#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i48 s ALA 51 N 0.00 3.33 -0.46 2.98 0.00 -1.26 -5.03 121.76 121.32 1i48 s ALA 51 Ca 0.00 -1.42 0.23 0.00 0.00 0.00 0.00 51.96 50.77 1i48 s ALA 51 Cb 0.00 -1.06 0.22 0.00 0.00 0.00 0.00 23.12 22.28 1i48 s ALA 51 CO 0.00 0.39 1.25 0.66 0.00 0.00 0.00 175.76 178.06 1i48 h SER 52 N 2.21 0.00 -0.52 0.00 4.64 -2.07 -3.31 113.55 114.50 1i48 h SER 52 Ca -0.47 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 1i48 h SER 52 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1i48 h SER 52 CO 0.60 0.05 0.00 2.22 -0.87 0.00 0.00 176.83 178.83 1i48 n PHE 53 N -2.45 0.69 -3.93 4.77 1.16 -1.26 -4.83 117.46 111.62 1i48 n PHE 53 Ca 0.02 -0.44 -0.30 0.00 -1.87 0.00 0.00 57.45 54.86 1i48 n PHE 53 Cb 0.49 -0.01 -0.16 0.00 -1.61 0.00 0.00 39.48 38.20 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 -1.07 2.66 -0.10 5.98 1.43 -1.25 -4.97 118.68 121.37 1i48 s LEU 54 Ca 0.37 -1.26 -0.05 0.00 -1.03 0.00 0.00 54.13 52.17 1i48 s LEU 54 Cb 0.20 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 1i48 s LEU 54 CO 0.27 -0.26 -0.12 0.59 0.23 0.00 0.00 176.35 177.05 1i48 n ASN 55 N 4.66 0.69 -4.68 2.29 3.02 -1.26 -4.64 115.26 115.34 1i48 n ASN 55 Ca -0.10 0.12 -0.44 0.00 -0.03 0.00 0.00 54.58 54.12 1i48 n ASN 55 Cb 0.44 -0.29 -0.02 0.00 -0.61 0.00 0.00 39.78 39.30 1i48 n ASN 55 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1i48 n SER 56 N -3.44 2.93 -0.20 6.41 2.88 -1.26 -4.86 113.62 116.08 1i48 n SER 56 Ca -0.19 1.15 -0.00 0.00 -1.33 0.00 0.00 58.87 58.50 1i48 n SER 56 Cb 0.63 -1.46 0.11 0.00 -0.75 0.00 0.00 64.21 62.74 1i48 n SER 56 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1i48 h ASP 57 N 4.15 0.21 -0.37 -3.46 3.32 -2.00 -2.42 116.42 115.86 1i48 h ASP 57 Ca -0.45 0.08 0.06 0.00 0.02 0.00 0.00 57.03 56.74 1i48 h ASP 57 Cb 1.27 0.06 -0.09 0.00 0.22 0.00 0.00 39.33 40.79 1i48 h ASP 57 CO 0.75 0.13 -0.44 1.23 -1.72 0.00 0.00 179.24 179.19 1i48 h GLY 58 N 0.40 -0.61 0.14 2.75 0.00 -1.98 0.32 103.07 104.09 1i48 h GLY 58 Ca 0.31 0.55 0.19 0.00 0.00 0.00 0.00 47.33 48.38 1i48 h GLY 58 CO -0.31 -0.18 0.61 1.76 0.00 0.00 0.00 176.54 178.42 1i48 h SER 59 N -0.35 0.75 0.57 0.19 0.02 -1.81 -1.88 113.55 111.02 1i48 h SER 59 Ca 0.13 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 1i48 h SER 59 Cb 0.59 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 63.09 1i48 h SER 59 CO -0.55 0.27 -0.27 0.58 -1.14 0.00 0.00 176.83 175.71 1i48 h VAL 60 N 0.73 0.19 0.00 2.27 2.07 -0.45 -1.16 116.25 119.90 1i48 h VAL 60 Ca 0.57 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.67 1i48 h VAL 60 Cb 0.93 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1i48 h VAL 60 CO -0.36 0.03 0.44 0.00 0.02 0.00 0.00 177.57 177.70 1i48 h ALA 61 N -0.95 1.30 0.00 1.67 0.00 0.22 1.03 119.26 122.53 1i48 h ALA 61 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.46 1i48 h ALA 61 Cb 0.63 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 1i48 h ALA 61 CO 0.13 -0.30 -2.04 -0.89 0.00 0.00 0.00 179.25 176.14 1i48 n ILE 62 N -2.03 1.53 0.80 0.00 5.41 -0.78 -4.10 119.36 120.19 1i48 n ILE 62 Ca -0.01 -0.25 0.09 0.00 1.00 0.00 0.00 62.75 63.58 1i48 n ILE 62 Cb 0.45 -1.93 -0.01 0.00 -0.71 0.00 0.00 39.64 37.44 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 -4.29 0.00 -1.68 1.39 8.25 -0.30 -4.87 115.22 113.72 1i48 n HIS 63 Ca -0.46 0.00 -0.48 0.00 -0.26 0.00 0.00 57.72 56.52 1i48 n HIS 63 Cb 0.81 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.88 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 -0.24 0.93 -2.03 -1.41 0.00 0.34 -1.33 120.51 116.78 1i48 n ALA 64 Ca 0.07 0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.73 1i48 n ALA 64 Cb 0.36 -2.45 -0.01 0.00 0.00 0.00 0.00 19.45 17.35 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 4.14 0.18 1.81 0.00 0.00 -1.26 -4.14 105.19 105.92 1i48 n GLY 65 Ca 0.21 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.16 0.00 -0.23 1.61 1.02 -0.44 -4.75 120.64 115.69 1i48 n GLU 66 Ca -0.12 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.13 1i48 n GLU 66 Cb 0.55 0.00 0.22 0.00 -0.02 0.00 0.00 31.44 32.19 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 -2.35 -0.05 0.01 3.49 3.00 -0.88 -2.10 116.66 117.77 1i48 n ARG 67 Ca 0.00 0.99 -0.01 0.00 -0.00 0.00 0.00 57.85 58.83 1i48 n ARG 67 Cb 0.00 -1.59 -0.00 0.00 0.00 0.00 0.00 32.46 30.87 1i48 n ARG 67 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1i48 h LEU 68 N 0.00 -0.05 -8.34 6.15 3.38 -1.93 -3.50 115.31 111.03 1i48 h LEU 68 Ca 0.42 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.28 1i48 h LEU 68 Cb 0.91 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 1i48 h LEU 68 CO -0.61 0.10 -0.21 -0.83 0.09 0.00 0.00 178.44 176.98 1i48 s GLY 69 N -2.33 0.82 0.00 0.83 0.00 -0.89 -5.07 107.32 100.68 1i48 s GLY 69 Ca -0.01 -1.11 0.00 0.00 0.00 0.00 0.00 44.72 43.61 1i48 s GLY 69 CO 0.02 -0.81 0.00 0.54 0.00 0.00 0.00 173.10 172.86 1i48 n ARG 70 N -0.39 1.06 -1.38 2.90 1.74 -1.26 -3.72 116.66 115.61 1i48 n ARG 70 Ca -0.01 -0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.94 1i48 n ARG 70 Cb 0.63 -0.09 -0.06 0.00 -1.02 0.00 0.00 32.46 31.92 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 0.15 1.34 0.00 -0.13 0.00 -1.26 -4.72 105.19 100.57 1i48 n GLY 71 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.49 0.14 -0.01 -0.61 0.00 -1.26 -5.08 119.36 110.05 1i48 n ILE 72 Ca -0.13 -0.14 0.00 0.00 0.00 0.00 0.00 62.75 62.48 1i48 n ILE 72 Cb 0.49 0.93 0.00 0.00 0.00 0.00 0.00 39.64 41.06 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 -0.07 0.00 -3.55 9.51 0.31 -1.26 -5.03 118.33 118.24 1i48 n VAL 73 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 1i48 n VAL 73 Cb 0.47 -0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.34 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 -1.16 2.52 -4.23 -1.26 -5.00 115.64 106.51 1i48 s THR 74 Ca 0.00 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.60 1i48 s THR 74 Cb 0.00 -1.00 0.37 0.00 1.34 0.00 0.00 72.50 73.21 1i48 s THR 74 CO 0.00 0.00 1.18 -0.90 -0.54 0.00 0.00 174.62 174.36 1i48 n ASP 75 N 0.78 2.81 -4.84 3.99 5.68 -1.26 -4.88 116.55 118.83 1i48 n ASP 75 Ca -0.14 -2.28 -0.34 0.00 -0.50 0.00 0.00 54.79 51.53 1i48 n ASP 75 Cb 0.58 -0.46 -0.06 0.00 -1.14 0.00 0.00 41.12 40.04 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 -1.73 3.41 -0.01 2.12 0.00 -1.26 -5.01 121.76 119.28 1i48 s ALA 76 Ca 0.26 0.01 -0.22 0.00 0.00 0.00 0.00 51.96 52.01 1i48 s ALA 76 Cb 0.18 -2.71 -0.22 0.00 0.00 0.00 0.00 23.12 20.38 1i48 s ALA 76 CO 0.11 0.37 1.12 0.82 0.00 0.00 0.00 175.76 178.19 1i48 h ILE 77 N 2.27 1.46 -3.69 0.00 5.03 -2.04 -3.46 117.51 117.08 1i48 h ILE 77 Ca -0.48 -1.88 -0.47 0.00 -0.12 0.00 0.00 64.86 61.91 1i48 h ILE 77 Cb 1.18 2.51 0.06 0.00 -3.03 0.00 0.00 36.82 37.54 1i48 h ILE 77 CO 0.66 0.54 0.19 0.42 -0.68 0.00 0.00 178.15 179.27 1i48 s THR 78 N -3.39 3.53 0.07 -0.27 -4.23 -1.26 -4.98 115.64 105.10 1i48 s THR 78 Ca -0.14 -0.01 -0.30 0.00 -1.18 0.00 0.00 61.69 60.06 1i48 s THR 78 Cb 0.03 -3.41 -0.05 0.00 1.34 0.00 0.00 72.50 70.41 1i48 s THR 78 CO 0.78 -0.43 1.00 -0.89 -0.54 0.00 0.00 174.62 174.54 1i48 s THR 79 N -3.02 4.55 0.26 3.99 2.01 -1.26 -5.01 115.64 117.15 1i48 s THR 79 Ca 0.55 1.97 -0.30 0.00 0.31 0.00 0.00 61.69 64.22 1i48 s THR 79 Cb -0.11 -4.26 -0.09 0.00 0.01 0.00 0.00 72.50 68.05 1i48 s THR 79 CO 0.45 0.23 1.07 -2.16 -0.69 0.00 0.00 174.62 173.52 1i48 s PRO 80 N 0.48 4.68 -0.47 4.92 0.04 -1.26 -5.00 135.00 138.39 1i48 s PRO 80 Ca 0.50 1.73 -0.24 0.00 0.04 0.00 0.00 61.00 63.03 1i48 s PRO 80 Cb -0.24 -3.22 0.03 0.00 0.04 0.00 0.00 34.50 31.12 1i48 s PRO 80 CO 0.29 0.26 0.85 0.08 0.04 0.00 0.00 177.00 178.52 1i48 s VAL 81 N -1.05 4.55 -0.47 -0.36 1.01 -1.26 -4.52 120.40 118.31 1i48 s VAL 81 Ca 0.44 0.50 -0.20 0.00 0.00 0.00 0.00 61.98 62.72 1i48 s VAL 81 Cb -0.30 -4.39 0.04 0.00 0.00 0.00 0.00 36.38 31.72 1i48 s VAL 81 CO 0.38 -0.82 0.64 -0.69 0.00 0.00 0.00 175.10 174.62 1i48 s VAL 82 N 3.54 4.83 -1.15 2.92 1.01 -1.26 -4.99 120.40 125.30 1i48 s VAL 82 Ca 0.32 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.11 1i48 s VAL 82 Cb -0.12 -4.25 0.26 0.00 0.00 0.00 0.00 36.38 32.27 1i48 s VAL 82 CO 0.23 -0.70 1.58 0.59 0.00 0.00 0.00 175.10 176.80 1i48 n ASN 83 N 6.27 5.91 -4.37 3.32 3.02 -1.26 -4.78 115.26 123.38 1i48 n ASN 83 Ca -0.04 -3.28 -0.30 0.00 -0.03 0.00 0.00 54.58 50.94 1i48 n ASN 83 Cb 0.47 -1.35 -0.14 0.00 -0.61 0.00 0.00 39.78 38.15 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 -1.56 2.20 -0.43 3.41 -1.32 -1.26 -5.01 115.64 111.67 1i48 s THR 84 Ca 0.34 -1.58 0.23 0.00 -1.21 0.00 0.00 61.69 59.47 1i48 s THR 84 Cb 0.05 -1.91 -0.08 0.00 -1.51 0.00 0.00 72.50 69.04 1i48 s THR 84 CO 0.06 0.23 1.01 -1.54 -2.21 0.00 0.00 174.62 172.17 1i48 n SER 85 N 1.34 0.63 -3.20 8.08 3.41 -1.26 -4.74 113.62 117.88 1i48 n SER 85 Ca -0.17 0.03 -0.07 0.00 -0.26 0.00 0.00 58.87 58.39 1i48 n SER 85 Cb 0.52 0.74 0.01 0.00 -0.26 0.00 0.00 64.21 65.22 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 -3.28 -0.98 -0.03 7.33 0.00 -1.26 -2.28 121.76 121.25 1i48 s ALA 86 Ca 0.01 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.43 1i48 s ALA 86 Cb 0.13 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.96 1i48 s ALA 86 CO 0.80 -1.01 -0.12 0.71 0.00 0.00 0.00 175.76 176.14 1i48 s TYR 87 N -2.64 1.23 0.61 0.00 1.51 -1.12 -4.85 117.35 112.10 1i48 s TYR 87 Ca 0.15 -0.33 0.01 0.00 -1.01 0.00 0.00 57.07 55.89 1i48 s TYR 87 Cb -0.05 -0.85 0.07 0.00 -0.11 0.00 0.00 41.96 41.02 1i48 s TYR 87 CO 0.09 -0.13 0.85 -0.59 -1.11 0.00 0.00 175.55 174.67 1i48 s PHE 88 N 0.15 2.30 0.04 2.71 -0.12 -1.26 -4.79 117.98 117.00 1i48 s PHE 88 Ca -0.04 -0.16 0.06 0.00 -0.05 0.00 0.00 56.93 56.74 1i48 s PHE 88 Cb -0.10 -2.80 -0.02 0.00 -0.63 0.00 0.00 43.02 39.47 1i48 s PHE 88 CO 0.01 -1.20 -0.16 -0.06 -0.05 0.00 0.00 175.22 173.76 1i48 s PHE 89 N -2.89 1.43 0.16 3.49 0.40 -1.26 -5.05 117.98 114.25 1i48 s PHE 89 Ca 0.61 -0.35 -0.11 0.00 -0.60 0.00 0.00 56.93 56.47 1i48 s PHE 89 Cb -0.08 -0.85 0.04 0.00 0.51 0.00 0.00 43.02 42.63 1i48 s PHE 89 CO 0.41 0.05 1.62 -0.91 0.70 0.00 0.00 175.22 177.09 1i48 h ASN 90 N 4.96 0.91 -5.01 1.36 2.35 -2.00 -3.46 115.58 114.70 1i48 h ASN 90 Ca -0.39 -0.29 -0.07 0.00 -0.55 0.00 0.00 56.30 55.00 1i48 h ASN 90 Cb 1.17 -0.24 -0.17 0.00 0.05 0.00 0.00 38.32 39.12 1i48 h ASN 90 CO 0.44 0.98 0.06 -1.59 -1.65 0.00 0.00 177.43 175.68 1i48 s LYS 91 N -5.07 1.01 0.28 0.81 -2.85 -1.26 -5.05 119.74 107.62 1i48 s LYS 91 Ca -0.12 -0.06 0.00 0.00 -1.00 0.00 0.00 55.97 54.79 1i48 s LYS 91 Cb 0.12 0.47 0.67 0.00 -2.06 0.00 0.00 37.83 37.03 1i48 s LYS 91 CO 0.83 -0.34 1.63 1.15 0.10 0.00 0.00 175.35 178.72 1i48 h THR 92 N 2.96 0.27 -0.96 3.79 2.02 -2.00 0.33 112.91 119.33 1i48 h THR 92 Ca -0.29 -0.05 0.24 0.00 0.77 0.00 0.00 66.41 67.07 1i48 h THR 92 Cb 1.19 0.11 -0.13 0.00 -1.74 0.00 0.00 68.15 67.58 1i48 h THR 92 CO 0.40 0.03 0.51 0.77 0.37 0.00 0.00 175.52 177.60 1i48 h SER 93 N 0.16 0.52 -0.18 4.18 4.64 -2.00 0.49 113.55 121.36 1i48 h SER 93 Ca 0.53 0.15 -0.09 0.00 -0.47 0.00 0.00 61.79 61.91 1i48 h SER 93 Cb 1.06 0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1i48 h SER 93 CO -0.70 0.04 -0.22 -0.33 -0.87 0.00 0.00 176.83 174.76 1i48 h GLU 94 N 0.49 0.46 -0.86 4.77 5.08 -0.77 -2.31 114.58 121.44 1i48 h GLU 94 Ca 0.61 -0.26 0.11 0.00 -1.00 0.00 0.00 59.36 58.82 1i48 h GLU 94 Cb 1.18 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.37 1i48 h GLU 94 CO -0.51 0.85 0.49 1.25 -1.00 0.00 0.00 179.01 180.09 1i48 h LEU 95 N 0.11 0.68 0.21 1.33 5.85 -0.63 -0.20 115.31 122.66 1i48 h LEU 95 Ca 0.02 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1i48 h LEU 95 Cb 0.78 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.75 1i48 h LEU 95 CO 0.05 0.36 -0.10 0.40 -0.34 0.00 0.00 178.44 178.81 1i48 h ILE 96 N 0.78 0.83 -0.48 4.05 2.04 -0.96 0.14 117.51 123.91 1i48 h ILE 96 Ca 0.43 -0.18 0.10 0.00 1.00 0.00 0.00 64.86 66.21 1i48 h ILE 96 Cb 0.46 0.94 -0.10 0.00 -0.74 0.00 0.00 36.82 37.37 1i48 h ILE 96 CO -0.28 0.04 -0.24 0.44 0.00 0.00 0.00 178.15 178.11 1i48 h ASP 97 N -0.37 -0.82 0.02 1.72 5.19 -0.64 0.87 116.42 122.39 1i48 h ASP 97 Ca -0.03 0.18 -0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1i48 h ASP 97 Cb 0.28 0.44 0.00 0.00 0.18 0.00 0.00 39.33 40.23 1i48 h ASP 97 CO 0.05 -0.26 -0.01 0.15 -3.12 0.00 0.00 179.24 176.05 1i48 h PHE 98 N -0.13 -0.03 -0.06 4.55 3.57 -0.90 0.68 116.94 124.62 1i48 h PHE 98 Ca 0.22 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1i48 h PHE 98 Cb 0.48 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.23 1i48 h PHE 98 CO -0.51 -0.02 0.04 0.87 -2.23 0.00 0.00 178.31 176.47 1i48 h LYS 99 N -0.03 0.02 -0.37 1.11 1.79 0.26 0.32 116.57 119.66 1i48 h LYS 99 Ca -0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1i48 h LYS 99 Cb 0.03 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1i48 h LYS 99 CO 0.01 0.01 0.00 0.39 -1.08 0.00 0.00 179.45 178.78 1i48 n GLU 100 N -4.52 1.85 -3.33 3.15 -0.58 0.29 -4.92 120.64 112.57 1i48 n GLU 100 Ca -0.02 -1.32 -0.17 0.00 -0.42 0.00 0.00 57.16 55.24 1i48 n GLU 100 Cb 0.13 -1.29 0.08 0.00 -0.57 0.00 0.00 31.44 29.80 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 0.57 -6.24 0.00 3.49 4.01 0.11 -4.92 118.16 115.18 1i48 n LYS 101 Ca 0.12 0.77 0.00 0.00 -0.51 0.00 0.00 58.31 58.69 1i48 n LYS 101 Cb 0.31 -5.57 0.00 0.00 -0.51 0.00 0.00 35.03 29.26 1i48 n LYS 101 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1i48 n ARG 102 N -3.98 5.91 -4.37 1.97 1.74 0.22 -4.98 116.66 113.18 1i48 n ARG 102 Ca -0.22 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.68 1i48 n ARG 102 Cb 0.64 -0.53 -0.10 0.00 -1.02 0.00 0.00 32.46 31.44 1i48 n ARG 102 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1i48 s ARG 103 N -1.06 1.50 -0.11 5.56 3.52 -1.22 -4.85 118.95 122.31 1i48 s ARG 103 Ca 0.00 -1.82 0.01 0.00 -0.13 0.00 0.00 55.73 53.79 1i48 s ARG 103 Cb 0.00 -0.51 -0.02 0.00 -1.56 0.00 0.00 34.95 32.86 1i48 s ARG 103 CO 0.00 -0.25 -0.14 0.00 -0.81 0.00 0.00 175.30 174.10 1i48 s ALA 104 N -3.57 2.59 -0.22 6.12 0.00 -1.26 -4.63 121.76 120.80 1i48 s ALA 104 Ca 0.37 -0.92 -0.31 0.00 0.00 0.00 0.00 51.96 51.10 1i48 s ALA 104 Cb 0.08 -1.12 0.16 0.00 0.00 0.00 0.00 23.12 22.24 1i48 s ALA 104 CO 0.14 0.33 1.20 0.45 0.00 0.00 0.00 175.76 177.88 1i48 s SER 105 N 0.07 -0.17 0.31 0.00 0.15 -1.26 -5.03 113.70 107.77 1i48 s SER 105 Ca -0.06 0.15 0.24 0.00 0.70 0.00 0.00 55.95 56.98 1i48 s SER 105 Cb -0.15 0.15 0.37 0.00 -1.71 0.00 0.00 66.02 64.69 1i48 s SER 105 CO 0.05 -0.19 1.50 -0.26 1.20 0.00 0.00 173.24 175.53 1i48 h PHE 106 N 2.20 0.00 0.00 3.44 0.04 -1.93 -3.47 116.94 117.22 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 -2.72 0.00 -4.34 1.51 2.13 -1.26 -4.43 120.64 111.53 1i48 n GLU 107 Ca 0.03 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.63 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 1.87 0.55 4.31 5.04 -1.26 -2.77 117.35 125.08 1i48 s TYR 108 Ca 0.00 -0.45 0.22 0.00 -2.44 0.00 0.00 57.07 54.40 1i48 s TYR 108 Cb 0.00 -0.94 1.49 0.00 0.35 0.00 0.00 41.96 42.86 1i48 s TYR 108 CO 0.00 0.34 2.17 0.78 -1.34 0.00 0.00 175.55 177.49 1i48 h GLY 109 N 3.31 0.00 2.00 8.97 0.00 -1.67 0.20 103.07 115.88 1i48 h GLY 109 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1i48 h GLY 109 CO 0.50 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 176.95 1i48 h ARG 110 N 0.00 0.00 -0.47 4.80 2.43 -1.91 -3.03 114.38 116.19 1i48 h ARG 110 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1i48 h ARG 110 Cb 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1i48 h ARG 110 CO -0.00 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.12 1i48 n TYR 111 N -2.80 0.63 0.00 2.20 4.01 0.05 -4.75 117.16 116.50 1i48 n TYR 111 Ca 0.03 -0.31 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 1i48 n TYR 111 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 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 1.37 1.92 3.64 2.72 0.00 -1.15 -4.84 105.19 108.85 1i48 n GLY 112 Ca 0.18 -1.77 -0.07 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.56 0.27 1.61 3.84 -1.26 -4.42 114.94 114.41 1i48 s ASN 113 Ca 0.00 0.98 -0.02 0.00 0.21 0.00 0.00 52.86 54.03 1i48 s ASN 113 Cb 0.00 1.10 0.45 0.00 -0.55 0.00 0.00 41.25 42.25 1i48 s ASN 113 CO 0.00 -0.16 1.85 1.55 -2.79 0.00 0.00 177.10 177.55 1i48 h PRO 114 N 5.26 1.01 -0.17 0.43 0.13 -1.97 0.66 132.00 137.36 1i48 h PRO 114 Ca -0.28 -0.06 -0.10 0.00 -0.87 0.00 0.00 66.00 64.69 1i48 h PRO 114 Cb 1.19 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 1i48 h PRO 114 CO 0.14 0.67 -0.31 1.15 -0.23 0.00 0.00 178.00 179.41 1i48 h THR 115 N 1.04 1.28 0.05 1.56 2.02 -1.89 -3.24 112.91 113.72 1i48 h THR 115 Ca 0.44 -1.33 -0.00 0.00 0.77 0.00 0.00 66.41 66.29 1i48 h THR 115 Cb 0.31 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1i48 h THR 115 CO -0.22 0.41 -0.02 0.74 0.37 0.00 0.00 175.52 176.80 1i48 h THR 116 N 0.30 1.29 -1.30 3.16 2.02 -1.49 -3.29 112.91 113.61 1i48 h THR 116 Ca 0.04 -1.60 0.38 0.00 0.77 0.00 0.00 66.41 65.99 1i48 h THR 116 Cb 0.71 2.27 -0.07 0.00 -1.74 0.00 0.00 68.15 69.32 1i48 h THR 116 CO 0.05 0.38 0.90 -0.37 0.37 0.00 0.00 175.52 176.85 1i48 h VAL 117 N -0.84 0.33 0.71 3.16 -1.51 -0.99 0.84 116.25 117.96 1i48 h VAL 117 Ca -0.01 -0.03 -0.03 0.00 -1.23 0.00 0.00 66.70 65.40 1i48 h VAL 117 Cb 0.66 0.24 0.00 0.00 -2.13 0.00 0.00 31.29 30.06 1i48 h VAL 117 CO 0.01 0.02 -0.38 0.58 -1.23 0.00 0.00 177.57 176.57 1i48 h VAL 118 N 0.09 0.00 -0.97 7.19 2.07 -1.62 0.58 116.25 123.58 1i48 h VAL 118 Ca 0.66 0.00 0.19 0.00 0.82 0.00 0.00 66.70 68.37 1i48 h VAL 118 Cb 2.39 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 32.07 1i48 h VAL 118 CO -0.12 0.00 0.61 0.25 0.02 0.00 0.00 177.57 178.33 1i48 h LEU 119 N -1.00 0.68 0.24 2.57 5.85 -1.06 0.60 115.31 123.20 1i48 h LEU 119 Ca -0.10 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1i48 h LEU 119 Cb 0.78 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1i48 h LEU 119 CO 0.13 0.27 -0.16 -0.33 -0.34 0.00 0.00 178.44 178.01 1i48 h GLU 120 N 0.68 -0.38 -0.67 1.25 5.08 -0.12 -0.66 114.58 119.76 1i48 h GLU 120 Ca 0.53 0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.85 1i48 h GLU 120 Cb 0.94 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1i48 h GLU 120 CO -0.30 -0.25 0.13 0.93 -1.00 0.00 0.00 179.01 178.52 1i48 h GLU 121 N -0.39 1.09 0.39 2.33 5.08 0.19 -1.15 114.58 122.12 1i48 h GLU 121 Ca -0.02 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1i48 h GLU 121 Cb 0.33 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1i48 h GLU 121 CO 0.01 0.99 -0.49 -0.22 -1.00 0.00 0.00 179.01 178.30 1i48 h LYS 122 N 1.03 -0.87 -0.42 2.33 3.64 0.46 -0.11 116.57 122.62 1i48 h LYS 122 Ca 0.21 0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1i48 h LYS 122 Cb 0.41 0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.37 1i48 h LYS 122 CO 0.01 -0.58 0.11 0.82 -2.27 0.00 0.00 179.45 177.53 1i48 h ILE 123 N -0.91 0.80 -0.74 2.00 2.04 -1.06 -1.38 117.51 118.27 1i48 h ILE 123 Ca -0.05 -0.08 0.17 0.00 1.00 0.00 0.00 64.86 65.89 1i48 h ILE 123 Cb 0.81 0.54 -0.13 0.00 -0.74 0.00 0.00 36.82 37.30 1i48 h ILE 123 CO -0.12 0.04 0.02 0.28 0.00 0.00 0.00 178.15 178.38 1i48 h SER 124 N 0.25 -0.31 -0.36 1.72 0.02 -0.75 0.13 113.55 114.24 1i48 h SER 124 Ca 0.20 0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 61.32 1i48 h SER 124 Cb 0.23 0.32 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 1i48 h SER 124 CO -0.25 -0.16 0.16 0.00 -1.14 0.00 0.00 176.83 175.44 1i48 h ALA 125 N 1.68 0.47 0.68 3.77 0.00 0.04 0.39 119.26 126.29 1i48 h ALA 125 Ca 0.40 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1i48 h ALA 125 Cb 0.70 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1i48 h ALA 125 CO -0.64 0.05 -0.45 -0.07 0.00 0.00 0.00 179.25 178.14 1i48 h LEU 126 N 0.44 -1.17 0.00 0.00 3.38 -0.32 -1.05 115.31 116.60 1i48 h LEU 126 Ca 0.12 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1i48 h LEU 126 Cb 0.15 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1i48 h LEU 126 CO -0.01 -0.68 0.00 -0.62 0.09 0.00 0.00 178.44 177.22 1i48 n GLU 127 N -5.28 0.15 -3.62 1.13 -0.58 -0.21 -4.84 120.64 107.39 1i48 n GLU 127 Ca -0.13 0.18 -0.22 0.00 -0.42 0.00 0.00 57.16 56.57 1i48 n GLU 127 Cb 0.45 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.89 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 -0.35 -0.42 4.00 0.62 0.00 0.22 -4.78 105.19 104.47 1i48 n GLY 128 Ca 0.05 0.17 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.41 4.55 0.07 4.61 0.00 0.11 -4.96 121.76 122.73 1i48 s ALA 129 Ca 0.28 -1.86 -0.05 0.00 0.00 0.00 0.00 51.96 50.32 1i48 s ALA 129 Cb -0.13 -1.40 -0.28 0.00 0.00 0.00 0.00 23.12 21.31 1i48 s ALA 129 CO 0.77 -0.54 1.14 1.49 0.00 0.00 0.00 175.76 178.61 1i48 h GLU 130 N 0.50 0.30 -2.14 0.00 4.81 -1.75 -3.43 114.58 112.86 1i48 h GLU 130 Ca -0.35 -0.50 0.06 0.00 -0.13 0.00 0.00 59.36 58.43 1i48 h GLU 130 Cb 1.28 0.19 -0.17 0.00 0.63 0.00 0.00 28.75 30.68 1i48 h GLU 130 CO 0.46 1.24 0.43 0.45 -0.73 0.00 0.00 179.01 180.85 1i48 s SER 131 N -7.19 -0.43 0.10 1.04 0.15 -0.56 -4.78 113.70 102.03 1i48 s SER 131 Ca -0.04 0.21 0.05 0.00 0.70 0.00 0.00 55.95 56.86 1i48 s SER 131 Cb 0.07 0.41 -0.03 0.00 -1.71 0.00 0.00 66.02 64.76 1i48 s SER 131 CO 0.89 -0.59 -0.13 -0.89 1.20 0.00 0.00 173.24 173.71 1i48 s THR 132 N -2.40 1.17 0.10 6.45 2.01 -1.26 -1.37 115.64 120.33 1i48 s THR 132 Ca 0.00 -1.53 0.09 0.00 0.31 0.00 0.00 61.69 60.56 1i48 s THR 132 Cb -0.01 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 1i48 s THR 132 CO -0.04 -0.36 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.08 1i48 s LEU 133 N -2.15 2.27 -0.14 4.42 2.96 0.17 -4.89 118.68 121.33 1i48 s LEU 133 Ca 0.04 -0.67 0.00 0.00 -0.22 0.00 0.00 54.13 53.28 1i48 s LEU 133 Cb -0.07 -1.01 0.02 0.00 0.50 0.00 0.00 46.19 45.63 1i48 s LEU 133 CO 0.02 0.12 -0.13 -0.76 -1.32 0.00 0.00 176.35 174.28 1i48 s LEU 134 N -1.78 1.61 0.00 -0.68 1.43 -1.26 -1.37 118.68 116.62 1i48 s LEU 134 Ca 0.09 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.76 1i48 s LEU 134 Cb -0.10 -1.11 0.02 0.00 0.03 0.00 0.00 46.19 45.03 1i48 s LEU 134 CO 0.04 -0.06 0.17 0.23 0.23 0.00 0.00 176.35 176.96 1i48 n MET 135 N 4.73 0.85 0.10 1.70 2.81 -0.42 -4.34 117.12 122.54 1i48 n MET 135 Ca -0.17 -0.63 0.12 0.00 -1.81 0.00 0.00 57.70 55.22 1i48 n MET 135 Cb 0.50 -0.06 0.23 0.00 -0.71 0.00 0.00 33.22 33.18 1i48 n MET 135 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1i48 h ALA 136 N 0.28 0.77 -1.41 3.04 0.00 -1.63 -3.25 119.26 117.05 1i48 h ALA 136 Ca -0.06 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.98 1i48 h ALA 136 Cb 0.25 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.80 1i48 h ALA 136 CO 0.08 0.00 0.67 -1.54 0.00 0.00 0.00 179.25 178.45 1i48 s SER 137 N -4.71 -0.27 0.22 0.00 1.04 -1.26 -3.11 113.70 105.61 1i48 s SER 137 Ca 0.07 0.32 -0.15 0.00 0.48 0.00 0.00 55.95 56.67 1i48 s SER 137 Cb 0.12 0.25 0.25 0.00 0.10 0.00 0.00 66.02 66.73 1i48 s SER 137 CO 0.68 -0.23 1.59 1.23 0.98 0.00 0.00 173.24 177.49 1i48 h GLY 138 N 2.54 0.29 -0.39 7.32 0.00 -1.83 0.29 103.07 111.28 1i48 h GLY 138 Ca -0.16 0.34 0.13 0.00 0.00 0.00 0.00 47.33 47.64 1i48 h GLY 138 CO 0.27 -0.26 -0.19 -0.33 0.00 0.00 0.00 176.54 176.03 1i48 h MET 139 N -0.06 -0.02 0.21 4.80 2.86 -1.95 0.19 114.93 120.97 1i48 h MET 139 Ca 0.32 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.97 1i48 h MET 139 Cb 0.56 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.20 1i48 h MET 139 CO -0.77 -0.01 -0.30 0.00 1.06 0.00 0.00 176.91 176.89 1i48 n ALA 141 N -2.63 -0.12 -0.05 0.00 0.00 0.46 0.77 120.51 118.94 1i48 n ALA 141 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 1i48 n ALA 141 Cb 0.32 0.37 -0.03 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.98 -0.50 0.00 4.64 -0.95 0.16 113.55 115.91 1i48 h SER 142 Ca 0.00 0.16 0.10 0.00 -0.47 0.00 0.00 61.79 61.58 1i48 h SER 142 Cb 0.00 0.44 -0.10 0.00 -0.31 0.00 0.00 62.40 62.44 1i48 h SER 142 CO 0.00 -0.33 -0.17 0.74 -0.87 0.00 0.00 176.83 176.20 1i48 h THR 143 N -0.31 0.42 0.61 2.95 2.02 -0.06 -1.16 112.91 117.38 1i48 h THR 143 Ca 0.13 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.28 1i48 h THR 143 Cb 0.53 0.42 0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1i48 h THR 143 CO -0.43 0.00 -0.29 0.58 0.37 0.00 0.00 175.52 175.75 1i48 h VAL 144 N -0.06 0.00 -0.98 3.16 2.07 0.11 -2.89 116.25 117.66 1i48 h VAL 144 Ca 0.24 -0.07 0.37 0.00 0.82 0.00 0.00 66.70 68.05 1i48 h VAL 144 Cb 0.42 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.06 1i48 h VAL 144 CO -0.54 0.00 0.59 0.80 0.02 0.00 0.00 177.57 178.44 1i48 n MET 145 N -4.41 -0.04 0.17 1.57 0.00 0.48 0.03 117.12 114.92 1i48 n MET 145 Ca -0.10 1.07 -0.07 0.00 0.00 0.00 0.00 57.70 58.60 1i48 n MET 145 Cb 0.32 -2.02 -0.03 0.00 0.00 0.00 0.00 33.22 31.49 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 -0.39 -2.05 -0.89 3.38 -1.06 -1.44 115.31 112.87 1i48 h LEU 146 Ca 0.71 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.74 1i48 h LEU 146 Cb 2.10 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.94 1i48 h LEU 146 CO -0.50 -0.17 0.35 -0.07 0.09 0.00 0.00 178.44 178.15 1i48 h LEU 147 N -0.67 0.00 0.11 1.67 3.38 -0.43 -0.26 115.31 119.10 1i48 h LEU 147 Ca -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1i48 h LEU 147 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1i48 h LEU 147 CO 0.08 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.55 1i48 h ALA 148 N 1.47 -0.15 0.10 1.53 0.00 -0.26 -3.41 119.26 118.54 1i48 h ALA 148 Ca 0.08 -0.25 -0.30 0.00 0.00 0.00 0.00 54.91 54.45 1i48 h ALA 148 Cb 0.79 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1i48 h ALA 148 CO -0.00 -0.22 -1.58 -0.07 0.00 0.00 0.00 179.25 177.38 1i48 h LEU 149 N -0.88 0.33 -9.07 0.00 3.38 -0.58 -3.46 115.31 105.03 1i48 h LEU 149 Ca -0.02 -0.83 -0.56 0.00 0.09 0.00 0.00 57.88 56.56 1i48 h LEU 149 Cb 0.55 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1i48 h LEU 149 CO 0.03 1.68 1.03 -0.69 0.09 0.00 0.00 178.44 180.58 1i48 s VAL 150 N -2.49 3.92 0.99 1.22 1.01 -0.17 -5.01 120.40 119.87 1i48 s VAL 150 Ca -0.22 1.06 -0.14 0.00 0.00 0.00 0.00 61.98 62.69 1i48 s VAL 150 Cb 0.05 -3.85 0.18 0.00 0.00 0.00 0.00 36.38 32.77 1i48 s VAL 150 CO 0.74 -0.27 1.13 -2.84 0.00 0.00 0.00 175.10 173.86 1i48 s PRO 151 N 4.20 0.49 0.33 2.72 0.02 -1.26 -4.72 135.00 136.78 1i48 s PRO 151 Ca 0.64 0.27 -0.29 0.00 0.02 0.00 0.00 61.00 61.64 1i48 s PRO 151 Cb -0.23 -1.77 -0.10 0.00 0.02 0.00 0.00 34.50 32.42 1i48 s PRO 151 CO 0.24 -2.63 1.28 0.00 -0.33 0.00 0.00 177.00 175.56 1i48 s ALA 152 N -3.17 3.48 0.00 -1.55 0.00 -1.26 -2.15 121.76 117.11 1i48 s ALA 152 Ca 0.66 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.83 1i48 s ALA 152 Cb -0.15 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1i48 s ALA 152 CO 0.55 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1i48 n GLY 153 N 0.85 0.35 3.45 0.00 0.00 -0.45 -4.94 105.19 104.44 1i48 n GLY 153 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1i48 n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i48 n GLY 154 N -1.71 -2.67 3.14 -0.02 0.00 -0.92 -4.66 105.19 98.35 1i48 n GLY 154 Ca 0.00 -1.51 -0.20 0.00 0.00 0.00 0.00 46.02 44.31 1i48 n GLY 154 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1i48 s HIS 155 N -3.01 1.22 0.02 1.61 5.65 -1.26 -1.79 115.29 117.73 1i48 s HIS 155 Ca 0.70 -0.34 0.01 0.00 0.25 0.00 0.00 55.06 55.68 1i48 s HIS 155 Cb -0.06 -0.73 -0.02 0.00 -1.18 0.00 0.00 32.58 30.59 1i48 s HIS 155 CO 0.53 0.03 -0.05 -1.50 -0.65 0.00 0.00 174.74 173.10 1i48 s ILE 156 N -0.79 0.29 -0.05 0.89 2.07 -0.66 0.15 121.20 123.10 1i48 s ILE 156 Ca 0.02 -0.74 0.04 0.00 -1.41 0.00 0.00 60.65 58.56 1i48 s ILE 156 Cb -0.08 -0.36 -0.02 0.00 0.13 0.00 0.00 42.46 42.13 1i48 s ILE 156 CO 0.01 -0.30 -0.15 -0.69 -1.91 0.00 0.00 174.94 171.90 1i48 s VAL 157 N -1.03 2.99 0.04 4.00 1.01 -0.57 -1.17 120.40 125.68 1i48 s VAL 157 Ca -0.09 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 1i48 s VAL 157 Cb -0.07 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1i48 s VAL 157 CO -0.00 0.59 0.30 0.28 0.00 0.00 0.00 175.10 176.26 1i48 s THR 158 N -0.67 0.08 0.75 3.92 -1.32 -0.54 0.35 115.64 118.21 1i48 s THR 158 Ca 0.10 -0.69 -0.11 0.00 -1.21 0.00 0.00 61.69 59.78 1i48 s THR 158 Cb -0.11 -0.94 0.04 0.00 -1.51 0.00 0.00 72.50 69.98 1i48 s THR 158 CO 0.01 -0.38 1.08 0.42 -2.21 0.00 0.00 174.62 173.53 1i48 s THR 159 N -2.57 3.57 0.04 5.08 -4.23 -1.25 -1.42 115.64 114.87 1i48 s THR 159 Ca -0.05 0.51 -0.22 0.00 -1.18 0.00 0.00 61.69 60.75 1i48 s THR 159 Cb -0.01 -3.19 -0.14 0.00 1.34 0.00 0.00 72.50 70.51 1i48 s THR 159 CO -0.03 -0.67 1.44 0.71 -0.54 0.00 0.00 174.62 175.53 1i48 h THR 160 N -0.94 1.28 -2.54 3.99 1.35 -0.84 -3.41 112.91 111.79 1i48 h THR 160 Ca -0.45 -0.91 -0.55 0.00 -0.55 0.00 0.00 66.41 63.95 1i48 h THR 160 Cb 1.23 1.64 -0.04 0.00 -1.73 0.00 0.00 68.15 69.26 1i48 h THR 160 CO 0.56 0.26 1.26 -1.81 -0.25 0.00 0.00 175.52 175.54 1i48 s ASP 161 N -5.78 5.77 0.18 5.36 1.11 -1.26 -4.95 116.67 117.10 1i48 s ASP 161 Ca -0.14 0.85 0.00 0.00 0.18 0.00 0.00 52.55 53.44 1i48 s ASP 161 Cb 0.05 -2.53 -0.04 0.00 1.07 0.00 0.00 42.92 41.47 1i48 s ASP 161 CO 0.71 -1.89 0.06 0.00 1.18 0.00 0.00 175.17 175.23 1i48 s TYR 163 N -3.88 2.73 0.02 0.00 5.04 -1.26 -4.87 117.35 115.13 1i48 s TYR 163 Ca 0.30 0.91 -0.05 0.00 -2.44 0.00 0.00 57.07 55.79 1i48 s TYR 163 Cb 0.07 -3.61 -0.01 0.00 0.35 0.00 0.00 41.96 38.76 1i48 s TYR 163 CO 0.07 -1.92 0.36 -2.13 -1.34 0.00 0.00 175.55 170.59 1i48 n ARG 164 N 6.78 -0.07 0.18 4.97 3.00 -1.26 -0.22 116.66 130.04 1i48 n ARG 164 Ca 0.14 0.36 -0.15 0.00 -0.00 0.00 0.00 57.85 58.20 1i48 n ARG 164 Cb 0.45 -0.53 -0.08 0.00 0.00 0.00 0.00 32.46 32.30 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 -0.72 -1.02 -0.14 6.56 -1.98 -1.52 116.57 117.75 1i48 h LYS 165 Ca 0.02 0.05 0.32 0.00 -1.06 0.00 0.00 60.65 59.98 1i48 h LYS 165 Cb 0.06 0.16 -0.14 0.00 -0.57 0.00 0.00 32.23 31.74 1i48 h LYS 165 CO -0.14 -0.48 0.59 1.15 -2.06 0.00 0.00 179.45 178.51 1i48 h THR 166 N -0.74 0.32 0.29 -0.16 2.02 -0.99 0.20 112.91 113.85 1i48 h THR 166 Ca -0.01 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1i48 h THR 166 Cb 0.71 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1i48 h THR 166 CO -0.17 0.06 -0.27 -0.09 0.37 0.00 0.00 175.52 175.43 1i48 h ARG 167 N 0.34 -0.53 -0.78 6.66 2.43 -0.14 -2.86 114.38 119.50 1i48 h ARG 167 Ca 0.72 0.04 0.16 0.00 -0.81 0.00 0.00 59.98 60.09 1i48 h ARG 167 Cb 1.67 0.12 -0.15 0.00 -0.42 0.00 0.00 29.97 31.19 1i48 h ARG 167 CO -0.57 -0.35 -0.20 0.82 -1.51 0.00 0.00 179.97 178.16 1i48 h ILE 168 N -0.55 0.22 -0.76 1.20 2.04 -0.62 0.13 117.51 119.16 1i48 h ILE 168 Ca -0.04 0.00 0.16 0.00 1.00 0.00 0.00 64.86 65.98 1i48 h ILE 168 Cb 0.47 0.22 -0.11 0.00 -0.74 0.00 0.00 36.82 36.67 1i48 h ILE 168 CO -0.02 0.00 0.25 0.15 0.00 0.00 0.00 178.15 178.52 1i48 h PHE 169 N -0.00 0.40 -0.09 1.37 3.57 -1.29 0.46 116.94 121.36 1i48 h PHE 169 Ca 0.37 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.76 1i48 h PHE 169 Cb 0.57 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1i48 h PHE 169 CO -0.62 -0.03 -0.61 0.82 -2.23 0.00 0.00 178.31 175.64 1i48 h ILE 170 N 0.34 1.37 -0.00 1.41 2.04 -0.59 -0.56 117.51 121.53 1i48 h ILE 170 Ca 0.43 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 64.32 1i48 h ILE 170 Cb 0.73 1.98 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1i48 h ILE 170 CO -0.48 0.59 -0.26 -0.62 0.00 0.00 0.00 178.15 177.38 1i48 n GLU 171 N -3.88 0.60 0.00 2.37 1.02 0.13 -4.24 120.64 116.64 1i48 n GLU 171 Ca -0.03 -0.31 0.00 0.00 -0.02 0.00 0.00 57.16 56.80 1i48 n GLU 171 Cb 0.63 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 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 -0.93 0.00 -0.09 2.62 -2.24 0.14 -4.86 114.28 108.91 1i48 n THR 172 Ca 0.11 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.78 1i48 n THR 172 Cb 0.33 -0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.38 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 -0.72 1.49 -0.34 2.28 2.08 -0.26 -4.44 119.36 119.44 1i48 n ILE 173 Ca 0.00 0.09 0.19 0.00 0.56 0.00 0.00 62.75 63.59 1i48 n ILE 173 Cb 0.09 -2.29 0.42 0.00 -0.75 0.00 0.00 39.64 37.11 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 0.61 -2.02 1.39 3.38 -1.62 0.51 115.31 116.56 1i48 h LEU 174 Ca -0.10 0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.10 1i48 h LEU 174 Cb 0.99 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1i48 h LEU 174 CO -0.06 0.07 0.24 1.55 0.09 0.00 0.00 178.44 180.33 1i48 h PRO 175 N 0.52 0.00 -0.87 1.13 0.13 -1.73 0.60 132.00 131.77 1i48 h PRO 175 Ca 0.65 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.82 1i48 h PRO 175 Cb 1.34 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.42 1i48 h PRO 175 CO -0.46 0.00 0.56 0.87 -0.23 0.00 0.00 178.00 178.75 1i48 h LYS 176 N 0.00 1.05 -0.53 0.86 1.57 -0.19 0.50 116.57 119.82 1i48 h LYS 176 Ca 0.15 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1i48 h LYS 176 Cb 0.62 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1i48 h LYS 176 CO -0.00 0.69 0.00 -1.33 -0.57 0.00 0.00 179.45 178.24 1i48 n MET 177 N -4.55 1.63 -1.31 3.15 0.00 0.07 -4.83 117.12 111.27 1i48 n MET 177 Ca 0.11 -0.65 -0.11 0.00 0.00 0.00 0.00 57.70 57.05 1i48 n MET 177 Cb 0.10 -1.40 -0.05 0.00 0.00 0.00 0.00 33.22 31.88 1i48 n MET 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1i48 n GLY 178 N 0.46 1.17 3.62 3.03 0.00 0.17 -1.34 105.19 112.30 1i48 n GLY 178 Ca 0.06 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.28 4.56 0.13 -0.61 1.01 -0.38 -3.24 121.20 120.39 1i48 s ILE 179 Ca 0.00 1.36 -0.03 0.00 0.00 0.00 0.00 60.65 61.98 1i48 s ILE 179 Cb 0.00 -4.36 -0.05 0.00 0.01 0.00 0.00 42.46 38.06 1i48 s ILE 179 CO 0.00 -0.52 0.34 0.28 0.00 0.00 0.00 174.94 175.04 1i48 s THR 180 N 3.54 5.22 0.05 2.92 -1.32 -0.74 -3.58 115.64 121.73 1i48 s THR 180 Ca 0.40 -0.12 -0.02 0.00 -1.21 0.00 0.00 61.69 60.75 1i48 s THR 180 Cb -0.12 -3.64 -0.03 0.00 -1.51 0.00 0.00 72.50 67.20 1i48 s THR 180 CO 0.18 0.03 -0.00 0.00 -2.21 0.00 0.00 174.62 172.61 1i48 s ALA 181 N -1.66 0.33 -0.08 11.08 0.00 -1.26 -1.66 121.76 128.51 1i48 s ALA 181 Ca 0.39 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 51.41 1i48 s ALA 181 Cb -0.12 0.26 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 1i48 s ALA 181 CO 0.26 -0.33 -0.24 0.99 0.00 0.00 0.00 175.76 176.44 1i48 s THR 182 N -3.31 2.01 -0.25 0.00 2.01 -0.32 -4.95 115.64 110.83 1i48 s THR 182 Ca 0.01 -1.01 -0.10 0.00 0.31 0.00 0.00 61.69 60.90 1i48 s THR 182 Cb 0.03 -1.73 -0.05 0.00 0.01 0.00 0.00 72.50 70.77 1i48 s THR 182 CO -0.08 0.55 0.15 -0.69 -0.69 0.00 0.00 174.62 173.87 1i48 s VAL 183 N 0.18 5.15 0.20 3.82 1.01 -1.26 -1.47 120.40 128.03 1i48 s VAL 183 Ca -0.13 0.11 0.05 0.00 0.00 0.00 0.00 61.98 62.01 1i48 s VAL 183 Cb -0.16 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 1i48 s VAL 183 CO 0.07 0.32 -0.06 0.27 0.00 0.00 0.00 175.10 175.69 1i48 s ILE 184 N 1.33 1.25 0.37 2.22 -4.36 -0.50 -4.86 121.20 116.64 1i48 s ILE 184 Ca 0.07 -2.08 -0.26 0.00 -0.26 0.00 0.00 60.65 58.12 1i48 s ILE 184 Cb -0.15 -2.14 -0.09 0.00 1.25 0.00 0.00 42.46 41.34 1i48 s ILE 184 CO 0.06 -0.51 1.13 -0.62 0.24 0.00 0.00 174.94 175.24 1i48 s ASP 185 N -3.27 6.75 0.39 4.36 2.15 -1.26 -0.11 116.67 125.69 1i48 s ASP 185 Ca 0.24 2.26 0.14 0.00 0.43 0.00 0.00 52.55 55.61 1i48 s ASP 185 Cb 0.03 -2.61 0.98 0.00 -0.30 0.00 0.00 42.92 41.02 1i48 s ASP 185 CO 0.06 -0.51 1.87 -0.65 -0.17 0.00 0.00 175.17 175.77 1i48 h PRO 186 N 2.88 0.50 0.14 4.34 0.11 -1.94 -2.82 132.00 135.20 1i48 h PRO 186 Ca -0.48 -0.03 -0.30 0.00 0.11 0.00 0.00 66.00 65.30 1i48 h PRO 186 Cb 1.22 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1i48 h PRO 186 CO 0.63 0.33 -1.54 0.00 -0.21 0.00 0.00 178.00 177.21 1i48 h ALA 187 N 1.62 0.18 -0.02 -0.75 0.00 -1.92 -3.44 119.26 114.93 1i48 h ALA 187 Ca 0.45 -1.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.16 1i48 h ALA 187 Cb 0.95 0.48 0.02 0.00 0.00 0.00 0.00 17.79 19.25 1i48 h ALA 187 CO -0.19 0.91 0.72 -3.47 0.00 0.00 0.00 179.25 177.22 1i48 n ASP 188 N -3.81 -0.64 0.03 0.00 -0.08 -1.07 -4.62 116.55 106.37 1i48 n ASP 188 Ca -0.25 -1.52 0.01 0.00 -1.51 0.00 0.00 54.79 51.52 1i48 n ASP 188 Cb 0.96 -0.64 0.35 0.00 2.34 0.00 0.00 41.12 44.13 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 6.09 1.17 0.23 5.18 2.07 -1.84 -2.92 116.25 126.23 1i48 h VAL 189 Ca 0.04 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.92 1i48 h VAL 189 Cb 0.82 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 1i48 h VAL 189 CO 1.01 0.22 -0.53 1.23 0.02 0.00 0.00 177.57 179.53 1i48 h GLY 190 N 0.73 -1.19 -0.35 2.17 0.00 -1.97 -0.93 103.07 101.52 1i48 h GLY 190 Ca 0.10 0.63 0.19 0.00 0.00 0.00 0.00 47.33 48.25 1i48 h GLY 190 CO 0.00 -0.30 0.08 0.00 0.00 0.00 0.00 176.54 176.33 1i48 h ALA 191 N -0.63 0.93 0.61 3.60 0.00 -1.91 0.50 119.26 122.36 1i48 h ALA 191 Ca -0.02 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1i48 h ALA 191 Cb 0.80 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1i48 h ALA 191 CO -0.22 -0.42 -0.40 1.25 0.00 0.00 0.00 179.25 179.45 1i48 h LEU 192 N 0.15 -1.02 -0.91 0.00 5.85 -1.37 0.36 115.31 118.37 1i48 h LEU 192 Ca 0.45 0.06 0.12 0.00 0.84 0.00 0.00 57.88 59.35 1i48 h LEU 192 Cb 0.82 0.31 -0.08 0.00 0.37 0.00 0.00 40.66 42.08 1i48 h LEU 192 CO -0.64 -0.61 0.53 -0.08 -0.34 0.00 0.00 178.44 177.30 1i48 h GLU 193 N -0.97 0.81 0.44 1.25 4.81 0.14 0.63 114.58 121.70 1i48 h GLU 193 Ca -0.07 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1i48 h GLU 193 Cb 0.79 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.99 1i48 h GLU 193 CO 0.06 0.54 -0.21 1.25 -0.73 0.00 0.00 179.01 179.91 1i48 h LEU 194 N 0.83 -0.50 -1.46 1.64 5.85 0.51 -2.72 115.31 119.47 1i48 h LEU 194 Ca 0.46 0.02 0.18 0.00 0.84 0.00 0.00 57.88 59.38 1i48 h LEU 194 Cb 0.50 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.59 1i48 h LEU 194 CO -0.28 -0.36 0.58 0.00 -0.34 0.00 0.00 178.44 178.04 1i48 h ALA 195 N -1.72 2.10 -0.50 1.25 0.00 -0.01 0.49 119.26 120.87 1i48 h ALA 195 Ca -0.06 0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.01 1i48 h ALA 195 Cb 0.45 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1i48 h ALA 195 CO 0.10 -0.37 0.45 1.25 0.00 0.00 0.00 179.25 180.68 1i48 h LEU 196 N 0.48 0.00 0.00 0.00 7.12 0.56 -2.58 115.31 120.90 1i48 h LEU 196 Ca 0.46 0.00 -0.42 0.00 0.13 0.00 0.00 57.88 58.05 1i48 h LEU 196 Cb 1.03 0.00 -0.07 0.00 -0.53 0.00 0.00 40.66 41.09 1i48 h LEU 196 CO -0.18 0.00 -2.48 0.59 -0.13 0.00 0.00 178.44 176.23 1i48 n ASN 197 N -3.96 1.97 0.01 1.25 3.02 0.16 -4.66 115.26 113.06 1i48 n ASN 197 Ca 0.09 0.04 -0.08 0.00 -0.03 0.00 0.00 54.58 54.61 1i48 n ASN 197 Cb 0.66 -0.57 -0.05 0.00 -0.61 0.00 0.00 39.78 39.21 1i48 n ASN 197 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1i48 h GLN 198 N -0.36 -0.31 0.00 3.52 4.20 -0.79 -3.44 115.11 117.93 1i48 h GLN 198 Ca -0.62 0.02 -0.45 0.00 0.06 0.00 0.00 58.65 57.66 1i48 h GLN 198 Cb 1.80 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 29.63 1i48 h GLN 198 CO -0.21 -0.21 -0.17 1.63 -0.67 0.00 0.00 178.83 179.21 1i48 n LYS 199 N -4.00 0.77 -3.45 1.46 4.01 -1.02 -5.07 118.16 110.86 1i48 n LYS 199 Ca -0.03 -2.76 -0.43 0.00 -0.51 0.00 0.00 58.31 54.57 1i48 n LYS 199 Cb 0.20 0.14 -0.04 0.00 -0.51 0.00 0.00 35.03 34.82 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 -3.97 3.42 0.11 1.97 2.36 -1.26 -4.70 119.74 117.67 1i48 s LYS 200 Ca 0.34 -2.66 -0.31 0.00 -2.55 0.00 0.00 55.97 50.79 1i48 s LYS 200 Cb -0.03 -4.24 -0.08 0.00 -1.05 0.00 0.00 37.83 32.43 1i48 s LYS 200 CO 0.21 -1.25 1.44 0.08 1.55 0.00 0.00 175.35 177.38 1i48 s VAL 201 N -0.22 3.20 -0.07 4.02 1.01 -1.26 -4.22 120.40 122.86 1i48 s VAL 201 Ca 0.20 0.84 -0.11 0.00 0.00 0.00 0.00 61.98 62.91 1i48 s VAL 201 Cb -0.12 -3.54 -0.30 0.00 0.00 0.00 0.00 36.38 32.43 1i48 s VAL 201 CO -0.08 0.06 0.61 0.78 0.00 0.00 0.00 175.10 176.47 1i48 h ASN 202 N 6.96 0.56 -4.14 3.32 4.21 -0.66 -3.37 115.58 122.46 1i48 h ASN 202 Ca -0.42 -0.93 -0.03 0.00 1.21 0.00 0.00 56.30 56.13 1i48 h ASN 202 Cb 1.21 -0.18 -0.21 0.00 -1.12 0.00 0.00 38.32 38.01 1i48 h ASN 202 CO 0.88 1.78 0.20 -0.22 -1.29 0.00 0.00 177.43 178.78 1i48 s LEU 203 N -7.30 -0.68 -0.25 1.61 0.20 -1.23 -1.72 118.68 109.32 1i48 s LEU 203 Ca -0.17 1.17 -0.08 0.00 0.69 0.00 0.00 54.13 55.73 1i48 s LEU 203 Cb 0.05 2.39 -0.03 0.00 -0.43 0.00 0.00 46.19 48.17 1i48 s LEU 203 CO 0.83 -0.33 0.09 0.12 -0.29 0.00 0.00 176.35 176.78 1i48 s PHE 204 N -0.07 3.13 -0.08 5.38 5.36 0.56 -1.50 117.98 130.75 1i48 s PHE 204 Ca -0.02 -0.26 0.04 0.00 -0.96 0.00 0.00 56.93 55.72 1i48 s PHE 204 Cb -0.04 -2.25 0.00 0.00 -0.34 0.00 0.00 43.02 40.40 1i48 s PHE 204 CO 0.02 -0.26 -0.20 0.12 -1.46 0.00 0.00 175.22 173.44 1i48 s PHE 205 N 1.50 2.13 -0.05 10.12 5.36 0.16 -0.75 117.98 136.45 1i48 s PHE 205 Ca 0.06 -0.81 -0.29 0.00 -0.96 0.00 0.00 56.93 54.93 1i48 s PHE 205 Cb -0.15 -1.45 0.11 0.00 -0.34 0.00 0.00 43.02 41.18 1i48 s PHE 205 CO 0.05 -0.33 0.90 -0.08 -1.46 0.00 0.00 175.22 174.30 1i48 s THR 206 N 0.35 0.00 0.10 0.12 -1.32 -0.75 -3.79 115.64 110.34 1i48 s THR 206 Ca -0.15 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.37 1i48 s THR 206 Cb -0.16 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.79 1i48 s THR 206 CO 0.06 0.00 0.11 -1.83 -2.21 0.00 0.00 174.62 170.75 1i48 s GLU 207 N -2.39 2.95 -0.24 7.08 1.03 -1.26 -1.57 118.70 124.29 1i48 s GLU 207 Ca 0.02 -0.70 -0.07 0.00 0.03 0.00 0.00 54.97 54.24 1i48 s GLU 207 Cb -0.01 -2.75 0.11 0.00 -0.80 0.00 0.00 34.13 30.69 1i48 s GLU 207 CO -0.05 0.55 0.50 0.45 -1.33 0.00 0.00 175.26 175.39 1i48 s SER 208 N -2.56 -0.57 0.69 0.83 0.15 -1.20 -3.73 113.70 107.31 1i48 s SER 208 Ca 0.30 1.13 -0.17 0.00 0.70 0.00 0.00 55.95 57.92 1i48 s SER 208 Cb -0.12 1.69 -0.00 0.00 -1.71 0.00 0.00 66.02 65.88 1i48 s SER 208 CO 0.23 -0.23 1.06 -2.65 1.20 0.00 0.00 173.24 172.85 1i48 n PRO 209 N 5.41 0.70 -2.27 5.44 -0.02 -1.26 -4.54 135.00 138.46 1i48 n PRO 209 Ca -0.09 0.29 -0.27 0.00 -2.02 0.00 0.00 63.50 61.42 1i48 n PRO 209 Cb 0.49 -2.30 0.15 0.00 -0.02 0.00 0.00 33.50 31.82 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 -1.68 2.04 -0.02 3.45 -1.32 0.15 -4.68 115.64 113.59 1i48 s THR 210 Ca 0.76 -0.31 0.04 0.00 -1.21 0.00 0.00 61.69 60.97 1i48 s THR 210 Cb -0.36 -2.73 -0.01 0.00 -1.51 0.00 0.00 72.50 67.89 1i48 s THR 210 CO 0.47 0.00 -0.12 0.21 -2.21 0.00 0.00 174.62 172.97 1i48 s ASN 211 N -4.84 1.46 0.00 8.08 2.47 -1.26 -1.46 114.94 119.39 1i48 s ASN 211 Ca 0.71 -0.23 0.23 0.00 0.42 0.00 0.00 52.86 53.99 1i48 s ASN 211 Cb -0.04 -0.24 0.54 0.00 -1.45 0.00 0.00 41.25 40.07 1i48 s ASN 211 CO 0.49 0.13 1.47 -0.81 -3.72 0.00 0.00 177.10 174.67 1i48 n PRO 212 N 2.92 2.57 -0.38 0.43 -0.04 -1.26 -4.00 135.00 135.24 1i48 n PRO 212 Ca -0.15 -2.42 0.07 0.00 -0.04 0.00 0.00 63.50 60.96 1i48 n PRO 212 Cb 0.55 -1.54 0.25 0.00 -0.04 0.00 0.00 33.50 32.72 1i48 n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1i48 n PHE 213 N 1.53 0.94 -3.79 0.54 3.72 -1.26 -4.56 117.46 114.58 1i48 n PHE 213 Ca 0.22 -0.40 -0.27 0.00 -0.05 0.00 0.00 57.45 56.95 1i48 n PHE 213 Cb 0.60 -0.12 -0.05 0.00 -0.94 0.00 0.00 39.48 38.97 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 0.84 -0.60 -4.75 4.37 4.32 -0.53 -4.75 117.00 115.89 1i48 n LEU 214 Ca 0.18 -0.61 -0.41 0.00 -0.02 0.00 0.00 56.01 55.15 1i48 n LEU 214 Cb 0.59 -1.43 -0.03 0.00 -1.62 0.00 0.00 43.42 40.93 1i48 n LEU 214 CO 0.15 0.07 0.98 -0.13 -1.22 0.00 0.00 177.39 177.24 1i48 s ARG 215 N -6.42 4.39 0.29 3.23 1.81 -1.26 -4.15 118.95 116.84 1i48 s ARG 215 Ca 0.53 2.12 0.07 0.00 -1.72 0.00 0.00 55.73 56.73 1i48 s ARG 215 Cb -0.31 -3.14 -0.03 0.00 -0.45 0.00 0.00 34.95 31.02 1i48 s ARG 215 CO 0.65 -0.20 0.22 0.00 -0.68 0.00 0.00 175.30 175.29 1i48 s VAL 217 N -2.21 1.71 -1.18 0.00 1.01 -1.26 -4.67 120.40 113.80 1i48 s VAL 217 Ca 0.36 -0.85 -0.23 0.00 0.00 0.00 0.00 61.98 61.26 1i48 s VAL 217 Cb -0.07 -1.48 -0.10 0.00 0.00 0.00 0.00 36.38 34.74 1i48 s VAL 217 CO 0.25 0.48 1.95 -0.62 0.00 0.00 0.00 175.10 177.16 1i48 s ASP 218 N 0.17 4.92 0.00 3.32 -1.08 -1.26 -4.80 116.67 117.94 1i48 s ASP 218 Ca -0.10 -1.61 0.00 0.00 -0.52 0.00 0.00 52.55 50.32 1i48 s ASP 218 Cb -0.15 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.73 1i48 s ASP 218 CO 0.05 -3.19 0.79 -0.38 0.52 0.00 0.00 175.17 172.96 1i48 n ILE 219 N 7.89 0.00 -0.21 4.11 5.41 -1.26 -1.18 119.36 134.11 1i48 n ILE 219 Ca 0.45 1.28 -0.04 0.00 1.00 0.00 0.00 62.75 65.44 1i48 n ILE 219 Cb 0.47 -1.77 -0.02 0.00 -0.71 0.00 0.00 39.64 37.60 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 -2.21 -0.18 0.27 0.38 2.13 -1.20 0.34 120.64 120.16 1i48 n GLU 220 Ca 0.00 0.77 -0.13 0.00 0.66 0.00 0.00 57.16 58.46 1i48 n GLU 220 Cb 0.00 -1.14 -0.07 0.00 0.27 0.00 0.00 31.44 30.51 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 -0.87 -0.63 4.31 5.85 -1.62 -2.11 115.31 120.24 1i48 h LEU 221 Ca 0.12 0.05 0.13 0.00 0.84 0.00 0.00 57.88 59.02 1i48 h LEU 221 Cb 0.24 0.26 -0.11 0.00 0.37 0.00 0.00 40.66 41.42 1i48 h LEU 221 CO -0.49 -0.50 -0.08 0.58 -0.34 0.00 0.00 178.44 177.62 1i48 h VAL 222 N -0.78 0.42 -0.65 1.05 2.07 0.99 0.13 116.25 119.48 1i48 h VAL 222 Ca -0.07 -0.02 0.13 0.00 0.82 0.00 0.00 66.70 67.57 1i48 h VAL 222 Cb 0.64 0.36 -0.10 0.00 -1.52 0.00 0.00 31.29 30.67 1i48 h VAL 222 CO 0.04 0.01 0.08 0.28 0.02 0.00 0.00 177.57 178.00 1i48 h SER 223 N 0.05 -0.13 0.70 0.57 0.02 0.01 0.75 113.55 115.52 1i48 h SER 223 Ca 0.32 0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 61.38 1i48 h SER 223 Cb 0.51 0.22 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 1i48 h SER 223 CO -0.60 -0.07 -0.43 0.50 -1.14 0.00 0.00 176.83 175.10 1i48 h LYS 224 N 0.19 -1.02 -1.01 3.45 3.64 -0.08 0.19 116.57 121.93 1i48 h LYS 224 Ca 0.35 0.07 0.25 0.00 -1.27 0.00 0.00 60.65 60.04 1i48 h LYS 224 Cb 0.56 0.23 -0.09 0.00 -0.41 0.00 0.00 32.23 32.53 1i48 h LYS 224 CO -0.50 -0.68 0.65 -0.07 -2.27 0.00 0.00 179.45 176.59 1i48 h LEU 225 N -1.06 0.48 0.15 5.20 3.38 -0.61 -0.84 115.31 122.02 1i48 h LEU 225 Ca -0.09 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1i48 h LEU 225 Cb 0.84 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1i48 h LEU 225 CO 0.10 0.12 -0.07 0.00 0.09 0.00 0.00 178.44 178.67 1i48 h HIS 227 N -1.00 0.00 -0.21 0.00 3.86 -0.19 0.57 115.15 118.18 1i48 h HIS 227 Ca -0.02 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.07 1i48 h HIS 227 Cb 0.36 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 1i48 h HIS 227 CO 0.05 0.00 -0.37 1.49 0.86 0.00 0.00 177.93 179.97 1i48 h GLU 228 N 0.00 0.45 -0.53 2.45 4.81 -1.21 -2.78 114.58 117.78 1i48 h GLU 228 Ca 0.16 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1i48 h GLU 228 Cb 1.13 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1i48 h GLU 228 CO -0.00 0.76 0.00 1.63 -0.73 0.00 0.00 179.01 180.66 1i48 n LYS 229 N -4.05 4.30 -0.94 1.92 4.76 0.19 -4.93 118.16 119.41 1i48 n LYS 229 Ca -0.01 -3.04 0.00 0.00 -2.87 0.00 0.00 58.31 52.39 1i48 n LYS 229 Cb 0.48 -2.10 0.00 0.00 -1.84 0.00 0.00 35.03 31.56 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 0.51 0.28 3.85 0.72 0.00 -0.80 -4.87 105.19 104.86 1i48 n GLY 230 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.65 2.93 -0.04 4.61 0.00 -0.87 -4.94 121.76 121.79 1i48 s ALA 231 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 51.96 51.95 1i48 s ALA 231 Cb 0.00 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.96 1i48 s ALA 231 CO 0.00 -0.86 0.10 -0.51 0.00 0.00 0.00 175.76 174.49 1i48 s LEU 232 N -5.22 4.07 -0.27 0.00 1.43 -0.70 -3.84 118.68 114.14 1i48 s LEU 232 Ca 0.57 0.26 -0.03 0.00 -1.03 0.00 0.00 54.13 53.90 1i48 s LEU 232 Cb -0.12 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 43.89 1i48 s LEU 232 CO 0.52 0.32 -0.02 -0.69 0.23 0.00 0.00 176.35 176.71 1i48 s VAL 233 N -1.14 3.10 -0.19 -1.59 1.01 -1.26 0.21 120.40 120.53 1i48 s VAL 233 Ca 0.21 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 1i48 s VAL 233 Cb -0.12 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.63 1i48 s VAL 233 CO 0.11 0.09 -0.12 0.00 0.00 0.00 0.00 175.10 175.19 1i48 s ILE 235 N 1.29 3.49 -0.96 0.00 -1.09 0.96 -1.82 121.20 123.07 1i48 s ILE 235 Ca 0.04 -0.53 -0.12 0.00 -2.23 0.00 0.00 60.65 57.80 1i48 s ILE 235 Cb -0.14 -2.46 0.24 0.00 -1.58 0.00 0.00 42.46 38.52 1i48 s ILE 235 CO -0.06 0.55 0.93 -0.62 -1.23 0.00 0.00 174.94 174.51 1i48 s ASP 236 N -0.12 6.99 0.00 3.58 -1.08 -0.61 -1.38 116.67 124.06 1i48 s ASP 236 Ca 0.00 -3.04 0.00 0.00 -0.52 0.00 0.00 52.55 48.99 1i48 s ASP 236 Cb -0.13 -2.22 0.00 0.00 -1.46 0.00 0.00 42.92 39.11 1i48 s ASP 236 CO 0.03 -0.48 1.22 0.61 0.52 0.00 0.00 175.17 177.07 1i48 n GLY 237 N 3.51 2.08 0.10 2.66 0.00 -0.99 -3.26 105.19 109.30 1i48 n GLY 237 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 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 0.27 0.00 -0.95 2.61 2.02 -1.87 0.63 112.91 115.61 1i48 h THR 238 Ca 0.00 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.40 1i48 h THR 238 Cb 0.98 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.31 1i48 h THR 238 CO 0.00 0.00 0.62 -0.26 0.37 0.00 0.00 175.52 176.25 1i48 h PHE 239 N -0.13 0.60 0.31 3.16 0.04 -1.83 -3.09 116.94 116.00 1i48 h PHE 239 Ca 0.01 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 1i48 h PHE 239 Cb 0.15 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.12 1i48 h PHE 239 CO -0.47 0.13 -0.15 0.00 -0.60 0.00 0.00 178.31 177.23 1i48 h ALA 240 N 1.61 -0.59 0.00 2.45 0.00 -1.59 -3.41 119.26 117.73 1i48 h ALA 240 Ca 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1i48 h ALA 240 Cb 1.25 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1i48 h ALA 240 CO -0.22 -0.56 0.00 2.41 0.00 0.00 0.00 179.25 180.88 1i48 n THR 241 N -4.05 -0.36 0.32 0.00 -1.04 0.13 -4.12 114.28 105.16 1i48 n THR 241 Ca -0.05 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.11 1i48 n THR 241 Cb 0.16 0.00 0.79 0.00 -1.82 0.00 0.00 70.33 69.46 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 0.01 -2.82 0.13 -1.84 -0.92 132.00 126.56 1i48 h PRO 242 Ca 0.00 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.89 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 -0.98 -0.07 -0.23 0.00 0.00 178.00 176.72 1i48 h LEU 243 N 0.00 0.59 0.00 1.56 3.38 -1.94 -3.29 115.31 115.61 1i48 h LEU 243 Ca 0.02 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1i48 h LEU 243 Cb 0.74 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1i48 h LEU 243 CO -0.00 1.29 -0.42 0.59 0.09 0.00 0.00 178.44 179.99 1i48 n ASN 244 N -3.75 0.74 -3.62 -0.43 3.02 -0.37 -4.84 115.26 106.00 1i48 n ASN 244 Ca -0.08 0.27 -0.08 0.00 -0.03 0.00 0.00 54.58 54.66 1i48 n ASN 244 Cb 0.85 -0.16 -0.06 0.00 -0.61 0.00 0.00 39.78 39.80 1i48 n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i48 s GLN 245 N -3.14 0.45 -0.75 3.52 -2.07 -1.06 -1.76 119.66 114.85 1i48 s GLN 245 Ca 0.08 0.34 0.04 0.00 -1.82 0.00 0.00 55.36 53.99 1i48 s GLN 245 Cb 0.13 0.22 0.26 0.00 -1.09 0.00 0.00 33.01 32.53 1i48 s GLN 245 CO 0.68 -0.09 0.93 1.63 -1.32 0.00 0.00 175.29 177.12 1i48 n LYS 246 N 1.52 3.02 -0.43 9.60 4.76 -1.26 -4.28 118.16 131.10 1i48 n LYS 246 Ca -0.11 -4.65 0.37 0.00 -2.87 0.00 0.00 58.31 51.05 1i48 n LYS 246 Cb 0.57 -2.32 0.64 0.00 -1.84 0.00 0.00 35.03 32.07 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 0.95 1.25 -0.02 7.82 0.00 -1.26 0.27 120.51 129.52 1i48 n ALA 247 Ca 0.29 0.87 -0.11 0.00 0.00 0.00 0.00 53.44 54.49 1i48 n ALA 247 Cb 0.39 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 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 0.16 -1.83 0.00 3.38 -1.86 -1.69 115.31 113.47 1i48 h LEU 248 Ca 0.84 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.68 1i48 h LEU 248 Cb 2.62 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 43.32 1i48 h LEU 248 CO -0.51 0.22 -0.14 0.00 0.09 0.00 0.00 178.44 178.10 1i48 h ALA 249 N 0.95 1.37 0.00 1.53 0.00 -0.49 -0.36 119.26 122.26 1i48 h ALA 249 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1i48 h ALA 249 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1i48 h ALA 249 CO -0.01 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.70 1i48 n LEU 250 N -3.79 0.16 0.00 0.00 4.77 -0.77 -4.86 117.00 112.50 1i48 n LEU 250 Ca -0.02 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1i48 n LEU 250 Cb 0.25 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1i48 n LEU 250 CO 0.32 -0.23 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 1i48 n GLY 251 N 0.47 2.01 3.44 -0.72 0.00 -0.15 -3.25 105.19 106.99 1i48 n GLY 251 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 -1.69 -0.04 4.61 0.00 -0.71 -4.93 120.51 117.75 1i48 n ALA 252 Ca 0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 53.44 53.00 1i48 n ALA 252 Cb 0.00 -1.81 -0.13 0.00 0.00 0.00 0.00 19.45 17.51 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 -0.33 0.21 -3.93 0.00 3.32 -1.21 -3.42 116.42 111.06 1i48 h ASP 253 Ca -0.45 -0.74 -0.38 0.00 0.02 0.00 0.00 57.03 55.48 1i48 h ASP 253 Cb 1.36 -0.07 -0.29 0.00 0.22 0.00 0.00 39.33 40.55 1i48 h ASP 253 CO 0.42 1.60 -0.77 -0.76 -1.72 0.00 0.00 179.24 178.01 1i48 s LEU 254 N -7.59 1.93 -0.03 1.55 1.43 -0.75 -4.31 118.68 110.91 1i48 s LEU 254 Ca -0.24 -0.14 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 1i48 s LEU 254 Cb 0.05 -0.42 -0.01 0.00 0.03 0.00 0.00 46.19 45.85 1i48 s LEU 254 CO 0.69 0.08 -0.17 0.54 0.23 0.00 0.00 176.35 177.72 1i48 s VAL 255 N -0.05 1.38 -0.02 -1.59 0.11 -0.85 -0.03 120.40 119.36 1i48 s VAL 255 Ca 0.01 -0.72 -0.04 0.00 -2.93 0.00 0.00 61.98 58.30 1i48 s VAL 255 Cb -0.05 -1.17 0.00 0.00 -1.53 0.00 0.00 36.38 33.64 1i48 s VAL 255 CO -0.00 0.40 0.10 -1.48 -3.33 0.00 0.00 175.10 170.78 1i48 s LEU 256 N -0.16 1.67 0.21 2.54 0.05 -0.48 -0.62 118.68 121.90 1i48 s LEU 256 Ca 0.01 -0.01 0.05 0.00 0.05 0.00 0.00 54.13 54.22 1i48 s LEU 256 Cb -0.09 0.42 -0.05 0.00 -2.05 0.00 0.00 46.19 44.42 1i48 s LEU 256 CO 0.01 -0.18 -0.06 -1.00 -0.55 0.00 0.00 176.35 174.58 1i48 s HIS 257 N -0.60 1.56 -0.81 3.48 3.76 -0.95 -2.34 115.29 119.40 1i48 s HIS 257 Ca -0.07 -0.80 -0.14 0.00 -0.15 0.00 0.00 55.06 53.91 1i48 s HIS 257 Cb -0.04 -0.86 0.21 0.00 1.11 0.00 0.00 32.58 33.01 1i48 s HIS 257 CO 0.00 0.09 0.75 0.45 -0.85 0.00 0.00 174.74 175.18 1i48 s SER 258 N -3.29 6.69 0.49 1.40 0.15 -1.26 -2.32 113.70 115.55 1i48 s SER 258 Ca 0.25 -2.67 0.20 0.00 0.70 0.00 0.00 55.95 54.42 1i48 s SER 258 Cb 0.04 -2.20 1.07 0.00 -1.71 0.00 0.00 66.02 63.22 1i48 s SER 258 CO 0.07 -0.57 1.55 0.00 1.20 0.00 0.00 173.24 175.48 1i48 h ALA 259 N 7.79 1.30 -0.76 5.45 0.00 -0.76 0.16 119.26 132.43 1i48 h ALA 259 Ca 0.09 0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.18 1i48 h ALA 259 Cb 1.04 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1i48 h ALA 259 CO 0.76 -0.30 0.52 1.15 0.00 0.00 0.00 179.25 181.39 1i48 h THR 260 N 0.00 0.70 0.00 0.00 2.02 -1.53 -0.69 112.91 113.41 1i48 h THR 260 Ca 0.00 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.11 1i48 h THR 260 Cb 0.70 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1i48 h THR 260 CO 0.00 0.04 0.00 0.29 0.37 0.00 0.00 175.52 176.22 1i48 n LYS 261 N -4.41 0.00 -0.07 6.66 4.76 0.55 -4.50 118.16 121.15 1i48 n LYS 261 Ca 0.15 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.45 1i48 n LYS 261 Cb 0.68 -0.01 -0.13 0.00 -1.84 0.00 0.00 35.03 33.74 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 -0.72 2.13 0.04 -1.74 0.39 116.94 117.05 1i48 h PHE 262 Ca 0.00 0.00 0.16 0.00 2.80 0.00 0.00 57.97 60.93 1i48 h PHE 262 Cb 0.00 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.03 1i48 h PHE 262 CO 0.00 1.03 0.06 -0.07 -0.60 0.00 0.00 178.31 178.73 1i48 h LEU 263 N -1.00 -0.22 0.22 1.54 3.38 -1.84 -0.65 115.31 116.74 1i48 h LEU 263 Ca -0.04 0.17 -0.30 0.00 0.09 0.00 0.00 57.88 57.81 1i48 h LEU 263 Cb 1.01 0.28 0.03 0.00 0.09 0.00 0.00 40.66 42.07 1i48 h LEU 263 CO -0.02 -0.12 -1.32 1.23 0.09 0.00 0.00 178.44 178.29 1i48 h GLY 264 N 0.15 0.53 -3.51 0.83 0.00 -1.27 -3.27 103.07 96.54 1i48 h GLY 264 Ca 0.40 -1.36 -0.10 0.00 0.00 0.00 0.00 47.33 46.27 1i48 h GLY 264 CO -0.59 1.19 -0.11 0.61 0.00 0.00 0.00 176.54 177.64 1i48 n GLY 265 N 1.72 -0.14 0.00 4.60 0.00 0.13 -4.69 105.19 106.80 1i48 n GLY 265 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1i48 n GLY 265 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1i48 n HIS 266 N -2.29 0.00 -3.47 1.61 8.25 -1.26 -1.38 115.22 116.68 1i48 n HIS 266 Ca -0.06 -0.11 -0.25 0.00 -0.26 0.00 0.00 57.72 57.04 1i48 n HIS 266 Cb 0.40 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.51 1i48 n HIS 266 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1i48 n ASN 267 N -0.11 -4.22 -0.83 0.41 3.02 -1.26 -4.83 115.26 107.44 1i48 n ASN 267 Ca 0.00 -0.49 0.04 0.00 -0.03 0.00 0.00 54.58 54.10 1i48 n ASN 267 Cb 0.22 -3.45 0.06 0.00 -0.61 0.00 0.00 39.78 36.01 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 -2.44 1.01 -3.64 6.41 5.75 -1.26 -5.08 116.55 117.30 1i48 n ASP 268 Ca -0.01 -2.49 -0.04 0.00 -0.01 0.00 0.00 54.79 52.24 1i48 n ASP 268 Cb 0.55 -0.33 -0.06 0.00 -1.03 0.00 0.00 41.12 40.25 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 -0.98 0.00 -0.02 2.12 0.11 -1.26 -5.10 120.40 115.26 1i48 s VAL 269 Ca 0.24 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.29 1i48 s VAL 269 Cb 0.25 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.07 1i48 s VAL 269 CO -0.07 0.00 0.02 -0.76 -3.33 0.00 0.00 175.10 170.95 1i48 s LEU 270 N -0.41 3.60 -0.29 2.54 1.43 -1.26 -4.41 118.68 119.87 1i48 s LEU 270 Ca 0.06 0.06 -0.25 0.00 -1.03 0.00 0.00 54.13 52.97 1i48 s LEU 270 Cb -0.03 -2.02 0.18 0.00 0.03 0.00 0.00 46.19 44.35 1i48 s LEU 270 CO -0.10 0.30 1.38 0.00 0.23 0.00 0.00 176.35 178.16 1i48 s ALA 271 N -1.06 -2.18 0.36 4.21 0.00 -1.18 -4.64 121.76 117.27 1i48 s ALA 271 Ca 0.19 1.71 0.09 0.00 0.00 0.00 0.00 51.96 53.95 1i48 s ALA 271 Cb -0.12 -1.71 -0.07 0.00 0.00 0.00 0.00 23.12 21.22 1i48 s ALA 271 CO 0.09 -0.13 -0.07 0.20 0.00 0.00 0.00 175.76 175.86 1i48 s GLY 272 N -0.03 2.26 -0.15 0.00 0.00 -1.23 -0.02 107.32 108.14 1i48 s GLY 272 Ca 0.07 -2.14 -0.29 0.00 0.00 0.00 0.00 44.72 42.36 1i48 s GLY 272 CO -0.14 -2.04 0.81 0.00 0.00 0.00 0.00 173.10 171.73 1i48 s ILE 274 N -0.64 1.06 0.08 0.00 1.01 -0.47 -2.23 121.20 120.00 1i48 s ILE 274 Ca -0.05 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.10 1i48 s ILE 274 Cb -0.02 -0.90 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 1i48 s ILE 274 CO 0.04 0.31 -0.11 -0.44 0.00 0.00 0.00 174.94 174.74 1i48 s SER 275 N -0.12 1.39 0.00 3.58 0.01 0.20 0.45 113.70 119.21 1i48 s SER 275 Ca 0.01 -0.71 0.00 0.00 1.31 0.00 0.00 55.95 56.57 1i48 s SER 275 Cb -0.07 -0.00 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1i48 s SER 275 CO 0.00 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.06 1i48 n GLY 276 N 0.93 -0.51 3.77 3.44 0.00 -0.47 -2.00 105.19 110.35 1i48 n GLY 276 Ca -0.19 -1.00 -0.39 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.70 4.12 0.11 1.61 0.04 -1.26 -1.49 135.00 136.42 1i48 s PRO 277 Ca 0.00 1.96 -0.33 0.00 0.04 0.00 0.00 61.00 62.67 1i48 s PRO 277 Cb 0.00 -2.79 -0.12 0.00 0.04 0.00 0.00 34.50 31.63 1i48 s PRO 277 CO 0.00 -0.30 1.57 1.25 0.04 0.00 0.00 177.00 179.56 1i48 h LEU 278 N 2.83 -1.40 -1.77 -3.56 6.46 -1.89 -0.39 115.31 115.59 1i48 h LEU 278 Ca -0.49 0.15 0.53 0.00 -0.12 0.00 0.00 57.88 57.95 1i48 h LEU 278 Cb 1.23 0.52 -0.09 0.00 -0.73 0.00 0.00 40.66 41.60 1i48 h LEU 278 CO 0.63 -0.53 1.26 1.17 -0.62 0.00 0.00 178.44 180.35 1i48 n LYS 279 N -5.48 -0.01 -0.06 1.25 0.00 -1.26 -1.21 118.16 111.39 1i48 n LYS 279 Ca -0.08 1.05 -0.05 0.00 0.00 0.00 0.00 58.31 59.23 1i48 n LYS 279 Cb 0.40 -2.36 -0.02 0.00 0.00 0.00 0.00 35.03 33.05 1i48 n LYS 279 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1i48 n LEU 280 N -3.95 1.42 -0.31 3.14 4.77 -0.51 -4.28 117.00 117.28 1i48 n LEU 280 Ca 0.41 0.42 0.15 0.00 -0.03 0.00 0.00 56.01 56.96 1i48 n LEU 280 Cb 1.83 -0.74 0.33 0.00 -2.33 0.00 0.00 43.42 42.51 1i48 n LEU 280 CO 0.38 -0.42 1.01 1.62 -1.33 0.00 0.00 177.39 178.66 1i48 h VAL 281 N -0.76 0.38 -0.32 4.08 3.04 -0.54 -0.61 116.25 121.52 1i48 h VAL 281 Ca 0.00 -0.11 0.06 0.00 -1.01 0.00 0.00 66.70 65.64 1i48 h VAL 281 Cb 0.55 0.04 -0.06 0.00 -2.01 0.00 0.00 31.29 29.82 1i48 h VAL 281 CO 0.00 0.06 -0.05 0.77 -1.01 0.00 0.00 177.57 177.34 1i48 h SER 282 N 0.31 -0.23 -1.04 3.17 4.64 -1.40 0.37 113.55 119.37 1i48 h SER 282 Ca 0.58 0.09 0.28 0.00 -0.47 0.00 0.00 61.79 62.27 1i48 h SER 282 Cb 1.18 0.17 -0.12 0.00 -0.31 0.00 0.00 62.40 63.32 1i48 h SER 282 CO -0.59 -0.08 0.63 -0.33 -0.87 0.00 0.00 176.83 175.59 1i48 h GLU 283 N 0.03 0.44 -0.01 4.77 4.39 -1.29 0.11 114.58 123.03 1i48 h GLU 283 Ca 0.15 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1i48 h GLU 283 Cb 0.22 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1i48 h GLU 283 CO -0.30 0.29 -0.05 0.82 -1.16 0.00 0.00 179.01 178.61 1i48 h ILE 284 N 0.45 1.55 -0.93 3.13 2.04 -1.09 -3.16 117.51 119.49 1i48 h ILE 284 Ca 0.65 -1.68 0.25 0.00 1.00 0.00 0.00 64.86 65.09 1i48 h ILE 284 Cb 1.47 2.66 -0.14 0.00 -0.74 0.00 0.00 36.82 40.07 1i48 h ILE 284 CO -0.43 0.44 0.40 -0.09 0.00 0.00 0.00 178.15 178.47 1i48 h ARG 285 N -0.63 0.32 0.49 2.37 9.65 0.11 0.35 114.38 127.03 1i48 h ARG 285 Ca -0.00 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.84 1i48 h ARG 285 Cb 0.75 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.26 1i48 h ARG 285 CO 0.01 0.21 -0.35 -0.91 2.80 0.00 0.00 179.97 181.73 1i48 h ASN 286 N 0.33 -0.90 -0.85 -3.80 4.21 -0.96 0.85 115.58 114.45 1i48 h ASN 286 Ca 0.61 0.06 0.18 0.00 1.21 0.00 0.00 56.30 58.36 1i48 h ASN 286 Cb 1.26 0.28 -0.06 0.00 -1.12 0.00 0.00 38.32 38.67 1i48 h ASN 286 CO -0.59 -0.51 0.56 0.25 -1.29 0.00 0.00 177.43 175.85 1i48 h LEU 287 N -0.80 0.41 -0.06 1.61 5.85 -1.19 0.48 115.31 121.61 1i48 h LEU 287 Ca -0.06 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1i48 h LEU 287 Cb 0.66 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1i48 h LEU 287 CO 0.04 0.19 -0.01 -0.74 -0.34 0.00 0.00 178.44 177.58 1i48 h HIS 288 N 0.42 -0.01 -0.19 1.25 2.76 0.43 -0.72 115.15 119.10 1i48 h HIS 288 Ca 0.43 0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.66 1i48 h HIS 288 Cb 1.02 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.99 1i48 h HIS 288 CO -0.00 -0.01 0.35 0.45 -1.30 0.00 0.00 177.93 177.41 1i48 h HIS 289 N 0.01 0.00 0.00 5.26 3.86 0.15 0.12 115.15 124.54 1i48 h HIS 289 Ca 0.03 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.07 1i48 h HIS 289 Cb 0.04 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 1i48 h HIS 289 CO -0.11 0.00 -1.06 0.82 0.86 0.00 0.00 177.93 178.43 1i48 h ILE 290 N 0.00 0.68 0.00 2.45 2.04 -1.08 -3.35 117.51 118.24 1i48 h ILE 290 Ca 0.09 -1.87 -0.00 0.00 1.00 0.00 0.00 64.86 64.07 1i48 h ILE 290 Cb 0.79 1.64 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1i48 h ILE 290 CO -0.00 0.23 -0.01 -0.07 0.00 0.00 0.00 178.15 178.30 1i48 h LEU 291 N -1.00 0.00 -2.73 1.44 3.38 -0.70 -3.47 115.31 112.23 1i48 h LEU 291 Ca -0.26 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.58 1i48 h LEU 291 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1i48 h LEU 291 CO -0.16 0.01 -0.49 0.61 0.09 0.00 0.00 178.44 178.50 1i48 n GLY 292 N -1.12 -1.10 1.01 0.83 0.00 0.36 -4.95 105.19 100.22 1i48 n GLY 292 Ca -0.03 0.83 0.01 0.00 0.00 0.00 0.00 46.02 46.82 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 -1.10 4.78 3.48 -0.02 0.00 -1.26 -5.08 105.19 105.98 1i48 n GLY 293 Ca -0.03 -1.48 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.84 -1.14 -2.67 4.61 0.00 -1.26 -1.99 120.51 117.21 1i48 n ALA 294 Ca 0.21 0.09 -0.38 0.00 0.00 0.00 0.00 53.44 53.37 1i48 n ALA 294 Cb 0.79 -1.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.35 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 1.07 4.31 0.33 0.00 2.96 -1.26 -4.53 118.68 121.55 1i48 s LEU 295 Ca 0.65 0.79 -0.29 0.00 -0.22 0.00 0.00 54.13 55.06 1i48 s LEU 295 Cb -0.53 -2.61 -0.10 0.00 0.50 0.00 0.00 46.19 43.44 1i48 s LEU 295 CO 0.56 0.08 1.30 0.21 -1.32 0.00 0.00 176.35 177.19 1i48 s ASN 296 N 0.26 6.79 0.15 3.68 3.84 -1.26 -4.87 114.94 123.52 1i48 s ASN 296 Ca 0.24 2.68 -0.26 0.00 0.21 0.00 0.00 52.86 55.72 1i48 s ASN 296 Cb -0.15 -2.65 -0.01 0.00 -0.55 0.00 0.00 41.25 37.89 1i48 s ASN 296 CO 0.10 -0.52 1.59 -0.65 -2.79 0.00 0.00 177.10 174.82 1i48 h PRO 297 N 3.39 -0.36 -0.93 0.43 0.11 -1.97 -1.21 132.00 131.47 1i48 h PRO 297 Ca -0.49 0.02 0.27 0.00 0.11 0.00 0.00 66.00 65.91 1i48 h PRO 297 Cb 1.23 0.08 -0.15 0.00 0.11 0.00 0.00 31.00 32.27 1i48 h PRO 297 CO 0.65 -0.24 0.35 -0.91 -0.21 0.00 0.00 178.00 177.65 1i48 h ASN 298 N -0.38 0.18 0.95 -2.05 2.35 -1.92 0.41 115.58 115.12 1i48 h ASN 298 Ca 0.12 0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 56.02 1i48 h ASN 298 Cb 0.58 0.23 0.01 0.00 0.05 0.00 0.00 38.32 39.19 1i48 h ASN 298 CO -0.47 -0.16 -0.46 0.00 -1.65 0.00 0.00 177.43 174.70 1i48 h ALA 299 N 1.82 -1.30 -0.93 -0.83 0.00 -1.63 -1.69 119.26 114.70 1i48 h ALA 299 Ca 0.62 -0.28 0.26 0.00 0.00 0.00 0.00 54.91 55.51 1i48 h ALA 299 Cb 1.33 0.49 -0.17 0.00 0.00 0.00 0.00 17.79 19.45 1i48 h ALA 299 CO -0.65 -1.21 0.09 0.00 0.00 0.00 0.00 179.25 177.48 1i48 h ALA 300 N -1.37 1.18 0.45 0.00 0.00 0.42 0.31 119.26 120.25 1i48 h ALA 300 Ca -0.13 0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1i48 h ALA 300 Cb 0.98 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1i48 h ALA 300 CO 0.21 -0.55 -0.22 -0.92 0.00 0.00 0.00 179.25 177.78 1i48 h TYR 301 N 0.06 -0.56 -0.86 0.00 3.20 -0.32 -0.50 116.97 117.99 1i48 h TYR 301 Ca 0.57 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.66 1i48 h TYR 301 Cb 1.18 0.19 -0.14 0.00 1.54 0.00 0.00 36.73 39.49 1i48 h TYR 301 CO -0.41 -0.31 0.16 -0.07 -1.64 0.00 0.00 178.16 175.89 1i48 h LEU 302 N -0.68 -0.13 0.16 2.82 3.38 -0.02 0.63 115.31 121.47 1i48 h LEU 302 Ca -0.06 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1i48 h LEU 302 Cb 0.50 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1i48 h LEU 302 CO 0.10 -0.18 -0.08 0.40 0.09 0.00 0.00 178.44 178.77 1i48 h ILE 303 N 0.16 0.92 -0.84 1.22 2.04 -1.02 0.10 117.51 120.10 1i48 h ILE 303 Ca 0.53 -0.35 0.16 0.00 1.00 0.00 0.00 64.86 66.19 1i48 h ILE 303 Cb 1.05 1.14 -0.10 0.00 -0.74 0.00 0.00 36.82 38.17 1i48 h ILE 303 CO -0.69 0.08 0.40 0.40 0.00 0.00 0.00 178.15 178.35 1i48 h ILE 304 N -0.38 0.68 -0.66 -0.67 2.04 0.10 0.31 117.51 118.93 1i48 h ILE 304 Ca -0.02 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1i48 h ILE 304 Cb 0.30 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 1i48 h ILE 304 CO 0.04 0.10 0.24 -0.09 0.00 0.00 0.00 178.15 178.44 1i48 h ARG 305 N 0.55 0.98 -0.04 2.37 2.43 0.60 -3.08 114.38 118.19 1i48 h ARG 305 Ca 0.47 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 59.46 1i48 h ARG 305 Cb 0.71 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1i48 h ARG 305 CO -0.40 0.81 -0.02 0.78 -1.51 0.00 0.00 179.97 179.64 1i48 h GLY 306 N 1.04 0.09 1.75 2.80 0.00 0.21 -3.00 103.07 105.96 1i48 h GLY 306 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1i48 h GLY 306 CO -0.02 0.07 0.08 1.03 0.00 0.00 0.00 176.54 177.71 1i48 n MET 307 N -4.82 0.08 0.30 4.80 2.81 0.03 -0.88 117.12 119.44 1i48 n MET 307 Ca -0.08 0.56 0.16 0.00 -1.81 0.00 0.00 57.70 56.53 1i48 n MET 307 Cb 0.24 -1.86 0.93 0.00 -0.71 0.00 0.00 33.22 31.82 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 -1.45 -2.08 116.57 114.86 1i48 h LYS 308 Ca 0.00 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1i48 h LYS 308 Cb 0.17 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1i48 h LYS 308 CO 0.00 0.02 -0.14 0.25 -1.08 0.00 0.00 179.45 178.50 1i48 n THR 309 N -3.70 1.57 0.02 -0.16 -2.24 -0.06 -4.74 114.28 104.98 1i48 n THR 309 Ca -0.03 -1.95 -0.05 0.00 -2.27 0.00 0.00 64.05 59.76 1i48 n THR 309 Cb 0.11 -0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.21 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 0.09 -0.49 -0.46 3.22 5.85 -1.37 -1.09 115.31 121.07 1i48 h LEU 310 Ca -0.00 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1i48 h LEU 310 Cb 1.08 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 42.21 1i48 h LEU 310 CO 0.00 -0.16 -0.55 1.12 -0.34 0.00 0.00 178.44 178.51 1i48 h HIS 311 N -0.21 -1.69 -0.96 1.25 2.07 -1.90 0.72 115.15 114.43 1i48 h HIS 311 Ca 0.00 0.09 0.15 0.00 -2.85 0.00 0.00 60.37 57.76 1i48 h HIS 311 Cb 0.22 0.80 -0.16 0.00 2.57 0.00 0.00 27.41 30.84 1i48 h HIS 311 CO -0.38 -0.46 -0.36 1.28 -3.07 0.00 0.00 177.93 174.94 1i48 n LEU 312 N -5.28 -0.59 0.37 6.12 7.99 -1.11 -0.70 117.00 123.80 1i48 n LEU 312 Ca -0.03 1.68 -0.15 0.00 -0.01 0.00 0.00 56.01 57.50 1i48 n LEU 312 Cb 0.32 -0.40 -0.07 0.00 -0.11 0.00 0.00 43.42 43.16 1i48 n LEU 312 CO -0.01 -1.52 0.41 0.03 -1.51 0.00 0.00 177.39 174.79 1i48 h ARG 313 N 0.00 -0.93 -0.81 3.23 3.08 0.22 -2.97 114.38 116.19 1i48 h ARG 313 Ca 0.35 0.06 0.16 0.00 0.07 0.00 0.00 59.98 60.63 1i48 h ARG 313 Cb 0.59 0.21 -0.15 0.00 0.08 0.00 0.00 29.97 30.70 1i48 h ARG 313 CO -0.96 -0.62 -0.20 0.28 -1.07 0.00 0.00 179.97 177.39 1i48 h VAL 314 N -1.18 0.19 -0.01 2.04 2.07 -0.15 0.14 116.25 119.34 1i48 h VAL 314 Ca -0.10 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1i48 h VAL 314 Cb 0.74 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1i48 h VAL 314 CO 0.16 0.00 -0.04 1.56 0.02 0.00 0.00 177.57 179.27 1i48 h GLN 315 N 0.00 -0.05 -0.83 1.57 4.20 -0.94 0.70 115.11 119.77 1i48 h GLN 315 Ca 0.39 0.00 0.20 0.00 0.06 0.00 0.00 58.65 59.30 1i48 h GLN 315 Cb 0.60 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 28.24 1i48 h GLN 315 CO -0.84 -0.03 0.04 0.37 -0.67 0.00 0.00 178.83 177.70 1i48 h GLN 316 N -0.05 0.10 -0.63 1.46 5.75 -1.12 0.90 115.11 121.52 1i48 h GLN 316 Ca 0.00 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.46 1i48 h GLN 316 Cb 0.05 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 1i48 h GLN 316 CO -0.03 0.06 0.25 1.96 -2.65 0.00 0.00 178.83 178.43 1i48 h GLN 317 N 0.10 0.93 -0.58 1.69 4.20 0.03 -2.25 115.11 119.23 1i48 h GLN 317 Ca 0.47 -0.17 0.03 0.00 0.06 0.00 0.00 58.65 59.04 1i48 h GLN 317 Cb 0.88 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.46 1i48 h GLN 317 CO -0.72 0.79 0.34 -0.91 -0.67 0.00 0.00 178.83 177.66 1i48 h ASN 318 N 0.87 0.55 0.10 1.46 2.35 0.29 -2.01 115.58 119.19 1i48 h ASN 318 Ca 0.21 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1i48 h ASN 318 Cb 0.20 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1i48 h ASN 318 CO -0.02 0.38 -0.05 0.28 -1.65 0.00 0.00 177.43 176.38 1i48 h SER 319 N 0.67 -0.11 -0.92 5.81 0.02 -1.17 -2.45 113.55 115.41 1i48 h SER 319 Ca 0.24 0.00 0.23 0.00 -0.84 0.00 0.00 61.79 61.42 1i48 h SER 319 Cb 0.04 0.03 -0.17 0.00 0.14 0.00 0.00 62.40 62.44 1i48 h SER 319 CO -0.11 -0.07 -0.04 0.41 -1.14 0.00 0.00 176.83 175.88 1i48 n THR 320 N -2.41 -0.38 0.05 -2.27 -1.04 -0.87 -0.71 114.28 106.66 1i48 n THR 320 Ca -0.02 2.03 -0.04 0.00 -2.04 0.00 0.00 64.05 63.99 1i48 n THR 320 Cb 0.05 -2.93 -0.02 0.00 -1.82 0.00 0.00 70.33 65.60 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 1.83 -0.77 -0.69 2.41 0.00 -1.34 -0.99 119.26 119.70 1i48 h ALA 321 Ca 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1i48 h ALA 321 Cb 1.02 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1i48 h ALA 321 CO -0.88 -0.79 0.00 -0.11 0.00 0.00 0.00 179.25 177.47 1i48 n LEU 322 N -3.13 0.00 -0.33 0.00 7.94 0.11 0.40 117.00 121.99 1i48 n LEU 322 Ca -0.03 0.88 -0.09 0.00 -1.11 0.00 0.00 56.01 55.67 1i48 n LEU 322 Cb 0.11 -0.38 -0.08 0.00 0.53 0.00 0.00 43.42 43.59 1i48 n LEU 322 CO 0.05 -0.38 0.48 0.03 -1.11 0.00 0.00 177.39 176.46 1i48 h ARG 323 N 0.00 -0.02 -0.86 1.96 3.08 -1.40 0.79 114.38 117.93 1i48 h ARG 323 Ca 0.00 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.24 1i48 h ARG 323 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 1i48 h ARG 323 CO 0.00 -0.01 0.57 0.52 -1.07 0.00 0.00 179.97 179.98 1i48 h MET 324 N -0.02 0.39 0.94 0.04 2.86 -0.75 -0.81 114.93 117.58 1i48 h MET 324 Ca 0.13 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 1i48 h MET 324 Cb 0.34 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.92 1i48 h MET 324 CO -0.75 0.26 -0.48 0.00 1.06 0.00 0.00 176.91 177.00 1i48 h ALA 325 N 1.62 -1.34 0.23 6.32 0.00 0.55 0.22 119.26 126.87 1i48 h ALA 325 Ca 0.44 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1i48 h ALA 325 Cb 1.09 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 1i48 h ALA 325 CO -0.16 -1.25 -0.50 0.93 0.00 0.00 0.00 179.25 178.27 1i48 h GLU 326 N -1.29 -0.78 -0.97 0.00 5.08 -0.61 0.47 114.58 116.47 1i48 h GLU 326 Ca -0.13 0.05 0.31 0.00 -1.00 0.00 0.00 59.36 58.60 1i48 h GLU 326 Cb 1.00 0.18 -0.15 0.00 0.50 0.00 0.00 28.75 30.27 1i48 h GLU 326 CO 0.19 -0.52 0.45 0.82 -1.00 0.00 0.00 179.01 178.96 1i48 h ILE 327 N -0.81 0.24 -0.16 3.13 2.04 -1.12 0.43 117.51 121.26 1i48 h ILE 327 Ca -0.02 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.67 1i48 h ILE 327 Cb 0.78 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1i48 h ILE 327 CO -0.22 0.04 -0.27 -0.07 0.00 0.00 0.00 178.15 177.63 1i48 h LEU 328 N 0.23 0.51 -0.82 1.44 3.38 0.12 -2.67 115.31 117.50 1i48 h LEU 328 Ca 0.70 -0.54 0.06 0.00 0.09 0.00 0.00 57.88 58.19 1i48 h LEU 328 Cb 1.60 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 42.15 1i48 h LEU 328 CO -0.66 0.95 0.50 -0.08 0.09 0.00 0.00 178.44 179.24 1i48 h GLU 329 N 0.09 0.89 0.00 1.13 4.81 0.41 -1.28 114.58 120.63 1i48 h GLU 329 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1i48 h GLU 329 Cb 0.86 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1i48 h GLU 329 CO 0.06 0.59 0.00 0.00 -0.73 0.00 0.00 179.01 178.93 1i48 h ALA 330 N 1.39 1.00 -2.76 2.92 0.00 -0.75 -3.45 119.26 117.61 1i48 h ALA 330 Ca 0.35 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.74 1i48 h ALA 330 Cb 0.16 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.00 1i48 h ALA 330 CO -0.17 0.00 0.70 -1.58 0.00 0.00 0.00 179.25 178.20 1i48 s HIS 331 N -3.56 3.09 0.17 0.00 5.65 -0.48 -4.94 115.29 115.22 1i48 s HIS 331 Ca 0.02 1.17 -0.12 0.00 0.25 0.00 0.00 55.06 56.38 1i48 s HIS 331 Cb 0.09 -3.73 0.08 0.00 -1.18 0.00 0.00 32.58 27.83 1i48 s HIS 331 CO 0.54 -2.26 1.74 -1.00 -0.65 0.00 0.00 174.74 173.12 1i48 h PRO 332 N 4.74 0.87 0.00 2.88 0.13 -1.87 -2.63 132.00 136.12 1i48 h PRO 332 Ca -0.46 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1i48 h PRO 332 Cb 1.22 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1i48 h PRO 332 CO 0.75 0.72 0.00 1.63 -0.23 0.00 0.00 178.00 180.87 1i48 n LYS 333 N -4.50 0.07 -3.01 0.86 5.02 -1.26 -4.51 118.16 110.83 1i48 n LYS 333 Ca 0.04 0.27 -0.44 0.00 -2.02 0.00 0.00 58.31 56.16 1i48 n LYS 333 Cb 0.14 -1.63 -0.05 0.00 -0.02 0.00 0.00 35.03 33.48 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 -3.10 4.63 0.07 -0.18 1.01 -0.99 0.72 120.40 122.55 1i48 s VAL 334 Ca 0.07 -0.41 -0.35 0.00 0.00 0.00 0.00 61.98 61.30 1i48 s VAL 334 Cb 0.11 -4.48 -0.20 0.00 0.00 0.00 0.00 36.38 31.81 1i48 s VAL 334 CO 0.35 -1.09 1.61 -0.09 0.00 0.00 0.00 175.10 175.87 1i48 h ARG 335 N 9.24 -1.04 -4.23 2.72 2.43 -1.41 -3.46 114.38 118.64 1i48 h ARG 335 Ca -0.28 0.07 -0.16 0.00 -0.81 0.00 0.00 59.98 58.80 1i48 h ARG 335 Cb 1.08 0.24 -0.17 0.00 -0.42 0.00 0.00 29.97 30.70 1i48 h ARG 335 CO 1.07 -0.69 -0.69 -1.58 -1.51 0.00 0.00 179.97 176.57 1i48 s HIS 336 N -6.03 0.49 -0.03 2.20 5.04 -1.10 -4.98 115.29 110.88 1i48 s HIS 336 Ca -0.19 -0.84 0.00 0.00 -1.54 0.00 0.00 55.06 52.50 1i48 s HIS 336 Cb 0.03 -0.34 0.03 0.00 0.04 0.00 0.00 32.58 32.34 1i48 s HIS 336 CO 0.61 -0.27 0.02 0.08 -2.34 0.00 0.00 174.74 172.84 1i48 s VAL 337 N -2.90 0.04 -0.16 0.89 1.01 -1.26 -1.03 120.40 116.99 1i48 s VAL 337 Ca -0.01 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 1i48 s VAL 337 Cb 0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.19 1i48 s VAL 337 CO -0.06 0.12 -0.04 -0.31 0.00 0.00 0.00 175.10 174.81 1i48 s TYR 338 N 1.10 3.00 -0.30 5.22 1.51 0.16 -4.85 117.35 123.19 1i48 s TYR 338 Ca -0.09 -0.40 -0.18 0.00 -1.01 0.00 0.00 57.07 55.39 1i48 s TYR 338 Cb -0.13 -1.97 0.19 0.00 -0.11 0.00 0.00 41.96 39.93 1i48 s TYR 338 CO -0.02 -0.12 1.22 -0.47 -1.11 0.00 0.00 175.55 175.05 1i48 s TYR 339 N 0.53 -0.22 0.64 2.71 5.04 -1.26 -2.71 117.35 122.08 1i48 s TYR 339 Ca -0.03 0.37 0.28 0.00 -2.44 0.00 0.00 57.07 55.25 1i48 s TYR 339 Cb -0.14 0.13 1.46 0.00 0.35 0.00 0.00 41.96 43.76 1i48 s TYR 339 CO 0.03 -0.11 1.84 -1.35 -1.34 0.00 0.00 175.55 174.63 1i48 h PRO 340 N 7.10 0.00 -0.08 4.97 0.11 -1.87 -0.32 132.00 141.90 1i48 h PRO 340 Ca -0.14 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.88 1i48 h PRO 340 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1i48 h PRO 340 CO 0.07 0.00 -0.35 0.78 -0.21 0.00 0.00 178.00 178.29 1i48 h GLY 341 N 0.00 0.17 -1.68 -0.55 0.00 -1.94 -3.43 103.07 95.64 1i48 h GLY 341 Ca 0.09 -0.14 -0.49 0.00 0.00 0.00 0.00 47.33 46.79 1i48 h GLY 341 CO -0.00 0.13 0.36 1.08 0.00 0.00 0.00 176.54 178.11 1i48 s LEU 342 N -8.32 3.51 0.21 3.11 1.43 -0.13 -4.96 118.68 113.53 1i48 s LEU 342 Ca -0.04 1.46 0.10 0.00 -1.03 0.00 0.00 54.13 54.62 1i48 s LEU 342 Cb 0.14 -4.43 0.10 0.00 0.03 0.00 0.00 46.19 42.02 1i48 s LEU 342 CO 0.75 -0.67 1.45 1.56 0.23 0.00 0.00 176.35 179.68 1i48 h GLN 343 N 0.50 0.00 0.00 1.70 4.20 -1.86 -2.98 115.11 116.67 1i48 h GLN 343 Ca -0.46 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.25 1i48 h GLN 343 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1i48 h GLN 343 CO 0.62 0.76 0.10 0.66 -0.67 0.00 0.00 178.83 180.30 1i48 h SER 344 N 0.00 0.00 -3.32 1.46 4.64 -1.93 -3.42 113.55 110.98 1i48 h SER 344 Ca -0.01 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1i48 h SER 344 Cb 1.42 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.50 1i48 h SER 344 CO 0.10 0.00 0.45 -2.28 -0.87 0.00 0.00 176.83 174.23 1i48 s HIS 345 N -3.69 3.57 0.10 4.77 5.04 -1.13 -4.97 115.29 118.97 1i48 s HIS 345 Ca -0.03 1.53 -0.24 0.00 -1.54 0.00 0.00 55.06 54.78 1i48 s HIS 345 Cb 0.07 -3.25 -0.08 0.00 0.04 0.00 0.00 32.58 29.37 1i48 s HIS 345 CO 0.23 -0.56 1.41 -1.35 -2.34 0.00 0.00 174.74 172.13 1i48 h PRO 346 N 6.74 -0.24 -0.86 2.88 0.11 -1.90 -1.00 132.00 137.73 1i48 h PRO 346 Ca -0.41 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.69 1i48 h PRO 346 Cb 1.22 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1i48 h PRO 346 CO 0.77 -0.16 0.03 -0.85 -0.21 0.00 0.00 178.00 177.58 1i48 n GLU 347 N -4.70 2.40 -0.31 1.05 0.00 -1.26 -4.46 120.64 113.36 1i48 n GLU 347 Ca -0.02 -1.22 0.15 0.00 0.00 0.00 0.00 57.16 56.07 1i48 n GLU 347 Cb 0.25 -1.76 0.33 0.00 0.00 0.00 0.00 31.44 30.25 1i48 n GLU 347 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1i48 h HIS 348 N 1.42 0.60 -0.61 -1.84 2.76 -1.44 0.21 115.15 116.24 1i48 h HIS 348 Ca 0.03 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.23 1i48 h HIS 348 Cb 1.15 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.96 1i48 h HIS 348 CO 0.45 -0.12 0.35 1.12 -1.30 0.00 0.00 177.93 178.43 1i48 h HIS 349 N 0.33 0.83 -0.32 5.26 2.07 -1.82 -1.31 115.15 120.19 1i48 h HIS 349 Ca 0.58 -0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 58.06 1i48 h HIS 349 Cb 1.16 -0.27 -0.01 0.00 2.57 0.00 0.00 27.41 30.86 1i48 h HIS 349 CO -0.16 0.59 0.11 0.82 -3.07 0.00 0.00 177.93 176.21 1i48 h ILE 350 N 0.83 1.20 -0.83 6.12 2.04 -1.06 -1.51 117.51 124.30 1i48 h ILE 350 Ca 0.22 -0.64 0.16 0.00 1.00 0.00 0.00 64.86 65.60 1i48 h ILE 350 Cb 0.02 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 37.02 1i48 h ILE 350 CO -0.04 0.22 0.39 0.00 0.00 0.00 0.00 178.15 178.72 1i48 h ALA 351 N 0.94 1.26 -0.39 1.87 0.00 -0.33 0.21 119.26 122.83 1i48 h ALA 351 Ca 0.10 0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 1i48 h ALA 351 Cb 0.23 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1i48 h ALA 351 CO -0.00 -0.19 -0.30 0.87 0.00 0.00 0.00 179.25 179.63 1i48 h LYS 352 N 0.51 0.84 -0.18 0.00 1.57 -0.80 0.87 116.57 119.38 1i48 h LYS 352 Ca 0.47 -0.39 -0.13 0.00 -1.87 0.00 0.00 60.65 58.73 1i48 h LYS 352 Cb 0.75 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1i48 h LYS 352 CO -0.42 1.03 -0.46 1.57 -0.57 0.00 0.00 179.45 180.60 1i48 h LYS 353 N 0.71 0.45 0.00 3.15 2.10 0.01 -3.35 116.57 119.65 1i48 h LYS 353 Ca 0.08 -0.25 0.00 0.00 -2.00 0.00 0.00 60.65 58.48 1i48 h LYS 353 Cb 0.85 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.20 1i48 h LYS 353 CO 0.07 0.82 -1.05 0.00 -2.00 0.00 0.00 179.45 177.30 1i48 n GLN 354 N -3.99 1.77 -4.06 0.07 10.64 -0.34 -5.03 117.38 116.43 1i48 n GLN 354 Ca -0.02 -0.05 -0.22 0.00 -1.83 0.00 0.00 57.00 54.87 1i48 n GLN 354 Cb 0.54 -1.15 -0.05 0.00 -0.86 0.00 0.00 30.24 28.72 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 -2.43 2.66 0.00 2.61 -1.94 0.30 -4.66 119.30 115.84 1i48 s MET 355 Ca -0.00 -1.27 0.00 0.00 -1.71 0.00 0.00 55.69 52.71 1i48 s MET 355 Cb 0.08 -2.40 0.00 0.00 2.01 0.00 0.00 34.83 34.52 1i48 s MET 355 CO 0.45 0.26 0.37 0.25 -0.01 0.00 0.00 175.02 176.35 1i48 n THR 356 N -1.17 0.00 -3.92 2.05 -2.24 -0.72 -4.67 114.28 103.60 1i48 n THR 356 Ca -0.05 -0.43 -0.11 0.00 -2.27 0.00 0.00 64.05 61.18 1i48 n THR 356 Cb 0.59 1.11 -0.00 0.00 -2.10 0.00 0.00 70.33 69.93 1i48 n THR 356 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1i48 s GLY 357 N -0.12 0.83 -0.03 3.38 0.00 -1.26 -5.02 107.32 105.11 1i48 s GLY 357 Ca 0.00 -1.07 0.20 0.00 0.00 0.00 0.00 44.72 43.85 1i48 s GLY 357 CO 0.00 -0.59 1.15 0.69 0.00 0.00 0.00 173.10 174.35 1i48 n PHE 358 N -0.55 0.00 -2.67 1.90 3.72 -1.26 -4.98 117.46 113.62 1i48 n PHE 358 Ca -0.05 -0.56 0.08 0.00 -0.05 0.00 0.00 57.45 56.88 1i48 n PHE 358 Cb 0.61 -0.15 -0.02 0.00 -0.94 0.00 0.00 39.48 38.98 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 0.16 -1.68 0.25 1.37 0.00 -1.26 -4.49 105.19 99.54 1i48 n GLY 359 Ca 0.07 -1.20 0.09 0.00 0.00 0.00 0.00 46.02 44.98 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 -1.88 4.97 3.60 -0.02 0.00 -1.26 -4.01 105.19 106.58 1i48 n GLY 360 Ca 0.00 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.49 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 -3.00 3.14 -0.03 4.61 0.00 -1.26 -1.20 121.76 124.02 1i48 s ALA 361 Ca 0.34 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 51.47 1i48 s ALA 361 Cb 0.31 -1.49 0.03 0.00 0.00 0.00 0.00 23.12 21.97 1i48 s ALA 361 CO -0.00 0.43 0.05 0.08 0.00 0.00 0.00 175.76 176.32 1i48 s VAL 362 N -0.35 -0.05 0.08 0.00 1.01 -0.56 -4.91 120.40 115.62 1i48 s VAL 362 Ca 0.06 0.18 0.06 0.00 0.00 0.00 0.00 61.98 62.29 1i48 s VAL 362 Cb -0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1i48 s VAL 362 CO 0.02 0.07 -0.08 -0.44 0.00 0.00 0.00 175.10 174.68 1i48 s SER 363 N 0.95 4.53 -0.12 3.32 0.01 -1.10 -0.75 113.70 120.54 1i48 s SER 363 Ca -0.08 -0.31 -0.30 0.00 1.31 0.00 0.00 55.95 56.57 1i48 s SER 363 Cb -0.11 -0.94 0.10 0.00 0.21 0.00 0.00 66.02 65.28 1i48 s SER 363 CO -0.03 0.20 0.83 0.72 0.41 0.00 0.00 173.24 175.37 1i48 s PHE 364 N -1.18 -0.54 -0.17 2.43 -0.71 -0.05 0.36 117.98 118.11 1i48 s PHE 364 Ca 0.21 0.98 -0.11 0.00 -1.04 0.00 0.00 56.93 56.97 1i48 s PHE 364 Cb -0.11 0.42 -0.05 0.00 -1.21 0.00 0.00 43.02 42.07 1i48 s PHE 364 CO 0.13 -0.47 0.19 -1.21 -1.34 0.00 0.00 175.22 172.52 1i48 s GLU 365 N -0.99 4.06 0.16 1.99 2.02 -0.19 -0.14 118.70 125.61 1i48 s GLU 365 Ca -0.06 -0.09 -0.18 0.00 0.02 0.00 0.00 54.97 54.66 1i48 s GLU 365 Cb -0.01 -3.37 -0.07 0.00 0.10 0.00 0.00 34.13 30.78 1i48 s GLU 365 CO 0.05 0.38 0.63 0.08 0.02 0.00 0.00 175.26 176.43 1i48 s VAL 366 N 0.08 4.70 -0.85 2.63 1.01 -1.11 -1.25 120.40 125.61 1i48 s VAL 366 Ca 0.12 1.12 -0.21 0.00 0.00 0.00 0.00 61.98 63.01 1i48 s VAL 366 Cb -0.12 -3.84 -0.14 0.00 0.00 0.00 0.00 36.38 32.29 1i48 s VAL 366 CO 0.01 0.31 1.95 -0.67 0.00 0.00 0.00 175.10 176.71 1i48 n ASP 367 N 1.02 2.67 -0.55 3.32 2.03 0.22 -4.66 116.55 120.60 1i48 n ASP 367 Ca -0.05 -2.70 0.00 0.00 0.52 0.00 0.00 54.79 52.56 1i48 n ASP 367 Cb 0.51 -1.19 0.00 0.00 -0.72 0.00 0.00 41.12 39.72 1i48 n ASP 367 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i48 n GLY 368 N 4.54 1.80 3.82 0.27 0.00 -1.26 -5.01 105.19 109.36 1i48 n GLY 368 Ca 0.50 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 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 0.36 4.61 0.06 1.61 -4.77 -1.26 -4.79 116.67 112.49 1i48 s ASP 369 Ca 0.00 -1.08 -0.11 0.00 -3.30 0.00 0.00 52.55 48.06 1i48 s ASP 369 Cb 0.00 -0.20 -0.02 0.00 -1.09 0.00 0.00 42.92 41.61 1i48 s ASP 369 CO 0.00 -0.74 1.01 -0.11 0.70 0.00 0.00 175.17 176.03 1i48 n LEU 370 N -1.46 -0.37 -0.18 2.11 -0.00 -1.26 0.26 117.00 116.11 1i48 n LEU 370 Ca -0.01 1.10 -0.01 0.00 -0.00 0.00 0.00 56.01 57.08 1i48 n LEU 370 Cb 0.64 -0.32 0.08 0.00 -0.00 0.00 0.00 43.42 43.83 1i48 n LEU 370 CO 0.43 -0.74 0.92 -0.07 -0.00 0.00 0.00 177.39 177.92 1i48 h LEU 371 N 0.00 0.03 0.59 -1.96 -0.00 -1.96 -1.70 115.31 110.31 1i48 h LEU 371 Ca 0.06 0.09 -0.03 0.00 -0.00 0.00 0.00 57.88 58.01 1i48 h LEU 371 Cb 0.14 0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 40.93 1i48 h LEU 371 CO -0.33 0.04 -0.33 0.74 -0.00 0.00 0.00 178.44 178.56 1i48 h THR 372 N 0.27 0.33 -0.69 0.22 2.02 -1.16 -1.32 112.91 112.57 1i48 h THR 372 Ca 0.28 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.61 1i48 h THR 372 Cb 0.38 0.33 -0.12 0.00 -1.74 0.00 0.00 68.15 67.00 1i48 h THR 372 CO -0.35 0.00 -0.05 0.74 0.37 0.00 0.00 175.52 176.24 1i48 h THR 373 N -0.85 0.38 -0.19 3.16 2.02 0.11 0.23 112.91 117.77 1i48 h THR 373 Ca -0.07 -0.03 0.05 0.00 0.77 0.00 0.00 66.41 67.13 1i48 h THR 373 Cb 0.68 0.30 -0.06 0.00 -1.74 0.00 0.00 68.15 67.32 1i48 h THR 373 CO 0.10 0.01 -0.20 0.00 0.37 0.00 0.00 175.52 175.80 1i48 h ALA 374 N 1.66 -0.10 -1.14 6.16 0.00 -1.01 0.30 119.26 125.12 1i48 h ALA 374 Ca 0.36 0.07 0.32 0.00 0.00 0.00 0.00 54.91 55.66 1i48 h ALA 374 Cb 0.60 0.41 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 1i48 h ALA 374 CO -0.63 -0.64 0.80 -0.22 0.00 0.00 0.00 179.25 178.56 1i48 h LYS 375 N -0.22 0.07 0.47 0.00 3.64 0.59 0.23 116.57 121.34 1i48 h LYS 375 Ca 0.12 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1i48 h LYS 375 Cb 0.40 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1i48 h LYS 375 CO -0.32 0.05 -0.22 0.35 -2.27 0.00 0.00 179.45 177.03 1i48 h PHE 376 N 0.07 -0.58 -0.86 1.91 3.57 0.59 -2.59 116.94 119.06 1i48 h PHE 376 Ca 0.56 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 62.19 1i48 h PHE 376 Cb 2.09 0.19 -0.09 0.00 2.79 0.00 0.00 35.95 40.93 1i48 h PHE 376 CO -0.00 -0.36 0.46 -0.39 -2.23 0.00 0.00 178.31 175.79 1i48 h VAL 377 N -0.95 0.77 -0.36 1.41 -1.51 -0.61 0.27 116.25 115.26 1i48 h VAL 377 Ca -0.06 -0.23 0.11 0.00 -1.23 0.00 0.00 66.70 65.28 1i48 h VAL 377 Cb 0.48 0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.66 1i48 h VAL 377 CO 0.10 0.12 0.27 0.44 -1.23 0.00 0.00 177.57 177.28 1i48 h ASP 378 N 0.67 0.00 0.44 4.19 5.19 -0.64 -1.24 116.42 125.03 1i48 h ASP 378 Ca 0.46 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.68 1i48 h ASP 378 Cb 0.60 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 1i48 h ASP 378 CO -0.34 0.00 -0.78 0.00 -3.12 0.00 0.00 179.24 175.00 1i48 h ALA 379 N 1.80 0.61 -2.60 3.45 0.00 -0.04 -3.45 119.26 119.02 1i48 h ALA 379 Ca 0.17 -0.65 -0.58 0.00 0.00 0.00 0.00 54.91 53.86 1i48 h ALA 379 Cb 0.71 -0.07 0.14 0.00 0.00 0.00 0.00 17.79 18.57 1i48 h ALA 379 CO -0.00 0.83 0.15 1.28 0.00 0.00 0.00 179.25 181.51 1i48 n LEU 380 N -3.76 3.04 -0.00 0.00 4.77 -0.47 -4.81 117.00 115.77 1i48 n LEU 380 Ca -0.04 0.94 0.02 0.00 -0.03 0.00 0.00 56.01 56.90 1i48 n LEU 380 Cb 0.74 -1.37 -0.03 0.00 -2.33 0.00 0.00 43.42 40.43 1i48 n LEU 380 CO 0.47 -1.62 -0.46 0.29 -1.33 0.00 0.00 177.39 174.73 1i48 n LYS 381 N -0.29 0.97 -0.10 3.23 5.02 -1.26 -4.87 118.16 120.86 1i48 n LYS 381 Ca 0.11 -0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.22 1i48 n LYS 381 Cb 0.43 -1.02 -0.06 0.00 -0.02 0.00 0.00 35.03 34.36 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 -1.54 1.49 -1.66 -0.18 5.41 -1.26 -4.98 119.36 116.63 1i48 n ILE 382 Ca -0.00 -0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.40 1i48 n ILE 382 Cb 0.09 -2.19 0.07 0.00 -0.71 0.00 0.00 39.64 36.89 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 -2.57 2.52 0.05 0.38 0.04 -1.26 -4.75 135.00 129.41 1i48 s PRO 383 Ca -0.28 1.68 -0.09 0.00 0.04 0.00 0.00 61.00 62.34 1i48 s PRO 383 Cb 0.07 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 1i48 s PRO 383 CO 0.42 -1.52 0.36 0.71 0.04 0.00 0.00 177.00 177.00 1i48 s TYR 384 N -1.98 3.59 -0.55 0.56 2.02 0.08 -4.80 117.35 116.26 1i48 s TYR 384 Ca 0.73 0.73 -0.21 0.00 -0.37 0.00 0.00 57.07 57.95 1i48 s TYR 384 Cb -0.27 -2.11 0.06 0.00 -0.40 0.00 0.00 41.96 39.24 1i48 s TYR 384 CO 0.41 0.56 0.77 0.42 -1.57 0.00 0.00 175.55 176.14 1i48 s ILE 385 N -1.34 4.65 -0.03 2.71 1.01 -1.26 -0.77 121.20 126.18 1i48 s ILE 385 Ca 0.30 -0.34 -0.30 0.00 0.00 0.00 0.00 60.65 60.31 1i48 s ILE 385 Cb -0.14 -4.45 0.11 0.00 0.01 0.00 0.00 42.46 37.99 1i48 s ILE 385 CO 0.17 -1.03 1.13 0.00 0.00 0.00 0.00 174.94 175.21 1i48 s ALA 386 N 3.20 -2.00 0.75 9.38 0.00 -0.99 -4.98 121.76 127.13 1i48 s ALA 386 Ca 0.20 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1i48 s ALA 386 Cb -0.18 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1i48 s ALA 386 CO 0.13 -0.87 0.00 -2.30 0.00 0.00 0.00 175.76 172.72 1i48 n PRO 387 N -0.34 2.61 -0.94 0.00 -0.02 -1.26 -4.50 135.00 130.54 1i48 n PRO 387 Ca -0.06 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.53 1i48 n PRO 387 Cb 0.61 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.06 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 -4.68 -3.73 2.55 2.88 -1.26 -4.94 113.62 104.44 1i48 n SER 388 Ca 0.00 0.48 0.02 0.00 -1.33 0.00 0.00 58.87 58.05 1i48 n SER 388 Cb 0.00 -3.04 0.01 0.00 -0.75 0.00 0.00 64.21 60.43 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 -2.70 0.00 0.00 0.66 -0.12 -1.26 -4.95 117.98 109.62 1i48 s PHE 389 Ca 0.00 -0.11 0.00 0.00 -0.05 0.00 0.00 56.93 56.77 1i48 s PHE 389 Cb 0.00 0.55 0.00 0.00 -0.63 0.00 0.00 43.02 42.94 1i48 s PHE 389 CO 0.00 -0.26 0.00 0.41 -0.05 0.00 0.00 175.22 175.32 1i48 n GLY 390 N -0.74 1.60 3.86 1.99 0.00 -1.26 -4.29 105.19 106.35 1i48 n GLY 390 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1i48 n GLY 390 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i48 s GLY 391 N -1.91 1.63 0.38 -0.02 0.00 -1.26 -4.37 107.32 101.78 1i48 s GLY 391 Ca 0.00 -0.26 0.10 0.00 0.00 0.00 0.00 44.72 44.56 1i48 s GLY 391 CO 0.00 0.10 1.93 0.00 0.00 0.00 0.00 173.10 175.14 1i48 s GLU 393 N -5.58 4.77 0.50 0.00 8.01 -1.26 0.10 118.70 125.25 1i48 s GLU 393 Ca -0.09 1.39 -0.19 0.00 0.01 0.00 0.00 54.97 56.09 1i48 s GLU 393 Cb 0.20 -3.28 -0.08 0.00 -4.31 0.00 0.00 34.13 26.67 1i48 s GLU 393 CO 0.77 0.52 1.04 -1.12 0.01 0.00 0.00 175.26 176.48 1i48 s SER 394 N -1.11 6.26 0.01 -0.19 0.01 -1.26 -4.35 113.70 113.07 1i48 s SER 394 Ca 0.40 1.91 0.00 0.00 1.31 0.00 0.00 55.95 59.57 1i48 s SER 394 Cb -0.25 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.41 1i48 s SER 394 CO 0.30 -0.84 -0.03 -0.63 0.41 0.00 0.00 173.24 172.46 1i48 s ILE 395 N -2.06 0.15 0.15 1.44 1.01 -0.14 -0.74 121.20 121.00 1i48 s ILE 395 Ca 0.67 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.79 1i48 s ILE 395 Cb -0.16 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.04 1i48 s ILE 395 CO 0.23 -0.26 -0.04 0.68 0.00 0.00 0.00 174.94 175.55 1i48 s VAL 396 N -0.82 0.77 -0.09 2.92 -7.23 0.05 0.35 120.40 116.34 1i48 s VAL 396 Ca -0.08 -1.98 -0.32 0.00 -1.81 0.00 0.00 61.98 57.79 1i48 s VAL 396 Cb -0.06 -1.94 0.12 0.00 0.56 0.00 0.00 36.38 35.06 1i48 s VAL 396 CO -0.00 -0.64 1.04 1.51 -0.31 0.00 0.00 175.10 176.70 1i48 s ASP 397 N -3.13 -0.25 -0.77 4.85 -4.77 -0.92 -2.33 116.67 109.33 1i48 s ASP 397 Ca 0.19 -0.00 0.01 0.00 -3.30 0.00 0.00 52.55 49.44 1i48 s ASP 397 Cb 0.05 0.27 0.19 0.00 -1.09 0.00 0.00 42.92 42.34 1i48 s ASP 397 CO 0.01 -0.43 0.61 -1.58 0.70 0.00 0.00 175.17 174.47 1i48 s GLN 398 N -2.78 2.82 0.14 2.11 0.74 -1.26 -1.93 119.66 119.51 1i48 s GLN 398 Ca 0.07 -3.18 -0.00 0.00 0.05 0.00 0.00 55.36 52.31 1i48 s GLN 398 Cb -0.01 -3.70 0.33 0.00 1.10 0.00 0.00 33.01 30.73 1i48 s GLN 398 CO -0.07 -1.25 0.74 -2.30 -0.55 0.00 0.00 175.29 171.86 1i48 n PRO 399 N 2.39 -0.04 -0.36 1.67 -0.02 -1.26 0.23 135.00 137.61 1i48 n PRO 399 Ca 0.18 0.71 0.26 0.00 -2.02 0.00 0.00 63.50 62.63 1i48 n PRO 399 Cb 0.36 -1.12 0.52 0.00 -0.02 0.00 0.00 33.50 33.24 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 0.94 2.23 0.00 3.55 0.00 -1.85 -1.85 119.26 122.28 1i48 h ALA 400 Ca 0.27 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 1i48 h ALA 400 Cb 0.54 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1i48 h ALA 400 CO -0.45 -0.76 -1.06 -0.89 0.00 0.00 0.00 179.25 176.08 1i48 n ILE 401 N -4.80 1.47 -0.27 0.00 5.41 0.64 -0.98 119.36 120.82 1i48 n ILE 401 Ca 0.30 0.11 0.13 0.00 1.00 0.00 0.00 62.75 64.29 1i48 n ILE 401 Cb 1.03 -2.24 0.25 0.00 -0.71 0.00 0.00 39.64 37.98 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 -4.35 -0.06 -0.44 0.38 1.56 0.13 -3.02 117.12 111.33 1i48 n MET 402 Ca -0.17 1.18 0.00 0.00 -0.27 0.00 0.00 57.70 58.45 1i48 n MET 402 Cb 0.51 -1.90 0.00 0.00 2.15 0.00 0.00 33.22 33.99 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 -5.10 0.00 0.00 6.12 3.41 -0.76 -4.87 113.62 112.42 1i48 n SER 403 Ca 0.20 -1.60 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 1i48 n SER 403 Cb 0.64 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 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 0.00 0.00 0.33 7.33 4.02 -0.80 -4.79 117.16 123.24 1i48 n TYR 404 Ca 0.00 -0.01 0.21 0.00 -0.01 0.00 0.00 57.90 58.09 1i48 n TYR 404 Cb 0.62 -0.00 1.15 0.00 -0.02 0.00 0.00 39.34 41.09 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 -0.97 0.73 115.95 114.99 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 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.85 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 -3.26 0.56 -4.95 2.65 5.75 -1.26 -4.77 116.55 111.26 1i48 n ASP 406 Ca -0.03 0.63 -0.19 0.00 -0.01 0.00 0.00 54.79 55.19 1i48 n ASP 406 Cb 0.08 -0.75 -0.01 0.00 -1.03 0.00 0.00 41.12 39.40 1i48 n ASP 406 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1i48 s LEU 407 N -4.22 3.76 0.49 -2.12 1.43 0.25 -5.11 118.68 113.16 1i48 s LEU 407 Ca 0.05 -0.36 -0.16 0.00 -1.03 0.00 0.00 54.13 52.62 1i48 s LEU 407 Cb 0.10 -2.54 -0.08 0.00 0.03 0.00 0.00 46.19 43.69 1i48 s LEU 407 CO 0.39 -0.51 0.95 -0.94 0.23 0.00 0.00 176.35 176.47 1i48 s SER 408 N -4.17 6.66 0.40 2.29 1.04 -1.26 -4.84 113.70 113.82 1i48 s SER 408 Ca 0.47 1.53 0.19 0.00 0.48 0.00 0.00 55.95 58.62 1i48 s SER 408 Cb -0.08 -2.49 1.12 0.00 0.10 0.00 0.00 66.02 64.66 1i48 s SER 408 CO 0.30 -0.52 1.77 -0.61 0.98 0.00 0.00 173.24 175.16 1i48 h GLN 409 N 1.13 0.37 0.32 4.02 5.75 -1.96 0.24 115.11 124.98 1i48 h GLN 409 Ca -0.47 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 57.99 1i48 h GLN 409 Cb 1.18 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.65 1i48 h GLN 409 CO 0.62 0.25 -0.15 0.77 -2.65 0.00 0.00 178.83 177.66 1i48 h SER 410 N 0.38 -0.36 -0.82 -0.69 0.02 -1.99 -3.19 113.55 106.90 1i48 h SER 410 Ca 0.59 0.01 0.21 0.00 -0.84 0.00 0.00 61.79 61.76 1i48 h SER 410 Cb 1.52 0.09 -0.05 0.00 0.14 0.00 0.00 62.40 64.10 1i48 h SER 410 CO -0.28 0.09 0.57 0.44 -1.14 0.00 0.00 176.83 176.50 1i48 h ASP 411 N -1.11 0.19 -0.20 3.07 3.32 -1.77 0.10 116.42 120.02 1i48 h ASP 411 Ca -0.04 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.05 1i48 h ASP 411 Cb 0.33 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1i48 h ASP 411 CO 0.07 0.08 0.07 0.03 -1.72 0.00 0.00 179.24 177.77 1i48 h ARG 412 N 0.20 0.16 0.00 3.56 3.08 -0.60 -1.07 114.38 119.70 1i48 h ARG 412 Ca 0.41 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.44 1i48 h ARG 412 Cb 1.31 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 1i48 h ARG 412 CO -0.08 0.10 -0.03 0.00 -1.07 0.00 0.00 179.97 178.89 1i48 h ALA 413 N 1.13 1.22 0.00 0.04 0.00 -0.96 -1.99 119.26 118.70 1i48 h ALA 413 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1i48 h ALA 413 Cb 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1i48 h ALA 413 CO -0.09 0.03 0.24 -0.22 0.00 0.00 0.00 179.25 179.21 1i48 h LYS 414 N 0.00 0.00 0.00 0.00 3.64 -0.95 0.14 116.57 119.41 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 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 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 -2.45 0.00 -0.43 1.91 4.01 -0.76 -4.98 117.16 114.46 1i48 n TYR 415 Ca -0.02 -0.19 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1i48 n TYR 415 Cb 0.27 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 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 -0.19 0.99 3.56 2.72 0.00 0.50 -4.99 105.19 107.78 1i48 n GLY 416 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.00 3.43 0.09 -0.61 -1.09 -1.16 -4.95 121.20 113.91 1i48 s ILE 417 Ca 0.00 0.28 -0.02 0.00 -2.23 0.00 0.00 60.65 58.68 1i48 s ILE 417 Cb 0.00 -4.05 -0.05 0.00 -1.58 0.00 0.00 42.46 36.79 1i48 s ILE 417 CO 0.00 -0.98 0.27 -0.04 -1.23 0.00 0.00 174.94 172.96 1i48 s MET 418 N 6.69 3.51 0.00 2.79 -1.94 -1.26 -3.93 119.30 125.16 1i48 s MET 418 Ca 0.64 -0.30 0.07 0.00 -1.71 0.00 0.00 55.69 54.39 1i48 s MET 418 Cb -0.13 -2.97 0.38 0.00 2.01 0.00 0.00 34.83 34.12 1i48 s MET 418 CO 0.22 0.56 0.90 -0.25 -0.01 0.00 0.00 175.02 176.44 1i48 n ASP 419 N 0.27 0.00 -0.06 3.03 9.92 -1.26 -1.33 116.55 127.12 1i48 n ASP 419 Ca -0.04 -0.12 -0.20 0.00 -0.53 0.00 0.00 54.79 53.90 1i48 n ASP 419 Cb 0.51 -0.06 -0.13 0.00 -0.64 0.00 0.00 41.12 40.80 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 0.13 -2.14 -2.24 -0.00 -1.89 -3.35 115.58 106.08 1i48 h ASN 420 Ca 0.00 -0.74 -0.63 0.00 -0.00 0.00 0.00 56.30 54.94 1i48 h ASN 420 Cb 0.01 -0.04 0.10 0.00 -0.00 0.00 0.00 38.32 38.39 1i48 h ASN 420 CO 0.00 1.43 0.11 -0.11 -0.00 0.00 0.00 177.43 178.86 1i48 n LEU 421 N -4.29 1.41 -3.81 0.34 7.94 -0.44 -2.73 117.00 115.41 1i48 n LEU 421 Ca -0.25 1.16 -0.16 0.00 -1.11 0.00 0.00 56.01 55.66 1i48 n LEU 421 Cb 0.71 -1.23 -0.16 0.00 0.53 0.00 0.00 43.42 43.28 1i48 n LEU 421 CO 0.30 -1.52 -0.36 -0.69 -1.11 0.00 0.00 177.39 174.00 1i48 s VAL 422 N -0.75 0.07 -0.14 1.96 1.01 0.80 -4.42 120.40 118.92 1i48 s VAL 422 Ca 0.64 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 62.69 1i48 s VAL 422 Cb -0.78 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1i48 s VAL 422 CO 0.57 0.11 0.07 -0.13 0.00 0.00 0.00 175.10 175.71 1i48 s ARG 423 N 0.90 3.57 -0.21 2.72 0.52 -0.81 -0.87 118.95 124.77 1i48 s ARG 423 Ca -0.08 -0.30 -0.02 0.00 -0.52 0.00 0.00 55.73 54.81 1i48 s ARG 423 Cb -0.12 -3.10 0.06 0.00 0.52 0.00 0.00 34.95 32.31 1i48 s ARG 423 CO -0.02 0.53 0.01 0.12 0.02 0.00 0.00 175.30 175.96 1i48 s PHE 424 N -0.35 1.39 -0.72 -0.53 2.19 0.08 -2.18 117.98 117.86 1i48 s PHE 424 Ca 0.09 -1.11 -0.18 0.00 0.33 0.00 0.00 56.93 56.06 1i48 s PHE 424 Cb -0.12 -1.18 0.13 0.00 -1.31 0.00 0.00 43.02 40.54 1i48 s PHE 424 CO 0.02 -0.66 0.82 0.45 1.83 0.00 0.00 175.22 177.68 1i48 s SER 425 N 1.73 6.39 0.11 6.13 0.15 0.15 -1.50 113.70 126.87 1i48 s SER 425 Ca -0.02 -1.80 -0.31 0.00 0.70 0.00 0.00 55.95 54.53 1i48 s SER 425 Cb -0.18 -2.31 -0.10 0.00 -1.71 0.00 0.00 66.02 61.72 1i48 s SER 425 CO -0.08 -1.01 1.83 -0.36 1.20 0.00 0.00 173.24 174.82 1i48 s PHE 426 N 2.26 2.05 0.00 3.44 0.08 -0.34 -0.96 117.98 124.51 1i48 s PHE 426 Ca 0.18 -0.05 0.00 0.00 0.12 0.00 0.00 56.93 57.18 1i48 s PHE 426 Cb -0.17 -4.17 0.00 0.00 -0.57 0.00 0.00 43.02 38.11 1i48 s PHE 426 CO -0.00 -4.87 0.00 0.41 -0.10 0.00 0.00 175.22 170.66 1i48 n GLY 427 N 4.26 -0.82 0.71 4.36 0.00 -1.26 -4.83 105.19 107.60 1i48 n GLY 427 Ca 0.18 -1.42 0.08 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.13 0.40 -0.56 1.61 3.14 0.29 -4.70 118.33 118.38 1i48 n VAL 428 Ca 0.00 -0.70 -0.30 0.00 -2.96 0.00 0.00 64.34 60.38 1i48 n VAL 428 Cb 0.00 0.98 0.22 0.00 -1.06 0.00 0.00 33.84 33.98 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 0.85 -2.25 -2.27 1.45 4.71 -1.26 -4.89 120.64 116.99 1i48 n GLU 429 Ca 0.12 -0.64 -0.41 0.00 -0.01 0.00 0.00 57.16 56.21 1i48 n GLU 429 Cb 0.42 -1.87 -0.03 0.00 -1.01 0.00 0.00 31.44 28.95 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 -2.11 6.96 0.02 1.62 2.15 -1.26 -4.92 116.67 119.13 1i48 s ASP 430 Ca 0.61 2.39 -0.06 0.00 0.43 0.00 0.00 52.55 55.92 1i48 s ASP 430 Cb -0.17 -2.62 -0.02 0.00 -0.30 0.00 0.00 42.92 39.82 1i48 s ASP 430 CO 0.64 -0.45 1.09 0.15 -0.17 0.00 0.00 175.17 176.43 1i48 h PHE 431 N 4.86 -0.29 -0.87 -5.34 3.04 -1.98 -1.35 116.94 115.00 1i48 h PHE 431 Ca -0.46 0.01 0.15 0.00 3.98 0.00 0.00 57.97 61.66 1i48 h PHE 431 Cb 1.22 0.14 -0.15 0.00 2.56 0.00 0.00 35.95 39.71 1i48 h PHE 431 CO 0.61 -0.08 -0.32 -0.44 -2.02 0.00 0.00 178.31 176.05 1i48 h ASP 432 N -0.06 -1.17 -0.85 0.41 3.32 -1.98 0.80 116.42 116.89 1i48 h ASP 432 Ca 0.01 0.28 0.15 0.00 0.02 0.00 0.00 57.03 57.50 1i48 h ASP 432 Cb 0.10 0.65 -0.10 0.00 0.22 0.00 0.00 39.33 40.20 1i48 h ASP 432 CO -0.10 -0.30 0.43 0.44 -1.72 0.00 0.00 179.24 177.98 1i48 h ASP 433 N -0.04 0.50 0.18 6.45 3.32 -1.80 0.14 116.42 125.18 1i48 h ASP 433 Ca 0.35 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.49 1i48 h ASP 433 Cb 0.61 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1i48 h ASP 433 CO -0.90 0.19 -0.09 -0.07 -1.72 0.00 0.00 179.24 176.66 1i48 h LEU 434 N 0.59 -0.21 -0.13 1.55 3.38 0.15 -2.85 115.31 117.79 1i48 h LEU 434 Ca 0.47 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 58.16 1i48 h LEU 434 Cb 0.69 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.43 1i48 h LEU 434 CO -0.38 0.32 -0.39 0.50 0.09 0.00 0.00 178.44 178.58 1i48 h LYS 435 N -0.85 -0.45 -0.84 1.13 3.64 0.14 0.59 116.57 119.94 1i48 h LYS 435 Ca -0.02 0.03 0.20 0.00 -1.27 0.00 0.00 60.65 59.58 1i48 h LYS 435 Cb 0.52 0.10 -0.12 0.00 -0.41 0.00 0.00 32.23 32.32 1i48 h LYS 435 CO 0.04 -0.30 0.30 0.00 -2.27 0.00 0.00 179.45 177.22 1i48 h ALA 436 N 0.21 1.23 0.70 5.00 0.00 -0.82 0.45 119.26 126.03 1i48 h ALA 436 Ca 0.08 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1i48 h ALA 436 Cb 0.61 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.60 1i48 h ALA 436 CO -0.39 -0.35 -0.34 0.22 0.00 0.00 0.00 179.25 178.40 1i48 h ASP 437 N 0.34 -0.80 -0.15 0.00 3.58 -0.85 -0.93 116.42 117.60 1i48 h ASP 437 Ca 0.50 0.01 0.05 0.00 0.42 0.00 0.00 57.03 58.01 1i48 h ASP 437 Cb 0.92 0.21 -0.07 0.00 1.72 0.00 0.00 39.33 42.11 1i48 h ASP 437 CO -0.53 -0.54 -0.39 0.40 -2.88 0.00 0.00 179.24 175.30 1i48 h ILE 438 N -0.99 0.19 0.20 2.25 2.04 0.26 -0.43 117.51 121.02 1i48 h ILE 438 Ca -0.10 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.77 1i48 h ILE 438 Cb 0.74 0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1i48 h ILE 438 CO 0.16 0.00 -0.46 -0.07 0.00 0.00 0.00 178.15 177.78 1i48 h LEU 439 N -0.45 -1.34 -1.69 1.44 3.38 -0.96 -0.71 115.31 114.98 1i48 h LEU 439 Ca 0.09 0.14 0.28 0.00 0.09 0.00 0.00 57.88 58.48 1i48 h LEU 439 Cb 0.60 0.49 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 1i48 h LEU 439 CO -0.40 -0.54 0.71 -0.61 0.09 0.00 0.00 178.44 177.69 1i48 h GLN 440 N -0.75 0.20 0.00 1.13 -0.00 -0.83 0.63 115.11 115.49 1i48 h GLN 440 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1i48 h GLN 440 Cb 0.74 -0.04 0.00 0.00 0.00 0.00 0.00 27.48 28.17 1i48 h GLN 440 CO -0.22 0.13 0.00 0.00 0.00 0.00 0.00 178.83 178.75 1i48 n ALA 441 N -2.61 2.57 -0.13 3.38 0.00 -0.20 -3.65 120.51 119.87 1i48 n ALA 441 Ca 0.23 -0.18 -0.23 0.00 0.00 0.00 0.00 53.44 53.27 1i48 n ALA 441 Cb 0.98 -1.48 -0.11 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.06 2.58 0.10 0.00 4.77 0.22 -4.30 117.00 119.31 1i48 n LEU 442 Ca 0.21 0.06 0.18 0.00 -0.03 0.00 0.00 56.01 56.43 1i48 n LEU 442 Cb 0.13 -0.88 0.74 0.00 -2.33 0.00 0.00 43.42 41.08 1i48 n LEU 442 CO 0.18 0.79 1.16 0.44 -1.33 0.00 0.00 177.39 178.64 1i48 h ASP 443 N -0.38 0.00 -0.97 -1.43 3.32 -1.60 0.10 116.42 115.46 1i48 h ASP 443 Ca -0.62 0.00 0.23 0.00 0.02 0.00 0.00 57.03 56.66 1i48 h ASP 443 Cb 1.79 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 41.26 1i48 h ASP 443 CO -0.21 0.00 0.63 0.28 -1.72 0.00 0.00 179.24 178.22 1i48 h SER 444 N 0.00 0.45 -0.00 6.45 0.02 -1.75 -3.53 113.55 115.19 1i48 h SER 444 Ca 0.17 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1i48 h SER 444 Cb 0.80 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1i48 h SER 444 CO -0.00 0.15 0.00 -0.38 -1.14 0.00 0.00 176.83 175.45