#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s4f n ILE 93 N 0.00 0.00 -4.18 1.34 -5.35 -1.26 -5.08 119.36 104.83 1s4f n ILE 93 Ca 0.00 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.14 1s4f n ILE 93 Cb 0.00 -1.11 -0.11 0.00 -1.74 0.00 0.00 39.64 36.68 1s4f n ILE 93 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1s4f s ARG 94 N 1.54 3.84 0.27 6.28 0.52 -1.26 -5.04 118.95 125.10 1s4f s ARG 94 Ca 0.00 -0.42 -0.02 0.00 -0.52 0.00 0.00 55.73 54.77 1s4f s ARG 94 Cb 0.00 -3.08 0.58 0.00 0.52 0.00 0.00 34.95 32.97 1s4f s ARG 94 CO 0.00 0.26 1.64 0.93 0.02 0.00 0.00 175.30 178.16 1s4f h GLU 95 N 6.68 0.16 -0.05 3.54 4.39 -2.02 0.47 114.58 127.74 1s4f h GLU 95 Ca -0.34 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.35 1s4f h GLU 95 Cb 1.18 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1s4f h GLU 95 CO 0.67 0.10 0.00 -2.39 -1.16 0.00 0.00 179.01 176.24 1s4f n HIS 96 N -5.28 0.00 0.00 4.33 1.44 -1.26 -1.77 115.22 112.68 1s4f n HIS 96 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 1s4f n HIS 96 Cb 0.59 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.69 1s4f n HIS 96 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 1s4f n ASN 97 N -0.42 0.39 0.28 4.39 3.02 0.15 -4.67 115.26 118.40 1s4f n ASN 97 Ca 0.00 -0.45 0.15 0.00 -0.03 0.00 0.00 54.58 54.25 1s4f n ASN 97 Cb 0.01 0.99 0.83 0.00 -0.61 0.00 0.00 39.78 41.00 1s4f n ASN 97 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1s4f h LYS 98 N 0.00 0.00 -0.79 3.52 1.57 -1.35 -3.04 116.57 116.48 1s4f h LYS 98 Ca 0.00 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 59.01 1s4f h LYS 98 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1s4f h LYS 98 CO 0.00 0.07 0.99 0.11 -0.57 0.00 0.00 179.45 180.05 1s4f h TRP 99 N 0.00 0.00 0.10 -1.35 5.08 -1.83 0.76 115.95 118.71 1s4f h TRP 99 Ca -0.00 0.00 -0.32 0.00 1.08 0.00 0.00 58.89 59.65 1s4f h TRP 99 Cb 0.25 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.39 1s4f h TRP 99 CO 0.00 0.00 -1.69 0.97 -1.28 0.00 0.00 178.44 176.44 1s4f h ILE 100 N 0.00 0.95 0.00 0.12 6.09 -1.92 -3.35 117.51 119.40 1s4f h ILE 100 Ca 0.38 -2.65 0.00 0.00 -1.37 0.00 0.00 64.86 61.21 1s4f h ILE 100 Cb 2.35 2.63 0.00 0.00 0.47 0.00 0.00 36.82 42.27 1s4f h ILE 100 CO -0.00 0.78 0.14 0.18 -3.07 0.00 0.00 178.15 176.18 1s4f n LEU 101 N -3.39 0.00 -0.59 2.19 4.77 0.26 0.45 117.00 120.69 1s4f n LEU 101 Ca -0.21 0.06 0.07 0.00 -0.03 0.00 0.00 56.01 55.90 1s4f n LEU 101 Cb 1.05 -0.06 0.09 0.00 -2.33 0.00 0.00 43.42 42.17 1s4f n LEU 101 CO 0.48 -0.06 0.51 0.29 -1.33 0.00 0.00 177.39 177.28 1s4f n LYS 102 N -0.86 1.41 -0.09 3.23 5.02 -1.25 -4.28 118.16 121.34 1s4f n LYS 102 Ca 0.00 -1.53 0.11 0.00 -2.02 0.00 0.00 58.31 54.86 1s4f n LYS 102 Cb 0.14 -1.27 0.14 0.00 -0.02 0.00 0.00 35.03 34.02 1s4f n LYS 102 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1s4f n LYS 103 N 0.73 2.17 -2.72 1.97 5.02 0.17 -4.96 118.16 120.55 1s4f n LYS 103 Ca 0.09 -1.98 -0.38 0.00 -2.02 0.00 0.00 58.31 54.03 1s4f n LYS 103 Cb 0.37 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.88 1s4f n LYS 103 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1s4f s ILE 104 N -1.56 4.07 0.00 -0.18 1.01 -1.26 -4.18 121.20 119.10 1s4f s ILE 104 Ca 0.30 1.76 0.00 0.00 0.00 0.00 0.00 60.65 62.71 1s4f s ILE 104 Cb 0.19 -4.00 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1s4f s ILE 104 CO 0.28 0.19 0.00 0.54 0.00 0.00 0.00 174.94 175.94 1s4f n ARG 105 N 0.64 3.29 -4.22 2.79 5.12 -0.05 -4.94 116.66 119.28 1s4f n ARG 105 Ca 0.02 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.81 1s4f n ARG 105 Cb 0.49 -0.52 -0.10 0.00 -1.16 0.00 0.00 32.46 31.17 1s4f n ARG 105 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1s4f s PHE 106 N -0.66 1.20 0.54 -1.55 0.40 -0.73 -4.97 117.98 112.20 1s4f s PHE 106 Ca 0.00 -1.27 -0.17 0.00 -0.60 0.00 0.00 56.93 54.89 1s4f s PHE 106 Cb 0.00 -0.64 -0.06 0.00 0.51 0.00 0.00 43.02 42.83 1s4f s PHE 106 CO 0.00 -0.50 1.02 -0.65 0.70 0.00 0.00 175.22 175.79 1s4f s GLN 107 N -4.09 3.67 0.31 0.44 1.11 -1.26 -0.26 119.66 119.58 1s4f s GLN 107 Ca 0.35 1.14 -0.29 0.00 0.01 0.00 0.00 55.36 56.57 1s4f s GLN 107 Cb 0.07 -2.09 -0.10 0.00 -1.01 0.00 0.00 33.01 29.89 1s4f s GLN 107 CO 0.10 -0.52 1.15 0.20 0.01 0.00 0.00 175.29 176.24 1s4f s GLY 108 N -2.72 3.02 -0.18 3.09 0.00 -1.22 -4.15 107.32 105.17 1s4f s GLY 108 Ca 0.62 0.98 0.16 0.00 0.00 0.00 0.00 44.72 46.49 1s4f s GLY 108 CO 0.31 1.58 1.53 0.70 0.00 0.00 0.00 173.10 177.22 1s4f n ASN 109 N 0.94 4.47 -4.25 1.64 3.02 -1.26 -4.82 115.26 115.00 1s4f n ASN 109 Ca -0.00 -2.85 -0.37 0.00 -0.03 0.00 0.00 54.58 51.33 1s4f n ASN 109 Cb 0.44 -0.57 -0.13 0.00 -0.61 0.00 0.00 39.78 38.92 1s4f n ASN 109 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1s4f s LEU 110 N -2.56 4.15 -1.47 3.41 1.43 -1.26 -4.98 118.68 117.40 1s4f s LEU 110 Ca 0.45 -1.13 -0.13 0.00 -1.03 0.00 0.00 54.13 52.29 1s4f s LEU 110 Cb 0.35 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.75 1s4f s LEU 110 CO 0.13 -0.30 2.38 -0.46 0.23 0.00 0.00 176.35 178.34 1s4f n ASN 111 N 4.77 4.89 -4.65 2.29 6.94 -1.26 -4.80 115.26 123.44 1s4f n ASN 111 Ca -0.13 -2.77 -0.44 0.00 -0.02 0.00 0.00 54.58 51.22 1s4f n ASN 111 Cb 0.45 -1.62 -0.04 0.00 -2.36 0.00 0.00 39.78 36.21 1s4f n ASN 111 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1s4f n THR 112 N 4.79 0.63 -0.01 5.53 -2.24 -1.26 -4.89 114.28 116.84 1s4f n THR 112 Ca 0.58 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 62.03 1s4f n THR 112 Cb 0.35 -2.26 -0.09 0.00 -2.10 0.00 0.00 70.33 66.24 1s4f n THR 112 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1s4f h LYS 113 N 11.26 0.04 -0.00 -0.78 1.79 -2.04 -3.37 116.57 123.47 1s4f h LYS 113 Ca -0.47 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1s4f h LYS 113 Cb 1.25 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 1s4f h LYS 113 CO 0.95 0.42 -0.15 1.63 -1.08 0.00 0.00 179.45 181.22 1s4f n LYS 114 N -4.87 2.88 -3.99 3.15 4.76 -1.26 -5.02 118.16 113.81 1s4f n LYS 114 Ca -0.08 -0.38 -0.24 0.00 -2.87 0.00 0.00 58.31 54.74 1s4f n LYS 114 Cb 0.22 -0.92 -0.03 0.00 -1.84 0.00 0.00 35.03 32.46 1s4f n LYS 114 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1s4f s MET 115 N -1.10 3.32 -0.60 1.97 -1.94 -1.26 -5.07 119.30 114.62 1s4f s MET 115 Ca 0.04 -0.72 -0.12 0.00 -1.71 0.00 0.00 55.69 53.18 1s4f s MET 115 Cb 0.05 -2.86 0.15 0.00 2.01 0.00 0.00 34.83 34.17 1s4f s MET 115 CO 0.17 0.48 0.51 -1.17 -0.01 0.00 0.00 175.02 175.00 1s4f s LEU 116 N -3.47 6.11 -0.95 -0.03 0.20 -1.26 -4.63 118.68 114.65 1s4f s LEU 116 Ca 0.34 -2.13 -0.16 0.00 0.69 0.00 0.00 54.13 52.87 1s4f s LEU 116 Cb -0.10 -2.12 0.17 0.00 -0.43 0.00 0.00 46.19 43.70 1s4f s LEU 116 CO 0.28 -0.70 1.08 0.21 -0.29 0.00 0.00 176.35 176.92 1s4f s ASN 117 N 2.76 6.75 0.00 3.68 2.47 -1.26 -4.98 114.94 124.36 1s4f s ASN 117 Ca 0.08 -2.40 0.00 0.00 0.42 0.00 0.00 52.86 50.96 1s4f s ASN 117 Cb -0.23 -2.34 0.00 0.00 -1.45 0.00 0.00 41.25 37.22 1s4f s ASN 117 CO -0.01 -0.86 0.00 -2.65 -3.72 0.00 0.00 177.10 169.85 1s4f n PRO 118 N 5.60 0.00 0.00 0.43 -0.02 -1.26 -4.50 135.00 135.25 1s4f n PRO 118 Ca 0.23 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1s4f n PRO 118 Cb 0.47 -0.17 0.00 0.00 -0.02 0.00 0.00 33.50 33.79 1s4f n PRO 118 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s4f n GLY 119 N 0.00 5.42 2.94 -1.23 0.00 -1.26 -3.42 105.19 107.63 1s4f n GLY 119 Ca 0.00 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.61 1s4f n GLY 119 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s4f s LYS 120 N 4.21 0.08 1.01 1.61 2.20 0.65 -4.08 119.74 125.42 1s4f s LYS 120 Ca 0.00 0.11 -0.12 0.00 -0.36 0.00 0.00 55.97 55.59 1s4f s LYS 120 Cb 0.00 0.03 0.19 0.00 -1.51 0.00 0.00 37.83 36.55 1s4f s LYS 120 CO 0.00 -0.02 1.08 -0.51 -0.36 0.00 0.00 175.35 175.55 1s4f s LEU 121 N 0.08 1.60 0.10 5.43 2.01 -1.26 -0.87 118.68 125.76 1s4f s LEU 121 Ca -0.00 1.30 0.20 0.00 0.01 0.00 0.00 54.13 55.64 1s4f s LEU 121 Cb -0.01 -3.48 -0.11 0.00 0.01 0.00 0.00 46.19 42.60 1s4f s LEU 121 CO -0.00 -3.24 0.84 -1.54 1.01 0.00 0.00 176.35 173.43 1s4f n SER 122 N -4.26 0.72 -4.96 2.29 3.41 -1.26 -4.67 113.62 104.89 1s4f n SER 122 Ca 0.05 0.30 -0.22 0.00 -0.26 0.00 0.00 58.87 58.74 1s4f n SER 122 Cb 0.56 0.54 0.03 0.00 -0.26 0.00 0.00 64.21 65.08 1s4f n SER 122 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1s4f s GLU 123 N -3.16 2.63 0.05 4.33 2.02 -1.26 -3.50 118.70 119.80 1s4f s GLU 123 Ca -0.03 -0.64 -0.08 0.00 0.02 0.00 0.00 54.97 54.24 1s4f s GLU 123 Cb 0.10 -2.46 -0.00 0.00 0.10 0.00 0.00 34.13 31.86 1s4f s GLU 123 CO 0.81 -0.67 0.15 -0.65 0.02 0.00 0.00 175.26 174.92 1s4f s GLN 124 N -4.77 0.68 -0.53 1.61 -0.21 -0.74 -4.87 119.66 110.82 1s4f s GLN 124 Ca 0.56 -0.75 -0.16 0.00 0.02 0.00 0.00 55.36 55.02 1s4f s GLN 124 Cb -0.10 0.27 0.11 0.00 1.00 0.00 0.00 33.01 34.29 1s4f s GLN 124 CO 0.39 -0.19 0.51 -1.17 -2.12 0.00 0.00 175.29 172.71 1s4f s LEU 125 N -2.26 5.96 1.01 2.90 2.96 -1.26 -2.11 118.68 125.89 1s4f s LEU 125 Ca -0.03 -1.64 -0.12 0.00 -0.22 0.00 0.00 54.13 52.12 1s4f s LEU 125 Cb 0.00 -2.22 0.15 0.00 0.50 0.00 0.00 46.19 44.62 1s4f s LEU 125 CO -0.06 -0.85 0.81 -0.90 -1.32 0.00 0.00 176.35 174.03 1s4f n ASP 126 N 5.40 -1.06 -3.75 3.68 3.85 -0.61 -4.80 116.55 119.25 1s4f n ASP 126 Ca -0.13 0.19 -0.42 0.00 -0.71 0.00 0.00 54.79 53.73 1s4f n ASP 126 Cb 0.41 -1.30 0.00 0.00 -1.35 0.00 0.00 41.12 38.88 1s4f n ASP 126 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.20 175.05 1s4f n ARG 127 N -3.57 3.88 0.00 0.11 3.00 -1.26 -3.10 116.66 115.71 1s4f n ARG 127 Ca 0.07 -3.48 0.00 0.00 -0.00 0.00 0.00 57.85 54.44 1s4f n ARG 127 Cb 0.54 -2.85 0.00 0.00 0.00 0.00 0.00 32.46 30.15 1s4f n ARG 127 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1s4f n GLU 128 N 3.30 0.00 0.00 -0.14 4.07 -1.26 -5.02 120.64 121.58 1s4f n GLU 128 Ca 0.46 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.56 1s4f n GLU 128 Cb 0.33 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.71 1s4f n GLU 128 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1s4f n GLY 129 N 0.00 2.38 3.76 8.31 0.00 -1.18 -5.06 105.19 113.40 1s4f n GLY 129 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1s4f n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s4f s ARG 130 N -0.00 4.26 -1.09 1.61 1.81 -1.26 -4.84 118.95 119.43 1s4f s ARG 130 Ca 0.00 2.35 -0.06 0.00 -1.72 0.00 0.00 55.73 56.29 1s4f s ARG 130 Cb 0.00 -3.05 0.29 0.00 -0.45 0.00 0.00 34.95 31.74 1s4f s ARG 130 CO 0.00 -0.36 1.26 1.17 -0.68 0.00 0.00 175.30 176.68 1s4f n LYS 131 N 1.24 3.90 -2.61 3.54 4.81 -1.26 -1.58 118.16 126.20 1s4f n LYS 131 Ca 0.03 -4.51 -0.29 0.00 -0.87 0.00 0.00 58.31 52.67 1s4f n LYS 131 Cb 0.40 -2.52 -0.01 0.00 0.02 0.00 0.00 35.03 32.92 1s4f n LYS 131 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1s4f s ARG 132 N -1.95 3.63 0.19 1.64 1.04 -0.89 -4.73 118.95 117.88 1s4f s ARG 132 Ca 0.31 0.37 -0.30 0.00 -1.04 0.00 0.00 55.73 55.07 1s4f s ARG 132 Cb -0.03 -2.34 -0.08 0.00 -2.04 0.00 0.00 34.95 30.46 1s4f s ARG 132 CO -0.00 -0.20 1.05 -0.80 -0.04 0.00 0.00 175.30 175.31 1s4f s ASN 133 N -3.79 7.36 0.02 -2.89 -0.87 -1.26 -1.79 114.94 111.72 1s4f s ASN 133 Ca 0.50 2.05 -0.25 0.00 -1.57 0.00 0.00 52.86 53.58 1s4f s ASN 133 Cb -0.10 -2.61 -0.18 0.00 -0.02 0.00 0.00 41.25 38.35 1s4f s ASN 133 CO 0.41 -0.13 1.36 0.40 -2.57 0.00 0.00 177.10 176.57 1s4f h ILE 134 N 3.61 0.98 -3.23 0.60 2.04 -1.89 -3.48 117.51 116.14 1s4f h ILE 134 Ca -0.44 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 64.77 1s4f h ILE 134 Cb 1.21 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1s4f h ILE 134 CO 0.71 0.15 0.00 -1.22 0.00 0.00 0.00 178.15 177.79 1s4f n TYR 135 N -5.04 -0.50 -3.82 1.37 4.02 -1.26 -4.76 117.16 107.17 1s4f n TYR 135 Ca -0.09 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.44 1s4f n TYR 135 Cb 0.21 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.42 1s4f n TYR 135 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 1s4f s ASN 136 N -0.58 5.49 0.00 7.72 0.01 -1.09 -4.94 114.94 121.54 1s4f s ASN 136 Ca 0.00 -0.06 0.00 0.00 -0.71 0.00 0.00 52.86 52.09 1s4f s ASN 136 Cb 0.00 -1.98 0.00 0.00 0.41 0.00 0.00 41.25 39.68 1s4f s ASN 136 CO 0.00 0.04 0.95 1.57 -1.51 0.00 0.00 177.10 178.15 1s4f n HIS 137 N 4.45 0.00 -0.12 2.20 -0.00 -1.26 -1.13 115.22 119.36 1s4f n HIS 137 Ca -0.16 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.51 1s4f n HIS 137 Cb 0.52 -0.45 0.01 0.00 -0.00 0.00 0.00 29.99 30.07 1s4f n HIS 137 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.34 178.30 1s4f h GLN 138 N 0.00 -0.02 -0.14 1.57 1.08 -1.96 -2.31 115.11 113.33 1s4f h GLN 138 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1s4f h GLN 138 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1s4f h GLN 138 CO 0.00 -0.01 0.08 0.82 -0.95 0.00 0.00 178.83 178.77 1s4f h ILE 139 N -0.02 1.09 -0.35 2.54 2.04 -1.92 -3.13 117.51 117.75 1s4f h ILE 139 Ca 0.19 -0.23 -0.13 0.00 1.00 0.00 0.00 64.86 65.69 1s4f h ILE 139 Cb 0.31 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1s4f h ILE 139 CO -0.42 0.08 -0.30 1.23 0.00 0.00 0.00 178.15 178.74 1s4f h GLY 140 N 0.14 0.90 0.51 5.37 0.00 -1.01 -2.62 103.07 106.35 1s4f h GLY 140 Ca 0.05 -0.89 0.08 0.00 0.00 0.00 0.00 47.33 46.57 1s4f h GLY 140 CO -0.01 0.80 0.22 -0.84 0.00 0.00 0.00 176.54 176.72 1s4f h THR 141 N 0.61 0.83 -0.38 4.70 2.02 -1.47 0.52 112.91 119.74 1s4f h THR 141 Ca 0.06 -0.14 -0.05 0.00 0.77 0.00 0.00 66.41 67.05 1s4f h THR 141 Cb 0.87 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1s4f h THR 141 CO 0.08 0.08 0.03 0.40 0.37 0.00 0.00 175.52 176.47 1s4f h ILE 142 N 0.42 1.20 -0.01 3.11 2.04 -1.53 -0.72 117.51 122.02 1s4f h ILE 142 Ca 0.27 -0.78 -0.13 0.00 1.00 0.00 0.00 64.86 65.23 1s4f h ILE 142 Cb 0.29 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1s4f h ILE 142 CO -0.25 0.27 -0.58 0.24 0.00 0.00 0.00 178.15 177.83 1s4f h MET 143 N 0.57 0.03 0.00 2.37 2.86 -0.63 -2.21 114.93 117.92 1s4f h MET 143 Ca 0.12 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1s4f h MET 143 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1s4f h MET 143 CO 0.01 0.61 0.00 0.77 1.06 0.00 0.00 176.91 179.35 1s4f h SER 144 N 0.03 0.00 0.59 1.22 0.02 0.12 -3.09 113.55 112.43 1s4f h SER 144 Ca -0.01 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1s4f h SER 144 Cb 1.04 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.58 1s4f h SER 144 CO 0.08 0.00 -0.28 0.28 -1.14 0.00 0.00 176.83 175.77 1s4f h SER 145 N 0.00 -0.67 -4.25 3.07 0.02 -0.52 -3.41 113.55 107.78 1s4f h SER 145 Ca 0.00 0.02 -0.49 0.00 -0.84 0.00 0.00 61.79 60.48 1s4f h SER 145 Cb 0.61 0.17 0.07 0.00 0.14 0.00 0.00 62.40 63.39 1s4f h SER 145 CO 0.00 -0.47 0.35 0.00 -1.14 0.00 0.00 176.83 175.58 1s4f s ALA 146 N -6.02 3.02 -0.71 3.77 0.00 -1.20 -4.88 121.76 115.75 1s4f s ALA 146 Ca -0.17 -0.40 -0.24 0.00 0.00 0.00 0.00 51.96 51.14 1s4f s ALA 146 Cb 0.04 -2.92 -0.20 0.00 0.00 0.00 0.00 23.12 20.04 1s4f s ALA 146 CO 0.62 -1.00 1.87 0.41 0.00 0.00 0.00 175.76 177.66 1s4f n GLY 147 N -2.87 1.70 3.17 0.00 0.00 -1.26 -4.86 105.19 101.08 1s4f n GLY 147 Ca 0.06 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.72 1s4f n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s4f s ILE 148 N 7.19 2.68 -0.67 -0.61 1.01 -1.17 -2.24 121.20 127.39 1s4f s ILE 148 Ca 0.63 -1.10 -0.26 0.00 0.00 0.00 0.00 60.65 59.93 1s4f s ILE 148 Cb 0.11 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 40.26 1s4f s ILE 148 CO 0.17 0.21 1.16 -0.13 0.00 0.00 0.00 174.94 176.35 1s4f s ARG 149 N 1.29 3.26 0.66 2.79 0.52 -0.25 -4.33 118.95 122.89 1s4f s ARG 149 Ca -0.00 -0.25 0.37 0.00 -0.52 0.00 0.00 55.73 55.32 1s4f s ARG 149 Cb -0.17 -4.14 2.03 0.00 0.52 0.00 0.00 34.95 33.19 1s4f s ARG 149 CO -0.06 -1.90 2.15 -0.07 0.02 0.00 0.00 175.30 175.44 1s4f h LEU 150 N 12.21 0.00 -2.51 2.53 3.38 -1.94 0.52 115.31 129.51 1s4f h LEU 150 Ca -0.27 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.59 1s4f h LEU 150 Cb 1.06 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 1s4f h LEU 150 CO 1.22 0.00 0.13 -1.84 0.09 0.00 0.00 178.44 178.04 1s4f n GLU 151 N -3.04 2.28 0.00 1.13 0.00 -1.26 -3.35 120.64 116.39 1s4f n GLU 151 Ca -0.02 -1.43 0.00 0.00 0.00 0.00 0.00 57.16 55.70 1s4f n GLU 151 Cb 0.23 -1.72 0.00 0.00 0.00 0.00 0.00 31.44 29.95 1s4f n GLU 151 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1s4f n LYS 152 N 0.05 0.29 -2.06 3.44 4.76 0.17 -5.02 118.16 119.80 1s4f n LYS 152 Ca 0.19 -0.10 -0.30 0.00 -2.87 0.00 0.00 58.31 55.23 1s4f n LYS 152 Cb 0.85 -0.50 -0.04 0.00 -1.84 0.00 0.00 35.03 33.49 1s4f n LYS 152 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1s4f s LEU 153 N -0.14 3.20 -0.35 -0.35 1.43 -1.21 -4.79 118.68 116.47 1s4f s LEU 153 Ca 0.00 -0.43 -0.31 0.00 -1.03 0.00 0.00 54.13 52.36 1s4f s LEU 153 Cb 0.00 -2.55 -0.13 0.00 0.03 0.00 0.00 46.19 43.54 1s4f s LEU 153 CO 0.00 -2.62 1.44 -2.65 0.23 0.00 0.00 176.35 172.75 1s4f n PRO 154 N 8.94 0.00 0.00 1.29 -0.02 -1.26 -4.79 135.00 139.17 1s4f n PRO 154 Ca 0.35 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1s4f n PRO 154 Cb 0.48 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.92 1s4f n PRO 154 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1s4f n ILE 155 N 4.30 0.00 -3.74 4.25 3.06 -1.24 -4.56 119.36 121.43 1s4f n ILE 155 Ca 0.36 0.00 -0.14 0.00 -2.50 0.00 0.00 62.75 60.48 1s4f n ILE 155 Cb -0.03 0.00 -0.08 0.00 0.54 0.00 0.00 39.64 40.07 1s4f n ILE 155 CO 0.00 0.00 0.00 0.68 -2.50 0.00 0.00 176.55 174.73 1s4f s VAL 156 N -0.03 0.05 -0.41 9.51 -7.23 -0.75 -4.91 120.40 116.63 1s4f s VAL 156 Ca 0.00 -0.44 -0.29 0.00 -1.81 0.00 0.00 61.98 59.44 1s4f s VAL 156 Cb 0.00 -0.64 0.02 0.00 0.56 0.00 0.00 36.38 36.32 1s4f s VAL 156 CO 0.00 -0.24 1.15 -0.13 -0.31 0.00 0.00 175.10 175.57 1s4f s ARG 157 N -1.32 3.83 -0.25 4.82 3.00 -1.26 0.08 118.95 127.85 1s4f s ARG 157 Ca -0.13 0.79 -0.38 0.00 0.00 0.00 0.00 55.73 56.01 1s4f s ARG 157 Cb -0.05 -3.86 -0.14 0.00 0.00 0.00 0.00 34.95 30.90 1s4f s ARG 157 CO 0.05 -1.23 1.87 0.00 0.00 0.00 0.00 175.30 175.98 1s4f n ALA 158 N 7.61 0.30 -1.53 2.13 0.00 -0.06 -3.95 120.51 125.01 1s4f n ALA 158 Ca 0.13 0.28 -0.21 0.00 0.00 0.00 0.00 53.44 53.64 1s4f n ALA 158 Cb 0.48 -2.35 -0.14 0.00 0.00 0.00 0.00 19.45 17.45 1s4f n ALA 158 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1s4f n GLN 159 N 6.25 0.33 -2.13 0.00 6.02 1.42 -4.74 117.38 124.52 1s4f n GLN 159 Ca 0.29 -0.37 -0.42 0.00 -0.01 0.00 0.00 57.00 56.49 1s4f n GLN 159 Cb 0.18 -2.42 0.00 0.00 1.02 0.00 0.00 30.24 29.03 1s4f n GLN 159 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1s4f n THR 160 N 7.30 4.31 -5.07 5.09 -1.04 -1.26 -4.58 114.28 119.04 1s4f n THR 160 Ca 0.56 -4.06 -0.32 0.00 -2.04 0.00 0.00 64.05 58.19 1s4f n THR 160 Cb 0.29 -2.38 -0.16 0.00 -1.82 0.00 0.00 70.33 66.27 1s4f n THR 160 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1s4f s ASP 161 N 1.25 3.43 0.47 8.00 1.11 -1.25 -4.98 116.67 124.70 1s4f s ASP 161 Ca 0.44 -0.46 0.34 0.00 0.18 0.00 0.00 52.55 53.05 1s4f s ASP 161 Cb 0.12 -1.34 1.47 0.00 1.07 0.00 0.00 42.92 44.24 1s4f s ASP 161 CO -0.03 0.19 1.66 0.74 1.18 0.00 0.00 175.17 178.91 1s4f h THR 162 N 5.41 0.19 0.23 -1.27 2.02 -1.97 3.37 112.91 120.89 1s4f h THR 162 Ca -0.25 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1s4f h THR 162 Cb 1.21 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 1s4f h THR 162 CO 0.50 0.02 -0.11 0.50 0.37 0.00 0.00 175.52 176.80 1s4f h LYS 163 N 0.09 -0.29 -1.93 6.66 3.64 -1.98 -2.57 116.57 120.20 1s4f h LYS 163 Ca 0.78 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 60.18 1s4f h LYS 163 Cb 2.64 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 34.53 1s4f h LYS 163 CO -0.26 -0.20 0.00 2.41 -2.27 0.00 0.00 179.45 179.13 1s4f n THR 164 N -4.01 0.63 0.00 1.00 -1.04 1.04 -2.89 114.28 109.02 1s4f n THR 164 Ca -0.04 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1s4f n THR 164 Cb 0.12 -1.07 0.00 0.00 -1.82 0.00 0.00 70.33 67.56 1s4f n THR 164 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1s4f n PHE 165 N 1.62 -0.32 -0.47 -1.42 -0.00 0.32 -3.90 117.46 113.29 1s4f n PHE 165 Ca 0.00 0.00 0.40 0.00 -0.00 0.00 0.00 57.45 57.85 1s4f n PHE 165 Cb 0.18 0.44 0.68 0.00 -0.00 0.00 0.00 39.48 40.78 1s4f n PHE 165 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1s4f n HIS 166 N -2.33 0.71 -0.05 -5.13 8.25 -0.97 0.42 115.22 116.12 1s4f n HIS 166 Ca 0.00 0.71 0.24 0.00 -0.26 0.00 0.00 57.72 58.42 1s4f n HIS 166 Cb 0.00 -1.15 0.72 0.00 1.12 0.00 0.00 29.99 30.68 1s4f n HIS 166 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1s4f h GLU 167 N 0.00 0.00 0.00 -0.41 5.08 -1.75 1.29 114.58 118.79 1s4f h GLU 167 Ca 0.88 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 59.20 1s4f h GLU 167 Cb 2.85 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 32.09 1s4f h GLU 167 CO -0.47 0.00 -0.32 0.00 -1.00 0.00 0.00 179.01 177.22 1s4f h ALA 168 N 1.48 0.06 -0.10 3.43 0.00 0.82 -3.26 119.26 121.68 1s4f h ALA 168 Ca 0.31 -0.53 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1s4f h ALA 168 Cb 1.45 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 1s4f h ALA 168 CO -0.00 0.20 -0.31 0.82 0.00 0.00 0.00 179.25 179.96 1s4f h ILE 169 N -1.00 0.31 0.00 0.00 2.04 -0.88 0.53 117.51 118.51 1s4f h ILE 169 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1s4f h ILE 169 Cb 0.76 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1s4f h ILE 169 CO -0.04 0.00 0.00 0.54 0.00 0.00 0.00 178.15 178.65 1s4f n ARG 170 N -5.40 0.15 0.00 2.37 1.74 0.43 -1.17 116.66 114.78 1s4f n ARG 170 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1s4f n ARG 170 Cb 0.32 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1s4f n ARG 170 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1s4f n ASP 171 N 1.22 0.00 0.04 0.55 8.00 0.17 -4.87 116.55 121.66 1s4f n ASP 171 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.50 1s4f n ASP 171 Cb 0.08 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1s4f n ASP 171 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1s4f n LYS 172 N -1.51 0.02 0.19 -1.24 5.02 -0.29 -4.79 118.16 115.57 1s4f n LYS 172 Ca 0.00 0.01 0.03 0.00 -2.02 0.00 0.00 58.31 56.33 1s4f n LYS 172 Cb 0.00 -0.50 0.38 0.00 -0.02 0.00 0.00 35.03 34.89 1s4f n LYS 172 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1s4f h ILE 173 N -0.03 1.25 0.00 -0.18 2.04 -1.73 -3.35 117.51 115.50 1s4f h ILE 173 Ca 0.00 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.68 1s4f h ILE 173 Cb 0.03 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 1s4f h ILE 173 CO 0.00 0.34 0.00 -0.90 0.00 0.00 0.00 178.15 177.59 1s4f n ASP 174 N -4.13 0.00 0.00 1.72 3.85 -0.32 -4.69 116.55 112.98 1s4f n ASP 174 Ca -0.02 -0.22 0.00 0.00 -0.71 0.00 0.00 54.79 53.84 1s4f n ASP 174 Cb 0.38 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.15 1s4f n ASP 174 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1s4f n LYS 175 N 1.09 0.00 0.00 0.11 5.02 -1.26 -4.94 118.16 118.19 1s4f n LYS 175 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1s4f n LYS 175 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1s4f n LYS 175 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1s4f n SER 176 N 0.00 0.00 0.00 4.39 3.41 -1.26 -4.85 113.62 115.30 1s4f n SER 176 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1s4f n SER 176 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1s4f n SER 176 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1s4f n GLU 177 N 0.00 0.00 -2.23 4.33 4.07 -1.26 -4.90 120.64 120.65 1s4f n GLU 177 Ca 0.00 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.79 1s4f n GLU 177 Cb 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.37 1s4f n GLU 177 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 1s4f s ASN 178 N 0.00 6.44 0.00 4.31 0.01 -1.26 -4.93 114.94 119.51 1s4f s ASN 178 Ca 0.00 1.44 -0.03 0.00 -0.71 0.00 0.00 52.86 53.56 1s4f s ASN 178 Cb 0.00 -2.47 -0.14 0.00 0.41 0.00 0.00 41.25 39.06 1s4f s ASN 178 CO 0.00 -0.69 2.16 0.54 -1.51 0.00 0.00 177.10 177.60 1s4f n ARG 179 N -2.07 1.07 -2.05 -0.60 3.00 -1.26 -4.92 116.66 109.84 1s4f n ARG 179 Ca 0.06 -0.51 -0.40 0.00 -0.01 0.00 0.00 57.85 56.98 1s4f n ARG 179 Cb 0.54 -1.73 -0.01 0.00 0.00 0.00 0.00 32.46 31.26 1s4f n ARG 179 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1s4f s GLN 180 N 1.79 4.20 0.37 5.56 -0.21 -1.26 -4.52 119.66 125.60 1s4f s GLN 180 Ca 0.34 2.26 -0.11 0.00 0.02 0.00 0.00 55.36 57.88 1s4f s GLN 180 Cb 0.16 -2.96 -0.07 0.00 1.00 0.00 0.00 33.01 31.14 1s4f s GLN 180 CO 0.00 -0.33 0.73 0.54 -2.12 0.00 0.00 175.29 174.11 1s4f s ASN 181 N -0.50 6.56 0.00 5.90 6.03 -1.24 -5.00 114.94 126.69 1s4f s ASN 181 Ca 0.52 1.10 -0.00 0.00 -1.03 0.00 0.00 52.86 53.45 1s4f s ASN 181 Cb -0.40 -2.31 -0.00 0.00 -3.03 0.00 0.00 41.25 35.51 1s4f s ASN 181 CO 0.53 -0.33 1.00 -0.65 -2.03 0.00 0.00 177.10 175.62 1s4f h PRO 182 N 1.51 -0.00 -0.05 3.55 0.11 -1.95 -3.10 132.00 132.07 1s4f h PRO 182 Ca -0.47 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1s4f h PRO 182 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1s4f h PRO 182 CO 0.64 -0.00 0.08 0.93 -0.21 0.00 0.00 178.00 179.44 1s4f h GLU 183 N -0.00 0.00 0.00 1.05 4.39 -1.99 -3.35 114.58 114.67 1s4f h GLU 183 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1s4f h GLU 183 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1s4f h GLU 183 CO -0.00 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.13 1s4f n LEU 184 N -3.53 0.00 0.09 1.33 4.77 -1.17 0.25 117.00 118.74 1s4f n LEU 184 Ca -0.02 0.37 -0.13 0.00 -0.03 0.00 0.00 56.01 56.21 1s4f n LEU 184 Cb 0.17 -0.18 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 1s4f n LEU 184 CO 0.24 -0.18 0.79 0.45 -1.33 0.00 0.00 177.39 177.37 1s4f h HIS 185 N 0.00 -0.14 -0.35 -1.77 3.86 -1.83 -2.60 115.15 112.33 1s4f h HIS 185 Ca 0.00 -0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.33 1s4f h HIS 185 Cb 0.00 0.05 -0.06 0.00 1.06 0.00 0.00 27.41 28.45 1s4f h HIS 185 CO -0.34 -0.02 0.12 0.09 0.86 0.00 0.00 177.93 178.64 1s4f n ASN 186 N -5.12 0.06 -0.12 2.45 3.02 0.14 -0.86 115.26 114.83 1s4f n ASN 186 Ca -0.08 0.59 -0.22 0.00 -0.03 0.00 0.00 54.58 54.84 1s4f n ASN 186 Cb 0.11 -0.26 -0.10 0.00 -0.61 0.00 0.00 39.78 38.93 1s4f n ASN 186 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1s4f n LYS 187 N -4.00 0.55 -0.20 3.52 5.02 -1.00 -4.56 118.16 117.51 1s4f n LYS 187 Ca 0.11 0.19 0.19 0.00 -2.02 0.00 0.00 58.31 56.78 1s4f n LYS 187 Cb 0.38 -1.42 0.35 0.00 -0.02 0.00 0.00 35.03 34.31 1s4f n LYS 187 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1s4f n LEU 188 N -3.67 0.19 0.19 -0.35 4.77 -0.04 0.31 117.00 118.40 1s4f n LEU 188 Ca -0.45 1.01 -0.14 0.00 -0.03 0.00 0.00 56.01 56.39 1s4f n LEU 188 Cb 0.89 -0.48 -0.07 0.00 -2.33 0.00 0.00 43.42 41.42 1s4f n LEU 188 CO 0.13 -1.12 0.74 0.25 -1.33 0.00 0.00 177.39 176.06 1s4f h LEU 189 N 0.00 -0.46 -0.50 2.23 6.46 -1.78 0.85 115.31 122.12 1s4f h LEU 189 Ca 0.51 0.03 0.10 0.00 -0.12 0.00 0.00 57.88 58.39 1s4f h LEU 189 Cb 1.32 0.14 -0.09 0.00 -0.73 0.00 0.00 40.66 41.30 1s4f h LEU 189 CO -0.47 -0.30 -0.13 -0.08 -0.62 0.00 0.00 178.44 176.84 1s4f h GLU 190 N -0.47 -0.00 -0.92 1.25 4.57 0.44 0.71 114.58 120.16 1s4f h GLU 190 Ca -0.03 0.00 0.14 0.00 -1.18 0.00 0.00 59.36 58.29 1s4f h GLU 190 Cb 0.39 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.90 1s4f h GLU 190 CO 0.03 -0.00 0.59 0.82 -1.18 0.00 0.00 179.01 179.27 1s4f h ILE 191 N -0.00 0.86 0.13 2.32 2.04 -0.85 -0.12 117.51 121.89 1s4f h ILE 191 Ca 0.24 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1s4f h ILE 191 Cb 0.37 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1s4f h ILE 191 CO -0.51 0.14 -0.06 0.15 0.00 0.00 0.00 178.15 177.86 1s4f h PHE 192 N 0.78 -0.17 -0.95 1.37 3.57 0.26 -3.11 116.94 118.69 1s4f h PHE 192 Ca 0.46 -0.00 0.17 0.00 3.53 0.00 0.00 57.97 62.13 1s4f h PHE 192 Cb 0.66 0.06 -0.17 0.00 2.79 0.00 0.00 35.95 39.28 1s4f h PHE 192 CO -0.00 0.16 -0.31 0.45 -2.23 0.00 0.00 178.31 176.38 1s4f h HIS 193 N -0.51 -0.80 -1.02 0.41 3.86 0.19 0.90 115.15 118.18 1s4f h HIS 193 Ca -0.02 0.09 0.25 0.00 -1.16 0.00 0.00 60.37 59.54 1s4f h HIS 193 Cb 0.40 0.49 -0.10 0.00 1.06 0.00 0.00 27.41 29.26 1s4f h HIS 193 CO 0.03 -0.41 0.64 1.79 0.86 0.00 0.00 177.93 180.84 1s4f h THR 194 N -0.01 0.55 0.00 2.45 1.35 -1.24 0.24 112.91 116.25 1s4f h THR 194 Ca 0.40 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 66.09 1s4f h THR 194 Cb 0.65 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 1s4f h THR 194 CO -0.97 0.09 -1.09 2.30 -0.25 0.00 0.00 175.52 175.60 1s4f n ILE 195 N -4.72 0.00 -1.95 6.82 -6.64 0.84 -4.94 119.36 108.76 1s4f n ILE 195 Ca 0.25 -0.05 -0.41 0.00 -1.77 0.00 0.00 62.75 60.77 1s4f n ILE 195 Cb 0.80 0.89 -0.02 0.00 -1.44 0.00 0.00 39.64 39.87 1s4f n ILE 195 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1s4f s ALA 196 N -3.05 3.59 -0.27 -1.28 0.00 0.28 -4.97 121.76 116.05 1s4f s ALA 196 Ca 0.06 1.41 -0.02 0.00 0.00 0.00 0.00 51.96 53.41 1s4f s ALA 196 Cb 0.16 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.75 1s4f s ALA 196 CO 0.87 -0.83 -0.02 -0.65 0.00 0.00 0.00 175.76 175.12 1s4f s GLN 197 N -1.34 2.69 0.61 0.00 -0.21 -1.26 -4.93 119.66 115.22 1s4f s GLN 197 Ca 0.55 -1.09 0.31 0.00 0.02 0.00 0.00 55.36 55.15 1s4f s GLN 197 Cb -0.43 -3.10 1.77 0.00 1.00 0.00 0.00 33.01 32.25 1s4f s GLN 197 CO 0.53 -0.49 2.12 -1.35 -2.12 0.00 0.00 175.29 173.97 1s4f h PRO 198 N 8.03 0.00 -5.95 2.91 0.11 -1.95 -3.32 132.00 131.84 1s4f h PRO 198 Ca -0.28 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.25 1s4f h PRO 198 Cb 1.09 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 1s4f h PRO 198 CO 0.56 0.00 -0.12 0.99 -0.21 0.00 0.00 178.00 179.22 1s4f s THR 199 N -4.50 5.03 0.00 -1.15 2.01 -1.26 -2.69 115.64 113.08 1s4f s THR 199 Ca -0.05 1.02 0.00 0.00 0.31 0.00 0.00 61.69 62.97 1s4f s THR 199 Cb 0.14 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.83 1s4f s THR 199 CO 0.49 0.44 0.00 0.18 -0.69 0.00 0.00 174.62 175.04 1s4f n LEU 200 N 2.73 0.00 -4.77 4.42 4.77 -1.26 -5.04 117.00 117.86 1s4f n LEU 200 Ca -0.09 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.48 1s4f n LEU 200 Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1s4f n LEU 200 CO 0.41 0.00 0.93 -0.75 -1.33 0.00 0.00 177.39 176.66 1s4f s LYS 201 N -0.88 4.40 0.00 3.23 2.20 -1.10 -2.61 119.74 124.98 1s4f s LYS 201 Ca 0.00 2.11 0.00 0.00 -0.36 0.00 0.00 55.97 57.72 1s4f s LYS 201 Cb 0.00 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.25 1s4f s LYS 201 CO 0.00 -0.11 0.00 0.72 -0.36 0.00 0.00 175.35 175.60 1s4f n HIS 202 N 0.84 0.00 0.81 4.03 8.25 0.81 -4.65 115.22 125.31 1s4f n HIS 202 Ca -0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 1s4f n HIS 202 Cb 0.43 -1.24 0.52 0.00 1.12 0.00 0.00 29.99 30.81 1s4f n HIS 202 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1s4f n THR 203 N -0.99 0.32 -2.14 1.59 -1.04 -1.07 -4.69 114.28 106.26 1s4f n THR 203 Ca 0.00 -0.08 -0.27 0.00 -2.04 0.00 0.00 64.05 61.67 1s4f n THR 203 Cb 0.24 -0.59 0.07 0.00 -1.82 0.00 0.00 70.33 68.23 1s4f n THR 203 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1s4f s TYR 204 N -3.05 2.94 0.00 -1.42 2.02 -1.22 -5.04 117.35 111.58 1s4f s TYR 204 Ca 0.12 0.52 0.00 0.00 -0.37 0.00 0.00 57.07 57.34 1s4f s TYR 204 Cb 0.16 -3.25 0.00 0.00 -0.40 0.00 0.00 41.96 38.47 1s4f s TYR 204 CO 0.53 -1.47 0.00 0.41 -1.57 0.00 0.00 175.55 173.45 1s4f n GLY 205 N -3.00 1.61 3.65 0.71 0.00 -1.25 -4.44 105.19 102.47 1s4f n GLY 205 Ca 0.08 -0.98 -0.50 0.00 0.00 0.00 0.00 46.02 44.62 1s4f n GLY 205 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1s4f n GLU 206 N -0.67 1.81 -2.30 1.61 2.13 -1.26 -4.74 120.64 117.22 1s4f n GLU 206 Ca 0.00 0.64 -0.22 0.00 0.66 0.00 0.00 57.16 58.24 1s4f n GLU 206 Cb 0.00 -2.56 0.12 0.00 0.27 0.00 0.00 31.44 29.28 1s4f n GLU 206 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1s4f n VAL 207 N 5.54 0.00 -4.72 6.31 0.24 -1.20 -4.95 118.33 119.54 1s4f n VAL 207 Ca 0.27 -1.36 -0.33 0.00 -2.04 0.00 0.00 64.34 60.88 1s4f n VAL 207 Cb 0.26 -1.03 -0.12 0.00 -1.47 0.00 0.00 33.84 31.48 1s4f n VAL 207 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1s4f s THR 208 N -2.98 3.33 -0.86 3.34 -4.23 -1.26 -4.71 115.64 108.26 1s4f s THR 208 Ca 0.63 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 60.43 1s4f s THR 208 Cb -0.03 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.45 1s4f s THR 208 CO 0.42 0.54 0.00 -2.67 -0.54 0.00 0.00 174.62 172.37 1s4f n TRP 209 N 2.08 0.00 0.02 3.99 2.14 -1.26 -1.97 117.44 122.44 1s4f n TRP 209 Ca -0.17 0.00 -0.05 0.00 2.07 0.00 0.00 57.50 59.35 1s4f n TRP 209 Cb 0.52 0.00 0.16 0.00 -0.81 0.00 0.00 31.31 31.19 1s4f n TRP 209 CO 0.00 0.00 0.00 0.93 2.07 0.00 0.00 177.69 180.69 1s4f h GLU 210 N 0.43 0.48 0.04 -2.67 3.07 -1.98 -2.55 114.58 111.40 1s4f h GLU 210 Ca 0.00 -0.21 -0.33 0.00 -0.50 0.00 0.00 59.36 58.31 1s4f h GLU 210 Cb 0.00 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 1s4f h GLU 210 CO 0.00 0.76 -1.87 0.94 -1.40 0.00 0.00 179.01 177.44 1s4f n GLN 211 N -4.06 0.64 0.32 2.33 7.27 -0.83 -3.22 117.38 119.83 1s4f n GLN 211 Ca -0.01 0.37 0.12 0.00 0.07 0.00 0.00 57.00 57.55 1s4f n GLN 211 Cb 0.47 -1.66 0.64 0.00 2.41 0.00 0.00 30.24 32.09 1s4f n GLN 211 CO 0.00 0.00 0.00 1.25 0.07 0.00 0.00 177.06 178.38 1s4f h LEU 212 N -0.55 0.00 0.00 1.69 5.85 -1.63 2.79 115.31 123.47 1s4f h LEU 212 Ca -0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1s4f h LEU 212 Cb 1.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.69 1s4f h LEU 212 CO -0.14 0.00 -1.05 1.21 -0.34 0.00 0.00 178.44 178.12 1s4f n GLU 213 N -2.83 1.08 -0.89 1.25 2.13 -0.96 -4.69 120.64 115.73 1s4f n GLU 213 Ca -0.01 -0.04 -0.14 0.00 0.66 0.00 0.00 57.16 57.63 1s4f n GLU 213 Cb 0.53 -1.35 -0.04 0.00 0.27 0.00 0.00 31.44 30.85 1s4f n GLU 213 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1s4f n ALA 214 N -1.58 0.32 -2.13 4.31 0.00 0.93 -2.18 120.51 120.18 1s4f n ALA 214 Ca 0.02 -1.32 -0.03 0.00 0.00 0.00 0.00 53.44 52.10 1s4f n ALA 214 Cb 0.32 -1.39 0.02 0.00 0.00 0.00 0.00 19.45 18.39 1s4f n ALA 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s4f n GLY 215 N 4.24 0.36 0.00 0.00 0.00 -1.26 -5.04 105.19 103.49 1s4f n GLY 215 Ca 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1s4f n GLY 215 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1s4f n VAL 216 N -1.69 0.00 -3.50 1.61 0.24 -0.93 -4.79 118.33 109.27 1s4f n VAL 216 Ca -0.04 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.17 1s4f n VAL 216 Cb 0.53 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.81 1s4f n VAL 216 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1s4f s ASN 217 N -1.00 -0.07 -0.60 -1.34 2.47 -1.26 -4.96 114.94 108.19 1s4f s ASN 217 Ca 0.00 0.64 -0.00 0.00 0.42 0.00 0.00 52.86 53.92 1s4f s ASN 217 Cb 0.00 1.27 0.51 0.00 -1.45 0.00 0.00 41.25 41.58 1s4f s ASN 217 CO 0.00 -0.26 2.00 0.54 -3.72 0.00 0.00 177.10 175.66 1s4f n ARG 218 N 5.38 2.54 -0.17 0.43 1.74 -1.25 -2.79 116.66 122.54 1s4f n ARG 218 Ca -0.06 -3.17 0.02 0.00 -0.77 0.00 0.00 57.85 53.88 1s4f n ARG 218 Cb 0.50 -2.24 0.03 0.00 -1.02 0.00 0.00 32.46 29.73 1s4f n ARG 218 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1s4f n LYS 219 N -0.97 0.92 -2.88 5.56 4.76 -1.26 -4.83 118.16 119.46 1s4f n LYS 219 Ca 0.61 -1.35 -0.42 0.00 -2.87 0.00 0.00 58.31 54.29 1s4f n LYS 219 Cb 0.97 -0.84 -0.04 0.00 -1.84 0.00 0.00 35.03 33.28 1s4f n LYS 219 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1s4f s GLY 220 N -1.18 1.93 0.70 0.72 0.00 -1.12 -5.01 107.32 103.34 1s4f s GLY 220 Ca 0.08 -0.04 -0.10 0.00 0.00 0.00 0.00 44.72 44.66 1s4f s GLY 220 CO 0.01 1.75 -0.49 0.00 0.00 0.00 0.00 173.10 174.37 1s4f n ALA 221 N 5.63 1.09 -0.08 3.20 0.00 -1.26 -2.92 120.51 126.18 1s4f n ALA 221 Ca 0.05 -0.52 -0.16 0.00 0.00 0.00 0.00 53.44 52.81 1s4f n ALA 221 Cb 0.48 -0.32 -0.05 0.00 0.00 0.00 0.00 19.45 19.56 1s4f n ALA 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s4f n ALA 222 N -3.25 1.89 0.00 0.00 0.00 -1.26 -3.99 120.51 113.89 1s4f n ALA 222 Ca -0.00 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.80 1s4f n ALA 222 Cb 0.27 0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1s4f n ALA 222 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s4f n GLY 223 N 2.01 1.34 0.00 0.00 0.00 -1.26 -2.21 105.19 105.07 1s4f n GLY 223 Ca -0.29 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1s4f n GLY 223 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1s4f n PHE 224 N 1.19 0.00 0.54 1.61 7.35 -1.26 0.25 117.46 127.14 1s4f n PHE 224 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1s4f n PHE 224 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1s4f n PHE 224 CO 0.00 0.00 0.00 1.47 -0.76 0.00 0.00 176.76 177.47 1s4f n LEU 225 N 0.00 1.18 -4.87 -2.13 -0.00 -1.26 -4.78 117.00 105.15 1s4f n LEU 225 Ca 0.00 -0.59 -0.33 0.00 -0.00 0.00 0.00 56.01 55.09 1s4f n LEU 225 Cb 0.00 -0.27 -0.05 0.00 -0.00 0.00 0.00 43.42 43.10 1s4f n LEU 225 CO 0.00 0.22 0.18 -0.70 -0.00 0.00 0.00 177.39 177.09 1s4f s GLU 226 N -0.12 3.80 -0.01 1.47 2.56 0.69 -5.04 118.70 122.05 1s4f s GLU 226 Ca 0.00 0.25 -0.00 0.00 0.00 0.00 0.00 54.97 55.22 1s4f s GLU 226 Cb 0.00 -2.75 -0.00 0.00 2.00 0.00 0.00 34.13 33.38 1s4f s GLU 226 CO 0.00 0.38 -0.00 0.87 -0.56 0.00 0.00 175.26 175.95 1s4f h LYS 227 N 2.84 0.00 -5.61 4.30 6.56 -1.86 -3.44 116.57 119.37 1s4f h LYS 227 Ca -0.47 0.00 -0.62 0.00 -1.06 0.00 0.00 60.65 58.50 1s4f h LYS 227 Cb 1.17 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 32.73 1s4f h LYS 227 CO 0.69 0.00 -0.48 0.15 -2.06 0.00 0.00 179.45 177.75 1s4f s LYS 228 N -1.09 2.18 0.43 3.15 1.02 -1.26 -5.00 119.74 119.17 1s4f s LYS 228 Ca -0.00 -2.13 -0.07 0.00 0.02 0.00 0.00 55.97 53.78 1s4f s LYS 228 Cb 0.00 -1.79 -0.05 0.00 -0.52 0.00 0.00 37.83 35.48 1s4f s LYS 228 CO 0.00 -0.30 0.76 -0.80 -0.92 0.00 0.00 175.35 174.09 1s4f s ASN 229 N -3.94 6.39 0.26 2.83 0.02 -1.26 -4.39 114.94 114.85 1s4f s ASN 229 Ca 0.25 1.00 -0.30 0.00 -1.02 0.00 0.00 52.86 52.79 1s4f s ASN 229 Cb 0.03 -2.27 -0.11 0.00 0.02 0.00 0.00 41.25 38.91 1s4f s ASN 229 CO 0.14 -0.47 1.57 -0.63 0.02 0.00 0.00 177.10 177.74 1s4f s ILE 230 N -2.53 2.23 0.00 0.60 1.01 -1.15 0.35 121.20 121.72 1s4f s ILE 230 Ca 0.49 0.19 0.00 0.00 0.00 0.00 0.00 60.65 61.33 1s4f s ILE 230 Cb -0.10 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.25 1s4f s ILE 230 CO 0.38 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.95 1s4f n GLY 231 N 2.51 0.25 0.00 6.18 0.00 -1.26 -3.83 105.19 109.04 1s4f n GLY 231 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1s4f n GLY 231 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1s4f n GLU 232 N -2.00 3.75 0.00 1.61 1.02 0.15 -3.93 120.64 121.24 1s4f n GLU 232 Ca 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.25 1s4f n GLU 232 Cb 0.00 -0.64 0.04 0.00 -0.02 0.00 0.00 31.44 30.82 1s4f n GLU 232 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1s4f n VAL 233 N -1.04 0.00 0.24 2.62 0.31 -0.08 -3.58 118.33 116.80 1s4f n VAL 233 Ca 0.00 -0.38 0.13 0.00 -0.01 0.00 0.00 64.34 64.08 1s4f n VAL 233 Cb 0.00 1.34 0.47 0.00 -0.91 0.00 0.00 33.84 34.74 1s4f n VAL 233 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1s4f h LEU 234 N 3.23 0.00 0.00 7.52 5.85 -1.79 -3.30 115.31 126.82 1s4f h LEU 234 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1s4f h LEU 234 Cb 0.80 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1s4f h LEU 234 CO 0.00 0.11 0.00 0.47 -0.34 0.00 0.00 178.44 178.68 1s4f n ASP 235 N -3.20 0.00 -4.80 1.25 8.00 -1.23 -4.95 116.55 111.61 1s4f n ASP 235 Ca 0.01 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.18 1s4f n ASP 235 Cb 0.42 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.45 1s4f n ASP 235 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1s4f s SER 236 N -1.00 5.80 0.00 -2.24 1.04 -1.26 -4.42 113.70 111.62 1s4f s SER 236 Ca 0.00 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.62 1s4f s SER 236 Cb 0.00 -1.70 0.00 0.00 0.10 0.00 0.00 66.02 64.42 1s4f s SER 236 CO 0.00 0.28 0.00 1.21 0.98 0.00 0.00 173.24 175.71 1s4f n GLU 237 N 1.23 0.00 0.03 4.02 4.07 -1.26 -4.36 120.64 124.37 1s4f n GLU 237 Ca -0.13 0.00 0.18 0.00 -0.06 0.00 0.00 57.16 57.15 1s4f n GLU 237 Cb 0.53 0.00 0.40 0.00 -0.06 0.00 0.00 31.44 32.31 1s4f n GLU 237 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1s4f h LYS 238 N 0.00 0.00 0.04 5.31 1.57 -1.77 0.65 116.57 122.37 1s4f h LYS 238 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1s4f h LYS 238 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1s4f h LYS 238 CO 0.00 0.00 -0.02 0.45 -0.57 0.00 0.00 179.45 179.31 1s4f h HIS 239 N 0.00 -0.05 -0.26 -1.35 3.86 -1.93 -3.31 115.15 112.11 1s4f h HIS 239 Ca 0.27 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.53 1s4f h HIS 239 Cb 2.21 0.02 -0.08 0.00 1.06 0.00 0.00 27.41 30.62 1s4f h HIS 239 CO 0.00 0.59 -0.48 -0.07 0.86 0.00 0.00 177.93 178.83 1s4f h LEU 240 N -0.82 -1.56 -0.86 2.43 3.38 -0.11 -2.39 115.31 115.38 1s4f h LEU 240 Ca -0.01 0.21 0.09 0.00 0.09 0.00 0.00 57.88 58.26 1s4f h LEU 240 Cb 0.67 0.64 -0.11 0.00 0.09 0.00 0.00 40.66 41.95 1s4f h LEU 240 CO 0.01 -0.42 -0.46 0.52 0.09 0.00 0.00 178.44 178.17 1s4f n VAL 241 N -5.42 -0.55 -0.39 1.22 0.31 -1.10 0.60 118.33 113.00 1s4f n VAL 241 Ca -0.04 2.07 0.33 0.00 -0.01 0.00 0.00 64.34 66.70 1s4f n VAL 241 Cb 0.36 -2.61 0.60 0.00 -0.91 0.00 0.00 33.84 31.29 1s4f n VAL 241 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1s4f h GLU 242 N 0.00 0.11 -0.01 5.55 5.08 -1.51 2.25 114.58 126.05 1s4f h GLU 242 Ca 0.18 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.41 1s4f h GLU 242 Cb 0.40 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1s4f h GLU 242 CO -0.82 0.08 -0.56 0.37 -1.00 0.00 0.00 179.01 177.07 1s4f h GLN 243 N 0.12 0.04 0.41 2.33 5.75 0.14 0.21 115.11 124.10 1s4f h GLN 243 Ca 0.81 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 59.26 1s4f h GLN 243 Cb 2.31 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.87 1s4f h GLN 243 CO -0.53 0.59 -0.20 1.25 -2.65 0.00 0.00 178.83 177.29 1s4f h LEU 244 N 0.03 -0.46 -0.99 -2.39 6.46 0.39 0.14 115.31 118.48 1s4f h LEU 244 Ca -0.00 -0.12 0.19 0.00 -0.12 0.00 0.00 57.88 57.83 1s4f h LEU 244 Cb 1.00 0.12 -0.11 0.00 -0.73 0.00 0.00 40.66 40.95 1s4f h LEU 244 CO 0.08 -0.08 0.59 0.58 -0.62 0.00 0.00 178.44 178.99 1s4f h VAL 245 N -0.93 0.69 0.00 1.05 2.07 -0.86 0.51 116.25 118.78 1s4f h VAL 245 Ca -0.06 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1s4f h VAL 245 Cb 0.56 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1s4f h VAL 245 CO 0.09 0.13 0.00 -1.14 0.02 0.00 0.00 177.57 176.68 1s4f n ARG 246 N -4.79 0.00 0.24 1.57 0.63 0.71 -0.58 116.66 114.44 1s4f n ARG 246 Ca 0.23 0.47 0.17 0.00 -0.92 0.00 0.00 57.85 57.80 1s4f n ARG 246 Cb 0.58 -1.43 0.79 0.00 0.45 0.00 0.00 32.46 32.85 1s4f n ARG 246 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1s4f h ASP 247 N 0.00 0.00 0.24 6.15 3.45 -0.33 0.38 116.42 126.31 1s4f h ASP 247 Ca 0.00 0.00 -0.31 0.00 0.43 0.00 0.00 57.03 57.15 1s4f h ASP 247 Cb 0.00 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 38.80 1s4f h ASP 247 CO 0.00 0.00 -1.32 0.25 -1.57 0.00 0.00 179.24 176.60 1s4f h LEU 248 N 0.00 0.81 -0.83 1.55 5.85 0.16 0.24 115.31 123.08 1s4f h LEU 248 Ca 0.08 -0.79 -0.12 0.00 0.84 0.00 0.00 57.88 57.88 1s4f h LEU 248 Cb 0.82 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1s4f h LEU 248 CO -0.00 1.60 -0.57 0.50 -0.34 0.00 0.00 178.44 179.63 1s4f h LYS 249 N 0.21 0.04 -0.12 1.25 3.64 0.21 -2.95 116.57 118.85 1s4f h LYS 249 Ca -0.20 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 58.96 1s4f h LYS 249 Cb 2.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1s4f h LYS 249 CO 0.25 0.60 -0.69 0.00 -2.27 0.00 0.00 179.45 177.34 1s4f h ALA 250 N 1.39 0.56 0.00 5.00 0.00 -0.87 -3.41 119.26 121.94 1s4f h ALA 250 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1s4f h ALA 250 Cb 1.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1s4f h ALA 250 CO 0.08 0.73 0.00 0.41 0.00 0.00 0.00 179.25 180.46 1s4f n GLY 251 N 0.51 1.60 3.90 0.00 0.00 -0.12 -4.98 105.19 106.09 1s4f n GLY 251 Ca -0.05 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 1s4f n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s4f s ARG 252 N -1.01 2.46 0.19 1.61 0.52 -0.12 -5.02 118.95 117.59 1s4f s ARG 252 Ca 0.00 0.17 -0.30 0.00 -0.52 0.00 0.00 55.73 55.08 1s4f s ARG 252 Cb 0.00 -2.05 -0.08 0.00 0.52 0.00 0.00 34.95 33.33 1s4f s ARG 252 CO 0.00 -1.21 1.21 0.21 0.02 0.00 0.00 175.30 175.53 1s4f s LYS 253 N -5.37 4.48 -0.04 3.54 2.47 -1.26 -4.84 119.74 118.73 1s4f s LYS 253 Ca 0.59 1.91 0.02 0.00 -1.56 0.00 0.00 55.97 56.92 1s4f s LYS 253 Cb -0.11 -3.23 0.01 0.00 -1.46 0.00 0.00 37.83 33.05 1s4f s LYS 253 CO 0.49 -0.10 -0.07 -1.50 0.16 0.00 0.00 175.35 174.33 1s4f s ILE 254 N -0.09 0.65 -0.91 5.43 1.10 -1.26 -5.08 121.20 121.04 1s4f s ILE 254 Ca 0.53 -0.24 -0.24 0.00 -0.51 0.00 0.00 60.65 60.19 1s4f s ILE 254 Cb -0.33 -0.62 -0.04 0.00 0.15 0.00 0.00 42.46 41.61 1s4f s ILE 254 CO 0.37 0.23 1.92 -0.54 -2.11 0.00 0.00 174.94 174.82 1s4f s LYS 255 N 0.57 2.61 0.02 3.50 1.02 -1.26 -4.93 119.74 121.26 1s4f s LYS 255 Ca -0.08 -0.34 -0.11 0.00 0.02 0.00 0.00 55.97 55.46 1s4f s LYS 255 Cb -0.12 -5.08 -0.05 0.00 -0.52 0.00 0.00 37.83 32.06 1s4f s LYS 255 CO 0.01 -3.33 0.35 -0.47 -0.92 0.00 0.00 175.35 170.99 1s4f s TYR 256 N 9.84 3.63 0.01 3.18 5.04 -1.26 -5.07 117.35 132.72 1s4f s TYR 256 Ca 0.69 0.79 -0.29 0.00 -2.44 0.00 0.00 57.07 55.82 1s4f s TYR 256 Cb -0.06 -2.15 0.10 0.00 0.35 0.00 0.00 41.96 40.20 1s4f s TYR 256 CO -0.01 0.60 0.96 1.52 -1.34 0.00 0.00 175.55 177.28 1s4f s TYR 257 N -1.23 -0.26 0.14 4.97 -0.85 -1.26 -4.57 117.35 114.28 1s4f s TYR 257 Ca 0.27 0.10 0.07 0.00 -0.52 0.00 0.00 57.07 56.99 1s4f s TYR 257 Cb -0.15 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 1s4f s TYR 257 CO 0.15 -0.55 -0.15 -1.21 -1.52 0.00 0.00 175.55 172.26 1s4f s GLU 258 N -3.04 1.10 -0.21 -3.49 2.02 -0.46 -4.05 118.70 110.57 1s4f s GLU 258 Ca 0.07 -1.30 -0.09 0.00 0.02 0.00 0.00 54.97 53.67 1s4f s GLU 258 Cb -0.01 -1.02 -0.05 0.00 0.10 0.00 0.00 34.13 33.15 1s4f s GLU 258 CO -0.06 0.20 0.12 0.99 0.02 0.00 0.00 175.26 176.53 1s4f s THR 259 N -2.15 5.15 -0.22 3.63 2.01 -0.42 0.31 115.64 123.96 1s4f s THR 259 Ca 0.11 0.10 -0.06 0.00 0.31 0.00 0.00 61.69 62.15 1s4f s THR 259 Cb -0.05 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 1s4f s THR 259 CO 0.04 0.41 0.03 0.00 -0.69 0.00 0.00 174.62 174.41 1s4f s ALA 260 N 0.68 3.10 0.19 7.40 0.00 0.49 -1.39 121.76 132.23 1s4f s ALA 260 Ca 0.06 -1.03 -0.09 0.00 0.00 0.00 0.00 51.96 50.91 1s4f s ALA 260 Cb -0.12 -1.89 -0.01 0.00 0.00 0.00 0.00 23.12 21.09 1s4f s ALA 260 CO 0.01 -0.26 0.31 0.96 0.00 0.00 0.00 175.76 176.78 1s4f s ILE 261 N 1.19 0.04 0.12 0.00 -4.36 -1.16 -1.91 121.20 115.11 1s4f s ILE 261 Ca 0.04 -1.49 -0.14 0.00 -0.26 0.00 0.00 60.65 58.79 1s4f s ILE 261 Cb -0.14 -2.04 -0.07 0.00 1.25 0.00 0.00 42.46 41.46 1s4f s ILE 261 CO 0.02 -0.18 0.52 -2.84 0.24 0.00 0.00 174.94 172.71 1s4f s PRO 262 N -4.01 3.98 -0.37 0.37 0.02 -1.26 -1.06 135.00 132.66 1s4f s PRO 262 Ca 0.22 0.48 -0.26 0.00 0.02 0.00 0.00 61.00 61.46 1s4f s PRO 262 Cb 0.03 -3.00 0.01 0.00 0.02 0.00 0.00 34.50 31.56 1s4f s PRO 262 CO 0.04 0.53 0.93 0.21 -0.33 0.00 0.00 177.00 178.38 1s4f s LYS 263 N -1.77 3.84 -0.61 5.54 2.20 -1.23 -4.92 119.74 122.80 1s4f s LYS 263 Ca 0.35 0.58 -0.27 0.00 -0.36 0.00 0.00 55.97 56.27 1s4f s LYS 263 Cb -0.16 -3.80 0.01 0.00 -1.51 0.00 0.00 37.83 32.37 1s4f s LYS 263 CO 0.19 -0.95 1.52 1.21 -0.36 0.00 0.00 175.35 176.96 1s4f s ASN 264 N 1.88 5.89 0.26 1.43 2.47 -1.26 -4.70 114.94 120.91 1s4f s ASN 264 Ca 0.38 0.17 -0.12 0.00 0.42 0.00 0.00 52.86 53.71 1s4f s ASN 264 Cb -0.12 -2.54 -0.00 0.00 -1.45 0.00 0.00 41.25 37.14 1s4f s ASN 264 CO 0.19 -1.92 0.50 -1.83 -3.72 0.00 0.00 177.10 170.31 1s4f s GLU 265 N 5.98 1.61 -0.26 0.43 -1.05 -1.26 -5.02 118.70 119.14 1s4f s GLU 265 Ca 0.53 -1.30 -0.10 0.00 -0.15 0.00 0.00 54.97 53.96 1s4f s GLU 265 Cb -0.11 0.48 -0.04 0.00 -0.44 0.00 0.00 34.13 34.01 1s4f s GLU 265 CO 0.22 -0.68 0.15 0.21 0.95 0.00 0.00 175.26 176.11 1s4f s LYS 266 N -3.87 3.91 0.51 -4.83 2.20 -1.26 -0.88 119.74 115.52 1s4f s LYS 266 Ca 0.23 -0.35 0.09 0.00 -0.36 0.00 0.00 55.97 55.58 1s4f s LYS 266 Cb -0.01 -3.54 0.05 0.00 -1.51 0.00 0.00 37.83 32.82 1s4f s LYS 266 CO 0.10 -0.12 0.68 1.03 -0.36 0.00 0.00 175.35 176.69 1s4f s ARG 267 N 1.54 2.52 -0.67 4.03 0.52 0.11 -4.78 118.95 122.23 1s4f s ARG 267 Ca 0.07 -1.49 -0.08 0.00 -0.52 0.00 0.00 55.73 53.71 1s4f s ARG 267 Cb -0.15 -2.67 0.17 0.00 0.52 0.00 0.00 34.95 32.82 1s4f s ARG 267 CO 0.08 -0.60 0.53 0.34 0.02 0.00 0.00 175.30 175.67 1s4f s ASP 268 N -4.52 5.83 -0.06 0.23 3.68 -1.26 -1.81 116.67 118.75 1s4f s ASP 268 Ca 0.58 -2.64 0.01 0.00 2.13 0.00 0.00 52.55 52.64 1s4f s ASP 268 Cb -0.07 -2.00 0.12 0.00 -1.45 0.00 0.00 42.92 39.52 1s4f s ASP 268 CO 0.36 -0.49 0.98 1.33 0.13 0.00 0.00 175.17 177.48 1s4f n VAL 269 N 3.89 1.01 -0.14 1.11 0.24 -1.26 -4.32 118.33 118.87 1s4f n VAL 269 Ca 0.07 -0.28 -0.04 0.00 -2.04 0.00 0.00 64.34 62.06 1s4f n VAL 269 Cb 0.41 -0.74 0.04 0.00 -1.47 0.00 0.00 33.84 32.08 1s4f n VAL 269 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1s4f h SER 270 N 0.35 -0.12 0.05 -1.34 0.87 -1.91 0.69 113.55 112.13 1s4f h SER 270 Ca 0.06 0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1s4f h SER 270 Cb 1.09 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1s4f h SER 270 CO 0.14 -0.03 -0.02 0.44 -0.53 0.00 0.00 176.83 176.83 1s4f h ASP 271 N 0.14 -0.05 0.20 6.23 3.32 -2.00 -3.10 116.42 121.17 1s4f h ASP 271 Ca 0.22 -0.54 0.01 0.00 0.02 0.00 0.00 57.03 56.74 1s4f h ASP 271 Cb 0.31 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 1s4f h ASP 271 CO -0.34 0.54 -0.50 0.44 -1.72 0.00 0.00 179.24 177.66 1s4f h ASP 272 N -0.67 -1.47 0.06 6.45 3.32 -1.78 -1.93 116.42 120.40 1s4f h ASP 272 Ca -0.01 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1s4f h ASP 272 Cb 0.59 0.53 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1s4f h ASP 272 CO 0.01 -0.57 0.00 0.79 -1.72 0.00 0.00 179.24 177.75 1s4f n TRP 273 N -5.50 0.00 1.10 4.55 7.02 0.24 -2.19 117.44 122.66 1s4f n TRP 273 Ca -0.09 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.51 1s4f n TRP 273 Cb 0.42 -0.31 0.17 0.00 -2.42 0.00 0.00 31.31 29.17 1s4f n TRP 273 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1s4f n GLN 274 N -1.31 1.98 -0.06 -0.99 6.02 -0.72 -3.99 117.38 118.31 1s4f n GLN 274 Ca 0.01 -1.56 -0.12 0.00 -0.01 0.00 0.00 57.00 55.33 1s4f n GLN 274 Cb 0.03 -1.47 -0.15 0.00 1.02 0.00 0.00 30.24 29.67 1s4f n GLN 274 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1s4f n ALA 275 N 0.85 1.42 0.00 -1.58 0.00 -0.93 -4.95 120.51 115.32 1s4f n ALA 275 Ca 0.14 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.56 1s4f n ALA 275 Cb 0.53 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.51 1s4f n ALA 275 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s4f n GLY 276 N 1.77 0.97 3.57 0.00 0.00 -1.25 -5.06 105.19 105.20 1s4f n GLY 276 Ca -0.29 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.46 1s4f n GLY 276 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s4f s ASP 277 N -0.54 5.07 -0.22 1.61 1.01 -1.24 -4.82 116.67 117.53 1s4f s ASP 277 Ca 0.00 -1.07 -0.02 0.00 0.71 0.00 0.00 52.55 52.17 1s4f s ASP 277 Cb 0.00 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 1s4f s ASP 277 CO 0.00 -2.91 1.47 0.18 0.21 0.00 0.00 175.17 174.13 1s4f n LEU 278 N 14.23 1.98 -4.66 1.23 4.77 -1.26 -3.81 117.00 129.48 1s4f n LEU 278 Ca 0.42 -1.60 -0.49 0.00 -0.03 0.00 0.00 56.01 54.31 1s4f n LEU 278 Cb 0.47 -0.60 -0.05 0.00 -2.33 0.00 0.00 43.42 40.91 1s4f n LEU 278 CO 0.63 -0.08 1.24 0.55 -1.33 0.00 0.00 177.39 178.40 1s4f n VAL 279 N 3.69 0.20 0.00 4.08 3.14 -1.26 -4.99 118.33 123.20 1s4f n VAL 279 Ca 0.17 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.52 1s4f n VAL 279 Cb 0.17 -1.48 0.00 0.00 -1.06 0.00 0.00 33.84 31.47 1s4f n VAL 279 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 1s4f n VAL 280 N 3.89 0.00 -3.86 1.55 0.31 -1.26 -4.96 118.33 114.00 1s4f n VAL 280 Ca 0.20 0.09 -0.26 0.00 -0.01 0.00 0.00 64.34 64.35 1s4f n VAL 280 Cb 0.26 -0.25 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1s4f n VAL 280 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1s4f s GLU 281 N -0.01 3.46 0.51 5.55 2.02 -1.26 -4.78 118.70 124.19 1s4f s GLU 281 Ca 0.00 -0.52 0.02 0.00 0.02 0.00 0.00 54.97 54.49 1s4f s GLU 281 Cb 0.00 -2.92 -0.01 0.00 0.10 0.00 0.00 34.13 31.29 1s4f s GLU 281 CO 0.00 0.48 0.04 0.21 0.02 0.00 0.00 175.26 176.02 1s4f s LYS 282 N -3.27 2.19 0.22 1.61 2.20 -1.25 -4.71 119.74 116.72 1s4f s LYS 282 Ca 0.36 -2.35 -0.30 0.00 -0.36 0.00 0.00 55.97 53.32 1s4f s LYS 282 Cb -0.11 -1.60 -0.08 0.00 -1.51 0.00 0.00 37.83 34.53 1s4f s LYS 282 CO 0.29 -0.37 0.94 1.03 -0.36 0.00 0.00 175.35 176.88 1s4f s ARG 283 N -3.91 4.83 -0.00 4.03 3.00 -1.26 0.42 118.95 126.06 1s4f s ARG 283 Ca 0.10 1.49 0.17 0.00 0.00 0.00 0.00 55.73 57.49 1s4f s ARG 283 Cb 0.02 -3.29 -0.19 0.00 0.00 0.00 0.00 34.95 31.48 1s4f s ARG 283 CO 0.06 0.47 0.66 -0.35 0.00 0.00 0.00 175.30 176.14 1s4f n PRO 284 N 1.69 1.33 -0.42 3.54 -0.04 -1.26 -4.88 135.00 134.95 1s4f n PRO 284 Ca -0.01 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1s4f n PRO 284 Cb 0.47 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 1s4f n PRO 284 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1s4f n ARG 285 N -1.50 0.00 0.00 0.54 3.00 -1.26 -3.56 116.66 113.88 1s4f n ARG 285 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.86 1s4f n ARG 285 Cb 0.29 -0.14 0.00 0.00 0.00 0.00 0.00 32.46 32.61 1s4f n ARG 285 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1s4f n VAL 286 N 0.61 0.00 -2.82 1.55 0.24 -1.26 -4.63 118.33 112.03 1s4f n VAL 286 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 1s4f n VAL 286 Cb 0.00 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.34 1s4f n VAL 286 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1s4f s ILE 287 N 0.00 4.32 -0.22 1.34 1.01 -0.23 -4.75 121.20 122.68 1s4f s ILE 287 Ca 0.00 -0.62 -0.18 0.00 0.00 0.00 0.00 60.65 59.85 1s4f s ILE 287 Cb 0.00 -4.77 -0.03 0.00 0.01 0.00 0.00 42.46 37.67 1s4f s ILE 287 CO 0.00 -1.56 0.50 -1.10 0.00 0.00 0.00 174.94 172.79 1s4f s GLN 288 N 3.98 4.15 0.00 2.79 -0.21 -1.26 -3.01 119.66 126.10 1s4f s GLN 288 Ca 0.28 0.36 0.01 0.00 0.02 0.00 0.00 55.36 56.03 1s4f s GLN 288 Cb -0.11 -3.59 -0.01 0.00 1.00 0.00 0.00 33.01 30.30 1s4f s GLN 288 CO 0.04 -0.19 -0.04 1.52 -2.12 0.00 0.00 175.29 174.50 1s4f s TYR 289 N 1.79 0.35 1.13 0.91 -0.85 -0.49 -0.13 117.35 120.07 1s4f s TYR 289 Ca 0.23 -0.11 -0.16 0.00 -0.52 0.00 0.00 57.07 56.51 1s4f s TYR 289 Cb -0.15 -0.23 0.25 0.00 0.38 0.00 0.00 41.96 42.21 1s4f s TYR 289 CO 0.09 -0.02 1.08 -2.14 -1.52 0.00 0.00 175.55 173.04 1s4f s PRO 290 N -0.25 -0.65 1.01 -3.49 0.02 -1.26 -1.30 135.00 129.08 1s4f s PRO 290 Ca -0.00 0.30 -0.14 0.00 0.02 0.00 0.00 61.00 61.18 1s4f s PRO 290 Cb -0.02 -1.63 0.08 0.00 0.02 0.00 0.00 34.50 32.95 1s4f s PRO 290 CO -0.00 -3.41 0.37 0.39 -0.33 0.00 0.00 177.00 174.02 1s4f n GLU 291 N -4.61 -0.84 0.09 5.54 1.02 -1.26 -4.77 120.64 115.80 1s4f n GLU 291 Ca 0.08 -0.21 -0.14 0.00 -0.02 0.00 0.00 57.16 56.87 1s4f n GLU 291 Cb 0.58 -1.87 -0.14 0.00 -0.02 0.00 0.00 31.44 30.00 1s4f n GLU 291 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s4f h ALA 292 N -1.81 0.18 0.02 0.62 0.00 -1.67 -1.35 119.26 115.25 1s4f h ALA 292 Ca -0.48 -0.93 -0.00 0.00 0.00 0.00 0.00 54.91 53.50 1s4f h ALA 292 Cb 1.31 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1s4f h ALA 292 CO 0.37 1.06 -0.01 -0.22 0.00 0.00 0.00 179.25 180.45 1s4f h LYS 293 N 0.06 -0.03 -0.43 0.00 3.64 -1.89 -2.45 116.57 115.47 1s4f h LYS 293 Ca -0.12 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.23 1s4f h LYS 293 Cb 1.94 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.74 1s4f h LYS 293 CO 0.18 0.31 0.14 1.15 -2.27 0.00 0.00 179.45 178.96 1s4f h THR 294 N -0.38 1.18 0.00 1.00 2.02 -1.93 -2.71 112.91 112.09 1s4f h THR 294 Ca -0.00 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1s4f h THR 294 Cb 0.36 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1s4f h THR 294 CO 0.01 0.22 0.00 0.54 0.37 0.00 0.00 175.52 176.66 1s4f n ARG 295 N -4.34 0.00 -0.53 6.66 1.74 -0.51 -1.51 116.66 118.17 1s4f n ARG 295 Ca 0.03 0.24 0.43 0.00 -0.77 0.00 0.00 57.85 57.77 1s4f n ARG 295 Cb 0.17 -1.21 0.69 0.00 -1.02 0.00 0.00 32.46 31.10 1s4f n ARG 295 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1s4f n LEU 296 N -1.17 0.14 -0.05 0.55 7.94 -0.94 0.15 117.00 123.62 1s4f n LEU 296 Ca 0.00 1.21 -0.16 0.00 -1.11 0.00 0.00 56.01 55.95 1s4f n LEU 296 Cb 0.00 -0.60 -0.06 0.00 0.53 0.00 0.00 43.42 43.29 1s4f n LEU 296 CO 0.00 -1.29 0.34 0.00 -1.11 0.00 0.00 177.39 175.34 1s4f h ALA 297 N 1.34 0.36 -0.24 1.96 0.00 -1.36 -2.33 119.26 119.00 1s4f h ALA 297 Ca 0.86 -0.56 -0.16 0.00 0.00 0.00 0.00 54.91 55.06 1s4f h ALA 297 Cb 3.02 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 20.76 1s4f h ALA 297 CO -0.31 0.66 -0.51 0.82 0.00 0.00 0.00 179.25 179.91 1s4f h ILE 298 N 0.57 1.30 0.00 0.00 2.04 0.24 -2.77 117.51 118.89 1s4f h ILE 298 Ca -0.02 -1.73 0.00 0.00 1.00 0.00 0.00 64.86 64.11 1s4f h ILE 298 Cb 1.28 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.03 1s4f h ILE 298 CO 0.14 0.55 0.00 0.74 0.00 0.00 0.00 178.15 179.58 1s4f h THR 299 N 0.52 0.00 0.00 -0.27 2.02 -0.92 -2.97 112.91 111.29 1s4f h THR 299 Ca 0.02 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1s4f h THR 299 Cb 1.07 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1s4f h THR 299 CO 0.10 0.00 -0.02 0.50 0.37 0.00 0.00 175.52 176.48 1s4f h LYS 300 N 0.00 0.00 -0.87 6.66 3.64 -1.14 -1.70 116.57 123.15 1s4f h LYS 300 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1s4f h LYS 300 Cb 0.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1s4f h LYS 300 CO 0.00 0.00 0.00 1.55 -2.27 0.00 0.00 179.45 178.73 1s4f n VAL 301 N -2.29 0.11 -1.61 2.00 3.14 -1.12 -1.90 118.33 116.66 1s4f n VAL 301 Ca -0.00 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.36 1s4f n VAL 301 Cb 0.01 -0.34 -0.01 0.00 -1.06 0.00 0.00 33.84 32.44 1s4f n VAL 301 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 1s4f n MET 302 N 0.58 0.00 -0.21 1.45 2.81 -1.12 -4.53 117.12 116.10 1s4f n MET 302 Ca 0.00 -0.19 -0.04 0.00 -1.81 0.00 0.00 57.70 55.66 1s4f n MET 302 Cb 0.09 0.19 0.02 0.00 -0.71 0.00 0.00 33.22 32.81 1s4f n MET 302 CO 0.00 0.00 0.00 -0.92 1.51 0.00 0.00 175.97 176.56 1s4f h TYR 303 N 0.00 -0.78 0.07 2.03 3.20 -0.58 -2.85 116.97 118.06 1s4f h TYR 303 Ca -0.11 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1s4f h TYR 303 Cb 0.69 0.43 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 1s4f h TYR 303 CO -0.13 -0.36 -0.12 -0.91 -1.64 0.00 0.00 178.16 174.99 1s4f h ASN 304 N -0.12 -0.36 -0.36 -2.11 2.35 -1.86 0.18 115.58 113.30 1s4f h ASN 304 Ca 0.26 0.03 0.07 0.00 -0.55 0.00 0.00 56.30 56.11 1s4f h ASN 304 Cb 0.54 0.13 -0.09 0.00 0.05 0.00 0.00 38.32 38.95 1s4f h ASN 304 CO -0.68 -0.15 -0.38 -0.25 -1.65 0.00 0.00 177.43 174.32 1s4f h TRP 305 N -0.21 -1.09 -0.25 1.19 -0.00 -1.96 0.39 115.95 114.01 1s4f h TRP 305 Ca -0.01 0.06 -0.06 0.00 -0.00 0.00 0.00 58.89 58.88 1s4f h TRP 305 Cb 0.20 0.53 -0.01 0.00 -0.00 0.00 0.00 29.16 29.87 1s4f h TRP 305 CO -0.22 -0.42 -0.12 0.28 -0.00 0.00 0.00 178.44 177.96 1s4f h VAL 306 N -0.32 1.22 -0.02 2.65 2.07 -1.52 -2.50 116.25 117.83 1s4f h VAL 306 Ca 0.14 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.72 1s4f h VAL 306 Cb 0.57 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1s4f h VAL 306 CO -0.53 0.31 -0.10 1.17 0.02 0.00 0.00 177.57 178.44 1s4f n LYS 307 N -4.22 1.62 -3.91 1.57 3.00 0.64 -4.32 118.16 112.53 1s4f n LYS 307 Ca 0.00 -1.11 -0.29 0.00 -0.00 0.00 0.00 58.31 56.91 1s4f n LYS 307 Cb 0.30 -1.48 -0.03 0.00 0.00 0.00 0.00 35.03 33.83 1s4f n LYS 307 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1s4f n GLN 308 N 0.28 -0.70 0.00 1.64 -0.06 0.13 -4.93 117.38 113.75 1s4f n GLN 308 Ca 0.16 -0.02 0.00 0.00 -2.00 0.00 0.00 57.00 55.14 1s4f n GLN 308 Cb 0.42 -2.08 0.00 0.00 -4.06 0.00 0.00 30.24 24.53 1s4f n GLN 308 CO 0.00 0.00 0.00 0.94 -0.20 0.00 0.00 177.06 177.80 1s4f n GLN 309 N -3.80 0.00 -1.28 3.69 -0.06 -1.22 -3.74 117.38 110.97 1s4f n GLN 309 Ca -0.16 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.74 1s4f n GLN 309 Cb 0.46 0.00 -0.09 0.00 -4.06 0.00 0.00 30.24 26.55 1s4f n GLN 309 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 1s4f n PRO 310 N 0.00 0.06 -1.54 3.69 -0.02 -1.26 -4.66 135.00 131.27 1s4f n PRO 310 Ca 0.00 -0.28 -0.55 0.00 -2.02 0.00 0.00 63.50 60.64 1s4f n PRO 310 Cb 0.00 -1.59 -0.07 0.00 -0.02 0.00 0.00 33.50 31.82 1s4f n PRO 310 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1s4f n VAL 311 N 5.76 0.11 -1.44 -1.45 0.31 -1.25 -4.96 118.33 115.41 1s4f n VAL 311 Ca 0.31 -0.03 0.06 0.00 -0.01 0.00 0.00 64.34 64.67 1s4f n VAL 311 Cb 0.37 -0.38 0.09 0.00 -0.91 0.00 0.00 33.84 33.02 1s4f n VAL 311 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1s4f n VAL 312 N 1.87 1.18 -3.98 2.52 0.24 -1.26 -4.97 118.33 113.93 1s4f n VAL 312 Ca 0.19 -1.45 -0.34 0.00 -2.04 0.00 0.00 64.34 60.71 1s4f n VAL 312 Cb 0.14 0.05 -0.14 0.00 -1.47 0.00 0.00 33.84 32.41 1s4f n VAL 312 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1s4f s ILE 313 N -1.80 2.62 0.52 1.34 1.01 -1.26 -4.92 121.20 118.71 1s4f s ILE 313 Ca 0.20 -1.49 -0.23 0.00 0.00 0.00 0.00 60.65 59.13 1s4f s ILE 313 Cb 0.18 -2.51 -0.06 0.00 0.01 0.00 0.00 42.46 40.08 1s4f s ILE 313 CO 0.01 -0.07 1.38 -2.65 0.00 0.00 0.00 174.94 173.62 1s4f n PRO 314 N 4.54 1.85 0.00 2.79 -0.02 -1.26 -1.41 135.00 141.49 1s4f n PRO 314 Ca -0.14 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1s4f n PRO 314 Cb 0.43 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1s4f n PRO 314 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s4f n GLY 315 N 0.71 2.61 3.49 -1.23 0.00 -1.25 -4.64 105.19 104.88 1s4f n GLY 315 Ca 0.09 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.62 1s4f n GLY 315 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1s4f n TYR 316 N -0.84 1.72 -1.72 1.61 9.36 -0.50 -2.44 117.16 124.36 1s4f n TYR 316 Ca 0.00 0.19 -0.14 0.00 3.32 0.00 0.00 57.90 61.26 1s4f n TYR 316 Cb 0.00 -2.58 0.11 0.00 -0.63 0.00 0.00 39.34 36.24 1s4f n TYR 316 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 1s4f n GLU 317 N 8.16 2.66 0.00 2.98 4.07 -1.04 -4.78 120.64 132.70 1s4f n GLU 317 Ca 0.38 -3.66 -0.12 0.00 -0.06 0.00 0.00 57.16 53.70 1s4f n GLU 317 Cb 0.27 -2.03 -0.09 0.00 -0.06 0.00 0.00 31.44 29.53 1s4f n GLU 317 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 1s4f h GLY 318 N 1.63 -0.11 1.65 8.31 0.00 -1.87 -3.28 103.07 109.40 1s4f h GLY 318 Ca 0.28 0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.61 1s4f h GLY 318 CO 0.60 -0.04 -0.03 0.50 0.00 0.00 0.00 176.54 177.58 1s4f h LYS 319 N -0.80 0.43 -6.50 4.80 1.57 -1.92 -3.43 116.57 110.72 1s4f h LYS 319 Ca -0.01 -0.09 -0.60 0.00 -1.87 0.00 0.00 60.65 58.08 1s4f h LYS 319 Cb 0.61 -0.06 0.08 0.00 0.08 0.00 0.00 32.23 32.93 1s4f h LYS 319 CO 0.02 0.49 0.57 2.41 -0.57 0.00 0.00 179.45 182.36 1s4f n THR 320 N -4.29 0.70 -2.69 -0.16 -1.04 -1.24 -4.91 114.28 100.66 1s4f n THR 320 Ca 0.01 -0.18 -0.41 0.00 -2.04 0.00 0.00 64.05 61.44 1s4f n THR 320 Cb 0.24 -1.32 -0.05 0.00 -1.82 0.00 0.00 70.33 67.39 1s4f n THR 320 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1s4f s PRO 321 N -0.11 4.73 0.28 -2.82 0.02 -1.26 -4.96 135.00 130.88 1s4f s PRO 321 Ca 0.72 1.53 0.00 0.00 0.02 0.00 0.00 61.00 63.27 1s4f s PRO 321 Cb -0.72 -3.32 0.66 0.00 0.02 0.00 0.00 34.50 31.14 1s4f s PRO 321 CO 0.48 0.29 1.64 -0.07 -0.33 0.00 0.00 177.00 179.00 1s4f h LEU 322 N 4.97 -0.12 -1.55 -5.54 3.38 -1.93 -0.94 115.31 113.57 1s4f h LEU 322 Ca -0.44 0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1s4f h LEU 322 Cb 1.21 0.31 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 1s4f h LEU 322 CO 0.70 -0.18 -0.18 2.19 0.09 0.00 0.00 178.44 181.06 1s4f h PHE 323 N 0.16 0.06 -2.44 1.13 -5.15 -1.92 -3.26 116.94 105.52 1s4f h PHE 323 Ca 0.53 -0.01 -0.60 0.00 -0.20 0.00 0.00 57.97 57.69 1s4f h PHE 323 Cb 1.05 -0.02 -0.42 0.00 0.22 0.00 0.00 35.95 36.79 1s4f h PHE 323 CO -0.32 0.24 -0.65 0.27 -2.00 0.00 0.00 178.31 175.85 1s4f n ASN 324 N -4.29 3.06 0.00 -0.68 0.23 -0.36 -4.71 115.26 108.50 1s4f n ASN 324 Ca -0.02 -3.27 0.00 0.00 -0.53 0.00 0.00 54.58 50.76 1s4f n ASN 324 Cb 0.26 -0.69 0.00 0.00 -2.08 0.00 0.00 39.78 37.27 1s4f n ASN 324 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1s4f n ILE 325 N 1.30 0.00 -0.49 1.53 3.06 -1.21 -4.46 119.36 119.09 1s4f n ILE 325 Ca 0.26 0.00 0.43 0.00 -2.50 0.00 0.00 62.75 60.94 1s4f n ILE 325 Cb 0.41 -0.17 0.78 0.00 0.54 0.00 0.00 39.64 41.19 1s4f n ILE 325 CO 0.00 0.00 0.00 -0.26 -2.50 0.00 0.00 176.55 173.79 1s4f h PHE 326 N 0.00 0.04 -0.27 9.51 0.05 -1.86 0.87 116.94 125.27 1s4f h PHE 326 Ca 0.00 0.00 0.06 0.00 3.82 0.00 0.00 57.97 61.85 1s4f h PHE 326 Cb 0.00 -0.01 -0.06 0.00 2.00 0.00 0.00 35.95 37.88 1s4f h PHE 326 CO 0.00 -0.01 -0.10 -0.44 -0.18 0.00 0.00 178.31 177.58 1s4f h ASP 327 N 0.01 -0.36 0.38 2.17 3.32 -1.88 -0.96 116.42 119.11 1s4f h ASP 327 Ca 0.74 0.10 -0.19 0.00 0.02 0.00 0.00 57.03 57.69 1s4f h ASP 327 Cb 2.92 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 42.67 1s4f h ASP 327 CO -0.03 -0.13 -0.79 0.07 -1.72 0.00 0.00 179.24 176.63 1s4f h LYS 328 N -0.06 0.33 -0.14 3.56 2.10 -1.16 -2.45 116.57 118.74 1s4f h LYS 328 Ca 0.14 -0.30 0.04 0.00 -2.00 0.00 0.00 60.65 58.53 1s4f h LYS 328 Cb 0.26 0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 31.66 1s4f h LYS 328 CO -0.31 0.96 0.17 0.28 -2.00 0.00 0.00 179.45 178.55 1s4f h VAL 329 N 0.21 0.43 -0.07 0.07 2.07 -0.88 0.05 116.25 118.14 1s4f h VAL 329 Ca -0.04 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 1s4f h VAL 329 Cb 1.38 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1s4f h VAL 329 CO 0.13 0.00 -0.08 -0.09 0.02 0.00 0.00 177.57 177.55 1s4f h ARG 330 N 0.00 0.17 -0.48 1.57 9.65 -0.69 -1.44 114.38 123.16 1s4f h ARG 330 Ca 0.07 -0.10 0.07 0.00 -1.10 0.00 0.00 59.98 58.92 1s4f h ARG 330 Cb 0.40 0.01 -0.09 0.00 -1.39 0.00 0.00 29.97 28.89 1s4f h ARG 330 CO -0.00 0.63 -0.48 0.87 2.80 0.00 0.00 179.97 183.79 1s4f h LYS 331 N -0.27 -0.30 -0.87 0.20 1.79 -0.95 0.57 116.57 116.73 1s4f h LYS 331 Ca 0.01 0.02 0.14 0.00 -2.18 0.00 0.00 60.65 58.63 1s4f h LYS 331 Cb 0.61 0.07 -0.09 0.00 -1.58 0.00 0.00 32.23 31.23 1s4f h LYS 331 CO 0.02 -0.20 0.48 0.93 -1.08 0.00 0.00 179.45 179.60 1s4f h GLU 332 N -0.31 0.69 0.80 3.15 5.08 -1.45 0.12 114.58 122.65 1s4f h GLU 332 Ca 0.13 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1s4f h GLU 332 Cb 0.58 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1s4f h GLU 332 CO -0.63 0.45 -0.44 2.35 -1.00 0.00 0.00 179.01 179.74 1s4f h TRP 333 N 0.71 -1.17 -0.77 4.33 2.91 0.71 -2.70 115.95 119.98 1s4f h TRP 333 Ca 0.46 -0.02 0.09 0.00 1.13 0.00 0.00 58.89 60.56 1s4f h TRP 333 Cb 0.59 0.40 -0.05 0.00 -0.51 0.00 0.00 29.16 29.59 1s4f h TRP 333 CO -0.07 -0.68 0.51 -0.44 -1.03 0.00 0.00 178.44 176.72 1s4f h ASP 334 N -1.15 0.63 0.00 2.65 3.32 0.71 -2.78 116.42 119.80 1s4f h ASP 334 Ca -0.11 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1s4f h ASP 334 Cb 0.91 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1s4f h ASP 334 CO 0.14 0.38 0.00 -1.54 -1.72 0.00 0.00 179.24 176.50 1s4f n SER 335 N -4.50 0.54 -2.89 6.45 3.41 0.35 -4.62 113.62 112.35 1s4f n SER 335 Ca 0.13 -0.58 -0.17 0.00 -0.26 0.00 0.00 58.87 57.99 1s4f n SER 335 Cb 0.32 -0.10 -0.06 0.00 -0.26 0.00 0.00 64.21 64.11 1s4f n SER 335 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1s4f n PHE 336 N 1.24 -0.60 -0.07 7.33 3.72 -1.05 -5.02 117.46 123.01 1s4f n PHE 336 Ca 0.00 -2.31 -0.11 0.00 -0.05 0.00 0.00 57.45 54.98 1s4f n PHE 336 Cb 0.07 0.22 -0.04 0.00 -0.94 0.00 0.00 39.48 38.80 1s4f n PHE 336 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1s4f n ASN 337 N -1.89 1.66 -3.06 4.37 4.13 -1.26 -4.81 115.26 114.40 1s4f n ASN 337 Ca 0.06 0.27 -0.22 0.00 1.68 0.00 0.00 54.58 56.37 1s4f n ASN 337 Cb 0.50 -0.63 -0.03 0.00 -1.54 0.00 0.00 39.78 38.08 1s4f n ASN 337 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1s4f n GLU 338 N -4.14 2.09 -1.10 3.52 2.13 -1.26 -5.08 120.64 116.80 1s4f n GLU 338 Ca -0.19 -4.10 -0.37 0.00 0.66 0.00 0.00 57.16 53.16 1s4f n GLU 338 Cb 0.50 -1.96 0.03 0.00 0.27 0.00 0.00 31.44 30.28 1s4f n GLU 338 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1s4f n PRO 339 N 0.01 0.01 -3.63 5.31 -0.02 -1.26 0.31 135.00 135.73 1s4f n PRO 339 Ca 0.28 0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.65 1s4f n PRO 339 Cb 0.53 -1.08 -0.07 0.00 -0.02 0.00 0.00 33.50 32.86 1s4f n PRO 339 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1s4f s VAL 340 N -2.01 0.00 -0.14 -1.45 0.11 0.01 -4.38 120.40 112.54 1s4f s VAL 340 Ca 0.48 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.50 1s4f s VAL 340 Cb -0.31 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.51 1s4f s VAL 340 CO 0.75 0.00 -0.04 0.00 -3.33 0.00 0.00 175.10 172.48 1s4f s ALA 341 N 0.52 3.02 -0.28 1.54 0.00 -0.43 -2.15 121.76 123.98 1s4f s ALA 341 Ca -0.01 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 1s4f s ALA 341 Cb -0.05 -1.53 0.04 0.00 0.00 0.00 0.00 23.12 21.58 1s4f s ALA 341 CO -0.04 0.27 -0.01 0.08 0.00 0.00 0.00 175.76 176.06 1s4f s VAL 342 N 0.18 3.04 0.28 0.00 1.01 -0.39 0.06 120.40 124.58 1s4f s VAL 342 Ca -0.02 -1.21 -0.26 0.00 0.00 0.00 0.00 61.98 60.49 1s4f s VAL 342 Cb -0.14 -2.67 -0.09 0.00 0.00 0.00 0.00 36.38 33.48 1s4f s VAL 342 CO 0.03 0.01 0.91 -0.44 0.00 0.00 0.00 175.10 175.61 1s4f s SER 343 N 1.30 7.40 0.34 3.32 0.01 -0.28 -1.77 113.70 124.03 1s4f s SER 343 Ca -0.03 1.82 -0.11 0.00 1.31 0.00 0.00 55.95 58.94 1s4f s SER 343 Cb -0.19 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.41 1s4f s SER 343 CO -0.02 0.02 0.70 -0.36 0.41 0.00 0.00 173.24 173.99 1s4f s PHE 344 N -1.46 3.44 -0.43 2.43 2.99 0.40 -3.90 117.98 121.45 1s4f s PHE 344 Ca 0.46 1.00 0.08 0.00 0.00 0.00 0.00 56.93 58.47 1s4f s PHE 344 Cb -0.21 -2.39 0.34 0.00 0.00 0.00 0.00 43.02 40.77 1s4f s PHE 344 CO 0.26 0.04 1.03 -3.47 -0.00 0.00 0.00 175.22 173.07 1s4f n ASP 345 N -0.85 -1.31 -4.74 1.36 2.03 -1.26 -4.48 116.55 107.30 1s4f n ASP 345 Ca 0.02 -3.37 -0.41 0.00 0.52 0.00 0.00 54.79 51.54 1s4f n ASP 345 Cb 0.54 1.07 -0.03 0.00 -0.72 0.00 0.00 41.12 41.98 1s4f n ASP 345 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1s4f s THR 346 N -0.60 3.20 -0.28 5.18 2.01 -1.26 -1.16 115.64 122.72 1s4f s THR 346 Ca 0.27 1.00 -0.26 0.00 0.31 0.00 0.00 61.69 63.01 1s4f s THR 346 Cb 0.32 -3.64 0.01 0.00 0.01 0.00 0.00 72.50 69.20 1s4f s THR 346 CO -0.06 0.16 0.92 -0.75 -0.69 0.00 0.00 174.62 174.20 1s4f s LYS 347 N -0.23 4.08 -0.58 4.92 2.20 -0.97 -4.30 119.74 124.87 1s4f s LYS 347 Ca 0.56 0.92 -0.18 0.00 -0.36 0.00 0.00 55.97 56.91 1s4f s LYS 347 Cb -0.36 -3.70 0.03 0.00 -1.51 0.00 0.00 37.83 32.28 1s4f s LYS 347 CO 0.39 -0.70 0.64 0.00 -0.36 0.00 0.00 175.35 175.32 1s4f n ALA 348 N 6.37 -2.64 0.07 3.13 0.00 -1.26 -4.71 120.51 121.47 1s4f n ALA 348 Ca 0.08 0.38 -0.12 0.00 0.00 0.00 0.00 53.44 53.78 1s4f n ALA 348 Cb 0.47 -2.21 -0.06 0.00 0.00 0.00 0.00 19.45 17.65 1s4f n ALA 348 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1s4f h TRP 349 N 1.27 -0.19 -0.28 0.00 2.91 -1.97 -1.99 115.95 115.70 1s4f h TRP 349 Ca -0.33 0.00 0.08 0.00 1.13 0.00 0.00 58.89 59.77 1s4f h TRP 349 Cb 1.23 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.94 1s4f h TRP 349 CO 0.11 -0.12 0.23 -0.44 -1.03 0.00 0.00 178.44 177.19 1s4f h ASP 350 N -0.16 0.00 -0.51 2.65 5.19 -1.91 0.47 116.42 122.16 1s4f h ASP 350 Ca 0.01 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.30 1s4f h ASP 350 Cb 0.16 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.65 1s4f h ASP 350 CO -0.03 0.00 -0.13 0.74 -3.12 0.00 0.00 179.24 176.69 1s4f h THR 351 N 0.00 1.27 0.14 0.35 2.02 -1.64 -0.48 112.91 114.57 1s4f h THR 351 Ca 0.13 -1.29 -0.28 0.00 0.77 0.00 0.00 66.41 65.74 1s4f h THR 351 Cb 0.59 1.00 0.01 0.00 -1.74 0.00 0.00 68.15 68.02 1s4f h THR 351 CO -0.00 0.45 -1.26 1.56 0.37 0.00 0.00 175.52 176.64 1s4f h GLN 352 N 0.88 0.36 -5.42 6.66 7.50 0.34 -3.46 115.11 121.98 1s4f h GLN 352 Ca 0.13 -0.57 -0.56 0.00 0.50 0.00 0.00 58.65 58.15 1s4f h GLN 352 Cb 0.70 0.21 0.14 0.00 0.05 0.00 0.00 27.48 28.58 1s4f h GLN 352 CO 0.05 1.26 -0.84 0.28 -1.50 0.00 0.00 178.83 178.08 1s4f n VAL 353 N -3.61 0.63 -4.37 -0.54 0.31 -0.39 -4.54 118.33 105.82 1s4f n VAL 353 Ca -0.10 -0.45 -0.19 0.00 -0.01 0.00 0.00 64.34 63.59 1s4f n VAL 353 Cb 1.02 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.84 1s4f n VAL 353 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1s4f s THR 354 N -1.49 1.33 0.20 2.52 2.01 -1.26 -4.19 115.64 114.77 1s4f s THR 354 Ca 0.54 -2.08 -0.11 0.00 0.31 0.00 0.00 61.69 60.35 1s4f s THR 354 Cb -0.59 -2.34 0.16 0.00 0.01 0.00 0.00 72.50 69.74 1s4f s THR 354 CO 0.56 -0.36 1.69 0.28 -0.69 0.00 0.00 174.62 176.11 1s4f h SER 355 N 2.41 -0.08 0.23 3.53 0.02 -1.88 0.45 113.55 118.23 1s4f h SER 355 Ca -0.39 0.12 -0.06 0.00 -0.84 0.00 0.00 61.79 60.62 1s4f h SER 355 Cb 1.22 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.94 1s4f h SER 355 CO 0.65 -0.02 -0.26 0.11 -1.14 0.00 0.00 176.83 176.17 1s4f h LYS 356 N 0.21 0.05 0.00 3.45 1.57 -1.96 -1.17 116.57 118.72 1s4f h LYS 356 Ca 0.30 -0.01 -0.23 0.00 -1.87 0.00 0.00 60.65 58.84 1s4f h LYS 356 Cb 0.45 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1s4f h LYS 356 CO -0.42 0.30 -0.95 -0.44 -0.57 0.00 0.00 179.45 177.38 1s4f h ASP 357 N 0.04 0.51 -0.29 0.86 5.19 -1.12 -2.41 116.42 119.20 1s4f h ASP 357 Ca 0.01 -0.42 -0.10 0.00 -0.62 0.00 0.00 57.03 55.90 1s4f h ASP 357 Cb 0.48 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 39.82 1s4f h ASP 357 CO 0.03 1.22 -0.17 -0.07 -3.12 0.00 0.00 179.24 177.13 1s4f h LEU 358 N 0.22 0.75 -0.20 1.55 3.38 0.41 -1.87 115.31 119.54 1s4f h LEU 358 Ca -0.08 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1s4f h LEU 358 Cb 1.58 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1s4f h LEU 358 CO 0.16 0.92 -0.01 1.56 0.09 0.00 0.00 178.44 181.17 1s4f h GLN 359 N 0.66 0.35 -0.18 1.13 4.20 -1.23 0.65 115.11 120.70 1s4f h GLN 359 Ca 0.10 -0.12 0.04 0.00 0.06 0.00 0.00 58.65 58.74 1s4f h GLN 359 Cb 0.66 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.34 1s4f h GLN 359 CO 0.05 0.56 -0.47 1.25 -0.67 0.00 0.00 178.83 179.55 1s4f h LEU 360 N 0.10 -1.49 -1.21 1.46 5.85 -1.20 1.11 115.31 119.93 1s4f h LEU 360 Ca 0.05 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 1s4f h LEU 360 Cb 0.41 0.61 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1s4f h LEU 360 CO 0.01 -0.44 0.44 0.40 -0.34 0.00 0.00 178.44 178.51 1s4f h ILE 361 N -0.50 1.20 -0.18 4.05 5.03 -1.32 0.31 117.51 126.10 1s4f h ILE 361 Ca 0.07 -0.43 0.01 0.00 -0.12 0.00 0.00 64.86 64.39 1s4f h ILE 361 Cb 0.64 0.17 -0.02 0.00 -3.03 0.00 0.00 36.82 34.59 1s4f h ILE 361 CO -0.45 0.21 0.07 1.23 -0.68 0.00 0.00 178.15 178.54 1s4f h GLY 362 N 1.02 0.23 0.82 5.37 0.00 0.16 0.12 103.07 110.78 1s4f h GLY 362 Ca 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 1s4f h GLY 362 CO -0.05 0.04 -0.26 -2.09 0.00 0.00 0.00 176.54 174.18 1s4f h GLU 363 N 0.17 -0.58 0.00 4.80 4.81 0.21 0.33 114.58 124.31 1s4f h GLU 363 Ca 0.08 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1s4f h GLU 363 Cb 0.04 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1s4f h GLU 363 CO -0.07 -0.39 0.32 0.82 -0.73 0.00 0.00 179.01 178.97 1s4f h ILE 364 N -0.60 0.00 0.10 2.32 2.04 0.02 0.18 117.51 121.56 1s4f h ILE 364 Ca -0.03 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.49 1s4f h ILE 364 Cb 0.52 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1s4f h ILE 364 CO 0.01 0.00 -1.88 1.56 0.00 0.00 0.00 178.15 177.84 1s4f h GLN 365 N 0.00 0.21 0.00 2.37 4.20 0.23 -3.23 115.11 118.88 1s4f h GLN 365 Ca 0.00 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1s4f h GLN 365 Cb 0.65 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1s4f h GLN 365 CO 0.00 1.04 0.00 1.63 -0.67 0.00 0.00 178.83 180.83 1s4f n LYS 366 N -3.38 0.36 -0.00 1.46 5.02 0.60 -1.97 118.16 120.24 1s4f n LYS 366 Ca -0.27 0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 55.96 1s4f n LYS 366 Cb 1.05 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 34.42 1s4f n LYS 366 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1s4f h TYR 367 N 0.00 0.01 0.00 2.13 3.20 -1.49 -3.40 116.97 117.41 1s4f h TYR 367 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1s4f h TYR 367 Cb 0.01 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.28 1s4f h TYR 367 CO 0.00 1.01 0.00 0.66 -1.64 0.00 0.00 178.16 178.19 1s4f n TYR 368 N -3.12 0.00 -0.11 -3.82 4.02 -0.83 -3.55 117.16 109.75 1s4f n TYR 368 Ca -0.13 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.73 1s4f n TYR 368 Cb 1.03 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 40.32 1s4f n TYR 368 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1s4f n TYR 369 N -1.65 -0.11 -2.92 -0.72 4.02 -1.23 -0.13 117.16 114.41 1s4f n TYR 369 Ca 0.00 0.33 0.00 0.00 -0.01 0.00 0.00 57.90 58.22 1s4f n TYR 369 Cb 0.00 -0.50 0.00 0.00 -0.02 0.00 0.00 39.34 38.82 1s4f n TYR 369 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1s4f n LYS 370 N -4.24 -0.63 -0.10 -0.72 4.81 -1.26 -3.40 118.16 112.63 1s4f n LYS 370 Ca 0.01 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.50 1s4f n LYS 370 Cb 0.07 0.00 0.10 0.00 0.02 0.00 0.00 35.03 35.22 1s4f n LYS 370 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1s4f n LYS 371 N 0.00 1.94 -0.09 1.64 5.02 -1.26 -4.47 118.16 120.93 1s4f n LYS 371 Ca 0.00 -1.66 -0.16 0.00 -2.02 0.00 0.00 58.31 54.47 1s4f n LYS 371 Cb 0.00 -1.22 -0.09 0.00 -0.02 0.00 0.00 35.03 33.69 1s4f n LYS 371 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1s4f h GLU 372 N 1.88 0.00 -5.20 1.97 4.11 -1.96 -3.38 114.58 111.99 1s4f h GLU 372 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.76 1s4f h GLU 372 Cb 0.60 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.69 1s4f h GLU 372 CO 0.00 0.78 0.74 -1.58 0.07 0.00 0.00 179.01 179.01 1s4f s TRP 373 N -2.27 2.94 0.00 2.06 0.23 -1.26 -4.57 118.94 116.07 1s4f s TRP 373 Ca -0.23 -1.07 0.00 0.00 -2.03 0.00 0.00 56.10 52.77 1s4f s TRP 373 Cb 0.03 -4.29 0.00 0.00 0.03 0.00 0.00 33.47 29.24 1s4f s TRP 373 CO 0.51 -1.56 0.00 1.58 0.96 0.00 0.00 176.95 178.45 1s4f n HIS 374 N 7.04 0.00 0.79 -1.98 -0.00 -1.26 -4.29 115.22 115.51 1s4f n HIS 374 Ca 0.14 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.32 1s4f n HIS 374 Cb 0.48 0.22 0.00 0.00 -0.12 0.00 0.00 29.99 30.57 1s4f n HIS 374 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1s4f n LYS 375 N -1.71 0.79 -0.05 1.57 5.02 -1.26 0.51 118.16 123.03 1s4f n LYS 375 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1s4f n LYS 375 Cb 0.00 -1.17 -0.03 0.00 -0.02 0.00 0.00 35.03 33.81 1s4f n LYS 375 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1s4f n PHE 376 N 0.50 0.00 0.09 2.13 7.35 -1.26 -4.17 117.46 122.09 1s4f n PHE 376 Ca 0.00 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.70 1s4f n PHE 376 Cb 0.35 -0.37 0.32 0.00 0.35 0.00 0.00 39.48 40.13 1s4f n PHE 376 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1s4f h ILE 377 N -0.43 1.22 0.20 -2.13 2.04 -1.06 -3.08 117.51 114.27 1s4f h ILE 377 Ca -0.22 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 1s4f h ILE 377 Cb 1.04 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1s4f h ILE 377 CO -0.14 0.31 -0.21 0.44 0.00 0.00 0.00 178.15 178.55 1s4f h ASP 378 N 0.28 -0.58 0.28 1.72 5.19 -0.16 -0.63 116.42 122.52 1s4f h ASP 378 Ca 0.05 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.51 1s4f h ASP 378 Cb 0.49 0.19 -0.03 0.00 0.18 0.00 0.00 39.33 40.16 1s4f h ASP 378 CO 0.03 -0.28 -0.47 0.74 -3.12 0.00 0.00 179.24 176.15 1s4f h THR 379 N -0.41 0.00 -0.97 0.35 2.02 -1.73 1.45 112.91 113.61 1s4f h THR 379 Ca -0.03 0.00 0.32 0.00 0.77 0.00 0.00 66.41 67.47 1s4f h THR 379 Cb 0.36 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.61 1s4f h THR 379 CO -0.03 0.00 0.34 -0.29 0.37 0.00 0.00 175.52 175.91 1s4f h ILE 380 N -0.79 0.14 -0.18 3.11 2.10 -1.60 1.88 117.51 122.17 1s4f h ILE 380 Ca -0.03 -0.04 -0.11 0.00 1.08 0.00 0.00 64.86 65.76 1s4f h ILE 380 Cb 0.74 0.01 -0.00 0.00 -1.09 0.00 0.00 36.82 36.48 1s4f h ILE 380 CO -0.16 0.02 -0.30 0.74 -1.08 0.00 0.00 178.15 177.37 1s4f h THR 381 N 0.12 1.34 -0.24 2.19 2.02 0.73 -2.61 112.91 116.46 1s4f h THR 381 Ca 0.69 -1.53 0.06 0.00 0.77 0.00 0.00 66.41 66.40 1s4f h THR 381 Cb 1.60 1.88 -0.08 0.00 -1.74 0.00 0.00 68.15 69.82 1s4f h THR 381 CO -0.75 0.47 -0.37 -0.78 0.37 0.00 0.00 175.52 174.46 1s4f h ASP 382 N 0.18 -1.19 -0.05 4.18 -0.00 1.33 -2.68 116.42 118.18 1s4f h ASP 382 Ca 0.01 0.18 0.01 0.00 -0.00 0.00 0.00 57.03 57.23 1s4f h ASP 382 Cb 0.89 0.51 -0.03 0.00 -0.00 0.00 0.00 39.33 40.70 1s4f h ASP 382 CO 0.07 -0.37 -0.23 0.45 -0.00 0.00 0.00 179.24 179.16 1s4f h HIS 383 N -0.38 -0.67 -0.06 0.28 3.86 -0.12 -2.00 115.15 116.06 1s4f h HIS 383 Ca 0.11 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.37 1s4f h HIS 383 Cb 0.58 0.30 -0.00 0.00 1.06 0.00 0.00 27.41 29.34 1s4f h HIS 383 CO -0.50 -0.23 1.01 -1.33 0.86 0.00 0.00 177.93 177.74 1s4f n MET 384 N -3.75 0.03 0.24 2.45 2.81 -0.99 0.14 117.12 118.06 1s4f n MET 384 Ca -0.03 0.95 0.10 0.00 -1.81 0.00 0.00 57.70 56.92 1s4f n MET 384 Cb 0.16 -2.57 0.62 0.00 -0.71 0.00 0.00 33.22 30.72 1s4f n MET 384 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1s4f h THR 385 N 0.00 0.72 -1.94 2.03 2.02 -1.20 -3.35 112.91 111.19 1s4f h THR 385 Ca 0.03 -0.72 -0.14 0.00 0.77 0.00 0.00 66.41 66.35 1s4f h THR 385 Cb 2.05 1.44 -0.29 0.00 -1.74 0.00 0.00 68.15 69.61 1s4f h THR 385 CO -0.00 0.17 -0.47 -0.70 0.37 0.00 0.00 175.52 174.89 1s4f s GLU 386 N -4.17 0.35 -0.20 6.66 2.12 0.38 0.11 118.70 123.95 1s4f s GLU 386 Ca -0.03 0.58 0.01 0.00 0.36 0.00 0.00 54.97 55.90 1s4f s GLU 386 Cb 0.13 -0.40 0.04 0.00 0.26 0.00 0.00 34.13 34.17 1s4f s GLU 386 CO 0.62 -0.61 -0.10 0.08 -0.54 0.00 0.00 175.26 174.72 1s4f s VAL 387 N 2.55 1.61 -0.02 3.70 1.01 -0.37 -4.83 120.40 124.04 1s4f s VAL 387 Ca 0.12 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.82 1s4f s VAL 387 Cb -0.15 -1.69 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 1s4f s VAL 387 CO -0.16 0.17 1.66 -2.84 0.00 0.00 0.00 175.10 173.94 1s4f s PRO 388 N 1.41 4.19 0.01 2.72 0.02 -1.26 -2.35 135.00 139.74 1s4f s PRO 388 Ca -0.01 2.23 0.01 0.00 0.02 0.00 0.00 61.00 63.25 1s4f s PRO 388 Cb -0.16 -3.91 -0.04 0.00 0.02 0.00 0.00 34.50 30.41 1s4f s PRO 388 CO -0.08 -0.82 0.04 0.08 -0.33 0.00 0.00 177.00 175.89 1s4f s VAL 389 N 3.74 4.44 -0.17 3.83 1.01 0.18 -1.35 120.40 132.08 1s4f s VAL 389 Ca 0.74 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1s4f s VAL 389 Cb -0.35 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.04 1s4f s VAL 389 CO 0.31 0.32 -0.11 -0.63 0.00 0.00 0.00 175.10 174.99 1s4f s ILE 390 N -1.18 1.52 0.91 2.22 1.01 0.15 -2.05 121.20 123.79 1s4f s ILE 390 Ca 0.22 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.94 1s4f s ILE 390 Cb -0.12 -1.55 0.15 0.00 0.01 0.00 0.00 42.46 40.95 1s4f s ILE 390 CO 0.14 0.27 1.20 0.42 0.00 0.00 0.00 174.94 176.97 1s4f s THR 391 N 1.47 1.97 0.14 2.92 -4.23 0.08 -0.38 115.64 117.62 1s4f s THR 391 Ca 0.01 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.38 1s4f s THR 391 Cb -0.15 -2.89 0.02 0.00 1.34 0.00 0.00 72.50 70.82 1s4f s THR 391 CO -0.09 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 175.68 1s4f h ALA 392 N -1.47 0.59 -0.09 3.99 0.00 -1.71 -1.87 119.26 118.69 1s4f h ALA 392 Ca -0.47 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.32 1s4f h ALA 392 Cb 1.30 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1s4f h ALA 392 CO 0.54 0.21 0.07 0.38 0.00 0.00 0.00 179.25 180.45 1s4f h ASP 393 N 0.60 0.00 0.00 0.00 2.03 -1.94 -3.45 116.42 113.66 1s4f h ASP 393 Ca 0.15 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.45 1s4f h ASP 393 Cb 0.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.70 1s4f h ASP 393 CO -0.01 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.81 1s4f n GLY 394 N -1.54 1.02 3.75 7.15 0.00 -0.70 -5.12 105.19 109.75 1s4f n GLY 394 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1s4f n GLY 394 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s4f s GLU 395 N 0.00 2.98 -0.19 1.61 0.41 -1.26 -4.68 118.70 117.57 1s4f s GLU 395 Ca 0.00 1.98 -0.01 0.00 -0.41 0.00 0.00 54.97 56.53 1s4f s GLU 395 Cb 0.00 -2.03 0.05 0.00 -1.78 0.00 0.00 34.13 30.37 1s4f s GLU 395 CO 0.00 -1.24 -0.04 0.08 -0.49 0.00 0.00 175.26 173.57 1s4f s VAL 396 N -1.47 1.12 0.20 2.63 1.01 -1.26 -0.74 120.40 121.89 1s4f s VAL 396 Ca 0.76 -0.78 0.11 0.00 0.00 0.00 0.00 61.98 62.07 1s4f s VAL 396 Cb -0.34 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1s4f s VAL 396 CO 0.38 0.01 -0.22 -0.72 0.00 0.00 0.00 175.10 174.56 1s4f s TYR 397 N 1.61 2.14 -0.43 5.22 -0.85 -0.87 -4.97 117.35 119.20 1s4f s TYR 397 Ca -0.01 -0.39 -0.13 0.00 -0.52 0.00 0.00 57.07 56.02 1s4f s TYR 397 Cb -0.17 -1.04 0.06 0.00 0.38 0.00 0.00 41.96 41.19 1s4f s TYR 397 CO -0.07 0.48 0.31 0.42 -1.52 0.00 0.00 175.55 175.17 1s4f s ILE 398 N -1.92 4.82 0.30 -3.49 1.09 -1.26 -0.65 121.20 120.10 1s4f s ILE 398 Ca 0.21 -1.08 -0.27 0.00 -1.10 0.00 0.00 60.65 58.40 1s4f s ILE 398 Cb -0.07 -3.85 -0.09 0.00 -1.06 0.00 0.00 42.46 37.39 1s4f s ILE 398 CO 0.10 -0.47 0.99 -0.60 -0.10 0.00 0.00 174.94 174.85 1s4f s ARG 399 N 1.57 4.61 -0.44 2.79 3.52 -0.99 -4.89 118.95 125.11 1s4f s ARG 399 Ca 0.03 1.48 -0.11 0.00 -0.13 0.00 0.00 55.73 57.01 1s4f s ARG 399 Cb -0.22 -2.96 0.08 0.00 -1.56 0.00 0.00 34.95 30.29 1s4f s ARG 399 CO 0.06 0.27 0.30 -0.80 -0.81 0.00 0.00 175.30 174.32 1s4f s ASN 400 N -1.36 5.76 0.00 -2.12 0.02 -1.26 -1.24 114.94 114.74 1s4f s ASN 400 Ca 0.48 -1.54 0.00 0.00 -1.02 0.00 0.00 52.86 50.78 1s4f s ASN 400 Cb -0.23 -2.03 0.00 0.00 0.02 0.00 0.00 41.25 39.00 1s4f s ASN 400 CO 0.30 -0.59 0.00 0.61 0.02 0.00 0.00 177.10 177.44 1s4f n GLY 401 N 4.98 0.00 3.11 0.66 0.00 0.31 -4.82 105.19 109.42 1s4f n GLY 401 Ca -0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 1s4f n GLY 401 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s4f n GLN 402 N -1.32 -3.69 -4.62 1.61 6.02 -1.26 -4.18 117.38 109.94 1s4f n GLN 402 Ca 0.00 -1.10 -0.33 0.00 -0.01 0.00 0.00 57.00 55.56 1s4f n GLN 402 Cb 0.00 -1.70 -0.15 0.00 1.02 0.00 0.00 30.24 29.41 1s4f n GLN 402 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1s4f s ARG 403 N -4.31 3.28 -0.35 -1.09 6.06 -0.19 -4.94 118.95 117.40 1s4f s ARG 403 Ca 0.51 -0.73 -0.14 0.00 -2.50 0.00 0.00 55.73 52.87 1s4f s ARG 403 Cb -0.09 -2.63 -0.01 0.00 0.06 0.00 0.00 34.95 32.28 1s4f s ARG 403 CO 0.43 0.09 0.28 0.20 -2.50 0.00 0.00 175.30 173.80 1s4f s GLY 404 N 0.65 1.95 0.22 8.12 0.00 -1.26 -4.63 107.32 112.37 1s4f s GLY 404 Ca -0.08 -1.37 0.07 0.00 0.00 0.00 0.00 44.72 43.35 1s4f s GLY 404 CO 0.02 0.86 1.00 -1.14 0.00 0.00 0.00 173.10 173.84 1s4f n SER 405 N 5.20 0.07 0.00 1.64 3.41 -1.17 0.59 113.62 123.36 1s4f n SER 405 Ca -0.11 1.07 0.08 0.00 -0.26 0.00 0.00 58.87 59.64 1s4f n SER 405 Cb 0.49 -0.45 0.35 0.00 -0.26 0.00 0.00 64.21 64.34 1s4f n SER 405 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s4f n GLY 406 N -1.24 -0.99 3.76 5.00 0.00 0.82 -4.75 105.19 107.78 1s4f n GLY 406 Ca 0.19 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1s4f n GLY 406 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s4f s GLN 407 N -2.90 4.15 0.20 1.61 -0.21 0.20 -4.27 119.66 118.43 1s4f s GLN 407 Ca 0.09 2.52 -0.11 0.00 0.02 0.00 0.00 55.36 57.88 1s4f s GLN 407 Cb 0.10 -3.02 0.23 0.00 1.00 0.00 0.00 33.01 31.33 1s4f s GLN 407 CO 0.27 -0.56 1.73 -1.35 -2.12 0.00 0.00 175.29 173.27 1s4f h PRO 408 N 4.30 0.31 0.00 2.91 0.11 -1.89 -1.93 132.00 135.81 1s4f h PRO 408 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1s4f h PRO 408 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1s4f h PRO 408 CO 0.74 0.21 0.00 -3.47 -0.21 0.00 0.00 178.00 175.27 1s4f n ASP 409 N -5.05 0.00 -0.01 -2.05 2.03 -1.26 -4.39 116.55 105.81 1s4f n ASP 409 Ca 0.07 -0.78 -0.10 0.00 0.52 0.00 0.00 54.79 54.50 1s4f n ASP 409 Cb 0.26 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.62 1s4f n ASP 409 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1s4f h THR 410 N 0.00 0.26 -0.20 5.18 2.02 -1.64 1.00 112.91 119.52 1s4f h THR 410 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1s4f h THR 410 Cb 0.00 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 1s4f h THR 410 CO 0.00 0.00 0.07 -1.28 0.37 0.00 0.00 175.52 174.68 1s4f h SER 411 N -0.39 0.29 0.57 4.18 0.87 -1.84 -0.18 113.55 117.05 1s4f h SER 411 Ca 0.10 -0.19 -0.03 0.00 -1.23 0.00 0.00 61.79 60.45 1s4f h SER 411 Cb 0.56 -0.08 0.01 0.00 -0.44 0.00 0.00 62.40 62.45 1s4f h SER 411 CO -0.38 0.40 -0.27 0.00 -0.53 0.00 0.00 176.83 176.04 1s4f h ALA 412 N 0.90 -0.77 0.41 6.23 0.00 -1.72 -2.41 119.26 121.90 1s4f h ALA 412 Ca 0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1s4f h ALA 412 Cb 0.21 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1s4f h ALA 412 CO -0.00 -0.88 -0.23 0.78 0.00 0.00 0.00 179.25 178.91 1s4f h GLY 413 N -0.86 -0.63 0.32 0.00 0.00 -0.84 -1.62 103.07 99.44 1s4f h GLY 413 Ca -0.08 0.25 0.11 0.00 0.00 0.00 0.00 47.33 47.62 1s4f h GLY 413 CO 0.13 -0.24 0.31 3.43 0.00 0.00 0.00 176.54 180.17 1s4f h ASN 414 N -0.60 0.34 0.81 0.19 4.21 -1.09 -1.05 115.58 118.39 1s4f h ASN 414 Ca -0.05 0.08 -0.04 0.00 1.21 0.00 0.00 56.30 57.51 1s4f h ASN 414 Cb 0.48 0.04 0.01 0.00 -1.12 0.00 0.00 38.32 37.73 1s4f h ASN 414 CO 0.06 0.17 -0.39 0.28 -1.29 0.00 0.00 177.43 176.27 1s4f h SER 415 N 0.50 -0.92 -0.76 5.81 0.02 -1.28 0.29 113.55 117.21 1s4f h SER 415 Ca 0.37 0.02 0.16 0.00 -0.84 0.00 0.00 61.79 61.50 1s4f h SER 415 Cb 0.48 0.24 -0.11 0.00 0.14 0.00 0.00 62.40 63.16 1s4f h SER 415 CO -0.33 -0.58 0.26 -0.03 -1.14 0.00 0.00 176.83 175.00 1s4f h MET 416 N -1.23 0.35 -0.26 3.45 1.85 -1.19 0.29 114.93 118.18 1s4f h MET 416 Ca -0.11 -0.02 -0.06 0.00 -0.61 0.00 0.00 59.70 58.90 1s4f h MET 416 Cb 0.84 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 32.78 1s4f h MET 416 CO 0.18 0.23 -0.11 1.25 -0.40 0.00 0.00 176.91 178.06 1s4f h LEU 417 N 0.36 0.40 -0.38 3.39 5.85 -1.06 -2.68 115.31 121.20 1s4f h LEU 417 Ca 0.43 -0.09 -0.19 0.00 0.84 0.00 0.00 57.88 58.87 1s4f h LEU 417 Cb 0.72 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1s4f h LEU 417 CO -0.47 0.55 -0.78 -1.13 -0.34 0.00 0.00 178.44 176.28 1s4f h ASN 418 N 0.39 0.41 0.03 1.25 -1.24 0.32 -2.49 115.58 114.25 1s4f h ASN 418 Ca 0.08 -0.29 -0.27 0.00 0.71 0.00 0.00 56.30 56.53 1s4f h ASN 418 Cb 0.43 -0.12 0.02 0.00 0.73 0.00 0.00 38.32 39.39 1s4f h ASN 418 CO 0.02 1.04 -1.08 -0.37 -1.29 0.00 0.00 177.43 175.75 1s4f h VAL 419 N 0.22 1.28 -0.49 2.57 -1.51 -1.11 -1.60 116.25 115.61 1s4f h VAL 419 Ca -0.04 -2.29 0.01 0.00 -1.23 0.00 0.00 66.70 63.15 1s4f h VAL 419 Cb 1.36 2.46 -0.03 0.00 -2.13 0.00 0.00 31.29 32.95 1s4f h VAL 419 CO 0.13 0.71 0.32 -0.07 -1.23 0.00 0.00 177.57 177.42 1s4f h LEU 420 N 0.36 0.54 -0.10 4.19 3.38 -1.52 0.98 115.31 123.13 1s4f h LEU 420 Ca -0.14 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1s4f h LEU 420 Cb 1.74 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.36 1s4f h LEU 420 CO 0.21 0.39 0.02 0.74 0.09 0.00 0.00 178.44 179.89 1s4f h THR 421 N 0.65 1.22 -0.62 0.22 2.02 -1.48 -0.89 112.91 114.03 1s4f h THR 421 Ca 0.19 -0.67 -0.05 0.00 0.77 0.00 0.00 66.41 66.65 1s4f h THR 421 Cb -0.05 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 1s4f h THR 421 CO -0.05 0.19 0.20 0.24 0.37 0.00 0.00 175.52 176.47 1s4f h MET 422 N -0.07 0.95 -1.00 6.66 2.86 -0.98 1.05 114.93 124.41 1s4f h MET 422 Ca 0.03 -0.20 0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1s4f h MET 422 Cb 0.29 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.75 1s4f h MET 422 CO 0.00 0.83 0.66 0.52 1.06 0.00 0.00 176.91 179.98 1s4f h MET 423 N 0.88 1.27 0.00 1.72 2.07 0.11 0.42 114.93 121.39 1s4f h MET 423 Ca 0.20 -0.08 0.00 0.00 -2.07 0.00 0.00 59.70 57.75 1s4f h MET 423 Cb 0.27 -0.29 0.00 0.00 -1.87 0.00 0.00 31.60 29.72 1s4f h MET 423 CO -0.01 0.84 0.00 0.98 1.07 0.00 0.00 176.91 179.79 1s4f n TYR 424 N -4.41 0.00 -0.18 -0.22 9.36 -0.35 -1.02 117.16 120.34 1s4f n TYR 424 Ca 0.13 0.00 0.01 0.00 3.32 0.00 0.00 57.90 61.35 1s4f n TYR 424 Cb 0.06 -0.31 0.04 0.00 -0.63 0.00 0.00 39.34 38.49 1s4f n TYR 424 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1s4f n ALA 425 N -1.43 0.00 0.42 2.98 0.00 0.36 0.06 120.51 122.91 1s4f n ALA 425 Ca 0.00 0.50 -0.19 0.00 0.00 0.00 0.00 53.44 53.75 1s4f n ALA 425 Cb 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 19.45 19.10 1s4f n ALA 425 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1s4f h PHE 426 N 0.00 -0.98 -0.10 0.00 3.57 -0.10 -2.97 116.94 116.35 1s4f h PHE 426 Ca 0.19 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.71 1s4f h PHE 426 Cb 0.31 0.33 -0.05 0.00 2.79 0.00 0.00 35.95 39.33 1s4f h PHE 426 CO -0.41 -0.61 -0.18 0.00 -2.23 0.00 0.00 178.31 174.89 1s4f n GLU 428 N -5.32 0.00 -0.02 0.00 -0.58 -0.21 -0.60 120.64 113.91 1s4f n GLU 428 Ca -0.03 0.47 -0.01 0.00 -0.42 0.00 0.00 57.16 57.17 1s4f n GLU 428 Cb 0.24 -1.51 -0.00 0.00 -0.57 0.00 0.00 31.44 29.59 1s4f n GLU 428 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1s4f n SER 429 N -1.47 0.36 -0.14 1.62 7.64 -0.41 -4.63 113.62 116.59 1s4f n SER 429 Ca 0.00 0.19 -0.08 0.00 1.01 0.00 0.00 58.87 59.99 1s4f n SER 429 Cb 0.01 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1s4f n SER 429 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1s4f h THR 430 N -0.19 1.12 0.00 0.44 1.35 -1.42 -3.47 112.91 110.74 1s4f h THR 430 Ca 0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1s4f h THR 430 Cb 0.14 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.09 1s4f h THR 430 CO 0.00 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 176.00 1s4f n GLY 431 N -1.16 1.14 3.77 5.82 0.00 0.24 -5.09 105.19 109.91 1s4f n GLY 431 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1s4f n GLY 431 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4f s VAL 432 N -2.00 2.23 0.55 1.61 1.01 -1.20 -4.96 120.40 117.64 1s4f s VAL 432 Ca 0.00 0.22 -0.18 0.00 0.00 0.00 0.00 61.98 62.02 1s4f s VAL 432 Cb 0.00 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 1s4f s VAL 432 CO 0.00 0.05 1.09 -2.84 0.00 0.00 0.00 175.10 173.40 1s4f s PRO 433 N -1.66 3.39 0.12 2.72 0.02 -1.26 -4.64 135.00 133.69 1s4f s PRO 433 Ca 0.54 1.44 -0.28 0.00 0.02 0.00 0.00 61.00 62.72 1s4f s PRO 433 Cb -0.45 -2.03 -0.07 0.00 0.02 0.00 0.00 34.50 31.98 1s4f s PRO 433 CO 0.57 -0.79 1.60 1.88 -0.33 0.00 0.00 177.00 179.94 1s4f h TYR 434 N 1.00 -0.98 0.00 6.54 0.05 -1.95 -1.37 116.97 120.26 1s4f h TYR 434 Ca -0.49 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.32 1s4f h TYR 434 Cb 1.24 0.43 0.00 0.00 1.01 0.00 0.00 36.73 39.41 1s4f h TYR 434 CO 0.54 -0.45 0.00 1.17 -1.05 0.00 0.00 178.16 178.38 1s4f n LYS 435 N -5.43 0.16 -0.15 4.88 0.00 -1.26 -1.75 118.16 114.62 1s4f n LYS 435 Ca -0.05 0.11 0.10 0.00 0.00 0.00 0.00 58.31 58.46 1s4f n LYS 435 Cb 0.34 -1.50 0.17 0.00 0.00 0.00 0.00 35.03 34.04 1s4f n LYS 435 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1s4f n SER 436 N -1.14 3.10 0.03 3.14 7.64 -0.52 -4.72 113.62 121.15 1s4f n SER 436 Ca 0.04 -1.90 -0.07 0.00 1.01 0.00 0.00 58.87 57.95 1s4f n SER 436 Cb 0.04 -0.19 -0.04 0.00 -1.01 0.00 0.00 64.21 63.00 1s4f n SER 436 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1s4f h PHE 437 N 3.70 -0.69 -1.03 1.43 3.57 -1.36 -2.29 116.94 120.27 1s4f h PHE 437 Ca 0.00 0.02 0.30 0.00 3.53 0.00 0.00 57.97 61.82 1s4f h PHE 437 Cb 0.86 0.30 -0.13 0.00 2.79 0.00 0.00 35.95 39.76 1s4f h PHE 437 CO 0.19 -0.26 0.61 -0.91 -2.23 0.00 0.00 178.31 175.72 1s4f h ASN 438 N -0.31 0.54 -0.09 0.41 2.35 -1.85 1.16 115.58 117.80 1s4f h ASN 438 Ca 0.00 0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1s4f h ASN 438 Cb 0.32 0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 1s4f h ASN 438 CO -0.15 -0.03 0.06 0.03 -1.65 0.00 0.00 177.43 175.69 1s4f h ARG 439 N 0.41 0.12 0.00 0.81 2.47 -1.77 -3.24 114.38 113.18 1s4f h ARG 439 Ca 0.69 -0.01 -0.23 0.00 -1.26 0.00 0.00 59.98 59.17 1s4f h ARG 439 Cb 1.56 -0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 29.82 1s4f h ARG 439 CO -0.51 0.09 -1.30 0.28 0.56 0.00 0.00 179.97 179.09 1s4f h VAL 440 N 0.11 1.15 -3.36 2.04 2.07 -0.24 -3.49 116.25 114.52 1s4f h VAL 440 Ca 0.03 -2.87 -0.04 0.00 0.82 0.00 0.00 66.70 64.64 1s4f h VAL 440 Cb -0.00 2.54 -0.12 0.00 -1.52 0.00 0.00 31.29 32.19 1s4f h VAL 440 CO -0.01 0.65 -0.03 0.00 0.02 0.00 0.00 177.57 178.20 1s4f s ALA 441 N -2.71 -0.94 -0.07 1.67 0.00 0.37 -4.47 121.76 115.61 1s4f s ALA 441 Ca -0.02 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 51.89 1s4f s ALA 441 Cb 0.09 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 1s4f s ALA 441 CO 0.81 -0.70 -0.16 1.03 0.00 0.00 0.00 175.76 176.75 1s4f s ARG 442 N -3.83 2.76 0.18 0.00 1.81 -0.31 -3.83 118.95 115.72 1s4f s ARG 442 Ca 0.05 -0.74 0.10 0.00 -1.72 0.00 0.00 55.73 53.42 1s4f s ARG 442 Cb 0.01 -2.40 -0.04 0.00 -0.45 0.00 0.00 34.95 32.07 1s4f s ARG 442 CO -0.09 0.46 -0.15 -1.50 -0.68 0.00 0.00 175.30 173.34 1s4f s ILE 443 N -0.31 2.89 -0.20 1.52 2.07 -1.26 0.08 121.20 125.99 1s4f s ILE 443 Ca 0.02 -1.75 -0.04 0.00 -1.41 0.00 0.00 60.65 57.47 1s4f s ILE 443 Cb -0.13 -2.41 0.09 0.00 0.13 0.00 0.00 42.46 40.15 1s4f s ILE 443 CO 0.03 -0.08 0.20 -1.00 -1.91 0.00 0.00 174.94 172.18 1s4f s HIS 444 N -1.62 -0.20 -0.14 3.50 3.76 -0.24 -3.77 115.29 116.57 1s4f s HIS 444 Ca 0.23 0.10 -0.05 0.00 -0.15 0.00 0.00 55.06 55.19 1s4f s HIS 444 Cb -0.09 -0.43 -0.03 0.00 1.11 0.00 0.00 32.58 33.14 1s4f s HIS 444 CO 0.13 -0.61 0.01 0.14 -0.85 0.00 0.00 174.74 173.57 1s4f s VAL 445 N 2.30 4.39 -0.68 -0.90 -7.23 -1.02 -1.58 120.40 115.67 1s4f s VAL 445 Ca 0.06 -0.19 0.05 0.00 -1.81 0.00 0.00 61.98 60.09 1s4f s VAL 445 Cb -0.16 -2.92 0.26 0.00 0.56 0.00 0.00 36.38 34.12 1s4f s VAL 445 CO -0.13 0.52 0.82 0.00 -0.31 0.00 0.00 175.10 176.00 1s4f n GLY 447 N 0.88 2.42 0.41 0.00 0.00 -1.26 -1.63 105.19 106.01 1s4f n GLY 447 Ca 0.30 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.26 1s4f n GLY 447 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1s4f n ASP 448 N 9.66 1.60 -4.93 1.61 5.75 -1.26 -3.97 116.55 125.01 1s4f n ASP 448 Ca 0.00 -1.27 -0.25 0.00 -0.01 0.00 0.00 54.79 53.26 1s4f n ASP 448 Cb 0.00 0.26 -0.02 0.00 -1.03 0.00 0.00 41.12 40.33 1s4f n ASP 448 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1s4f s ASP 449 N -2.42 6.35 0.00 -1.12 2.15 -0.65 -4.68 116.67 116.30 1s4f s ASP 449 Ca 0.23 0.48 0.00 0.00 0.43 0.00 0.00 52.55 53.69 1s4f s ASP 449 Cb 0.19 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.77 1s4f s ASP 449 CO 0.51 -0.21 0.00 0.61 -0.17 0.00 0.00 175.17 175.91 1s4f n GLY 450 N -1.36 0.26 3.60 2.66 0.00 -1.26 0.11 105.19 109.19 1s4f n GLY 450 Ca -0.04 -1.19 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 1s4f n GLY 450 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1s4f s PHE 451 N -2.00 -0.38 0.06 1.61 -0.71 -0.61 0.15 117.98 116.10 1s4f s PHE 451 Ca 0.00 0.09 0.03 0.00 -1.04 0.00 0.00 56.93 56.01 1s4f s PHE 451 Cb 0.00 0.61 -0.03 0.00 -1.21 0.00 0.00 43.02 42.40 1s4f s PHE 451 CO 0.00 -0.95 -0.10 -0.48 -1.34 0.00 0.00 175.22 172.35 1s4f s LEU 452 N -2.79 2.30 -0.00 -1.99 2.34 -0.73 -1.08 118.68 116.72 1s4f s LEU 452 Ca 0.05 -0.63 0.03 0.00 0.06 0.00 0.00 54.13 53.65 1s4f s LEU 452 Cb -0.03 -0.26 -0.03 0.00 -0.56 0.00 0.00 46.19 45.31 1s4f s LEU 452 CO -0.05 -0.20 -0.08 -0.63 -1.06 0.00 0.00 176.35 174.34 1s4f s ILE 453 N -1.64 3.58 0.10 1.48 1.01 0.11 -1.26 121.20 124.58 1s4f s ILE 453 Ca -0.05 -0.77 -0.19 0.00 0.00 0.00 0.00 60.65 59.65 1s4f s ILE 453 Cb -0.08 -2.54 0.06 0.00 0.01 0.00 0.00 42.46 39.91 1s4f s ILE 453 CO 0.00 0.42 0.87 1.07 0.00 0.00 0.00 174.94 177.31 1s4f n THR 454 N 1.64 0.00 -2.48 2.92 5.66 -0.91 -1.16 114.28 119.95 1s4f n THR 454 Ca -0.16 -0.36 -0.41 0.00 -3.05 0.00 0.00 64.05 60.08 1s4f n THR 454 Cb 0.53 0.57 -0.04 0.00 -1.55 0.00 0.00 70.33 69.84 1s4f n THR 454 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1s4f s GLU 455 N -2.03 4.59 0.41 1.09 0.41 -1.26 -0.81 118.70 121.09 1s4f s GLU 455 Ca 0.20 1.78 0.35 0.00 -0.41 0.00 0.00 54.97 56.89 1s4f s GLU 455 Cb -0.02 -3.24 1.30 0.00 -1.78 0.00 0.00 34.13 30.39 1s4f s GLU 455 CO 0.03 0.09 1.22 1.17 -0.49 0.00 0.00 175.26 177.28 1s4f n LYS 456 N 2.01 -0.01 0.00 1.61 4.81 0.15 -1.57 118.16 125.15 1s4f n LYS 456 Ca 0.02 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1s4f n LYS 456 Cb 0.45 -1.95 0.00 0.00 0.02 0.00 0.00 35.03 33.55 1s4f n LYS 456 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1s4f n GLY 457 N -1.63 -1.98 0.24 3.14 0.00 -1.26 -2.54 105.19 101.15 1s4f n GLY 457 Ca 0.34 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.37 1s4f n GLY 457 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1s4f h LEU 458 N 0.00 0.13 -0.26 0.99 3.38 -1.84 -3.13 115.31 114.58 1s4f h LEU 458 Ca 0.00 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1s4f h LEU 458 Cb 0.00 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1s4f h LEU 458 CO 0.00 0.07 -0.16 1.23 0.09 0.00 0.00 178.44 179.67 1s4f h GLY 459 N 0.34 -2.21 2.00 0.83 0.00 -1.37 -0.50 103.07 102.16 1s4f h GLY 459 Ca 0.32 1.07 0.00 0.00 0.00 0.00 0.00 47.33 48.72 1s4f h GLY 459 CO -0.36 -0.75 0.00 1.41 0.00 0.00 0.00 176.54 176.84 1s4f h LEU 460 N -0.00 0.00 0.10 3.11 3.38 -1.44 0.45 115.31 120.91 1s4f h LEU 460 Ca 0.04 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.75 1s4f h LEU 460 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1s4f h LEU 460 CO -0.25 0.00 -1.22 0.50 0.09 0.00 0.00 178.44 177.56 1s4f h LYS 461 N 0.00 0.22 -0.72 1.13 3.64 -1.13 -3.05 116.57 116.66 1s4f h LYS 461 Ca 0.00 -0.38 -0.05 0.00 -1.27 0.00 0.00 60.65 58.95 1s4f h LYS 461 Cb 0.07 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1s4f h LYS 461 CO 0.00 1.17 0.26 0.35 -2.27 0.00 0.00 179.45 178.96 1s4f h PHE 462 N 0.06 1.13 0.87 1.91 3.57 0.52 0.51 116.94 125.51 1s4f h PHE 462 Ca -0.12 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.24 1s4f h PHE 462 Cb 1.94 -0.33 0.01 0.00 2.79 0.00 0.00 35.95 40.36 1s4f h PHE 462 CO 0.05 0.88 -0.42 0.00 -2.23 0.00 0.00 178.31 176.60 1s4f h ALA 463 N 1.12 -1.16 0.38 2.41 0.00 -1.42 0.34 119.26 120.93 1s4f h ALA 463 Ca 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1s4f h ALA 463 Cb 0.26 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1s4f h ALA 463 CO -0.01 -1.12 -0.18 -0.91 0.00 0.00 0.00 179.25 177.02 1s4f h ASN 464 N -1.23 -0.43 0.15 0.00 2.35 -1.42 -2.84 115.58 112.15 1s4f h ASN 464 Ca -0.12 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 1s4f h ASN 464 Cb 0.90 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.38 1s4f h ASN 464 CO 0.20 -0.26 -0.00 0.29 -1.65 0.00 0.00 177.43 176.00 1s4f n LYS 465 N -5.28 0.88 -0.00 0.81 5.02 0.18 -3.59 118.16 116.18 1s4f n LYS 465 Ca -0.11 -0.05 -0.15 0.00 -2.02 0.00 0.00 58.31 55.98 1s4f n LYS 465 Cb 0.23 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.61 1s4f n LYS 465 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s4f n GLY 466 N 1.08 -0.77 0.33 0.72 0.00 0.12 -3.26 105.19 103.41 1s4f n GLY 466 Ca 0.21 -0.16 0.22 0.00 0.00 0.00 0.00 46.02 46.29 1s4f n GLY 466 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1s4f h MET 467 N 0.04 0.21 0.00 1.61 2.86 -1.56 -0.44 114.93 117.64 1s4f h MET 467 Ca -0.35 -0.01 -0.18 0.00 -2.06 0.00 0.00 59.70 57.09 1s4f h MET 467 Cb 2.03 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 33.61 1s4f h MET 467 CO 0.09 0.14 -1.01 0.37 1.06 0.00 0.00 176.91 177.56 1s4f h GLN 468 N 0.22 0.00 -1.07 1.72 -0.00 -1.78 -2.79 115.11 111.41 1s4f h GLN 468 Ca 0.70 0.00 0.31 0.00 -0.00 0.00 0.00 58.65 59.66 1s4f h GLN 468 Cb 1.61 0.00 -0.04 0.00 0.00 0.00 0.00 27.48 29.04 1s4f h GLN 468 CO -0.67 0.98 0.79 0.82 0.00 0.00 0.00 178.83 180.76 1s4f h ILE 469 N -1.00 0.42 0.00 2.39 1.08 -1.44 -0.94 117.51 118.03 1s4f h ILE 469 Ca -0.28 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.18 1s4f h ILE 469 Cb 1.23 0.44 -0.00 0.00 -3.07 0.00 0.00 36.82 35.42 1s4f h ILE 469 CO -0.17 0.00 -0.16 -0.07 -0.69 0.00 0.00 178.15 177.06 1s4f h LEU 470 N 0.00 0.00 -1.57 1.44 3.38 -1.22 -3.35 115.31 113.99 1s4f h LEU 470 Ca 0.51 -0.25 0.33 0.00 0.09 0.00 0.00 57.88 58.57 1s4f h LEU 470 Cb 2.09 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.75 1s4f h LEU 470 CO -0.01 0.71 0.78 -0.74 0.09 0.00 0.00 178.44 179.28 1s4f h HIS 471 N -1.00 0.43 -0.62 1.13 2.76 -1.02 1.35 115.15 118.17 1s4f h HIS 471 Ca -0.02 0.02 -0.33 0.00 -2.20 0.00 0.00 60.37 57.83 1s4f h HIS 471 Cb 0.38 -0.12 -0.19 0.00 1.55 0.00 0.00 27.41 29.03 1s4f h HIS 471 CO 0.03 -0.01 0.42 -0.85 -1.30 0.00 0.00 177.93 176.22 1s4f n GLU 472 N -4.49 1.80 -0.15 5.26 0.28 -0.45 -3.47 120.64 119.42 1s4f n GLU 472 Ca 0.28 -1.89 0.01 0.00 -0.16 0.00 0.00 57.16 55.41 1s4f n GLU 472 Cb 1.13 -1.74 0.01 0.00 1.43 0.00 0.00 31.44 32.28 1s4f n GLU 472 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1s4f n ALA 473 N -0.48 1.58 -1.59 -1.84 0.00 0.46 -3.60 120.51 115.05 1s4f n ALA 473 Ca 0.37 -0.95 -0.09 0.00 0.00 0.00 0.00 53.44 52.78 1s4f n ALA 473 Cb 1.18 -0.18 -0.03 0.00 0.00 0.00 0.00 19.45 20.42 1s4f n ALA 473 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s4f n GLY 474 N -0.24 0.67 2.32 0.00 0.00 -1.21 -4.82 105.19 101.91 1s4f n GLY 474 Ca 0.02 -0.60 -0.22 0.00 0.00 0.00 0.00 46.02 45.22 1s4f n GLY 474 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s4f n LYS 475 N -2.42 1.35 -1.45 1.61 4.76 -1.17 -4.55 118.16 116.29 1s4f n LYS 475 Ca -0.09 -3.66 -0.40 0.00 -2.87 0.00 0.00 58.31 51.29 1s4f n LYS 475 Cb 0.39 -1.69 0.02 0.00 -1.84 0.00 0.00 35.03 31.92 1s4f n LYS 475 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1s4f n PRO 476 N 0.59 0.54 -4.53 1.97 -0.02 -1.26 -3.98 135.00 128.30 1s4f n PRO 476 Ca 0.25 0.20 -0.32 0.00 -2.02 0.00 0.00 63.50 61.61 1s4f n PRO 476 Cb 0.56 -1.58 -0.11 0.00 -0.02 0.00 0.00 33.50 32.35 1s4f n PRO 476 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1s4f s GLN 477 N -1.78 2.55 0.61 -0.52 -1.52 -1.26 -2.29 119.66 115.45 1s4f s GLN 477 Ca 0.65 -0.70 -0.19 0.00 -1.95 0.00 0.00 55.36 53.16 1s4f s GLN 477 Cb -0.52 -2.49 -0.03 0.00 -0.22 0.00 0.00 33.01 29.75 1s4f s GLN 477 CO 0.57 0.61 1.28 1.63 -0.25 0.00 0.00 175.29 179.13 1s4f n LYS 478 N 1.73 1.29 -3.75 2.91 5.02 -0.31 -4.81 118.16 120.25 1s4f n LYS 478 Ca -0.16 0.49 -0.37 0.00 -2.02 0.00 0.00 58.31 56.25 1s4f n LYS 478 Cb 0.53 -2.51 -0.06 0.00 -0.02 0.00 0.00 35.03 32.97 1s4f n LYS 478 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1s4f s ILE 479 N -1.36 5.35 0.24 -0.18 1.09 -1.26 -5.00 121.20 120.07 1s4f s ILE 479 Ca 0.78 0.42 -0.04 0.00 -1.10 0.00 0.00 60.65 60.71 1s4f s ILE 479 Cb -0.40 -3.51 -0.03 0.00 -1.06 0.00 0.00 42.46 37.47 1s4f s ILE 479 CO 0.44 0.60 0.27 -0.89 -0.10 0.00 0.00 174.94 175.26 1s4f s THR 480 N -0.99 0.00 0.42 2.92 2.01 -1.26 -5.02 115.64 113.72 1s4f s THR 480 Ca 0.18 -1.79 0.21 0.00 0.31 0.00 0.00 61.69 60.59 1s4f s THR 480 Cb -0.14 -2.43 0.23 0.00 0.01 0.00 0.00 72.50 70.17 1s4f s THR 480 CO 0.07 0.00 2.02 -0.33 -0.69 0.00 0.00 174.62 175.69 1s4f h GLU 481 N 2.43 0.00 -0.49 4.92 5.08 -1.98 -1.64 114.58 122.89 1s4f h GLU 481 Ca -0.31 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.99 1s4f h GLU 481 Cb 1.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 1s4f h GLU 481 CO 0.45 0.17 0.09 0.78 -1.00 0.00 0.00 179.01 179.50 1s4f h GLY 482 N 0.75 0.82 0.00 -3.84 0.00 -1.99 -3.46 103.07 95.35 1s4f h GLY 482 Ca -0.00 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1s4f h GLY 482 CO 0.02 0.46 0.00 1.18 0.00 0.00 0.00 176.54 178.20 1s4f n GLU 483 N -4.27 0.00 -4.63 4.80 1.02 -0.62 -4.96 120.64 111.98 1s4f n GLU 483 Ca 0.03 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.89 1s4f n GLU 483 Cb 0.24 -2.45 -0.11 0.00 -0.02 0.00 0.00 31.44 29.10 1s4f n GLU 483 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1s4f s LYS 484 N -0.06 1.98 0.93 3.49 -2.85 -1.26 -4.94 119.74 117.03 1s4f s LYS 484 Ca 0.00 -2.14 -0.11 0.00 -1.00 0.00 0.00 55.97 52.73 1s4f s LYS 484 Cb 0.00 -1.59 0.15 0.00 -2.06 0.00 0.00 37.83 34.33 1s4f s LYS 484 CO 0.00 -0.09 1.12 -1.64 0.10 0.00 0.00 175.35 174.84 1s4f s MET 485 N -3.74 0.91 0.01 1.78 -1.94 -1.18 -4.90 119.30 110.24 1s4f s MET 485 Ca 0.31 1.38 -0.30 0.00 -1.71 0.00 0.00 55.69 55.37 1s4f s MET 485 Cb 0.09 -1.73 -0.06 0.00 2.01 0.00 0.00 34.83 35.14 1s4f s MET 485 CO 0.16 -2.65 1.46 0.21 -0.01 0.00 0.00 175.02 174.19 1s4f s LYS 486 N -4.67 4.26 -0.09 2.03 2.36 -1.25 -4.88 119.74 117.50 1s4f s LYS 486 Ca 0.66 2.04 0.04 0.00 -2.55 0.00 0.00 55.97 56.17 1s4f s LYS 486 Cb -0.22 -3.59 -0.00 0.00 -1.05 0.00 0.00 37.83 32.96 1s4f s LYS 486 CO 0.59 -0.62 -0.23 0.08 1.55 0.00 0.00 175.35 176.72 1s4f s VAL 487 N 2.52 2.21 -0.19 4.02 1.01 -1.26 -1.12 120.40 127.59 1s4f s VAL 487 Ca 0.66 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 1s4f s VAL 487 Cb -0.33 -1.84 -0.00 0.00 0.00 0.00 0.00 36.38 34.21 1s4f s VAL 487 CO 0.28 0.56 -0.11 0.00 0.00 0.00 0.00 175.10 175.82 1s4f s ALA 488 N 0.20 2.61 -0.40 5.51 0.00 0.11 -4.97 121.76 124.82 1s4f s ALA 488 Ca -0.14 -1.12 0.23 0.00 0.00 0.00 0.00 51.96 50.93 1s4f s ALA 488 Cb -0.17 -1.42 -0.01 0.00 0.00 0.00 0.00 23.12 21.53 1s4f s ALA 488 CO 0.07 -0.24 0.96 0.66 0.00 0.00 0.00 175.76 177.21 1s4f n TYR 489 N 4.44 0.47 -4.86 0.00 4.02 -1.26 -1.31 117.16 118.66 1s4f n TYR 489 Ca -0.19 0.14 -0.33 0.00 -0.01 0.00 0.00 57.90 57.51 1s4f n TYR 489 Cb 0.51 -0.63 -0.13 0.00 -0.02 0.00 0.00 39.34 39.07 1s4f n TYR 489 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1s4f s ARG 490 N -3.30 2.53 0.24 -0.72 0.52 -1.26 -4.88 118.95 112.07 1s4f s ARG 490 Ca 0.01 -0.68 -0.05 0.00 -0.52 0.00 0.00 55.73 54.48 1s4f s ARG 490 Cb 0.13 -2.40 0.42 0.00 0.52 0.00 0.00 34.95 33.62 1s4f s ARG 490 CO 0.81 0.63 1.73 0.35 0.02 0.00 0.00 175.30 178.83 1s4f h PHE 491 N 5.34 0.46 0.00 -0.53 3.04 -1.98 -0.72 116.94 122.55 1s4f h PHE 491 Ca -0.47 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.52 1s4f h PHE 491 Cb 1.15 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.57 1s4f h PHE 491 CO 0.51 0.05 0.00 1.05 -2.02 0.00 0.00 178.31 177.90 1s4f h GLU 492 N 0.42 0.00 -0.00 1.11 4.11 -1.95 -2.42 114.58 115.84 1s4f h GLU 492 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.82 1s4f h GLU 492 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1s4f h GLU 492 CO -0.40 0.00 -0.03 -0.25 0.07 0.00 0.00 179.01 178.40 1s4f n ASP 493 N -2.48 0.14 -4.77 3.06 8.00 -0.28 -4.25 116.55 115.97 1s4f n ASP 493 Ca 0.01 -0.38 -0.40 0.00 0.71 0.00 0.00 54.79 54.74 1s4f n ASP 493 Cb 0.22 -0.19 -0.01 0.00 -0.02 0.00 0.00 41.12 41.12 1s4f n ASP 493 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1s4f s ILE 494 N -2.47 2.72 0.04 0.53 1.01 -0.91 -4.94 121.20 117.18 1s4f s ILE 494 Ca 0.31 0.67 0.09 0.00 0.00 0.00 0.00 60.65 61.72 1s4f s ILE 494 Cb 0.20 -3.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.25 1s4f s ILE 494 CO 0.45 0.11 -0.26 -0.70 0.00 0.00 0.00 174.94 174.55 1s4f s GLU 495 N -2.10 1.82 -0.29 2.79 2.56 -1.26 -4.08 118.70 118.14 1s4f s GLU 495 Ca 0.54 -1.10 -0.25 0.00 0.00 0.00 0.00 54.97 54.16 1s4f s GLU 495 Cb -0.38 -1.99 0.15 0.00 2.00 0.00 0.00 34.13 33.92 1s4f s GLU 495 CO 0.49 0.51 1.22 0.12 -0.56 0.00 0.00 175.26 177.04 1s4f s PHE 496 N -0.80 -0.29 -0.67 5.30 5.36 -0.02 -4.90 117.98 121.95 1s4f s PHE 496 Ca 0.12 0.70 0.00 0.00 -0.96 0.00 0.00 56.93 56.79 1s4f s PHE 496 Cb -0.10 0.42 0.00 0.00 -0.34 0.00 0.00 43.02 43.00 1s4f s PHE 496 CO 0.02 -0.14 0.00 0.00 -1.46 0.00 0.00 175.22 173.64 1s4f n SER 498 N -1.30 -2.89 -4.11 0.00 7.64 -1.26 -5.05 113.62 106.66 1s4f n SER 498 Ca -0.09 0.02 -0.09 0.00 1.01 0.00 0.00 58.87 59.72 1s4f n SER 498 Cb 0.50 -0.65 -0.10 0.00 -1.01 0.00 0.00 64.21 62.95 1s4f n SER 498 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1s4f s HIS 499 N -2.03 0.75 0.03 1.43 3.76 0.20 -4.84 115.29 114.59 1s4f s HIS 499 Ca 0.00 -1.15 0.02 0.00 -0.15 0.00 0.00 55.06 53.79 1s4f s HIS 499 Cb 0.00 -0.41 -0.02 0.00 1.11 0.00 0.00 32.58 33.26 1s4f s HIS 499 CO 0.00 -0.53 -0.08 -0.08 -0.85 0.00 0.00 174.74 173.20 1s4f s THR 500 N -4.02 0.59 0.13 1.30 -1.32 0.18 -0.84 115.64 111.66 1s4f s THR 500 Ca 0.21 -0.77 -0.34 0.00 -1.21 0.00 0.00 61.69 59.58 1s4f s THR 500 Cb 0.07 -0.59 -0.14 0.00 -1.51 0.00 0.00 72.50 70.33 1s4f s THR 500 CO 0.00 -0.14 1.58 -2.65 -2.21 0.00 0.00 174.62 171.20 1s4f n PRO 501 N 2.05 2.04 -4.01 7.08 -0.02 -1.26 0.45 135.00 141.33 1s4f n PRO 501 Ca -0.19 0.74 -0.31 0.00 -2.02 0.00 0.00 63.50 61.72 1s4f n PRO 501 Cb 0.56 -2.50 -0.16 0.00 -0.02 0.00 0.00 33.50 31.38 1s4f n PRO 501 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1s4f s VAL 502 N 1.17 1.77 0.20 -1.45 1.01 -0.72 -4.82 120.40 117.55 1s4f s VAL 502 Ca 0.81 -1.18 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 1s4f s VAL 502 Cb -0.71 -1.86 -0.11 0.00 0.00 0.00 0.00 36.38 33.70 1s4f s VAL 502 CO 0.40 0.10 1.59 -2.84 0.00 0.00 0.00 175.10 174.36 1s4f s PRO 503 N 1.32 4.19 -0.04 2.72 0.02 -1.26 -2.10 135.00 139.85 1s4f s PRO 503 Ca -0.03 2.43 -0.00 0.00 0.02 0.00 0.00 61.00 63.41 1s4f s PRO 503 Cb -0.17 -3.12 0.03 0.00 0.02 0.00 0.00 34.50 31.26 1s4f s PRO 503 CO -0.07 -0.62 0.01 0.08 -0.33 0.00 0.00 177.00 176.06 1s4f s VAL 504 N 0.92 0.20 -0.18 3.83 1.01 -0.90 0.15 120.40 125.43 1s4f s VAL 504 Ca 0.69 0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.78 1s4f s VAL 504 Cb -0.45 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 35.57 1s4f s VAL 504 CO 0.34 0.19 -0.04 -0.13 0.00 0.00 0.00 175.10 175.46 1s4f s ARG 505 N 1.49 3.55 0.70 2.72 1.81 0.72 -2.26 118.95 127.69 1s4f s ARG 505 Ca -0.03 -0.56 0.01 0.00 -1.72 0.00 0.00 55.73 53.42 1s4f s ARG 505 Cb -0.13 -2.96 0.12 0.00 -0.45 0.00 0.00 34.95 31.54 1s4f s ARG 505 CO -0.03 0.06 0.97 -1.58 -0.68 0.00 0.00 175.30 174.04 1s4f s TRP 506 N 0.83 1.49 0.14 -0.53 0.52 -0.96 -0.46 118.94 119.98 1s4f s TRP 506 Ca -0.01 -0.37 -0.18 0.00 0.02 0.00 0.00 56.10 55.56 1s4f s TRP 506 Cb -0.15 -2.87 0.01 0.00 -1.15 0.00 0.00 33.47 29.32 1s4f s TRP 506 CO 0.02 -1.65 1.73 0.66 0.02 0.00 0.00 176.95 177.72 1s4f h SER 507 N -0.44 -0.03 0.00 2.95 4.64 -1.52 -1.68 113.55 117.47 1s4f h SER 507 Ca -0.35 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1s4f h SER 507 Cb 1.27 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1s4f h SER 507 CO 0.40 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 175.48 1s4f n ASP 508 N -5.11 0.12 0.00 4.97 5.75 -1.26 -4.73 116.55 116.29 1s4f n ASP 508 Ca -0.01 -0.38 0.00 0.00 -0.01 0.00 0.00 54.79 54.39 1s4f n ASP 508 Cb 0.13 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 1s4f n ASP 508 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1s4f n ASN 509 N 0.07 -3.42 -4.79 -1.12 3.02 -0.63 -4.96 115.26 103.43 1s4f n ASN 509 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.27 1s4f n ASN 509 Cb 0.03 -2.91 0.10 0.00 -0.61 0.00 0.00 39.78 36.39 1s4f n ASN 509 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1s4f s THR 510 N -1.12 2.10 0.24 3.41 -4.23 -1.26 -4.84 115.64 109.93 1s4f s THR 510 Ca 0.00 -0.11 0.06 0.00 -1.18 0.00 0.00 61.69 60.45 1s4f s THR 510 Cb 0.00 -2.98 -0.05 0.00 1.34 0.00 0.00 72.50 70.80 1s4f s THR 510 CO 0.00 0.00 -0.06 -0.44 -0.54 0.00 0.00 174.62 173.58 1s4f s SER 511 N -4.61 2.33 0.16 3.99 0.01 -1.26 -2.26 113.70 112.06 1s4f s SER 511 Ca 0.63 -1.15 -0.23 0.00 1.31 0.00 0.00 55.95 56.51 1s4f s SER 511 Cb -0.10 -0.09 0.08 0.00 0.21 0.00 0.00 66.02 66.12 1s4f s SER 511 CO 0.48 -0.37 1.04 -0.94 0.41 0.00 0.00 173.24 173.86 1s4f s SER 512 N -3.35 -0.05 0.01 2.44 1.04 -0.96 -5.01 113.70 107.83 1s4f s SER 512 Ca 0.27 -0.57 0.03 0.00 0.48 0.00 0.00 55.95 56.16 1s4f s SER 512 Cb 0.04 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 1s4f s SER 512 CO 0.09 -0.92 -0.11 -1.00 0.98 0.00 0.00 173.24 172.28 1s4f s HIS 513 N -2.47 0.94 0.27 5.02 3.76 -1.26 -2.12 115.29 119.42 1s4f s HIS 513 Ca 0.19 -0.24 0.12 0.00 -0.15 0.00 0.00 55.06 54.97 1s4f s HIS 513 Cb -0.02 -0.59 -0.05 0.00 1.11 0.00 0.00 32.58 33.03 1s4f s HIS 513 CO 0.04 -0.01 -0.19 -1.64 -0.85 0.00 0.00 174.74 172.09 1s4f s MET 514 N -0.59 1.69 0.11 1.40 -1.94 -0.89 -4.18 119.30 114.90 1s4f s MET 514 Ca 0.02 -1.71 -0.31 0.00 -1.71 0.00 0.00 55.69 51.98 1s4f s MET 514 Cb -0.05 -1.81 -0.08 0.00 2.01 0.00 0.00 34.83 34.90 1s4f s MET 514 CO 0.00 0.34 1.52 0.00 -0.01 0.00 0.00 175.02 176.87 1s4f s ALA 515 N -2.37 3.68 0.34 3.03 0.00 -1.26 -1.76 121.76 123.43 1s4f s ALA 515 Ca 0.29 1.20 0.08 0.00 0.00 0.00 0.00 51.96 53.53 1s4f s ALA 515 Cb -0.06 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 1s4f s ALA 515 CO 0.15 -0.82 0.13 0.20 0.00 0.00 0.00 175.76 175.41 1s4f s GLY 516 N 1.53 1.98 0.04 0.00 0.00 0.17 -4.80 107.32 106.24 1s4f s GLY 516 Ca 0.69 -1.86 -0.29 0.00 0.00 0.00 0.00 44.72 43.26 1s4f s GLY 516 CO 0.31 -1.78 1.19 -1.60 0.00 0.00 0.00 173.10 171.21 1s4f s ARG 517 N -3.84 0.64 0.16 2.90 3.52 -1.26 -0.64 118.95 120.44 1s4f s ARG 517 Ca 0.38 -0.36 -0.31 0.00 -0.13 0.00 0.00 55.73 55.31 1s4f s ARG 517 Cb -0.02 0.22 -0.09 0.00 -1.56 0.00 0.00 34.95 33.50 1s4f s ARG 517 CO 0.22 -0.29 1.38 -0.51 -0.81 0.00 0.00 175.30 175.29 1s4f s ASP 518 N -3.00 6.81 0.15 -2.12 -0.00 -1.26 -4.84 116.67 112.41 1s4f s ASP 518 Ca 0.14 2.41 -0.18 0.00 -0.00 0.00 0.00 52.55 54.93 1s4f s ASP 518 Cb 0.03 -2.60 0.04 0.00 -0.00 0.00 0.00 42.92 40.39 1s4f s ASP 518 CO -0.02 -0.63 1.72 0.74 -0.00 0.00 0.00 175.17 176.98 1s4f h THR 519 N 3.97 0.80 -1.04 -1.27 2.02 -1.48 -1.60 112.91 114.32 1s4f h THR 519 Ca -0.44 -0.04 0.26 0.00 0.77 0.00 0.00 66.41 66.97 1s4f h THR 519 Cb 1.21 0.67 -0.10 0.00 -1.74 0.00 0.00 68.15 68.19 1s4f h THR 519 CO 0.82 0.02 0.66 0.00 0.37 0.00 0.00 175.52 177.39 1s4f h ALA 520 N 1.26 2.14 0.00 6.16 0.00 -1.91 0.30 119.26 127.20 1s4f h ALA 520 Ca 0.15 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 1s4f h ALA 520 Cb 0.19 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1s4f h ALA 520 CO -0.23 -0.56 -0.62 0.28 0.00 0.00 0.00 179.25 178.12 1s4f h VAL 521 N 0.43 0.76 0.11 0.00 2.07 -1.67 -2.89 116.25 115.06 1s4f h VAL 521 Ca 0.61 -2.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 1s4f h VAL 521 Cb 1.45 2.34 0.00 0.00 -1.52 0.00 0.00 31.29 33.56 1s4f h VAL 521 CO -0.34 0.43 -0.05 0.40 0.02 0.00 0.00 177.57 178.03 1s4f h ILE 522 N 0.00 0.96 -0.74 4.57 2.04 0.08 -1.10 117.51 123.33 1s4f h ILE 522 Ca -0.03 -1.30 0.16 0.00 1.00 0.00 0.00 64.86 64.69 1s4f h ILE 522 Cb 1.39 1.66 -0.11 0.00 -0.74 0.00 0.00 36.82 39.03 1s4f h ILE 522 CO 0.06 0.27 0.20 -0.07 0.00 0.00 0.00 178.15 178.60 1s4f h LEU 523 N -0.87 0.06 -0.02 1.44 3.38 -1.06 0.55 115.31 118.79 1s4f h LEU 523 Ca -0.02 0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1s4f h LEU 523 Cb 0.55 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 1s4f h LEU 523 CO 0.03 -0.02 -0.28 0.28 0.09 0.00 0.00 178.44 178.54 1s4f h SER 524 N 0.29 -0.83 0.92 -0.43 0.02 -1.44 0.95 113.55 113.04 1s4f h SER 524 Ca 0.42 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1s4f h SER 524 Cb 0.70 0.34 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1s4f h SER 524 CO -0.49 -0.34 0.00 0.11 -1.14 0.00 0.00 176.83 174.97 1s4f h LYS 525 N -0.41 0.00 0.00 3.45 1.57 0.18 -0.58 116.57 120.78 1s4f h LYS 525 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1s4f h LYS 525 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1s4f h LYS 525 CO -0.25 0.00 -0.67 -0.12 -0.57 0.00 0.00 179.45 177.83 1s4f n MET 526 N -2.65 0.02 -0.01 3.15 1.56 0.18 -3.51 117.12 115.87 1s4f n MET 526 Ca 0.02 0.00 -0.01 0.00 -0.27 0.00 0.00 57.70 57.44 1s4f n MET 526 Cb 0.28 -1.51 -0.02 0.00 2.15 0.00 0.00 33.22 34.12 1s4f n MET 526 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1s4f n ALA 527 N -1.53 1.96 0.57 -5.12 0.00 0.16 -4.57 120.51 111.97 1s4f n ALA 527 Ca 0.05 -0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.48 1s4f n ALA 527 Cb 0.34 0.18 0.38 0.00 0.00 0.00 0.00 19.45 20.35 1s4f n ALA 527 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1s4f h THR 528 N 0.00 0.00 -3.94 0.00 1.35 -1.29 -2.89 112.91 106.14 1s4f h THR 528 Ca -0.06 -0.54 -0.56 0.00 -0.55 0.00 0.00 66.41 64.71 1s4f h THR 528 Cb 1.05 1.53 0.17 0.00 -1.73 0.00 0.00 68.15 69.16 1s4f h THR 528 CO 0.00 0.00 0.31 -1.14 -0.25 0.00 0.00 175.52 174.45 1s4f n ARG 529 N -2.37 0.79 -3.92 4.72 3.00 -1.23 -4.86 116.66 112.79 1s4f n ARG 529 Ca 0.05 0.33 -0.09 0.00 -0.00 0.00 0.00 57.85 58.13 1s4f n ARG 529 Cb 0.44 -2.37 -0.07 0.00 0.00 0.00 0.00 32.46 30.45 1s4f n ARG 529 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1s4f s LEU 530 N -3.80 0.99 0.00 6.15 1.43 -1.26 -4.28 118.68 117.92 1s4f s LEU 530 Ca 0.78 -0.79 -0.02 0.00 -1.03 0.00 0.00 54.13 53.06 1s4f s LEU 530 Cb -0.36 1.22 -0.01 0.00 0.03 0.00 0.00 46.19 47.06 1s4f s LEU 530 CO 0.45 -0.87 0.83 -0.78 0.23 0.00 0.00 176.35 176.21 1s4f h ASP 531 N 2.56 -0.07 -3.65 2.29 1.82 0.54 -3.43 116.42 116.49 1s4f h ASP 531 Ca -0.32 0.00 -0.67 0.00 -0.39 0.00 0.00 57.03 55.65 1s4f h ASP 531 Cb 1.22 0.02 -0.23 0.00 0.68 0.00 0.00 39.33 41.02 1s4f h ASP 531 CO 0.49 -0.04 -0.57 -0.55 -1.61 0.00 0.00 179.24 176.96 1s4f s SER 532 N -2.35 5.46 0.00 2.28 0.15 -1.26 -4.95 113.70 113.04 1s4f s SER 532 Ca -0.01 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.11 1s4f s SER 532 Cb 0.00 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 1s4f s SER 532 CO 0.03 -0.18 0.49 -1.20 1.20 0.00 0.00 173.24 173.58 1s4f n SER 533 N 4.96 0.00 -0.05 5.45 7.64 -1.26 -5.13 113.62 125.24 1s4f n SER 533 Ca -0.14 -1.36 -0.05 0.00 1.01 0.00 0.00 58.87 58.33 1s4f n SER 533 Cb 0.49 -0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.62 1s4f n SER 533 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1s4f n ARG 536 N 3.03 0.29 0.00 1.43 0.63 -1.26 -5.14 116.66 115.64 1s4f n ARG 536 Ca 0.00 0.12 0.00 0.00 -0.92 0.00 0.00 57.85 57.05 1s4f n ARG 536 Cb 0.00 -0.99 0.00 0.00 0.45 0.00 0.00 32.46 31.92 1s4f n ARG 536 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1s4f n GLY 537 N 1.73 4.39 0.00 5.14 0.00 -1.26 0.34 105.19 115.53 1s4f n GLY 537 Ca -0.08 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1s4f n GLY 537 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1s4f n THR 538 N -1.55 0.00 0.05 2.61 -2.24 -1.26 -4.96 114.28 106.93 1s4f n THR 538 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1s4f n THR 538 Cb 0.00 -0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 67.31 1s4f n THR 538 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1s4f h THR 539 N 0.01 0.82 0.00 4.28 2.02 -2.01 -2.88 112.91 115.15 1s4f h THR 539 Ca 0.00 -2.39 -0.12 0.00 0.77 0.00 0.00 66.41 64.66 1s4f h THR 539 Cb 0.00 2.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.70 1s4f h THR 539 CO 0.00 0.47 -0.59 0.00 0.37 0.00 0.00 175.52 175.77 1s4f h ALA 540 N 1.29 0.94 0.13 6.16 0.00 -1.92 -2.29 119.26 123.56 1s4f h ALA 540 Ca -0.14 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.23 1s4f h ALA 540 Cb 1.66 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1s4f h ALA 540 CO 0.07 0.74 -0.06 -0.92 0.00 0.00 0.00 179.25 179.07 1s4f h TYR 541 N 0.00 -0.17 -1.18 0.00 3.20 -1.91 0.90 116.97 117.82 1s4f h TYR 541 Ca -0.01 -0.00 0.36 0.00 3.14 0.00 0.00 58.73 62.22 1s4f h TYR 541 Cb 1.10 0.06 -0.12 0.00 1.54 0.00 0.00 36.73 39.31 1s4f h TYR 541 CO 0.00 -0.10 0.75 0.93 -1.64 0.00 0.00 178.16 178.10 1s4f h GLU 542 N -0.99 0.22 -0.10 1.82 5.08 -1.57 0.91 114.58 119.95 1s4f h GLU 542 Ca -0.02 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1s4f h GLU 542 Cb 0.14 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1s4f h GLU 542 CO 0.03 0.14 -0.40 0.87 -1.00 0.00 0.00 179.01 178.65 1s4f h LYS 543 N 0.22 0.23 0.00 2.33 1.57 -1.49 0.45 116.57 119.88 1s4f h LYS 543 Ca 0.72 -0.10 -0.13 0.00 -1.87 0.00 0.00 60.65 59.26 1s4f h LYS 543 Cb 2.07 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.36 1s4f h LYS 543 CO -0.38 0.60 -0.63 0.00 -0.57 0.00 0.00 179.45 178.46 1s4f h ALA 544 N 1.39 0.80 0.59 3.86 0.00 0.80 -1.26 119.26 125.44 1s4f h ALA 544 Ca 0.02 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 1s4f h ALA 544 Cb 0.80 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1s4f h ALA 544 CO 0.06 0.79 -0.28 0.28 0.00 0.00 0.00 179.25 180.10 1s4f h VAL 545 N 0.00 0.00 -1.01 0.00 2.07 -0.06 0.20 116.25 117.45 1s4f h VAL 545 Ca -0.01 -0.29 0.24 0.00 0.82 0.00 0.00 66.70 67.46 1s4f h VAL 545 Cb 1.24 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.90 1s4f h VAL 545 CO 0.08 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.29 1s4f h ALA 546 N -1.34 1.85 0.49 1.67 0.00 -0.14 0.19 119.26 121.98 1s4f h ALA 546 Ca -0.08 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1s4f h ALA 546 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1s4f h ALA 546 CO 0.13 -0.29 -0.24 0.35 0.00 0.00 0.00 179.25 179.21 1s4f h PHE 547 N 0.59 -0.61 -0.68 0.00 3.57 -1.12 -1.66 116.94 117.04 1s4f h PHE 547 Ca 0.62 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 62.21 1s4f h PHE 547 Cb 1.20 0.20 -0.08 0.00 2.79 0.00 0.00 35.95 40.06 1s4f h PHE 547 CO -0.00 -0.29 0.28 0.77 -2.23 0.00 0.00 178.31 176.84 1s4f h SER 548 N -0.92 0.31 0.42 0.41 0.02 0.83 0.69 113.55 115.30 1s4f h SER 548 Ca -0.07 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1s4f h SER 548 Cb 0.60 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 1s4f h SER 548 CO 0.11 0.16 -0.11 -0.26 -1.14 0.00 0.00 176.83 175.59 1s4f h PHE 549 N 0.47 0.00 -0.08 3.45 -1.00 -0.69 -2.88 116.94 116.22 1s4f h PHE 549 Ca 0.35 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.10 1s4f h PHE 549 Cb 0.44 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.00 1s4f h PHE 549 CO -0.15 0.11 -0.04 1.25 -1.61 0.00 0.00 178.31 177.87 1s4f h LEU 550 N 0.00 0.18 0.00 1.54 6.46 0.13 0.28 115.31 123.90 1s4f h LEU 550 Ca -0.00 -0.42 0.00 0.00 -0.12 0.00 0.00 57.88 57.34 1s4f h LEU 550 Cb 0.35 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 1s4f h LEU 550 CO 0.01 0.56 0.00 0.18 -0.62 0.00 0.00 178.44 178.58 1s4f n LEU 551 N -4.75 0.00 -0.03 2.25 4.77 -0.64 -1.98 117.00 116.62 1s4f n LEU 551 Ca -0.07 0.42 -0.02 0.00 -0.03 0.00 0.00 56.01 56.31 1s4f n LEU 551 Cb 0.27 -0.42 -0.07 0.00 -2.33 0.00 0.00 43.42 40.87 1s4f n LEU 551 CO 0.36 -0.28 -0.73 0.23 -1.33 0.00 0.00 177.39 175.64 1s4f n MET 552 N -1.42 2.06 -2.47 3.23 2.81 -1.02 -4.57 117.12 115.74 1s4f n MET 552 Ca 0.03 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1s4f n MET 552 Cb 0.10 -1.21 0.04 0.00 -0.71 0.00 0.00 33.22 31.45 1s4f n MET 552 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1s4f n TYR 553 N -2.18 0.99 0.25 2.03 4.02 0.95 -4.52 117.16 118.70 1s4f n TYR 553 Ca -0.10 -1.74 0.08 0.00 -0.01 0.00 0.00 57.90 56.13 1s4f n TYR 553 Cb 0.63 -0.21 0.64 0.00 -0.02 0.00 0.00 39.34 40.38 1s4f n TYR 553 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1s4f h SER 554 N 2.19 0.00 0.07 7.72 4.64 -1.58 -0.85 113.55 125.73 1s4f h SER 554 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1s4f h SER 554 Cb 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 1s4f h SER 554 CO 0.18 0.06 0.00 4.11 -0.87 0.00 0.00 176.83 180.31 1s4f h TRP 555 N 0.00 0.00 -3.20 4.77 5.08 -1.87 -3.38 115.95 117.35 1s4f h TRP 555 Ca -0.00 0.00 -0.75 0.00 1.08 0.00 0.00 58.89 59.22 1s4f h TRP 555 Cb 0.12 0.00 -0.23 0.00 -3.00 0.00 0.00 29.16 26.05 1s4f h TRP 555 CO 0.00 0.00 -0.27 1.21 -1.28 0.00 0.00 178.44 178.10 1s4f s ASN 556 N -4.15 6.17 0.22 0.11 2.47 -0.32 -4.84 114.94 114.59 1s4f s ASN 556 Ca -0.02 -1.53 -0.16 0.00 0.42 0.00 0.00 52.86 51.57 1s4f s ASN 556 Cb 0.07 -2.20 0.24 0.00 -1.45 0.00 0.00 41.25 37.91 1s4f s ASN 556 CO 0.23 -0.75 1.58 -0.65 -3.72 0.00 0.00 177.10 173.79 1s4f h PRO 557 N 8.82 -0.06 0.62 0.43 0.11 -1.85 0.35 132.00 140.42 1s4f h PRO 557 Ca -0.29 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 1s4f h PRO 557 Cb 1.11 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1s4f h PRO 557 CO 0.95 -0.04 -0.32 1.25 -0.21 0.00 0.00 178.00 179.64 1s4f h LEU 558 N -0.06 -0.77 -0.51 2.35 6.46 -1.94 -2.08 115.31 118.76 1s4f h LEU 558 Ca 0.32 0.03 0.10 0.00 -0.12 0.00 0.00 57.88 58.22 1s4f h LEU 558 Cb 0.59 0.21 -0.09 0.00 -0.73 0.00 0.00 40.66 40.64 1s4f h LEU 558 CO -0.84 -0.52 -0.02 0.58 -0.62 0.00 0.00 178.44 177.02 1s4f h VAL 559 N -0.86 0.57 -0.60 1.05 2.07 -1.79 -1.92 116.25 114.77 1s4f h VAL 559 Ca -0.08 -0.03 0.12 0.00 0.82 0.00 0.00 66.70 67.53 1s4f h VAL 559 Cb 0.67 0.47 -0.10 0.00 -1.52 0.00 0.00 31.29 30.81 1s4f h VAL 559 CO 0.12 0.02 0.01 -0.09 0.02 0.00 0.00 177.57 177.65 1s4f h ARG 560 N 0.09 0.12 -0.01 1.57 2.43 -0.25 -1.84 114.38 116.49 1s4f h ARG 560 Ca 0.26 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.31 1s4f h ARG 560 Cb 0.40 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1s4f h ARG 560 CO -0.45 0.08 -0.51 0.00 -1.51 0.00 0.00 179.97 177.58 1s4f h ARG 561 N 0.13 0.04 -0.31 0.20 3.08 -0.63 -2.11 114.38 114.77 1s4f h ARG 561 Ca 0.31 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.22 1s4f h ARG 561 Cb 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1s4f h ARG 561 CO -0.50 0.54 -0.28 0.82 -1.07 0.00 0.00 179.97 179.47 1s4f h ILE 562 N 0.03 1.30 -0.71 2.04 2.04 -0.91 0.20 117.51 121.50 1s4f h ILE 562 Ca -0.00 -1.44 -0.00 0.00 1.00 0.00 0.00 64.86 64.41 1s4f h ILE 562 Cb 0.91 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 1s4f h ILE 562 CO 0.07 0.47 0.43 0.00 0.00 0.00 0.00 178.15 179.12 1s4f h LEU 564 N 0.97 -0.76 -1.80 0.00 3.38 -1.14 0.35 115.31 116.31 1s4f h LEU 564 Ca 0.26 -0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.39 1s4f h LEU 564 Cb -0.04 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1s4f h LEU 564 CO -0.05 -0.47 0.62 -0.07 0.09 0.00 0.00 178.44 178.56 1s4f h LEU 565 N -1.02 0.00 0.14 1.67 3.38 -0.35 0.89 115.31 120.01 1s4f h LEU 565 Ca -0.09 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.69 1s4f h LEU 565 Cb 0.72 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.49 1s4f h LEU 565 CO 0.15 0.00 -0.81 0.58 0.09 0.00 0.00 178.44 178.45 1s4f h VAL 566 N 0.00 1.52 -0.38 1.22 2.07 -0.11 -3.30 116.25 117.26 1s4f h VAL 566 Ca 0.27 -2.54 -0.03 0.00 0.82 0.00 0.00 66.70 65.23 1s4f h VAL 566 Cb 1.51 3.21 -0.02 0.00 -1.52 0.00 0.00 31.29 34.47 1s4f h VAL 566 CO -0.00 0.72 0.11 -0.07 0.02 0.00 0.00 177.57 178.34 1s4f h LEU 567 N -0.37 0.51 0.00 2.57 3.38 0.45 -1.85 115.31 119.99 1s4f h LEU 567 Ca -0.14 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1s4f h LEU 567 Cb 1.64 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1s4f h LEU 567 CO 0.15 0.50 0.00 -1.20 0.09 0.00 0.00 178.44 177.98 1s4f n SER 568 N -4.35 0.00 -4.69 -0.43 7.64 0.21 -4.60 113.62 107.40 1s4f n SER 568 Ca 0.02 -0.37 -0.35 0.00 1.01 0.00 0.00 58.87 59.19 1s4f n SER 568 Cb 0.18 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.29 1s4f n SER 568 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1s4f s GLN 569 N -2.00 3.96 -1.22 1.43 -0.21 -0.70 -4.68 119.66 116.24 1s4f s GLN 569 Ca 0.10 -0.28 -0.13 0.00 0.02 0.00 0.00 55.36 55.06 1s4f s GLN 569 Cb 0.04 -3.26 -0.01 0.00 1.00 0.00 0.00 33.01 30.78 1s4f s GLN 569 CO 0.07 0.35 0.69 1.04 -2.12 0.00 0.00 175.29 175.32 1s4f n GLN 570 N 3.32 -2.14 0.00 2.91 6.02 -1.26 -4.77 117.38 121.46 1s4f n GLN 570 Ca -0.17 0.46 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 1s4f n GLN 570 Cb 0.52 -4.35 0.00 0.00 1.02 0.00 0.00 30.24 27.44 1s4f n GLN 570 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1s4f n PRO 571 N -4.24 0.04 -0.01 -1.09 -0.02 -1.26 -2.05 135.00 126.37 1s4f n PRO 571 Ca -0.17 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.29 1s4f n PRO 571 Cb 0.62 -1.46 -0.01 0.00 -0.02 0.00 0.00 33.50 32.64 1s4f n PRO 571 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1s4f n GLU 572 N 0.96 0.10 -1.70 -0.52 1.02 -1.26 -4.97 120.64 114.26 1s4f n GLU 572 Ca 0.00 0.04 -0.54 0.00 -0.02 0.00 0.00 57.16 56.64 1s4f n GLU 572 Cb 0.02 -0.51 -0.06 0.00 -0.02 0.00 0.00 31.44 30.87 1s4f n GLU 572 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1s4f n THR 573 N -3.06 0.41 -2.92 2.62 -2.24 -0.87 -4.91 114.28 103.31 1s4f n THR 573 Ca -0.03 -0.07 -0.39 0.00 -2.27 0.00 0.00 64.05 61.29 1s4f n THR 573 Cb 0.09 -1.46 -0.06 0.00 -2.10 0.00 0.00 70.33 66.80 1s4f n THR 573 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1s4f s ASP 574 N 3.74 7.39 1.04 3.42 1.01 -1.26 -4.95 116.67 127.06 1s4f s ASP 574 Ca 0.96 1.71 -0.23 0.00 0.71 0.00 0.00 52.55 55.71 1s4f s ASP 574 Cb -0.93 -2.52 -0.07 0.00 1.01 0.00 0.00 42.92 40.40 1s4f s ASP 574 CO 0.61 0.13 -0.81 -2.65 0.21 0.00 0.00 175.17 172.65 1s4f n PRO 575 N 1.28 -0.58 -1.96 8.23 -0.02 -1.26 -4.83 135.00 135.86 1s4f n PRO 575 Ca -0.03 -0.16 -0.29 0.00 -2.02 0.00 0.00 63.50 61.00 1s4f n PRO 575 Cb 0.49 -1.30 0.13 0.00 -0.02 0.00 0.00 33.50 32.80 1s4f n PRO 575 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1s4f s SER 576 N -1.36 3.96 0.00 2.55 0.15 0.31 -4.90 113.70 114.41 1s4f s SER 576 Ca 0.45 0.51 0.00 0.00 0.70 0.00 0.00 55.95 57.61 1s4f s SER 576 Cb -0.02 -0.83 0.00 0.00 -1.71 0.00 0.00 66.02 63.46 1s4f s SER 576 CO 0.68 -2.22 0.34 0.29 1.20 0.00 0.00 173.24 173.53 1s4f n LYS 577 N -3.46 0.62 0.08 5.44 5.02 -1.26 -4.68 118.16 119.92 1s4f n LYS 577 Ca 0.11 -0.34 -0.08 0.00 -2.02 0.00 0.00 58.31 55.98 1s4f n LYS 577 Cb 0.60 -0.83 0.00 0.00 -0.02 0.00 0.00 35.03 34.79 1s4f n LYS 577 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1s4f h HIS 578 N 0.00 0.29 -2.83 2.13 3.86 -1.93 0.27 115.15 116.94 1s4f h HIS 578 Ca 0.00 -0.16 -0.34 0.00 -1.16 0.00 0.00 60.37 58.71 1s4f h HIS 578 Cb 0.05 -0.03 0.20 0.00 1.06 0.00 0.00 27.41 28.69 1s4f h HIS 578 CO 0.00 0.95 -0.14 0.00 0.86 0.00 0.00 177.93 179.60 1s4f n ALA 579 N -2.46 -4.80 -0.33 2.45 0.00 -1.26 -2.89 120.51 111.22 1s4f n ALA 579 Ca -0.03 -1.44 -0.01 0.00 0.00 0.00 0.00 53.44 51.95 1s4f n ALA 579 Cb 0.79 -0.13 0.12 0.00 0.00 0.00 0.00 19.45 20.23 1s4f n ALA 579 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1s4f h THR 580 N -3.48 1.16 -3.78 0.00 2.02 -1.88 0.26 112.91 107.20 1s4f h THR 580 Ca -0.37 -0.40 -0.10 0.00 0.77 0.00 0.00 66.41 66.32 1s4f h THR 580 Cb 1.24 -0.09 -0.15 0.00 -1.74 0.00 0.00 68.15 67.41 1s4f h THR 580 CO 0.22 0.21 -0.41 -0.31 0.37 0.00 0.00 175.52 175.60 1s4f s TYR 581 N -6.10 0.16 0.06 3.16 4.12 -1.26 -1.68 117.35 115.81 1s4f s TYR 581 Ca -0.13 -0.54 -0.14 0.00 0.02 0.00 0.00 57.07 56.28 1s4f s TYR 581 Cb 0.18 -0.08 0.02 0.00 -1.52 0.00 0.00 41.96 40.56 1s4f s TYR 581 CO 0.80 -0.49 0.33 1.52 0.02 0.00 0.00 175.55 177.73 1s4f s TYR 582 N -3.46 -0.13 0.05 2.71 -0.85 -0.58 -4.55 117.35 110.53 1s4f s TYR 582 Ca 0.02 -0.05 0.09 0.00 -0.52 0.00 0.00 57.07 56.62 1s4f s TYR 582 Cb 0.03 0.13 -0.03 0.00 0.38 0.00 0.00 41.96 42.48 1s4f s TYR 582 CO -0.09 -0.55 -0.26 1.52 -1.52 0.00 0.00 175.55 174.65 1s4f s TYR 583 N -2.86 2.30 -0.30 -3.49 -0.85 -1.26 -1.09 117.35 109.80 1s4f s TYR 583 Ca -0.03 -0.41 -0.05 0.00 -0.52 0.00 0.00 57.07 56.06 1s4f s TYR 583 Cb 0.00 -1.38 0.02 0.00 0.38 0.00 0.00 41.96 40.99 1s4f s TYR 583 CO -0.05 0.13 0.05 0.21 -1.52 0.00 0.00 175.55 174.37 1s4f s LYS 584 N -1.26 2.85 0.00 -3.49 2.20 -0.81 -4.72 119.74 114.52 1s4f s LYS 584 Ca 0.12 -1.01 0.00 0.00 -0.36 0.00 0.00 55.97 54.72 1s4f s LYS 584 Cb -0.10 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 32.92 1s4f s LYS 584 CO 0.02 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 174.91 1s4f n GLY 585 N 4.79 0.52 3.68 5.54 0.00 -1.26 -1.75 105.19 116.71 1s4f n GLY 585 Ca -0.14 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 1s4f n GLY 585 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s4f s ASP 586 N -4.00 6.40 0.14 1.61 3.68 0.04 -4.95 116.67 119.59 1s4f s ASP 586 Ca 0.00 0.46 -0.27 0.00 2.13 0.00 0.00 52.55 54.87 1s4f s ASP 586 Cb 0.00 -2.20 -0.02 0.00 -1.45 0.00 0.00 42.92 39.25 1s4f s ASP 586 CO 0.00 -0.02 1.58 -0.65 0.13 0.00 0.00 175.17 176.21 1s4f h PRO 587 N 7.24 -0.38 0.00 4.34 0.11 -1.91 0.40 132.00 141.80 1s4f h PRO 587 Ca -0.37 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 1s4f h PRO 587 Cb 1.16 0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1s4f h PRO 587 CO 0.72 -0.25 -0.07 0.82 -0.21 0.00 0.00 178.00 179.01 1s4f h ILE 588 N -0.39 0.46 -0.23 4.15 1.08 -1.94 -0.71 117.51 119.94 1s4f h ILE 588 Ca 0.11 -0.33 -0.11 0.00 -0.39 0.00 0.00 64.86 64.15 1s4f h ILE 588 Cb 0.60 1.22 -0.00 0.00 -3.07 0.00 0.00 36.82 35.56 1s4f h ILE 588 CO -0.49 0.07 -0.28 1.23 -0.69 0.00 0.00 178.15 177.99 1s4f h GLY 589 N 0.58 0.64 1.82 5.37 0.00 -0.48 -2.99 103.07 108.01 1s4f h GLY 589 Ca -0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 47.33 46.56 1s4f h GLY 589 CO 0.01 0.62 -0.31 0.00 0.00 0.00 0.00 176.54 176.85 1s4f h ALA 590 N 0.65 1.27 0.42 3.60 0.00 0.50 -1.81 119.26 123.88 1s4f h ALA 590 Ca 0.03 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1s4f h ALA 590 Cb 0.85 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1s4f h ALA 590 CO 0.07 0.50 -0.39 -0.92 0.00 0.00 0.00 179.25 178.50 1s4f h TYR 591 N 0.19 -1.06 -0.66 0.00 3.20 -1.18 -1.81 116.97 115.63 1s4f h TYR 591 Ca 0.03 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.03 1s4f h TYR 591 Cb 0.65 0.41 -0.10 0.00 1.54 0.00 0.00 36.73 39.24 1s4f h TYR 591 CO 0.01 -0.55 0.15 -0.22 -1.64 0.00 0.00 178.16 175.91 1s4f h LYS 592 N -0.82 0.26 -0.74 1.82 3.11 -1.37 0.33 116.57 119.15 1s4f h LYS 592 Ca -0.04 -0.02 0.12 0.00 -2.81 0.00 0.00 60.65 57.91 1s4f h LYS 592 Cb 0.73 -0.06 -0.13 0.00 -1.00 0.00 0.00 32.23 31.77 1s4f h LYS 592 CO -0.05 0.17 -0.36 0.22 -2.81 0.00 0.00 179.45 176.62 1s4f h ASP 593 N 0.26 -1.28 0.01 4.20 -0.00 -0.47 -0.77 116.42 118.38 1s4f h ASP 593 Ca 0.36 0.26 -0.38 0.00 -0.00 0.00 0.00 57.03 57.27 1s4f h ASP 593 Cb 0.57 0.65 -0.07 0.00 -0.00 0.00 0.00 39.33 40.48 1s4f h ASP 593 CO -0.45 -0.30 -2.42 1.33 -0.00 0.00 0.00 179.24 177.40 1s4f n VAL 594 N -5.45 1.48 -0.22 2.25 0.24 -1.02 -4.45 118.33 111.17 1s4f n VAL 594 Ca 0.06 -0.65 -0.05 0.00 -2.04 0.00 0.00 64.34 61.65 1s4f n VAL 594 Cb 0.37 -1.17 0.05 0.00 -1.47 0.00 0.00 33.84 31.61 1s4f n VAL 594 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1s4f h ILE 595 N 0.00 1.13 0.00 1.34 1.08 -0.36 -3.47 117.51 117.24 1s4f h ILE 595 Ca -0.56 -0.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.63 1s4f h ILE 595 Cb 2.00 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 36.00 1s4f h ILE 595 CO -0.05 0.15 0.00 0.61 -0.69 0.00 0.00 178.15 178.17 1s4f n GLY 596 N -1.27 1.56 0.00 5.37 0.00 -0.30 -5.04 105.19 105.51 1s4f n GLY 596 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1s4f n GLY 596 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s4f n ARG 597 N -1.19 0.64 -4.75 1.61 1.74 -1.25 -5.02 116.66 108.44 1s4f n ARG 597 Ca 0.00 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 1s4f n ARG 597 Cb 0.00 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.31 1s4f n ARG 597 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1s4f s ASN 598 N -0.44 3.90 0.33 0.55 0.01 -1.26 -3.32 114.94 114.71 1s4f s ASN 598 Ca 0.00 -0.33 0.10 0.00 -0.71 0.00 0.00 52.86 51.92 1s4f s ASN 598 Cb 0.00 -0.71 0.87 0.00 0.41 0.00 0.00 41.25 41.82 1s4f s ASN 598 CO 0.00 0.29 1.77 0.25 -1.51 0.00 0.00 177.10 177.90 1s4f h LEU 599 N 4.83 0.67 -1.66 0.60 6.46 -1.86 0.35 115.31 124.70 1s4f h LEU 599 Ca -0.47 0.10 0.04 0.00 -0.12 0.00 0.00 57.88 57.43 1s4f h LEU 599 Cb 1.15 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 41.04 1s4f h LEU 599 CO 0.49 0.19 0.29 0.28 -0.62 0.00 0.00 178.44 179.07 1s4f h SER 600 N 0.63 0.38 0.37 1.25 0.02 -1.91 -1.53 113.55 112.76 1s4f h SER 600 Ca 0.59 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 1s4f h SER 600 Cb 1.11 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1s4f h SER 600 CO -0.37 0.26 0.00 -0.62 -1.14 0.00 0.00 176.83 174.96 1s4f n GLU 601 N -4.48 0.48 -2.44 3.45 1.02 0.12 -4.57 120.64 114.22 1s4f n GLU 601 Ca 0.05 0.03 -0.39 0.00 -0.02 0.00 0.00 57.16 56.83 1s4f n GLU 601 Cb 0.18 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.06 1s4f n GLU 601 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1s4f s LEU 602 N -2.43 3.31 -0.14 -4.62 1.98 -0.58 -1.28 118.68 114.92 1s4f s LEU 602 Ca 0.28 -0.79 -0.14 0.00 -2.89 0.00 0.00 54.13 50.60 1s4f s LEU 602 Cb 0.17 -2.56 -0.11 0.00 0.66 0.00 0.00 46.19 44.36 1s4f s LEU 602 CO 0.37 -1.88 0.19 0.50 -1.89 0.00 0.00 176.35 173.64 1s4f h LYS 603 N 10.65 0.00 -4.11 1.98 3.64 -1.72 -3.44 116.57 123.57 1s4f h LYS 603 Ca -0.04 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.12 1s4f h LYS 603 Cb 1.04 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 32.63 1s4f h LYS 603 CO 1.32 0.44 -0.72 0.50 -2.27 0.00 0.00 179.45 178.73 1s4f s ARG 604 N -2.04 0.32 -0.07 1.90 3.52 0.39 -5.00 118.95 117.97 1s4f s ARG 604 Ca -0.14 -0.51 0.03 0.00 -0.13 0.00 0.00 55.73 54.98 1s4f s ARG 604 Cb 0.01 -0.05 -0.02 0.00 -1.56 0.00 0.00 34.95 33.32 1s4f s ARG 604 CO 0.34 -0.00 -0.15 0.99 -0.81 0.00 0.00 175.30 175.66 1s4f s THR 605 N -1.08 2.93 -0.63 4.11 2.01 -1.26 -0.20 115.64 121.53 1s4f s THR 605 Ca -0.10 -0.75 -0.39 0.00 0.31 0.00 0.00 61.69 60.76 1s4f s THR 605 Cb -0.08 -2.16 -0.19 0.00 0.01 0.00 0.00 72.50 70.09 1s4f s THR 605 CO -0.00 0.57 2.32 0.61 -0.69 0.00 0.00 174.62 177.42 1s4f n GLY 606 N 2.73 -0.16 0.07 4.40 0.00 0.12 -4.81 105.19 107.54 1s4f n GLY 606 Ca -0.17 1.09 -0.02 0.00 0.00 0.00 0.00 46.02 46.92 1s4f n GLY 606 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1s4f n PHE 607 N 8.93 -0.07 -0.15 1.61 7.35 -1.26 -1.82 117.46 132.05 1s4f n PHE 607 Ca 0.56 0.21 0.12 0.00 -0.76 0.00 0.00 57.45 57.58 1s4f n PHE 607 Cb 0.03 -0.43 0.46 0.00 0.35 0.00 0.00 39.48 39.89 1s4f n PHE 607 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1s4f h GLU 608 N 0.00 0.50 -0.00 -4.13 4.39 -1.98 0.43 114.58 113.78 1s4f h GLU 608 Ca 0.03 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1s4f h GLU 608 Cb 0.07 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1s4f h GLU 608 CO -0.16 0.33 -0.00 -0.22 -1.16 0.00 0.00 179.01 177.80 1s4f h LYS 609 N 0.51 0.01 -0.80 2.33 1.63 -1.73 0.39 116.57 118.91 1s4f h LYS 609 Ca 0.33 -0.00 0.01 0.00 -0.85 0.00 0.00 60.65 60.13 1s4f h LYS 609 Cb 0.59 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.18 1s4f h LYS 609 CO -0.11 0.47 0.53 1.25 -3.45 0.00 0.00 179.45 178.15 1s4f h LEU 610 N -0.45 0.92 0.47 5.20 7.12 -1.25 0.17 115.31 127.48 1s4f h LEU 610 Ca 0.00 -0.03 -0.01 0.00 0.13 0.00 0.00 57.88 57.97 1s4f h LEU 610 Cb 0.47 -0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 40.35 1s4f h LEU 610 CO 0.00 0.67 -0.45 0.00 -0.13 0.00 0.00 178.44 178.54 1s4f h ALA 611 N 1.29 -1.00 0.30 1.25 0.00 -0.73 -1.43 119.26 118.95 1s4f h ALA 611 Ca 0.29 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1s4f h ALA 611 Cb -0.12 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1s4f h ALA 611 CO -0.06 -1.10 -0.23 -0.97 0.00 0.00 0.00 179.25 176.89 1s4f h ASN 612 N -0.92 -0.60 0.00 0.00 -0.73 0.19 -0.68 115.58 112.85 1s4f h ASN 612 Ca -0.05 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1s4f h ASN 612 Cb 0.80 0.19 0.00 0.00 0.27 0.00 0.00 38.32 39.59 1s4f h ASN 612 CO -0.05 -0.35 0.01 0.18 -0.37 0.00 0.00 177.43 176.84 1s4f n LEU 613 N -5.36 0.00 -0.41 0.34 4.77 0.56 -0.53 117.00 116.38 1s4f n LEU 613 Ca -0.09 0.27 0.05 0.00 -0.03 0.00 0.00 56.01 56.20 1s4f n LEU 613 Cb 0.27 -0.27 0.06 0.00 -2.33 0.00 0.00 43.42 41.14 1s4f n LEU 613 CO 0.32 -0.27 0.44 0.59 -1.33 0.00 0.00 177.39 177.14 1s4f n ASN 614 N -1.26 1.97 -0.06 -1.43 4.13 -0.31 -1.05 115.26 117.26 1s4f n ASN 614 Ca 0.00 -1.51 -0.13 0.00 1.68 0.00 0.00 54.58 54.62 1s4f n ASN 614 Cb 0.01 -0.04 -0.01 0.00 -1.54 0.00 0.00 39.78 38.19 1s4f n ASN 614 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1s4f h LEU 615 N 1.81 0.88 -0.94 3.41 3.38 -0.30 -3.19 115.31 120.36 1s4f h LEU 615 Ca 0.00 -0.47 0.18 0.00 0.09 0.00 0.00 57.88 57.68 1s4f h LEU 615 Cb 0.45 -0.25 -0.10 0.00 0.09 0.00 0.00 40.66 40.84 1s4f h LEU 615 CO 0.00 1.25 0.54 -1.28 0.09 0.00 0.00 178.44 179.04 1s4f h SER 616 N 0.61 0.66 -0.56 -0.43 0.87 -1.81 -1.84 113.55 111.05 1s4f h SER 616 Ca 0.01 0.10 0.08 0.00 -1.23 0.00 0.00 61.79 60.75 1s4f h SER 616 Cb 1.14 -0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 63.03 1s4f h SER 616 CO 0.12 0.23 0.20 -0.07 -0.53 0.00 0.00 176.83 176.78 1s4f h LEU 617 N 0.69 0.20 -2.75 2.23 3.38 -1.87 0.78 115.31 117.97 1s4f h LEU 617 Ca 0.54 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.52 1s4f h LEU 617 Cb 0.84 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1s4f h LEU 617 CO -0.39 0.13 0.07 -1.20 0.09 0.00 0.00 178.44 177.15 1s4f n SER 618 N -5.00 3.96 0.00 -0.43 7.64 -0.72 -0.87 113.62 118.21 1s4f n SER 618 Ca 0.07 -2.67 0.00 0.00 1.01 0.00 0.00 58.87 57.28 1s4f n SER 618 Cb 0.24 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 1s4f n SER 618 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1s4f n THR 619 N 0.24 0.00 0.40 0.44 -1.04 -0.52 -4.62 114.28 109.18 1s4f n THR 619 Ca 0.21 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.34 1s4f n THR 619 Cb 0.93 -0.52 0.24 0.00 -1.82 0.00 0.00 70.33 69.16 1s4f n THR 619 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1s4f n LEU 620 N -2.38 3.25 -3.41 -4.42 4.32 0.15 -4.97 117.00 109.53 1s4f n LEU 620 Ca 0.00 -1.41 -0.20 0.00 -0.02 0.00 0.00 56.01 54.38 1s4f n LEU 620 Cb 0.47 -0.25 0.06 0.00 -1.62 0.00 0.00 43.42 42.09 1s4f n LEU 620 CO 0.00 0.71 0.00 0.61 -1.22 0.00 0.00 177.39 177.49 1s4f n GLY 621 N 1.47 -0.97 0.10 -0.72 0.00 -0.99 -4.89 105.19 99.19 1s4f n GLY 621 Ca 0.19 0.47 -0.11 0.00 0.00 0.00 0.00 46.02 46.57 1s4f n GLY 621 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1s4f n VAL 622 N -3.65 1.59 -4.51 1.61 0.31 -0.05 -4.69 118.33 108.95 1s4f n VAL 622 Ca -0.12 -0.78 -0.26 0.00 -0.01 0.00 0.00 64.34 63.18 1s4f n VAL 622 Cb 0.62 -1.05 -0.08 0.00 -0.91 0.00 0.00 33.84 32.43 1s4f n VAL 622 CO 0.00 0.00 0.00 -1.66 -1.32 0.00 0.00 176.83 173.85 1s4f s TRP 623 N -2.57 1.78 0.13 3.52 1.48 -1.25 -1.09 118.94 120.95 1s4f s TRP 623 Ca -0.10 -1.34 0.07 0.00 -1.06 0.00 0.00 56.10 53.68 1s4f s TRP 623 Cb 0.07 -1.12 -0.04 0.00 -1.16 0.00 0.00 33.47 31.22 1s4f s TRP 623 CO 0.81 -0.36 -0.17 0.95 -4.06 0.00 0.00 176.95 174.11 1s4f s THR 624 N -3.21 1.61 -0.21 0.66 -4.23 -0.95 -4.87 115.64 104.45 1s4f s THR 624 Ca 0.24 -1.75 0.07 0.00 -1.18 0.00 0.00 61.69 59.07 1s4f s THR 624 Cb 0.02 -1.65 0.07 0.00 1.34 0.00 0.00 72.50 72.28 1s4f s THR 624 CO 0.16 -0.29 1.04 2.29 -0.54 0.00 0.00 174.62 177.28 1s4f n LYS 625 N 0.59 0.05 0.08 3.99 2.85 -1.26 0.77 118.16 125.22 1s4f n LYS 625 Ca -0.16 0.43 0.11 0.00 -1.05 0.00 0.00 58.31 57.65 1s4f n LYS 625 Cb 0.56 -1.95 -0.01 0.00 -0.65 0.00 0.00 35.03 32.99 1s4f n LYS 625 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1s4f n HIS 626 N -1.69 0.77 0.04 5.58 8.25 -1.26 -4.43 115.22 122.49 1s4f n HIS 626 Ca -0.00 0.22 -0.15 0.00 -0.26 0.00 0.00 57.72 57.53 1s4f n HIS 626 Cb 0.31 -0.84 -0.09 0.00 1.12 0.00 0.00 29.99 30.48 1s4f n HIS 626 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1s4f h THR 627 N 0.00 0.05 -0.36 1.59 2.02 0.04 0.12 112.91 116.38 1s4f h THR 627 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1s4f h THR 627 Cb 0.96 0.05 -0.06 0.00 -1.74 0.00 0.00 68.15 67.36 1s4f h THR 627 CO 0.00 0.00 -0.41 0.28 0.37 0.00 0.00 175.52 175.76 1s4f h SER 628 N -0.62 -1.38 -0.09 4.18 0.02 -1.77 -1.08 113.55 112.81 1s4f h SER 628 Ca 0.03 0.19 0.04 0.00 -0.84 0.00 0.00 61.79 61.21 1s4f h SER 628 Cb 0.69 0.57 -0.06 0.00 0.14 0.00 0.00 62.40 63.74 1s4f h SER 628 CO -0.37 -0.27 -0.40 0.50 -1.14 0.00 0.00 176.83 175.15 1s4f h LYS 629 N -0.24 -0.48 -0.39 3.45 3.64 -1.71 -2.49 116.57 118.35 1s4f h LYS 629 Ca 0.06 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.56 1s4f h LYS 629 Cb 0.41 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.25 1s4f h LYS 629 CO -0.47 -0.32 -0.20 0.00 -2.27 0.00 0.00 179.45 176.20 1s4f h ARG 630 N -0.50 -0.12 -0.18 1.90 3.08 -0.30 0.44 114.38 118.70 1s4f h ARG 630 Ca 0.07 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.18 1s4f h ARG 630 Cb 0.62 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1s4f h ARG 630 CO -0.37 -0.08 0.19 0.82 -1.07 0.00 0.00 179.97 179.46 1s4f h ILE 631 N -0.13 0.53 0.13 2.04 1.08 -0.96 0.17 117.51 120.38 1s4f h ILE 631 Ca 0.19 0.00 -0.26 0.00 -0.39 0.00 0.00 64.86 64.41 1s4f h ILE 631 Cb 0.42 0.85 0.03 0.00 -3.07 0.00 0.00 36.82 35.05 1s4f h ILE 631 CO -0.47 0.00 -1.08 0.40 -0.69 0.00 0.00 178.15 176.31 1s4f h ILE 632 N 0.00 1.36 -0.65 -0.67 2.04 0.23 -2.47 117.51 117.34 1s4f h ILE 632 Ca 0.09 -2.46 -0.02 0.00 1.00 0.00 0.00 64.86 63.46 1s4f h ILE 632 Cb 0.46 2.87 -0.03 0.00 -0.74 0.00 0.00 36.82 39.38 1s4f h ILE 632 CO -0.00 0.73 0.31 1.56 0.00 0.00 0.00 178.15 180.75 1s4f h GLN 633 N 0.03 0.94 -0.52 2.37 4.20 0.50 0.32 115.11 122.95 1s4f h GLN 633 Ca -0.17 -0.14 0.07 0.00 0.06 0.00 0.00 58.65 58.47 1s4f h GLN 633 Cb 1.81 -0.17 -0.06 0.00 0.30 0.00 0.00 27.48 29.36 1s4f h GLN 633 CO 0.21 0.75 0.19 -0.44 -0.67 0.00 0.00 178.83 178.87 1s4f h ASP 634 N 0.91 0.19 -0.27 1.46 3.45 -0.76 0.19 116.42 121.59 1s4f h ASP 634 Ca 0.22 0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.72 1s4f h ASP 634 Cb 0.12 0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 38.93 1s4f h ASP 634 CO -0.03 0.14 0.08 0.00 -1.57 0.00 0.00 179.24 177.86 1s4f h VAL 636 N 0.26 0.18 -0.41 0.00 2.07 -0.39 -2.63 116.25 115.34 1s4f h VAL 636 Ca 0.09 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.64 1s4f h VAL 636 Cb 0.25 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 1s4f h VAL 636 CO -0.00 0.00 -0.24 0.00 0.02 0.00 0.00 177.57 177.35 1s4f n ALA 637 N -2.60 -0.26 0.14 1.67 0.00 0.62 0.29 120.51 120.37 1s4f n ALA 637 Ca -0.14 0.35 -0.12 0.00 0.00 0.00 0.00 53.44 53.52 1s4f n ALA 637 Cb 0.44 -0.03 -0.07 0.00 0.00 0.00 0.00 19.45 19.79 1s4f n ALA 637 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1s4f h ILE 638 N 0.00 0.00 0.00 0.00 2.04 -1.50 -3.10 117.51 114.96 1s4f h ILE 638 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.93 1s4f h ILE 638 Cb 0.17 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 1s4f h ILE 638 CO -0.38 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.38 1s4f n GLY 639 N -1.37 -0.80 0.14 5.37 0.00 0.14 -3.69 105.19 104.99 1s4f n GLY 639 Ca -0.07 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 1s4f n GLY 639 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1s4f h LYS 640 N 0.00 0.38 -6.82 1.61 2.10 -0.47 -3.43 116.57 109.94 1s4f h LYS 640 Ca 0.00 -0.07 -0.50 0.00 -2.00 0.00 0.00 60.65 58.07 1s4f h LYS 640 Cb 0.16 -0.06 0.02 0.00 -0.90 0.00 0.00 32.23 31.45 1s4f h LYS 640 CO 0.00 0.43 0.48 -1.21 -2.00 0.00 0.00 179.45 177.15 1s4f s GLU 641 N -5.49 4.61 0.13 0.07 2.02 -1.24 -4.94 118.70 113.86 1s4f s GLU 641 Ca -0.13 1.81 -0.34 0.00 0.02 0.00 0.00 54.97 56.32 1s4f s GLU 641 Cb 0.08 -3.15 -0.17 0.00 0.10 0.00 0.00 34.13 30.98 1s4f s GLU 641 CO 0.72 0.18 1.03 0.39 0.02 0.00 0.00 175.26 177.60 1s4f n GLU 642 N 1.11 0.65 0.00 1.61 -0.58 -1.26 -4.91 120.64 117.26 1s4f n GLU 642 Ca -0.01 0.23 0.00 0.00 -0.42 0.00 0.00 57.16 56.96 1s4f n GLU 642 Cb 0.45 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 1s4f n GLU 642 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s4f n GLY 643 N 1.90 3.58 3.53 0.62 0.00 -1.26 -5.01 105.19 108.54 1s4f n GLY 643 Ca 0.17 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1s4f n GLY 643 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1s4f s ASN 644 N 0.00 6.53 -0.26 1.61 2.47 -1.26 -4.90 114.94 119.13 1s4f s ASN 644 Ca 0.00 -1.61 -0.16 0.00 0.42 0.00 0.00 52.86 51.51 1s4f s ASN 644 Cb 0.00 -2.52 -0.03 0.00 -1.45 0.00 0.00 41.25 37.25 1s4f s ASN 644 CO 0.00 -1.38 0.45 0.26 -3.72 0.00 0.00 177.10 172.70 1s4f s TRP 645 N 4.32 3.26 -0.25 0.43 0.23 -1.26 -4.95 118.94 120.71 1s4f s TRP 645 Ca 0.42 0.53 0.13 0.00 -2.03 0.00 0.00 56.10 55.16 1s4f s TRP 645 Cb -0.02 -2.65 0.73 0.00 0.03 0.00 0.00 33.47 31.56 1s4f s TRP 645 CO -0.10 -0.26 1.35 -0.11 0.96 0.00 0.00 176.95 178.79 1s4f n LEU 646 N 5.44 0.35 -0.76 2.99 0.00 -1.26 -1.19 117.00 122.57 1s4f n LEU 646 Ca -0.06 0.60 0.08 0.00 0.00 0.00 0.00 56.01 56.63 1s4f n LEU 646 Cb 0.50 -0.61 0.24 0.00 0.00 0.00 0.00 43.42 43.55 1s4f n LEU 646 CO 0.39 -0.72 0.69 1.33 0.00 0.00 0.00 177.39 179.08 1s4f n VAL 647 N -1.98 0.48 0.20 1.96 0.24 -1.26 -4.02 118.33 113.95 1s4f n VAL 647 Ca -0.01 -0.53 0.12 0.00 -2.04 0.00 0.00 64.34 61.88 1s4f n VAL 647 Cb 0.16 0.35 0.12 0.00 -1.47 0.00 0.00 33.84 33.00 1s4f n VAL 647 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1s4f h LYS 648 N 2.57 0.00 0.00 7.34 1.79 -1.47 -3.24 116.57 123.56 1s4f h LYS 648 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1s4f h LYS 648 Cb 0.58 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1s4f h LYS 648 CO 0.00 0.00 0.00 -2.30 -1.08 0.00 0.00 179.45 176.07 1s4f n PRO 649 N -2.92 0.00 -3.33 3.15 -0.02 -1.26 -3.82 135.00 126.81 1s4f n PRO 649 Ca 0.03 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.09 1s4f n PRO 649 Cb 0.53 -1.45 -0.09 0.00 -0.02 0.00 0.00 33.50 32.47 1s4f n PRO 649 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1s4f s ASP 650 N -1.92 6.21 0.00 2.55 2.15 -1.22 -3.30 116.67 121.14 1s4f s ASP 650 Ca 0.00 -0.40 -0.01 0.00 0.43 0.00 0.00 52.55 52.56 1s4f s ASP 650 Cb 0.00 -2.22 -0.01 0.00 -0.30 0.00 0.00 42.92 40.39 1s4f s ASP 650 CO 0.00 -0.48 1.02 0.03 -0.17 0.00 0.00 175.17 175.57 1s4f h ARG 651 N 8.60 -0.03 -0.82 4.34 3.08 -1.84 1.61 114.38 129.31 1s4f h ARG 651 Ca -0.28 0.00 0.17 0.00 0.07 0.00 0.00 59.98 59.94 1s4f h ARG 651 Cb 1.12 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 31.03 1s4f h ARG 651 CO 0.76 -0.02 -0.20 -0.11 -1.07 0.00 0.00 179.97 179.33 1s4f n LEU 652 N -2.46 -0.29 0.02 3.04 -0.00 -1.26 0.20 117.00 116.25 1s4f n LEU 652 Ca -0.00 1.41 -0.13 0.00 -0.00 0.00 0.00 56.01 57.29 1s4f n LEU 652 Cb 0.02 -0.43 -0.09 0.00 -0.00 0.00 0.00 43.42 42.92 1s4f n LEU 652 CO 0.01 -1.35 0.74 0.40 -0.00 0.00 0.00 177.39 177.18 1s4f h ILE 653 N 0.00 1.18 -0.23 1.96 5.03 -1.76 -2.69 117.51 121.00 1s4f h ILE 653 Ca 0.40 -0.60 0.05 0.00 -0.12 0.00 0.00 64.86 64.59 1s4f h ILE 653 Cb 0.62 1.59 -0.07 0.00 -3.03 0.00 0.00 36.82 35.92 1s4f h ILE 653 CO -0.84 0.15 -0.46 -1.28 -0.68 0.00 0.00 178.15 175.05 1s4f h SER 654 N -0.28 -1.47 0.14 1.72 0.87 1.41 -0.19 113.55 115.75 1s4f h SER 654 Ca -0.00 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1s4f h SER 654 Cb 0.27 0.61 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1s4f h SER 654 CO 0.00 -0.42 0.00 -1.54 -0.53 0.00 0.00 176.83 174.34 1s4f n SER 655 N -5.43 0.00 0.03 6.23 3.41 0.22 -0.87 113.62 117.21 1s4f n SER 655 Ca -0.03 0.48 0.11 0.00 -0.26 0.00 0.00 58.87 59.17 1s4f n SER 655 Cb 0.36 -0.48 -0.09 0.00 -0.26 0.00 0.00 64.21 63.74 1s4f n SER 655 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1s4f n LYS 656 N -1.48 0.55 -0.06 4.33 5.02 -0.13 -4.27 118.16 122.12 1s4f n LYS 656 Ca 0.01 -0.07 0.03 0.00 -2.02 0.00 0.00 58.31 56.26 1s4f n LYS 656 Cb 0.05 -1.61 0.06 0.00 -0.02 0.00 0.00 35.03 33.51 1s4f n LYS 656 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1s4f n THR 657 N -2.28 0.57 -1.20 -0.18 -2.24 -0.45 -4.98 114.28 103.53 1s4f n THR 657 Ca -0.02 -0.79 -0.10 0.00 -2.27 0.00 0.00 64.05 60.88 1s4f n THR 657 Cb 0.53 0.77 -0.04 0.00 -2.10 0.00 0.00 70.33 69.48 1s4f n THR 657 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s4f n GLY 658 N 0.18 0.96 3.29 3.38 0.00 -0.05 -4.74 105.19 108.20 1s4f n GLY 658 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1s4f n GLY 658 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s4f s HIS 659 N -1.76 2.20 0.46 1.61 3.76 -1.19 -5.04 115.29 115.33 1s4f s HIS 659 Ca 0.00 -0.41 0.07 0.00 -0.15 0.00 0.00 55.06 54.57 1s4f s HIS 659 Cb 0.00 -1.41 -0.00 0.00 1.11 0.00 0.00 32.58 32.28 1s4f s HIS 659 CO 0.00 -0.03 0.41 -0.51 -0.85 0.00 0.00 174.74 173.76 1s4f s LEU 660 N -0.62 3.20 -0.16 0.89 1.43 -1.26 -4.54 118.68 117.63 1s4f s LEU 660 Ca 0.10 -0.88 0.01 0.00 -1.03 0.00 0.00 54.13 52.33 1s4f s LEU 660 Cb -0.09 -1.80 0.02 0.00 0.03 0.00 0.00 46.19 44.34 1s4f s LEU 660 CO -0.01 -0.81 -0.20 -0.47 0.23 0.00 0.00 176.35 175.10 1s4f s TYR 661 N -2.56 2.59 -0.65 0.29 5.04 -1.26 -4.45 117.35 116.35 1s4f s TYR 661 Ca 0.46 -1.43 -0.17 0.00 -2.44 0.00 0.00 57.07 53.49 1s4f s TYR 661 Cb -0.03 -1.80 0.13 0.00 0.35 0.00 0.00 41.96 40.62 1s4f s TYR 661 CO 0.27 -0.70 0.70 0.42 -1.34 0.00 0.00 175.55 174.91 1s4f s ILE 662 N 1.13 5.06 0.23 3.14 1.09 -1.26 -4.92 121.20 125.67 1s4f s ILE 662 Ca -0.00 -1.45 -0.31 0.00 -1.10 0.00 0.00 60.65 57.79 1s4f s ILE 662 Cb -0.14 -4.47 -0.12 0.00 -1.06 0.00 0.00 42.46 36.67 1s4f s ILE 662 CO -0.08 -1.08 1.69 -2.84 -0.10 0.00 0.00 174.94 172.53 1s4f s PRO 663 N 1.95 4.12 0.45 2.79 0.02 -1.26 -5.02 135.00 138.04 1s4f s PRO 663 Ca 0.12 2.61 0.04 0.00 0.02 0.00 0.00 61.00 63.79 1s4f s PRO 663 Cb -0.21 -3.06 0.01 0.00 0.02 0.00 0.00 34.50 31.26 1s4f s PRO 663 CO 0.01 -0.73 0.63 -0.51 -0.33 0.00 0.00 177.00 176.08 1s4f s ASP 664 N 1.00 5.67 1.07 2.53 1.01 -1.26 -4.98 116.67 121.70 1s4f s ASP 664 Ca 0.72 -0.05 -0.15 0.00 0.71 0.00 0.00 52.55 53.77 1s4f s ASP 664 Cb -0.49 -1.09 0.13 0.00 1.01 0.00 0.00 42.92 42.47 1s4f s ASP 664 CO 0.36 -0.78 0.40 0.29 0.21 0.00 0.00 175.17 175.65 1s4f n LYS 665 N -2.01 -1.35 0.00 8.23 4.76 -1.26 -4.13 118.16 122.40 1s4f n LYS 665 Ca 0.04 -0.36 0.00 0.00 -2.87 0.00 0.00 58.31 55.12 1s4f n LYS 665 Cb 0.59 -1.89 0.00 0.00 -1.84 0.00 0.00 35.03 31.89 1s4f n LYS 665 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1s4f n GLY 666 N 1.55 2.35 3.33 0.72 0.00 -1.26 -0.78 105.19 111.10 1s4f n GLY 666 Ca 0.04 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 1s4f n GLY 666 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s4f s PHE 667 N -1.18 1.74 -0.17 1.61 0.40 -0.72 -2.72 117.98 116.94 1s4f s PHE 667 Ca 0.00 -0.52 -0.07 0.00 -0.60 0.00 0.00 56.93 55.74 1s4f s PHE 667 Cb 0.00 -0.84 -0.04 0.00 0.51 0.00 0.00 43.02 42.65 1s4f s PHE 667 CO 0.00 0.34 0.06 0.99 0.70 0.00 0.00 175.22 177.31 1s4f s THR 668 N -2.51 4.81 -0.04 0.64 2.01 -1.26 -1.92 115.64 117.38 1s4f s THR 668 Ca 0.19 -0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.22 1s4f s THR 668 Cb -0.03 -3.15 -0.01 0.00 0.01 0.00 0.00 72.50 69.31 1s4f s THR 668 CO 0.07 0.49 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.50 1s4f s LEU 669 N 0.15 2.02 -0.00 4.42 1.43 -0.25 -5.02 118.68 121.43 1s4f s LEU 669 Ca 0.05 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.42 1s4f s LEU 669 Cb -0.12 -1.18 -0.05 0.00 0.03 0.00 0.00 46.19 44.87 1s4f s LEU 669 CO 0.00 0.24 1.29 -1.58 0.23 0.00 0.00 176.35 176.53 1s4f s GLN 670 N -0.29 4.34 0.00 1.70 0.74 -1.26 -1.53 119.66 123.36 1s4f s GLN 670 Ca 0.02 1.83 0.00 0.00 0.05 0.00 0.00 55.36 57.26 1s4f s GLN 670 Cb -0.11 -3.51 0.00 0.00 1.10 0.00 0.00 33.01 30.50 1s4f s GLN 670 CO 0.01 -0.46 0.00 0.41 -0.55 0.00 0.00 175.29 174.70 1s4f n GLY 671 N 3.46 0.29 1.91 2.59 0.00 -0.67 -4.85 105.19 107.91 1s4f n GLY 671 Ca 0.11 -1.28 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 1s4f n GLY 671 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1s4f n LYS 672 N 0.00 1.76 -3.95 1.61 4.81 0.95 -4.85 118.16 118.48 1s4f n LYS 672 Ca 0.00 -1.38 -0.31 0.00 -0.87 0.00 0.00 58.31 55.75 1s4f n LYS 672 Cb 0.00 -1.60 -0.15 0.00 0.02 0.00 0.00 35.03 33.30 1s4f n LYS 672 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1s4f s HIS 673 N -1.37 2.94 0.00 5.64 3.76 -1.25 -4.84 115.29 120.18 1s4f s HIS 673 Ca 0.31 -2.33 0.00 0.00 -0.15 0.00 0.00 55.06 52.89 1s4f s HIS 673 Cb 0.23 -2.19 0.00 0.00 1.11 0.00 0.00 32.58 31.73 1s4f s HIS 673 CO -0.03 -0.88 0.00 0.98 -0.85 0.00 0.00 174.74 173.96