#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i48 s ALA 51 N 0.00 3.33 -0.03 2.98 0.00 -1.26 -5.12 121.76 121.66 1i48 s ALA 51 Ca 0.00 -1.54 -0.02 0.00 0.00 0.00 0.00 51.96 50.40 1i48 s ALA 51 Cb 0.00 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.37 1i48 s ALA 51 CO 0.00 -0.14 -0.03 0.66 0.00 0.00 0.00 175.76 176.25 1i48 h SER 52 N 1.69 0.00 0.00 0.00 4.64 -2.06 -3.38 113.55 114.43 1i48 h SER 52 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1i48 h SER 52 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1i48 h SER 52 CO 0.75 0.15 0.00 2.22 -0.87 0.00 0.00 176.83 179.07 1i48 n PHE 53 N -2.71 0.00 -3.90 4.77 1.16 -1.26 -4.41 117.46 111.11 1i48 n PHE 53 Ca -0.01 -0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.30 1i48 n PHE 53 Cb 0.05 -0.03 -0.17 0.00 -1.61 0.00 0.00 39.48 37.72 1i48 n PHE 53 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1i48 s LEU 54 N 0.00 1.23 0.00 5.98 1.43 -1.26 -5.04 118.68 121.02 1i48 s LEU 54 Ca 0.00 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1i48 s LEU 54 Cb 0.00 -0.84 0.00 0.00 0.03 0.00 0.00 46.19 45.38 1i48 s LEU 54 CO 0.00 -0.13 0.00 0.59 0.23 0.00 0.00 176.35 177.04 1i48 n ASN 55 N 4.94 0.00 -4.14 2.29 3.02 -1.26 -4.72 115.26 115.39 1i48 n ASN 55 Ca -0.12 0.00 -0.46 0.00 -0.03 0.00 0.00 54.58 53.97 1i48 n ASN 55 Cb 0.50 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.64 1i48 n ASN 55 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1i48 n SER 56 N -2.05 -1.11 -0.11 6.41 2.88 -1.26 -4.73 113.62 113.65 1i48 n SER 56 Ca 0.00 1.06 -0.05 0.00 -1.33 0.00 0.00 58.87 58.55 1i48 n SER 56 Cb 0.00 -0.89 0.01 0.00 -0.75 0.00 0.00 64.21 62.58 1i48 n SER 56 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1i48 h ASP 57 N 1.05 -0.31 -0.37 -3.46 5.19 -1.99 -2.41 116.42 114.13 1i48 h ASP 57 Ca -0.28 0.11 0.08 0.00 -0.62 0.00 0.00 57.03 56.32 1i48 h ASP 57 Cb 1.35 0.22 -0.08 0.00 0.18 0.00 0.00 39.33 41.00 1i48 h ASP 57 CO 0.54 -0.11 -0.13 1.23 -3.12 0.00 0.00 179.24 177.65 1i48 h GLY 58 N 0.02 0.19 0.37 2.75 0.00 -1.97 0.26 103.07 104.69 1i48 h GLY 58 Ca 0.18 0.17 0.14 0.00 0.00 0.00 0.00 47.33 47.83 1i48 h GLY 58 CO -0.37 -0.16 0.62 1.76 0.00 0.00 0.00 176.54 178.39 1i48 h SER 59 N -0.06 0.87 0.21 0.19 0.02 -1.78 -1.47 113.55 111.53 1i48 h SER 59 Ca 0.18 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1i48 h SER 59 Cb 0.33 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1i48 h SER 59 CO -0.41 0.42 -0.10 0.58 -1.14 0.00 0.00 176.83 176.18 1i48 h VAL 60 N 0.91 0.86 0.00 2.27 2.07 -0.75 -0.98 116.25 120.63 1i48 h VAL 60 Ca 0.52 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1i48 h VAL 60 Cb 0.63 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1i48 h VAL 60 CO -0.30 0.17 0.19 0.00 0.02 0.00 0.00 177.57 177.65 1i48 n ALA 61 N -2.48 0.63 -0.12 1.67 0.00 0.78 0.13 120.51 121.12 1i48 n ALA 61 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.11 1i48 n ALA 61 Cb 0.26 -0.62 -0.09 0.00 0.00 0.00 0.00 19.45 19.00 1i48 n ALA 61 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1i48 n ILE 62 N -1.30 1.28 0.36 0.00 5.41 -0.64 -3.98 119.36 120.48 1i48 n ILE 62 Ca 0.00 -0.34 0.08 0.00 1.00 0.00 0.00 62.75 63.48 1i48 n ILE 62 Cb 0.19 -1.75 0.11 0.00 -0.71 0.00 0.00 39.64 37.48 1i48 n ILE 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1i48 n HIS 63 N -3.93 0.21 -1.85 1.39 8.25 -0.40 -4.86 115.22 114.03 1i48 n HIS 63 Ca -0.45 -0.16 -0.42 0.00 -0.26 0.00 0.00 57.72 56.42 1i48 n HIS 63 Cb 0.84 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.91 1i48 n HIS 63 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i48 s ALA 64 N -1.20 3.69 -1.16 -1.41 0.00 0.34 -2.18 121.76 119.84 1i48 s ALA 64 Ca 0.23 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1i48 s ALA 64 Cb 0.14 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1i48 s ALA 64 CO 0.20 -1.22 0.00 0.41 0.00 0.00 0.00 175.76 175.16 1i48 n GLY 65 N 4.13 0.07 1.43 0.00 0.00 -1.26 -4.25 105.19 105.30 1i48 n GLY 65 Ca 0.17 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1i48 n GLY 65 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i48 n GLU 66 N -2.31 0.00 -0.23 1.61 1.02 -0.92 -4.74 120.64 115.06 1i48 n GLU 66 Ca -0.15 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.02 1i48 n GLU 66 Cb 0.59 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 32.09 1i48 n GLU 66 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1i48 n ARG 67 N -2.07 -0.07 0.00 3.49 3.00 -1.00 -2.34 116.66 117.67 1i48 n ARG 67 Ca 0.00 0.98 0.00 0.00 -0.00 0.00 0.00 57.85 58.83 1i48 n ARG 67 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 32.46 31.00 1i48 n ARG 67 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1i48 n LEU 68 N -5.01 0.68 -4.20 6.15 4.77 -1.26 -5.02 117.00 113.11 1i48 n LEU 68 Ca 0.10 0.51 -0.15 0.00 -0.03 0.00 0.00 56.01 56.43 1i48 n LEU 68 Cb 0.31 -0.31 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 1i48 n LEU 68 CO -0.08 -0.31 -0.09 -0.83 -1.33 0.00 0.00 177.39 174.75 1i48 s GLY 69 N -1.21 1.77 0.00 -0.72 0.00 -0.99 -5.07 107.32 101.10 1i48 s GLY 69 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 44.72 42.94 1i48 s GLY 69 CO 0.00 -1.31 0.00 0.54 0.00 0.00 0.00 173.10 172.33 1i48 n ARG 70 N -0.48 1.23 -1.18 2.90 1.74 -1.26 -3.68 116.66 115.92 1i48 n ARG 70 Ca 0.04 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.06 1i48 n ARG 70 Cb 0.63 -0.10 -0.03 0.00 -1.02 0.00 0.00 32.46 31.94 1i48 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i48 n GLY 71 N 0.00 0.78 0.03 -0.13 0.00 -1.26 -4.75 105.19 99.85 1i48 n GLY 71 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1i48 n GLY 71 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1i48 n ILE 72 N -2.52 0.34 -0.15 -0.61 0.00 -1.26 -5.09 119.36 110.08 1i48 n ILE 72 Ca -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 62.75 62.34 1i48 n ILE 72 Cb 0.36 0.80 0.00 0.00 0.00 0.00 0.00 39.64 40.80 1i48 n ILE 72 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1i48 n VAL 73 N -0.18 0.00 -3.61 9.51 0.31 -1.26 -5.03 118.33 118.07 1i48 n VAL 73 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1i48 n VAL 73 Cb 0.44 -0.10 -0.07 0.00 -0.91 0.00 0.00 33.84 33.21 1i48 n VAL 73 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1i48 s THR 74 N 0.00 0.00 -1.54 2.52 -4.23 -1.26 -4.99 115.64 106.14 1i48 s THR 74 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 1i48 s THR 74 Cb 0.00 -1.00 0.07 0.00 1.34 0.00 0.00 72.50 72.91 1i48 s THR 74 CO 0.00 0.00 0.86 -0.90 -0.54 0.00 0.00 174.62 174.04 1i48 n ASP 75 N 2.00 0.82 -4.83 3.99 5.68 -1.26 -4.82 116.55 118.13 1i48 n ASP 75 Ca -0.14 -2.04 -0.34 0.00 -0.50 0.00 0.00 54.79 51.78 1i48 n ASP 75 Cb 0.56 -0.25 -0.06 0.00 -1.14 0.00 0.00 41.12 40.23 1i48 n ASP 75 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1i48 s ALA 76 N -1.58 3.31 -0.03 2.12 0.00 -1.26 -5.00 121.76 119.33 1i48 s ALA 76 Ca 0.05 0.16 -0.23 0.00 0.00 0.00 0.00 51.96 51.93 1i48 s ALA 76 Cb 0.03 -2.86 -0.21 0.00 0.00 0.00 0.00 23.12 20.08 1i48 s ALA 76 CO 0.02 0.30 1.11 0.82 0.00 0.00 0.00 175.76 178.01 1i48 h ILE 77 N 2.27 1.49 -3.74 0.00 2.04 -2.04 -3.46 117.51 114.06 1i48 h ILE 77 Ca -0.48 -1.76 -0.46 0.00 1.00 0.00 0.00 64.86 63.15 1i48 h ILE 77 Cb 1.18 2.53 0.07 0.00 -0.74 0.00 0.00 36.82 39.87 1i48 h ILE 77 CO 0.65 0.49 0.21 0.42 0.00 0.00 0.00 178.15 179.92 1i48 s THR 78 N -3.45 2.85 -0.12 -0.27 -4.23 -1.26 -4.98 115.64 104.18 1i48 s THR 78 Ca -0.15 -0.14 -0.27 0.00 -1.18 0.00 0.00 61.69 59.95 1i48 s THR 78 Cb 0.02 -3.19 -0.02 0.00 1.34 0.00 0.00 72.50 70.65 1i48 s THR 78 CO 0.74 -0.21 0.88 -0.89 -0.54 0.00 0.00 174.62 174.61 1i48 s THR 79 N -3.15 4.87 0.43 3.99 2.01 -1.26 -5.02 115.64 117.50 1i48 s THR 79 Ca 0.58 1.77 -0.24 0.00 0.31 0.00 0.00 61.69 64.11 1i48 s THR 79 Cb -0.11 -4.20 -0.08 0.00 0.01 0.00 0.00 72.50 68.13 1i48 s THR 79 CO 0.45 0.06 1.20 -2.16 -0.69 0.00 0.00 174.62 173.48 1i48 s PRO 80 N 1.84 3.89 -0.49 4.92 0.04 -1.26 -4.98 135.00 138.96 1i48 s PRO 80 Ca 0.42 1.89 -0.21 0.00 0.04 0.00 0.00 61.00 63.15 1i48 s PRO 80 Cb -0.18 -2.58 0.04 0.00 0.04 0.00 0.00 34.50 31.83 1i48 s PRO 80 CO 0.16 -0.47 0.69 0.08 0.04 0.00 0.00 177.00 177.49 1i48 s VAL 81 N -1.43 4.77 -0.37 -0.36 1.01 -1.26 -4.52 120.40 118.24 1i48 s VAL 81 Ca 0.60 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 62.20 1i48 s VAL 81 Cb -0.32 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 31.76 1i48 s VAL 81 CO 0.39 -0.80 0.71 -0.69 0.00 0.00 0.00 175.10 174.72 1i48 s VAL 82 N 2.93 4.80 -0.99 2.92 1.01 -1.26 -4.98 120.40 124.82 1i48 s VAL 82 Ca 0.20 0.65 -0.02 0.00 0.00 0.00 0.00 61.98 62.82 1i48 s VAL 82 Cb -0.16 -4.16 0.30 0.00 0.00 0.00 0.00 36.38 32.35 1i48 s VAL 82 CO 0.15 -0.42 1.33 0.59 0.00 0.00 0.00 175.10 176.76 1i48 n ASN 83 N 6.27 5.89 -4.38 3.32 3.02 -1.26 -4.74 115.26 123.38 1i48 n ASN 83 Ca 0.01 -3.42 -0.29 0.00 -0.03 0.00 0.00 54.58 50.85 1i48 n ASN 83 Cb 0.48 -1.15 -0.13 0.00 -0.61 0.00 0.00 39.78 38.37 1i48 n ASN 83 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1i48 s THR 84 N -2.72 2.25 -0.98 3.41 -1.32 -1.26 -5.01 115.64 110.01 1i48 s THR 84 Ca 0.33 -1.65 0.23 0.00 -1.21 0.00 0.00 61.69 59.39 1i48 s THR 84 Cb 0.07 -1.96 -0.11 0.00 -1.51 0.00 0.00 72.50 68.99 1i48 s THR 84 CO 0.08 0.17 1.16 -1.54 -2.21 0.00 0.00 174.62 172.28 1i48 n SER 85 N 1.15 0.73 -3.40 8.08 3.41 -1.26 -4.75 113.62 117.59 1i48 n SER 85 Ca -0.18 -0.58 -0.05 0.00 -0.26 0.00 0.00 58.87 57.81 1i48 n SER 85 Cb 0.53 0.62 0.01 0.00 -0.26 0.00 0.00 64.21 65.10 1i48 n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i48 s ALA 86 N -3.01 -1.39 -0.02 7.33 0.00 -1.26 -2.87 121.76 120.54 1i48 s ALA 86 Ca 0.09 -0.31 0.03 0.00 0.00 0.00 0.00 51.96 51.78 1i48 s ALA 86 Cb 0.17 0.72 -0.00 0.00 0.00 0.00 0.00 23.12 24.00 1i48 s ALA 86 CO 0.78 -1.04 -0.12 0.71 0.00 0.00 0.00 175.76 176.10 1i48 s TYR 87 N -2.61 1.10 0.62 0.00 1.51 -1.11 -4.85 117.35 112.02 1i48 s TYR 87 Ca 0.17 -0.24 0.04 0.00 -1.01 0.00 0.00 57.07 56.03 1i48 s TYR 87 Cb -0.03 -0.74 0.09 0.00 -0.11 0.00 0.00 41.96 41.17 1i48 s TYR 87 CO 0.06 -0.06 0.85 -0.59 -1.11 0.00 0.00 175.55 174.70 1i48 s PHE 88 N -0.09 1.75 0.01 2.71 -0.12 -1.26 -4.79 117.98 116.19 1i48 s PHE 88 Ca 0.01 -0.44 0.04 0.00 -0.05 0.00 0.00 56.93 56.49 1i48 s PHE 88 Cb -0.07 -2.60 -0.02 0.00 -0.63 0.00 0.00 43.02 39.71 1i48 s PHE 88 CO 0.00 -1.29 -0.12 -0.06 -0.05 0.00 0.00 175.22 173.70 1i48 s PHE 89 N -2.84 1.09 0.23 3.49 0.40 -1.26 -5.05 117.98 114.04 1i48 s PHE 89 Ca 0.63 -0.28 -0.04 0.00 -0.60 0.00 0.00 56.93 56.64 1i48 s PHE 89 Cb -0.06 -0.68 0.23 0.00 0.51 0.00 0.00 43.02 43.02 1i48 s PHE 89 CO 0.41 0.00 1.67 -0.91 0.70 0.00 0.00 175.22 177.09 1i48 h ASN 90 N 5.39 0.78 -5.00 1.36 2.35 -2.00 -3.46 115.58 115.00 1i48 h ASN 90 Ca -0.35 -0.25 -0.06 0.00 -0.55 0.00 0.00 56.30 55.09 1i48 h ASN 90 Cb 1.18 -0.21 -0.18 0.00 0.05 0.00 0.00 38.32 39.16 1i48 h ASN 90 CO 0.46 0.94 0.14 -1.59 -1.65 0.00 0.00 177.43 175.73 1i48 s LYS 91 N -4.74 1.05 0.27 0.81 -2.85 -1.26 -5.05 119.74 107.98 1i48 s LYS 91 Ca -0.09 0.06 -0.01 0.00 -1.00 0.00 0.00 55.97 54.93 1i48 s LYS 91 Cb 0.14 0.49 0.61 0.00 -2.06 0.00 0.00 37.83 37.00 1i48 s LYS 91 CO 0.83 -0.35 1.64 1.15 0.10 0.00 0.00 175.35 178.72 1i48 h THR 92 N 2.91 0.33 -0.95 3.79 2.02 -1.99 0.23 112.91 119.25 1i48 h THR 92 Ca -0.29 -0.06 0.23 0.00 0.77 0.00 0.00 66.41 67.06 1i48 h THR 92 Cb 1.17 0.14 -0.12 0.00 -1.74 0.00 0.00 68.15 67.60 1i48 h THR 92 CO 0.39 0.03 0.51 0.77 0.37 0.00 0.00 175.52 177.59 1i48 h SER 93 N 0.18 0.53 -0.05 4.18 4.64 -1.99 0.23 113.55 121.27 1i48 h SER 93 Ca 0.50 0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 61.94 1i48 h SER 93 Cb 0.96 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1i48 h SER 93 CO -0.66 0.07 -0.03 -0.33 -0.87 0.00 0.00 176.83 175.01 1i48 h GLU 94 N 0.52 0.12 -0.96 4.77 5.08 -0.97 -1.80 114.58 121.34 1i48 h GLU 94 Ca 0.60 -0.05 0.15 0.00 -1.00 0.00 0.00 59.36 59.06 1i48 h GLU 94 Cb 1.12 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.27 1i48 h GLU 94 CO -0.49 0.52 0.57 1.25 -1.00 0.00 0.00 179.01 179.87 1i48 h LEU 95 N -0.29 0.77 0.20 1.33 5.85 -0.53 -0.00 115.31 122.63 1i48 h LEU 95 Ca 0.01 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1i48 h LEU 95 Cb 0.49 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1i48 h LEU 95 CO 0.01 0.34 -0.09 0.40 -0.34 0.00 0.00 178.44 178.76 1i48 h ILE 96 N 0.81 0.85 -0.37 4.05 2.04 -0.49 -0.90 117.51 123.50 1i48 h ILE 96 Ca 0.52 -0.18 0.08 0.00 1.00 0.00 0.00 64.86 66.27 1i48 h ILE 96 Cb 0.68 0.96 -0.09 0.00 -0.74 0.00 0.00 36.82 37.63 1i48 h ILE 96 CO -0.33 0.04 -0.30 0.44 0.00 0.00 0.00 178.15 178.00 1i48 h ASP 97 N -0.35 -0.98 -0.10 1.72 3.32 -0.17 0.43 116.42 120.29 1i48 h ASP 97 Ca -0.03 0.18 0.03 0.00 0.02 0.00 0.00 57.03 57.23 1i48 h ASP 97 Cb 0.27 0.47 -0.03 0.00 0.22 0.00 0.00 39.33 40.26 1i48 h ASP 97 CO 0.04 -0.31 -0.07 0.15 -1.72 0.00 0.00 179.24 177.34 1i48 h PHE 98 N -0.24 -0.17 0.00 4.55 3.57 -0.98 0.52 116.94 124.18 1i48 h PHE 98 Ca 0.17 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1i48 h PHE 98 Cb 0.52 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 1i48 h PHE 98 CO -0.50 -0.11 -0.02 0.87 -2.23 0.00 0.00 178.31 176.31 1i48 h LYS 99 N -0.08 0.00 -0.31 1.11 1.79 -0.33 0.35 116.57 119.09 1i48 h LYS 99 Ca 0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1i48 h LYS 99 Cb 0.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1i48 h LYS 99 CO -0.15 0.02 0.00 0.39 -1.08 0.00 0.00 179.45 178.64 1i48 n GLU 100 N -4.40 1.79 -3.35 3.15 -0.58 0.14 -4.92 120.64 112.48 1i48 n GLU 100 Ca -0.03 -1.22 -0.17 0.00 -0.42 0.00 0.00 57.16 55.32 1i48 n GLU 100 Cb 0.11 -1.29 0.08 0.00 -0.57 0.00 0.00 31.44 29.77 1i48 n GLU 100 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1i48 n LYS 101 N 0.48 -6.35 -0.00 3.49 4.01 0.12 -4.92 118.16 114.99 1i48 n LYS 101 Ca 0.12 0.77 0.00 0.00 -0.51 0.00 0.00 58.31 58.69 1i48 n LYS 101 Cb 0.30 -5.56 -0.00 0.00 -0.51 0.00 0.00 35.03 29.26 1i48 n LYS 101 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1i48 n ARG 102 N -4.04 6.39 -4.35 1.97 1.74 0.17 -4.98 116.66 113.56 1i48 n ARG 102 Ca -0.19 -0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.72 1i48 n ARG 102 Cb 0.63 -0.56 -0.10 0.00 -1.02 0.00 0.00 32.46 31.41 1i48 n ARG 102 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1i48 s ARG 103 N -1.12 1.44 -0.09 5.56 3.52 -1.23 -4.83 118.95 122.20 1i48 s ARG 103 Ca 0.00 -1.78 0.01 0.00 -0.13 0.00 0.00 55.73 53.84 1i48 s ARG 103 Cb 0.00 -0.44 -0.02 0.00 -1.56 0.00 0.00 34.95 32.93 1i48 s ARG 103 CO 0.02 -0.24 -0.13 0.00 -0.81 0.00 0.00 175.30 174.14 1i48 s ALA 104 N -3.61 2.65 -0.23 6.12 0.00 -1.26 -4.61 121.76 120.83 1i48 s ALA 104 Ca 0.36 -0.93 -0.31 0.00 0.00 0.00 0.00 51.96 51.08 1i48 s ALA 104 Cb 0.08 -1.11 0.16 0.00 0.00 0.00 0.00 23.12 22.25 1i48 s ALA 104 CO 0.13 0.39 1.23 0.45 0.00 0.00 0.00 175.76 177.96 1i48 s SER 105 N -0.16 -0.15 0.28 0.00 0.15 -1.26 -5.02 113.70 107.54 1i48 s SER 105 Ca -0.00 0.13 0.24 0.00 0.70 0.00 0.00 55.95 57.01 1i48 s SER 105 Cb -0.13 0.13 0.40 0.00 -1.71 0.00 0.00 66.02 64.71 1i48 s SER 105 CO 0.03 -0.17 1.49 -0.26 1.20 0.00 0.00 173.24 175.54 1i48 h PHE 106 N 2.18 0.00 0.00 3.44 0.04 -1.92 -3.47 116.94 117.20 1i48 h PHE 106 Ca -0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1i48 h PHE 106 Cb 1.17 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.32 1i48 h PHE 106 CO 0.24 0.00 0.00 -1.91 -0.60 0.00 0.00 178.31 176.04 1i48 n GLU 107 N -2.62 0.00 -4.33 1.51 2.13 -1.26 -4.46 120.64 111.61 1i48 n GLU 107 Ca 0.04 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 57.62 1i48 n GLU 107 Cb 0.49 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 32.08 1i48 n GLU 107 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1i48 s TYR 108 N 0.00 1.89 0.53 4.31 5.04 -1.26 -2.74 117.35 125.12 1i48 s TYR 108 Ca 0.00 -0.43 0.20 0.00 -2.44 0.00 0.00 57.07 54.40 1i48 s TYR 108 Cb 0.00 -0.98 1.37 0.00 0.35 0.00 0.00 41.96 42.69 1i48 s TYR 108 CO 0.00 0.30 2.12 0.78 -1.34 0.00 0.00 175.55 177.41 1i48 h GLY 109 N 3.61 0.00 2.00 8.97 0.00 -1.74 0.15 103.07 116.05 1i48 h GLY 109 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1i48 h GLY 109 CO 0.45 0.00 0.00 -2.13 0.00 0.00 0.00 176.54 174.86 1i48 n ARG 110 N -4.40 0.20 -0.21 4.80 0.63 -1.26 -2.75 116.66 113.67 1i48 n ARG 110 Ca 0.00 0.26 0.11 0.00 -0.92 0.00 0.00 57.85 57.30 1i48 n ARG 110 Cb 0.22 -1.78 0.26 0.00 0.45 0.00 0.00 32.46 31.62 1i48 n ARG 110 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1i48 n TYR 111 N -2.13 0.55 0.00 -0.14 4.01 0.50 -4.72 117.16 115.24 1i48 n TYR 111 Ca 0.05 -0.28 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 1i48 n TYR 111 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 1i48 n TYR 111 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i48 n GLY 112 N 1.43 2.08 3.64 2.72 0.00 -1.11 -4.87 105.19 109.09 1i48 n GLY 112 Ca 0.19 -1.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.32 1i48 n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i48 s ASN 113 N 0.00 -0.63 0.23 1.61 3.84 -1.26 -4.44 114.94 114.29 1i48 s ASN 113 Ca 0.00 1.11 -0.05 0.00 0.21 0.00 0.00 52.86 54.13 1i48 s ASN 113 Cb 0.00 1.19 0.38 0.00 -0.55 0.00 0.00 41.25 42.27 1i48 s ASN 113 CO 0.00 -0.18 1.77 1.55 -2.79 0.00 0.00 177.10 177.45 1i48 h PRO 114 N 5.35 0.58 -0.13 0.43 0.13 -1.97 0.16 132.00 136.55 1i48 h PRO 114 Ca -0.29 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1i48 h PRO 114 Cb 1.19 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 1i48 h PRO 114 CO 0.12 0.38 -0.20 0.00 -0.23 0.00 0.00 178.00 178.08 1i48 h THR 115 N 0.60 1.21 0.03 1.56 1.03 -1.89 -3.18 112.91 112.26 1i48 h THR 115 Ca 0.38 -0.95 -0.00 0.00 -0.01 0.00 0.00 66.41 65.82 1i48 h THR 115 Cb 0.44 1.34 0.00 0.00 -1.07 0.00 0.00 68.15 68.86 1i48 h THR 115 CO -0.30 0.29 -0.01 0.74 -0.01 0.00 0.00 175.52 176.23 1i48 h THR 116 N 0.20 1.32 -1.41 0.00 2.02 -1.45 -3.30 112.91 110.29 1i48 h THR 116 Ca 0.04 -1.78 0.42 0.00 0.77 0.00 0.00 66.41 65.85 1i48 h THR 116 Cb 0.48 2.40 -0.09 0.00 -1.74 0.00 0.00 68.15 69.19 1i48 h THR 116 CO 0.03 0.41 0.97 -0.37 0.37 0.00 0.00 175.52 176.93 1i48 h VAL 117 N -0.91 0.23 0.68 3.16 -1.51 -0.76 0.30 116.25 117.44 1i48 h VAL 117 Ca -0.00 -0.03 -0.03 0.00 -1.23 0.00 0.00 66.70 65.40 1i48 h VAL 117 Cb 0.71 0.13 0.01 0.00 -2.13 0.00 0.00 31.29 30.01 1i48 h VAL 117 CO 0.01 0.02 -0.34 0.58 -1.23 0.00 0.00 177.57 176.61 1i48 h VAL 118 N 0.09 0.00 -0.71 7.19 2.07 -1.63 0.34 116.25 123.59 1i48 h VAL 118 Ca 0.75 0.00 0.18 0.00 0.82 0.00 0.00 66.70 68.45 1i48 h VAL 118 Cb 2.63 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.36 1i48 h VAL 118 CO -0.19 0.00 0.49 0.25 0.02 0.00 0.00 177.57 178.14 1i48 h LEU 119 N -0.92 0.17 0.69 2.57 5.85 -0.64 0.48 115.31 123.51 1i48 h LEU 119 Ca -0.09 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1i48 h LEU 119 Cb 0.71 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.73 1i48 h LEU 119 CO 0.14 0.08 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.66 1i48 h GLU 120 N 0.18 -0.90 -0.96 1.25 5.08 -0.22 -1.92 114.58 117.10 1i48 h GLU 120 Ca 0.35 0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.87 1i48 h GLU 120 Cb 1.11 0.20 -0.08 0.00 0.50 0.00 0.00 28.75 30.49 1i48 h GLU 120 CO -0.06 -0.60 0.60 0.93 -1.00 0.00 0.00 179.01 178.88 1i48 h GLU 121 N -1.07 0.97 0.23 2.33 5.08 0.85 -0.76 114.58 122.22 1i48 h GLU 121 Ca -0.10 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1i48 h GLU 121 Cb 0.71 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1i48 h GLU 121 CO 0.16 0.65 -0.46 -0.22 -1.00 0.00 0.00 179.01 178.13 1i48 h LYS 122 N 1.00 -0.75 -0.79 2.33 3.64 -0.01 0.05 116.57 122.05 1i48 h LYS 122 Ca 0.45 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.92 1i48 h LYS 122 Cb 0.36 0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 1i48 h LYS 122 CO -0.23 -0.50 0.50 0.82 -2.27 0.00 0.00 179.45 177.77 1i48 h ILE 123 N -0.78 1.11 -0.39 2.00 2.04 -0.93 -2.19 117.51 118.37 1i48 h ILE 123 Ca -0.01 -0.33 0.08 0.00 1.00 0.00 0.00 64.86 65.60 1i48 h ILE 123 Cb 0.75 0.06 -0.09 0.00 -0.74 0.00 0.00 36.82 36.80 1i48 h ILE 123 CO -0.20 0.18 -0.25 0.28 0.00 0.00 0.00 178.15 178.16 1i48 h SER 124 N 0.97 -0.83 -0.07 1.72 0.02 -0.34 -0.17 113.55 114.85 1i48 h SER 124 Ca 0.32 0.17 0.03 0.00 -0.84 0.00 0.00 61.79 61.47 1i48 h SER 124 Cb 0.03 0.42 -0.03 0.00 0.14 0.00 0.00 62.40 62.95 1i48 h SER 124 CO -0.12 -0.27 -0.13 0.00 -1.14 0.00 0.00 176.83 175.17 1i48 h ALA 125 N 0.99 -0.09 0.13 3.77 0.00 -0.44 0.32 119.26 123.94 1i48 h ALA 125 Ca 0.19 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1i48 h ALA 125 Cb 0.48 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1i48 h ALA 125 CO -0.50 -0.60 -0.40 -0.07 0.00 0.00 0.00 179.25 177.68 1i48 h LEU 126 N -0.18 -1.20 0.00 0.00 3.38 -0.71 0.49 115.31 117.08 1i48 h LEU 126 Ca 0.07 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1i48 h LEU 126 Cb 0.28 0.44 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1i48 h LEU 126 CO -0.17 -0.44 0.00 -0.62 0.09 0.00 0.00 178.44 177.29 1i48 n GLU 127 N -4.76 0.03 -3.33 1.13 -0.58 -0.17 -4.84 120.64 108.11 1i48 n GLU 127 Ca -0.07 0.32 -0.16 0.00 -0.42 0.00 0.00 57.16 56.83 1i48 n GLU 127 Cb 0.32 -1.50 0.08 0.00 -0.57 0.00 0.00 31.44 29.77 1i48 n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i48 n GLY 128 N -0.60 -0.30 3.87 0.62 0.00 0.60 -4.76 105.19 104.61 1i48 n GLY 128 Ca 0.03 0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1i48 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 s ALA 129 N -3.32 4.10 0.05 4.61 0.00 0.80 -4.93 121.76 123.06 1i48 s ALA 129 Ca 0.09 -1.82 -0.15 0.00 0.00 0.00 0.00 51.96 50.08 1i48 s ALA 129 Cb -0.04 -0.90 -0.31 0.00 0.00 0.00 0.00 23.12 21.86 1i48 s ALA 129 CO 0.66 -0.28 1.07 1.49 0.00 0.00 0.00 175.76 178.70 1i48 h GLU 130 N 0.99 0.58 -2.35 0.00 4.81 -1.84 -3.42 114.58 113.34 1i48 h GLU 130 Ca -0.40 -0.86 -0.03 0.00 -0.13 0.00 0.00 59.36 57.94 1i48 h GLU 130 Cb 1.27 0.30 -0.16 0.00 0.63 0.00 0.00 28.75 30.79 1i48 h GLU 130 CO 0.58 1.40 0.23 0.45 -0.73 0.00 0.00 179.01 180.94 1i48 s SER 131 N -7.48 -0.60 0.10 1.04 0.15 -0.74 -4.81 113.70 101.37 1i48 s SER 131 Ca -0.09 0.41 0.06 0.00 0.70 0.00 0.00 55.95 57.03 1i48 s SER 131 Cb 0.05 0.54 -0.03 0.00 -1.71 0.00 0.00 66.02 64.87 1i48 s SER 131 CO 0.94 -0.73 -0.14 -0.89 1.20 0.00 0.00 173.24 173.62 1i48 s THR 132 N -2.20 1.26 0.04 6.45 2.01 -1.26 -1.19 115.64 120.75 1i48 s THR 132 Ca -0.05 -1.57 0.07 0.00 0.31 0.00 0.00 61.69 60.44 1i48 s THR 132 Cb -0.00 -1.38 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 1i48 s THR 132 CO 0.00 -0.34 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.17 1i48 s LEU 133 N -2.20 2.17 -0.16 4.42 2.96 0.29 -4.89 118.68 121.28 1i48 s LEU 133 Ca 0.05 -0.52 0.01 0.00 -0.22 0.00 0.00 54.13 53.45 1i48 s LEU 133 Cb -0.07 -0.94 0.02 0.00 0.50 0.00 0.00 46.19 45.70 1i48 s LEU 133 CO 0.03 0.15 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.27 1i48 s LEU 134 N -1.18 1.90 0.00 -0.68 1.43 -1.26 -0.48 118.68 118.42 1i48 s LEU 134 Ca 0.07 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 1i48 s LEU 134 Cb -0.09 -1.32 0.01 0.00 0.03 0.00 0.00 46.19 44.82 1i48 s LEU 134 CO 0.02 -0.01 0.05 0.23 0.23 0.00 0.00 176.35 176.86 1i48 n MET 135 N 4.60 0.89 0.06 1.70 2.81 0.52 -4.37 117.12 123.32 1i48 n MET 135 Ca -0.19 -0.18 0.12 0.00 -1.81 0.00 0.00 57.70 55.64 1i48 n MET 135 Cb 0.50 -0.02 0.23 0.00 -0.71 0.00 0.00 33.22 33.23 1i48 n MET 135 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1i48 n ALA 136 N -2.97 2.89 -3.62 3.04 0.00 -0.85 -3.26 120.51 115.75 1i48 n ALA 136 Ca -0.01 -0.22 -0.05 0.00 0.00 0.00 0.00 53.44 53.15 1i48 n ALA 136 Cb 0.04 -1.22 -0.05 0.00 0.00 0.00 0.00 19.45 18.22 1i48 n ALA 136 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1i48 s SER 137 N -4.05 -0.17 0.19 0.00 1.04 -1.26 -2.99 113.70 106.46 1i48 s SER 137 Ca 0.08 0.20 -0.23 0.00 0.48 0.00 0.00 55.95 56.47 1i48 s SER 137 Cb 0.14 0.16 0.10 0.00 0.10 0.00 0.00 66.02 66.51 1i48 s SER 137 CO 0.69 -0.15 1.56 1.23 0.98 0.00 0.00 173.24 177.56 1i48 h GLY 138 N 2.37 -0.31 -0.68 7.32 0.00 -1.83 0.36 103.07 110.29 1i48 h GLY 138 Ca -0.13 0.57 0.16 0.00 0.00 0.00 0.00 47.33 47.93 1i48 h GLY 138 CO 0.25 -0.15 -0.24 -0.33 0.00 0.00 0.00 176.54 176.07 1i48 h MET 139 N -0.11 -0.01 0.27 4.80 2.86 -1.95 0.24 114.93 121.02 1i48 h MET 139 Ca 0.24 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.88 1i48 h MET 139 Cb 0.55 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1i48 h MET 139 CO -0.82 -0.01 -0.41 0.00 1.06 0.00 0.00 176.91 176.73 1i48 h ALA 141 N -0.33 -0.45 0.16 0.00 0.00 0.75 0.44 119.26 119.83 1i48 h ALA 141 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1i48 h ALA 141 Cb 0.71 0.87 -0.05 0.00 0.00 0.00 0.00 17.79 19.32 1i48 h ALA 141 CO -0.15 -0.54 -0.50 0.66 0.00 0.00 0.00 179.25 178.72 1i48 h SER 142 N -0.13 -1.48 -0.76 0.00 4.64 -1.05 0.16 113.55 114.93 1i48 h SER 142 Ca 0.03 0.15 0.12 0.00 -0.47 0.00 0.00 61.79 61.62 1i48 h SER 142 Cb 0.20 0.54 -0.13 0.00 -0.31 0.00 0.00 62.40 62.70 1i48 h SER 142 CO -0.21 -0.55 -0.38 0.74 -0.87 0.00 0.00 176.83 175.56 1i48 h THR 143 N -0.76 0.09 0.72 2.95 2.02 -0.41 -0.03 112.91 117.49 1i48 h THR 143 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1i48 h THR 143 Cb 0.75 0.09 0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1i48 h THR 143 CO -0.26 0.00 -0.35 0.58 0.37 0.00 0.00 175.52 175.87 1i48 h VAL 144 N -0.10 0.00 -0.75 3.16 2.07 0.27 -2.79 116.25 118.10 1i48 h VAL 144 Ca 0.27 -0.01 0.26 0.00 0.82 0.00 0.00 66.70 68.04 1i48 h VAL 144 Cb 0.57 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.20 1i48 h VAL 144 CO -0.81 0.00 0.21 0.80 0.02 0.00 0.00 177.57 177.80 1i48 n MET 145 N -4.64 -0.05 0.28 1.57 0.00 0.54 0.47 117.12 115.29 1i48 n MET 145 Ca -0.12 1.08 -0.11 0.00 0.00 0.00 0.00 57.70 58.55 1i48 n MET 145 Cb 0.38 -1.83 -0.05 0.00 0.00 0.00 0.00 33.22 31.72 1i48 n MET 145 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 1i48 h LEU 146 N 0.00 -0.60 -2.10 -0.89 3.38 -0.81 -0.51 115.31 113.78 1i48 h LEU 146 Ca 0.55 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.62 1i48 h LEU 146 Cb 1.32 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 1i48 h LEU 146 CO -0.64 -0.38 0.33 -0.07 0.09 0.00 0.00 178.44 177.76 1i48 h LEU 147 N -0.81 0.00 0.02 1.67 3.38 -0.27 -0.39 115.31 118.91 1i48 h LEU 147 Ca -0.07 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1i48 h LEU 147 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1i48 h LEU 147 CO 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 178.64 1i48 h ALA 148 N 1.60 -0.02 0.02 1.53 0.00 0.37 -3.41 119.26 119.35 1i48 h ALA 148 Ca 0.13 -0.30 -0.28 0.00 0.00 0.00 0.00 54.91 54.45 1i48 h ALA 148 Cb 0.78 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1i48 h ALA 148 CO -0.00 -0.20 -1.55 1.28 0.00 0.00 0.00 179.25 178.78 1i48 n LEU 149 N -4.80 1.99 -4.66 0.00 4.77 -0.23 -4.88 117.00 109.19 1i48 n LEU 149 Ca -0.09 0.38 -0.42 0.00 -0.03 0.00 0.00 56.01 55.84 1i48 n LEU 149 Cb 0.31 -0.97 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 1i48 n LEU 149 CO 0.33 0.40 1.38 -0.69 -1.33 0.00 0.00 177.39 177.48 1i48 s VAL 150 N -2.41 3.53 0.98 4.08 1.01 -0.22 -4.99 120.40 122.38 1i48 s VAL 150 Ca -0.30 0.66 -0.15 0.00 0.00 0.00 0.00 61.98 62.19 1i48 s VAL 150 Cb 0.07 -3.43 0.19 0.00 0.00 0.00 0.00 36.38 33.22 1i48 s VAL 150 CO 0.60 -0.06 1.24 -2.84 0.00 0.00 0.00 175.10 174.04 1i48 s PRO 151 N 4.00 0.57 0.29 2.72 0.02 -1.26 -4.71 135.00 136.63 1i48 s PRO 151 Ca 0.74 -0.18 -0.29 0.00 0.02 0.00 0.00 61.00 61.29 1i48 s PRO 151 Cb -0.34 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.26 1i48 s PRO 151 CO 0.30 -2.50 1.33 0.00 -0.33 0.00 0.00 177.00 175.80 1i48 s ALA 152 N -3.61 3.53 0.00 -1.55 0.00 -1.26 -2.12 121.76 116.75 1i48 s ALA 152 Ca 0.70 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1i48 s ALA 152 Cb -0.07 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1i48 s ALA 152 CO 0.53 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 176.07 1i48 n GLY 153 N 1.35 0.22 3.73 0.00 0.00 -0.62 -4.95 105.19 104.94 1i48 n GLY 153 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1i48 n GLY 153 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i48 s GLY 154 N -2.00 1.64 0.05 -0.02 0.00 -0.90 -4.66 107.32 101.42 1i48 s GLY 154 Ca 0.00 -0.94 0.07 0.00 0.00 0.00 0.00 44.72 43.86 1i48 s GLY 154 CO 0.00 -0.15 -0.21 -1.58 0.00 0.00 0.00 173.10 171.16 1i48 s HIS 155 N -3.33 1.83 0.03 1.90 5.65 -1.26 -1.31 115.29 118.81 1i48 s HIS 155 Ca 0.70 -0.38 0.02 0.00 0.25 0.00 0.00 55.06 55.66 1i48 s HIS 155 Cb -0.09 -1.09 -0.02 0.00 -1.18 0.00 0.00 32.58 30.20 1i48 s HIS 155 CO 0.55 0.10 -0.07 -1.50 -0.65 0.00 0.00 174.74 173.17 1i48 s ILE 156 N -0.81 0.47 -0.08 0.89 2.07 -0.41 -0.07 121.20 123.26 1i48 s ILE 156 Ca 0.08 -0.80 0.03 0.00 -1.41 0.00 0.00 60.65 58.54 1i48 s ILE 156 Cb -0.09 -0.50 -0.02 0.00 0.13 0.00 0.00 42.46 41.98 1i48 s ILE 156 CO 0.02 -0.24 -0.15 -0.69 -1.91 0.00 0.00 174.94 171.97 1i48 s VAL 157 N -1.00 2.93 0.03 4.00 1.01 -0.62 -0.95 120.40 125.80 1i48 s VAL 157 Ca -0.07 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 1i48 s VAL 157 Cb -0.08 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1i48 s VAL 157 CO 0.00 0.56 0.30 0.28 0.00 0.00 0.00 175.10 176.25 1i48 s THR 158 N -0.27 0.08 0.72 3.92 -1.32 -0.83 0.91 115.64 118.84 1i48 s THR 158 Ca 0.01 -0.64 -0.11 0.00 -1.21 0.00 0.00 61.69 59.75 1i48 s THR 158 Cb -0.13 -0.86 0.03 0.00 -1.51 0.00 0.00 72.50 70.03 1i48 s THR 158 CO 0.03 -0.35 1.08 0.42 -2.21 0.00 0.00 174.62 173.58 1i48 s THR 159 N -2.27 3.65 0.03 5.08 -4.23 -1.25 -1.72 115.64 114.94 1i48 s THR 159 Ca -0.07 0.56 -0.25 0.00 -1.18 0.00 0.00 61.69 60.75 1i48 s THR 159 Cb -0.02 -3.16 -0.18 0.00 1.34 0.00 0.00 72.50 70.48 1i48 s THR 159 CO -0.02 -0.68 1.46 0.71 -0.54 0.00 0.00 174.62 175.55 1i48 h THR 160 N -0.81 1.19 -2.52 3.99 1.35 -0.57 -3.41 112.91 112.14 1i48 h THR 160 Ca -0.44 -0.65 -0.57 0.00 -0.55 0.00 0.00 66.41 64.20 1i48 h THR 160 Cb 1.22 1.63 -0.02 0.00 -1.73 0.00 0.00 68.15 69.25 1i48 h THR 160 CO 0.54 0.17 1.32 -1.81 -0.25 0.00 0.00 175.52 175.48 1i48 s ASP 161 N -5.45 5.78 0.19 5.36 1.11 -1.26 -4.94 116.67 117.46 1i48 s ASP 161 Ca -0.15 1.35 -0.02 0.00 0.18 0.00 0.00 52.55 53.91 1i48 s ASP 161 Cb 0.03 -2.52 -0.04 0.00 1.07 0.00 0.00 42.92 41.47 1i48 s ASP 161 CO 0.66 -1.79 0.16 0.00 1.18 0.00 0.00 175.17 175.38 1i48 s TYR 163 N -4.12 2.73 0.01 0.00 5.04 -1.26 -4.87 117.35 114.88 1i48 s TYR 163 Ca 0.34 0.91 -0.03 0.00 -2.44 0.00 0.00 57.07 55.86 1i48 s TYR 163 Cb 0.06 -3.73 -0.01 0.00 0.35 0.00 0.00 41.96 38.63 1i48 s TYR 163 CO 0.10 -1.77 0.20 -2.13 -1.34 0.00 0.00 175.55 170.61 1i48 n ARG 164 N 7.02 -0.04 0.31 4.97 3.00 -1.26 0.08 116.66 130.74 1i48 n ARG 164 Ca 0.15 0.20 -0.18 0.00 -0.00 0.00 0.00 57.85 58.01 1i48 n ARG 164 Cb 0.46 -0.30 -0.10 0.00 0.00 0.00 0.00 32.46 32.52 1i48 n ARG 164 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1i48 h LYS 165 N 0.00 -0.98 -1.12 -0.14 6.56 -1.98 -2.07 116.57 116.84 1i48 h LYS 165 Ca 0.01 0.07 0.35 0.00 -1.06 0.00 0.00 60.65 60.02 1i48 h LYS 165 Cb 0.04 0.22 -0.13 0.00 -0.57 0.00 0.00 32.23 31.79 1i48 h LYS 165 CO -0.09 -0.65 0.69 1.15 -2.06 0.00 0.00 179.45 178.50 1i48 h THR 166 N -1.01 0.30 0.28 -0.16 2.02 -0.74 0.30 112.91 113.89 1i48 h THR 166 Ca -0.06 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 1i48 h THR 166 Cb 0.87 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1i48 h THR 166 CO -0.04 0.05 -0.20 -0.09 0.37 0.00 0.00 175.52 175.60 1i48 h ARG 167 N 0.26 -0.44 -0.85 6.66 2.43 -0.45 -3.00 114.38 118.97 1i48 h ARG 167 Ca 0.73 0.03 0.16 0.00 -0.81 0.00 0.00 59.98 60.09 1i48 h ARG 167 Cb 1.94 0.10 -0.16 0.00 -0.42 0.00 0.00 29.97 31.43 1i48 h ARG 167 CO -0.46 -0.30 -0.26 0.82 -1.51 0.00 0.00 179.97 178.27 1i48 h ILE 168 N -0.46 0.12 -0.76 1.20 2.04 -0.63 0.11 117.51 119.12 1i48 h ILE 168 Ca -0.04 0.00 0.17 0.00 1.00 0.00 0.00 64.86 65.99 1i48 h ILE 168 Cb 0.38 0.12 -0.11 0.00 -0.74 0.00 0.00 36.82 36.47 1i48 h ILE 168 CO 0.02 0.00 0.23 0.15 0.00 0.00 0.00 178.15 178.55 1i48 h PHE 169 N -0.02 0.37 -0.10 1.37 3.57 -1.38 0.41 116.94 121.17 1i48 h PHE 169 Ca 0.38 0.04 -0.17 0.00 3.53 0.00 0.00 57.97 61.75 1i48 h PHE 169 Cb 0.62 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1i48 h PHE 169 CO -0.70 -0.05 -0.66 0.82 -2.23 0.00 0.00 178.31 175.48 1i48 h ILE 170 N 0.32 1.37 0.00 1.41 2.04 -0.70 -0.09 117.51 121.86 1i48 h ILE 170 Ca 0.44 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 64.26 1i48 h ILE 170 Cb 0.74 2.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1i48 h ILE 170 CO -0.49 0.61 -0.24 -0.62 0.00 0.00 0.00 178.15 177.41 1i48 n GLU 171 N -3.87 0.03 0.00 2.37 1.02 -0.07 -4.17 120.64 115.96 1i48 n GLU 171 Ca -0.04 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1i48 n GLU 171 Cb 0.67 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 1i48 n GLU 171 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1i48 n THR 172 N -1.58 0.00 -0.08 2.62 -2.24 0.13 -4.84 114.28 108.29 1i48 n THR 172 Ca 0.06 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.76 1i48 n THR 172 Cb 0.35 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.23 1i48 n THR 172 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1i48 n ILE 173 N -1.06 1.47 -0.33 2.28 2.08 -0.09 -4.40 119.36 119.30 1i48 n ILE 173 Ca 0.00 0.16 0.20 0.00 0.56 0.00 0.00 62.75 63.67 1i48 n ILE 173 Cb 0.18 -2.36 0.42 0.00 -0.75 0.00 0.00 39.64 37.13 1i48 n ILE 173 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1i48 h LEU 174 N -1.00 0.50 -1.56 1.39 3.38 -1.61 0.42 115.31 116.84 1i48 h LEU 174 Ca -0.02 0.17 0.17 0.00 0.09 0.00 0.00 57.88 58.29 1i48 h LEU 174 Cb 0.81 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.62 1i48 h LEU 174 CO -0.01 -0.05 0.54 1.55 0.09 0.00 0.00 178.44 180.56 1i48 h PRO 175 N 0.40 0.40 -0.76 1.13 0.13 -1.72 0.81 132.00 132.39 1i48 h PRO 175 Ca 0.68 -0.02 0.09 0.00 -0.87 0.00 0.00 66.00 65.87 1i48 h PRO 175 Cb 1.43 -0.09 -0.07 0.00 0.13 0.00 0.00 31.00 32.40 1i48 h PRO 175 CO -0.56 0.27 0.41 0.87 -0.23 0.00 0.00 178.00 178.76 1i48 h LYS 176 N 0.41 0.69 -0.18 0.86 1.57 -0.35 0.61 116.57 120.17 1i48 h LYS 176 Ca 0.40 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1i48 h LYS 176 Cb 0.96 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1i48 h LYS 176 CO -0.14 0.46 0.00 -1.33 -0.57 0.00 0.00 179.45 177.87 1i48 n MET 177 N -4.79 1.18 -1.44 3.15 2.81 0.18 -4.83 117.12 113.38 1i48 n MET 177 Ca 0.12 -0.25 -0.11 0.00 -1.81 0.00 0.00 57.70 55.64 1i48 n MET 177 Cb 0.26 -1.12 -0.04 0.00 -0.71 0.00 0.00 33.22 31.60 1i48 n MET 177 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i48 n GLY 178 N 0.54 1.08 3.58 3.03 0.00 0.21 -1.58 105.19 112.05 1i48 n GLY 178 Ca 0.02 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 1i48 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i48 s ILE 179 N -2.44 4.74 0.18 -0.61 1.01 -0.63 -3.01 121.20 120.44 1i48 s ILE 179 Ca 0.00 0.85 -0.04 0.00 0.00 0.00 0.00 60.65 61.46 1i48 s ILE 179 Cb 0.00 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1i48 s ILE 179 CO 0.00 -0.44 0.41 0.28 0.00 0.00 0.00 174.94 175.19 1i48 s THR 180 N 3.09 5.15 0.04 2.92 -1.32 -0.42 -3.70 115.64 121.40 1i48 s THR 180 Ca 0.31 -0.06 -0.01 0.00 -1.21 0.00 0.00 61.69 60.72 1i48 s THR 180 Cb -0.13 -3.67 -0.03 0.00 -1.51 0.00 0.00 72.50 67.16 1i48 s THR 180 CO 0.17 -0.07 -0.02 0.00 -2.21 0.00 0.00 174.62 172.49 1i48 s ALA 181 N -1.78 0.38 -0.09 11.08 0.00 -1.26 -1.28 121.76 128.80 1i48 s ALA 181 Ca 0.41 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 51.40 1i48 s ALA 181 Cb -0.12 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1i48 s ALA 181 CO 0.26 -0.31 -0.23 0.99 0.00 0.00 0.00 175.76 176.47 1i48 s THR 182 N -3.22 1.97 -0.25 0.00 2.01 -0.13 -4.94 115.64 111.09 1i48 s THR 182 Ca 0.00 -0.97 -0.11 0.00 0.31 0.00 0.00 61.69 60.92 1i48 s THR 182 Cb 0.03 -1.70 -0.05 0.00 0.01 0.00 0.00 72.50 70.79 1i48 s THR 182 CO -0.07 0.54 0.18 -0.69 -0.69 0.00 0.00 174.62 173.88 1i48 s VAL 183 N 0.31 5.34 0.26 3.82 1.01 -1.26 -1.97 120.40 127.91 1i48 s VAL 183 Ca -0.17 0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.05 1i48 s VAL 183 Cb -0.17 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 1i48 s VAL 183 CO 0.08 0.32 0.00 0.27 0.00 0.00 0.00 175.10 175.77 1i48 s ILE 184 N 1.26 1.16 0.28 2.22 -4.36 -0.70 -4.87 121.20 116.19 1i48 s ILE 184 Ca 0.08 -2.04 -0.29 0.00 -0.26 0.00 0.00 60.65 58.14 1i48 s ILE 184 Cb -0.14 -2.45 -0.09 0.00 1.25 0.00 0.00 42.46 41.02 1i48 s ILE 184 CO 0.06 -0.25 1.03 -0.62 0.24 0.00 0.00 174.94 175.40 1i48 s ASP 185 N -3.36 7.34 0.42 4.36 2.15 -1.26 0.21 116.67 126.54 1i48 s ASP 185 Ca 0.30 2.10 0.19 0.00 0.43 0.00 0.00 52.55 55.57 1i48 s ASP 185 Cb 0.06 -2.61 1.12 0.00 -0.30 0.00 0.00 42.92 41.19 1i48 s ASP 185 CO 0.11 -0.07 1.83 -0.65 -0.17 0.00 0.00 175.17 176.21 1i48 h PRO 186 N 3.72 0.36 0.09 4.34 0.11 -1.94 -2.69 132.00 135.99 1i48 h PRO 186 Ca -0.46 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.38 1i48 h PRO 186 Cb 1.21 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1i48 h PRO 186 CO 0.67 0.24 -1.27 0.00 -0.21 0.00 0.00 178.00 177.43 1i48 h ALA 187 N 1.60 0.17 -0.03 -0.75 0.00 -1.92 -3.44 119.26 114.89 1i48 h ALA 187 Ca 0.51 -1.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.34 1i48 h ALA 187 Cb 1.35 0.47 0.01 0.00 0.00 0.00 0.00 17.79 19.61 1i48 h ALA 187 CO -0.20 0.74 0.63 -3.47 0.00 0.00 0.00 179.25 176.94 1i48 n ASP 188 N -4.04 -0.55 0.20 0.00 -0.08 -1.01 -4.64 116.55 106.42 1i48 n ASP 188 Ca -0.24 -1.78 0.05 0.00 -1.51 0.00 0.00 54.79 51.30 1i48 n ASP 188 Cb 0.84 -0.94 0.42 0.00 2.34 0.00 0.00 41.12 43.77 1i48 n ASP 188 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1i48 h VAL 189 N 6.59 1.11 0.19 5.18 2.07 -1.85 -3.02 116.25 126.52 1i48 h VAL 189 Ca 0.02 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.39 1i48 h VAL 189 Cb 0.94 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 1i48 h VAL 189 CO 1.02 0.31 -0.17 1.23 0.02 0.00 0.00 177.57 179.99 1i48 h GLY 190 N 1.15 -0.37 0.18 2.17 0.00 -1.97 -0.24 103.07 103.98 1i48 h GLY 190 Ca -0.00 0.19 0.11 0.00 0.00 0.00 0.00 47.33 47.63 1i48 h GLY 190 CO 0.04 -0.17 0.08 0.00 0.00 0.00 0.00 176.54 176.49 1i48 h ALA 191 N 0.39 0.61 0.18 3.60 0.00 -1.92 0.63 119.26 122.75 1i48 h ALA 191 Ca -0.00 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1i48 h ALA 191 Cb 0.35 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1i48 h ALA 191 CO -0.03 -0.34 -0.22 1.25 0.00 0.00 0.00 179.25 179.91 1i48 h LEU 192 N 0.20 -0.59 -0.98 0.00 5.85 -1.43 0.45 115.31 118.82 1i48 h LEU 192 Ca 0.29 0.06 0.04 0.00 0.84 0.00 0.00 57.88 59.11 1i48 h LEU 192 Cb 0.43 0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 1i48 h LEU 192 CO -0.41 -0.31 0.64 -0.08 -0.34 0.00 0.00 178.44 177.93 1i48 h GLU 193 N -0.45 1.18 0.75 1.25 4.81 -0.13 0.39 114.58 122.38 1i48 h GLU 193 Ca 0.01 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1i48 h GLU 193 Cb 0.43 -0.27 0.01 0.00 0.63 0.00 0.00 28.75 29.55 1i48 h GLU 193 CO -0.08 0.78 -0.36 1.25 -0.73 0.00 0.00 179.01 179.88 1i48 h LEU 194 N 1.22 -0.85 -1.57 1.64 5.85 0.98 -2.85 115.31 119.73 1i48 h LEU 194 Ca 0.39 0.03 0.10 0.00 0.84 0.00 0.00 57.88 59.24 1i48 h LEU 194 Cb 0.03 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 1i48 h LEU 194 CO -0.13 -0.58 0.43 0.00 -0.34 0.00 0.00 178.44 177.81 1i48 h ALA 195 N -1.49 1.95 -0.46 1.25 0.00 0.03 0.11 119.26 120.66 1i48 h ALA 195 Ca -0.10 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.93 1i48 h ALA 195 Cb 0.77 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1i48 h ALA 195 CO 0.17 -0.09 0.40 1.25 0.00 0.00 0.00 179.25 180.98 1i48 h LEU 196 N 0.49 0.00 0.00 0.00 7.12 0.01 -2.65 115.31 120.29 1i48 h LEU 196 Ca 0.30 0.00 -0.40 0.00 0.13 0.00 0.00 57.88 57.91 1i48 h LEU 196 Cb 0.51 0.00 -0.07 0.00 -0.53 0.00 0.00 40.66 40.57 1i48 h LEU 196 CO -0.09 0.00 -2.47 0.59 -0.13 0.00 0.00 178.44 176.34 1i48 n ASN 197 N -4.03 1.98 0.01 1.25 3.02 0.26 -4.65 115.26 113.09 1i48 n ASN 197 Ca 0.08 -0.06 -0.02 0.00 -0.03 0.00 0.00 54.58 54.56 1i48 n ASN 197 Cb 0.60 -0.49 -0.01 0.00 -0.61 0.00 0.00 39.78 39.27 1i48 n ASN 197 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1i48 h GLN 198 N -0.15 -0.08 -6.32 3.52 4.20 -0.86 -3.44 115.11 111.98 1i48 h GLN 198 Ca -0.59 0.01 -0.53 0.00 0.06 0.00 0.00 58.65 57.60 1i48 h GLN 198 Cb 1.86 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.65 1i48 h GLN 198 CO -0.13 -0.05 -0.20 0.15 -0.67 0.00 0.00 178.83 177.93 1i48 s LYS 199 N -3.34 2.30 -0.73 1.46 3.01 -1.06 -5.07 119.74 116.32 1i48 s LYS 199 Ca -0.02 -1.79 -0.14 0.00 -1.01 0.00 0.00 55.97 53.01 1i48 s LYS 199 Cb 0.01 -2.41 0.19 0.00 -1.01 0.00 0.00 37.83 34.61 1i48 s LYS 199 CO 0.08 -0.72 0.67 0.21 0.51 0.00 0.00 175.35 176.10 1i48 s LYS 200 N -4.48 3.38 0.28 1.68 2.36 -1.26 -4.67 119.74 117.03 1i48 s LYS 200 Ca 0.50 -2.23 -0.29 0.00 -2.55 0.00 0.00 55.97 51.39 1i48 s LYS 200 Cb -0.04 -4.37 -0.10 0.00 -1.05 0.00 0.00 37.83 32.27 1i48 s LYS 200 CO 0.31 -1.30 1.27 0.08 1.55 0.00 0.00 175.35 177.26 1i48 s VAL 201 N 0.60 3.00 -0.17 4.02 1.01 -1.26 -4.23 120.40 123.38 1i48 s VAL 201 Ca 0.13 0.95 0.04 0.00 0.00 0.00 0.00 61.98 63.10 1i48 s VAL 201 Cb -0.17 -3.60 -0.22 0.00 0.00 0.00 0.00 36.38 32.39 1i48 s VAL 201 CO -0.05 0.20 0.17 0.59 0.00 0.00 0.00 175.10 176.01 1i48 n ASN 202 N 1.44 1.48 -3.64 3.32 4.13 0.90 -4.35 115.26 118.55 1i48 n ASN 202 Ca 0.02 0.10 -0.09 0.00 1.68 0.00 0.00 54.58 56.28 1i48 n ASN 202 Cb 0.43 -0.25 -0.07 0.00 -1.54 0.00 0.00 39.78 38.35 1i48 n ASN 202 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1i48 s LEU 203 N -6.43 -0.60 -0.29 3.41 0.20 -1.24 -2.26 118.68 111.48 1i48 s LEU 203 Ca -0.21 1.09 -0.12 0.00 0.69 0.00 0.00 54.13 55.58 1i48 s LEU 203 Cb 0.07 2.07 -0.04 0.00 -0.43 0.00 0.00 46.19 47.86 1i48 s LEU 203 CO 0.74 -0.18 0.22 0.12 -0.29 0.00 0.00 176.35 176.96 1i48 s PHE 204 N 0.63 3.22 -0.08 5.38 5.36 0.70 -1.59 117.98 131.60 1i48 s PHE 204 Ca -0.01 0.09 0.05 0.00 -0.96 0.00 0.00 56.93 56.10 1i48 s PHE 204 Cb -0.05 -2.43 -0.01 0.00 -0.34 0.00 0.00 43.02 40.20 1i48 s PHE 204 CO -0.08 -0.21 -0.24 0.12 -1.46 0.00 0.00 175.22 173.35 1i48 s PHE 205 N 1.80 2.51 -0.09 10.12 5.36 0.26 -0.93 117.98 137.00 1i48 s PHE 205 Ca 0.08 -0.86 -0.30 0.00 -0.96 0.00 0.00 56.93 54.88 1i48 s PHE 205 Cb -0.16 -1.66 0.12 0.00 -0.34 0.00 0.00 43.02 40.98 1i48 s PHE 205 CO 0.11 -0.30 0.99 -0.08 -1.46 0.00 0.00 175.22 174.47 1i48 s THR 206 N 0.07 0.00 -0.05 0.12 -1.32 -0.70 -3.78 115.64 109.98 1i48 s THR 206 Ca -0.11 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.38 1i48 s THR 206 Cb -0.16 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.80 1i48 s THR 206 CO 0.06 0.00 -0.03 -1.83 -2.21 0.00 0.00 174.62 170.61 1i48 s GLU 207 N -2.37 2.81 -0.11 7.08 1.03 -1.26 -1.30 118.70 124.57 1i48 s GLU 207 Ca 0.04 -0.53 -0.04 0.00 0.03 0.00 0.00 54.97 54.46 1i48 s GLU 207 Cb -0.01 -2.66 0.06 0.00 -0.80 0.00 0.00 34.13 30.72 1i48 s GLU 207 CO -0.05 0.66 0.22 0.45 -1.33 0.00 0.00 175.26 175.22 1i48 s SER 208 N -1.03 0.42 0.92 0.83 0.15 -1.19 -3.42 113.70 110.37 1i48 s SER 208 Ca 0.14 0.50 -0.11 0.00 0.70 0.00 0.00 55.95 57.18 1i48 s SER 208 Cb -0.11 0.53 0.11 0.00 -1.71 0.00 0.00 66.02 64.84 1i48 s SER 208 CO 0.04 -0.23 0.94 -2.65 1.20 0.00 0.00 173.24 172.54 1i48 n PRO 209 N 5.22 -0.38 -2.42 5.44 -0.02 -1.26 -4.51 135.00 137.06 1i48 n PRO 209 Ca -0.08 -0.05 -0.22 0.00 -2.02 0.00 0.00 63.50 61.13 1i48 n PRO 209 Cb 0.50 -2.23 0.12 0.00 -0.02 0.00 0.00 33.50 31.87 1i48 n PRO 209 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1i48 n THR 210 N -4.01 0.00 -4.43 3.45 5.66 0.16 -4.72 114.28 110.38 1i48 n THR 210 Ca 0.11 -1.46 -0.20 0.00 -3.05 0.00 0.00 64.05 59.45 1i48 n THR 210 Cb 0.52 -0.95 -0.15 0.00 -1.55 0.00 0.00 70.33 68.20 1i48 n THR 210 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1i48 s ASN 211 N -4.89 1.24 -0.07 1.09 3.04 -1.26 -1.37 114.94 112.73 1i48 s ASN 211 Ca 0.63 -0.19 0.20 0.00 0.04 0.00 0.00 52.86 53.54 1i48 s ASN 211 Cb -0.03 -0.24 0.69 0.00 -1.54 0.00 0.00 41.25 40.13 1i48 s ASN 211 CO 0.42 0.10 1.60 -0.81 -3.04 0.00 0.00 177.10 175.37 1i48 n PRO 212 N 3.06 3.34 -0.35 0.43 -0.04 -1.26 -4.03 135.00 136.15 1i48 n PRO 212 Ca -0.16 -2.81 0.10 0.00 -0.04 0.00 0.00 63.50 60.60 1i48 n PRO 212 Cb 0.55 -1.76 0.29 0.00 -0.04 0.00 0.00 33.50 32.53 1i48 n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1i48 n PHE 213 N 1.33 0.90 -2.88 0.54 3.72 -1.26 -4.55 117.46 115.26 1i48 n PHE 213 Ca 0.25 -0.44 -0.11 0.00 -0.05 0.00 0.00 57.45 57.11 1i48 n PHE 213 Cb 0.79 -0.02 -0.01 0.00 -0.94 0.00 0.00 39.48 39.29 1i48 n PHE 213 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1i48 n LEU 214 N 1.34 -0.50 -4.76 4.37 4.32 -0.47 -4.76 117.00 116.54 1i48 n LEU 214 Ca 0.22 0.10 -0.41 0.00 -0.02 0.00 0.00 56.01 55.89 1i48 n LEU 214 Cb 0.56 -1.42 -0.01 0.00 -1.62 0.00 0.00 43.42 40.93 1i48 n LEU 214 CO 0.15 0.01 1.12 -0.13 -1.22 0.00 0.00 177.39 177.32 1i48 s ARG 215 N -5.44 4.20 0.16 3.23 1.81 -1.26 -3.91 118.95 117.74 1i48 s ARG 215 Ca 0.17 2.43 0.06 0.00 -1.72 0.00 0.00 55.73 56.66 1i48 s ARG 215 Cb -0.09 -3.04 -0.04 0.00 -0.45 0.00 0.00 34.95 31.33 1i48 s ARG 215 CO 0.20 -0.45 0.07 0.00 -0.68 0.00 0.00 175.30 174.44 1i48 s VAL 217 N -1.70 2.38 -1.11 0.00 1.01 -1.26 -4.70 120.40 115.02 1i48 s VAL 217 Ca 0.29 -0.92 -0.24 0.00 0.00 0.00 0.00 61.98 61.12 1i48 s VAL 217 Cb -0.10 -1.93 -0.13 0.00 0.00 0.00 0.00 36.38 34.22 1i48 s VAL 217 CO 0.21 0.55 1.96 -0.67 0.00 0.00 0.00 175.10 177.15 1i48 n ASP 218 N 3.36 2.68 -0.05 3.32 -0.08 -1.26 -4.78 116.55 119.73 1i48 n ASP 218 Ca -0.18 -2.66 -0.01 0.00 -1.51 0.00 0.00 54.79 50.43 1i48 n ASP 218 Cb 0.53 -1.66 -0.01 0.00 2.34 0.00 0.00 41.12 42.32 1i48 n ASP 218 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1i48 n ILE 219 N 7.87 -0.08 -0.31 5.18 5.41 -1.26 -1.19 119.36 134.98 1i48 n ILE 219 Ca 0.45 1.48 -0.01 0.00 1.00 0.00 0.00 62.75 65.66 1i48 n ILE 219 Cb 0.46 -1.94 0.02 0.00 -0.71 0.00 0.00 39.64 37.47 1i48 n ILE 219 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1i48 n GLU 220 N -3.20 -0.20 0.48 0.38 2.13 -1.20 0.94 120.64 119.96 1i48 n GLU 220 Ca 0.00 1.24 -0.20 0.00 0.66 0.00 0.00 57.16 58.86 1i48 n GLU 220 Cb 0.03 -1.84 -0.10 0.00 0.27 0.00 0.00 31.44 29.80 1i48 n GLU 220 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1i48 h LEU 221 N 0.00 -1.17 -0.37 4.31 5.85 -1.52 -2.35 115.31 120.07 1i48 h LEU 221 Ca 0.27 0.05 0.07 0.00 0.84 0.00 0.00 57.88 59.12 1i48 h LEU 221 Cb 0.47 0.32 -0.07 0.00 0.37 0.00 0.00 40.66 41.75 1i48 h LEU 221 CO -0.80 -0.77 -0.09 0.58 -0.34 0.00 0.00 178.44 177.02 1i48 h VAL 222 N -1.26 0.63 -0.83 1.05 2.07 0.62 -1.00 116.25 117.52 1i48 h VAL 222 Ca -0.12 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.58 1i48 h VAL 222 Cb 0.99 0.63 -0.11 0.00 -1.52 0.00 0.00 31.29 31.28 1i48 h VAL 222 CO 0.17 0.00 0.34 0.28 0.02 0.00 0.00 177.57 178.38 1i48 h SER 223 N -0.00 0.29 0.77 0.57 0.02 0.62 0.64 113.55 116.46 1i48 h SER 223 Ca 0.18 0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 61.22 1i48 h SER 223 Cb 0.27 0.12 0.01 0.00 0.14 0.00 0.00 62.40 62.93 1i48 h SER 223 CO -0.38 0.05 -0.37 0.50 -1.14 0.00 0.00 176.83 175.49 1i48 h LYS 224 N 0.42 -0.99 -0.88 3.45 3.64 -0.65 0.21 116.57 121.77 1i48 h LYS 224 Ca 0.49 0.07 0.22 0.00 -1.27 0.00 0.00 60.65 60.16 1i48 h LYS 224 Cb 0.85 0.23 -0.13 0.00 -0.41 0.00 0.00 32.23 32.76 1i48 h LYS 224 CO -0.48 -0.66 0.34 -0.07 -2.27 0.00 0.00 179.45 176.32 1i48 h LEU 225 N -1.08 0.24 0.37 5.20 3.38 -0.67 -0.42 115.31 122.33 1i48 h LEU 225 Ca -0.11 0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1i48 h LEU 225 Cb 0.79 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1i48 h LEU 225 CO 0.17 -0.04 -0.18 0.00 0.09 0.00 0.00 178.44 178.48 1i48 h HIS 227 N -0.99 0.00 -0.25 0.00 3.86 0.01 0.47 115.15 118.25 1i48 h HIS 227 Ca -0.05 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.01 1i48 h HIS 227 Cb 0.52 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 1i48 h HIS 227 CO 0.03 0.00 -0.44 1.49 0.86 0.00 0.00 177.93 179.86 1i48 h GLU 228 N 0.00 0.63 -0.66 2.45 4.81 -1.01 -3.01 114.58 117.79 1i48 h GLU 228 Ca 0.12 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1i48 h GLU 228 Cb 1.06 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.46 1i48 h GLU 228 CO -0.00 0.95 0.00 1.63 -0.73 0.00 0.00 179.01 180.85 1i48 n LYS 229 N -4.01 3.56 -0.92 1.92 4.76 0.16 -4.92 118.16 118.70 1i48 n LYS 229 Ca -0.02 -2.71 0.00 0.00 -2.87 0.00 0.00 58.31 52.71 1i48 n LYS 229 Cb 0.55 -1.85 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 1i48 n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i48 n GLY 230 N 1.14 0.59 3.80 0.72 0.00 -0.86 -4.88 105.19 105.70 1i48 n GLY 230 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 1i48 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 s ALA 231 N -2.62 2.52 -0.01 4.61 0.00 -0.93 -4.94 121.76 120.38 1i48 s ALA 231 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 51.96 52.05 1i48 s ALA 231 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1i48 s ALA 231 CO 0.00 -1.42 0.06 -0.51 0.00 0.00 0.00 175.76 173.89 1i48 s LEU 232 N -5.67 3.80 -0.22 0.00 1.43 -0.96 -4.00 118.68 113.07 1i48 s LEU 232 Ca 0.59 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.80 1i48 s LEU 232 Cb -0.15 -2.17 0.02 0.00 0.03 0.00 0.00 46.19 43.92 1i48 s LEU 232 CO 0.55 0.29 -0.10 -0.69 0.23 0.00 0.00 176.35 176.63 1i48 s VAL 233 N -1.14 2.71 -0.17 -1.59 1.01 -1.26 0.25 120.40 120.21 1i48 s VAL 233 Ca 0.21 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.31 1i48 s VAL 233 Cb -0.12 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 34.00 1i48 s VAL 233 CO 0.12 0.35 -0.20 0.00 0.00 0.00 0.00 175.10 175.37 1i48 s ILE 235 N 1.22 3.18 -0.94 0.00 -1.09 0.11 -1.72 121.20 121.96 1i48 s ILE 235 Ca 0.03 -0.64 -0.14 0.00 -2.23 0.00 0.00 60.65 57.67 1i48 s ILE 235 Cb -0.13 -2.32 0.21 0.00 -1.58 0.00 0.00 42.46 38.64 1i48 s ILE 235 CO -0.11 0.54 0.96 -0.62 -1.23 0.00 0.00 174.94 174.49 1i48 s ASP 236 N -0.00 6.89 -0.06 3.58 -1.08 -0.42 -1.41 116.67 124.17 1i48 s ASP 236 Ca -0.03 -2.80 0.00 0.00 -0.52 0.00 0.00 52.55 49.20 1i48 s ASP 236 Cb -0.14 -2.26 0.07 0.00 -1.46 0.00 0.00 42.92 39.13 1i48 s ASP 236 CO 0.04 -0.61 1.45 0.61 0.52 0.00 0.00 175.17 177.18 1i48 n GLY 237 N 3.97 2.53 0.30 2.66 0.00 -1.03 -3.19 105.19 110.43 1i48 n GLY 237 Ca 0.20 -0.19 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1i48 n GLY 237 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1i48 h THR 238 N 0.46 0.00 -0.80 2.61 2.02 -1.87 0.14 112.91 115.47 1i48 h THR 238 Ca 0.08 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.43 1i48 h THR 238 Cb 1.13 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.49 1i48 h THR 238 CO 0.16 0.00 0.54 -0.26 0.37 0.00 0.00 175.52 176.32 1i48 h PHE 239 N -0.47 0.47 0.15 3.16 0.04 -1.84 -3.19 116.94 115.26 1i48 h PHE 239 Ca -0.01 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1i48 h PHE 239 Cb 0.47 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.47 1i48 h PHE 239 CO -0.38 0.16 -0.07 0.00 -0.60 0.00 0.00 178.31 177.42 1i48 h ALA 240 N 1.63 -0.50 0.00 2.45 0.00 -1.58 -3.42 119.26 117.85 1i48 h ALA 240 Ca 0.40 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1i48 h ALA 240 Cb 1.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1i48 h ALA 240 CO -0.13 -0.48 0.00 2.41 0.00 0.00 0.00 179.25 181.05 1i48 n THR 241 N -3.05 -0.08 0.27 0.00 -1.04 -0.04 -4.12 114.28 106.21 1i48 n THR 241 Ca -0.02 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.12 1i48 n THR 241 Cb 0.08 -0.00 0.70 0.00 -1.82 0.00 0.00 70.33 69.29 1i48 n THR 241 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1i48 h PRO 242 N 0.00 0.00 0.14 -2.82 0.13 -1.84 -0.88 132.00 126.73 1i48 h PRO 242 Ca 0.00 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.84 1i48 h PRO 242 Cb 0.00 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.16 1i48 h PRO 242 CO 0.00 0.00 -1.21 -0.07 -0.23 0.00 0.00 178.00 176.49 1i48 h LEU 243 N 0.00 0.82 -0.08 1.56 3.38 -1.94 -3.32 115.31 115.74 1i48 h LEU 243 Ca 0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.12 1i48 h LEU 243 Cb 0.54 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1i48 h LEU 243 CO 0.00 1.59 -0.13 0.59 0.09 0.00 0.00 178.44 180.59 1i48 n ASN 244 N -3.84 0.24 -3.63 -0.43 4.13 -0.36 -4.84 115.26 106.53 1i48 n ASN 244 Ca -0.14 -0.08 -0.04 0.00 1.68 0.00 0.00 54.58 55.99 1i48 n ASN 244 Cb 0.98 -0.19 -0.05 0.00 -1.54 0.00 0.00 39.78 38.98 1i48 n ASN 244 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1i48 s GLN 245 N -2.76 0.17 -0.65 3.52 -2.07 -1.08 -1.99 119.66 114.80 1i48 s GLN 245 Ca 0.21 0.07 0.05 0.00 -1.82 0.00 0.00 55.36 53.87 1i48 s GLN 245 Cb 0.19 0.08 0.26 0.00 -1.09 0.00 0.00 33.01 32.46 1i48 s GLN 245 CO 0.53 -0.05 0.80 1.63 -1.32 0.00 0.00 175.29 176.89 1i48 n LYS 246 N 0.79 2.70 -0.51 9.60 4.76 -1.26 -4.27 118.16 129.97 1i48 n LYS 246 Ca -0.04 -4.69 0.42 0.00 -2.87 0.00 0.00 58.31 51.13 1i48 n LYS 246 Cb 0.58 -2.27 0.69 0.00 -1.84 0.00 0.00 35.03 32.19 1i48 n LYS 246 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1i48 n ALA 247 N 0.75 1.44 0.02 7.82 0.00 -1.26 0.50 120.51 129.78 1i48 n ALA 247 Ca 0.30 0.80 -0.12 0.00 0.00 0.00 0.00 53.44 54.43 1i48 n ALA 247 Cb 0.40 -1.05 -0.07 0.00 0.00 0.00 0.00 19.45 18.74 1i48 n ALA 247 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1i48 h LEU 248 N 0.00 0.04 -1.55 0.00 3.38 -1.86 -1.69 115.31 113.63 1i48 h LEU 248 Ca 0.87 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.75 1i48 h LEU 248 Cb 2.97 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 43.70 1i48 h LEU 248 CO -0.36 0.07 -0.23 0.00 0.09 0.00 0.00 178.44 178.01 1i48 h ALA 249 N 0.97 1.55 0.00 1.53 0.00 -0.25 -1.25 119.26 121.81 1i48 h ALA 249 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1i48 h ALA 249 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1i48 h ALA 249 CO -0.00 0.29 0.00 1.28 0.00 0.00 0.00 179.25 180.82 1i48 n LEU 250 N -4.16 0.06 0.00 0.00 4.77 -0.81 -4.85 117.00 112.01 1i48 n LEU 250 Ca -0.02 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 1i48 n LEU 250 Cb 0.29 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1i48 n LEU 250 CO 0.36 -0.29 0.00 0.61 -1.33 0.00 0.00 177.39 176.74 1i48 n GLY 251 N -0.10 2.10 3.53 -0.72 0.00 -0.47 -3.26 105.19 106.27 1i48 n GLY 251 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1i48 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 n ALA 252 N -0.01 -0.66 0.03 4.61 0.00 -0.70 -4.93 120.51 118.85 1i48 n ALA 252 Ca 0.00 -0.07 -0.22 0.00 0.00 0.00 0.00 53.44 53.15 1i48 n ALA 252 Cb 0.00 -1.96 -0.14 0.00 0.00 0.00 0.00 19.45 17.35 1i48 n ALA 252 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1i48 h ASP 253 N 0.16 0.47 -3.66 0.00 3.32 -1.11 -3.41 116.42 112.18 1i48 h ASP 253 Ca -0.47 -0.89 -0.25 0.00 0.02 0.00 0.00 57.03 55.44 1i48 h ASP 253 Cb 1.37 -0.15 -0.30 0.00 0.22 0.00 0.00 39.33 40.47 1i48 h ASP 253 CO 0.47 1.70 -0.72 -0.76 -1.72 0.00 0.00 179.24 178.21 1i48 s LEU 254 N -7.43 1.70 0.00 1.55 1.43 -0.62 -4.25 118.68 111.05 1i48 s LEU 254 Ca -0.18 0.01 0.07 0.00 -1.03 0.00 0.00 54.13 53.00 1i48 s LEU 254 Cb 0.05 -0.02 -0.02 0.00 0.03 0.00 0.00 46.19 46.22 1i48 s LEU 254 CO 0.80 -0.04 -0.22 0.54 0.23 0.00 0.00 176.35 177.66 1i48 s VAL 255 N 0.35 1.77 -0.06 -1.59 0.11 -0.79 0.06 120.40 120.25 1i48 s VAL 255 Ca -0.03 -1.05 -0.08 0.00 -2.93 0.00 0.00 61.98 57.89 1i48 s VAL 255 Cb -0.04 -1.49 0.02 0.00 -1.53 0.00 0.00 36.38 33.33 1i48 s VAL 255 CO -0.01 0.41 0.20 -1.48 -3.33 0.00 0.00 175.10 170.89 1i48 s LEU 256 N -0.76 1.24 0.19 2.54 0.05 -0.50 -0.76 118.68 120.68 1i48 s LEU 256 Ca 0.09 0.26 0.04 0.00 0.05 0.00 0.00 54.13 54.57 1i48 s LEU 256 Cb -0.09 0.76 -0.05 0.00 -2.05 0.00 0.00 46.19 44.76 1i48 s LEU 256 CO 0.00 -0.17 -0.07 -1.00 -0.55 0.00 0.00 176.35 174.56 1i48 s HIS 257 N -0.33 1.43 -0.99 3.48 0.09 -1.01 -2.46 115.29 115.50 1i48 s HIS 257 Ca -0.04 -0.80 -0.12 0.00 -0.00 0.00 0.00 55.06 54.09 1i48 s HIS 257 Cb -0.03 -0.76 0.24 0.00 -0.00 0.00 0.00 32.58 32.02 1i48 s HIS 257 CO 0.01 0.07 0.99 0.45 -0.00 0.00 0.00 174.74 176.25 1i48 s SER 258 N -3.24 7.03 0.32 1.40 0.15 -1.26 -2.58 113.70 115.51 1i48 s SER 258 Ca 0.22 -3.07 0.07 0.00 0.70 0.00 0.00 55.95 53.87 1i48 s SER 258 Cb 0.03 -2.24 0.39 0.00 -1.71 0.00 0.00 66.02 62.49 1i48 s SER 258 CO 0.04 -0.49 1.04 0.00 1.20 0.00 0.00 173.24 175.03 1i48 n ALA 259 N 3.70 0.34 0.25 5.45 0.00 -0.33 -0.10 120.51 129.82 1i48 n ALA 259 Ca 0.21 0.07 0.16 0.00 0.00 0.00 0.00 53.44 53.87 1i48 n ALA 259 Cb 0.43 -0.43 0.87 0.00 0.00 0.00 0.00 19.45 20.32 1i48 n ALA 259 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1i48 h THR 260 N 0.00 0.50 0.00 0.00 2.02 -1.67 -1.98 112.91 111.78 1i48 h THR 260 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1i48 h THR 260 Cb 1.00 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1i48 h THR 260 CO 0.00 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.18 1i48 n LYS 261 N -3.82 0.00 -0.06 6.66 4.76 0.85 -4.61 118.16 121.93 1i48 n LYS 261 Ca -0.01 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 1i48 n LYS 261 Cb 0.21 -0.05 -0.08 0.00 -1.84 0.00 0.00 35.03 33.28 1i48 n LYS 261 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1i48 h PHE 262 N 0.00 0.00 -0.88 2.13 0.04 -1.74 0.39 116.94 116.88 1i48 h PHE 262 Ca 0.00 0.00 0.22 0.00 2.80 0.00 0.00 57.97 60.99 1i48 h PHE 262 Cb 0.00 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.00 1i48 h PHE 262 CO 0.00 0.62 0.06 -0.07 -0.60 0.00 0.00 178.31 178.32 1i48 h LEU 263 N -1.00 -0.33 0.08 1.54 3.38 -1.86 0.19 115.31 117.31 1i48 h LEU 263 Ca -0.02 0.23 -0.29 0.00 0.09 0.00 0.00 57.88 57.89 1i48 h LEU 263 Cb 0.63 0.39 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1i48 h LEU 263 CO -0.01 -0.24 -1.52 1.23 0.09 0.00 0.00 178.44 177.98 1i48 h GLY 264 N 0.09 0.18 -5.10 0.83 0.00 -1.51 -3.21 103.07 94.36 1i48 h GLY 264 Ca 0.52 -0.47 -0.20 0.00 0.00 0.00 0.00 47.33 47.17 1i48 h GLY 264 CO -0.77 0.41 -0.29 0.61 0.00 0.00 0.00 176.54 176.50 1i48 n GLY 265 N 1.62 -0.37 0.00 4.60 0.00 0.68 -4.65 105.19 107.06 1i48 n GLY 265 Ca -0.15 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1i48 n GLY 265 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1i48 n HIS 266 N -2.56 0.00 -3.14 1.61 8.25 -1.26 -1.69 115.22 116.43 1i48 n HIS 266 Ca 0.04 -0.03 -0.22 0.00 -0.26 0.00 0.00 57.72 57.25 1i48 n HIS 266 Cb 0.39 -0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.51 1i48 n HIS 266 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1i48 n ASN 267 N -0.03 -4.80 -0.44 0.41 3.02 -1.26 -4.81 115.26 107.35 1i48 n ASN 267 Ca 0.00 -0.30 0.04 0.00 -0.03 0.00 0.00 54.58 54.29 1i48 n ASN 267 Cb 0.20 -3.93 0.06 0.00 -0.61 0.00 0.00 39.78 35.50 1i48 n ASN 267 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1i48 n ASP 268 N -2.35 0.97 -3.62 6.41 5.75 -1.26 -5.08 116.55 117.37 1i48 n ASP 268 Ca -0.07 -2.47 -0.08 0.00 -0.01 0.00 0.00 54.79 52.16 1i48 n ASP 268 Cb 0.58 -0.30 -0.06 0.00 -1.03 0.00 0.00 41.12 40.31 1i48 n ASP 268 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1i48 s VAL 269 N -1.15 0.00 0.05 2.12 0.11 -1.26 -5.10 120.40 115.17 1i48 s VAL 269 Ca 0.16 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.25 1i48 s VAL 269 Cb 0.14 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.96 1i48 s VAL 269 CO -0.01 0.00 -0.04 -0.76 -3.33 0.00 0.00 175.10 170.96 1i48 s LEU 270 N -0.45 3.31 -0.29 2.54 1.43 -1.26 -4.40 118.68 119.56 1i48 s LEU 270 Ca 0.03 -0.17 -0.27 0.00 -1.03 0.00 0.00 54.13 52.68 1i48 s LEU 270 Cb -0.03 -1.98 0.19 0.00 0.03 0.00 0.00 46.19 44.41 1i48 s LEU 270 CO -0.05 0.23 1.41 0.00 0.23 0.00 0.00 176.35 178.17 1i48 s ALA 271 N -1.15 -2.17 0.28 4.21 0.00 -1.16 -4.66 121.76 117.11 1i48 s ALA 271 Ca 0.21 1.80 0.09 0.00 0.00 0.00 0.00 51.96 54.06 1i48 s ALA 271 Cb -0.11 -1.65 -0.06 0.00 0.00 0.00 0.00 23.12 21.30 1i48 s ALA 271 CO 0.13 -0.17 -0.12 0.20 0.00 0.00 0.00 175.76 175.79 1i48 s GLY 272 N -0.55 1.87 -0.17 0.00 0.00 -1.20 -1.19 107.32 106.09 1i48 s GLY 272 Ca 0.08 -1.90 -0.27 0.00 0.00 0.00 0.00 44.72 42.63 1i48 s GLY 272 CO -0.12 -1.91 0.69 0.00 0.00 0.00 0.00 173.10 171.76 1i48 s ILE 274 N -0.35 1.16 0.04 0.00 1.01 0.37 -2.41 121.20 121.02 1i48 s ILE 274 Ca -0.05 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.08 1i48 s ILE 274 Cb -0.03 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.41 1i48 s ILE 274 CO 0.05 0.34 -0.14 -0.44 0.00 0.00 0.00 174.94 174.75 1i48 s SER 275 N 0.12 1.69 0.00 3.58 0.01 0.06 0.11 113.70 119.27 1i48 s SER 275 Ca -0.04 -0.48 0.00 0.00 1.31 0.00 0.00 55.95 56.74 1i48 s SER 275 Cb -0.10 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.02 1i48 s SER 275 CO 0.02 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.30 1i48 n GLY 276 N 1.81 -0.82 3.77 3.44 0.00 -0.33 -1.88 105.19 111.18 1i48 n GLY 276 Ca -0.18 -0.90 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 1i48 n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i48 s PRO 277 N -0.96 4.23 0.12 1.61 0.04 -1.26 -1.79 135.00 136.99 1i48 s PRO 277 Ca 0.00 2.24 -0.33 0.00 0.04 0.00 0.00 61.00 62.95 1i48 s PRO 277 Cb 0.00 -2.98 -0.11 0.00 0.04 0.00 0.00 34.50 31.45 1i48 s PRO 277 CO 0.00 -0.30 1.56 1.25 0.04 0.00 0.00 177.00 179.55 1i48 h LEU 278 N 3.16 -1.60 -1.62 -3.56 6.46 -1.89 0.29 115.31 116.55 1i48 h LEU 278 Ca -0.49 0.19 0.47 0.00 -0.12 0.00 0.00 57.88 57.93 1i48 h LEU 278 Cb 1.23 0.62 -0.06 0.00 -0.73 0.00 0.00 40.66 41.72 1i48 h LEU 278 CO 0.65 -0.49 1.35 1.17 -0.62 0.00 0.00 178.44 180.50 1i48 n LYS 279 N -5.45 0.01 -0.08 1.25 0.00 -1.26 -1.31 118.16 111.32 1i48 n LYS 279 Ca -0.06 1.06 -0.07 0.00 0.00 0.00 0.00 58.31 59.24 1i48 n LYS 279 Cb 0.39 -2.52 -0.02 0.00 0.00 0.00 0.00 35.03 32.87 1i48 n LYS 279 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1i48 n LEU 280 N -3.66 1.72 -0.26 3.14 4.77 -0.10 -4.37 117.00 118.24 1i48 n LEU 280 Ca 0.37 0.40 0.07 0.00 -0.03 0.00 0.00 56.01 56.81 1i48 n LEU 280 Cb 1.84 -0.76 0.19 0.00 -2.33 0.00 0.00 43.42 42.37 1i48 n LEU 280 CO 0.37 -0.35 0.90 1.62 -1.33 0.00 0.00 177.39 178.59 1i48 h VAL 281 N -0.90 0.42 -0.63 4.08 3.04 -0.43 -1.03 116.25 120.80 1i48 h VAL 281 Ca 0.00 -0.07 0.12 0.00 -1.01 0.00 0.00 66.70 65.74 1i48 h VAL 281 Cb 0.76 0.20 -0.09 0.00 -2.01 0.00 0.00 31.29 30.16 1i48 h VAL 281 CO 0.00 0.04 0.17 0.77 -1.01 0.00 0.00 177.57 177.54 1i48 h SER 282 N 0.20 0.08 -0.99 3.17 4.64 -1.43 0.96 113.55 120.18 1i48 h SER 282 Ca 0.44 0.11 0.21 0.00 -0.47 0.00 0.00 61.79 62.07 1i48 h SER 282 Cb 0.78 0.13 -0.10 0.00 -0.31 0.00 0.00 62.40 62.91 1i48 h SER 282 CO -0.58 0.04 0.62 -0.33 -0.87 0.00 0.00 176.83 175.70 1i48 h GLU 283 N 0.31 0.60 0.05 4.77 4.39 -1.38 0.07 114.58 123.39 1i48 h GLU 283 Ca 0.34 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 60.00 1i48 h GLU 283 Cb 0.49 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1i48 h GLU 283 CO -0.39 0.40 -0.02 0.82 -1.16 0.00 0.00 179.01 178.65 1i48 h ILE 284 N 0.62 1.30 -0.89 3.13 2.04 -0.87 -3.15 117.51 119.69 1i48 h ILE 284 Ca 0.56 -1.35 0.24 0.00 1.00 0.00 0.00 64.86 65.32 1i48 h ILE 284 Cb 1.07 2.17 -0.14 0.00 -0.74 0.00 0.00 36.82 39.17 1i48 h ILE 284 CO -0.32 0.33 0.25 -0.09 0.00 0.00 0.00 178.15 178.32 1i48 h ARG 285 N -0.69 0.20 0.50 2.37 2.43 0.34 0.51 114.38 120.05 1i48 h ARG 285 Ca -0.01 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1i48 h ARG 285 Cb 0.59 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 1i48 h ARG 285 CO 0.01 0.13 -0.40 -0.91 -1.51 0.00 0.00 179.97 177.29 1i48 h ASN 286 N 0.21 -1.07 -0.31 -3.80 4.21 -1.07 0.23 115.58 113.98 1i48 h ASN 286 Ca 0.57 0.08 0.04 0.00 1.21 0.00 0.00 56.30 58.20 1i48 h ASN 286 Cb 1.17 0.34 -0.02 0.00 -1.12 0.00 0.00 38.32 38.70 1i48 h ASN 286 CO -0.66 -0.58 0.21 0.25 -1.29 0.00 0.00 177.43 175.35 1i48 h LEU 287 N -0.90 0.21 -0.01 1.61 5.85 -0.99 -1.86 115.31 119.22 1i48 h LEU 287 Ca -0.05 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1i48 h LEU 287 Cb 0.76 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 1i48 h LEU 287 CO -0.01 0.14 0.00 -0.74 -0.34 0.00 0.00 178.44 177.50 1i48 h HIS 288 N 0.25 0.02 -0.37 1.25 2.76 0.12 -1.48 115.15 117.68 1i48 h HIS 288 Ca 0.13 -0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.41 1i48 h HIS 288 Cb 0.22 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.16 1i48 h HIS 288 CO -0.00 0.15 0.48 0.45 -1.30 0.00 0.00 177.93 177.72 1i48 h HIS 289 N -0.13 0.00 0.00 5.26 3.86 0.26 0.10 115.15 124.50 1i48 h HIS 289 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1i48 h HIS 289 Cb 0.14 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.61 1i48 h HIS 289 CO -0.03 0.00 -0.34 0.82 0.86 0.00 0.00 177.93 179.25 1i48 h ILE 290 N 0.00 0.08 0.00 2.45 2.04 -1.28 -3.33 117.51 117.47 1i48 h ILE 290 Ca 0.18 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1i48 h ILE 290 Cb 1.14 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1i48 h ILE 290 CO -0.00 0.03 0.07 -0.07 0.00 0.00 0.00 178.15 178.18 1i48 h LEU 291 N -1.00 0.00 -3.18 1.44 3.38 -0.94 -3.46 115.31 111.55 1i48 h LEU 291 Ca -0.01 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 1i48 h LEU 291 Cb 0.36 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.13 1i48 h LEU 291 CO -0.01 0.00 -0.97 0.61 0.09 0.00 0.00 178.44 178.16 1i48 n GLY 292 N -1.25 -0.40 0.71 0.83 0.00 0.32 -4.93 105.19 100.47 1i48 n GLY 292 Ca -0.02 1.13 0.06 0.00 0.00 0.00 0.00 46.02 47.19 1i48 n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i48 n GLY 293 N -0.38 4.23 3.22 -0.02 0.00 -1.26 -5.09 105.19 105.89 1i48 n GLY 293 Ca -0.04 -1.17 -0.37 0.00 0.00 0.00 0.00 46.02 44.43 1i48 n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 n ALA 294 N -0.82 -3.51 -2.80 4.61 0.00 -1.26 -2.00 120.51 114.73 1i48 n ALA 294 Ca 0.16 -0.32 -0.36 0.00 0.00 0.00 0.00 53.44 52.92 1i48 n ALA 294 Cb 0.77 -1.43 -0.07 0.00 0.00 0.00 0.00 19.45 18.72 1i48 n ALA 294 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1i48 s LEU 295 N 4.65 4.22 0.25 0.00 2.96 -1.26 -4.39 118.68 125.11 1i48 s LEU 295 Ca 0.53 0.31 -0.30 0.00 -0.22 0.00 0.00 54.13 54.46 1i48 s LEU 295 Cb -0.35 -2.06 -0.09 0.00 0.50 0.00 0.00 46.19 44.19 1i48 s LEU 295 CO 0.70 0.28 1.25 0.21 -1.32 0.00 0.00 176.35 177.47 1i48 s ASN 296 N -0.26 6.97 0.19 3.68 3.84 -1.26 -4.88 114.94 123.21 1i48 s ASN 296 Ca 0.11 2.43 -0.18 0.00 0.21 0.00 0.00 52.86 55.44 1i48 s ASN 296 Cb -0.12 -2.62 0.15 0.00 -0.55 0.00 0.00 41.25 38.11 1i48 s ASN 296 CO 0.01 -0.43 1.62 -0.65 -2.79 0.00 0.00 177.10 174.86 1i48 h PRO 297 N 4.45 -0.09 -0.87 0.43 0.11 -1.98 -0.29 132.00 133.76 1i48 h PRO 297 Ca -0.46 0.01 0.19 0.00 0.11 0.00 0.00 66.00 65.84 1i48 h PRO 297 Cb 1.22 0.02 -0.11 0.00 0.11 0.00 0.00 31.00 32.24 1i48 h PRO 297 CO 0.71 -0.06 0.39 -0.91 -0.21 0.00 0.00 178.00 177.92 1i48 h ASN 298 N -0.10 0.37 0.21 -2.05 2.35 -1.92 0.31 115.58 114.76 1i48 h ASN 298 Ca 0.24 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 56.11 1i48 h ASN 298 Cb 0.48 0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.94 1i48 h ASN 298 CO -0.59 0.07 -0.10 0.00 -1.65 0.00 0.00 177.43 175.16 1i48 h ALA 299 N 1.65 -0.28 -0.46 -0.83 0.00 -1.47 -1.93 119.26 115.93 1i48 h ALA 299 Ca 0.51 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.41 1i48 h ALA 299 Cb 0.89 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.69 1i48 h ALA 299 CO -0.47 -0.60 -0.25 0.00 0.00 0.00 0.00 179.25 177.93 1i48 h ALA 300 N 0.38 0.04 0.12 0.00 0.00 0.37 -1.76 119.26 118.41 1i48 h ALA 300 Ca -0.03 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1i48 h ALA 300 Cb 0.30 0.59 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1i48 h ALA 300 CO 0.05 -0.61 -0.35 -0.92 0.00 0.00 0.00 179.25 177.42 1i48 h TYR 301 N -0.16 -0.96 -0.89 0.00 3.20 -0.38 0.04 116.97 117.82 1i48 h TYR 301 Ca 0.21 0.02 0.24 0.00 3.14 0.00 0.00 58.73 62.34 1i48 h TYR 301 Cb 0.49 0.41 -0.14 0.00 1.54 0.00 0.00 36.73 39.02 1i48 h TYR 301 CO -0.51 -0.45 0.28 -0.07 -1.64 0.00 0.00 178.16 175.76 1i48 h LEU 302 N -0.58 0.07 0.27 2.82 3.38 -0.56 0.64 115.31 121.36 1i48 h LEU 302 Ca 0.03 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1i48 h LEU 302 Cb 0.61 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1i48 h LEU 302 CO -0.20 -0.14 -0.13 0.40 0.09 0.00 0.00 178.44 178.45 1i48 h ILE 303 N 0.23 0.77 -0.89 1.22 2.04 -0.52 0.15 117.51 120.51 1i48 h ILE 303 Ca 0.57 -0.44 0.21 0.00 1.00 0.00 0.00 64.86 66.19 1i48 h ILE 303 Cb 1.15 1.02 -0.12 0.00 -0.74 0.00 0.00 36.82 38.13 1i48 h ILE 303 CO -0.64 0.09 0.41 0.40 0.00 0.00 0.00 178.15 178.41 1i48 h ILE 304 N -0.60 0.52 -0.49 -0.67 2.04 0.11 0.65 117.51 119.07 1i48 h ILE 304 Ca -0.04 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1i48 h ILE 304 Cb 0.44 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 1i48 h ILE 304 CO 0.06 0.08 0.02 -0.09 0.00 0.00 0.00 178.15 178.22 1i48 h ARG 305 N 0.45 0.80 -0.19 2.37 2.43 0.64 -3.05 114.38 117.82 1i48 h ARG 305 Ca 0.55 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 59.45 1i48 h ARG 305 Cb 1.00 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1i48 h ARG 305 CO -0.50 0.80 -0.11 0.78 -1.51 0.00 0.00 179.97 179.43 1i48 h GLY 306 N 0.97 0.44 2.00 2.80 0.00 0.30 -2.92 103.07 106.66 1i48 h GLY 306 Ca 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1i48 h GLY 306 CO 0.02 0.37 0.00 1.03 0.00 0.00 0.00 176.54 177.96 1i48 n MET 307 N -4.56 0.09 0.25 4.80 2.81 0.48 -1.37 117.12 119.63 1i48 n MET 307 Ca -0.05 0.59 0.08 0.00 -1.81 0.00 0.00 57.70 56.51 1i48 n MET 307 Cb 0.33 -1.81 0.62 0.00 -0.71 0.00 0.00 33.22 31.65 1i48 n MET 307 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1i48 h LYS 308 N 0.00 0.00 -0.32 0.03 1.79 -1.42 -2.30 116.57 114.35 1i48 h LYS 308 Ca 0.00 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.23 1i48 h LYS 308 Cb 0.00 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 30.44 1i48 h LYS 308 CO 0.00 0.03 -0.69 0.25 -1.08 0.00 0.00 179.45 177.96 1i48 n THR 309 N -4.49 2.16 0.15 -0.16 -2.24 -0.47 -4.73 114.28 104.50 1i48 n THR 309 Ca -0.03 -3.49 -0.06 0.00 -2.27 0.00 0.00 64.05 58.20 1i48 n THR 309 Cb 0.12 -0.45 -0.03 0.00 -2.10 0.00 0.00 70.33 67.87 1i48 n THR 309 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1i48 h LEU 310 N 1.54 -0.36 -0.39 3.22 5.85 -1.44 -1.96 115.31 121.77 1i48 h LEU 310 Ca 0.13 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.91 1i48 h LEU 310 Cb 1.28 0.10 -0.07 0.00 0.37 0.00 0.00 40.66 42.34 1i48 h LEU 310 CO 0.31 -0.24 -0.47 1.12 -0.34 0.00 0.00 178.44 178.83 1i48 h HIS 311 N -0.39 -1.44 -0.92 1.25 2.07 -1.89 0.12 115.15 113.94 1i48 h HIS 311 Ca -0.04 0.07 0.16 0.00 -2.85 0.00 0.00 60.37 57.71 1i48 h HIS 311 Cb 0.31 0.68 -0.16 0.00 2.57 0.00 0.00 27.41 30.81 1i48 h HIS 311 CO 0.11 -0.40 -0.32 1.28 -3.07 0.00 0.00 177.93 175.54 1i48 n LEU 312 N -4.91 -0.52 0.28 6.12 7.99 -1.23 -0.46 117.00 124.27 1i48 n LEU 312 Ca -0.02 1.61 -0.11 0.00 -0.01 0.00 0.00 56.01 57.47 1i48 n LEU 312 Cb 0.28 -0.40 -0.05 0.00 -0.11 0.00 0.00 43.42 43.13 1i48 n LEU 312 CO -0.01 -1.47 0.38 0.03 -1.51 0.00 0.00 177.39 174.81 1i48 h ARG 313 N 0.00 -0.70 -0.98 3.23 3.08 -0.33 -2.91 114.38 115.77 1i48 h ARG 313 Ca 0.36 0.05 0.16 0.00 0.07 0.00 0.00 59.98 60.62 1i48 h ARG 313 Cb 0.59 0.16 -0.17 0.00 0.08 0.00 0.00 29.97 30.63 1i48 h ARG 313 CO -0.93 -0.47 -0.35 0.28 -1.07 0.00 0.00 179.97 177.43 1i48 h VAL 314 N -0.92 0.01 0.00 2.04 2.07 0.10 0.66 116.25 120.20 1i48 h VAL 314 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1i48 h VAL 314 Cb 0.56 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1i48 h VAL 314 CO 0.12 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.71 1i48 n GLN 315 N -5.51 0.00 -0.31 1.57 6.02 0.39 0.42 117.38 119.95 1i48 n GLN 315 Ca 0.11 0.76 0.11 0.00 -0.01 0.00 0.00 57.00 57.97 1i48 n GLN 315 Cb 0.42 -1.44 0.24 0.00 1.02 0.00 0.00 30.24 30.48 1i48 n GLN 315 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 1i48 h GLN 316 N 0.00 0.05 0.36 -1.09 5.75 -1.00 0.32 115.11 119.50 1i48 h GLN 316 Ca 0.00 -0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1i48 h GLN 316 Cb 0.00 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.54 1i48 h GLN 316 CO 0.00 0.04 -0.17 1.96 -2.65 0.00 0.00 178.83 178.00 1i48 h GLN 317 N 0.06 -0.47 -0.77 1.69 4.20 -0.13 -2.23 115.11 117.46 1i48 h GLN 317 Ca 0.53 0.03 0.17 0.00 0.06 0.00 0.00 58.65 59.44 1i48 h GLN 317 Cb 1.02 0.11 -0.14 0.00 0.30 0.00 0.00 27.48 28.77 1i48 h GLN 317 CO -0.83 -0.28 -0.05 -0.91 -0.67 0.00 0.00 178.83 176.09 1i48 h ASN 318 N -0.53 -0.46 0.00 1.46 2.35 0.21 -1.08 115.58 117.53 1i48 h ASN 318 Ca -0.05 0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1i48 h ASN 318 Cb 0.40 0.39 0.00 0.00 0.05 0.00 0.00 38.32 39.16 1i48 h ASN 318 CO 0.08 -0.21 0.00 -1.20 -1.65 0.00 0.00 177.43 174.45 1i48 n SER 319 N -5.40 0.00 -0.25 5.81 7.64 -0.84 -1.95 113.62 118.64 1i48 n SER 319 Ca 0.13 0.81 0.08 0.00 1.01 0.00 0.00 58.87 60.90 1i48 n SER 319 Cb 0.47 -0.36 0.16 0.00 -1.01 0.00 0.00 64.21 63.47 1i48 n SER 319 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1i48 n THR 320 N -1.57 -0.30 0.00 0.44 -1.04 -0.85 -0.32 114.28 110.64 1i48 n THR 320 Ca 0.00 1.58 0.00 0.00 -2.04 0.00 0.00 64.05 63.59 1i48 n THR 320 Cb 0.00 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.25 1i48 n THR 320 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1i48 n ALA 321 N -3.50 -0.29 -0.19 2.41 0.00 -0.42 -0.93 120.51 117.58 1i48 n ALA 321 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1i48 n ALA 321 Cb 0.46 0.16 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1i48 n ALA 321 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1i48 n LEU 322 N -2.17 0.00 -0.30 0.00 7.94 0.56 0.59 117.00 123.62 1i48 n LEU 322 Ca 0.00 0.87 -0.08 0.00 -1.11 0.00 0.00 56.01 55.68 1i48 n LEU 322 Cb 0.00 -0.38 -0.07 0.00 0.53 0.00 0.00 43.42 43.49 1i48 n LEU 322 CO 0.00 -0.38 0.49 0.03 -1.11 0.00 0.00 177.39 176.41 1i48 h ARG 323 N 0.00 -0.01 -1.00 1.96 3.08 -1.39 0.72 114.38 117.74 1i48 h ARG 323 Ca 0.00 0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.26 1i48 h ARG 323 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.95 1i48 h ARG 323 CO 0.00 -0.01 0.61 0.52 -1.07 0.00 0.00 179.97 180.02 1i48 h MET 324 N -0.02 0.66 0.15 0.04 2.86 -0.31 -0.70 114.93 117.61 1i48 h MET 324 Ca 0.12 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1i48 h MET 324 Cb 0.31 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 1i48 h MET 324 CO -0.68 0.43 -0.20 0.00 1.06 0.00 0.00 176.91 177.52 1i48 h ALA 325 N 1.66 -0.85 -0.25 6.32 0.00 0.60 0.33 119.26 127.07 1i48 h ALA 325 Ca 0.58 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.48 1i48 h ALA 325 Cb 1.03 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 19.24 1i48 h ALA 325 CO -0.37 -0.87 -0.40 0.93 0.00 0.00 0.00 179.25 178.53 1i48 h GLU 326 N -0.36 -0.39 -0.99 0.00 5.08 -0.62 0.39 114.58 117.69 1i48 h GLU 326 Ca -0.02 0.03 0.27 0.00 -1.00 0.00 0.00 59.36 58.64 1i48 h GLU 326 Cb 0.32 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.53 1i48 h GLU 326 CO -0.05 -0.26 0.56 0.82 -1.00 0.00 0.00 179.01 179.08 1i48 h ILE 327 N -0.40 0.45 0.00 3.13 2.04 -0.97 0.19 117.51 121.95 1i48 h ILE 327 Ca 0.11 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1i48 h ILE 327 Cb 0.60 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1i48 h ILE 327 CO -0.46 0.09 -0.00 -0.07 0.00 0.00 0.00 178.15 177.70 1i48 h LEU 328 N 0.47 -0.00 -0.82 1.44 3.38 0.27 -2.37 115.31 117.68 1i48 h LEU 328 Ca 0.67 -0.49 0.14 0.00 0.09 0.00 0.00 57.88 58.29 1i48 h LEU 328 Cb 1.36 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.02 1i48 h LEU 328 CO -0.53 0.49 0.41 -0.08 0.09 0.00 0.00 178.44 178.82 1i48 h GLU 329 N -0.50 0.57 0.00 1.13 4.81 0.20 0.78 114.58 121.57 1i48 h GLU 329 Ca -0.00 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1i48 h GLU 329 Cb 0.49 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1i48 h GLU 329 CO 0.00 0.38 -0.23 0.00 -0.73 0.00 0.00 179.01 178.43 1i48 h ALA 330 N 1.55 1.02 -2.92 2.92 0.00 -0.73 -3.45 119.26 117.65 1i48 h ALA 330 Ca 0.45 -0.21 -0.53 0.00 0.00 0.00 0.00 54.91 54.62 1i48 h ALA 330 Cb 0.63 -0.04 0.09 0.00 0.00 0.00 0.00 17.79 18.47 1i48 h ALA 330 CO -0.36 0.29 0.71 -1.58 0.00 0.00 0.00 179.25 178.30 1i48 s HIS 331 N -3.66 2.78 0.05 0.00 5.65 0.27 -4.95 115.29 115.43 1i48 s HIS 331 Ca 0.00 1.29 -0.21 0.00 0.25 0.00 0.00 55.06 56.39 1i48 s HIS 331 Cb 0.10 -3.85 -0.13 0.00 -1.18 0.00 0.00 32.58 27.51 1i48 s HIS 331 CO 0.64 -2.47 1.43 -1.00 -0.65 0.00 0.00 174.74 172.69 1i48 h PRO 332 N 3.09 0.28 0.00 2.88 0.13 -1.87 -3.05 132.00 133.47 1i48 h PRO 332 Ca -0.50 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1i48 h PRO 332 Cb 1.24 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1i48 h PRO 332 CO 0.64 0.57 0.00 1.63 -0.23 0.00 0.00 178.00 180.62 1i48 n LYS 333 N -4.70 0.11 -3.29 0.86 5.02 -1.26 -4.43 118.16 110.47 1i48 n LYS 333 Ca -0.06 0.23 -0.44 0.00 -2.02 0.00 0.00 58.31 56.02 1i48 n LYS 333 Cb 0.26 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.70 1i48 n LYS 333 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1i48 s VAL 334 N -2.68 5.07 0.04 -0.18 1.01 -1.15 0.17 120.40 122.68 1i48 s VAL 334 Ca 0.08 -0.70 -0.26 0.00 0.00 0.00 0.00 61.98 61.10 1i48 s VAL 334 Cb 0.07 -4.17 -0.17 0.00 0.00 0.00 0.00 36.38 32.11 1i48 s VAL 334 CO 0.16 -0.62 1.46 -0.09 0.00 0.00 0.00 175.10 176.00 1i48 h ARG 335 N 8.83 -0.38 -3.64 2.72 2.43 -1.39 -3.46 114.38 119.50 1i48 h ARG 335 Ca -0.28 0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.79 1i48 h ARG 335 Cb 1.10 0.09 -0.19 0.00 -0.42 0.00 0.00 29.97 30.55 1i48 h ARG 335 CO 0.89 -0.13 -0.49 -1.58 -1.51 0.00 0.00 179.97 177.15 1i48 s HIS 336 N -5.34 0.11 -0.03 2.20 5.04 -1.07 -4.97 115.29 111.24 1i48 s HIS 336 Ca -0.15 -0.31 0.02 0.00 -1.54 0.00 0.00 55.06 53.07 1i48 s HIS 336 Cb 0.03 -0.08 0.01 0.00 0.04 0.00 0.00 32.58 32.58 1i48 s HIS 336 CO 0.60 -0.34 -0.05 0.08 -2.34 0.00 0.00 174.74 172.68 1i48 s VAL 337 N -2.10 0.53 -0.15 0.89 1.01 -1.26 -0.02 120.40 119.29 1i48 s VAL 337 Ca -0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 1i48 s VAL 337 Cb -0.04 -0.50 -0.02 0.00 0.00 0.00 0.00 36.38 35.82 1i48 s VAL 337 CO -0.02 0.19 -0.09 -0.31 0.00 0.00 0.00 175.10 174.88 1i48 s TYR 338 N 0.43 2.91 -0.30 5.22 1.51 0.25 -4.87 117.35 122.50 1i48 s TYR 338 Ca -0.06 -0.58 -0.19 0.00 -1.01 0.00 0.00 57.07 55.24 1i48 s TYR 338 Cb -0.09 -1.93 0.19 0.00 -0.11 0.00 0.00 41.96 40.02 1i48 s TYR 338 CO 0.00 -0.21 1.25 -0.47 -1.11 0.00 0.00 175.55 175.01 1i48 s TYR 339 N 0.54 -0.15 0.42 2.71 5.04 -1.26 -2.76 117.35 121.90 1i48 s TYR 339 Ca -0.06 0.26 0.27 0.00 -2.44 0.00 0.00 57.07 55.10 1i48 s TYR 339 Cb -0.15 0.09 1.48 0.00 0.35 0.00 0.00 41.96 43.72 1i48 s TYR 339 CO 0.03 -0.07 1.81 -1.35 -1.34 0.00 0.00 175.55 174.63 1i48 h PRO 340 N 7.02 0.00 -0.00 4.97 0.11 -1.86 -0.20 132.00 142.03 1i48 h PRO 340 Ca -0.14 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.83 1i48 h PRO 340 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1i48 h PRO 340 CO 0.07 0.00 -0.65 0.78 -0.21 0.00 0.00 178.00 177.99 1i48 h GLY 341 N 0.00 0.02 -1.65 -0.55 0.00 -1.93 -3.43 103.07 95.52 1i48 h GLY 341 Ca 0.00 -0.03 -0.48 0.00 0.00 0.00 0.00 47.33 46.82 1i48 h GLY 341 CO 0.00 0.03 0.38 1.08 0.00 0.00 0.00 176.54 178.03 1i48 s LEU 342 N -7.56 3.50 0.15 3.11 1.43 -0.09 -4.97 118.68 114.26 1i48 s LEU 342 Ca -0.01 1.58 0.05 0.00 -1.03 0.00 0.00 54.13 54.72 1i48 s LEU 342 Cb 0.12 -4.50 -0.08 0.00 0.03 0.00 0.00 46.19 41.76 1i48 s LEU 342 CO 0.77 -0.78 1.34 1.56 0.23 0.00 0.00 176.35 179.47 1i48 h GLN 343 N 0.53 0.10 0.00 1.70 4.20 -1.87 -3.07 115.11 116.69 1i48 h GLN 343 Ca -0.46 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.12 1i48 h GLN 343 Cb 1.19 0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.01 1i48 h GLN 343 CO 0.61 0.96 0.17 0.66 -0.67 0.00 0.00 178.83 180.56 1i48 h SER 344 N 0.04 0.00 -3.12 1.46 4.64 -1.93 -3.42 113.55 111.23 1i48 h SER 344 Ca -0.04 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.75 1i48 h SER 344 Cb 1.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 1i48 h SER 344 CO 0.13 0.00 0.63 -2.28 -0.87 0.00 0.00 176.83 174.44 1i48 s HIS 345 N -3.97 3.33 0.11 4.77 5.04 -1.16 -4.96 115.29 118.44 1i48 s HIS 345 Ca -0.04 1.19 -0.28 0.00 -1.54 0.00 0.00 55.06 54.39 1i48 s HIS 345 Cb 0.09 -3.49 -0.09 0.00 0.04 0.00 0.00 32.58 29.14 1i48 s HIS 345 CO 0.30 -1.59 1.46 -1.35 -2.34 0.00 0.00 174.74 171.22 1i48 h PRO 346 N 6.96 -0.29 -0.92 2.88 0.11 -1.91 -1.39 132.00 137.44 1i48 h PRO 346 Ca -0.41 0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.57 1i48 h PRO 346 Cb 1.20 0.07 -0.09 0.00 0.11 0.00 0.00 31.00 32.29 1i48 h PRO 346 CO 0.84 -0.19 0.19 -0.85 -0.21 0.00 0.00 178.00 177.78 1i48 n GLU 347 N -4.94 2.16 -0.27 1.05 0.00 -1.26 -4.51 120.64 112.87 1i48 n GLU 347 Ca -0.02 -1.52 0.08 0.00 0.00 0.00 0.00 57.16 55.69 1i48 n GLU 347 Cb 0.28 -1.71 0.22 0.00 0.00 0.00 0.00 31.44 30.23 1i48 n GLU 347 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1i48 h HIS 348 N 1.10 0.43 -0.94 -1.84 2.76 -1.52 0.12 115.15 115.25 1i48 h HIS 348 Ca 0.19 0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.41 1i48 h HIS 348 Cb 1.65 -0.07 -0.05 0.00 1.55 0.00 0.00 27.41 30.49 1i48 h HIS 348 CO 0.69 -0.04 0.62 1.12 -1.30 0.00 0.00 177.93 179.02 1i48 h HIS 349 N 0.35 1.18 -0.31 5.26 2.07 -1.82 -0.34 115.15 121.53 1i48 h HIS 349 Ca 0.46 0.03 -0.06 0.00 -2.85 0.00 0.00 60.37 57.94 1i48 h HIS 349 Cb 0.79 -0.40 -0.01 0.00 2.57 0.00 0.00 27.41 30.36 1i48 h HIS 349 CO -0.21 0.73 -0.04 0.82 -3.07 0.00 0.00 177.93 176.16 1i48 h ILE 350 N 1.26 1.27 -0.52 6.12 2.04 -1.29 -0.86 117.51 125.53 1i48 h ILE 350 Ca 0.35 -1.04 0.10 0.00 1.00 0.00 0.00 64.86 65.28 1i48 h ILE 350 Cb -0.12 1.32 -0.09 0.00 -0.74 0.00 0.00 36.82 37.20 1i48 h ILE 350 CO -0.08 0.34 -0.02 0.00 0.00 0.00 0.00 178.15 178.38 1i48 h ALA 351 N 0.82 0.48 -0.69 1.87 0.00 -0.13 -0.19 119.26 121.41 1i48 h ALA 351 Ca 0.08 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1i48 h ALA 351 Cb 0.51 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1i48 h ALA 351 CO 0.02 -0.40 0.17 0.87 0.00 0.00 0.00 179.25 179.92 1i48 h LYS 352 N 0.10 1.11 -0.13 0.00 1.57 -0.86 0.34 116.57 118.70 1i48 h LYS 352 Ca 0.26 -0.26 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1i48 h LYS 352 Cb 0.41 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1i48 h LYS 352 CO -0.45 0.98 -0.38 1.57 -0.57 0.00 0.00 179.45 180.59 1i48 h LYS 353 N 1.04 0.27 0.00 3.15 2.10 0.30 -3.34 116.57 120.08 1i48 h LYS 353 Ca 0.22 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1i48 h LYS 353 Cb 0.36 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 1i48 h LYS 353 CO 0.00 0.62 -1.14 0.00 -2.00 0.00 0.00 179.45 176.93 1i48 n GLN 354 N -4.05 1.10 -4.08 0.07 10.64 -0.23 -5.04 117.38 115.79 1i48 n GLN 354 Ca -0.01 -0.05 -0.24 0.00 -1.83 0.00 0.00 57.00 54.86 1i48 n GLN 354 Cb 0.46 -1.11 -0.05 0.00 -0.86 0.00 0.00 30.24 28.68 1i48 n GLN 354 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1i48 s MET 355 N -2.35 2.96 0.00 2.61 -1.94 0.12 -4.68 119.30 116.02 1i48 s MET 355 Ca -0.02 -0.92 0.02 0.00 -1.71 0.00 0.00 55.69 53.07 1i48 s MET 355 Cb 0.05 -2.64 0.01 0.00 2.01 0.00 0.00 34.83 34.26 1i48 s MET 355 CO 0.31 0.45 0.47 0.25 -0.01 0.00 0.00 175.02 176.49 1i48 n THR 356 N -0.70 0.00 -3.98 2.05 -2.24 -0.84 -4.62 114.28 103.94 1i48 n THR 356 Ca -0.08 -0.49 -0.12 0.00 -2.27 0.00 0.00 64.05 61.09 1i48 n THR 356 Cb 0.56 1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 69.81 1i48 n THR 356 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1i48 s GLY 357 N -0.40 1.05 -0.03 3.38 0.00 -1.26 -5.02 107.32 105.04 1i48 s GLY 357 Ca 0.02 -1.21 0.14 0.00 0.00 0.00 0.00 44.72 43.67 1i48 s GLY 357 CO 0.04 -0.73 1.11 0.69 0.00 0.00 0.00 173.10 174.20 1i48 n PHE 358 N -0.55 0.00 -1.83 1.90 3.72 -1.26 -4.98 117.46 114.47 1i48 n PHE 358 Ca -0.02 -0.46 0.09 0.00 -0.05 0.00 0.00 57.45 57.00 1i48 n PHE 358 Cb 0.61 -0.12 -0.02 0.00 -0.94 0.00 0.00 39.48 39.01 1i48 n PHE 358 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1i48 n GLY 359 N -0.04 -1.89 0.31 1.37 0.00 -1.26 -4.52 105.19 99.16 1i48 n GLY 359 Ca 0.06 -1.27 0.09 0.00 0.00 0.00 0.00 46.02 44.90 1i48 n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i48 n GLY 360 N -2.18 4.59 3.69 -0.02 0.00 -1.26 -3.99 105.19 106.01 1i48 n GLY 360 Ca 0.00 -1.08 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 1i48 n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 s ALA 361 N -2.81 3.39 -0.05 4.61 0.00 -1.26 -1.55 121.76 124.09 1i48 s ALA 361 Ca 0.34 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.52 1i48 s ALA 361 Cb 0.29 -1.69 0.04 0.00 0.00 0.00 0.00 23.12 21.76 1i48 s ALA 361 CO 0.05 0.45 0.11 0.08 0.00 0.00 0.00 175.76 176.44 1i48 s VAL 362 N -0.46 -0.06 0.07 0.00 1.01 -0.63 -4.91 120.40 115.42 1i48 s VAL 362 Ca 0.09 0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.32 1i48 s VAL 362 Cb -0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 1i48 s VAL 362 CO 0.02 0.08 -0.02 -0.44 0.00 0.00 0.00 175.10 174.74 1i48 s SER 363 N 1.18 4.89 -0.20 3.32 0.01 -1.11 -0.46 113.70 121.32 1i48 s SER 363 Ca -0.09 -0.19 -0.28 0.00 1.31 0.00 0.00 55.95 56.71 1i48 s SER 363 Cb -0.12 -1.14 0.11 0.00 0.21 0.00 0.00 66.02 65.08 1i48 s SER 363 CO -0.05 0.20 0.92 0.72 0.41 0.00 0.00 173.24 175.44 1i48 s PHE 364 N -1.24 -0.52 -0.08 2.43 -0.71 -0.42 0.87 117.98 118.31 1i48 s PHE 364 Ca 0.24 1.10 -0.14 0.00 -1.04 0.00 0.00 56.93 57.08 1i48 s PHE 364 Cb -0.12 0.38 -0.05 0.00 -1.21 0.00 0.00 43.02 42.03 1i48 s PHE 364 CO 0.16 -0.35 0.35 -1.21 -1.34 0.00 0.00 175.22 172.83 1i48 s GLU 365 N -0.41 4.05 0.07 1.99 2.02 0.97 -1.00 118.70 126.38 1i48 s GLU 365 Ca -0.01 0.26 -0.12 0.00 0.02 0.00 0.00 54.97 55.11 1i48 s GLU 365 Cb -0.03 -3.32 -0.06 0.00 0.10 0.00 0.00 34.13 30.82 1i48 s GLU 365 CO -0.00 0.46 0.43 0.08 0.02 0.00 0.00 175.26 176.26 1i48 s VAL 366 N -0.29 5.02 -0.95 2.63 1.01 -1.23 -1.25 120.40 125.36 1i48 s VAL 366 Ca 0.21 0.65 -0.20 0.00 0.00 0.00 0.00 61.98 62.63 1i48 s VAL 366 Cb -0.15 -3.69 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 1i48 s VAL 366 CO 0.09 0.37 1.98 -0.67 0.00 0.00 0.00 175.10 176.87 1i48 n ASP 367 N 1.17 2.88 -0.81 3.32 2.03 0.13 -4.66 116.55 120.60 1i48 n ASP 367 Ca -0.09 -2.72 0.00 0.00 0.52 0.00 0.00 54.79 52.50 1i48 n ASP 367 Cb 0.52 -1.28 0.00 0.00 -0.72 0.00 0.00 41.12 39.64 1i48 n ASP 367 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i48 n GLY 368 N 4.54 1.69 3.85 0.27 0.00 -1.26 -5.00 105.19 109.28 1i48 n GLY 368 Ca 0.50 -0.91 -0.24 0.00 0.00 0.00 0.00 46.02 45.38 1i48 n GLY 368 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1i48 s ASP 369 N -0.43 4.75 0.04 1.61 -4.77 -1.26 -4.79 116.67 111.82 1i48 s ASP 369 Ca 0.00 -1.00 -0.08 0.00 -3.30 0.00 0.00 52.55 48.17 1i48 s ASP 369 Cb 0.00 -0.20 -0.02 0.00 -1.09 0.00 0.00 42.92 41.61 1i48 s ASP 369 CO 0.00 -0.79 0.90 -0.11 0.70 0.00 0.00 175.17 175.88 1i48 n LEU 370 N -1.55 -0.27 -0.20 2.11 -0.00 -1.26 -0.03 117.00 115.81 1i48 n LEU 370 Ca 0.01 0.96 0.01 0.00 -0.00 0.00 0.00 56.01 56.99 1i48 n LEU 370 Cb 0.63 -0.32 0.11 0.00 -0.00 0.00 0.00 43.42 43.85 1i48 n LEU 370 CO 0.42 -0.62 0.92 -0.07 -0.00 0.00 0.00 177.39 178.04 1i48 h LEU 371 N 0.00 -0.01 0.39 -1.96 -0.00 -1.96 -1.77 115.31 110.01 1i48 h LEU 371 Ca 0.04 0.12 -0.02 0.00 -0.00 0.00 0.00 57.88 58.02 1i48 h LEU 371 Cb 0.10 0.16 0.00 0.00 -0.00 0.00 0.00 40.66 40.92 1i48 h LEU 371 CO -0.24 0.00 -0.20 0.74 -0.00 0.00 0.00 178.44 178.75 1i48 h THR 372 N 0.26 0.59 -0.73 0.22 2.02 -1.14 -1.67 112.91 112.45 1i48 h THR 372 Ca 0.32 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.66 1i48 h THR 372 Cb 0.48 0.59 -0.11 0.00 -1.74 0.00 0.00 68.15 67.37 1i48 h THR 372 CO -0.41 0.00 0.17 0.74 0.37 0.00 0.00 175.52 176.39 1i48 h THR 373 N -0.55 0.51 -0.04 3.16 2.02 -0.03 0.13 112.91 118.12 1i48 h THR 373 Ca -0.05 -0.09 0.04 0.00 0.77 0.00 0.00 66.41 67.07 1i48 h THR 373 Cb 0.43 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.01 1i48 h THR 373 CO 0.08 0.05 -0.26 0.00 0.37 0.00 0.00 175.52 175.75 1i48 h ALA 374 N 1.61 -0.33 -1.30 6.16 0.00 -0.97 0.24 119.26 124.67 1i48 h ALA 374 Ca 0.41 0.01 0.38 0.00 0.00 0.00 0.00 54.91 55.71 1i48 h ALA 374 Cb 0.70 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 1i48 h ALA 374 CO -0.51 -0.75 0.89 -0.22 0.00 0.00 0.00 179.25 178.66 1i48 h LYS 375 N -0.38 0.11 0.45 0.00 3.64 0.20 0.33 116.57 120.91 1i48 h LYS 375 Ca 0.07 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1i48 h LYS 375 Cb 0.49 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1i48 h LYS 375 CO -0.26 0.07 -0.22 0.35 -2.27 0.00 0.00 179.45 177.13 1i48 h PHE 376 N 0.11 -0.56 -0.88 1.91 3.57 -0.35 -2.44 116.94 118.31 1i48 h PHE 376 Ca 0.68 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 62.30 1i48 h PHE 376 Cb 2.37 0.19 -0.09 0.00 2.79 0.00 0.00 35.95 41.21 1i48 h PHE 376 CO -0.00 -0.35 0.48 -0.39 -2.23 0.00 0.00 178.31 175.82 1i48 h VAL 377 N -0.89 0.78 -0.30 1.41 -1.51 -1.01 0.35 116.25 115.08 1i48 h VAL 377 Ca -0.06 -0.24 0.08 0.00 -1.23 0.00 0.00 66.70 65.25 1i48 h VAL 377 Cb 0.46 0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 29.62 1i48 h VAL 377 CO 0.10 0.13 0.22 0.44 -1.23 0.00 0.00 177.57 177.23 1i48 h ASP 378 N 0.71 0.02 0.14 4.19 3.32 -1.00 -0.82 116.42 122.97 1i48 h ASP 378 Ca 0.47 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.33 1i48 h ASP 378 Cb 0.61 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1i48 h ASP 378 CO -0.33 0.01 -0.69 0.00 -1.72 0.00 0.00 179.24 176.51 1i48 h ALA 379 N 1.85 0.59 -2.27 3.45 0.00 0.22 -3.45 119.26 119.64 1i48 h ALA 379 Ca 0.14 -0.58 -0.59 0.00 0.00 0.00 0.00 54.91 53.88 1i48 h ALA 379 Cb 0.55 -0.06 0.14 0.00 0.00 0.00 0.00 17.79 18.42 1i48 h ALA 379 CO -0.00 0.73 -0.09 1.28 0.00 0.00 0.00 179.25 181.16 1i48 n LEU 380 N -3.89 1.52 -0.00 0.00 4.77 -0.32 -4.84 117.00 114.25 1i48 n LEU 380 Ca -0.04 0.96 0.00 0.00 -0.03 0.00 0.00 56.01 56.90 1i48 n LEU 380 Cb 0.68 -1.25 -0.00 0.00 -2.33 0.00 0.00 43.42 40.52 1i48 n LEU 380 CO 0.48 -2.14 -0.19 0.29 -1.33 0.00 0.00 177.39 174.51 1i48 n LYS 381 N 0.25 4.31 -0.12 3.23 5.02 -1.26 -4.88 118.16 124.71 1i48 n LYS 381 Ca 0.11 -0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.19 1i48 n LYS 381 Cb 0.40 -0.70 -0.07 0.00 -0.02 0.00 0.00 35.03 34.64 1i48 n LYS 381 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1i48 n ILE 382 N -1.20 1.50 -2.32 -0.18 5.41 -1.26 -4.99 119.36 116.32 1i48 n ILE 382 Ca 0.00 -0.16 -0.35 0.00 1.00 0.00 0.00 62.75 63.24 1i48 n ILE 382 Cb 0.01 -2.07 -0.01 0.00 -0.71 0.00 0.00 39.64 36.87 1i48 n ILE 382 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1i48 s PRO 383 N -2.67 3.45 0.18 0.38 0.04 -1.26 -4.72 135.00 130.41 1i48 s PRO 383 Ca -0.34 1.56 -0.12 0.00 0.04 0.00 0.00 61.00 62.13 1i48 s PRO 383 Cb 0.10 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 1i48 s PRO 383 CO 0.46 -0.76 0.55 0.71 0.04 0.00 0.00 177.00 178.00 1i48 s TYR 384 N -1.81 3.53 -0.54 0.56 2.02 0.10 -4.76 117.35 116.44 1i48 s TYR 384 Ca 0.72 0.98 -0.21 0.00 -0.37 0.00 0.00 57.07 58.19 1i48 s TYR 384 Cb -0.22 -2.32 0.06 0.00 -0.40 0.00 0.00 41.96 39.07 1i48 s TYR 384 CO 0.25 0.36 0.77 0.42 -1.57 0.00 0.00 175.55 175.79 1i48 s ILE 385 N -1.61 4.65 -0.04 2.71 1.01 -1.26 -0.62 121.20 126.04 1i48 s ILE 385 Ca 0.42 -0.25 -0.31 0.00 0.00 0.00 0.00 60.65 60.51 1i48 s ILE 385 Cb -0.13 -4.43 0.12 0.00 0.01 0.00 0.00 42.46 38.02 1i48 s ILE 385 CO 0.20 -1.00 1.20 0.00 0.00 0.00 0.00 174.94 175.33 1i48 s ALA 386 N 3.23 -2.09 1.00 9.38 0.00 -0.86 -4.97 121.76 127.45 1i48 s ALA 386 Ca 0.21 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1i48 s ALA 386 Cb -0.17 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1i48 s ALA 386 CO 0.14 -0.90 0.00 -2.30 0.00 0.00 0.00 175.76 172.70 1i48 n PRO 387 N -0.36 1.75 -1.28 0.00 -0.02 -1.26 -4.50 135.00 129.33 1i48 n PRO 387 Ca -0.06 0.00 0.16 0.00 -2.02 0.00 0.00 63.50 61.58 1i48 n PRO 387 Cb 0.61 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 34.04 1i48 n PRO 387 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1i48 n SER 388 N 0.00 -7.33 -3.69 2.55 2.88 -1.26 -4.96 113.62 101.82 1i48 n SER 388 Ca 0.00 0.72 0.03 0.00 -1.33 0.00 0.00 58.87 58.30 1i48 n SER 388 Cb 0.00 -4.05 0.00 0.00 -0.75 0.00 0.00 64.21 59.41 1i48 n SER 388 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1i48 s PHE 389 N -2.77 -0.01 0.00 0.66 -0.12 -1.26 -4.94 117.98 109.54 1i48 s PHE 389 Ca 0.00 -0.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.84 1i48 s PHE 389 Cb 0.00 0.52 0.00 0.00 -0.63 0.00 0.00 43.02 42.91 1i48 s PHE 389 CO 0.00 -0.11 0.00 0.41 -0.05 0.00 0.00 175.22 175.47 1i48 n GLY 390 N -0.63 0.86 3.91 1.99 0.00 -1.26 -4.24 105.19 105.82 1i48 n GLY 390 Ca -0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 1i48 n GLY 390 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i48 s GLY 391 N -1.89 1.61 0.45 -0.02 0.00 -1.25 -4.27 107.32 101.95 1i48 s GLY 391 Ca 0.00 -0.63 0.16 0.00 0.00 0.00 0.00 44.72 44.24 1i48 s GLY 391 CO 0.00 -0.33 1.99 0.00 0.00 0.00 0.00 173.10 174.76 1i48 s GLU 393 N -5.32 4.66 0.47 0.00 8.01 -1.26 0.74 118.70 126.00 1i48 s GLU 393 Ca -0.07 1.28 -0.21 0.00 0.01 0.00 0.00 54.97 55.98 1i48 s GLU 393 Cb 0.20 -3.31 -0.08 0.00 -4.31 0.00 0.00 34.13 26.63 1i48 s GLU 393 CO 0.74 0.44 1.05 -1.12 0.01 0.00 0.00 175.26 176.38 1i48 s SER 394 N -0.75 6.40 0.01 -0.19 0.01 -1.26 -4.33 113.70 113.59 1i48 s SER 394 Ca 0.40 1.97 0.01 0.00 1.31 0.00 0.00 55.95 59.63 1i48 s SER 394 Cb -0.23 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.42 1i48 s SER 394 CO 0.28 -0.74 -0.03 -0.63 0.41 0.00 0.00 173.24 172.53 1i48 s ILE 395 N -1.90 0.17 0.12 1.44 1.01 0.24 -0.72 121.20 121.56 1i48 s ILE 395 Ca 0.65 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.77 1i48 s ILE 395 Cb -0.18 -0.24 -0.04 0.00 0.01 0.00 0.00 42.46 42.01 1i48 s ILE 395 CO 0.22 -0.25 -0.07 0.68 0.00 0.00 0.00 174.94 175.53 1i48 s VAL 396 N -0.81 0.81 0.02 2.92 -7.23 0.21 0.56 120.40 116.88 1i48 s VAL 396 Ca -0.08 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 57.83 1i48 s VAL 396 Cb -0.06 -1.77 0.10 0.00 0.56 0.00 0.00 36.38 35.21 1i48 s VAL 396 CO -0.00 -0.80 1.03 1.51 -0.31 0.00 0.00 175.10 176.53 1i48 s ASP 397 N -3.09 -0.21 -0.66 4.85 -4.77 -1.06 -2.04 116.67 109.69 1i48 s ASP 397 Ca 0.14 -0.16 0.04 0.00 -3.30 0.00 0.00 52.55 49.28 1i48 s ASP 397 Cb 0.05 0.34 0.16 0.00 -1.09 0.00 0.00 42.92 42.38 1i48 s ASP 397 CO -0.03 -0.60 0.44 -1.58 0.70 0.00 0.00 175.17 174.11 1i48 s GLN 398 N -2.94 2.37 0.11 2.11 0.74 -1.26 -2.42 119.66 118.37 1i48 s GLN 398 Ca 0.10 -3.15 -0.03 0.00 0.05 0.00 0.00 55.36 52.32 1i48 s GLN 398 Cb -0.00 -3.42 0.19 0.00 1.10 0.00 0.00 33.01 30.88 1i48 s GLN 398 CO -0.04 -1.24 0.64 -2.30 -0.55 0.00 0.00 175.29 171.80 1i48 n PRO 399 N 2.29 -0.04 -0.36 1.67 -0.02 -1.26 0.24 135.00 137.52 1i48 n PRO 399 Ca 0.16 0.64 0.28 0.00 -2.02 0.00 0.00 63.50 62.56 1i48 n PRO 399 Cb 0.34 -0.95 0.54 0.00 -0.02 0.00 0.00 33.50 33.41 1i48 n PRO 399 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i48 h ALA 400 N 0.82 2.21 0.00 3.55 0.00 -1.87 -0.62 119.26 123.36 1i48 h ALA 400 Ca 0.20 0.17 -0.17 0.00 0.00 0.00 0.00 54.91 55.10 1i48 h ALA 400 Cb 0.30 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1i48 h ALA 400 CO -0.42 -0.84 -1.53 -0.89 0.00 0.00 0.00 179.25 175.57 1i48 n ILE 401 N -4.95 1.46 -0.33 0.00 5.41 0.65 -0.40 119.36 121.20 1i48 n ILE 401 Ca 0.33 -0.05 0.15 0.00 1.00 0.00 0.00 62.75 64.18 1i48 n ILE 401 Cb 1.13 -2.12 0.29 0.00 -0.71 0.00 0.00 39.64 38.23 1i48 n ILE 401 CO 0.00 0.00 0.00 0.80 0.00 0.00 0.00 176.55 177.35 1i48 n MET 402 N -4.30 -0.08 -0.89 0.38 1.56 0.39 -3.21 117.12 110.97 1i48 n MET 402 Ca -0.28 1.44 -0.00 0.00 -0.27 0.00 0.00 57.70 58.59 1i48 n MET 402 Cb 0.63 -2.29 -0.01 0.00 2.15 0.00 0.00 33.22 33.70 1i48 n MET 402 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 1i48 n SER 403 N -5.43 0.10 0.00 6.12 3.41 -0.31 -4.87 113.62 112.64 1i48 n SER 403 Ca 0.23 -1.80 0.00 0.00 -0.26 0.00 0.00 58.87 57.04 1i48 n SER 403 Cb 0.75 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.60 1i48 n SER 403 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1i48 n TYR 404 N 0.15 0.00 0.32 7.33 4.02 -0.77 -4.82 117.16 123.38 1i48 n TYR 404 Ca -0.04 0.00 0.21 0.00 -0.01 0.00 0.00 57.90 58.07 1i48 n TYR 404 Cb 0.79 0.01 1.14 0.00 -0.02 0.00 0.00 39.34 41.26 1i48 n TYR 404 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 1i48 h TRP 405 N 0.00 0.00 0.00 -0.72 2.91 -0.69 0.12 115.95 117.57 1i48 h TRP 405 Ca 0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1i48 h TRP 405 Cb 0.56 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.21 1i48 h TRP 405 CO 0.00 0.00 0.00 -0.40 -1.03 0.00 0.00 178.44 177.01 1i48 n ASP 406 N -2.97 0.74 -5.00 2.65 5.75 -1.26 -4.78 116.55 111.67 1i48 n ASP 406 Ca -0.03 0.66 -0.17 0.00 -0.01 0.00 0.00 54.79 55.24 1i48 n ASP 406 Cb 0.07 -0.83 0.01 0.00 -1.03 0.00 0.00 41.12 39.34 1i48 n ASP 406 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1i48 s LEU 407 N -4.59 3.71 0.49 -2.12 1.43 0.43 -5.11 118.68 112.92 1i48 s LEU 407 Ca 0.05 -0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 52.64 1i48 s LEU 407 Cb 0.10 -2.66 -0.06 0.00 0.03 0.00 0.00 46.19 43.59 1i48 s LEU 407 CO 0.43 -0.70 0.89 -0.94 0.23 0.00 0.00 176.35 176.27 1i48 s SER 408 N -4.31 6.50 0.44 2.29 1.04 -1.26 -4.86 113.70 113.53 1i48 s SER 408 Ca 0.53 1.33 0.21 0.00 0.48 0.00 0.00 55.95 58.50 1i48 s SER 408 Cb -0.10 -2.41 1.19 0.00 0.10 0.00 0.00 66.02 64.80 1i48 s SER 408 CO 0.33 -0.56 1.82 -0.61 0.98 0.00 0.00 173.24 175.20 1i48 h GLN 409 N 0.80 0.30 0.17 4.02 5.75 -1.96 0.22 115.11 124.41 1i48 h GLN 409 Ca -0.47 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.01 1i48 h GLN 409 Cb 1.19 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.67 1i48 h GLN 409 CO 0.62 0.20 -0.08 0.77 -2.65 0.00 0.00 178.83 177.69 1i48 h SER 410 N 0.31 -0.19 -0.58 -0.69 0.02 -1.99 -3.22 113.55 107.21 1i48 h SER 410 Ca 0.52 0.01 0.17 0.00 -0.84 0.00 0.00 61.79 61.64 1i48 h SER 410 Cb 1.47 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 64.03 1i48 h SER 410 CO -0.18 0.28 0.53 0.44 -1.14 0.00 0.00 176.83 176.75 1i48 h ASP 411 N -1.06 0.00 -0.21 3.07 3.32 -1.82 0.91 116.42 120.63 1i48 h ASP 411 Ca -0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1i48 h ASP 411 Cb 0.17 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1i48 h ASP 411 CO 0.04 0.00 0.09 0.03 -1.72 0.00 0.00 179.24 177.68 1i48 h ARG 412 N 0.00 0.31 0.00 3.56 3.08 -0.64 -2.18 114.38 118.52 1i48 h ARG 412 Ca 0.27 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.27 1i48 h ARG 412 Cb 1.32 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 1i48 h ARG 412 CO -0.00 0.37 -0.01 0.00 -1.07 0.00 0.00 179.97 179.25 1i48 h ALA 413 N 0.93 1.04 -0.09 0.04 0.00 -0.83 -2.43 119.26 117.92 1i48 h ALA 413 Ca 0.07 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1i48 h ALA 413 Cb 0.17 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1i48 h ALA 413 CO -0.01 0.02 0.31 -0.22 0.00 0.00 0.00 179.25 179.35 1i48 h LYS 414 N 0.00 0.00 -0.02 0.00 3.64 -1.15 0.63 116.57 119.67 1i48 h LYS 414 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1i48 h LYS 414 Cb 0.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1i48 h LYS 414 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1i48 n TYR 415 N -3.13 0.02 -0.20 1.91 4.01 -0.93 -4.98 117.16 113.87 1i48 n TYR 415 Ca -0.00 -0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1i48 n TYR 415 Cb 0.39 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1i48 n TYR 415 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i48 n GLY 416 N 0.03 1.01 3.55 2.72 0.00 0.21 -4.99 105.19 107.73 1i48 n GLY 416 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1i48 n GLY 416 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i48 s ILE 417 N -2.62 3.27 0.17 -0.61 -1.09 -1.13 -4.93 121.20 114.26 1i48 s ILE 417 Ca 0.00 0.08 -0.05 0.00 -2.23 0.00 0.00 60.65 58.45 1i48 s ILE 417 Cb 0.00 -3.70 -0.06 0.00 -1.58 0.00 0.00 42.46 37.12 1i48 s ILE 417 CO 0.00 -0.68 0.41 -0.04 -1.23 0.00 0.00 174.94 173.40 1i48 s MET 418 N 7.39 3.64 0.00 2.79 -1.94 -1.26 -3.97 119.30 125.95 1i48 s MET 418 Ca 0.75 -0.05 0.08 0.00 -1.71 0.00 0.00 55.69 54.76 1i48 s MET 418 Cb -0.13 -2.81 0.45 0.00 2.01 0.00 0.00 34.83 34.35 1i48 s MET 418 CO 0.19 0.43 1.08 -0.25 -0.01 0.00 0.00 175.02 176.45 1i48 n ASP 419 N -0.04 0.00 -0.06 3.03 9.92 -1.26 -2.02 116.55 126.11 1i48 n ASP 419 Ca -0.02 0.02 -0.06 0.00 -0.53 0.00 0.00 54.79 54.20 1i48 n ASP 419 Cb 0.52 -0.19 -0.04 0.00 -0.64 0.00 0.00 41.12 40.77 1i48 n ASP 419 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 1i48 h ASN 420 N 0.00 0.00 -1.13 -2.24 -0.00 -1.89 -3.36 115.58 106.95 1i48 h ASN 420 Ca 0.00 -0.28 -0.65 0.00 -0.00 0.00 0.00 56.30 55.38 1i48 h ASN 420 Cb 0.05 0.00 0.12 0.00 -0.00 0.00 0.00 38.32 38.49 1i48 h ASN 420 CO 0.00 0.75 -0.61 -0.11 -0.00 0.00 0.00 177.43 177.45 1i48 n LEU 421 N -4.68 -1.59 -3.71 0.34 7.94 -0.86 -3.48 117.00 110.96 1i48 n LEU 421 Ca -0.06 1.04 -0.14 0.00 -1.11 0.00 0.00 56.01 55.74 1i48 n LEU 421 Cb 0.22 -0.92 -0.14 0.00 0.53 0.00 0.00 43.42 43.10 1i48 n LEU 421 CO 0.11 -3.21 -0.21 -0.69 -1.11 0.00 0.00 177.39 172.29 1i48 s VAL 422 N -1.13 -0.14 -0.11 1.96 1.01 -0.17 -4.50 120.40 117.31 1i48 s VAL 422 Ca 0.62 0.24 -0.11 0.00 0.00 0.00 0.00 61.98 62.73 1i48 s VAL 422 Cb -0.85 -0.29 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 1i48 s VAL 422 CO 0.57 0.10 0.23 -0.13 0.00 0.00 0.00 175.10 175.87 1i48 s ARG 423 N 1.61 3.82 -0.20 2.72 0.52 -1.01 -1.30 118.95 125.11 1i48 s ARG 423 Ca -0.05 0.03 -0.01 0.00 -0.52 0.00 0.00 55.73 55.18 1i48 s ARG 423 Cb -0.12 -3.28 0.06 0.00 0.52 0.00 0.00 34.95 32.13 1i48 s ARG 423 CO -0.06 0.58 -0.01 0.12 0.02 0.00 0.00 175.30 175.95 1i48 s PHE 424 N -0.54 1.59 -0.74 -0.53 2.19 0.39 -2.57 117.98 117.77 1i48 s PHE 424 Ca 0.16 -1.18 -0.18 0.00 0.33 0.00 0.00 56.93 56.07 1i48 s PHE 424 Cb -0.13 -1.25 0.14 0.00 -1.31 0.00 0.00 43.02 40.46 1i48 s PHE 424 CO 0.05 -0.66 0.83 0.45 1.83 0.00 0.00 175.22 177.73 1i48 s SER 425 N 1.67 6.45 0.08 6.13 0.15 0.19 -1.61 113.70 126.76 1i48 s SER 425 Ca -0.02 -1.91 -0.31 0.00 0.70 0.00 0.00 55.95 54.41 1i48 s SER 425 Cb -0.17 -2.31 -0.10 0.00 -1.71 0.00 0.00 66.02 61.74 1i48 s SER 425 CO -0.07 -0.97 1.88 -0.36 1.20 0.00 0.00 173.24 174.92 1i48 s PHE 426 N 2.06 1.80 0.00 3.44 0.08 -0.60 -0.59 117.98 124.17 1i48 s PHE 426 Ca 0.19 -0.19 0.00 0.00 0.12 0.00 0.00 56.93 57.05 1i48 s PHE 426 Cb -0.15 -4.20 0.00 0.00 -0.57 0.00 0.00 43.02 38.10 1i48 s PHE 426 CO -0.02 -5.11 0.00 0.41 -0.10 0.00 0.00 175.22 170.41 1i48 n GLY 427 N 4.35 -1.24 0.16 4.36 0.00 -1.26 -4.82 105.19 106.74 1i48 n GLY 427 Ca 0.19 -1.18 0.02 0.00 0.00 0.00 0.00 46.02 45.04 1i48 n GLY 427 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1i48 n VAL 428 N 0.00 0.24 -0.50 1.61 3.14 0.23 -4.67 118.33 118.38 1i48 n VAL 428 Ca 0.00 -0.62 -0.27 0.00 -2.96 0.00 0.00 64.34 60.49 1i48 n VAL 428 Cb 0.00 0.94 0.21 0.00 -1.06 0.00 0.00 33.84 33.93 1i48 n VAL 428 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1i48 n GLU 429 N 0.12 -2.66 -2.49 1.45 4.71 -1.26 -4.90 120.64 115.61 1i48 n GLU 429 Ca 0.03 -0.77 -0.41 0.00 -0.01 0.00 0.00 57.16 55.99 1i48 n GLU 429 Cb 0.14 -1.77 -0.04 0.00 -1.01 0.00 0.00 31.44 28.77 1i48 n GLU 429 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1i48 s ASP 430 N -2.22 7.22 0.02 1.62 2.15 -1.26 -4.95 116.67 119.25 1i48 s ASP 430 Ca 0.55 2.10 -0.04 0.00 0.43 0.00 0.00 52.55 55.59 1i48 s ASP 430 Cb -0.13 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 39.88 1i48 s ASP 430 CO 0.56 -0.26 1.07 0.15 -0.17 0.00 0.00 175.17 176.52 1i48 h PHE 431 N 5.27 -0.24 -0.91 -5.34 3.04 -1.98 -1.74 116.94 115.05 1i48 h PHE 431 Ca -0.44 0.01 0.17 0.00 3.98 0.00 0.00 57.97 61.69 1i48 h PHE 431 Cb 1.21 0.11 -0.17 0.00 2.56 0.00 0.00 35.95 39.67 1i48 h PHE 431 CO 0.63 -0.06 -0.28 -0.44 -2.02 0.00 0.00 178.31 176.14 1i48 h ASP 432 N -0.04 -1.03 -0.59 0.41 3.32 -1.98 0.51 116.42 117.02 1i48 h ASP 432 Ca 0.01 0.28 0.10 0.00 0.02 0.00 0.00 57.03 57.44 1i48 h ASP 432 Cb 0.07 0.62 -0.07 0.00 0.22 0.00 0.00 39.33 40.17 1i48 h ASP 432 CO -0.09 -0.30 0.19 0.44 -1.72 0.00 0.00 179.24 177.76 1i48 h ASP 433 N -0.02 0.15 0.66 6.45 3.32 -1.82 0.28 116.42 125.45 1i48 h ASP 433 Ca 0.40 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.50 1i48 h ASP 433 Cb 0.64 0.09 0.01 0.00 0.22 0.00 0.00 39.33 40.28 1i48 h ASP 433 CO -0.93 0.09 -0.32 -0.07 -1.72 0.00 0.00 179.24 176.29 1i48 h LEU 434 N 0.35 -0.75 -0.47 1.55 3.38 0.62 -2.43 115.31 117.56 1i48 h LEU 434 Ca 0.30 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.35 1i48 h LEU 434 Cb 0.39 0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1i48 h LEU 434 CO -0.33 -0.38 -0.44 0.50 0.09 0.00 0.00 178.44 177.88 1i48 h LYS 435 N -1.21 -0.20 -0.91 1.13 3.64 -0.01 0.24 116.57 119.25 1i48 h LYS 435 Ca -0.09 0.01 0.20 0.00 -1.27 0.00 0.00 60.65 59.50 1i48 h LYS 435 Cb 0.68 0.05 -0.17 0.00 -0.41 0.00 0.00 32.23 32.38 1i48 h LYS 435 CO 0.15 -0.14 -0.14 0.00 -2.27 0.00 0.00 179.45 177.06 1i48 h ALA 436 N -0.16 0.76 0.68 5.00 0.00 -0.51 0.15 119.26 125.18 1i48 h ALA 436 Ca 0.08 0.34 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1i48 h ALA 436 Cb 0.42 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1i48 h ALA 436 CO -0.55 -0.44 -0.48 0.22 0.00 0.00 0.00 179.25 177.99 1i48 h ASP 437 N 0.02 -1.26 -0.21 0.00 3.58 -0.12 0.74 116.42 119.16 1i48 h ASP 437 Ca 0.47 0.08 0.05 0.00 0.42 0.00 0.00 57.03 58.05 1i48 h ASP 437 Cb 0.80 0.38 -0.07 0.00 1.72 0.00 0.00 39.33 42.16 1i48 h ASP 437 CO -0.89 -0.71 -0.43 0.40 -2.88 0.00 0.00 179.24 174.72 1i48 h ILE 438 N -1.12 0.12 0.27 2.25 2.04 0.13 0.20 117.51 121.41 1i48 h ILE 438 Ca -0.09 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 1i48 h ILE 438 Cb 0.92 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 1i48 h ILE 438 CO 0.05 0.00 -0.45 -0.07 0.00 0.00 0.00 178.15 177.68 1i48 h LEU 439 N -0.45 -1.29 -1.20 1.44 3.38 -0.74 0.46 115.31 116.91 1i48 h LEU 439 Ca 0.09 0.12 0.32 0.00 0.09 0.00 0.00 57.88 58.50 1i48 h LEU 439 Cb 0.62 0.45 -0.12 0.00 0.09 0.00 0.00 40.66 41.70 1i48 h LEU 439 CO -0.45 -0.53 0.66 -0.61 0.09 0.00 0.00 178.44 177.60 1i48 h GLN 440 N -0.76 0.33 0.08 1.13 -0.00 -0.52 0.34 115.11 115.70 1i48 h GLN 440 Ca -0.03 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 1i48 h GLN 440 Cb 0.71 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 28.11 1i48 h GLN 440 CO -0.15 0.22 -0.04 0.00 0.00 0.00 0.00 178.83 178.86 1i48 h ALA 441 N 1.71 -0.11 0.00 3.38 0.00 0.10 -2.67 119.26 121.67 1i48 h ALA 441 Ca 0.69 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1i48 h ALA 441 Cb 1.74 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1i48 h ALA 441 CO -0.45 -0.38 0.00 1.28 0.00 0.00 0.00 179.25 179.70 1i48 n LEU 442 N -4.97 0.00 -0.04 0.00 4.77 0.15 -1.37 117.00 115.54 1i48 n LEU 442 Ca -0.08 0.21 0.02 0.00 -0.03 0.00 0.00 56.01 56.12 1i48 n LEU 442 Cb 0.21 -0.21 -0.15 0.00 -2.33 0.00 0.00 43.42 40.95 1i48 n LEU 442 CO 0.32 -0.21 -0.87 0.47 -1.33 0.00 0.00 177.39 175.78 1i48 n ASP 443 N -1.21 0.61 0.04 -1.43 9.92 -0.70 -4.30 116.55 119.49 1i48 n ASP 443 Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.29 1i48 n ASP 443 Cb 0.00 1.50 0.14 0.00 -0.64 0.00 0.00 41.12 42.12 1i48 n ASP 443 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1i48 n SER 444 N -2.37 0.14 0.00 -2.24 7.64 -0.47 -5.12 113.62 111.20 1i48 n SER 444 Ca -0.14 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1i48 n SER 444 Cb 0.73 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 1i48 n SER 444 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33