#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 3.12 -0.13 2.98 0.00 -1.26 -5.06 121.76 121.41 1i48 s ALA 51 Ca 0.00 -2.23 0.17 0.00 0.00 0.00 0.00 51.96 49.90 1i48 s ALA 51 Cb 0.00 0.22 -0.23 0.00 0.00 0.00 0.00 23.12 23.11 1i48 s ALA 51 CO 0.00 -0.14 0.44 -1.13 0.00 0.00 0.00 175.76 174.93 1i48 n SER 52 N -0.95 0.38 0.06 0.00 3.41 -1.26 -4.31 113.62 110.96 1i48 n SER 52 Ca -0.05 0.17 0.11 0.00 -0.26 0.00 0.00 58.87 58.85 1i48 n SER 52 Cb 0.67 0.74 0.01 0.00 -0.26 0.00 0.00 64.21 65.37 1i48 n SER 52 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1i48 n PHE 53 N -2.77 0.57 -3.62 7.33 1.16 -1.26 -4.79 117.46 114.09 1i48 n PHE 53 Ca -0.20 0.17 -0.38 0.00 -1.87 0.00 0.00 57.45 55.17 1i48 n PHE 53 Cb 0.97 -0.70 -0.11 0.00 -1.61 0.00 0.00 39.48 38.02 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 -4.65 4.01 0.00 5.98 1.43 -1.26 -4.92 118.68 119.27 1i48 s LEU 54 Ca 0.01 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1i48 s LEU 54 Cb 0.12 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.28 1i48 s LEU 54 CO 0.80 -0.11 0.00 0.59 0.23 0.00 0.00 176.35 177.86 1i48 n ASN 55 N 5.03 4.60 -4.73 2.29 3.02 -1.26 -4.52 115.26 119.68 1i48 n ASN 55 Ca -0.14 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.00 1i48 n ASN 55 Cb 0.51 0.56 -0.04 0.00 -0.61 0.00 0.00 39.78 40.19 1i48 n ASN 55 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1i48 s SER 56 N -2.63 7.35 0.27 6.41 0.15 -1.26 -4.92 113.70 119.07 1i48 s SER 56 Ca 0.00 1.96 0.00 0.00 0.70 0.00 0.00 55.95 58.61 1i48 s SER 56 Cb 0.00 -2.60 0.62 0.00 -1.71 0.00 0.00 66.02 62.33 1i48 s SER 56 CO 0.00 -0.18 1.69 0.44 1.20 0.00 0.00 173.24 176.40 1i48 h ASP 57 N 5.45 0.21 0.35 5.45 5.19 -1.99 -0.27 116.42 130.82 1i48 h ASP 57 Ca -0.43 0.15 -0.00 0.00 -0.62 0.00 0.00 57.03 56.12 1i48 h ASP 57 Cb 1.21 0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.86 1i48 h ASP 57 CO 0.73 -0.01 -0.36 1.23 -3.12 0.00 0.00 179.24 177.71 1i48 h GLY 58 N 0.36 -0.84 0.43 2.75 0.00 -1.98 0.26 103.07 104.05 1i48 h GLY 58 Ca 0.50 0.41 0.17 0.00 0.00 0.00 0.00 47.33 48.42 1i48 h GLY 58 CO -0.52 -0.30 0.58 1.76 0.00 0.00 0.00 176.54 178.06 1i48 h SER 59 N -0.74 0.53 0.58 0.19 0.02 -1.53 -1.78 113.55 110.82 1i48 h SER 59 Ca -0.02 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 1i48 h SER 59 Cb 0.67 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 63.16 1i48 h SER 59 CO -0.07 0.24 -0.28 0.58 -1.14 0.00 0.00 176.83 176.17 1i48 h VAL 60 N 0.55 0.08 0.00 2.27 2.07 -0.22 -0.79 116.25 120.20 1i48 h VAL 60 Ca 0.46 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1i48 h VAL 60 Cb 0.93 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1i48 h VAL 60 CO -0.20 0.01 0.63 0.00 0.02 0.00 0.00 177.57 178.04 1i48 h ALA 61 N -1.12 1.61 0.03 1.67 0.00 0.17 1.21 119.26 122.83 1i48 h ALA 61 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.49 1i48 h ALA 61 Cb 0.62 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1i48 h ALA 61 CO 0.13 -0.61 -1.87 -0.89 0.00 0.00 0.00 179.25 176.01 1i48 n ILE 62 N -2.60 1.59 0.70 0.00 5.41 -0.74 -4.11 119.36 119.60 1i48 n ILE 62 Ca -0.01 -0.31 0.07 0.00 1.00 0.00 0.00 62.75 63.50 1i48 n ILE 62 Cb 0.66 -1.87 -0.08 0.00 -0.71 0.00 0.00 39.64 37.64 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 -4.05 0.00 -1.67 1.39 8.25 0.14 -4.87 115.22 114.42 1i48 n HIS 63 Ca -0.39 0.00 -0.49 0.00 -0.26 0.00 0.00 57.72 56.58 1i48 n HIS 63 Cb 0.85 -0.00 -0.05 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 n ALA 64 N -1.35 0.65 -2.11 -1.41 0.00 0.39 -1.31 120.51 115.37 1i48 n ALA 64 Ca 0.03 0.40 -0.12 0.00 0.00 0.00 0.00 53.44 53.74 1i48 n ALA 64 Cb 0.23 -2.34 -0.01 0.00 0.00 0.00 0.00 19.45 17.33 1i48 n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i48 n GLY 65 N 3.68 0.06 1.86 0.00 0.00 -1.26 -4.24 105.19 105.29 1i48 n GLY 65 Ca 0.20 -0.38 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 -2.26 0.00 -0.26 1.61 1.02 -0.42 -4.75 120.64 115.58 1i48 n GLU 66 Ca -0.14 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.09 1i48 n GLU 66 Cb 0.58 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 32.20 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 -2.40 -0.06 0.00 3.49 3.00 -0.93 -2.34 116.66 117.42 1i48 n ARG 67 Ca 0.00 1.14 0.00 0.00 -0.00 0.00 0.00 57.85 58.99 1i48 n ARG 67 Cb 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 32.46 30.68 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 -5.08 0.60 -4.16 6.15 4.77 -1.26 -5.03 117.00 112.99 1i48 n LEU 68 Ca 0.16 0.51 -0.14 0.00 -0.03 0.00 0.00 56.01 56.51 1i48 n LEU 68 Cb 0.53 -0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 41.19 1i48 n LEU 68 CO -0.06 -0.36 -0.05 -0.83 -1.33 0.00 0.00 177.39 174.76 1i48 s GLY 69 N -1.42 1.49 0.00 -0.72 0.00 -0.99 -5.07 107.32 100.61 1i48 s GLY 69 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 44.72 43.12 1i48 s GLY 69 CO 0.00 -1.18 0.00 0.54 0.00 0.00 0.00 173.10 172.46 1i48 n ARG 70 N -0.44 2.11 -1.17 2.90 1.74 -1.26 -3.64 116.66 116.91 1i48 n ARG 70 Ca 0.02 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.05 1i48 n ARG 70 Cb 0.63 -0.19 -0.02 0.00 -1.02 0.00 0.00 32.46 31.86 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 0.10 0.75 0.06 -0.13 0.00 -1.26 -4.75 105.19 99.97 1i48 n GLY 71 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.59 0.29 0.00 -0.61 0.00 -1.26 -5.09 119.36 110.10 1i48 n ILE 72 Ca -0.06 -0.30 0.00 0.00 0.00 0.00 0.00 62.75 62.39 1i48 n ILE 72 Cb 0.31 0.78 0.00 0.00 0.00 0.00 0.00 39.64 40.74 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 -0.16 0.00 -3.58 9.51 0.31 -1.26 -5.03 118.33 118.11 1i48 n VAL 73 Ca 0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.22 1i48 n VAL 73 Cb 0.48 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.35 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 -1.64 2.52 -4.23 -1.26 -5.00 115.64 106.04 1i48 s THR 74 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.57 1i48 s THR 74 Cb 0.00 -1.00 0.20 0.00 1.34 0.00 0.00 72.50 73.04 1i48 s THR 74 CO 0.00 0.00 1.07 -0.90 -0.54 0.00 0.00 174.62 174.25 1i48 n ASP 75 N 1.27 1.51 -4.79 3.99 5.68 -1.26 -4.85 116.55 118.11 1i48 n ASP 75 Ca -0.13 -2.08 -0.39 0.00 -0.50 0.00 0.00 54.79 51.69 1i48 n ASP 75 Cb 0.57 -0.27 -0.06 0.00 -1.14 0.00 0.00 41.12 40.22 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 -1.65 3.46 0.01 2.12 0.00 -1.26 -5.00 121.76 119.44 1i48 s ALA 76 Ca 0.15 0.30 -0.25 0.00 0.00 0.00 0.00 51.96 52.16 1i48 s ALA 76 Cb 0.09 -2.91 -0.18 0.00 0.00 0.00 0.00 23.12 20.12 1i48 s ALA 76 CO 0.08 0.31 1.36 0.82 0.00 0.00 0.00 175.76 178.33 1i48 h ILE 77 N 3.25 1.05 -4.14 0.00 2.04 -2.04 -3.45 117.51 114.21 1i48 h ILE 77 Ca -0.47 -0.69 -0.46 0.00 1.00 0.00 0.00 64.86 64.23 1i48 h ILE 77 Cb 1.20 1.48 0.11 0.00 -0.74 0.00 0.00 36.82 38.87 1i48 h ILE 77 CO 0.66 0.17 0.35 0.42 0.00 0.00 0.00 178.15 179.74 1i48 s THR 78 N -4.84 2.07 -0.08 -0.27 -4.23 -1.26 -4.97 115.64 102.07 1i48 s THR 78 Ca -0.15 -0.10 -0.24 0.00 -1.18 0.00 0.00 61.69 60.03 1i48 s THR 78 Cb 0.03 -2.98 -0.03 0.00 1.34 0.00 0.00 72.50 70.86 1i48 s THR 78 CO 0.62 0.00 0.72 -0.89 -0.54 0.00 0.00 174.62 174.54 1i48 s THR 79 N -3.55 5.02 0.34 3.99 2.01 -1.26 -5.03 115.64 117.16 1i48 s THR 79 Ca 0.65 1.48 -0.27 0.00 0.31 0.00 0.00 61.69 63.85 1i48 s THR 79 Cb -0.09 -4.06 -0.09 0.00 0.01 0.00 0.00 72.50 68.27 1i48 s THR 79 CO 0.49 0.22 1.13 -2.16 -0.69 0.00 0.00 174.62 173.61 1i48 s PRO 80 N 0.99 4.35 -0.46 4.92 0.04 -1.26 -4.99 135.00 138.59 1i48 s PRO 80 Ca 0.38 1.80 -0.22 0.00 0.04 0.00 0.00 61.00 63.00 1i48 s PRO 80 Cb -0.18 -2.91 0.03 0.00 0.04 0.00 0.00 34.50 31.48 1i48 s PRO 80 CO 0.18 -0.05 0.73 0.08 0.04 0.00 0.00 177.00 177.98 1i48 s VAL 81 N -1.32 4.72 -0.44 -0.36 1.01 -1.26 -4.54 120.40 118.21 1i48 s VAL 81 Ca 0.51 0.17 -0.22 0.00 0.00 0.00 0.00 61.98 62.44 1i48 s VAL 81 Cb -0.31 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 31.80 1i48 s VAL 81 CO 0.39 -0.72 0.75 -0.69 0.00 0.00 0.00 175.10 174.83 1i48 s VAL 82 N 3.09 4.70 -1.06 2.92 1.01 -1.26 -4.98 120.40 124.82 1i48 s VAL 82 Ca 0.25 0.39 -0.03 0.00 0.00 0.00 0.00 61.98 62.59 1i48 s VAL 82 Cb -0.14 -4.28 0.31 0.00 0.00 0.00 0.00 36.38 32.27 1i48 s VAL 82 CO 0.20 -0.66 1.49 0.59 0.00 0.00 0.00 175.10 176.71 1i48 n ASN 83 N 6.58 6.41 -4.42 3.32 3.02 -1.26 -4.76 115.26 124.15 1i48 n ASN 83 Ca 0.01 -3.44 -0.31 0.00 -0.03 0.00 0.00 54.58 50.81 1i48 n ASN 83 Cb 0.48 -1.23 -0.13 0.00 -0.61 0.00 0.00 39.78 38.28 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 -2.94 2.56 -0.36 3.41 -1.32 -1.26 -5.01 115.64 110.72 1i48 s THR 84 Ca 0.32 -1.25 0.23 0.00 -1.21 0.00 0.00 61.69 59.78 1i48 s THR 84 Cb 0.07 -2.05 -0.06 0.00 -1.51 0.00 0.00 72.50 68.94 1i48 s THR 84 CO 0.08 0.35 1.01 -1.54 -2.21 0.00 0.00 174.62 172.32 1i48 n SER 85 N 1.64 0.66 -3.66 8.08 3.41 -1.26 -4.72 113.62 117.78 1i48 n SER 85 Ca -0.16 0.12 -0.08 0.00 -0.26 0.00 0.00 58.87 58.48 1i48 n SER 85 Cb 0.52 0.68 -0.02 0.00 -0.26 0.00 0.00 64.21 65.13 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 -3.31 -0.71 -0.05 7.33 0.00 -1.26 -2.27 121.76 121.48 1i48 s ALA 86 Ca 0.01 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.36 1i48 s ALA 86 Cb 0.12 0.90 0.00 0.00 0.00 0.00 0.00 23.12 24.14 1i48 s ALA 86 CO 0.80 -0.96 -0.14 0.71 0.00 0.00 0.00 175.76 176.16 1i48 s TYR 87 N -3.55 1.54 0.71 0.00 1.51 -1.08 -4.86 117.35 111.62 1i48 s TYR 87 Ca 0.16 -0.48 -0.00 0.00 -1.01 0.00 0.00 57.07 55.74 1i48 s TYR 87 Cb -0.04 -1.07 0.12 0.00 -0.11 0.00 0.00 41.96 40.86 1i48 s TYR 87 CO 0.09 -0.20 0.98 -0.59 -1.11 0.00 0.00 175.55 174.72 1i48 s PHE 88 N 0.27 1.62 0.02 2.71 -0.12 -1.26 -4.77 117.98 116.45 1i48 s PHE 88 Ca -0.08 -0.29 0.04 0.00 -0.05 0.00 0.00 56.93 56.55 1i48 s PHE 88 Cb -0.13 -2.95 -0.02 0.00 -0.63 0.00 0.00 43.02 39.30 1i48 s PHE 88 CO 0.03 -1.66 -0.11 -0.06 -0.05 0.00 0.00 175.22 173.37 1i48 s PHE 89 N -3.11 1.01 0.16 3.49 0.40 -1.26 -5.05 117.98 113.62 1i48 s PHE 89 Ca 0.66 -0.30 -0.11 0.00 -0.60 0.00 0.00 56.93 56.58 1i48 s PHE 89 Cb -0.05 -0.61 0.04 0.00 0.51 0.00 0.00 43.02 42.90 1i48 s PHE 89 CO 0.44 0.00 1.62 -0.91 0.70 0.00 0.00 175.22 177.07 1i48 h ASN 90 N 5.25 0.95 -5.00 1.36 2.35 -2.00 -3.46 115.58 115.02 1i48 h ASN 90 Ca -0.35 -0.30 -0.07 0.00 -0.55 0.00 0.00 56.30 55.02 1i48 h ASN 90 Cb 1.18 -0.25 -0.18 0.00 0.05 0.00 0.00 38.32 39.11 1i48 h ASN 90 CO 0.46 1.02 0.04 -1.59 -1.65 0.00 0.00 177.43 175.71 1i48 s LYS 91 N -5.03 0.97 0.29 0.81 -2.85 -1.26 -5.05 119.74 107.62 1i48 s LYS 91 Ca -0.12 0.01 0.02 0.00 -1.00 0.00 0.00 55.97 54.87 1i48 s LYS 91 Cb 0.13 0.45 0.71 0.00 -2.06 0.00 0.00 37.83 37.05 1i48 s LYS 91 CO 0.84 -0.31 1.63 1.15 0.10 0.00 0.00 175.35 178.76 1i48 h THR 92 N 3.12 0.26 -0.96 3.79 2.02 -1.99 0.44 112.91 119.59 1i48 h THR 92 Ca -0.29 -0.05 0.23 0.00 0.77 0.00 0.00 66.41 67.07 1i48 h THR 92 Cb 1.17 0.09 -0.12 0.00 -1.74 0.00 0.00 68.15 67.55 1i48 h THR 92 CO 0.40 0.03 0.53 0.77 0.37 0.00 0.00 175.52 177.61 1i48 h SER 93 N 0.16 0.57 -0.16 4.18 4.64 -1.99 0.17 113.55 121.13 1i48 h SER 93 Ca 0.55 0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 61.95 1i48 h SER 93 Cb 1.12 0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1i48 h SER 93 CO -0.70 0.09 -0.13 -0.33 -0.87 0.00 0.00 176.83 174.89 1i48 h GLU 94 N 0.54 0.36 -0.91 4.77 5.08 -0.55 -2.05 114.58 121.83 1i48 h GLU 94 Ca 0.61 -0.18 0.11 0.00 -1.00 0.00 0.00 59.36 58.90 1i48 h GLU 94 Cb 1.13 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 1i48 h GLU 94 CO -0.48 0.72 0.58 1.25 -1.00 0.00 0.00 179.01 180.08 1i48 h LEU 95 N 0.01 0.78 -0.10 1.33 5.85 -0.47 -0.82 115.31 121.89 1i48 h LEU 95 Ca 0.03 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1i48 h LEU 95 Cb 0.64 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 1i48 h LEU 95 CO 0.03 0.44 0.01 0.40 -0.34 0.00 0.00 178.44 178.98 1i48 h ILE 96 N 0.85 1.23 -0.23 4.05 2.04 -0.63 -1.28 117.51 123.55 1i48 h ILE 96 Ca 0.43 -0.71 0.06 0.00 1.00 0.00 0.00 64.86 65.64 1i48 h ILE 96 Cb 0.50 1.52 -0.07 0.00 -0.74 0.00 0.00 36.82 38.02 1i48 h ILE 96 CO -0.20 0.20 -0.27 0.44 0.00 0.00 0.00 178.15 178.32 1i48 h ASP 97 N -0.08 -0.87 0.01 1.72 5.19 -0.46 0.48 116.42 122.41 1i48 h ASP 97 Ca 0.03 0.15 0.02 0.00 -0.62 0.00 0.00 57.03 56.60 1i48 h ASP 97 Cb 0.30 0.40 -0.02 0.00 0.18 0.00 0.00 39.33 40.19 1i48 h ASP 97 CO 0.00 -0.31 -0.12 0.15 -3.12 0.00 0.00 179.24 175.85 1i48 h PHE 98 N -0.29 -0.30 -0.00 4.55 3.57 -1.16 0.50 116.94 123.80 1i48 h PHE 98 Ca 0.13 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1i48 h PHE 98 Cb 0.49 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.37 1i48 h PHE 98 CO -0.41 -0.18 0.00 0.87 -2.23 0.00 0.00 178.31 176.36 1i48 h LYS 99 N -0.21 0.00 -0.48 1.11 1.79 -0.65 0.40 116.57 118.53 1i48 h LYS 99 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1i48 h LYS 99 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1i48 h LYS 99 CO -0.11 0.00 0.00 0.39 -1.08 0.00 0.00 179.45 178.65 1i48 n GLU 100 N -4.28 2.18 -3.42 3.15 -0.58 0.16 -4.93 120.64 112.92 1i48 n GLU 100 Ca -0.03 -1.63 -0.17 0.00 -0.42 0.00 0.00 57.16 54.91 1i48 n GLU 100 Cb 0.09 -1.42 0.09 0.00 -0.57 0.00 0.00 31.44 29.63 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 0.75 -6.03 0.00 3.49 4.01 0.14 -4.92 118.16 115.60 1i48 n LYS 101 Ca 0.15 0.84 0.00 0.00 -0.51 0.00 0.00 58.31 58.79 1i48 n LYS 101 Cb 0.43 -5.83 0.00 0.00 -0.51 0.00 0.00 35.03 29.11 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 -4.03 5.21 -4.34 1.97 1.74 0.16 -4.98 116.66 112.39 1i48 n ARG 102 Ca -0.26 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.64 1i48 n ARG 102 Cb 0.66 -0.48 -0.10 0.00 -1.02 0.00 0.00 32.46 31.52 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 -0.94 1.42 -0.12 5.56 3.52 -1.23 -4.84 118.95 122.32 1i48 s ARG 103 Ca 0.00 -1.76 0.00 0.00 -0.13 0.00 0.00 55.73 53.84 1i48 s ARG 103 Cb 0.00 -0.46 -0.02 0.00 -1.56 0.00 0.00 34.95 32.91 1i48 s ARG 103 CO 0.00 -0.22 -0.12 0.00 -0.81 0.00 0.00 175.30 174.15 1i48 s ALA 104 N -3.59 2.70 -0.21 6.12 0.00 -1.26 -4.61 121.76 120.92 1i48 s ALA 104 Ca 0.35 -0.89 -0.31 0.00 0.00 0.00 0.00 51.96 51.10 1i48 s ALA 104 Cb 0.07 -1.22 0.15 0.00 0.00 0.00 0.00 23.12 22.13 1i48 s ALA 104 CO 0.12 0.32 1.18 0.45 0.00 0.00 0.00 175.76 177.83 1i48 s SER 105 N 0.10 -0.18 0.29 0.00 0.15 -1.26 -5.03 113.70 107.77 1i48 s SER 105 Ca -0.05 0.14 0.24 0.00 0.70 0.00 0.00 55.95 56.98 1i48 s SER 105 Cb -0.14 0.16 0.34 0.00 -1.71 0.00 0.00 66.02 64.66 1i48 s SER 105 CO 0.04 -0.21 1.45 -0.26 1.20 0.00 0.00 173.24 175.46 1i48 h PHE 106 N 2.19 0.00 0.00 3.44 0.04 -1.93 -3.47 116.94 117.21 1i48 h PHE 106 Ca -0.12 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.65 1i48 h PHE 106 Cb 1.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1i48 h PHE 106 CO 0.25 0.00 0.00 -1.91 -0.60 0.00 0.00 178.31 176.05 1i48 n GLU 107 N -2.69 0.00 -4.38 1.51 2.13 -1.26 -4.44 120.64 111.51 1i48 n GLU 107 Ca 0.03 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 57.61 1i48 n GLU 107 Cb 0.50 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 32.10 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 2.04 0.53 4.31 5.04 -1.26 -2.62 117.35 125.39 1i48 s TYR 108 Ca 0.00 -0.42 0.26 0.00 -2.44 0.00 0.00 57.07 54.48 1i48 s TYR 108 Cb 0.00 -1.00 1.60 0.00 0.35 0.00 0.00 41.96 42.91 1i48 s TYR 108 CO 0.00 0.42 2.18 0.78 -1.34 0.00 0.00 175.55 177.59 1i48 h GLY 109 N 3.15 0.00 2.00 8.97 0.00 -1.67 0.27 103.07 115.79 1i48 h GLY 109 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1i48 h GLY 109 CO 0.51 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 176.96 1i48 h ARG 110 N 0.00 0.00 -0.62 4.80 2.43 -1.91 -3.10 114.38 115.98 1i48 h ARG 110 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i48 h ARG 110 Cb 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1i48 h ARG 110 CO 0.01 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.13 1i48 n TYR 111 N -2.45 0.97 0.00 2.20 4.01 0.08 -4.75 117.16 117.23 1i48 n TYR 111 Ca 0.05 -0.44 0.00 0.00 -0.16 0.00 0.00 57.90 57.35 1i48 n TYR 111 Cb 0.42 -0.08 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 1.29 1.70 3.64 2.72 0.00 -1.17 -4.84 105.19 108.54 1i48 n GLY 112 Ca 0.21 -1.93 -0.05 0.00 0.00 0.00 0.00 46.02 44.25 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 -0.55 0.25 1.61 3.84 -1.26 -4.45 114.94 114.38 1i48 s ASN 113 Ca 0.00 0.92 -0.03 0.00 0.21 0.00 0.00 52.86 53.96 1i48 s ASN 113 Cb 0.00 1.14 0.49 0.00 -0.55 0.00 0.00 41.25 42.33 1i48 s ASN 113 CO 0.00 -0.15 1.75 1.55 -2.79 0.00 0.00 177.10 177.46 1i48 h PRO 114 N 5.66 0.51 -0.16 0.43 0.13 -1.97 0.28 132.00 136.89 1i48 h PRO 114 Ca -0.28 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.76 1i48 h PRO 114 Cb 1.19 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1i48 h PRO 114 CO 0.17 0.34 -0.16 0.00 -0.23 0.00 0.00 178.00 178.11 1i48 h THR 115 N 0.52 1.20 0.02 1.56 1.03 -1.89 -3.19 112.91 112.16 1i48 h THR 115 Ca 0.43 -0.89 -0.00 0.00 -0.01 0.00 0.00 66.41 65.94 1i48 h THR 115 Cb 0.63 1.26 0.00 0.00 -1.07 0.00 0.00 68.15 68.97 1i48 h THR 115 CO -0.38 0.28 -0.01 0.74 -0.01 0.00 0.00 175.52 176.14 1i48 h THR 116 N 0.25 1.50 -1.13 0.00 2.02 -0.93 -3.30 112.91 111.32 1i48 h THR 116 Ca 0.05 -1.77 0.32 0.00 0.77 0.00 0.00 66.41 65.77 1i48 h THR 116 Cb 0.44 2.66 -0.07 0.00 -1.74 0.00 0.00 68.15 69.44 1i48 h THR 116 CO 0.03 0.44 0.78 -0.37 0.37 0.00 0.00 175.52 176.77 1i48 h VAL 117 N -0.81 0.44 0.28 3.16 -1.51 -0.82 0.54 116.25 117.53 1i48 h VAL 117 Ca -0.00 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 65.41 1i48 h VAL 117 Cb 0.74 0.29 -0.00 0.00 -2.13 0.00 0.00 31.29 30.19 1i48 h VAL 117 CO 0.00 0.03 -0.18 0.58 -1.23 0.00 0.00 177.57 176.77 1i48 h VAL 118 N 0.14 0.00 -1.03 7.19 2.07 -1.63 0.46 116.25 123.45 1i48 h VAL 118 Ca 0.58 0.00 0.26 0.00 0.82 0.00 0.00 66.70 68.36 1i48 h VAL 118 Cb 1.99 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 31.67 1i48 h VAL 118 CO -0.12 0.00 0.66 0.25 0.02 0.00 0.00 177.57 178.37 1i48 h LEU 119 N -0.44 0.48 0.67 2.57 5.85 -1.19 0.46 115.31 123.72 1i48 h LEU 119 Ca -0.04 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 1i48 h LEU 119 Cb 0.35 0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.40 1i48 h LEU 119 CO 0.03 0.09 -0.32 -0.33 -0.34 0.00 0.00 178.44 177.57 1i48 h GLU 120 N 0.43 -0.86 -0.84 1.25 5.08 -0.29 -1.54 114.58 117.80 1i48 h GLU 120 Ca 0.60 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 59.02 1i48 h GLU 120 Cb 1.45 0.20 -0.04 0.00 0.50 0.00 0.00 28.75 30.86 1i48 h GLU 120 CO -0.32 -0.56 0.53 0.93 -1.00 0.00 0.00 179.01 178.59 1i48 h GLU 121 N -0.93 1.13 0.33 2.33 5.08 0.21 -1.24 114.58 121.48 1i48 h GLU 121 Ca -0.09 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1i48 h GLU 121 Cb 0.70 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1i48 h GLU 121 CO 0.15 0.77 -0.39 -0.22 -1.00 0.00 0.00 179.01 178.33 1i48 h LYS 122 N 1.15 -0.70 -0.67 2.33 3.64 0.01 -0.36 116.57 121.97 1i48 h LYS 122 Ca 0.31 0.05 0.11 0.00 -1.27 0.00 0.00 60.65 59.84 1i48 h LYS 122 Cb -0.09 0.16 -0.08 0.00 -0.41 0.00 0.00 32.23 31.81 1i48 h LYS 122 CO -0.06 -0.47 0.27 0.82 -2.27 0.00 0.00 179.45 177.74 1i48 h ILE 123 N -0.73 0.74 -0.42 2.00 2.04 -1.10 -0.91 117.51 119.13 1i48 h ILE 123 Ca -0.04 -0.15 0.09 0.00 1.00 0.00 0.00 64.86 65.75 1i48 h ILE 123 Cb 0.65 0.25 -0.08 0.00 -0.74 0.00 0.00 36.82 36.90 1i48 h ILE 123 CO -0.08 0.08 -0.13 0.28 0.00 0.00 0.00 178.15 178.30 1i48 h SER 124 N 0.44 -0.47 -0.12 1.72 0.02 -0.80 0.16 113.55 114.49 1i48 h SER 124 Ca 0.35 0.14 0.03 0.00 -0.84 0.00 0.00 61.79 61.47 1i48 h SER 124 Cb 0.46 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.26 1i48 h SER 124 CO -0.34 -0.17 -0.07 0.00 -1.14 0.00 0.00 176.83 175.11 1i48 h ALA 125 N 1.35 0.03 0.26 3.77 0.00 0.28 0.48 119.26 125.42 1i48 h ALA 125 Ca 0.20 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1i48 h ALA 125 Cb 0.35 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1i48 h ALA 125 CO -0.45 -0.53 -0.38 -0.07 0.00 0.00 0.00 179.25 177.82 1i48 h LEU 126 N -0.07 -1.06 0.00 0.00 3.38 -0.50 -0.36 115.31 116.69 1i48 h LEU 126 Ca 0.07 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1i48 h LEU 126 Cb 0.18 0.38 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1i48 h LEU 126 CO -0.17 -0.49 0.00 -0.62 0.09 0.00 0.00 178.44 177.25 1i48 n GLU 127 N -5.46 0.10 -3.49 1.13 -0.58 -0.05 -4.88 120.64 107.40 1i48 n GLU 127 Ca -0.09 0.18 -0.18 0.00 -0.42 0.00 0.00 57.16 56.66 1i48 n GLU 127 Cb 0.37 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.82 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 0.15 -0.37 3.89 0.62 0.00 0.15 -4.76 105.19 104.87 1i48 n GLY 128 Ca 0.06 0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.44 4.37 0.05 4.61 0.00 0.09 -4.92 121.76 122.52 1i48 s ALA 129 Ca 0.02 -1.32 -0.06 0.00 0.00 0.00 0.00 51.96 50.59 1i48 s ALA 129 Cb -0.00 -0.73 -0.30 0.00 0.00 0.00 0.00 23.12 22.09 1i48 s ALA 129 CO 0.75 -0.42 1.03 1.49 0.00 0.00 0.00 175.76 178.62 1i48 h GLU 130 N 0.80 0.32 -2.08 0.00 4.81 -1.84 -3.43 114.58 113.16 1i48 h GLU 130 Ca -0.37 -0.55 0.04 0.00 -0.13 0.00 0.00 59.36 58.35 1i48 h GLU 130 Cb 1.30 0.20 -0.18 0.00 0.63 0.00 0.00 28.75 30.70 1i48 h GLU 130 CO 0.58 1.24 0.40 0.45 -0.73 0.00 0.00 179.01 180.94 1i48 s SER 131 N -7.19 -0.47 0.09 1.04 0.15 -0.69 -4.77 113.70 101.86 1i48 s SER 131 Ca -0.06 0.31 0.05 0.00 0.70 0.00 0.00 55.95 56.95 1i48 s SER 131 Cb 0.06 0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 64.77 1i48 s SER 131 CO 0.89 -0.58 -0.14 -0.89 1.20 0.00 0.00 173.24 173.72 1i48 s THR 132 N -2.08 1.16 0.09 6.45 2.01 -1.26 -1.31 115.64 120.70 1i48 s THR 132 Ca -0.02 -1.45 0.09 0.00 0.31 0.00 0.00 61.69 60.62 1i48 s THR 132 Cb -0.01 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.24 1i48 s THR 132 CO -0.01 -0.31 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.16 1i48 s LEU 133 N -2.00 2.26 -0.13 4.42 2.96 0.27 -4.88 118.68 121.57 1i48 s LEU 133 Ca 0.02 -0.66 0.01 0.00 -0.22 0.00 0.00 54.13 53.28 1i48 s LEU 133 Cb -0.08 -1.05 0.02 0.00 0.50 0.00 0.00 46.19 45.58 1i48 s LEU 133 CO 0.02 0.14 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.29 1i48 s LEU 134 N -1.70 1.65 0.00 -0.68 1.43 -1.26 -0.94 118.68 117.17 1i48 s LEU 134 Ca 0.09 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 1i48 s LEU 134 Cb -0.10 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 45.01 1i48 s LEU 134 CO 0.04 -0.04 0.02 0.23 0.23 0.00 0.00 176.35 176.83 1i48 n MET 135 N 4.59 0.87 0.04 1.70 2.81 0.37 -4.29 117.12 123.21 1i48 n MET 135 Ca -0.17 -0.06 0.12 0.00 -1.81 0.00 0.00 57.70 55.78 1i48 n MET 135 Cb 0.50 -0.01 0.29 0.00 -0.71 0.00 0.00 33.22 33.30 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 -2.99 2.92 -3.63 3.04 0.00 -0.76 -3.38 120.51 115.70 1i48 n ALA 136 Ca -0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 53.44 53.18 1i48 n ALA 136 Cb 0.01 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 18.18 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 -3.75 -0.08 0.23 0.00 1.04 -1.26 -2.98 113.70 106.89 1i48 s SER 137 Ca 0.09 0.08 -0.12 0.00 0.48 0.00 0.00 55.95 56.48 1i48 s SER 137 Cb 0.15 0.07 0.29 0.00 0.10 0.00 0.00 66.02 66.63 1i48 s SER 137 CO 0.67 -0.08 1.61 1.23 0.98 0.00 0.00 173.24 177.65 1i48 h GLY 138 N 2.12 0.52 -0.30 7.32 0.00 -1.83 0.25 103.07 111.14 1i48 h GLY 138 Ca -0.09 0.24 0.12 0.00 0.00 0.00 0.00 47.33 47.59 1i48 h GLY 138 CO 0.23 -0.27 -0.22 -0.33 0.00 0.00 0.00 176.54 175.95 1i48 h MET 139 N -0.00 -0.07 0.11 4.80 2.86 -1.95 0.88 114.93 121.56 1i48 h MET 139 Ca 0.35 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 58.01 1i48 h MET 139 Cb 0.52 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.16 1i48 h MET 139 CO -0.74 -0.04 -0.38 0.00 1.06 0.00 0.00 176.91 176.80 1i48 n ALA 141 N -2.79 -0.07 -0.12 0.00 0.00 0.14 0.11 120.51 117.79 1i48 n ALA 141 Ca -0.07 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 1i48 n ALA 141 Cb 0.36 0.31 -0.05 0.00 0.00 0.00 0.00 19.45 20.07 1i48 n ALA 141 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1i48 h SER 142 N 0.00 -1.43 -0.67 0.00 4.64 -1.10 0.35 113.55 115.34 1i48 h SER 142 Ca 0.00 0.21 0.08 0.00 -0.47 0.00 0.00 61.79 61.61 1i48 h SER 142 Cb 0.00 0.62 -0.10 0.00 -0.31 0.00 0.00 62.40 62.61 1i48 h SER 142 CO 0.00 -0.37 -0.54 0.74 -0.87 0.00 0.00 176.83 175.79 1i48 h THR 143 N -0.34 0.02 0.43 2.95 2.02 -0.20 -0.07 112.91 117.71 1i48 h THR 143 Ca 0.13 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.29 1i48 h THR 143 Cb 0.59 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1i48 h THR 143 CO -0.56 0.00 -0.25 0.58 0.37 0.00 0.00 175.52 175.66 1i48 h VAL 144 N -0.21 0.00 -0.76 3.16 2.07 0.17 -2.73 116.25 117.94 1i48 h VAL 144 Ca 0.14 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.96 1i48 h VAL 144 Cb 0.53 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.16 1i48 h VAL 144 CO -0.75 0.00 0.36 0.80 0.02 0.00 0.00 177.57 178.00 1i48 n MET 145 N -3.87 -0.05 0.15 1.57 0.00 0.11 -0.41 117.12 114.62 1i48 n MET 145 Ca -0.08 1.07 -0.06 0.00 0.00 0.00 0.00 57.70 58.63 1i48 n MET 145 Cb 0.26 -1.88 -0.03 0.00 0.00 0.00 0.00 33.22 31.57 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 -0.33 -2.00 -0.89 3.38 -0.72 -1.49 115.31 113.26 1i48 h LEU 146 Ca 0.63 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.64 1i48 h LEU 146 Cb 1.62 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 1i48 h LEU 146 CO -0.61 -0.20 0.36 -0.07 0.09 0.00 0.00 178.44 178.01 1i48 h LEU 147 N -0.45 0.00 0.02 1.67 3.38 -0.66 -0.30 115.31 118.97 1i48 h LEU 147 Ca -0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1i48 h LEU 147 Cb 0.30 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.06 1i48 h LEU 147 CO 0.07 0.00 -0.29 0.00 0.09 0.00 0.00 178.44 178.30 1i48 h ALA 148 N 1.39 0.01 0.06 1.53 0.00 -0.52 -3.41 119.26 118.32 1i48 h ALA 148 Ca 0.06 -0.51 -0.34 0.00 0.00 0.00 0.00 54.91 54.11 1i48 h ALA 148 Cb 0.78 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1i48 h ALA 148 CO -0.00 0.12 -1.92 1.28 0.00 0.00 0.00 179.25 178.73 1i48 n LEU 149 N -4.46 2.40 -4.66 0.00 4.77 -0.58 -4.88 117.00 109.59 1i48 n LEU 149 Ca -0.10 0.23 -0.43 0.00 -0.03 0.00 0.00 56.01 55.68 1i48 n LEU 149 Cb 0.55 -1.02 -0.02 0.00 -2.33 0.00 0.00 43.42 40.60 1i48 n LEU 149 CO 0.40 0.67 1.25 -0.69 -1.33 0.00 0.00 177.39 177.70 1i48 s VAL 150 N -2.49 3.88 1.01 4.08 1.01 -0.20 -5.01 120.40 122.68 1i48 s VAL 150 Ca -0.28 1.05 -0.15 0.00 0.00 0.00 0.00 61.98 62.60 1i48 s VAL 150 Cb 0.08 -3.71 0.20 0.00 0.00 0.00 0.00 36.38 32.95 1i48 s VAL 150 CO 0.66 -0.12 1.18 -2.84 0.00 0.00 0.00 175.10 173.98 1i48 s PRO 151 N 3.90 0.30 0.37 2.72 0.02 -1.26 -4.73 135.00 136.31 1i48 s PRO 151 Ca 0.66 -0.01 -0.27 0.00 0.02 0.00 0.00 61.00 61.40 1i48 s PRO 151 Cb -0.28 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.39 1i48 s PRO 151 CO 0.24 -2.71 1.21 0.00 -0.33 0.00 0.00 177.00 175.41 1i48 s ALA 152 N -3.37 3.28 0.00 -1.55 0.00 -1.26 -2.15 121.76 116.71 1i48 s ALA 152 Ca 0.69 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.72 1i48 s ALA 152 Cb -0.10 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1i48 s ALA 152 CO 0.54 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1i48 n GLY 153 N 0.75 0.34 3.60 0.00 0.00 -0.50 -4.94 105.19 104.44 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 1.56 0.04 -0.02 0.00 -0.91 -4.62 107.32 101.37 1i48 s GLY 154 Ca 0.00 -0.75 0.06 0.00 0.00 0.00 0.00 44.72 44.04 1i48 s GLY 154 CO 0.00 0.06 -0.18 -1.58 0.00 0.00 0.00 173.10 171.40 1i48 s HIS 155 N -2.93 1.61 0.02 1.90 5.65 -1.26 -1.35 115.29 118.94 1i48 s HIS 155 Ca 0.69 -0.36 0.01 0.00 0.25 0.00 0.00 55.06 55.65 1i48 s HIS 155 Cb -0.13 -0.97 -0.02 0.00 -1.18 0.00 0.00 32.58 30.28 1i48 s HIS 155 CO 0.57 0.06 -0.04 -1.50 -0.65 0.00 0.00 174.74 173.18 1i48 s ILE 156 N -0.77 0.23 -0.02 0.89 2.07 -0.72 0.19 121.20 123.06 1i48 s ILE 156 Ca 0.06 -0.89 0.06 0.00 -1.41 0.00 0.00 60.65 58.46 1i48 s ILE 156 Cb -0.08 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 42.14 1i48 s ILE 156 CO 0.01 -0.43 -0.19 -0.69 -1.91 0.00 0.00 174.94 171.74 1i48 s VAL 157 N -1.33 2.68 0.04 4.00 1.01 -0.14 -1.35 120.40 125.30 1i48 s VAL 157 Ca -0.13 -0.96 -0.16 0.00 0.00 0.00 0.00 61.98 60.73 1i48 s VAL 157 Cb -0.09 -2.04 0.03 0.00 0.00 0.00 0.00 36.38 34.28 1i48 s VAL 157 CO -0.01 0.53 0.35 0.28 0.00 0.00 0.00 175.10 176.26 1i48 s THR 158 N -0.74 0.07 0.71 3.92 -1.32 -0.72 0.10 115.64 117.67 1i48 s THR 158 Ca 0.12 -0.57 -0.11 0.00 -1.21 0.00 0.00 61.69 59.92 1i48 s THR 158 Cb -0.10 -0.93 0.02 0.00 -1.51 0.00 0.00 72.50 69.98 1i48 s THR 158 CO 0.01 -0.31 1.07 0.42 -2.21 0.00 0.00 174.62 173.60 1i48 s THR 159 N -2.46 3.75 0.04 5.08 -4.23 -1.24 -1.73 115.64 114.86 1i48 s THR 159 Ca -0.06 0.59 -0.24 0.00 -1.18 0.00 0.00 61.69 60.81 1i48 s THR 159 Cb -0.01 -3.22 -0.17 0.00 1.34 0.00 0.00 72.50 70.43 1i48 s THR 159 CO -0.02 -0.72 1.54 0.71 -0.54 0.00 0.00 174.62 175.59 1i48 h THR 160 N -0.75 1.16 -2.66 3.99 1.35 -0.72 -3.40 112.91 111.88 1i48 h THR 160 Ca -0.44 -0.48 -0.58 0.00 -0.55 0.00 0.00 66.41 64.36 1i48 h THR 160 Cb 1.22 1.49 -0.03 0.00 -1.73 0.00 0.00 68.15 69.10 1i48 h THR 160 CO 0.55 0.12 1.28 -1.81 -0.25 0.00 0.00 175.52 175.41 1i48 s ASP 161 N -5.40 5.90 0.19 5.36 1.11 -1.26 -4.95 116.67 117.63 1i48 s ASP 161 Ca -0.14 1.34 -0.01 0.00 0.18 0.00 0.00 52.55 53.92 1i48 s ASP 161 Cb 0.04 -2.53 -0.04 0.00 1.07 0.00 0.00 42.92 41.47 1i48 s ASP 161 CO 0.67 -1.69 0.11 0.00 1.18 0.00 0.00 175.17 175.43 1i48 s TYR 163 N -4.11 3.03 0.01 0.00 5.04 -1.26 -4.85 117.35 115.21 1i48 s TYR 163 Ca 0.36 1.14 -0.02 0.00 -2.44 0.00 0.00 57.07 56.10 1i48 s TYR 163 Cb 0.07 -3.64 -0.00 0.00 0.35 0.00 0.00 41.96 38.74 1i48 s TYR 163 CO 0.10 -1.09 0.20 -2.13 -1.34 0.00 0.00 175.55 171.28 1i48 n ARG 164 N 6.83 -0.03 0.20 4.97 3.00 -1.26 0.26 116.66 130.64 1i48 n ARG 164 Ca 0.13 0.19 -0.17 0.00 -0.00 0.00 0.00 57.85 58.00 1i48 n ARG 164 Cb 0.46 -0.29 -0.10 0.00 0.00 0.00 0.00 32.46 32.54 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 -0.84 -1.22 -0.14 6.56 -1.98 -1.44 116.57 117.51 1i48 h LYS 165 Ca 0.01 0.06 0.37 0.00 -1.06 0.00 0.00 60.65 60.03 1i48 h LYS 165 Cb 0.03 0.19 -0.11 0.00 -0.57 0.00 0.00 32.23 31.76 1i48 h LYS 165 CO -0.06 -0.56 0.79 1.15 -2.06 0.00 0.00 179.45 178.71 1i48 h THR 166 N -0.87 0.27 0.54 -0.16 2.02 -0.58 0.09 112.91 114.23 1i48 h THR 166 Ca -0.03 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 1i48 h THR 166 Cb 0.81 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1i48 h THR 166 CO -0.17 0.03 -0.29 -0.09 0.37 0.00 0.00 175.52 175.37 1i48 h ARG 167 N 0.19 -0.73 -0.69 6.66 2.43 -0.08 -3.03 114.38 119.12 1i48 h ARG 167 Ca 0.73 0.05 0.12 0.00 -0.81 0.00 0.00 59.98 60.07 1i48 h ARG 167 Cb 2.19 0.17 -0.13 0.00 -0.42 0.00 0.00 29.97 31.78 1i48 h ARG 167 CO -0.36 -0.49 -0.33 0.82 -1.51 0.00 0.00 179.97 178.10 1i48 h ILE 168 N -0.76 0.14 -0.85 1.20 2.04 -0.66 0.65 117.51 119.26 1i48 h ILE 168 Ca -0.07 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.00 1i48 h ILE 168 Cb 0.59 0.14 -0.13 0.00 -0.74 0.00 0.00 36.82 36.68 1i48 h ILE 168 CO 0.11 0.00 0.27 0.15 0.00 0.00 0.00 178.15 178.67 1i48 h PHE 169 N -0.11 0.42 -0.11 1.37 3.57 -1.45 0.56 116.94 121.19 1i48 h PHE 169 Ca 0.27 0.05 -0.18 0.00 3.53 0.00 0.00 57.97 61.64 1i48 h PHE 169 Cb 0.56 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 1i48 h PHE 169 CO -0.69 -0.13 -0.67 0.82 -2.23 0.00 0.00 178.31 175.41 1i48 h ILE 170 N 0.28 1.36 -0.00 1.41 2.04 -0.83 0.06 117.51 121.83 1i48 h ILE 170 Ca 0.52 -2.02 0.00 0.00 1.00 0.00 0.00 64.86 64.36 1i48 h ILE 170 Cb 0.99 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.07 1i48 h ILE 170 CO -0.58 0.61 -0.22 -0.62 0.00 0.00 0.00 178.15 177.35 1i48 n GLU 171 N -3.88 0.21 0.00 2.37 1.02 0.50 -4.21 120.64 116.65 1i48 n GLU 171 Ca -0.04 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1i48 n GLU 171 Cb 0.67 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 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 -1.33 0.00 -0.10 2.62 -2.24 0.17 -4.85 114.28 108.54 1i48 n THR 172 Ca 0.09 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.71 1i48 n THR 172 Cb 0.32 -0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.26 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 -0.92 1.50 -0.32 2.28 2.08 -0.04 -4.42 119.36 119.52 1i48 n ILE 173 Ca 0.00 -0.01 0.13 0.00 0.56 0.00 0.00 62.75 63.43 1i48 n ILE 173 Cb 0.14 -2.20 0.31 0.00 -0.75 0.00 0.00 39.64 37.15 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 0.48 -1.58 1.39 3.38 -1.61 0.19 115.31 116.57 1i48 h LEU 174 Ca -0.23 0.13 0.16 0.00 0.09 0.00 0.00 57.88 58.03 1i48 h LEU 174 Cb 1.11 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 1i48 h LEU 174 CO -0.14 0.08 0.52 1.55 0.09 0.00 0.00 178.44 180.54 1i48 h PRO 175 N 0.51 0.40 -0.96 1.13 0.13 -1.73 0.12 132.00 131.59 1i48 h PRO 175 Ca 0.57 -0.02 0.11 0.00 -0.87 0.00 0.00 66.00 65.78 1i48 h PRO 175 Cb 1.02 -0.09 -0.08 0.00 0.13 0.00 0.00 31.00 31.99 1i48 h PRO 175 CO -0.48 0.26 0.61 0.87 -0.23 0.00 0.00 178.00 179.04 1i48 h LYS 176 N 0.41 0.93 -0.68 0.86 1.57 -0.82 0.72 116.57 119.56 1i48 h LYS 176 Ca 0.38 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1i48 h LYS 176 Cb 0.90 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1i48 h LYS 176 CO -0.12 0.62 0.00 -1.33 -0.57 0.00 0.00 179.45 178.04 1i48 n MET 177 N -4.57 2.03 -1.52 3.15 2.81 0.33 -4.84 117.12 114.50 1i48 n MET 177 Ca 0.17 -0.95 -0.16 0.00 -1.81 0.00 0.00 57.70 54.95 1i48 n MET 177 Cb 0.33 -1.58 -0.06 0.00 -0.71 0.00 0.00 33.22 31.20 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 0.40 1.49 3.58 3.03 0.00 0.25 -1.41 105.19 112.53 1i48 n GLY 178 Ca 0.09 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.61 4.78 0.20 -0.61 1.01 -0.69 -2.77 121.20 120.50 1i48 s ILE 179 Ca 0.00 0.80 -0.02 0.00 0.00 0.00 0.00 60.65 61.43 1i48 s ILE 179 Cb 0.00 -4.17 -0.05 0.00 0.01 0.00 0.00 42.46 38.25 1i48 s ILE 179 CO 0.00 -0.39 0.41 0.28 0.00 0.00 0.00 174.94 175.24 1i48 s THR 180 N 2.98 5.17 0.09 2.92 -1.32 -0.46 -3.61 115.64 121.41 1i48 s THR 180 Ca 0.29 -0.21 -0.04 0.00 -1.21 0.00 0.00 61.69 60.52 1i48 s THR 180 Cb -0.14 -3.71 -0.03 0.00 -1.51 0.00 0.00 72.50 67.12 1i48 s THR 180 CO 0.16 -0.15 0.07 0.00 -2.21 0.00 0.00 174.62 172.50 1i48 s ALA 181 N -1.85 0.33 -0.09 11.08 0.00 -1.26 -1.76 121.76 128.21 1i48 s ALA 181 Ca 0.40 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 51.32 1i48 s ALA 181 Cb -0.11 0.49 0.00 0.00 0.00 0.00 0.00 23.12 23.50 1i48 s ALA 181 CO 0.28 -0.45 -0.20 0.99 0.00 0.00 0.00 175.76 176.38 1i48 s THR 182 N -3.93 1.73 -0.23 0.00 2.01 -0.46 -4.94 115.64 109.81 1i48 s THR 182 Ca 0.10 -0.83 -0.10 0.00 0.31 0.00 0.00 61.69 61.18 1i48 s THR 182 Cb 0.07 -1.52 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 1i48 s THR 182 CO -0.07 0.49 0.15 -0.69 -0.69 0.00 0.00 174.62 173.80 1i48 s VAL 183 N 0.45 5.27 0.19 3.82 1.01 -1.26 -1.75 120.40 128.13 1i48 s VAL 183 Ca -0.17 0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1i48 s VAL 183 Cb -0.17 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.71 1i48 s VAL 183 CO 0.07 0.36 -0.01 0.27 0.00 0.00 0.00 175.10 175.79 1i48 s ILE 184 N 1.00 0.87 0.35 2.22 -4.36 -0.70 -4.87 121.20 115.70 1i48 s ILE 184 Ca 0.07 -2.01 -0.27 0.00 -0.26 0.00 0.00 60.65 58.18 1i48 s ILE 184 Cb -0.13 -2.17 -0.09 0.00 1.25 0.00 0.00 42.46 41.32 1i48 s ILE 184 CO 0.04 -0.45 1.13 -0.62 0.24 0.00 0.00 174.94 175.27 1i48 s ASP 185 N -3.22 6.90 0.43 4.36 2.15 -1.26 0.05 116.67 126.07 1i48 s ASP 185 Ca 0.25 2.28 0.18 0.00 0.43 0.00 0.00 52.55 55.69 1i48 s ASP 185 Cb 0.05 -2.62 1.12 0.00 -0.30 0.00 0.00 42.92 41.17 1i48 s ASP 185 CO 0.05 -0.41 1.87 -0.65 -0.17 0.00 0.00 175.17 175.87 1i48 h PRO 186 N 3.15 0.36 0.12 4.34 0.11 -1.94 -2.68 132.00 135.45 1i48 h PRO 186 Ca -0.48 -0.02 -0.30 0.00 0.11 0.00 0.00 66.00 65.31 1i48 h PRO 186 Cb 1.22 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1i48 h PRO 186 CO 0.64 0.24 -1.59 0.00 -0.21 0.00 0.00 178.00 177.08 1i48 h ALA 187 N 1.62 0.25 -0.05 -0.75 0.00 -1.91 -3.44 119.26 114.98 1i48 h ALA 187 Ca 0.44 -1.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.16 1i48 h ALA 187 Cb 1.15 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 19.50 1i48 h ALA 187 CO -0.15 0.96 0.55 -3.47 0.00 0.00 0.00 179.25 177.14 1i48 n ASP 188 N -3.82 -0.38 0.19 0.00 -0.08 -1.01 -4.64 116.55 106.81 1i48 n ASP 188 Ca -0.27 -1.88 0.03 0.00 -1.51 0.00 0.00 54.79 51.16 1i48 n ASP 188 Cb 0.94 -1.14 0.38 0.00 2.34 0.00 0.00 41.12 43.63 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 6.88 1.20 0.45 5.18 2.07 -1.86 -3.07 116.25 127.10 1i48 h VAL 189 Ca 0.00 -1.27 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 1i48 h VAL 189 Cb 1.00 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 1i48 h VAL 189 CO 1.02 0.36 -0.42 1.23 0.02 0.00 0.00 177.57 179.77 1i48 h GLY 190 N 1.18 -1.17 -0.67 2.17 0.00 -1.97 0.46 103.07 103.06 1i48 h GLY 190 Ca -0.00 0.53 0.16 0.00 0.00 0.00 0.00 47.33 48.02 1i48 h GLY 190 CO 0.05 -0.36 -0.25 0.00 0.00 0.00 0.00 176.54 175.98 1i48 h ALA 191 N -1.09 0.43 0.24 3.60 0.00 -1.93 0.81 119.26 121.31 1i48 h ALA 191 Ca -0.06 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1i48 h ALA 191 Cb 0.73 0.70 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1i48 h ALA 191 CO -0.04 -0.46 -0.27 1.25 0.00 0.00 0.00 179.25 179.74 1i48 h LEU 192 N -0.02 -0.72 -0.86 0.00 5.85 -1.42 0.51 115.31 118.65 1i48 h LEU 192 Ca 0.37 0.07 0.06 0.00 0.84 0.00 0.00 57.88 59.22 1i48 h LEU 192 Cb 0.60 0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.82 1i48 h LEU 192 CO -0.85 -0.38 0.53 -0.08 -0.34 0.00 0.00 178.44 177.32 1i48 h GLU 193 N -0.55 0.95 0.30 1.25 4.81 0.13 0.35 114.58 121.83 1i48 h GLU 193 Ca -0.00 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1i48 h GLU 193 Cb 0.52 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1i48 h GLU 193 CO -0.07 0.63 -0.17 1.25 -0.73 0.00 0.00 179.01 179.92 1i48 h LEU 194 N 0.98 -0.41 -1.30 1.64 5.85 0.13 -2.69 115.31 119.51 1i48 h LEU 194 Ca 0.37 0.02 0.26 0.00 0.84 0.00 0.00 57.88 59.36 1i48 h LEU 194 Cb 0.15 0.11 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 1i48 h LEU 194 CO -0.17 -0.27 0.65 0.00 -0.34 0.00 0.00 178.44 178.32 1i48 h ALA 195 N -1.72 2.14 -0.42 1.25 0.00 0.18 0.65 119.26 121.34 1i48 h ALA 195 Ca -0.04 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.06 1i48 h ALA 195 Cb 0.34 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1i48 h ALA 195 CO 0.06 -0.54 0.36 1.25 0.00 0.00 0.00 179.25 180.38 1i48 h LEU 196 N 0.44 0.00 0.02 0.00 7.12 0.02 -2.65 115.31 120.27 1i48 h LEU 196 Ca 0.59 0.00 -0.39 0.00 0.13 0.00 0.00 57.88 58.21 1i48 h LEU 196 Cb 1.41 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 41.49 1i48 h LEU 196 CO -0.32 0.00 -2.27 0.59 -0.13 0.00 0.00 178.44 176.31 1i48 n ASN 197 N -4.04 1.99 0.00 1.25 3.02 0.22 -4.65 115.26 113.04 1i48 n ASN 197 Ca 0.07 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 1i48 n ASN 197 Cb 0.55 -0.68 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 1i48 n ASN 197 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i48 n GLN 198 N -3.73 0.00 -2.62 3.52 6.02 -0.56 -4.77 117.38 115.23 1i48 n GLN 198 Ca -0.45 0.71 -0.17 0.00 -0.01 0.00 0.00 57.00 57.08 1i48 n GLN 198 Cb 0.93 -1.44 0.06 0.00 1.02 0.00 0.00 30.24 30.82 1i48 n GLN 198 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1i48 n LYS 199 N -2.32 0.56 -3.47 -1.09 4.01 -1.03 -5.06 118.16 109.75 1i48 n LYS 199 Ca 0.00 -2.62 -0.43 0.00 -0.51 0.00 0.00 58.31 54.76 1i48 n LYS 199 Cb 0.00 -0.26 -0.04 0.00 -0.51 0.00 0.00 35.03 34.21 1i48 n LYS 199 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1i48 s LYS 200 N -4.32 3.37 0.22 1.97 2.36 -1.26 -4.69 119.74 117.38 1i48 s LYS 200 Ca 0.53 -2.69 -0.30 0.00 -2.55 0.00 0.00 55.97 50.96 1i48 s LYS 200 Cb -0.04 -4.20 -0.10 0.00 -1.05 0.00 0.00 37.83 32.44 1i48 s LYS 200 CO 0.34 -1.25 1.44 0.08 1.55 0.00 0.00 175.35 177.51 1i48 s VAL 201 N -0.28 2.77 -0.11 4.02 1.01 -1.26 -4.30 120.40 122.25 1i48 s VAL 201 Ca 0.21 0.62 -0.02 0.00 0.00 0.00 0.00 61.98 62.78 1i48 s VAL 201 Cb -0.13 -3.40 -0.25 0.00 0.00 0.00 0.00 36.38 32.61 1i48 s VAL 201 CO -0.08 0.08 0.39 0.59 0.00 0.00 0.00 175.10 176.09 1i48 n ASN 202 N 2.82 1.86 -3.63 3.32 4.13 0.13 -4.25 115.26 119.64 1i48 n ASN 202 Ca 0.08 0.23 -0.13 0.00 1.68 0.00 0.00 54.58 56.44 1i48 n ASN 202 Cb 0.40 -0.67 -0.07 0.00 -1.54 0.00 0.00 39.78 37.91 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 -6.82 -0.67 -0.27 3.41 0.20 -1.22 -1.72 118.68 111.59 1i48 s LEU 203 Ca -0.19 1.27 -0.09 0.00 0.69 0.00 0.00 54.13 55.81 1i48 s LEU 203 Cb 0.07 2.34 -0.03 0.00 -0.43 0.00 0.00 46.19 48.14 1i48 s LEU 203 CO 0.77 -0.25 0.11 0.12 -0.29 0.00 0.00 176.35 176.82 1i48 s PHE 204 N 0.24 3.13 -0.09 5.38 5.36 0.48 -0.97 117.98 131.51 1i48 s PHE 204 Ca 0.00 -0.32 0.04 0.00 -0.96 0.00 0.00 56.93 55.69 1i48 s PHE 204 Cb -0.05 -2.29 -0.00 0.00 -0.34 0.00 0.00 43.02 40.34 1i48 s PHE 204 CO -0.00 -0.33 -0.23 0.12 -1.46 0.00 0.00 175.22 173.32 1i48 s PHE 205 N 1.65 2.55 -0.05 10.12 5.36 0.28 -1.31 117.98 136.59 1i48 s PHE 205 Ca 0.06 -0.95 -0.29 0.00 -0.96 0.00 0.00 56.93 54.79 1i48 s PHE 205 Cb -0.16 -1.70 0.10 0.00 -0.34 0.00 0.00 43.02 40.93 1i48 s PHE 205 CO 0.06 -0.36 0.88 -0.08 -1.46 0.00 0.00 175.22 174.26 1i48 s THR 206 N 0.23 0.00 -0.00 0.12 -1.32 -0.81 -3.65 115.64 110.20 1i48 s THR 206 Ca -0.15 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.35 1i48 s THR 206 Cb -0.17 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.79 1i48 s THR 206 CO 0.08 0.00 -0.01 -1.83 -2.21 0.00 0.00 174.62 170.64 1i48 s GLU 207 N -2.35 2.75 -0.16 7.08 1.03 -1.26 -1.34 118.70 124.45 1i48 s GLU 207 Ca 0.01 -0.62 -0.06 0.00 0.03 0.00 0.00 54.97 54.33 1i48 s GLU 207 Cb -0.01 -2.64 0.07 0.00 -0.80 0.00 0.00 34.13 30.76 1i48 s GLU 207 CO -0.04 0.62 0.34 0.45 -1.33 0.00 0.00 175.26 175.30 1i48 s SER 208 N -1.51 0.02 0.80 0.83 0.15 -1.20 -3.44 113.70 109.35 1i48 s SER 208 Ca 0.19 0.78 -0.14 0.00 0.70 0.00 0.00 55.95 57.48 1i48 s SER 208 Cb -0.11 0.98 0.05 0.00 -1.71 0.00 0.00 66.02 65.23 1i48 s SER 208 CO 0.09 -0.23 0.99 -2.65 1.20 0.00 0.00 173.24 172.64 1i48 n PRO 209 N 5.27 0.18 -2.48 5.44 -0.02 -1.26 -4.53 135.00 137.60 1i48 n PRO 209 Ca -0.09 0.13 -0.25 0.00 -2.02 0.00 0.00 63.50 61.27 1i48 n PRO 209 Cb 0.50 -2.26 0.13 0.00 -0.02 0.00 0.00 33.50 31.85 1i48 n PRO 209 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1i48 s THR 210 N -2.09 2.07 -0.03 3.45 -1.32 0.19 -4.69 115.64 113.24 1i48 s THR 210 Ca 0.70 -0.49 0.04 0.00 -1.21 0.00 0.00 61.69 60.73 1i48 s THR 210 Cb -0.30 -2.58 -0.01 0.00 -1.51 0.00 0.00 72.50 68.10 1i48 s THR 210 CO 0.54 0.00 -0.15 0.21 -2.21 0.00 0.00 174.62 173.00 1i48 s ASN 211 N -4.79 1.86 -0.07 8.08 3.04 -1.26 -1.39 114.94 120.41 1i48 s ASN 211 Ca 0.68 -0.29 0.17 0.00 0.04 0.00 0.00 52.86 53.46 1i48 s ASN 211 Cb -0.05 -0.37 0.59 0.00 -1.54 0.00 0.00 41.25 39.89 1i48 s ASN 211 CO 0.46 0.16 1.51 -0.81 -3.04 0.00 0.00 177.10 175.38 1i48 n PRO 212 N 2.95 3.24 -0.29 0.43 -0.04 -1.26 -4.00 135.00 136.03 1i48 n PRO 212 Ca -0.16 -2.65 0.09 0.00 -0.04 0.00 0.00 63.50 60.74 1i48 n PRO 212 Cb 0.54 -1.68 0.26 0.00 -0.04 0.00 0.00 33.50 32.58 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 0.95 0.76 -2.32 0.54 3.72 -1.26 -4.57 117.46 115.28 1i48 n PHE 213 Ca 0.22 -0.38 -0.05 0.00 -0.05 0.00 0.00 57.45 57.18 1i48 n PHE 213 Cb 0.73 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.26 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 1.21 -0.49 -4.76 4.37 4.32 -0.48 -4.76 117.00 116.40 1i48 n LEU 214 Ca 0.19 0.34 -0.41 0.00 -0.02 0.00 0.00 56.01 56.11 1i48 n LEU 214 Cb 0.49 -1.46 -0.00 0.00 -1.62 0.00 0.00 43.42 40.83 1i48 n LEU 214 CO 0.13 -0.08 1.08 0.54 -1.22 0.00 0.00 177.39 177.84 1i48 n ARG 215 N -2.49 2.54 -4.20 3.23 5.12 -1.26 -3.88 116.66 115.72 1i48 n ARG 215 Ca -0.06 0.89 -0.28 0.00 -1.93 0.00 0.00 57.85 56.47 1i48 n ARG 215 Cb 0.51 -2.58 -0.08 0.00 -1.16 0.00 0.00 32.46 29.14 1i48 n ARG 215 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1i48 s VAL 217 N -1.60 2.78 -1.15 0.00 1.01 -1.26 -4.70 120.40 115.48 1i48 s VAL 217 Ca 0.26 -0.77 -0.23 0.00 0.00 0.00 0.00 61.98 61.24 1i48 s VAL 217 Cb -0.10 -2.13 -0.10 0.00 0.00 0.00 0.00 36.38 34.04 1i48 s VAL 217 CO 0.18 0.54 1.94 -0.67 0.00 0.00 0.00 175.10 177.09 1i48 n ASP 218 N 3.38 2.92 -0.15 3.32 -0.08 -1.26 -4.80 116.55 119.88 1i48 n ASP 218 Ca -0.18 -2.68 -0.04 0.00 -1.51 0.00 0.00 54.79 50.38 1i48 n ASP 218 Cb 0.53 -1.70 -0.04 0.00 2.34 0.00 0.00 41.12 42.25 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 7.79 -0.25 -0.32 5.18 -0.00 -1.26 -1.32 119.36 129.18 1i48 n ILE 219 Ca 0.45 1.82 -0.00 0.00 -0.00 0.00 0.00 62.75 65.02 1i48 n ILE 219 Cb 0.46 -2.35 0.04 0.00 -0.00 0.00 0.00 39.64 37.80 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 -3.81 -0.18 0.50 0.38 2.13 -1.20 0.52 120.64 118.97 1i48 n GLU 220 Ca 0.01 1.28 -0.19 0.00 0.66 0.00 0.00 57.16 58.91 1i48 n GLU 220 Cb 0.09 -1.90 -0.09 0.00 0.27 0.00 0.00 31.44 29.81 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 -1.08 -0.41 4.31 5.85 -1.51 -2.56 115.31 119.92 1i48 h LEU 221 Ca 0.30 0.04 0.08 0.00 0.84 0.00 0.00 57.88 59.14 1i48 h LEU 221 Cb 0.51 0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.73 1i48 h LEU 221 CO -0.83 -0.76 -0.16 0.58 -0.34 0.00 0.00 178.44 176.94 1i48 h VAL 222 N -1.29 0.49 -0.74 1.05 2.07 0.20 -0.07 116.25 117.95 1i48 h VAL 222 Ca -0.13 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.55 1i48 h VAL 222 Cb 0.97 0.49 -0.11 0.00 -1.52 0.00 0.00 31.29 31.12 1i48 h VAL 222 CO 0.21 0.00 0.16 0.28 0.02 0.00 0.00 177.57 178.24 1i48 h SER 223 N -0.07 -0.04 0.64 0.57 0.02 0.07 0.10 113.55 114.85 1i48 h SER 223 Ca 0.20 0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 61.28 1i48 h SER 223 Cb 0.38 0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1i48 h SER 223 CO -0.46 -0.06 -0.37 0.50 -1.14 0.00 0.00 176.83 175.30 1i48 h LYS 224 N 0.24 -0.90 -0.82 3.45 3.64 -0.62 0.20 116.57 121.76 1i48 h LYS 224 Ca 0.42 0.06 0.20 0.00 -1.27 0.00 0.00 60.65 60.06 1i48 h LYS 224 Cb 0.73 0.20 -0.13 0.00 -0.41 0.00 0.00 32.23 32.63 1i48 h LYS 224 CO -0.54 -0.60 0.21 -0.07 -2.27 0.00 0.00 179.45 176.19 1i48 h LEU 225 N -0.94 0.01 0.40 5.20 3.38 -0.54 -0.58 115.31 122.25 1i48 h LEU 225 Ca -0.09 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1i48 h LEU 225 Cb 0.74 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1i48 h LEU 225 CO 0.10 -0.10 -0.19 0.00 0.09 0.00 0.00 178.44 178.34 1i48 h HIS 227 N -0.96 0.00 -0.22 0.00 3.86 -0.11 0.46 115.15 118.18 1i48 h HIS 227 Ca -0.06 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.05 1i48 h HIS 227 Cb 0.55 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 1i48 h HIS 227 CO 0.02 0.00 -0.30 1.49 0.86 0.00 0.00 177.93 180.00 1i48 h GLU 228 N 0.00 0.44 -0.53 2.45 4.81 -1.02 -2.76 114.58 117.98 1i48 h GLU 228 Ca 0.17 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1i48 h GLU 228 Cb 1.05 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1i48 h GLU 228 CO -0.00 0.70 0.00 1.63 -0.73 0.00 0.00 179.01 180.61 1i48 n LYS 229 N -4.09 4.19 -0.85 1.92 4.76 0.15 -4.93 118.16 119.31 1i48 n LYS 229 Ca -0.01 -3.01 0.00 0.00 -2.87 0.00 0.00 58.31 52.42 1i48 n LYS 229 Cb 0.43 -2.07 0.00 0.00 -1.84 0.00 0.00 35.03 31.55 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 0.53 0.45 3.80 0.72 0.00 -0.83 -4.86 105.19 105.00 1i48 n GLY 230 Ca 0.26 0.00 -0.32 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 -2.26 2.64 -0.04 4.61 0.00 -0.78 -4.93 121.76 121.01 1i48 s ALA 231 Ca 0.00 0.29 -0.03 0.00 0.00 0.00 0.00 51.96 52.21 1i48 s ALA 231 Cb 0.00 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1i48 s ALA 231 CO 0.00 -1.10 0.15 -0.51 0.00 0.00 0.00 175.76 174.30 1i48 s LEU 232 N -5.05 4.28 -0.26 0.00 1.43 -0.70 -3.84 118.68 114.54 1i48 s LEU 232 Ca 0.62 0.34 -0.02 0.00 -1.03 0.00 0.00 54.13 54.04 1i48 s LEU 232 Cb -0.16 -2.40 0.03 0.00 0.03 0.00 0.00 46.19 43.69 1i48 s LEU 232 CO 0.46 0.30 -0.05 -0.69 0.23 0.00 0.00 176.35 176.60 1i48 s VAL 233 N -1.22 2.90 -0.19 -1.59 1.01 -1.26 0.18 120.40 120.24 1i48 s VAL 233 Ca 0.23 -1.08 -0.00 0.00 0.00 0.00 0.00 61.98 61.13 1i48 s VAL 233 Cb -0.12 -2.51 0.01 0.00 0.00 0.00 0.00 36.38 33.76 1i48 s VAL 233 CO 0.14 0.15 -0.17 0.00 0.00 0.00 0.00 175.10 175.22 1i48 s ILE 235 N 1.31 3.79 -0.90 0.00 -1.09 0.41 -1.93 121.20 122.78 1i48 s ILE 235 Ca 0.05 -0.43 -0.10 0.00 -2.23 0.00 0.00 60.65 57.94 1i48 s ILE 235 Cb -0.13 -2.58 0.23 0.00 -1.58 0.00 0.00 42.46 38.40 1i48 s ILE 235 CO -0.10 0.57 0.84 -0.62 -1.23 0.00 0.00 174.94 174.40 1i48 s ASP 236 N -0.48 6.69 -0.08 3.58 -1.08 -0.45 -1.10 116.67 123.75 1i48 s ASP 236 Ca 0.07 -3.11 -0.00 0.00 -0.52 0.00 0.00 52.55 49.00 1i48 s ASP 236 Cb -0.12 -2.14 0.07 0.00 -1.46 0.00 0.00 42.92 39.27 1i48 s ASP 236 CO 0.02 -0.42 1.73 0.61 0.52 0.00 0.00 175.17 177.63 1i48 n GLY 237 N 3.34 2.77 0.41 2.66 0.00 -0.91 -3.23 105.19 110.24 1i48 n GLY 237 Ca 0.17 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 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 0.73 0.00 -0.48 2.61 2.02 -1.88 0.03 112.91 115.94 1i48 h THR 238 Ca 0.09 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.40 1i48 h THR 238 Cb 1.06 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1i48 h THR 238 CO 0.20 0.00 0.36 -0.26 0.37 0.00 0.00 175.52 176.19 1i48 h PHE 239 N -0.76 0.00 0.12 3.16 0.04 -1.84 -3.16 116.94 114.50 1i48 h PHE 239 Ca -0.04 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 1i48 h PHE 239 Cb 0.69 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.84 1i48 h PHE 239 CO -0.29 0.00 -0.06 0.00 -0.60 0.00 0.00 178.31 177.36 1i48 h ALA 240 N 1.73 -0.21 0.00 2.45 0.00 -1.57 -3.42 119.26 118.25 1i48 h ALA 240 Ca 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1i48 h ALA 240 Cb 0.94 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1i48 h ALA 240 CO -0.00 -0.19 0.00 2.41 0.00 0.00 0.00 179.25 181.46 1i48 n THR 241 N -4.13 -0.37 0.33 0.00 -1.04 -0.09 -4.15 114.28 104.83 1i48 n THR 241 Ca -0.02 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.11 1i48 n THR 241 Cb 0.06 -0.15 0.62 0.00 -1.82 0.00 0.00 70.33 69.05 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 0.05 -2.82 0.13 -1.84 0.09 132.00 127.61 1i48 h PRO 242 Ca 0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.88 1i48 h PRO 242 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1i48 h PRO 242 CO 0.00 0.00 -1.07 -0.07 -0.23 0.00 0.00 178.00 176.63 1i48 h LEU 243 N 0.00 0.63 -0.01 1.56 3.38 -1.93 -3.30 115.31 115.64 1i48 h LEU 243 Ca 0.00 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1i48 h LEU 243 Cb 0.96 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1i48 h LEU 243 CO 0.00 1.36 -0.27 0.59 0.09 0.00 0.00 178.44 180.21 1i48 n ASN 244 N -3.73 0.29 -3.63 -0.43 4.13 0.00 -4.83 115.26 107.06 1i48 n ASN 244 Ca -0.09 0.06 -0.05 0.00 1.68 0.00 0.00 54.58 56.18 1i48 n ASN 244 Cb 0.91 -0.09 -0.05 0.00 -1.54 0.00 0.00 39.78 39.01 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 -2.98 0.23 -0.70 3.52 -2.07 -1.12 -1.73 119.66 114.81 1i48 s GLN 245 Ca 0.13 0.12 0.05 0.00 -1.82 0.00 0.00 55.36 53.83 1i48 s GLN 245 Cb 0.18 0.11 0.26 0.00 -1.09 0.00 0.00 33.01 32.47 1i48 s GLN 245 CO 0.62 -0.06 0.84 1.63 -1.32 0.00 0.00 175.29 177.00 1i48 n LYS 246 N 0.99 2.77 -0.39 9.60 4.76 -1.26 -4.28 118.16 130.34 1i48 n LYS 246 Ca -0.06 -4.66 0.35 0.00 -2.87 0.00 0.00 58.31 51.07 1i48 n LYS 246 Cb 0.58 -2.29 0.61 0.00 -1.84 0.00 0.00 35.03 32.09 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 0.92 1.18 0.03 7.82 0.00 -1.26 0.15 120.51 129.33 1i48 n ALA 247 Ca 0.29 0.89 -0.11 0.00 0.00 0.00 0.00 53.44 54.51 1i48 n ALA 247 Cb 0.40 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.01 -1.79 0.00 3.38 -1.86 -1.52 115.31 113.51 1i48 h LEU 248 Ca 0.83 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.78 1i48 h LEU 248 Cb 2.49 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 43.24 1i48 h LEU 248 CO -0.57 0.00 -0.16 0.00 0.09 0.00 0.00 178.44 177.81 1i48 h ALA 249 N 1.03 1.40 0.00 1.53 0.00 -0.60 -0.82 119.26 121.80 1i48 h ALA 249 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1i48 h ALA 249 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1i48 h ALA 249 CO -0.03 0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.70 1i48 n LEU 250 N -3.86 0.00 0.00 0.00 4.77 -0.66 -4.85 117.00 112.40 1i48 n LEU 250 Ca -0.02 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1i48 n LEU 250 Cb 0.25 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1i48 n LEU 250 CO 0.32 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 1i48 n GLY 251 N 0.35 1.77 3.62 -0.72 0.00 -0.31 -3.27 105.19 106.63 1i48 n GLY 251 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.53 -0.24 -0.01 4.61 0.00 -0.68 -4.90 120.51 118.77 1i48 n ALA 252 Ca 0.00 -0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.01 1i48 n ALA 252 Cb 0.00 -2.13 -0.14 0.00 0.00 0.00 0.00 19.45 17.18 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 -0.37 0.34 -4.09 0.00 3.32 -1.31 -3.41 116.42 110.90 1i48 h ASP 253 Ca -0.47 -0.83 -0.29 0.00 0.02 0.00 0.00 57.03 55.46 1i48 h ASP 253 Cb 1.33 -0.11 -0.27 0.00 0.22 0.00 0.00 39.33 40.50 1i48 h ASP 253 CO 0.46 1.69 -0.74 -0.76 -1.72 0.00 0.00 179.24 178.17 1i48 s LEU 254 N -7.43 2.07 -0.01 1.55 1.43 -0.78 -4.22 118.68 111.28 1i48 s LEU 254 Ca -0.22 -0.18 0.04 0.00 -1.03 0.00 0.00 54.13 52.73 1i48 s LEU 254 Cb 0.05 -0.19 -0.01 0.00 0.03 0.00 0.00 46.19 46.08 1i48 s LEU 254 CO 0.74 -0.01 -0.12 0.54 0.23 0.00 0.00 176.35 177.72 1i48 s VAL 255 N -0.40 0.99 -0.01 -1.59 0.11 -0.85 -0.45 120.40 118.21 1i48 s VAL 255 Ca -0.01 -0.53 -0.06 0.00 -2.93 0.00 0.00 61.98 58.44 1i48 s VAL 255 Cb -0.04 -0.83 0.00 0.00 -1.53 0.00 0.00 36.38 33.98 1i48 s VAL 255 CO -0.00 0.28 0.13 -1.48 -3.33 0.00 0.00 175.10 170.70 1i48 s LEU 256 N -0.26 1.58 0.23 2.54 0.05 -0.26 -1.16 118.68 121.42 1i48 s LEU 256 Ca 0.04 -0.14 0.02 0.00 0.05 0.00 0.00 54.13 54.10 1i48 s LEU 256 Cb -0.05 0.60 -0.05 0.00 -2.05 0.00 0.00 46.19 44.64 1i48 s LEU 256 CO -0.00 -0.31 0.05 -1.00 -0.55 0.00 0.00 176.35 174.54 1i48 s HIS 257 N -1.12 1.47 -0.73 3.48 3.76 -1.01 -2.14 115.29 118.99 1i48 s HIS 257 Ca -0.12 -1.09 -0.10 0.00 -0.15 0.00 0.00 55.06 53.60 1i48 s HIS 257 Cb -0.07 -0.86 0.19 0.00 1.11 0.00 0.00 32.58 32.96 1i48 s HIS 257 CO 0.01 -0.24 0.63 0.45 -0.85 0.00 0.00 174.74 174.74 1i48 s SER 258 N -3.28 6.20 0.33 1.40 0.15 -1.26 -2.63 113.70 114.61 1i48 s SER 258 Ca 0.33 -2.66 0.13 0.00 0.70 0.00 0.00 55.95 54.44 1i48 s SER 258 Cb 0.07 -2.09 0.70 0.00 -1.71 0.00 0.00 66.02 62.99 1i48 s SER 258 CO 0.10 -0.53 1.29 0.00 1.20 0.00 0.00 173.24 175.30 1i48 n ALA 259 N 3.93 0.60 0.18 5.45 0.00 -0.29 -0.36 120.51 130.02 1i48 n ALA 259 Ca 0.09 0.12 0.15 0.00 0.00 0.00 0.00 53.44 53.80 1i48 n ALA 259 Cb 0.43 -0.77 0.73 0.00 0.00 0.00 0.00 19.45 19.85 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 0.74 0.00 0.00 2.02 -1.68 -1.45 112.91 112.54 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 0.63 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 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 -4.23 0.00 -0.07 6.66 4.76 0.51 -4.58 118.16 121.21 1i48 n LYS 261 Ca 0.02 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.35 1i48 n LYS 261 Cb 0.30 -0.02 -0.10 0.00 -1.84 0.00 0.00 35.03 33.37 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 -0.79 2.13 0.04 -1.74 0.27 116.94 116.85 1i48 h PHE 262 Ca 0.00 0.00 0.15 0.00 2.80 0.00 0.00 57.97 60.92 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 0.78 -0.27 -0.07 -0.60 0.00 0.00 178.31 178.15 1i48 h LEU 263 N -1.00 -0.97 0.13 1.54 3.38 -1.84 0.20 115.31 116.75 1i48 h LEU 263 Ca -0.01 0.25 -0.28 0.00 0.09 0.00 0.00 57.88 57.93 1i48 h LEU 263 Cb 0.78 0.57 0.01 0.00 0.09 0.00 0.00 40.66 42.11 1i48 h LEU 263 CO -0.01 -0.28 -1.26 1.23 0.09 0.00 0.00 178.44 178.21 1i48 h GLY 264 N -0.04 0.40 -3.38 0.83 0.00 -1.42 -3.25 103.07 96.22 1i48 h GLY 264 Ca 0.35 -0.97 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 1i48 h GLY 264 CO -0.83 0.85 -0.06 0.61 0.00 0.00 0.00 176.54 177.12 1i48 n GLY 265 N 1.51 -0.14 0.00 4.60 0.00 0.71 -4.68 105.19 107.19 1i48 n GLY 265 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.96 0.00 -3.27 1.61 8.25 -1.26 -0.98 115.22 117.61 1i48 n HIS 266 Ca -0.03 -0.07 -0.23 0.00 -0.26 0.00 0.00 57.72 57.13 1i48 n HIS 266 Cb 0.31 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.43 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 -0.07 -4.80 -0.73 0.41 3.02 -1.26 -4.80 115.26 107.02 1i48 n ASN 267 Ca 0.00 -0.38 0.04 0.00 -0.03 0.00 0.00 54.58 54.21 1i48 n ASN 267 Cb 0.17 -3.91 0.06 0.00 -0.61 0.00 0.00 39.78 35.48 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 -2.43 0.92 -3.63 6.41 5.75 -1.26 -5.08 116.55 117.23 1i48 n ASP 268 Ca -0.05 -2.43 -0.07 0.00 -0.01 0.00 0.00 54.79 52.23 1i48 n ASP 268 Cb 0.57 -0.31 -0.06 0.00 -1.03 0.00 0.00 41.12 40.29 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 -0.92 0.00 0.02 2.12 0.11 -1.26 -5.10 120.40 115.37 1i48 s VAL 269 Ca 0.20 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.27 1i48 s VAL 269 Cb 0.21 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.02 1i48 s VAL 269 CO -0.05 0.00 0.02 -0.76 -3.33 0.00 0.00 175.10 170.98 1i48 s LEU 270 N -0.29 3.58 0.00 2.54 1.43 -1.26 -4.38 118.68 120.30 1i48 s LEU 270 Ca 0.04 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 1i48 s LEU 270 Cb -0.03 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1i48 s LEU 270 CO -0.08 0.25 0.00 0.00 0.23 0.00 0.00 176.35 176.75 1i48 n ALA 271 N 1.13 0.00 -2.45 4.21 0.00 -1.16 -4.65 120.51 117.59 1i48 n ALA 271 Ca -0.13 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.09 1i48 n ALA 271 Cb 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 1i48 n ALA 271 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1i48 s GLY 272 N 0.00 1.87 -0.14 0.00 0.00 -1.22 -1.13 107.32 106.70 1i48 s GLY 272 Ca 0.00 -1.91 -0.28 0.00 0.00 0.00 0.00 44.72 42.53 1i48 s GLY 272 CO 0.00 -1.90 0.68 0.00 0.00 0.00 0.00 173.10 171.88 1i48 s ILE 274 N -0.51 0.99 0.07 0.00 1.01 -0.12 -2.40 121.20 120.23 1i48 s ILE 274 Ca -0.06 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.15 1i48 s ILE 274 Cb -0.02 -0.86 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 1i48 s ILE 274 CO 0.06 0.30 -0.14 -0.44 0.00 0.00 0.00 174.94 174.72 1i48 s SER 275 N 0.08 1.60 0.00 3.58 0.01 -0.30 0.95 113.70 119.61 1i48 s SER 275 Ca -0.02 -0.61 0.00 0.00 1.31 0.00 0.00 55.95 56.63 1i48 s SER 275 Cb -0.09 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.10 1i48 s SER 275 CO 0.01 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.18 1i48 n GLY 276 N 1.30 -1.01 3.76 3.44 0.00 -0.43 -2.01 105.19 110.24 1i48 n GLY 276 Ca -0.21 -1.01 -0.38 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.27 3.36 0.11 1.61 0.04 -1.26 -1.70 135.00 135.89 1i48 s PRO 277 Ca 0.00 2.09 -0.31 0.00 0.04 0.00 0.00 61.00 62.82 1i48 s PRO 277 Cb 0.00 -2.32 -0.11 0.00 0.04 0.00 0.00 34.50 32.11 1i48 s PRO 277 CO 0.00 -0.97 1.60 1.25 0.04 0.00 0.00 177.00 178.92 1i48 h LEU 278 N 1.68 -1.12 -1.44 -3.56 6.46 -1.89 -1.01 115.31 114.42 1i48 h LEU 278 Ca -0.50 0.12 0.48 0.00 -0.12 0.00 0.00 57.88 57.85 1i48 h LEU 278 Cb 1.28 0.41 -0.12 0.00 -0.73 0.00 0.00 40.66 41.50 1i48 h LEU 278 CO 0.58 -0.49 0.96 1.17 -0.62 0.00 0.00 178.44 180.04 1i48 n LYS 279 N -5.46 -0.03 -0.04 1.25 0.00 -1.26 -1.18 118.16 111.44 1i48 n LYS 279 Ca -0.08 1.17 -0.02 0.00 0.00 0.00 0.00 58.31 59.38 1i48 n LYS 279 Cb 0.37 -2.38 -0.01 0.00 0.00 0.00 0.00 35.03 33.01 1i48 n LYS 279 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1i48 h LEU 280 N 0.00 0.00 -0.90 3.14 3.38 -1.73 -3.37 115.31 115.82 1i48 h LEU 280 Ca 0.86 0.00 0.25 0.00 0.09 0.00 0.00 57.88 59.08 1i48 h LEU 280 Cb 2.91 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 43.51 1i48 h LEU 280 CO -0.36 0.42 0.21 1.62 0.09 0.00 0.00 178.44 180.41 1i48 h VAL 281 N -0.56 0.24 -0.38 1.22 3.04 -0.75 -0.09 116.25 118.97 1i48 h VAL 281 Ca 0.00 -0.05 0.08 0.00 -1.01 0.00 0.00 66.70 65.71 1i48 h VAL 281 Cb 0.27 0.07 -0.07 0.00 -2.01 0.00 0.00 31.29 29.56 1i48 h VAL 281 CO 0.00 0.03 -0.08 0.77 -1.01 0.00 0.00 177.57 177.28 1i48 h SER 282 N 0.15 -0.32 -1.02 3.17 4.64 -1.37 0.52 113.55 119.34 1i48 h SER 282 Ca 0.57 0.11 0.25 0.00 -0.47 0.00 0.00 61.79 62.26 1i48 h SER 282 Cb 1.19 0.22 -0.09 0.00 -0.31 0.00 0.00 62.40 63.42 1i48 h SER 282 CO -0.71 -0.11 0.66 -0.33 -0.87 0.00 0.00 176.83 175.47 1i48 h GLU 283 N 0.02 0.39 0.08 4.77 4.39 -1.17 0.28 114.58 123.34 1i48 h GLU 283 Ca 0.18 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.86 1i48 h GLU 283 Cb 0.28 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1i48 h GLU 283 CO -0.38 0.26 -0.04 0.82 -1.16 0.00 0.00 179.01 178.51 1i48 h ILE 284 N 0.40 1.15 -0.93 3.13 2.04 -0.95 -3.19 117.51 119.16 1i48 h ILE 284 Ca 0.57 -1.42 0.28 0.00 1.00 0.00 0.00 64.86 65.28 1i48 h ILE 284 Cb 1.43 1.99 -0.16 0.00 -0.74 0.00 0.00 36.82 39.35 1i48 h ILE 284 CO -0.27 0.32 0.27 -0.09 0.00 0.00 0.00 178.15 178.38 1i48 h ARG 285 N -0.82 0.14 0.52 2.37 2.43 0.86 0.29 114.38 120.17 1i48 h ARG 285 Ca -0.01 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1i48 h ARG 285 Cb 0.60 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1i48 h ARG 285 CO 0.02 0.10 -0.41 -0.91 -1.51 0.00 0.00 179.97 177.26 1i48 h ASN 286 N 0.15 -1.08 -0.45 -3.80 4.21 -1.06 0.14 115.58 113.69 1i48 h ASN 286 Ca 0.63 0.08 0.12 0.00 1.21 0.00 0.00 56.30 58.33 1i48 h ASN 286 Cb 1.36 0.34 -0.02 0.00 -1.12 0.00 0.00 38.32 38.88 1i48 h ASN 286 CO -0.72 -0.58 0.32 0.25 -1.29 0.00 0.00 177.43 175.41 1i48 h LEU 287 N -0.89 0.04 -0.38 1.61 5.85 -1.09 -0.13 115.31 120.31 1i48 h LEU 287 Ca -0.07 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.62 1i48 h LEU 287 Cb 0.75 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1i48 h LEU 287 CO 0.01 0.02 0.09 -0.74 -0.34 0.00 0.00 178.44 177.48 1i48 h HIS 288 N 0.04 0.64 -0.10 1.25 2.76 0.65 -1.39 115.15 119.00 1i48 h HIS 288 Ca 0.21 -0.08 0.03 0.00 -2.20 0.00 0.00 60.37 58.33 1i48 h HIS 288 Cb 0.80 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 29.57 1i48 h HIS 288 CO -0.00 0.63 0.19 0.45 -1.30 0.00 0.00 177.93 177.90 1i48 h HIS 289 N 0.47 0.00 0.00 5.26 3.86 0.12 -0.08 115.15 124.78 1i48 h HIS 289 Ca 0.12 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1i48 h HIS 289 Cb 0.31 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.78 1i48 h HIS 289 CO 0.02 0.00 -0.45 0.82 0.86 0.00 0.00 177.93 179.18 1i48 h ILE 290 N 0.00 0.11 0.00 2.45 2.04 -1.23 -3.35 117.51 117.53 1i48 h ILE 290 Ca 0.05 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.78 1i48 h ILE 290 Cb 0.43 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1i48 h ILE 290 CO -0.00 0.04 0.17 -0.07 0.00 0.00 0.00 178.15 178.29 1i48 h LEU 291 N -1.00 0.00 -2.85 1.44 3.38 -1.08 -3.46 115.31 111.73 1i48 h LEU 291 Ca -0.03 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 1i48 h LEU 291 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1i48 h LEU 291 CO -0.02 0.00 -0.57 0.61 0.09 0.00 0.00 178.44 178.56 1i48 n GLY 292 N -1.15 -1.06 0.67 0.83 0.00 -0.06 -4.95 105.19 99.47 1i48 n GLY 292 Ca -0.02 0.81 0.06 0.00 0.00 0.00 0.00 46.02 46.86 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 -1.14 4.67 3.35 -0.02 0.00 -1.26 -5.08 105.19 105.71 1i48 n GLY 293 Ca -0.06 -1.24 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.96 -2.27 -2.71 4.61 0.00 -1.26 -1.83 120.51 116.10 1i48 n ALA 294 Ca 0.17 0.03 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 1i48 n ALA 294 Cb 0.74 -1.60 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 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 3.19 4.21 0.35 0.00 2.96 -1.26 -4.45 118.68 123.67 1i48 s LEU 295 Ca 0.62 0.44 -0.28 0.00 -0.22 0.00 0.00 54.13 54.68 1i48 s LEU 295 Cb -0.53 -2.35 -0.11 0.00 0.50 0.00 0.00 46.19 43.71 1i48 s LEU 295 CO 0.61 0.06 1.46 0.21 -1.32 0.00 0.00 176.35 177.38 1i48 s ASN 296 N 0.65 6.44 0.17 3.68 3.84 -1.26 -4.85 114.94 123.61 1i48 s ASN 296 Ca 0.15 2.96 -0.16 0.00 0.21 0.00 0.00 52.86 56.02 1i48 s ASN 296 Cb -0.13 -2.66 0.12 0.00 -0.55 0.00 0.00 41.25 38.02 1i48 s ASN 296 CO 0.04 -0.81 1.68 -0.65 -2.79 0.00 0.00 177.10 174.57 1i48 h PRO 297 N 3.37 0.05 -0.82 0.43 0.11 -1.97 -1.43 132.00 131.74 1i48 h PRO 297 Ca -0.50 -0.00 0.17 0.00 0.11 0.00 0.00 66.00 65.78 1i48 h PRO 297 Cb 1.23 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.23 1i48 h PRO 297 CO 0.67 0.03 0.35 -0.91 -0.21 0.00 0.00 178.00 177.93 1i48 h ASN 298 N 0.05 0.32 0.33 -2.05 2.35 -1.91 0.20 115.58 114.87 1i48 h ASN 298 Ca 0.20 0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 56.06 1i48 h ASN 298 Cb 0.30 0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1i48 h ASN 298 CO -0.39 0.08 -0.16 0.00 -1.65 0.00 0.00 177.43 175.32 1i48 h ALA 299 N 1.61 -0.45 -0.83 -0.83 0.00 -1.67 -1.95 119.26 115.13 1i48 h ALA 299 Ca 0.47 -0.14 0.19 0.00 0.00 0.00 0.00 54.91 55.43 1i48 h ALA 299 Cb 0.77 0.17 -0.12 0.00 0.00 0.00 0.00 17.79 18.62 1i48 h ALA 299 CO -0.44 -0.69 0.29 0.00 0.00 0.00 0.00 179.25 178.40 1i48 h ALA 300 N 0.05 1.20 0.35 0.00 0.00 -0.11 -0.42 119.26 120.33 1i48 h ALA 300 Ca -0.05 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1i48 h ALA 300 Cb 0.42 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1i48 h ALA 300 CO 0.08 -0.34 -0.17 -0.92 0.00 0.00 0.00 179.25 177.90 1i48 h TYR 301 N 0.34 -0.43 -0.91 0.00 3.20 -0.47 -0.58 116.97 118.12 1i48 h TYR 301 Ca 0.49 -0.01 0.25 0.00 3.14 0.00 0.00 58.73 62.60 1i48 h TYR 301 Cb 0.89 0.14 -0.14 0.00 1.54 0.00 0.00 36.73 39.17 1i48 h TYR 301 CO -0.20 -0.24 0.34 -0.07 -1.64 0.00 0.00 178.16 176.35 1i48 h LEU 302 N -0.51 0.19 -0.05 2.82 3.38 -0.32 0.54 115.31 121.36 1i48 h LEU 302 Ca -0.05 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1i48 h LEU 302 Cb 0.39 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1i48 h LEU 302 CO 0.08 -0.11 -0.02 0.40 0.09 0.00 0.00 178.44 178.88 1i48 h ILE 303 N 0.28 1.31 -0.96 1.22 2.04 -0.96 0.99 117.51 121.44 1i48 h ILE 303 Ca 0.59 -0.95 0.14 0.00 1.00 0.00 0.00 64.86 65.64 1i48 h ILE 303 Cb 1.20 1.85 -0.09 0.00 -0.74 0.00 0.00 36.82 39.04 1i48 h ILE 303 CO -0.61 0.26 0.57 0.40 0.00 0.00 0.00 178.15 178.77 1i48 h ILE 304 N -0.27 0.83 -0.47 -0.67 2.04 0.78 0.37 117.51 120.12 1i48 h ILE 304 Ca 0.01 -0.29 -0.10 0.00 1.00 0.00 0.00 64.86 65.48 1i48 h ILE 304 Cb 0.42 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1i48 h ILE 304 CO 0.01 0.15 -0.11 -0.09 0.00 0.00 0.00 178.15 178.11 1i48 h ARG 305 N 0.84 0.85 -0.18 2.37 2.43 0.25 -3.08 114.38 117.87 1i48 h ARG 305 Ca 0.50 -0.29 -0.05 0.00 -0.81 0.00 0.00 59.98 59.33 1i48 h ARG 305 Cb 0.62 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1i48 h ARG 305 CO -0.31 0.92 -0.09 0.78 -1.51 0.00 0.00 179.97 179.76 1i48 h GLY 306 N 0.97 0.42 1.95 2.80 0.00 0.20 -2.94 103.07 106.46 1i48 h GLY 306 Ca 0.13 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1i48 h GLY 306 CO 0.04 0.34 0.02 1.03 0.00 0.00 0.00 176.54 177.97 1i48 n MET 307 N -4.59 0.12 0.27 4.80 2.81 0.98 -1.42 117.12 120.09 1i48 n MET 307 Ca -0.05 0.62 0.10 0.00 -1.81 0.00 0.00 57.70 56.55 1i48 n MET 307 Cb 0.32 -1.91 0.70 0.00 -0.71 0.00 0.00 33.22 31.61 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 0.00 0.03 1.79 -1.43 -2.55 116.57 114.41 1i48 h LYS 308 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1i48 h LYS 308 Cb 0.04 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.65 1i48 h LYS 308 CO 0.00 0.03 -0.52 0.25 -1.08 0.00 0.00 179.45 178.13 1i48 n THR 309 N -4.30 1.94 0.16 -0.16 -2.24 -0.51 -4.69 114.28 104.48 1i48 n THR 309 Ca -0.03 -2.91 -0.08 0.00 -2.27 0.00 0.00 64.05 58.76 1i48 n THR 309 Cb 0.11 -0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 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 0.91 -0.59 -0.43 3.22 5.85 -1.48 -1.41 115.31 121.39 1i48 h LEU 310 Ca -0.02 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.80 1i48 h LEU 310 Cb 1.10 0.18 -0.09 0.00 0.37 0.00 0.00 40.66 42.22 1i48 h LEU 310 CO 0.01 -0.32 -0.51 1.12 -0.34 0.00 0.00 178.44 178.40 1i48 h HIS 311 N -0.49 -1.54 -0.94 1.25 2.07 -1.89 0.73 115.15 114.33 1i48 h HIS 311 Ca -0.04 0.08 0.12 0.00 -2.85 0.00 0.00 60.37 57.68 1i48 h HIS 311 Cb 0.41 0.73 -0.14 0.00 2.57 0.00 0.00 27.41 30.99 1i48 h HIS 311 CO -0.07 -0.47 -0.48 -0.07 -3.07 0.00 0.00 177.93 173.77 1i48 h LEU 312 N -0.36 -1.74 0.14 6.12 -0.00 -1.91 0.48 115.31 118.05 1i48 h LEU 312 Ca 0.10 0.31 -0.01 0.00 -0.00 0.00 0.00 57.88 58.28 1i48 h LEU 312 Cb 0.59 0.83 0.00 0.00 -0.00 0.00 0.00 40.66 42.08 1i48 h LEU 312 CO -0.60 -0.27 -0.07 0.03 -0.00 0.00 0.00 178.44 177.53 1i48 h ARG 313 N -0.03 -0.18 -0.78 1.13 3.08 -0.04 -2.93 114.38 114.62 1i48 h ARG 313 Ca 0.25 0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.44 1i48 h ARG 313 Cb 0.52 0.04 -0.13 0.00 0.08 0.00 0.00 29.97 30.48 1i48 h ARG 313 CO -0.93 -0.12 -0.27 0.28 -1.07 0.00 0.00 179.97 177.86 1i48 n VAL 314 N -2.53 -0.38 -0.01 2.04 0.31 0.12 -0.42 118.33 117.46 1i48 n VAL 314 Ca -0.02 1.81 -0.02 0.00 -0.01 0.00 0.00 64.34 66.09 1i48 n VAL 314 Cb 0.08 -2.42 -0.01 0.00 -0.91 0.00 0.00 33.84 30.57 1i48 n VAL 314 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1i48 h GLN 315 N 0.00 -0.07 -0.75 5.55 4.20 -0.90 0.51 115.11 123.65 1i48 h GLN 315 Ca 0.30 0.00 0.16 0.00 0.06 0.00 0.00 58.65 59.18 1i48 h GLN 315 Cb 0.50 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 28.15 1i48 h GLN 315 CO -0.78 -0.04 -0.12 0.37 -0.67 0.00 0.00 178.83 177.59 1i48 h GLN 316 N -0.07 0.03 0.24 1.46 5.75 -0.55 -1.01 115.11 120.97 1i48 h GLN 316 Ca 0.01 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1i48 h GLN 316 Cb 0.09 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1i48 h GLN 316 CO -0.08 0.02 -0.19 1.96 -2.65 0.00 0.00 178.83 177.90 1i48 h GLN 317 N 0.03 -0.42 -0.65 1.69 4.20 -0.13 -1.81 115.11 118.01 1i48 h GLN 317 Ca 0.38 0.03 0.13 0.00 0.06 0.00 0.00 58.65 59.25 1i48 h GLN 317 Cb 0.62 0.10 -0.13 0.00 0.30 0.00 0.00 27.48 28.37 1i48 h GLN 317 CO -0.74 -0.28 -0.22 -0.91 -0.67 0.00 0.00 178.83 176.01 1i48 h ASN 318 N -0.44 -0.78 0.07 1.46 2.35 0.13 -0.09 115.58 118.27 1i48 h ASN 318 Ca -0.01 0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1i48 h ASN 318 Cb 0.39 0.46 0.00 0.00 0.05 0.00 0.00 38.32 39.23 1i48 h ASN 318 CO -0.01 -0.25 -0.03 0.28 -1.65 0.00 0.00 177.43 175.76 1i48 h SER 319 N -0.05 -0.08 -0.89 5.81 0.02 -1.14 -2.01 113.55 115.22 1i48 h SER 319 Ca 0.30 0.00 0.21 0.00 -0.84 0.00 0.00 61.79 61.47 1i48 h SER 319 Cb 0.52 0.02 -0.17 0.00 0.14 0.00 0.00 62.40 62.91 1i48 h SER 319 CO -0.69 -0.05 -0.09 0.41 -1.14 0.00 0.00 176.83 175.26 1i48 n THR 320 N -2.25 -0.37 0.03 -2.27 -1.04 -0.70 -0.67 114.28 107.01 1i48 n THR 320 Ca -0.01 1.99 -0.03 0.00 -2.04 0.00 0.00 64.05 63.96 1i48 n THR 320 Cb 0.04 -2.83 -0.02 0.00 -1.82 0.00 0.00 70.33 65.69 1i48 n THR 320 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1i48 h ALA 321 N 1.78 -0.70 -0.11 2.41 0.00 -0.89 -0.84 119.26 120.90 1i48 h ALA 321 Ca 0.49 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.38 1i48 h ALA 321 Cb 0.90 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 1i48 h ALA 321 CO -0.87 -0.72 -0.08 1.25 0.00 0.00 0.00 179.25 178.83 1i48 h LEU 322 N -0.15 -0.29 -0.68 0.00 5.85 -0.13 0.47 115.31 120.38 1i48 h LEU 322 Ca -0.00 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.83 1i48 h LEU 322 Cb 0.14 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 1i48 h LEU 322 CO -0.04 -0.04 -0.56 0.03 -0.34 0.00 0.00 178.44 177.49 1i48 h ARG 323 N -0.02 -0.20 -0.78 1.25 3.08 -1.35 0.23 114.38 116.60 1i48 h ARG 323 Ca 0.02 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.20 1i48 h ARG 323 Cb 0.07 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 1i48 h ARG 323 CO -0.12 -0.14 0.38 0.52 -1.07 0.00 0.00 179.97 179.55 1i48 h MET 324 N -0.21 0.58 0.07 0.04 2.86 -0.59 -0.63 114.93 117.05 1i48 h MET 324 Ca 0.12 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1i48 h MET 324 Cb 0.52 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1i48 h MET 324 CO -0.76 0.38 -0.42 0.00 1.06 0.00 0.00 176.91 177.18 1i48 h ALA 325 N 1.50 -0.89 0.04 6.32 0.00 0.32 0.59 119.26 127.13 1i48 h ALA 325 Ca 0.40 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.26 1i48 h ALA 325 Cb 0.51 0.82 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 1i48 h ALA 325 CO -0.32 -1.00 -0.43 0.93 0.00 0.00 0.00 179.25 178.42 1i48 h GLU 326 N -0.58 -0.59 -0.90 0.00 5.08 -0.74 0.40 114.58 117.26 1i48 h GLU 326 Ca -0.00 0.04 0.24 0.00 -1.00 0.00 0.00 59.36 58.64 1i48 h GLU 326 Cb 0.59 0.13 -0.14 0.00 0.50 0.00 0.00 28.75 29.83 1i48 h GLU 326 CO -0.24 -0.39 0.31 0.82 -1.00 0.00 0.00 179.01 178.51 1i48 h ILE 327 N -0.61 0.35 0.11 3.13 2.04 -0.71 0.94 117.51 122.76 1i48 h ILE 327 Ca 0.04 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1i48 h ILE 327 Cb 0.67 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1i48 h ILE 327 CO -0.30 0.05 -0.05 -0.07 0.00 0.00 0.00 178.15 177.78 1i48 h LEU 328 N 0.27 -0.13 -0.78 1.44 3.38 0.18 -2.22 115.31 117.45 1i48 h LEU 328 Ca 0.58 -0.29 0.17 0.00 0.09 0.00 0.00 57.88 58.42 1i48 h LEU 328 Cb 1.17 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.84 1i48 h LEU 328 CO -0.62 0.24 0.23 -0.08 0.09 0.00 0.00 178.44 178.30 1i48 h GLU 329 N -0.51 0.30 0.00 1.13 4.81 0.18 0.22 114.58 120.71 1i48 h GLU 329 Ca -0.02 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1i48 h GLU 329 Cb 0.41 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1i48 h GLU 329 CO 0.03 0.20 -0.23 0.00 -0.73 0.00 0.00 179.01 178.27 1i48 h ALA 330 N 1.63 1.14 -2.94 2.92 0.00 -0.84 -3.45 119.26 117.72 1i48 h ALA 330 Ca 0.45 -0.21 -0.54 0.00 0.00 0.00 0.00 54.91 54.61 1i48 h ALA 330 Cb 0.78 -0.04 0.10 0.00 0.00 0.00 0.00 17.79 18.63 1i48 h ALA 330 CO -0.51 0.29 0.71 -1.58 0.00 0.00 0.00 179.25 178.16 1i48 s HIS 331 N -3.88 2.64 0.00 0.00 5.65 0.77 -4.94 115.29 115.53 1i48 s HIS 331 Ca -0.01 1.27 -0.25 0.00 0.25 0.00 0.00 55.06 56.32 1i48 s HIS 331 Cb 0.12 -3.89 -0.19 0.00 -1.18 0.00 0.00 32.58 27.44 1i48 s HIS 331 CO 0.64 -2.69 1.35 -1.00 -0.65 0.00 0.00 174.74 172.39 1i48 h PRO 332 N 2.77 0.02 0.00 2.88 0.13 -1.86 -3.03 132.00 132.90 1i48 h PRO 332 Ca -0.50 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1i48 h PRO 332 Cb 1.25 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1i48 h PRO 332 CO 0.63 0.41 0.00 1.63 -0.23 0.00 0.00 178.00 180.44 1i48 n LYS 333 N -4.88 0.09 -3.42 0.86 5.02 -1.26 -4.39 118.16 110.17 1i48 n LYS 333 Ca -0.08 0.20 -0.43 0.00 -2.02 0.00 0.00 58.31 55.98 1i48 n LYS 333 Cb 0.21 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.63 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 -2.49 5.22 0.02 -0.18 1.01 -1.15 0.31 120.40 123.14 1i48 s VAL 334 Ca 0.05 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 1i48 s VAL 334 Cb 0.04 -3.98 -0.18 0.00 0.00 0.00 0.00 36.38 32.26 1i48 s VAL 334 CO 0.08 -0.38 1.38 -0.09 0.00 0.00 0.00 175.10 176.09 1i48 h ARG 335 N 8.67 -0.20 -3.70 2.72 2.43 -1.44 -3.46 114.38 119.41 1i48 h ARG 335 Ca -0.27 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 58.81 1i48 h ARG 335 Cb 1.12 0.04 -0.16 0.00 -0.42 0.00 0.00 29.97 30.55 1i48 h ARG 335 CO 0.77 0.10 -0.40 -1.58 -1.51 0.00 0.00 179.97 177.35 1i48 s HIS 336 N -4.94 0.12 -0.01 2.20 5.04 -1.13 -4.98 115.29 111.58 1i48 s HIS 336 Ca -0.15 -0.44 0.00 0.00 -1.54 0.00 0.00 55.06 52.94 1i48 s HIS 336 Cb 0.03 -0.06 0.01 0.00 0.04 0.00 0.00 32.58 32.60 1i48 s HIS 336 CO 0.62 -0.47 0.01 0.08 -2.34 0.00 0.00 174.74 172.63 1i48 s VAL 337 N -3.14 0.05 -0.16 0.89 1.01 -1.26 -1.15 120.40 116.64 1i48 s VAL 337 Ca -0.01 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 1i48 s VAL 337 Cb 0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 1i48 s VAL 337 CO -0.07 0.07 -0.08 -0.31 0.00 0.00 0.00 175.10 174.70 1i48 s TYR 338 N 0.54 2.91 -0.30 5.22 1.51 0.26 -4.86 117.35 122.63 1i48 s TYR 338 Ca -0.05 -0.63 -0.17 0.00 -1.01 0.00 0.00 57.07 55.22 1i48 s TYR 338 Cb -0.07 -1.94 0.18 0.00 -0.11 0.00 0.00 41.96 40.02 1i48 s TYR 338 CO -0.01 -0.25 1.17 -0.47 -1.11 0.00 0.00 175.55 174.87 1i48 s TYR 339 N 0.64 -0.30 0.58 2.71 5.04 -1.26 -2.69 117.35 122.07 1i48 s TYR 339 Ca -0.05 0.45 0.30 0.00 -2.44 0.00 0.00 57.07 55.33 1i48 s TYR 339 Cb -0.15 0.15 1.40 0.00 0.35 0.00 0.00 41.96 43.72 1i48 s TYR 339 CO 0.03 -0.16 1.79 -1.35 -1.34 0.00 0.00 175.55 174.52 1i48 h PRO 340 N 7.48 0.00 -0.22 4.97 0.11 -1.86 0.68 132.00 143.15 1i48 h PRO 340 Ca -0.13 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.93 1i48 h PRO 340 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1i48 h PRO 340 CO -0.01 0.00 -0.07 0.78 -0.21 0.00 0.00 178.00 178.49 1i48 h GLY 341 N 0.00 0.37 -1.43 -0.55 0.00 -1.93 -3.43 103.07 96.10 1i48 h GLY 341 Ca 0.33 -0.22 -0.50 0.00 0.00 0.00 0.00 47.33 46.93 1i48 h GLY 341 CO -0.00 0.21 0.40 1.08 0.00 0.00 0.00 176.54 178.22 1i48 s LEU 342 N -8.90 3.28 0.14 3.11 1.43 0.23 -4.97 118.68 113.00 1i48 s LEU 342 Ca -0.06 1.52 0.08 0.00 -1.03 0.00 0.00 54.13 54.64 1i48 s LEU 342 Cb 0.15 -4.49 -0.15 0.00 0.03 0.00 0.00 46.19 41.74 1i48 s LEU 342 CO 0.74 -1.01 1.32 1.56 0.23 0.00 0.00 176.35 179.20 1i48 h GLN 343 N -0.20 0.00 0.00 1.70 4.20 -1.85 -3.16 115.11 115.80 1i48 h GLN 343 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1i48 h GLN 343 Cb 1.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1i48 h GLN 343 CO 0.60 0.94 0.05 0.77 -0.67 0.00 0.00 178.83 180.53 1i48 h SER 344 N 0.00 0.00 -3.28 1.46 0.02 -1.93 -3.42 113.55 106.40 1i48 h SER 344 Ca -0.01 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.41 1i48 h SER 344 Cb 1.69 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.23 1i48 h SER 344 CO 0.12 0.00 0.50 -2.28 -1.14 0.00 0.00 176.83 174.03 1i48 s HIS 345 N -3.71 3.51 0.14 3.45 5.04 -1.20 -4.97 115.29 117.56 1i48 s HIS 345 Ca -0.03 1.44 -0.31 0.00 -1.54 0.00 0.00 55.06 54.61 1i48 s HIS 345 Cb 0.08 -3.32 -0.08 0.00 0.04 0.00 0.00 32.58 29.30 1i48 s HIS 345 CO 0.25 -0.86 1.55 -1.35 -2.34 0.00 0.00 174.74 171.98 1i48 h PRO 346 N 6.70 -0.32 -0.78 2.88 0.11 -1.91 -1.54 132.00 137.14 1i48 h PRO 346 Ca -0.42 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1i48 h PRO 346 Cb 1.22 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1i48 h PRO 346 CO 0.79 -0.21 0.00 -0.85 -0.21 0.00 0.00 178.00 177.51 1i48 n GLU 347 N -5.37 2.95 -0.30 1.05 0.00 -1.26 -4.53 120.64 113.18 1i48 n GLU 347 Ca -0.02 -1.59 0.12 0.00 0.00 0.00 0.00 57.16 55.67 1i48 n GLU 347 Cb 0.34 -1.87 0.27 0.00 0.00 0.00 0.00 31.44 30.18 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 2.03 0.18 -0.60 -1.84 2.76 -1.54 0.40 115.15 116.54 1i48 h HIS 348 Ca 0.00 0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.27 1i48 h HIS 348 Cb 1.23 0.06 -0.04 0.00 1.55 0.00 0.00 27.41 30.21 1i48 h HIS 348 CO 0.55 -0.28 0.35 1.12 -1.30 0.00 0.00 177.93 178.37 1i48 h HIS 349 N 0.13 0.65 -0.45 5.26 2.07 -1.83 -0.54 115.15 120.44 1i48 h HIS 349 Ca 0.54 0.02 -0.03 0.00 -2.85 0.00 0.00 60.37 58.06 1i48 h HIS 349 Cb 1.10 -0.20 -0.02 0.00 2.57 0.00 0.00 27.41 30.86 1i48 h HIS 349 CO -0.35 0.34 0.16 0.82 -3.07 0.00 0.00 177.93 175.84 1i48 h ILE 350 N 0.67 1.21 -0.61 6.12 2.04 -0.68 -1.02 117.51 125.25 1i48 h ILE 350 Ca 0.26 -0.68 0.11 0.00 1.00 0.00 0.00 64.86 65.55 1i48 h ILE 350 Cb 0.09 0.82 -0.09 0.00 -0.74 0.00 0.00 36.82 36.90 1i48 h ILE 350 CO -0.13 0.25 0.14 0.00 0.00 0.00 0.00 178.15 178.40 1i48 h ALA 351 N 1.01 0.73 -0.52 1.87 0.00 0.05 -0.54 119.26 121.86 1i48 h ALA 351 Ca 0.15 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 1i48 h ALA 351 Cb 0.23 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1i48 h ALA 351 CO -0.01 -0.30 -0.12 0.87 0.00 0.00 0.00 179.25 179.70 1i48 h LYS 352 N 0.27 1.00 -0.26 0.00 1.57 -0.77 0.16 116.57 118.55 1i48 h LYS 352 Ca 0.32 -0.38 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1i48 h LYS 352 Cb 0.47 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1i48 h LYS 352 CO -0.40 1.06 -0.20 1.57 -0.57 0.00 0.00 179.45 180.91 1i48 h LYS 353 N 0.87 0.47 0.00 3.15 2.10 0.00 -3.34 116.57 119.83 1i48 h LYS 353 Ca 0.13 -0.16 -0.03 0.00 -2.00 0.00 0.00 60.65 58.60 1i48 h LYS 353 Cb 0.69 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.97 1i48 h LYS 353 CO 0.05 0.65 -1.53 0.00 -2.00 0.00 0.00 179.45 176.62 1i48 n GLN 354 N -4.16 0.62 -3.56 0.07 10.64 -0.33 -5.03 117.38 115.63 1i48 n GLN 354 Ca -0.00 -0.09 -0.20 0.00 -1.83 0.00 0.00 57.00 54.89 1i48 n GLN 354 Cb 0.37 -1.26 -0.01 0.00 -0.86 0.00 0.00 30.24 28.47 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 -2.69 2.96 0.00 2.61 -1.94 0.56 -4.68 119.30 116.12 1i48 s MET 355 Ca -0.04 -1.13 0.00 0.00 -1.71 0.00 0.00 55.69 52.81 1i48 s MET 355 Cb 0.06 -2.69 0.00 0.00 2.01 0.00 0.00 34.83 34.21 1i48 s MET 355 CO 0.45 0.05 0.30 0.25 -0.01 0.00 0.00 175.02 176.06 1i48 n THR 356 N -1.56 0.00 -3.82 2.05 -2.24 -0.70 -4.68 114.28 103.32 1i48 n THR 356 Ca -0.00 -0.42 -0.09 0.00 -2.27 0.00 0.00 64.05 61.26 1i48 n THR 356 Cb 0.59 1.11 -0.01 0.00 -2.10 0.00 0.00 70.33 69.92 1i48 n THR 356 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i48 n GLY 357 N 0.25 2.05 0.56 3.38 0.00 -1.26 -5.02 105.19 105.14 1i48 n GLY 357 Ca 0.00 -1.44 0.02 0.00 0.00 0.00 0.00 46.02 44.59 1i48 n GLY 357 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1i48 n PHE 358 N -0.41 0.00 -0.48 1.61 3.72 -1.26 -4.97 117.46 115.67 1i48 n PHE 358 Ca -0.02 -0.18 0.06 0.00 -0.05 0.00 0.00 57.45 57.26 1i48 n PHE 358 Cb 0.43 -0.07 -0.01 0.00 -0.94 0.00 0.00 39.48 38.88 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 -0.12 -2.16 0.40 1.37 0.00 -1.26 -4.57 105.19 98.85 1i48 n GLY 359 Ca 0.03 -1.43 0.06 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.92 3.57 3.74 -0.02 0.00 -1.26 -3.94 105.19 105.35 1i48 n GLY 360 Ca 0.00 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 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 -1.81 3.63 -0.02 4.61 0.00 -1.26 -1.15 121.76 125.75 1i48 s ALA 361 Ca 0.23 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.49 1i48 s ALA 361 Cb 0.17 -1.99 0.02 0.00 0.00 0.00 0.00 23.12 21.32 1i48 s ALA 361 CO 0.07 0.32 0.01 0.08 0.00 0.00 0.00 175.76 176.24 1i48 s VAL 362 N -0.10 0.08 0.05 0.00 1.01 -0.63 -4.92 120.40 115.90 1i48 s VAL 362 Ca 0.09 0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.24 1i48 s VAL 362 Cb -0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 1i48 s VAL 362 CO 0.00 0.11 -0.09 -0.44 0.00 0.00 0.00 175.10 174.69 1i48 s SER 363 N 0.90 4.48 -0.18 3.32 0.01 -1.09 -0.48 113.70 120.65 1i48 s SER 363 Ca -0.08 -0.27 -0.28 0.00 1.31 0.00 0.00 55.95 56.63 1i48 s SER 363 Cb -0.12 -0.95 0.10 0.00 0.21 0.00 0.00 66.02 65.27 1i48 s SER 363 CO -0.02 0.23 0.86 0.72 0.41 0.00 0.00 173.24 175.45 1i48 s PHE 364 N -1.09 -0.56 -0.11 2.43 -0.71 -0.36 0.90 117.98 118.48 1i48 s PHE 364 Ca 0.19 1.15 -0.13 0.00 -1.04 0.00 0.00 56.93 57.10 1i48 s PHE 364 Cb -0.11 0.38 -0.05 0.00 -1.21 0.00 0.00 43.02 42.03 1i48 s PHE 364 CO 0.10 -0.40 0.32 -1.21 -1.34 0.00 0.00 175.22 172.69 1i48 s GLU 365 N -0.52 4.06 0.09 1.99 2.02 -0.30 -0.78 118.70 125.27 1i48 s GLU 365 Ca -0.03 0.17 -0.15 0.00 0.02 0.00 0.00 54.97 54.99 1i48 s GLU 365 Cb -0.02 -3.34 -0.06 0.00 0.10 0.00 0.00 34.13 30.80 1i48 s GLU 365 CO 0.02 0.43 0.50 0.08 0.02 0.00 0.00 175.26 176.31 1i48 s VAL 366 N -0.13 4.91 -0.76 2.63 1.01 -1.20 -1.40 120.40 125.45 1i48 s VAL 366 Ca 0.19 0.84 -0.21 0.00 0.00 0.00 0.00 61.98 62.80 1i48 s VAL 366 Cb -0.14 -3.75 -0.15 0.00 0.00 0.00 0.00 36.38 32.34 1i48 s VAL 366 CO 0.07 0.38 1.93 -0.67 0.00 0.00 0.00 175.10 176.80 1i48 n ASP 367 N 1.20 2.64 -0.42 3.32 2.03 0.15 -4.68 116.55 120.78 1i48 n ASP 367 Ca -0.08 -2.65 0.00 0.00 0.52 0.00 0.00 54.79 52.58 1i48 n ASP 367 Cb 0.52 -1.10 0.00 0.00 -0.72 0.00 0.00 41.12 39.82 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 4.48 2.02 3.76 0.27 0.00 -1.26 -5.00 105.19 109.46 1i48 n GLY 368 Ca 0.49 -0.81 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 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 0.74 4.50 0.04 1.61 -4.77 -1.26 -4.80 116.67 112.74 1i48 s ASP 369 Ca 0.00 -1.04 -0.08 0.00 -3.30 0.00 0.00 52.55 48.12 1i48 s ASP 369 Cb 0.00 -0.48 -0.02 0.00 -1.09 0.00 0.00 42.92 41.33 1i48 s ASP 369 CO 0.00 -0.56 0.84 -0.11 0.70 0.00 0.00 175.17 176.03 1i48 n LEU 370 N -1.28 -0.29 -0.11 2.11 -0.00 -1.26 0.13 117.00 116.30 1i48 n LEU 370 Ca -0.01 0.90 -0.05 0.00 -0.00 0.00 0.00 56.01 56.85 1i48 n LEU 370 Cb 0.64 -0.27 0.01 0.00 -0.00 0.00 0.00 43.42 43.80 1i48 n LEU 370 CO 0.45 -0.60 0.79 -0.07 -0.00 0.00 0.00 177.39 177.96 1i48 h LEU 371 N 0.00 -0.38 0.27 -1.96 -0.00 -1.96 -1.50 115.31 109.78 1i48 h LEU 371 Ca 0.04 0.12 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 1i48 h LEU 371 Cb 0.11 0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 41.00 1i48 h LEU 371 CO -0.26 -0.13 -0.25 0.74 -0.00 0.00 0.00 178.44 178.54 1i48 h THR 372 N -0.01 0.47 -0.67 0.22 2.02 -1.10 -1.17 112.91 112.67 1i48 h THR 372 Ca 0.18 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.50 1i48 h THR 372 Cb 0.29 0.47 -0.12 0.00 -1.74 0.00 0.00 68.15 67.05 1i48 h THR 372 CO -0.39 0.00 -0.07 0.74 0.37 0.00 0.00 175.52 176.17 1i48 h THR 373 N -0.54 0.38 -0.33 3.16 2.02 0.09 0.21 112.91 117.91 1i48 h THR 373 Ca -0.01 -0.02 0.06 0.00 0.77 0.00 0.00 66.41 67.21 1i48 h THR 373 Cb 0.49 0.32 -0.06 0.00 -1.74 0.00 0.00 68.15 67.16 1i48 h THR 373 CO -0.04 0.01 -0.04 0.00 0.37 0.00 0.00 175.52 175.82 1i48 h ALA 374 N 1.65 0.25 -1.07 6.16 0.00 -0.77 0.70 119.26 126.18 1i48 h ALA 374 Ca 0.35 0.11 0.29 0.00 0.00 0.00 0.00 54.91 55.65 1i48 h ALA 374 Cb 0.57 0.21 -0.09 0.00 0.00 0.00 0.00 17.79 18.48 1i48 h ALA 374 CO -0.63 -0.44 0.70 -0.22 0.00 0.00 0.00 179.25 178.66 1i48 h LYS 375 N 0.04 0.30 0.63 0.00 3.64 0.63 0.11 116.57 121.92 1i48 h LYS 375 Ca 0.16 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 1i48 h LYS 375 Cb 0.23 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1i48 h LYS 375 CO -0.30 0.20 -0.30 0.35 -2.27 0.00 0.00 179.45 177.12 1i48 h PHE 376 N 0.31 -0.78 -0.95 1.91 3.57 -0.14 -1.99 116.94 118.87 1i48 h PHE 376 Ca 0.60 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 62.20 1i48 h PHE 376 Cb 1.68 0.26 -0.08 0.00 2.79 0.00 0.00 35.95 40.60 1i48 h PHE 376 CO -0.00 -0.49 0.61 -0.39 -2.23 0.00 0.00 178.31 175.81 1i48 h VAL 377 N -1.04 0.92 0.00 1.41 -1.51 -1.04 0.38 116.25 115.37 1i48 h VAL 377 Ca -0.09 -0.31 -0.01 0.00 -1.23 0.00 0.00 66.70 65.06 1i48 h VAL 377 Cb 0.65 -0.07 -0.00 0.00 -2.13 0.00 0.00 31.29 29.74 1i48 h VAL 377 CO 0.14 0.17 -0.04 0.44 -1.23 0.00 0.00 177.57 177.04 1i48 h ASP 378 N 0.91 0.00 0.23 4.19 5.19 -0.76 -1.97 116.42 124.20 1i48 h ASP 378 Ca 0.46 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.64 1i48 h ASP 378 Cb 0.51 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.03 1i48 h ASP 378 CO -0.23 0.04 -0.97 0.00 -3.12 0.00 0.00 179.24 174.97 1i48 h ALA 379 N 1.96 0.29 -2.25 3.45 0.00 0.55 -3.46 119.26 119.80 1i48 h ALA 379 Ca -0.00 -0.70 -0.59 0.00 0.00 0.00 0.00 54.91 53.61 1i48 h ALA 379 Cb 0.11 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.03 1i48 h ALA 379 CO 0.01 0.78 0.07 1.28 0.00 0.00 0.00 179.25 181.38 1i48 n LEU 380 N -3.78 2.02 -0.00 0.00 4.77 -0.74 -4.81 117.00 114.46 1i48 n LEU 380 Ca -0.08 1.05 0.02 0.00 -0.03 0.00 0.00 56.01 56.97 1i48 n LEU 380 Cb 0.85 -1.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.61 1i48 n LEU 380 CO 0.53 -1.68 -0.29 0.29 -1.33 0.00 0.00 177.39 174.90 1i48 n LYS 381 N 0.34 2.72 -0.12 3.23 5.02 -1.26 -4.86 118.16 123.23 1i48 n LYS 381 Ca 0.10 -0.02 -0.21 0.00 -2.02 0.00 0.00 58.31 56.16 1i48 n LYS 381 Cb 0.37 -0.92 -0.07 0.00 -0.02 0.00 0.00 35.03 34.39 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 -1.40 1.52 -1.95 -0.18 5.41 -1.26 -4.99 119.36 116.50 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 0.10 -2.09 0.04 0.00 -0.71 0.00 0.00 39.64 36.98 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 -2.68 2.92 0.06 0.38 0.04 -1.26 -4.72 135.00 129.73 1i48 s PRO 383 Ca -0.35 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 62.29 1i48 s PRO 383 Cb 0.10 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.65 1i48 s PRO 383 CO 0.46 -1.22 0.40 0.71 0.04 0.00 0.00 177.00 177.40 1i48 s TYR 384 N -1.79 3.62 -0.60 0.56 2.02 0.19 -4.80 117.35 116.56 1i48 s TYR 384 Ca 0.75 0.85 -0.23 0.00 -0.37 0.00 0.00 57.07 58.06 1i48 s TYR 384 Cb -0.27 -2.20 0.06 0.00 -0.40 0.00 0.00 41.96 39.15 1i48 s TYR 384 CO 0.34 0.55 0.93 0.42 -1.57 0.00 0.00 175.55 176.22 1i48 s ILE 385 N -1.31 4.40 -0.01 2.71 1.01 -1.26 -1.31 121.20 125.43 1i48 s ILE 385 Ca 0.30 -0.10 -0.30 0.00 0.00 0.00 0.00 60.65 60.55 1i48 s ILE 385 Cb -0.15 -4.59 0.11 0.00 0.01 0.00 0.00 42.46 37.84 1i48 s ILE 385 CO 0.16 -1.26 1.15 0.00 0.00 0.00 0.00 174.94 175.00 1i48 s ALA 386 N 3.90 -2.02 1.00 9.38 0.00 -1.02 -4.98 121.76 128.01 1i48 s ALA 386 Ca 0.25 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1i48 s ALA 386 Cb -0.15 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1i48 s ALA 386 CO 0.14 -0.93 0.00 -2.30 0.00 0.00 0.00 175.76 172.67 1i48 n PRO 387 N -0.38 1.75 -1.19 0.00 -0.02 -1.26 -4.51 135.00 129.39 1i48 n PRO 387 Ca -0.06 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.56 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 -6.52 -3.62 2.55 2.88 -1.26 -4.96 113.62 102.70 1i48 n SER 388 Ca 0.00 0.70 0.02 0.00 -1.33 0.00 0.00 58.87 58.26 1i48 n SER 388 Cb 0.00 -3.80 -0.00 0.00 -0.75 0.00 0.00 64.21 59.65 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 -2.93 -0.03 0.00 0.66 -0.12 -1.26 -4.94 117.98 109.36 1i48 s PHE 389 Ca 0.00 -0.05 0.00 0.00 -0.05 0.00 0.00 56.93 56.83 1i48 s PHE 389 Cb 0.00 0.54 0.00 0.00 -0.63 0.00 0.00 43.02 42.93 1i48 s PHE 389 CO 0.00 -0.21 0.00 0.41 -0.05 0.00 0.00 175.22 175.37 1i48 n GLY 390 N -0.52 0.61 3.91 1.99 0.00 -1.26 -4.20 105.19 105.73 1i48 n GLY 390 Ca -0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.82 1.64 0.39 -0.02 0.00 -1.25 -4.24 107.32 102.02 1i48 s GLY 391 Ca 0.00 -0.74 0.10 0.00 0.00 0.00 0.00 44.72 44.08 1i48 s GLY 391 CO 0.00 -0.34 1.97 0.00 0.00 0.00 0.00 173.10 174.73 1i48 s GLU 393 N -5.54 4.63 0.51 0.00 8.01 -1.26 0.30 118.70 125.34 1i48 s GLU 393 Ca -0.09 1.28 -0.21 0.00 0.01 0.00 0.00 54.97 55.97 1i48 s GLU 393 Cb 0.19 -3.35 -0.06 0.00 -4.31 0.00 0.00 34.13 26.60 1i48 s GLU 393 CO 0.76 0.32 1.13 -1.12 0.01 0.00 0.00 175.26 176.36 1i48 s SER 394 N -0.29 5.89 0.02 -0.19 0.01 -1.26 -4.39 113.70 113.49 1i48 s SER 394 Ca 0.42 2.20 0.00 0.00 1.31 0.00 0.00 55.95 59.88 1i48 s SER 394 Cb -0.23 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.40 1i48 s SER 394 CO 0.27 -1.10 -0.04 -0.63 0.41 0.00 0.00 173.24 172.15 1i48 s ILE 395 N -1.71 0.20 0.07 1.44 1.01 -0.25 -0.64 121.20 121.31 1i48 s ILE 395 Ca 0.70 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1i48 s ILE 395 Cb -0.25 -0.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.87 1i48 s ILE 395 CO 0.29 -0.41 -0.04 0.68 0.00 0.00 0.00 174.94 175.45 1i48 s VAL 396 N -1.27 0.43 -0.06 2.92 -7.23 -0.43 -0.11 120.40 114.65 1i48 s VAL 396 Ca -0.13 -1.87 -0.30 0.00 -1.81 0.00 0.00 61.98 57.87 1i48 s VAL 396 Cb -0.09 -1.61 0.11 0.00 0.56 0.00 0.00 36.38 35.36 1i48 s VAL 396 CO -0.01 -0.93 0.97 1.51 -0.31 0.00 0.00 175.10 176.33 1i48 s ASP 397 N -2.98 -0.31 -0.76 4.85 -4.77 -0.85 -2.43 116.67 109.43 1i48 s ASP 397 Ca 0.10 0.01 0.02 0.00 -3.30 0.00 0.00 52.55 49.38 1i48 s ASP 397 Cb 0.07 0.32 0.18 0.00 -1.09 0.00 0.00 42.92 42.40 1i48 s ASP 397 CO -0.07 -0.52 0.58 -1.58 0.70 0.00 0.00 175.17 174.28 1i48 s GLN 398 N -2.89 2.72 0.13 2.11 0.74 -1.26 -1.69 119.66 119.52 1i48 s GLN 398 Ca 0.06 -3.26 0.02 0.00 0.05 0.00 0.00 55.36 52.23 1i48 s GLN 398 Cb -0.01 -3.61 0.35 0.00 1.10 0.00 0.00 33.01 30.83 1i48 s GLN 398 CO -0.08 -1.26 0.65 -2.30 -0.55 0.00 0.00 175.29 171.75 1i48 n PRO 399 N 2.21 -0.03 -0.31 1.67 -0.02 -1.26 0.18 135.00 137.43 1i48 n PRO 399 Ca 0.19 0.61 0.14 0.00 -2.02 0.00 0.00 63.50 62.43 1i48 n PRO 399 Cb 0.36 -0.99 0.32 0.00 -0.02 0.00 0.00 33.50 33.17 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 0.83 1.51 0.00 3.55 0.00 -1.86 -1.28 119.26 122.01 1i48 h ALA 400 Ca 0.26 0.15 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 1i48 h ALA 400 Cb 0.57 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1i48 h ALA 400 CO -0.38 -0.33 -1.37 -0.89 0.00 0.00 0.00 179.25 176.28 1i48 n ILE 401 N -5.01 1.50 -0.32 0.00 5.41 0.48 0.07 119.36 121.48 1i48 n ILE 401 Ca 0.23 -0.00 0.20 0.00 1.00 0.00 0.00 62.75 64.18 1i48 n ILE 401 Cb 0.68 -2.21 0.37 0.00 -0.71 0.00 0.00 39.64 37.77 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 -4.42 -0.07 -0.54 0.38 1.56 0.14 -3.15 117.12 111.02 1i48 n MET 402 Ca -0.25 1.39 -0.00 0.00 -0.27 0.00 0.00 57.70 58.57 1i48 n MET 402 Cb 0.59 -2.31 -0.00 0.00 2.15 0.00 0.00 33.22 33.66 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 -5.34 0.01 0.00 6.12 3.41 -0.65 -4.87 113.62 112.30 1i48 n SER 403 Ca 0.27 -1.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 1i48 n SER 403 Cb 0.90 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 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 0.01 0.00 0.32 7.33 4.02 -0.58 -4.79 117.16 123.48 1i48 n TYR 404 Ca -0.00 -0.00 0.20 0.00 -0.01 0.00 0.00 57.90 58.09 1i48 n TYR 404 Cb 0.64 -0.00 1.11 0.00 -0.02 0.00 0.00 39.34 41.07 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 -0.00 -0.32 0.20 115.95 115.12 1i48 h TRP 405 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1i48 h TRP 405 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.75 1i48 h TRP 405 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 178.44 178.04 1i48 n ASP 406 N -3.28 0.43 -4.93 2.65 5.75 -1.26 -4.77 116.55 111.14 1i48 n ASP 406 Ca -0.03 0.60 -0.20 0.00 -0.01 0.00 0.00 54.79 55.15 1i48 n ASP 406 Cb 0.10 -0.69 -0.02 0.00 -1.03 0.00 0.00 41.12 39.49 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 -3.93 3.79 0.43 -2.12 1.43 0.71 -5.11 118.68 113.89 1i48 s LEU 407 Ca 0.06 -0.34 -0.20 0.00 -1.03 0.00 0.00 54.13 52.62 1i48 s LEU 407 Cb 0.10 -2.51 -0.10 0.00 0.03 0.00 0.00 46.19 43.71 1i48 s LEU 407 CO 0.38 -0.43 0.94 -0.94 0.23 0.00 0.00 176.35 176.53 1i48 s SER 408 N -4.11 6.88 0.47 2.29 1.04 -1.26 -4.83 113.70 114.17 1i48 s SER 408 Ca 0.44 1.64 0.29 0.00 0.48 0.00 0.00 55.95 58.80 1i48 s SER 408 Cb -0.08 -2.52 1.36 0.00 0.10 0.00 0.00 66.02 64.88 1i48 s SER 408 CO 0.29 -0.38 1.75 -0.61 0.98 0.00 0.00 173.24 175.27 1i48 h GLN 409 N 1.78 0.17 0.12 4.02 5.75 -1.96 0.48 115.11 125.47 1i48 h GLN 409 Ca -0.49 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.00 1i48 h GLN 409 Cb 1.18 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.69 1i48 h GLN 409 CO 0.61 0.11 -0.06 0.77 -2.65 0.00 0.00 178.83 177.62 1i48 h SER 410 N 0.17 -0.14 -0.40 -0.69 0.02 -1.99 -3.23 113.55 107.30 1i48 h SER 410 Ca 0.64 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.71 1i48 h SER 410 Cb 2.08 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 64.64 1i48 h SER 410 CO -0.19 0.31 0.43 0.44 -1.14 0.00 0.00 176.83 176.68 1i48 h ASP 411 N -0.98 0.00 -0.02 3.07 3.32 -1.66 -0.35 116.42 119.80 1i48 h ASP 411 Ca -0.02 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 1i48 h ASP 411 Cb 0.12 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 1i48 h ASP 411 CO 0.03 0.00 0.00 0.03 -1.72 0.00 0.00 179.24 177.58 1i48 h ARG 412 N 0.00 0.02 0.00 3.56 3.08 -0.15 -2.50 114.38 118.39 1i48 h ARG 412 Ca 0.19 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 1i48 h ARG 412 Cb 1.05 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.10 1i48 h ARG 412 CO -0.00 0.23 -0.00 0.00 -1.07 0.00 0.00 179.97 179.12 1i48 h ALA 413 N 0.80 1.01 -0.07 0.04 0.00 -1.08 -1.78 119.26 118.18 1i48 h ALA 413 Ca 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1i48 h ALA 413 Cb 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1i48 h ALA 413 CO -0.00 0.00 0.24 -0.22 0.00 0.00 0.00 179.25 179.27 1i48 h LYS 414 N 0.00 0.00 -0.04 0.00 3.64 -1.26 0.43 116.57 119.34 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 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 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 -3.18 0.04 -0.25 1.91 4.01 -0.68 -4.97 117.16 114.04 1i48 n TYR 415 Ca -0.01 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 1i48 n TYR 415 Cb 0.32 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 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 0.09 1.15 3.55 2.72 0.00 0.14 -4.98 105.19 107.86 1i48 n GLY 416 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.75 3.27 0.24 -0.61 -1.09 -1.16 -4.93 121.20 114.17 1i48 s ILE 417 Ca 0.00 0.02 -0.08 0.00 -2.23 0.00 0.00 60.65 58.36 1i48 s ILE 417 Cb 0.00 -3.68 -0.06 0.00 -1.58 0.00 0.00 42.46 37.13 1i48 s ILE 417 CO 0.00 -0.66 0.53 -0.04 -1.23 0.00 0.00 174.94 173.55 1i48 s MET 418 N 7.45 3.73 0.00 2.79 -1.94 -1.26 -4.03 119.30 126.04 1i48 s MET 418 Ca 0.76 0.16 0.09 0.00 -1.71 0.00 0.00 55.69 55.00 1i48 s MET 418 Cb -0.12 -2.67 0.48 0.00 2.01 0.00 0.00 34.83 34.53 1i48 s MET 418 CO 0.16 0.30 1.17 -0.25 -0.01 0.00 0.00 175.02 176.39 1i48 n ASP 419 N -0.34 0.00 -0.07 3.03 9.92 -1.26 -1.89 116.55 125.94 1i48 n ASP 419 Ca -0.00 0.13 -0.11 0.00 -0.53 0.00 0.00 54.79 54.27 1i48 n ASP 419 Cb 0.53 -0.27 -0.09 0.00 -0.64 0.00 0.00 41.12 40.65 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 -1.34 -2.24 -0.00 -1.90 -3.36 115.58 106.75 1i48 h ASN 420 Ca 0.00 -0.61 -0.66 0.00 -0.00 0.00 0.00 56.30 55.03 1i48 h ASN 420 Cb 0.08 0.00 0.11 0.00 -0.00 0.00 0.00 38.32 38.51 1i48 h ASN 420 CO 0.00 0.93 -0.35 -0.11 -0.00 0.00 0.00 177.43 177.90 1i48 n LEU 421 N -4.63 -0.50 -3.77 0.34 7.94 -0.79 -3.28 117.00 112.32 1i48 n LEU 421 Ca -0.11 1.14 -0.14 0.00 -1.11 0.00 0.00 56.01 55.79 1i48 n LEU 421 Cb 0.38 -1.03 -0.15 0.00 0.53 0.00 0.00 43.42 43.14 1i48 n LEU 421 CO 0.22 -2.58 -0.31 -0.69 -1.11 0.00 0.00 177.39 172.91 1i48 s VAL 422 N -0.97 -0.05 -0.16 1.96 1.01 0.04 -4.45 120.40 117.78 1i48 s VAL 422 Ca 0.64 0.19 -0.07 0.00 0.00 0.00 0.00 61.98 62.74 1i48 s VAL 422 Cb -0.89 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 1i48 s VAL 422 CO 0.57 0.08 0.08 -0.13 0.00 0.00 0.00 175.10 175.70 1i48 s ARG 423 N 1.03 3.77 -0.26 2.72 0.52 -0.68 -1.22 118.95 124.83 1i48 s ARG 423 Ca -0.08 -0.29 -0.01 0.00 -0.52 0.00 0.00 55.73 54.83 1i48 s ARG 423 Cb -0.12 -3.19 0.08 0.00 0.52 0.00 0.00 34.95 32.24 1i48 s ARG 423 CO -0.04 0.44 0.03 0.12 0.02 0.00 0.00 175.30 175.88 1i48 s PHE 424 N -0.10 1.85 -0.75 -0.53 2.19 0.37 -2.01 117.98 119.00 1i48 s PHE 424 Ca 0.08 -1.57 -0.20 0.00 0.33 0.00 0.00 56.93 55.57 1i48 s PHE 424 Cb -0.12 -1.55 0.10 0.00 -1.31 0.00 0.00 43.02 40.14 1i48 s PHE 424 CO 0.01 -0.77 0.97 0.45 1.83 0.00 0.00 175.22 177.70 1i48 s SER 425 N 1.57 6.35 0.09 6.13 0.15 0.84 -1.61 113.70 127.23 1i48 s SER 425 Ca 0.02 -1.50 -0.31 0.00 0.70 0.00 0.00 55.95 54.86 1i48 s SER 425 Cb -0.18 -2.38 -0.10 0.00 -1.71 0.00 0.00 66.02 61.65 1i48 s SER 425 CO -0.13 -1.22 1.84 -0.36 1.20 0.00 0.00 173.24 174.57 1i48 s PHE 426 N 3.19 1.93 0.00 3.44 0.08 -0.30 -1.10 117.98 125.23 1i48 s PHE 426 Ca 0.24 -0.10 0.00 0.00 0.12 0.00 0.00 56.93 57.19 1i48 s PHE 426 Cb -0.14 -4.16 0.00 0.00 -0.57 0.00 0.00 43.02 38.15 1i48 s PHE 426 CO 0.02 -4.92 0.00 0.41 -0.10 0.00 0.00 175.22 170.63 1i48 n GLY 427 N 4.29 -1.04 0.43 4.36 0.00 -1.26 -4.83 105.19 107.13 1i48 n GLY 427 Ca 0.18 -1.31 0.05 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.08 0.38 -0.61 1.61 3.14 0.15 -4.66 118.33 118.25 1i48 n VAL 428 Ca 0.00 -0.69 -0.31 0.00 -2.96 0.00 0.00 64.34 60.38 1i48 n VAL 428 Cb 0.00 0.93 0.20 0.00 -1.06 0.00 0.00 33.84 33.91 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 0.46 -1.81 -2.22 1.45 4.71 -1.26 -4.88 120.64 117.10 1i48 n GLU 429 Ca 0.07 -0.50 -0.41 0.00 -0.01 0.00 0.00 57.16 56.31 1i48 n GLU 429 Cb 0.29 -1.90 -0.03 0.00 -1.01 0.00 0.00 31.44 28.80 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 -2.07 6.90 0.02 1.62 2.15 -1.26 -4.91 116.67 119.11 1i48 s ASP 430 Ca 0.61 2.46 -0.05 0.00 0.43 0.00 0.00 52.55 55.99 1i48 s ASP 430 Cb -0.18 -2.62 -0.02 0.00 -0.30 0.00 0.00 42.92 39.80 1i48 s ASP 430 CO 0.66 -0.49 1.09 0.15 -0.17 0.00 0.00 175.17 176.40 1i48 h PHE 431 N 4.79 -0.27 -0.94 -5.34 3.04 -1.99 -1.56 116.94 114.68 1i48 h PHE 431 Ca -0.46 0.01 0.19 0.00 3.98 0.00 0.00 57.97 61.70 1i48 h PHE 431 Cb 1.22 0.12 -0.18 0.00 2.56 0.00 0.00 35.95 39.67 1i48 h PHE 431 CO 0.60 -0.08 -0.21 -0.44 -2.02 0.00 0.00 178.31 176.16 1i48 h ASP 432 N -0.07 -0.84 -0.48 0.41 3.32 -1.98 0.76 116.42 117.54 1i48 h ASP 432 Ca 0.01 0.28 0.08 0.00 0.02 0.00 0.00 57.03 57.42 1i48 h ASP 432 Cb 0.10 0.57 -0.06 0.00 0.22 0.00 0.00 39.33 40.16 1i48 h ASP 432 CO -0.09 -0.31 0.11 0.44 -1.72 0.00 0.00 179.24 177.67 1i48 h ASP 433 N 0.00 0.03 0.59 6.45 3.32 -1.80 -0.16 116.42 124.84 1i48 h ASP 433 Ca 0.46 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.57 1i48 h ASP 433 Cb 0.73 0.11 0.01 0.00 0.22 0.00 0.00 39.33 40.39 1i48 h ASP 433 CO -0.96 0.05 -0.28 -0.07 -1.72 0.00 0.00 179.24 176.25 1i48 h LEU 434 N 0.25 -0.67 -0.32 1.55 3.38 0.13 -2.62 115.31 117.01 1i48 h LEU 434 Ca 0.24 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.23 1i48 h LEU 434 Cb 0.31 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 1i48 h LEU 434 CO -0.30 -0.28 -0.34 0.50 0.09 0.00 0.00 178.44 178.11 1i48 h LYS 435 N -1.15 -0.18 -0.97 1.13 3.64 -0.22 0.16 116.57 118.97 1i48 h LYS 435 Ca -0.08 0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.50 1i48 h LYS 435 Cb 0.64 0.04 -0.18 0.00 -0.41 0.00 0.00 32.23 32.32 1i48 h LYS 435 CO 0.13 -0.12 -0.25 0.00 -2.27 0.00 0.00 179.45 176.94 1i48 h ALA 436 N -0.45 0.60 0.29 5.00 0.00 -1.12 0.20 119.26 123.79 1i48 h ALA 436 Ca 0.05 0.37 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 1i48 h ALA 436 Cb 0.34 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1i48 h ALA 436 CO -0.40 -0.40 -0.28 0.22 0.00 0.00 0.00 179.25 178.39 1i48 h ASP 437 N -0.00 -0.76 -0.69 0.00 3.58 -0.41 0.88 116.42 119.03 1i48 h ASP 437 Ca 0.45 0.06 0.10 0.00 0.42 0.00 0.00 57.03 58.06 1i48 h ASP 437 Cb 0.70 0.25 -0.12 0.00 1.72 0.00 0.00 39.33 41.88 1i48 h ASP 437 CO -0.99 -0.37 -0.45 0.40 -2.88 0.00 0.00 179.24 174.94 1i48 h ILE 438 N -0.56 0.06 -0.12 2.25 2.04 0.15 0.29 117.51 121.62 1i48 h ILE 438 Ca -0.04 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.87 1i48 h ILE 438 Cb 0.49 0.06 -0.05 0.00 -0.74 0.00 0.00 36.82 36.58 1i48 h ILE 438 CO -0.03 0.00 -0.19 -0.07 0.00 0.00 0.00 178.15 177.86 1i48 h LEU 439 N -0.17 -0.58 -0.88 1.44 3.38 -0.59 -1.56 115.31 116.35 1i48 h LEU 439 Ca 0.20 0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.35 1i48 h LEU 439 Cb 0.55 0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.50 1i48 h LEU 439 CO -0.76 -0.24 0.53 -0.61 0.09 0.00 0.00 178.44 177.45 1i48 h GLN 440 N -0.24 0.90 0.00 1.13 -0.00 0.56 0.30 115.11 117.76 1i48 h GLN 440 Ca 0.09 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.69 1i48 h GLN 440 Cb 0.38 -0.20 0.00 0.00 0.00 0.00 0.00 27.48 27.66 1i48 h GLN 440 CO -0.26 0.59 0.00 0.00 0.00 0.00 0.00 178.83 179.16 1i48 n ALA 441 N -2.36 2.04 -0.10 3.38 0.00 0.89 -2.75 120.51 121.60 1i48 n ALA 441 Ca 0.14 -0.09 -0.16 0.00 0.00 0.00 0.00 53.44 53.33 1i48 n ALA 441 Cb 0.24 -1.25 -0.08 0.00 0.00 0.00 0.00 19.45 18.35 1i48 n ALA 441 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i48 n LEU 442 N -1.05 2.52 0.00 0.00 4.77 0.97 -4.37 117.00 119.84 1i48 n LEU 442 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1i48 n LEU 442 Cb 0.07 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.51 1i48 n LEU 442 CO 0.09 0.70 0.42 0.47 -1.33 0.00 0.00 177.39 177.75 1i48 n ASP 443 N -3.32 0.00 -0.90 -1.43 9.92 -0.62 -2.11 116.55 118.09 1i48 n ASP 443 Ca -0.36 0.33 -0.00 0.00 -0.53 0.00 0.00 54.79 54.23 1i48 n ASP 443 Cb 0.84 -0.33 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 1i48 n ASP 443 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1i48 n SER 444 N -1.33 2.56 0.00 -2.24 3.41 -1.23 -5.12 113.62 109.68 1i48 n SER 444 Ca 0.00 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.59 1i48 n SER 444 Cb 0.01 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 1i48 n SER 444 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50