.82 -0.16 0.00 1.31 0.00 0.00 55.95 60.32 1a4q s SER 338 Cb 0.21 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.74 1a4q s SER 338 CO 0.41 -0.86 1.44 0.78 0.41 0.00 0.00 173.24 175.42 1a4q h ASN 339 N 5.48 0.68 -3.00 2.44 2.35 -1.90 -3.49 115.58 118.15 1a4q h ASN 339 Ca -0.45 -0.44 0.07 0.00 -0.55 0.00 0.00 56.30 54.92 1a4q h ASN 339 Cb 1.21 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.38 1a4q h ASN 339 CO 0.83 0.97 -0.09 0.61 -1.65 0.00 0.00 177.43 178.11 1a4q n GLY 340 N 0.06 -1.76 3.89 2.83 0.00 -1.26 -4.33 105.19 104.62 1a4q n GLY 340 Ca -0.04 -1.28 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 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 -4.16 6.29 -1.46 1.61 2.15 -1.26 -4.49 116.67 115.34 1a4q s ASP 341 Ca 0.00 1.14 -0.10 0.00 0.43 0.00 0.00 52.55 54.02 1a4q s ASP 341 Cb 0.00 -2.34 0.06 0.00 -0.30 0.00 0.00 42.92 40.34 1a4q s ASP 341 CO 0.00 -0.66 0.92 0.29 -0.17 0.00 0.00 175.17 175.55 1a4q n LYS 342 N -2.33 -5.55 0.09 4.34 5.02 -1.26 -4.31 118.16 114.16 1a4q n LYS 342 Ca 0.03 0.62 0.05 0.00 -2.02 0.00 0.00 58.31 56.98 1a4q n LYS 342 Cb 0.55 -5.44 -0.01 0.00 -0.02 0.00 0.00 35.03 30.11 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 -2.08 0.00 -3.59 0.72 0.00 -1.79 -3.36 103.07 92.97 1a4q h GLY 343 Ca -0.59 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.24 1a4q h GLY 343 CO 0.64 0.00 0.25 -1.60 0.00 0.00 0.00 176.54 175.82 1a4q s ARG 344 N -3.07 4.55 0.00 4.80 6.06 -1.23 -3.41 118.95 126.66 1a4q s ARG 344 Ca 0.00 1.20 0.00 0.00 -2.50 0.00 0.00 55.73 54.44 1a4q s ARG 344 Cb 0.08 -3.02 0.00 0.00 0.06 0.00 0.00 34.95 32.07 1a4q s ARG 344 CO 0.78 0.43 0.00 0.41 -2.50 0.00 0.00 175.30 174.41 1a4q n GLY 345 N 1.03 -0.01 0.00 8.12 0.00 0.76 -4.58 105.19 110.51 1a4q n GLY 345 Ca -0.02 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.03 -1.82 3.47 -0.02 0.00 -1.12 -4.30 105.19 101.37 1a4q n GLY 346 Ca 0.00 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.16 0.01 0.21 -0.61 2.07 -1.23 -4.76 121.20 114.74 1a4q s ILE 347 Ca 0.00 -0.08 -0.30 0.00 -1.41 0.00 0.00 60.65 58.87 1a4q s ILE 347 Cb 0.00 -0.87 -0.08 0.00 0.13 0.00 0.00 42.46 41.63 1a4q s ILE 347 CO 0.00 -0.04 1.12 -0.75 -1.91 0.00 0.00 174.94 173.36 1a4q s LYS 348 N -0.56 4.59 0.04 3.50 2.20 -1.26 -4.71 119.74 123.53 1a4q s LYS 348 Ca -0.07 1.78 0.09 0.00 -0.36 0.00 0.00 55.97 57.41 1a4q s LYS 348 Cb -0.03 -3.24 -0.03 0.00 -1.51 0.00 0.00 37.83 33.02 1a4q s LYS 348 CO 0.05 0.09 -0.25 0.20 -0.36 0.00 0.00 175.35 175.08 1a4q s GLY 349 N -0.31 1.42 0.34 5.54 0.00 -1.25 -2.51 107.32 110.55 1a4q s GLY 349 Ca 0.48 -1.24 -0.28 0.00 0.00 0.00 0.00 44.72 43.69 1a4q s GLY 349 CO 0.37 -1.11 1.17 -0.32 0.00 0.00 0.00 173.10 173.21 1a4q s GLY 350 N -1.19 2.97 -0.23 0.20 0.00 -1.08 -4.50 107.32 103.49 1a4q s GLY 350 Ca 0.12 1.00 -0.16 0.00 0.00 0.00 0.00 44.72 45.68 1a4q s GLY 350 CO 0.02 1.58 0.58 -0.12 0.00 0.00 0.00 173.10 175.16 1a4q s PHE 351 N -1.27 -0.78 0.02 1.90 5.36 -1.26 -2.32 117.98 119.63 1a4q s PHE 351 Ca 0.51 1.70 -0.18 0.00 -0.96 0.00 0.00 56.93 58.00 1a4q s PHE 351 Cb -0.33 0.38 0.03 0.00 -0.34 0.00 0.00 43.02 42.76 1a4q s PHE 351 CO 0.43 -0.40 0.40 0.54 -1.46 0.00 0.00 175.22 174.73 1a4q s VAL 352 N 1.05 0.05 -0.03 3.12 0.11 -0.37 -3.34 120.40 120.99 1a4q s VAL 352 Ca -0.06 -0.44 -0.04 0.00 -2.93 0.00 0.00 61.98 58.51 1a4q s VAL 352 Cb -0.06 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 1a4q s VAL 352 CO -0.10 -0.24 0.17 -1.00 -3.33 0.00 0.00 175.10 170.60 1a4q s HIS 353 N -2.09 3.56 -0.41 1.54 3.76 -1.26 -1.59 115.29 118.80 1a4q s HIS 353 Ca -0.08 0.40 0.01 0.00 -0.15 0.00 0.00 55.06 55.24 1a4q s HIS 353 Cb -0.02 -1.86 0.11 0.00 1.11 0.00 0.00 32.58 31.93 1a4q s HIS 353 CO 0.00 0.67 0.16 -1.14 -0.85 0.00 0.00 174.74 173.58 1a4q s GLN 354 N -1.74 1.80 -0.24 1.40 0.74 -0.06 -4.67 119.66 116.90 1a4q s GLN 354 Ca 0.25 -2.03 -0.22 0.00 0.05 0.00 0.00 55.36 53.41 1a4q s GLN 354 Cb -0.12 -3.38 -0.02 0.00 1.10 0.00 0.00 33.01 30.59 1a4q s GLN 354 CO 0.16 -1.03 0.70 1.03 -0.55 0.00 0.00 175.29 175.60 1a4q s ARG 355 N 0.71 4.16 0.44 1.67 0.52 -1.26 -0.51 118.95 124.68 1a4q s ARG 355 Ca 0.12 0.70 0.06 0.00 -0.52 0.00 0.00 55.73 56.09 1a4q s ARG 355 Cb -0.21 -3.63 -0.04 0.00 0.52 0.00 0.00 34.95 31.58 1a4q s ARG 355 CO -0.05 -0.41 0.15 -1.64 0.02 0.00 0.00 175.30 173.37 1a4q s MET 356 N 2.49 2.18 0.37 3.54 -1.94 -0.63 -1.15 119.30 124.15 1a4q s MET 356 Ca 0.30 -1.99 0.06 0.00 -1.71 0.00 0.00 55.69 52.35 1a4q s MET 356 Cb -0.16 -1.87 0.71 0.00 2.01 0.00 0.00 34.83 35.52 1a4q s MET 356 CO 0.09 -0.19 1.94 0.00 -0.01 0.00 0.00 175.02 176.85 1a4q h ALA 357 N 1.40 1.50 0.00 3.03 0.00 -1.97 -3.31 119.26 119.90 1a4q h ALA 357 Ca -0.42 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1a4q h ALA 357 Cb 1.26 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1a4q h ALA 357 CO 0.71 0.37 -0.20 -1.13 0.00 0.00 0.00 179.25 179.01 1a4q n SER 358 N -4.35 0.62 -3.75 0.00 3.41 -1.26 -5.07 113.62 103.22 1a4q n SER 358 Ca 0.02 -1.85 -0.13 0.00 -0.26 0.00 0.00 58.87 56.65 1a4q n SER 358 Cb 0.18 -0.15 -0.08 0.00 -0.26 0.00 0.00 64.21 63.90 1a4q n SER 358 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1a4q s LYS 359 N -0.58 0.70 -0.07 4.33 2.20 -1.25 -5.10 119.74 119.98 1a4q s LYS 359 Ca 0.05 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.47 1a4q s LYS 359 Cb 0.04 0.31 0.02 0.00 -1.51 0.00 0.00 37.83 36.69 1a4q s LYS 359 CO 0.00 -0.20 -0.10 0.42 -0.36 0.00 0.00 175.35 175.12 1a4q s ILE 360 N -1.44 1.00 -0.15 5.43 1.01 -1.26 -1.60 121.20 124.19 1a4q s ILE 360 Ca -0.13 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.03 1a4q s ILE 360 Cb -0.05 -0.95 -0.05 0.00 0.01 0.00 0.00 42.46 41.42 1a4q s ILE 360 CO 0.04 0.33 0.25 -0.83 0.00 0.00 0.00 174.94 174.73 1a4q s GLY 361 N 0.92 2.19 -0.25 6.18 0.00 0.34 -0.85 107.32 115.85 1a4q s GLY 361 Ca -0.10 -0.51 -0.01 0.00 0.00 0.00 0.00 44.72 44.11 1a4q s GLY 361 CO 0.01 0.25 -0.07 0.50 0.00 0.00 0.00 173.10 173.78 1a4q s ARG 362 N 0.13 2.72 -0.11 2.90 0.52 -0.24 -0.88 118.95 123.98 1a4q s ARG 362 Ca 0.15 -1.05 -0.03 0.00 -0.52 0.00 0.00 55.73 54.28 1a4q s ARG 362 Cb -0.13 -2.96 -0.03 0.00 0.52 0.00 0.00 34.95 32.35 1a4q s ARG 362 CO 0.03 -0.43 0.02 -1.58 0.02 0.00 0.00 175.30 173.36 1a4q s TRP 363 N 1.28 3.20 0.05 -0.53 0.52 -0.62 -1.65 118.94 121.18 1a4q s TRP 363 Ca -0.01 0.14 -0.04 0.00 0.02 0.00 0.00 56.10 56.21 1a4q s TRP 363 Cb -0.17 -1.86 -0.02 0.00 -1.15 0.00 0.00 33.47 30.26 1a4q s TRP 363 CO -0.05 0.38 0.05 0.71 0.02 0.00 0.00 176.95 178.07 1a4q s TYR 364 N -0.56 0.30 0.06 -1.98 1.51 -0.40 -1.23 117.35 115.05 1a4q s TYR 364 Ca 0.10 -0.69 0.05 0.00 -1.01 0.00 0.00 57.07 55.51 1a4q s TYR 364 Cb -0.12 -0.22 -0.03 0.00 -0.11 0.00 0.00 41.96 41.49 1a4q s TYR 364 CO 0.02 -0.37 -0.13 -1.54 -1.11 0.00 0.00 175.55 172.42 1a4q s SER 365 N -2.39 1.53 0.06 2.29 1.04 -0.98 -0.52 113.70 114.72 1a4q s SER 365 Ca -0.01 -0.59 -0.15 0.00 0.48 0.00 0.00 55.95 55.68 1a4q s SER 365 Cb 0.02 -0.04 0.02 0.00 0.10 0.00 0.00 66.02 66.12 1a4q s SER 365 CO -0.07 -0.09 0.34 0.00 0.98 0.00 0.00 173.24 174.40 1a4q s ARG 366 N -1.66 0.88 0.77 4.02 1.70 -0.63 -4.14 118.95 119.90 1a4q s ARG 366 Ca -0.03 -0.53 -0.14 0.00 -0.47 0.00 0.00 55.73 54.56 1a4q s ARG 366 Cb -0.10 0.38 0.06 0.00 -0.57 0.00 0.00 34.95 34.73 1a4q s ARG 366 CO 0.02 -0.30 1.21 0.95 -1.08 0.00 0.00 175.30 176.10 1a4q s THR 367 N -2.79 2.16 0.06 4.99 -4.23 -1.26 -1.09 115.64 113.48 1a4q s THR 367 Ca -0.03 0.07 -0.15 0.00 -1.18 0.00 0.00 61.69 60.40 1a4q s THR 367 Cb -0.00 -2.56 -0.24 0.00 1.34 0.00 0.00 72.50 71.04 1a4q s THR 367 CO -0.05 -0.05 1.17 -0.03 -0.54 0.00 0.00 174.62 175.13 1a4q h MET 368 N -0.65 0.67 -6.97 3.99 4.05 -1.28 -3.44 114.93 111.30 1a4q h MET 368 Ca -0.47 -0.73 -0.50 0.00 -0.28 0.00 0.00 59.70 57.72 1a4q h MET 368 Cb 1.30 0.21 0.05 0.00 -0.80 0.00 0.00 31.60 32.35 1a4q h MET 368 CO 0.48 1.31 0.47 0.45 0.23 0.00 0.00 176.91 179.85 1a4q s SER 369 N -7.24 6.45 0.36 1.39 0.15 -0.74 -4.93 113.70 109.14 1a4q s SER 369 Ca -0.10 2.25 0.19 0.00 0.70 0.00 0.00 55.95 58.99 1a4q s SER 369 Cb 0.06 -2.60 0.25 0.00 -1.71 0.00 0.00 66.02 62.02 1a4q s SER 369 CO 0.91 -0.72 1.54 0.11 1.20 0.00 0.00 173.24 176.29 1a4q h LYS 370 N 2.38 0.00 0.00 5.44 1.57 -1.89 -3.39 116.57 120.68 1a4q h LYS 370 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 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 0.62 0.28 -1.09 0.25 -0.57 0.00 0.00 179.45 178.93 1a4q n THR 371 N -3.18 0.00 -4.51 -0.16 -2.24 -1.26 -1.73 114.28 101.19 1a4q n THR 371 Ca 0.03 -0.09 -0.24 0.00 -2.27 0.00 0.00 64.05 61.47 1a4q n THR 371 Cb 0.63 0.46 -0.11 0.00 -2.10 0.00 0.00 70.33 69.21 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 -2.17 1.74 -1.29 -0.78 0.41 -1.26 -4.51 118.70 110.84 1a4q s GLU 372 Ca -0.01 -1.92 -0.08 0.00 -0.41 0.00 0.00 54.97 52.55 1a4q s GLU 372 Cb 0.02 -1.45 0.16 0.00 -1.78 0.00 0.00 34.13 31.08 1a4q s GLU 372 CO 0.13 0.05 2.03 0.54 -0.49 0.00 0.00 175.26 177.52 1a4q n ARG 373 N -0.75 3.97 -4.22 1.61 1.74 -1.26 -4.37 116.66 113.39 1a4q n ARG 373 Ca -0.05 -3.54 -0.23 0.00 -0.77 0.00 0.00 57.85 53.26 1a4q n ARG 373 Cb 0.64 -2.81 -0.17 0.00 -1.02 0.00 0.00 32.46 29.10 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 -0.24 1.21 0.15 5.56 -1.94 -1.25 -1.89 119.30 120.91 1a4q s MET 374 Ca 0.44 -0.21 0.00 0.00 -1.71 0.00 0.00 55.69 54.21 1a4q s MET 374 Cb 0.12 -1.17 0.00 0.00 2.01 0.00 0.00 34.83 35.80 1a4q s MET 374 CO -0.02 -0.10 0.00 0.41 -0.01 0.00 0.00 175.02 175.30 1a4q n GLY 375 N 4.24 -1.89 3.61 -0.03 0.00 -0.12 -1.72 105.19 109.28 1a4q n GLY 375 Ca -0.20 -1.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.41 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 -2.02 0.55 0.10 1.61 1.75 -0.26 -3.16 119.30 117.87 1a4q s MET 376 Ca 0.00 1.08 0.09 0.00 -1.25 0.00 0.00 55.69 55.61 1a4q s MET 376 Cb 0.00 0.33 -0.03 0.00 2.84 0.00 0.00 34.83 37.97 1a4q s MET 376 CO 0.00 -0.14 -0.22 -1.21 -0.65 0.00 0.00 175.02 172.80 1a4q s GLU 377 N 1.96 1.23 -0.01 4.11 2.02 -0.25 -0.42 118.70 127.34 1a4q s GLU 377 Ca -0.08 -1.16 -0.03 0.00 0.02 0.00 0.00 54.97 53.72 1a4q s GLU 377 Cb -0.06 -1.51 -0.04 0.00 0.10 0.00 0.00 34.13 32.62 1a4q s GLU 377 CO -0.18 0.36 0.19 -1.17 0.02 0.00 0.00 175.26 174.48 1a4q s LEU 378 N -1.81 4.37 0.02 1.80 0.20 -0.37 -1.60 118.68 121.30 1a4q s LEU 378 Ca 0.08 0.38 -0.01 0.00 0.69 0.00 0.00 54.13 55.26 1a4q s LEU 378 Cb -0.10 -2.62 -0.02 0.00 -0.43 0.00 0.00 46.19 43.02 1a4q s LEU 378 CO 0.04 0.26 -0.00 -0.31 -0.29 0.00 0.00 176.35 176.05 1a4q s TYR 379 N -1.32 0.27 0.03 5.38 1.51 0.33 -0.27 117.35 123.28 1a4q s TYR 379 Ca 0.27 -0.57 -0.03 0.00 -1.01 0.00 0.00 57.07 55.73 1a4q s TYR 379 Cb -0.13 -0.20 -0.02 0.00 -0.11 0.00 0.00 41.96 41.50 1a4q s TYR 379 CO 0.18 -0.24 0.02 0.54 -1.11 0.00 0.00 175.55 174.94 1a4q s VAL 380 N -1.93 0.13 -0.12 0.71 0.11 -0.25 -1.28 120.40 117.78 1a4q s VAL 380 Ca -0.11 -1.07 -0.08 0.00 -2.93 0.00 0.00 61.98 57.79 1a4q s VAL 380 Cb -0.06 -0.64 0.04 0.00 -1.53 0.00 0.00 36.38 34.18 1a4q s VAL 380 CO -0.02 -0.59 0.29 -0.60 -3.33 0.00 0.00 175.10 170.85 1a4q s ARG 381 N -2.13 0.30 -0.17 1.54 3.52 -0.66 -1.06 118.95 120.28 1a4q s ARG 381 Ca -0.09 0.51 -0.08 0.00 -0.13 0.00 0.00 55.73 55.94 1a4q s ARG 381 Cb -0.05 0.02 -0.04 0.00 -1.56 0.00 0.00 34.95 33.33 1a4q s ARG 381 CO -0.03 -0.11 0.08 0.71 -0.81 0.00 0.00 175.30 175.14 1a4q s TYR 382 N 0.78 3.31 0.00 5.12 2.02 -1.26 -1.08 117.35 126.23 1a4q s TYR 382 Ca -0.05 0.17 0.00 0.00 -0.37 0.00 0.00 57.07 56.82 1a4q s TYR 382 Cb -0.06 -2.06 0.00 0.00 -0.40 0.00 0.00 41.96 39.44 1a4q s TYR 382 CO -0.05 0.26 0.00 -0.25 -1.57 0.00 0.00 175.55 173.94 1a4q n ASP 383 N 3.29 -2.35 -0.02 2.29 8.00 -0.03 -4.97 116.55 122.76 1a4q n ASP 383 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1a4q n ASP 383 Cb 0.52 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.62 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 -2.15 3.02 0.44 0.00 -1.26 -4.81 105.19 100.42 1a4q n GLY 384 Ca 0.00 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 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 -3.30 3.77 0.55 1.61 -1.08 -1.26 -5.00 116.67 111.97 1a4q s ASP 385 Ca 0.00 -1.07 0.28 0.00 -0.52 0.00 0.00 52.55 51.24 1a4q s ASP 385 Cb 0.00 -1.34 1.46 0.00 -1.46 0.00 0.00 42.92 41.59 1a4q s ASP 385 CO 0.00 -0.16 1.94 -0.65 0.52 0.00 0.00 175.17 176.82 1a4q h PRO 386 N 7.91 0.00 0.00 4.34 0.11 -1.91 -0.59 132.00 141.85 1a4q h PRO 386 Ca -0.25 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.79 1a4q h PRO 386 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1a4q h PRO 386 CO 0.47 0.00 -0.32 -1.49 -0.21 0.00 0.00 178.00 176.45 1a4q h TRP 387 N 0.00 0.00 0.00 0.65 6.55 -1.92 0.35 115.95 121.58 1a4q h TRP 387 Ca 0.28 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.12 1a4q h TRP 387 Cb 1.24 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.54 1a4q h TRP 387 CO 0.00 0.32 -0.50 0.25 -1.05 0.00 0.00 178.44 177.46 1a4q n THR 388 N -3.34 0.00 -2.54 1.49 -2.24 -0.43 -4.21 114.28 103.01 1a4q n THR 388 Ca 0.01 -0.18 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 1a4q n THR 388 Cb 0.54 0.67 -0.02 0.00 -2.10 0.00 0.00 70.33 69.42 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 -1.37 6.75 0.00 3.42 1.11 -0.36 -4.89 116.67 121.33 1a4q s ASP 389 Ca 0.00 0.98 0.27 0.00 0.18 0.00 0.00 52.55 53.99 1a4q s ASP 389 Cb 0.00 -2.54 0.93 0.00 1.07 0.00 0.00 42.92 42.38 1a4q s ASP 389 CO 0.00 -1.05 1.70 -1.54 1.18 0.00 0.00 175.17 175.45 1a4q n SER 390 N 7.43 0.37 -4.74 0.27 3.41 -1.26 -1.99 113.62 117.12 1a4q n SER 390 Ca 0.13 -0.15 -0.39 0.00 -0.26 0.00 0.00 58.87 58.21 1a4q n SER 390 Cb 0.47 -0.07 0.04 0.00 -0.26 0.00 0.00 64.21 64.40 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 -1.30 2.60 -4.71 4.04 8.00 -1.26 -1.48 116.55 122.44 1a4q n ASP 391 Ca 0.09 0.97 -0.39 0.00 0.71 0.00 0.00 54.79 56.17 1a4q n ASP 391 Cb 0.32 -1.57 0.04 0.00 -0.02 0.00 0.00 41.12 39.90 1a4q n ASP 391 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a4q n ALA 392 N -1.05 1.27 -1.80 2.24 0.00 -1.26 -4.17 120.51 115.74 1a4q n ALA 392 Ca 0.10 0.12 -0.34 0.00 0.00 0.00 0.00 53.44 53.32 1a4q n ALA 392 Cb 0.45 -2.30 -0.04 0.00 0.00 0.00 0.00 19.45 17.56 1a4q n ALA 392 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1a4q s LEU 393 N -2.99 3.87 -0.15 0.00 1.02 -1.26 -5.00 118.68 114.16 1a4q s LEU 393 Ca 0.71 1.94 -0.22 0.00 0.02 0.00 0.00 54.13 56.59 1a4q s LEU 393 Cb -0.43 -4.53 -0.03 0.00 0.02 0.00 0.00 46.19 41.23 1a4q s LEU 393 CO 0.49 -0.76 0.67 0.00 0.02 0.00 0.00 176.35 176.77 1a4q s ALA 394 N -1.95 3.48 0.16 4.21 0.00 -0.22 -4.84 121.76 122.59 1a4q s ALA 394 Ca 0.66 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 52.20 1a4q s ALA 394 Cb -0.17 -2.98 -0.09 0.00 0.00 0.00 0.00 23.12 19.88 1a4q s ALA 394 CO 0.21 -0.41 1.49 -1.58 0.00 0.00 0.00 175.76 175.47 1a4q s HIS 395 N 1.55 3.12 -0.11 0.00 2.46 -1.26 -1.09 115.29 119.96 1a4q s HIS 395 Ca 0.32 0.78 0.18 0.00 0.47 0.00 0.00 55.06 56.81 1a4q s HIS 395 Cb -0.16 -3.83 0.41 0.00 -0.13 0.00 0.00 32.58 28.87 1a4q s HIS 395 CO 0.13 -2.98 1.19 0.43 -2.47 0.00 0.00 174.74 171.04 1a4q n SER 396 N 3.77 1.38 0.00 9.88 7.64 0.63 -4.93 113.62 131.99 1a4q n SER 396 Ca 0.12 -3.02 0.00 0.00 1.01 0.00 0.00 58.87 56.98 1a4q n SER 396 Cb 0.40 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 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 -0.39 3.91 3.57 0.23 0.00 -1.24 -4.48 105.19 106.79 1a4q n GLY 397 Ca 0.13 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.87 4.81 -0.05 1.61 1.01 -1.26 -1.24 120.40 123.41 1a4q s VAL 398 Ca 0.00 0.63 0.08 0.00 0.00 0.00 0.00 61.98 62.69 1a4q s VAL 398 Cb 0.00 -4.16 -0.24 0.00 0.00 0.00 0.00 36.38 31.99 1a4q s VAL 398 CO 0.00 -0.42 0.65 0.24 0.00 0.00 0.00 175.10 175.57 1a4q h MET 399 N 8.55 0.06 -3.48 2.72 2.86 -1.05 -3.36 114.93 121.24 1a4q h MET 399 Ca -0.26 -0.10 -0.32 0.00 -2.06 0.00 0.00 59.70 56.96 1a4q h MET 399 Cb 1.10 0.04 -0.35 0.00 0.06 0.00 0.00 31.60 32.45 1a4q h MET 399 CO 0.88 0.67 -0.73 0.08 1.06 0.00 0.00 176.91 178.87 1a4q s VAL 400 N -2.60 -0.06 0.83 -2.22 1.01 -0.38 -1.20 120.40 115.79 1a4q s VAL 400 Ca -0.08 0.27 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 1a4q s VAL 400 Cb 0.08 -0.11 0.09 0.00 0.00 0.00 0.00 36.38 36.44 1a4q s VAL 400 CO 0.82 0.12 1.09 -0.94 0.00 0.00 0.00 175.10 176.18 1a4q s SER 401 N 1.36 4.04 0.64 3.32 1.04 -1.26 -1.10 113.70 121.74 1a4q s SER 401 Ca -0.05 1.58 0.31 0.00 0.48 0.00 0.00 55.95 58.27 1a4q s SER 401 Cb -0.13 -2.28 1.70 0.00 0.10 0.00 0.00 66.02 65.42 1a4q s SER 401 CO -0.03 -2.30 2.00 -0.03 0.98 0.00 0.00 173.24 173.87 1a4q h MET 402 N -1.31 0.00 0.00 4.02 4.05 -1.94 -1.32 114.93 118.43 1a4q h MET 402 Ca -0.47 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 1a4q h MET 402 Cb 1.26 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.06 1a4q h MET 402 CO 0.54 0.00 0.00 -0.22 0.23 0.00 0.00 176.91 177.46 1a4q h LYS 403 N 0.00 0.00 -6.47 0.39 1.63 -1.94 -3.38 116.57 106.80 1a4q h LYS 403 Ca 0.05 0.00 -0.63 0.00 -0.85 0.00 0.00 60.65 59.22 1a4q h LYS 403 Cb 0.65 0.00 -0.14 0.00 -0.60 0.00 0.00 32.23 32.13 1a4q h LYS 403 CO -0.00 0.00 -0.73 -1.21 -3.45 0.00 0.00 179.45 174.06 1a4q s GLU 404 N -3.27 2.07 0.24 1.90 0.41 -0.50 -5.00 118.70 114.56 1a4q s GLU 404 Ca 0.07 -1.22 -0.30 0.00 -0.41 0.00 0.00 54.97 53.10 1a4q s GLU 404 Cb 0.07 -2.19 -0.11 0.00 -1.78 0.00 0.00 34.13 30.13 1a4q s GLU 404 CO 0.62 0.45 1.53 -1.25 -0.49 0.00 0.00 175.26 176.12 1a4q s PRO 405 N -2.71 4.20 -0.31 0.39 0.04 -1.26 -0.95 135.00 134.40 1a4q s PRO 405 Ca 0.24 2.42 -0.00 0.00 0.04 0.00 0.00 61.00 63.70 1a4q s PRO 405 Cb -0.09 -3.09 0.10 0.00 0.04 0.00 0.00 34.50 31.46 1a4q s PRO 405 CO 0.15 -0.55 0.10 0.20 0.04 0.00 0.00 177.00 176.94 1a4q s GLY 406 N 0.62 1.13 0.00 0.56 0.00 -0.79 -4.57 107.32 104.26 1a4q s GLY 406 Ca 0.64 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1a4q s GLY 406 CO 0.42 1.59 0.00 0.79 0.00 0.00 0.00 173.10 175.89 1a4q n TRP 407 N 4.78 0.00 -2.03 1.90 7.02 -0.28 -3.77 117.44 125.06 1a4q n TRP 407 Ca -0.01 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.11 1a4q n TRP 407 Cb 0.42 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.34 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 3.08 2.43 0.18 -5.99 1.51 -1.26 -4.75 117.35 112.55 1a4q s TYR 408 Ca 0.00 1.51 0.03 0.00 -1.01 0.00 0.00 57.07 57.60 1a4q s TYR 408 Cb 0.00 -3.48 -0.05 0.00 -0.11 0.00 0.00 41.96 38.32 1a4q s TYR 408 CO 0.00 -2.17 -0.04 -1.54 -1.11 0.00 0.00 175.55 170.68 1a4q s SER 409 N -1.55 1.64 0.11 2.29 1.04 -1.04 -0.54 113.70 115.65 1a4q s SER 409 Ca 0.76 -1.12 -0.19 0.00 0.48 0.00 0.00 55.95 55.88 1a4q s SER 409 Cb -0.30 0.03 0.05 0.00 0.10 0.00 0.00 66.02 65.89 1a4q s SER 409 CO 0.34 -0.45 0.48 0.72 0.98 0.00 0.00 173.24 175.30 1a4q s PHE 410 N -3.45 -0.34 0.27 5.02 -0.12 -0.77 -2.64 117.98 115.97 1a4q s PHE 410 Ca 0.22 0.14 0.07 0.00 -0.05 0.00 0.00 56.93 57.31 1a4q s PHE 410 Cb 0.04 0.35 -0.03 0.00 -0.63 0.00 0.00 43.02 42.75 1a4q s PHE 410 CO 0.04 -0.72 0.24 0.20 -0.05 0.00 0.00 175.22 174.93 1a4q s GLY 411 N -2.56 1.49 0.16 1.99 0.00 -1.21 -1.48 107.32 105.70 1a4q s GLY 411 Ca 0.00 -1.46 -0.24 0.00 0.00 0.00 0.00 44.72 43.02 1a4q s GLY 411 CO -0.09 -1.47 0.81 -0.11 0.00 0.00 0.00 173.10 172.23 1a4q s PHE 412 N -2.17 -0.27 -0.02 1.90 -0.71 -0.53 -4.70 117.98 111.49 1a4q s PHE 412 Ca 0.35 -0.02 0.04 0.00 -1.04 0.00 0.00 56.93 56.26 1a4q s PHE 412 Cb -0.07 0.62 -0.01 0.00 -1.21 0.00 0.00 43.02 42.35 1a4q s PHE 412 CO 0.26 -0.89 -0.14 -1.21 -1.34 0.00 0.00 175.22 171.90 1a4q s GLU 413 N -3.52 1.28 -0.06 1.99 2.02 -1.26 -1.02 118.70 118.13 1a4q s GLU 413 Ca 0.08 -0.48 -0.11 0.00 0.02 0.00 0.00 54.97 54.48 1a4q s GLU 413 Cb -0.02 -1.18 -0.05 0.00 0.10 0.00 0.00 34.13 32.98 1a4q s GLU 413 CO -0.02 0.24 0.27 0.42 0.02 0.00 0.00 175.26 176.19 1a4q s ILE 414 N -0.09 5.28 -0.47 -1.63 1.01 -0.43 -4.33 121.20 120.54 1a4q s ILE 414 Ca 0.01 0.51 -0.20 0.00 0.00 0.00 0.00 60.65 60.97 1a4q s ILE 414 Cb -0.08 -3.55 0.04 0.00 0.01 0.00 0.00 42.46 38.88 1a4q s ILE 414 CO 0.00 0.60 0.63 -0.54 0.00 0.00 0.00 174.94 175.64 1a4q s LYS 415 N -1.04 3.19 0.92 2.79 -0.14 -1.26 -0.99 119.74 123.21 1a4q s LYS 415 Ca 0.19 -0.64 -0.15 0.00 -1.36 0.00 0.00 55.97 54.02 1a4q s LYS 415 Cb -0.14 -4.03 0.21 0.00 -1.68 0.00 0.00 37.83 32.19 1a4q s LYS 415 CO 0.08 -1.12 1.25 -3.47 -0.76 0.00 0.00 175.35 171.33 1a4q n ASP 416 N 6.24 0.19 -0.15 2.83 2.03 -0.30 -4.89 116.55 122.48 1a4q n ASP 416 Ca -0.04 -1.51 -0.05 0.00 0.52 0.00 0.00 54.79 53.71 1a4q n ASP 416 Cb 0.47 -0.95 0.04 0.00 -0.72 0.00 0.00 41.12 39.96 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 0.49 0.00 -0.67 1.79 -1.97 -3.34 116.57 112.88 1a4q h LYS 417 Ca -0.40 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 1a4q h LYS 417 Cb 1.13 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 1a4q h LYS 417 CO 0.29 0.33 0.00 1.63 -1.08 0.00 0.00 179.45 180.62 1a4q n LYS 418 N -4.86 2.05 -3.93 3.15 5.02 -1.26 -5.08 118.16 113.25 1a4q n LYS 418 Ca 0.03 -0.30 -0.09 0.00 -2.02 0.00 0.00 58.31 55.93 1a4q n LYS 418 Cb 0.10 -0.79 -0.05 0.00 -0.02 0.00 0.00 35.03 34.27 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 -2.98 5.57 -0.33 0.00 1.01 -0.93 -1.15 116.67 117.85 1a4q s ASP 420 Ca 0.18 0.20 -0.09 0.00 0.71 0.00 0.00 52.55 53.55 1a4q s ASP 420 Cb -0.00 -1.73 0.02 0.00 1.01 0.00 0.00 42.92 42.22 1a4q s ASP 420 CO 0.05 0.34 0.14 -0.69 0.21 0.00 0.00 175.17 175.21 1a4q s VAL 421 N -0.61 4.25 0.21 -1.27 1.01 -0.16 -0.41 120.40 123.43 1a4q s VAL 421 Ca 0.11 -0.78 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 1a4q s VAL 421 Cb -0.12 -3.29 -0.08 0.00 0.00 0.00 0.00 36.38 32.89 1a4q s VAL 421 CO 0.02 -0.08 1.08 -2.16 0.00 0.00 0.00 175.10 173.96 1a4q s PRO 422 N 1.52 4.64 0.05 2.72 0.04 -1.26 -1.31 135.00 141.40 1a4q s PRO 422 Ca 0.02 1.72 -0.04 0.00 0.04 0.00 0.00 61.00 62.73 1a4q s PRO 422 Cb -0.18 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.09 1a4q s PRO 422 CO 0.05 0.17 0.07 0.00 0.04 0.00 0.00 177.00 177.32 1a4q s ILE 424 N -3.32 1.32 0.16 0.00 1.01 -0.21 -1.45 121.20 118.70 1a4q s ILE 424 Ca 0.01 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.09 1a4q s ILE 424 Cb 0.03 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 1a4q s ILE 424 CO -0.08 0.39 0.03 -0.83 0.00 0.00 0.00 174.94 174.45 1a4q s GLY 425 N 0.22 1.76 -0.12 6.18 0.00 -0.55 -1.21 107.32 113.61 1a4q s GLY 425 Ca -0.07 -1.29 -0.01 0.00 0.00 0.00 0.00 44.72 43.35 1a4q s GLY 425 CO 0.03 -1.29 -0.03 -0.42 0.00 0.00 0.00 173.10 171.38 1a4q s ILE 426 N -1.65 0.77 -0.00 0.90 1.01 0.15 -1.84 121.20 120.54 1a4q s ILE 426 Ca 0.28 -0.25 -0.30 0.00 0.00 0.00 0.00 60.65 60.38 1a4q s ILE 426 Cb -0.10 -0.92 -0.05 0.00 0.01 0.00 0.00 42.46 41.40 1a4q s ILE 426 CO 0.20 0.22 1.28 -0.70 0.00 0.00 0.00 174.94 175.94 1a4q s GLU 427 N 1.80 4.34 -0.44 2.79 2.12 0.30 -0.96 118.70 128.65 1a4q s GLU 427 Ca 0.04 1.81 0.04 0.00 0.36 0.00 0.00 54.97 57.22 1a4q s GLU 427 Cb -0.13 -3.50 0.12 0.00 0.26 0.00 0.00 34.13 30.88 1a4q s GLU 427 CO -0.07 -0.45 0.17 -1.64 -0.54 0.00 0.00 175.26 172.73 1a4q s MET 428 N 1.96 1.76 0.29 4.30 -1.94 0.46 -1.12 119.30 124.99 1a4q s MET 428 Ca 0.60 -2.30 -0.29 0.00 -1.71 0.00 0.00 55.69 51.99 1a4q s MET 428 Cb -0.29 -3.25 -0.09 0.00 2.01 0.00 0.00 34.83 33.21 1a4q s MET 428 CO 0.25 -1.04 1.05 0.08 -0.01 0.00 0.00 175.02 175.36 1a4q s VAL 429 N 0.22 3.67 -0.54 -6.03 1.01 -1.26 -1.32 120.40 116.14 1a4q s VAL 429 Ca 0.14 1.62 -0.18 0.00 0.00 0.00 0.00 61.98 63.57 1a4q s VAL 429 Cb -0.23 -4.01 0.10 0.00 0.00 0.00 0.00 36.38 32.24 1a4q s VAL 429 CO -0.03 0.34 0.58 -1.00 0.00 0.00 0.00 175.10 174.98 1a4q s HIS 430 N -1.24 3.12 -0.25 5.22 3.76 0.81 -4.70 115.29 122.01 1a4q s HIS 430 Ca 0.45 -0.96 0.00 0.00 -0.15 0.00 0.00 55.06 54.41 1a4q s HIS 430 Cb -0.29 -3.71 0.04 0.00 1.11 0.00 0.00 32.58 29.73 1a4q s HIS 430 CO 0.37 -1.08 -0.09 0.34 -0.85 0.00 0.00 174.74 173.43 1a4q s ASP 431 N 3.25 4.22 -0.14 1.40 2.15 -1.26 -2.99 116.67 123.29 1a4q s ASP 431 Ca 0.09 -1.02 0.18 0.00 0.43 0.00 0.00 52.55 52.23 1a4q s ASP 431 Cb -0.25 -1.61 0.33 0.00 -0.30 0.00 0.00 42.92 41.10 1a4q s ASP 431 CO 0.07 -0.14 1.20 0.61 -0.17 0.00 0.00 175.17 176.73 1a4q n GLY 432 N 4.59 4.76 0.90 2.66 0.00 -1.26 -5.10 105.19 111.74 1a4q n GLY 432 Ca -0.16 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.73 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 -1.28 -2.66 0.29 -0.02 0.00 -1.26 -4.45 105.19 95.81 1a4q n GLY 433 Ca 0.17 -1.66 0.17 0.00 0.00 0.00 0.00 46.02 44.69 1a4q n GLY 433 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1a4q h LYS 434 N 0.00 0.00 0.00 1.61 3.64 -1.99 -3.03 116.57 116.80 1a4q h LYS 434 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1a4q h LYS 434 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1a4q h LYS 434 CO 0.00 0.05 0.00 0.36 -2.27 0.00 0.00 179.45 177.59 1a4q n LYS 435 N -3.46 0.02 -3.16 1.90 2.85 -1.26 -4.79 118.16 110.26 1a4q n LYS 435 Ca -0.02 0.14 -0.10 0.00 -1.05 0.00 0.00 58.31 57.28 1a4q n LYS 435 Cb 0.16 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.01 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 -1.49 0.00 -1.12 0.58 5.66 -1.15 -5.05 114.28 111.72 1a4q n THR 436 Ca 0.05 -1.26 -0.31 0.00 -3.05 0.00 0.00 64.05 59.49 1a4q n THR 436 Cb 0.24 0.67 0.12 0.00 -1.55 0.00 0.00 70.33 69.81 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 -3.13 2.31 -0.05 1.09 1.48 -1.26 -4.83 118.94 114.54 1a4q s TRP 437 Ca 0.21 1.55 -0.01 0.00 -1.06 0.00 0.00 56.10 56.78 1a4q s TRP 437 Cb 0.01 -3.13 0.03 0.00 -1.16 0.00 0.00 33.47 29.22 1a4q s TRP 437 CO 0.15 -2.15 0.03 -1.58 -4.06 0.00 0.00 176.95 169.33 1a4q s HIS 438 N -2.85 0.31 0.00 1.66 2.46 -1.26 -4.45 115.29 111.16 1a4q s HIS 438 Ca 0.63 0.07 0.00 0.00 0.47 0.00 0.00 55.06 56.22 1a4q s HIS 438 Cb -0.19 -0.57 0.00 0.00 -0.13 0.00 0.00 32.58 31.69 1a4q s HIS 438 CO 0.57 -0.22 0.00 0.45 -2.47 0.00 0.00 174.74 173.06 1a4q n SER 439 N 5.02 0.00 -3.52 9.88 2.88 -1.16 -4.46 113.62 122.26 1a4q n SER 439 Ca -0.09 -0.09 -0.16 0.00 -1.33 0.00 0.00 58.87 57.20 1a4q n SER 439 Cb 0.50 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.91 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 -1.00 -1.62 0.36 -1.46 0.00 -1.23 -0.13 121.76 116.68 1a4q s ALA 440 Ca 0.00 0.98 0.03 0.00 0.00 0.00 0.00 51.96 52.97 1a4q s ALA 440 Cb 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 1a4q s ALA 440 CO 0.00 -0.47 0.54 0.00 0.00 0.00 0.00 175.76 175.83 1a4q s ALA 441 N -1.93 3.89 -0.12 0.00 0.00 -0.43 -4.70 121.76 118.47 1a4q s ALA 441 Ca -0.08 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1a4q s ALA 441 Cb -0.01 -1.95 0.02 0.00 0.00 0.00 0.00 23.12 21.19 1a4q s ALA 441 CO 0.03 -0.10 -0.11 0.99 0.00 0.00 0.00 175.76 176.57 1a4q s THR 442 N -2.31 1.30 -0.14 0.00 2.01 -0.25 -0.41 115.64 115.85 1a4q s THR 442 Ca 0.43 -0.48 -0.07 0.00 0.31 0.00 0.00 61.69 61.88 1a4q s THR 442 Cb -0.10 -1.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 1a4q s THR 442 CO 0.34 0.41 0.11 0.00 -0.69 0.00 0.00 174.62 174.79 1a4q s ALA 443 N 1.43 3.70 -0.11 7.40 0.00 -0.14 -0.62 121.76 133.42 1a4q s ALA 443 Ca 0.01 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.32 1a4q s ALA 443 Cb -0.13 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.07 1a4q s ALA 443 CO -0.07 0.48 -0.22 0.42 0.00 0.00 0.00 175.76 176.37 1a4q s ILE 444 N -0.60 1.97 -0.03 0.00 1.09 0.54 -0.67 121.20 123.49 1a4q s ILE 444 Ca 0.12 -0.95 0.07 0.00 -1.10 0.00 0.00 60.65 58.79 1a4q s ILE 444 Cb -0.12 -1.72 -0.02 0.00 -1.06 0.00 0.00 42.46 39.54 1a4q s ILE 444 CO 0.02 0.54 -0.24 -0.31 -0.10 0.00 0.00 174.94 174.85 1a4q s TYR 445 N 0.54 2.24 0.06 3.97 1.51 -0.35 -0.70 117.35 124.62 1a4q s TYR 445 Ca -0.14 -0.49 0.01 0.00 -1.01 0.00 0.00 57.07 55.44 1a4q s TYR 445 Cb -0.17 -1.45 -0.03 0.00 -0.11 0.00 0.00 41.96 40.20 1a4q s TYR 445 CO 0.05 -0.08 -0.05 0.00 -1.11 0.00 0.00 175.55 174.35 1a4q n LEU 447 N 0.70 3.96 -3.22 0.00 7.94 -0.31 -0.76 117.00 125.32 1a4q n LEU 447 Ca -0.18 0.98 -0.00 0.00 -1.11 0.00 0.00 56.01 55.70 1a4q n LEU 447 Cb 0.58 -1.52 -0.03 0.00 0.53 0.00 0.00 43.42 42.97 1a4q n LEU 447 CO 0.25 0.14 0.09 -0.32 -1.11 0.00 0.00 177.39 176.44 1a4q s MET 448 N 2.93 0.50 3.39 1.96 1.75 0.29 -4.83 119.30 125.28 1a4q s MET 448 Ca 0.83 0.84 0.00 0.00 -1.25 0.00 0.00 55.69 56.11 1a4q s MET 448 Cb -0.50 0.20 0.00 0.00 2.84 0.00 0.00 34.83 37.37 1a4q s MET 448 CO 0.39 -0.64 0.00 0.41 -0.65 0.00 0.00 175.02 174.53 1a4q n GLY 449 N 5.41 0.36 1.39 2.11 0.00 -1.26 -4.60 105.19 108.60 1a4q n GLY 449 Ca -0.02 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 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 -1.53 0.55 0.00 1.61 3.41 -1.26 -0.53 113.62 115.87 1a4q n SER 450 Ca 0.00 -1.92 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 1a4q n SER 450 Cb 0.00 0.54 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 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 0.53 0.34 3.33 5.00 0.00 -1.26 -4.81 105.19 108.32 1a4q n GLY 451 Ca -0.00 -1.44 -0.18 0.00 0.00 0.00 0.00 46.02 44.40 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 1.30 0.20 1.61 -2.07 -1.26 -4.61 119.66 114.84 1a4q s GLN 452 Ca 0.00 -1.60 -0.32 0.00 -1.82 0.00 0.00 55.36 51.62 1a4q s GLN 452 Cb 0.00 -0.95 -0.12 0.00 -1.09 0.00 0.00 33.01 30.85 1a4q s GLN 452 CO 0.00 0.10 1.70 -1.17 -1.32 0.00 0.00 175.29 174.60 1a4q s LEU 453 N -3.30 4.37 -0.17 2.60 0.20 -1.25 -4.96 118.68 116.15 1a4q s LEU 453 Ca 0.23 2.83 0.15 0.00 0.69 0.00 0.00 54.13 58.03 1a4q s LEU 453 Cb 0.01 -3.60 -0.21 0.00 -0.43 0.00 0.00 46.19 41.96 1a4q s LEU 453 CO 0.06 -0.95 0.05 0.18 -0.29 0.00 0.00 176.35 175.40 1a4q n LEU 454 N 3.93 0.13 -3.80 -0.68 4.32 -1.26 -4.89 117.00 114.76 1a4q n LEU 454 Ca 0.15 -0.01 -0.10 0.00 -0.02 0.00 0.00 56.01 56.03 1a4q n LEU 454 Cb 0.36 0.38 -0.07 0.00 -1.62 0.00 0.00 43.42 42.46 1a4q n LEU 454 CO 0.63 0.45 -0.04 0.86 -1.22 0.00 0.00 177.39 178.08 1a4q s TRP 455 N -2.42 0.00 0.55 -1.77 -0.00 -1.26 -5.11 118.94 108.93 1a4q s TRP 455 Ca -0.10 -0.25 0.08 0.00 -0.00 0.00 0.00 56.10 55.84 1a4q s TRP 455 Cb 0.05 0.03 0.07 0.00 -0.00 0.00 0.00 33.47 33.62 1a4q s TRP 455 CO 0.71 -0.50 0.75 0.16 -0.00 0.00 0.00 176.95 178.07 1a4q s ASP 456 N -2.30 5.19 -0.08 5.86 -4.77 -1.26 -4.55 116.67 114.76 1a4q s ASP 456 Ca -0.02 -0.65 0.05 0.00 -3.30 0.00 0.00 52.55 48.62 1a4q s ASP 456 Cb 0.01 -0.04 -0.00 0.00 -1.09 0.00 0.00 42.92 41.80 1a4q s ASP 456 CO -0.06 -1.23 -0.23 -0.89 0.70 0.00 0.00 175.17 173.46 1a4q s THR 457 N -2.63 1.94 0.07 2.11 2.01 -0.34 -5.00 115.64 113.80 1a4q s THR 457 Ca 0.60 -0.97 0.07 0.00 0.31 0.00 0.00 61.69 61.70 1a4q s THR 457 Cb -0.07 -1.67 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 1a4q s THR 457 CO 0.38 0.54 -0.13 0.68 -0.69 0.00 0.00 174.62 175.39 1a4q s VAL 458 N 0.17 3.14 -0.15 3.82 -7.23 -1.26 -4.54 120.40 114.35 1a4q s VAL 458 Ca -0.12 -1.20 0.17 0.00 -1.81 0.00 0.00 61.98 59.01 1a4q s VAL 458 Cb -0.16 -2.40 0.11 0.00 0.56 0.00 0.00 36.38 34.49 1a4q s VAL 458 CO 0.06 0.23 1.50 0.71 -0.31 0.00 0.00 175.10 177.29 1a4q h THR 459 N 3.61 0.75 0.00 5.32 1.35 -1.97 -3.47 112.91 118.49 1a4q h THR 459 Ca -0.49 -1.98 0.00 0.00 -0.55 0.00 0.00 66.41 63.40 1a4q h THR 459 Cb 1.16 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 1a4q h THR 459 CO 0.50 0.41 0.00 0.61 -0.25 0.00 0.00 175.52 176.79 1a4q n GLY 460 N 1.09 0.34 3.75 5.82 0.00 -1.26 -4.84 105.19 110.09 1a4q n GLY 460 Ca 0.02 0.00 -0.37 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 -1.76 5.30 -0.40 1.61 1.01 -1.26 -4.96 120.40 119.94 1a4q s VAL 461 Ca 0.00 0.54 -0.14 0.00 0.00 0.00 0.00 61.98 62.38 1a4q s VAL 461 Cb 0.00 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.78 1a4q s VAL 461 CO 0.00 0.42 0.28 -0.62 0.00 0.00 0.00 175.10 175.18 1a4q s ASP 462 N 0.21 6.03 0.08 3.32 -1.08 -1.26 -4.97 116.67 119.00 1a4q s ASP 462 Ca 0.17 -0.90 0.11 0.00 -0.52 0.00 0.00 52.55 51.40 1a4q s ASP 462 Cb -0.13 -2.13 0.49 0.00 -1.46 0.00 0.00 42.92 39.68 1a4q s ASP 462 CO 0.05 -0.43 1.33 0.23 0.52 0.00 0.00 175.17 176.87 1a4q n MET 463 N 5.13 0.04 0.15 4.34 2.81 -1.26 -2.68 117.12 125.65 1a4q n MET 463 Ca -0.11 0.43 0.13 0.00 -1.81 0.00 0.00 57.70 56.34 1a4q n MET 463 Cb 0.47 -1.61 0.34 0.00 -0.71 0.00 0.00 33.22 31.71 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 2.19 1.00 -0.01 3.04 0.00 -2.03 -3.50 119.26 119.95 1a4q h ALA 464 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1a4q h ALA 464 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1a4q h ALA 464 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53