#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 3.35 0.23 2.98 0.00 -1.26 -5.01 121.76 122.05 1i48 s ALA 51 Ca 0.00 -0.77 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 1i48 s ALA 51 Cb 0.00 -1.66 0.24 0.00 0.00 0.00 0.00 23.12 21.71 1i48 s ALA 51 CO 0.00 0.45 1.61 0.66 0.00 0.00 0.00 175.76 178.48 1i48 h SER 52 N 5.70 0.56 0.14 0.00 4.64 -2.06 -3.09 113.55 119.44 1i48 h SER 52 Ca -0.45 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 60.62 1i48 h SER 52 Cb 1.19 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1i48 h SER 52 CO 0.60 0.90 -0.04 2.22 -0.87 0.00 0.00 176.83 179.63 1i48 n PHE 53 N -4.03 0.00 -3.97 4.77 1.16 -1.26 -4.68 117.46 109.45 1i48 n PHE 53 Ca -0.02 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.22 1i48 n PHE 53 Cb 0.51 -0.07 -0.14 0.00 -1.61 0.00 0.00 39.48 38.16 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 -2.19 3.48 -0.01 5.98 1.43 -1.17 -4.95 118.68 121.25 1i48 s LEU 54 Ca 0.38 -1.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.36 1i48 s LEU 54 Cb 0.21 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.76 1i48 s LEU 54 CO 0.40 -0.19 0.02 0.59 0.23 0.00 0.00 176.35 177.40 1i48 n ASN 55 N 4.60 4.62 -4.75 2.29 3.02 -1.26 -4.66 115.26 119.12 1i48 n ASN 55 Ca -0.15 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.00 1i48 n ASN 55 Cb 0.45 0.78 -0.06 0.00 -0.61 0.00 0.00 39.78 40.33 1i48 n ASN 55 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1i48 s SER 56 N -2.75 7.61 0.19 6.41 0.15 -1.26 -4.96 113.70 119.09 1i48 s SER 56 Ca -0.01 1.90 -0.14 0.00 0.70 0.00 0.00 55.95 58.41 1i48 s SER 56 Cb 0.01 -2.60 0.19 0.00 -1.71 0.00 0.00 66.02 61.91 1i48 s SER 56 CO 0.07 0.14 1.69 0.44 1.20 0.00 0.00 173.24 176.78 1i48 h ASP 57 N 4.30 -0.17 0.03 5.45 3.32 -1.99 -2.06 116.42 125.29 1i48 h ASP 57 Ca -0.45 0.11 0.03 0.00 0.02 0.00 0.00 57.03 56.74 1i48 h ASP 57 Cb 1.20 0.19 -0.05 0.00 0.22 0.00 0.00 39.33 40.89 1i48 h ASP 57 CO 0.68 -0.06 -0.39 1.23 -1.72 0.00 0.00 179.24 178.98 1i48 h GLY 58 N 0.13 -0.73 0.02 2.75 0.00 -1.98 0.22 103.07 103.49 1i48 h GLY 58 Ca 0.25 0.48 0.21 0.00 0.00 0.00 0.00 47.33 48.27 1i48 h GLY 58 CO -0.40 -0.25 0.60 1.76 0.00 0.00 0.00 176.54 178.25 1i48 h SER 59 N -0.57 0.74 0.26 0.19 0.02 -1.85 -0.86 113.55 111.48 1i48 h SER 59 Ca 0.04 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1i48 h SER 59 Cb 0.64 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.17 1i48 h SER 59 CO -0.29 0.21 -0.12 0.58 -1.14 0.00 0.00 176.83 176.07 1i48 h VAL 60 N 0.69 0.79 0.00 2.27 2.07 -0.56 -0.52 116.25 121.00 1i48 h VAL 60 Ca 0.60 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1i48 h VAL 60 Cb 1.02 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 1i48 h VAL 60 CO -0.42 0.13 0.22 0.00 0.02 0.00 0.00 177.57 177.52 1i48 n ALA 61 N -2.43 0.66 -0.13 1.67 0.00 0.67 0.11 120.51 121.06 1i48 n ALA 61 Ca -0.09 0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.17 1i48 n ALA 61 Cb 0.25 -0.76 -0.11 0.00 0.00 0.00 0.00 19.45 18.84 1i48 n ALA 61 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1i48 n ILE 62 N -1.72 1.47 0.56 0.00 5.41 -0.66 -4.09 119.36 120.34 1i48 n ILE 62 Ca -0.00 -0.45 0.07 0.00 1.00 0.00 0.00 62.75 63.36 1i48 n ILE 62 Cb 0.23 -1.68 0.04 0.00 -0.71 0.00 0.00 39.64 37.52 1i48 n ILE 62 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1i48 n HIS 63 N -3.82 0.00 -1.69 1.39 8.25 -0.25 -4.86 115.22 114.25 1i48 n HIS 63 Ca -0.50 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.53 1i48 n HIS 63 Cb 0.92 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.00 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 0.45 1.98 -1.75 -1.41 0.00 0.31 -1.78 120.51 118.31 1i48 n ALA 64 Ca 0.07 0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.69 1i48 n ALA 64 Cb 0.31 -2.57 -0.03 0.00 0.00 0.00 0.00 19.45 17.16 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 4.21 0.72 2.00 0.00 0.00 -1.26 -4.31 105.19 106.55 1i48 n GLY 65 Ca 0.18 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.46 0.00 -0.29 1.61 1.02 -0.74 -4.71 120.64 115.07 1i48 n GLU 66 Ca -0.14 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.10 1i48 n GLU 66 Cb 0.51 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 32.13 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 -2.60 -0.07 0.02 3.49 3.00 -0.84 -2.37 116.66 117.30 1i48 n ARG 67 Ca 0.00 1.24 -0.01 0.00 -0.00 0.00 0.00 57.85 59.08 1i48 n ARG 67 Cb 0.00 -1.94 -0.00 0.00 0.00 0.00 0.00 32.46 30.52 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 -8.53 6.15 3.38 -1.92 -3.49 115.31 110.85 1i48 h LEU 68 Ca 0.46 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.17 1i48 h LEU 68 Cb 0.89 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 1i48 h LEU 68 CO -0.79 0.02 -0.23 -0.83 0.09 0.00 0.00 178.44 176.70 1i48 s GLY 69 N -1.95 1.45 0.00 0.83 0.00 -1.00 -5.07 107.32 101.59 1i48 s GLY 69 Ca -0.01 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.20 1i48 s GLY 69 CO 0.03 -1.02 0.00 0.54 0.00 0.00 0.00 173.10 172.65 1i48 n ARG 70 N -0.53 0.19 -1.30 2.90 1.74 -1.26 -3.65 116.66 114.74 1i48 n ARG 70 Ca 0.01 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.99 1i48 n ARG 70 Cb 0.62 -0.02 -0.04 0.00 -1.02 0.00 0.00 32.46 32.00 1i48 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i48 n GLY 71 N 0.00 1.12 0.07 -0.13 0.00 -1.26 -4.73 105.19 100.26 1i48 n GLY 71 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1i48 n GLY 71 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1i48 n ILE 72 N -2.49 0.18 0.00 -0.61 0.00 -1.26 -5.08 119.36 110.10 1i48 n ILE 72 Ca -0.10 -0.19 0.00 0.00 0.00 0.00 0.00 62.75 62.46 1i48 n ILE 72 Cb 0.45 0.83 0.00 0.00 0.00 0.00 0.00 39.64 40.92 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 -0.10 0.00 -3.58 9.51 0.31 -1.26 -5.03 118.33 118.18 1i48 n VAL 73 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.21 1i48 n VAL 73 Cb 0.50 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.37 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 -1.60 2.52 -4.23 -1.26 -5.00 115.64 106.08 1i48 s THR 74 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.55 1i48 s THR 74 Cb 0.00 -1.00 0.13 0.00 1.34 0.00 0.00 72.50 72.97 1i48 s THR 74 CO 0.00 0.00 0.96 -0.90 -0.54 0.00 0.00 174.62 174.14 1i48 n ASP 75 N 1.30 1.12 -4.79 3.99 5.68 -1.26 -4.84 116.55 117.74 1i48 n ASP 75 Ca -0.14 -2.06 -0.38 0.00 -0.50 0.00 0.00 54.79 51.71 1i48 n ASP 75 Cb 0.57 -0.25 -0.06 0.00 -1.14 0.00 0.00 41.12 40.24 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 -1.64 3.41 0.00 2.12 0.00 -1.26 -4.99 121.76 119.40 1i48 s ALA 76 Ca 0.09 0.33 -0.25 0.00 0.00 0.00 0.00 51.96 52.13 1i48 s ALA 76 Cb 0.06 -2.95 -0.19 0.00 0.00 0.00 0.00 23.12 20.04 1i48 s ALA 76 CO 0.05 0.29 1.33 0.82 0.00 0.00 0.00 175.76 178.25 1i48 h ILE 77 N 3.09 1.20 -4.26 0.00 5.03 -2.04 -3.45 117.51 117.08 1i48 h ILE 77 Ca -0.47 -0.87 -0.46 0.00 -0.12 0.00 0.00 64.86 62.94 1i48 h ILE 77 Cb 1.20 1.77 0.11 0.00 -3.03 0.00 0.00 36.82 36.87 1i48 h ILE 77 CO 0.66 0.22 0.37 0.42 -0.68 0.00 0.00 178.15 179.13 1i48 s THR 78 N -4.61 2.06 -0.08 -0.27 -4.23 -1.26 -4.97 115.64 102.27 1i48 s THR 78 Ca -0.15 -0.07 -0.23 0.00 -1.18 0.00 0.00 61.69 60.06 1i48 s THR 78 Cb 0.02 -2.99 -0.04 0.00 1.34 0.00 0.00 72.50 70.84 1i48 s THR 78 CO 0.65 0.00 0.67 -0.89 -0.54 0.00 0.00 174.62 174.50 1i48 s THR 79 N -3.57 5.07 0.32 3.99 2.01 -1.26 -5.04 115.64 117.15 1i48 s THR 79 Ca 0.64 1.37 -0.28 0.00 0.31 0.00 0.00 61.69 63.73 1i48 s THR 79 Cb -0.09 -4.01 -0.09 0.00 0.01 0.00 0.00 72.50 68.32 1i48 s THR 79 CO 0.49 0.26 1.13 -2.16 -0.69 0.00 0.00 174.62 173.64 1i48 s PRO 80 N 0.80 4.46 -0.44 4.92 0.04 -1.26 -5.00 135.00 138.53 1i48 s PRO 80 Ca 0.36 1.82 -0.22 0.00 0.04 0.00 0.00 61.00 62.99 1i48 s PRO 80 Cb -0.17 -3.02 0.02 0.00 0.04 0.00 0.00 34.50 31.37 1i48 s PRO 80 CO 0.17 0.05 0.74 0.08 0.04 0.00 0.00 177.00 178.07 1i48 s VAL 81 N -1.26 4.71 -0.43 -0.36 1.01 -1.26 -4.53 120.40 118.29 1i48 s VAL 81 Ca 0.48 0.37 -0.21 0.00 0.00 0.00 0.00 61.98 62.63 1i48 s VAL 81 Cb -0.31 -4.27 0.02 0.00 0.00 0.00 0.00 36.38 31.81 1i48 s VAL 81 CO 0.40 -0.65 0.64 -0.69 0.00 0.00 0.00 175.10 174.80 1i48 s VAL 82 N 3.12 4.84 -1.04 2.92 1.01 -1.26 -4.98 120.40 125.01 1i48 s VAL 82 Ca 0.28 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.39 1i48 s VAL 82 Cb -0.13 -4.19 0.30 0.00 0.00 0.00 0.00 36.38 32.36 1i48 s VAL 82 CO 0.21 -0.56 1.35 0.59 0.00 0.00 0.00 175.10 176.69 1i48 n ASN 83 N 6.23 6.01 -4.33 3.32 3.02 -1.26 -4.74 115.26 123.51 1i48 n ASN 83 Ca -0.02 -3.37 -0.28 0.00 -0.03 0.00 0.00 54.58 50.89 1i48 n ASN 83 Cb 0.48 -1.22 -0.14 0.00 -0.61 0.00 0.00 39.78 38.29 1i48 n ASN 83 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1i48 s THR 84 N -2.55 2.00 -0.68 3.41 -1.32 -1.26 -5.01 115.64 110.23 1i48 s THR 84 Ca 0.32 -1.46 0.23 0.00 -1.21 0.00 0.00 61.69 59.57 1i48 s THR 84 Cb 0.04 -1.75 -0.09 0.00 -1.51 0.00 0.00 72.50 69.19 1i48 s THR 84 CO 0.07 0.20 1.10 -1.54 -2.21 0.00 0.00 174.62 172.24 1i48 n SER 85 N 1.48 0.63 -3.38 8.08 3.41 -1.26 -4.74 113.62 117.85 1i48 n SER 85 Ca -0.18 -0.23 -0.07 0.00 -0.26 0.00 0.00 58.87 58.14 1i48 n SER 85 Cb 0.53 0.68 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 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 -3.16 -1.11 -0.04 7.33 0.00 -1.26 -2.42 121.76 121.11 1i48 s ALA 86 Ca 0.05 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.58 1i48 s ALA 86 Cb 0.15 0.74 0.00 0.00 0.00 0.00 0.00 23.12 24.01 1i48 s ALA 86 CO 0.78 -1.02 -0.13 0.71 0.00 0.00 0.00 175.76 176.11 1i48 s TYR 87 N -2.93 1.34 0.69 0.00 1.51 -1.08 -4.85 117.35 112.03 1i48 s TYR 87 Ca 0.14 -0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 55.81 1i48 s TYR 87 Cb -0.05 -0.94 0.11 0.00 -0.11 0.00 0.00 41.96 40.97 1i48 s TYR 87 CO 0.08 -0.17 0.96 -0.59 -1.11 0.00 0.00 175.55 174.73 1i48 s PHE 88 N 0.26 1.78 0.02 2.71 -0.12 -1.26 -4.79 117.98 116.58 1i48 s PHE 88 Ca -0.06 -0.24 0.04 0.00 -0.05 0.00 0.00 56.93 56.62 1i48 s PHE 88 Cb -0.11 -2.94 -0.01 0.00 -0.63 0.00 0.00 43.02 39.32 1i48 s PHE 88 CO 0.02 -1.57 -0.12 -0.06 -0.05 0.00 0.00 175.22 173.44 1i48 s PHE 89 N -3.08 1.03 0.18 3.49 0.40 -1.26 -5.05 117.98 113.69 1i48 s PHE 89 Ca 0.65 -0.28 -0.09 0.00 -0.60 0.00 0.00 56.93 56.61 1i48 s PHE 89 Cb -0.06 -0.64 0.07 0.00 0.51 0.00 0.00 43.02 42.90 1i48 s PHE 89 CO 0.43 -0.00 1.64 -0.91 0.70 0.00 0.00 175.22 177.08 1i48 h ASN 90 N 5.37 1.06 -5.02 1.36 2.35 -2.00 -3.46 115.58 115.25 1i48 h ASN 90 Ca -0.35 -0.31 -0.06 0.00 -0.55 0.00 0.00 56.30 55.03 1i48 h ASN 90 Cb 1.18 -0.29 -0.16 0.00 0.05 0.00 0.00 38.32 39.10 1i48 h ASN 90 CO 0.46 1.11 0.03 -1.59 -1.65 0.00 0.00 177.43 175.80 1i48 s LYS 91 N -5.02 1.03 0.25 0.81 -2.85 -1.26 -5.05 119.74 107.65 1i48 s LYS 91 Ca -0.12 -0.24 -0.05 0.00 -1.00 0.00 0.00 55.97 54.56 1i48 s LYS 91 Cb 0.14 0.47 0.48 0.00 -2.06 0.00 0.00 37.83 36.86 1i48 s LYS 91 CO 0.86 -0.37 1.65 1.15 0.10 0.00 0.00 175.35 178.74 1i48 h THR 92 N 2.79 0.40 -0.85 3.79 2.02 -1.99 0.68 112.91 119.74 1i48 h THR 92 Ca -0.31 -0.06 0.22 0.00 0.77 0.00 0.00 66.41 67.03 1i48 h THR 92 Cb 1.21 0.21 -0.13 0.00 -1.74 0.00 0.00 68.15 67.70 1i48 h THR 92 CO 0.41 0.03 0.24 0.77 0.37 0.00 0.00 175.52 177.34 1i48 h SER 93 N 0.17 0.04 -0.10 4.18 4.64 -1.99 0.16 113.55 120.64 1i48 h SER 93 Ca 0.43 0.18 -0.02 0.00 -0.47 0.00 0.00 61.79 61.91 1i48 h SER 93 Cb 0.77 0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1i48 h SER 93 CO -0.61 -0.11 -0.01 -0.33 -0.87 0.00 0.00 176.83 174.90 1i48 h GLU 94 N 0.24 0.18 -1.00 4.77 5.08 -1.29 -1.69 114.58 120.88 1i48 h GLU 94 Ca 0.52 -0.06 0.15 0.00 -1.00 0.00 0.00 59.36 58.97 1i48 h GLU 94 Cb 1.01 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.16 1i48 h GLU 94 CO -0.61 0.46 0.63 1.25 -1.00 0.00 0.00 179.01 179.73 1i48 h LEU 95 N -0.11 0.87 0.07 1.33 5.85 -0.49 0.68 115.31 123.51 1i48 h LEU 95 Ca 0.03 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1i48 h LEU 95 Cb 0.38 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1i48 h LEU 95 CO 0.01 0.41 -0.03 0.40 -0.34 0.00 0.00 178.44 178.88 1i48 h ILE 96 N 0.90 1.02 -0.39 4.05 2.04 -0.59 -0.60 117.51 123.94 1i48 h ILE 96 Ca 0.53 -0.29 0.08 0.00 1.00 0.00 0.00 64.86 66.18 1i48 h ILE 96 Cb 0.65 1.21 -0.09 0.00 -0.74 0.00 0.00 36.82 37.85 1i48 h ILE 96 CO -0.31 0.07 -0.23 0.44 0.00 0.00 0.00 178.15 178.12 1i48 h ASP 97 N -0.23 -0.79 -0.06 1.72 5.19 0.01 0.43 116.42 122.70 1i48 h ASP 97 Ca -0.01 0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1i48 h ASP 97 Cb 0.19 0.40 -0.00 0.00 0.18 0.00 0.00 39.33 40.10 1i48 h ASP 97 CO 0.02 -0.26 0.04 0.15 -3.12 0.00 0.00 179.24 176.06 1i48 h PHE 98 N -0.17 0.07 0.00 4.55 3.57 -0.93 0.60 116.94 124.64 1i48 h PHE 98 Ca 0.19 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 1i48 h PHE 98 Cb 0.46 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 1i48 h PHE 98 CO -0.46 0.05 -0.02 0.87 -2.23 0.00 0.00 178.31 176.51 1i48 h LYS 99 N 0.08 0.00 -0.47 1.11 1.79 -0.35 0.28 116.57 119.01 1i48 h LYS 99 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1i48 h LYS 99 Cb -0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1i48 h LYS 99 CO -0.01 0.02 0.00 0.39 -1.08 0.00 0.00 179.45 178.78 1i48 n GLU 100 N -4.28 2.15 -3.45 3.15 -0.58 0.15 -4.93 120.64 112.86 1i48 n GLU 100 Ca -0.03 -1.62 -0.18 0.00 -0.42 0.00 0.00 57.16 54.91 1i48 n GLU 100 Cb 0.11 -1.41 0.09 0.00 -0.57 0.00 0.00 31.44 29.66 1i48 n GLU 100 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1i48 n LYS 101 N 0.75 -6.80 0.00 3.49 4.01 1.00 -4.91 118.16 115.70 1i48 n LYS 101 Ca 0.15 0.85 0.00 0.00 -0.51 0.00 0.00 58.31 58.80 1i48 n LYS 101 Cb 0.42 -5.87 0.00 0.00 -0.51 0.00 0.00 35.03 29.07 1i48 n LYS 101 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1i48 n ARG 102 N -4.24 6.31 -4.34 1.97 1.74 0.20 -4.98 116.66 113.32 1i48 n ARG 102 Ca -0.25 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.65 1i48 n ARG 102 Cb 0.66 -0.51 -0.10 0.00 -1.02 0.00 0.00 32.46 31.48 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 -1.02 1.46 -0.08 5.56 3.52 -1.22 -4.85 118.95 122.33 1i48 s ARG 103 Ca 0.00 -1.80 0.02 0.00 -0.13 0.00 0.00 55.73 53.83 1i48 s ARG 103 Cb 0.00 -0.38 -0.02 0.00 -1.56 0.00 0.00 34.95 32.99 1i48 s ARG 103 CO 0.00 -0.28 -0.14 0.00 -0.81 0.00 0.00 175.30 174.07 1i48 s ALA 104 N -3.66 2.61 -0.27 6.12 0.00 -1.26 -4.61 121.76 120.69 1i48 s ALA 104 Ca 0.38 -0.94 -0.29 0.00 0.00 0.00 0.00 51.96 51.10 1i48 s ALA 104 Cb 0.08 -1.05 0.18 0.00 0.00 0.00 0.00 23.12 22.33 1i48 s ALA 104 CO 0.14 0.42 1.31 0.45 0.00 0.00 0.00 175.76 178.08 1i48 s SER 105 N -0.23 -0.09 0.44 0.00 0.15 -1.26 -5.02 113.70 107.68 1i48 s SER 105 Ca 0.01 0.11 0.24 0.00 0.70 0.00 0.00 55.95 57.01 1i48 s SER 105 Cb -0.13 0.09 0.47 0.00 -1.71 0.00 0.00 66.02 64.73 1i48 s SER 105 CO 0.03 -0.08 1.66 -0.26 1.20 0.00 0.00 173.24 175.78 1i48 h PHE 106 N 2.24 0.00 0.00 3.44 0.04 -1.93 -3.47 116.94 117.26 1i48 h PHE 106 Ca -0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1i48 h PHE 106 Cb 1.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1i48 h PHE 106 CO 0.21 0.00 0.00 -1.91 -0.60 0.00 0.00 178.31 176.01 1i48 n GLU 107 N -3.07 0.00 -4.35 1.51 2.13 -1.26 -4.46 120.64 111.14 1i48 n GLU 107 Ca 0.04 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.61 1i48 n GLU 107 Cb 0.50 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 32.09 1i48 n GLU 107 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1i48 s TYR 108 N 0.00 2.02 0.55 4.31 5.04 -1.26 -2.64 117.35 125.37 1i48 s TYR 108 Ca 0.00 -0.41 0.23 0.00 -2.44 0.00 0.00 57.07 54.45 1i48 s TYR 108 Cb 0.00 -1.05 1.48 0.00 0.35 0.00 0.00 41.96 42.74 1i48 s TYR 108 CO 0.00 0.33 2.13 0.78 -1.34 0.00 0.00 175.55 177.45 1i48 h GLY 109 N 3.62 0.00 2.00 8.97 0.00 -1.69 0.17 103.07 116.14 1i48 h GLY 109 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1i48 h GLY 109 CO 0.44 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 176.89 1i48 h ARG 110 N 0.00 0.00 -0.40 4.80 2.43 -1.92 -2.98 114.38 116.32 1i48 h ARG 110 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1i48 h ARG 110 Cb 0.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 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 -3.01 0.52 0.00 2.20 4.01 0.58 -4.78 117.16 116.69 1i48 n TYR 111 Ca 0.03 -0.26 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 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 1.23 1.58 3.64 2.72 0.00 -1.13 -4.85 105.19 108.38 1i48 n GLY 112 Ca 0.16 -1.87 -0.05 0.00 0.00 0.00 0.00 46.02 44.26 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 -0.50 0.23 1.61 3.84 -1.26 -4.44 114.94 114.42 1i48 s ASN 113 Ca 0.00 0.87 -0.06 0.00 0.21 0.00 0.00 52.86 53.88 1i48 s ASN 113 Cb 0.00 1.07 0.37 0.00 -0.55 0.00 0.00 41.25 42.13 1i48 s ASN 113 CO 0.00 -0.14 1.78 1.55 -2.79 0.00 0.00 177.10 177.50 1i48 h PRO 114 N 5.30 0.63 -0.22 0.43 0.13 -1.97 0.20 132.00 136.49 1i48 h PRO 114 Ca -0.28 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 1i48 h PRO 114 Cb 1.19 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1i48 h PRO 114 CO 0.16 0.41 -0.05 0.00 -0.23 0.00 0.00 178.00 178.29 1i48 h THR 115 N 0.65 1.17 0.06 1.56 1.03 -1.89 -3.15 112.91 112.33 1i48 h THR 115 Ca 0.37 -0.69 -0.00 0.00 -0.01 0.00 0.00 66.41 66.08 1i48 h THR 115 Cb 0.39 1.06 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 1i48 h THR 115 CO -0.27 0.23 -0.03 0.74 -0.01 0.00 0.00 175.52 176.17 1i48 h THR 116 N 0.33 0.94 -1.30 0.00 2.02 -1.24 -3.31 112.91 110.35 1i48 h THR 116 Ca 0.07 -1.50 0.42 0.00 0.77 0.00 0.00 66.41 66.17 1i48 h THR 116 Cb 0.30 1.71 -0.13 0.00 -1.74 0.00 0.00 68.15 68.30 1i48 h THR 116 CO 0.01 0.29 0.84 -0.37 0.37 0.00 0.00 175.52 176.66 1i48 h VAL 117 N -0.94 0.15 0.23 3.16 -1.51 -0.74 0.20 116.25 116.79 1i48 h VAL 117 Ca -0.01 -0.04 -0.01 0.00 -1.23 0.00 0.00 66.70 65.42 1i48 h VAL 117 Cb 0.55 0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 29.73 1i48 h VAL 117 CO 0.01 0.02 -0.23 0.58 -1.23 0.00 0.00 177.57 176.73 1i48 h VAL 118 N 0.10 0.00 -0.96 7.19 2.07 -1.63 0.33 116.25 123.34 1i48 h VAL 118 Ca 0.81 0.00 0.23 0.00 0.82 0.00 0.00 66.70 68.56 1i48 h VAL 118 Cb 2.50 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 32.20 1i48 h VAL 118 CO -0.42 0.00 0.64 0.25 0.02 0.00 0.00 177.57 178.06 1i48 h LEU 119 N -0.45 0.40 0.73 2.57 5.85 -0.81 0.25 115.31 123.85 1i48 h LEU 119 Ca -0.03 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 1i48 h LEU 119 Cb 0.39 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.41 1i48 h LEU 119 CO -0.03 0.13 -0.36 -0.33 -0.34 0.00 0.00 178.44 177.52 1i48 h GLU 120 N 0.38 -0.95 -0.94 1.25 5.08 0.14 -1.45 114.58 118.09 1i48 h GLU 120 Ca 0.52 0.07 0.09 0.00 -1.00 0.00 0.00 59.36 59.04 1i48 h GLU 120 Cb 1.34 0.22 -0.08 0.00 0.50 0.00 0.00 28.75 30.73 1i48 h GLU 120 CO -0.21 -0.64 0.58 0.93 -1.00 0.00 0.00 179.01 178.68 1i48 h GLU 121 N -0.99 0.95 0.21 2.33 5.08 0.60 0.13 114.58 122.88 1i48 h GLU 121 Ca -0.10 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1i48 h GLU 121 Cb 0.76 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 1i48 h GLU 121 CO 0.16 0.63 -0.52 -0.22 -1.00 0.00 0.00 179.01 178.06 1i48 h LYS 122 N 0.98 -0.78 -0.65 2.33 3.64 -0.38 0.12 116.57 121.83 1i48 h LYS 122 Ca 0.44 0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.93 1i48 h LYS 122 Cb 0.35 0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 1i48 h LYS 122 CO -0.23 -0.52 0.36 0.82 -2.27 0.00 0.00 179.45 177.61 1i48 h ILE 123 N -0.81 0.97 -0.56 2.00 2.04 -0.81 -1.63 117.51 118.71 1i48 h ILE 123 Ca -0.02 -0.23 0.10 0.00 1.00 0.00 0.00 64.86 65.71 1i48 h ILE 123 Cb 0.78 0.25 -0.11 0.00 -0.74 0.00 0.00 36.82 37.00 1i48 h ILE 123 CO -0.23 0.12 -0.31 0.28 0.00 0.00 0.00 178.15 178.00 1i48 h SER 124 N 0.67 -1.09 0.04 1.72 0.02 0.06 0.35 113.55 115.32 1i48 h SER 124 Ca 0.29 0.22 0.02 0.00 -0.84 0.00 0.00 61.79 61.48 1i48 h SER 124 Cb 0.17 0.54 -0.03 0.00 0.14 0.00 0.00 62.40 63.22 1i48 h SER 124 CO -0.18 -0.30 -0.20 0.00 -1.14 0.00 0.00 176.83 175.02 1i48 h ALA 125 N 1.02 -0.29 0.17 3.77 0.00 0.10 0.36 119.26 124.39 1i48 h ALA 125 Ca 0.23 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1i48 h ALA 125 Cb 0.54 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1i48 h ALA 125 CO -0.65 -0.71 -0.49 -0.07 0.00 0.00 0.00 179.25 177.33 1i48 h LEU 126 N -0.35 -1.45 -0.05 0.00 3.38 -0.43 0.19 115.31 116.61 1i48 h LEU 126 Ca 0.05 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1i48 h LEU 126 Cb 0.40 0.53 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1i48 h LEU 126 CO -0.16 -0.53 0.00 -0.62 0.09 0.00 0.00 178.44 177.22 1i48 n GLU 127 N -5.25 0.01 -3.35 1.13 -0.58 -0.02 -4.85 120.64 107.73 1i48 n GLU 127 Ca -0.08 0.34 -0.17 0.00 -0.42 0.00 0.00 57.16 56.83 1i48 n GLU 127 Cb 0.39 -1.52 0.08 0.00 -0.57 0.00 0.00 31.44 29.82 1i48 n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1i48 n GLY 128 N -0.51 -0.31 3.91 0.62 0.00 0.90 -4.77 105.19 105.02 1i48 n GLY 128 Ca 0.02 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 1i48 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 s ALA 129 N -3.31 4.28 0.05 4.61 0.00 0.76 -4.93 121.76 123.21 1i48 s ALA 129 Ca 0.15 -1.71 -0.15 0.00 0.00 0.00 0.00 51.96 50.25 1i48 s ALA 129 Cb -0.06 -0.97 -0.28 0.00 0.00 0.00 0.00 23.12 21.80 1i48 s ALA 129 CO 0.66 -0.39 1.11 1.49 0.00 0.00 0.00 175.76 178.63 1i48 h GLU 130 N 0.82 0.63 -1.91 0.00 4.81 -1.85 -3.43 114.58 113.65 1i48 h GLU 130 Ca -0.38 -0.81 0.01 0.00 -0.13 0.00 0.00 59.36 58.04 1i48 h GLU 130 Cb 1.28 0.26 -0.20 0.00 0.63 0.00 0.00 28.75 30.73 1i48 h GLU 130 CO 0.55 1.37 0.35 0.45 -0.73 0.00 0.00 179.01 181.00 1i48 s SER 131 N -7.39 -0.52 0.15 1.04 0.15 -0.87 -4.82 113.70 101.44 1i48 s SER 131 Ca -0.10 0.50 0.08 0.00 0.70 0.00 0.00 55.95 57.14 1i48 s SER 131 Cb 0.06 0.44 -0.04 0.00 -1.71 0.00 0.00 66.02 64.77 1i48 s SER 131 CO 0.93 -0.53 -0.19 -0.89 1.20 0.00 0.00 173.24 173.76 1i48 s THR 132 N -1.45 1.81 0.04 6.45 2.01 -1.26 -1.57 115.64 121.67 1i48 s THR 132 Ca -0.06 -1.86 0.07 0.00 0.31 0.00 0.00 61.69 60.16 1i48 s THR 132 Cb -0.00 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.68 1i48 s THR 132 CO 0.04 -0.27 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.28 1i48 s LEU 133 N -2.54 2.17 -0.14 4.42 2.96 0.16 -4.87 118.68 120.84 1i48 s LEU 133 Ca 0.14 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 1i48 s LEU 133 Cb -0.06 -0.94 0.01 0.00 0.50 0.00 0.00 46.19 45.70 1i48 s LEU 133 CO 0.06 0.15 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.30 1i48 s LEU 134 N -1.17 1.93 0.00 -0.68 1.43 -1.26 -1.06 118.68 117.86 1i48 s LEU 134 Ca 0.07 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 1i48 s LEU 134 Cb -0.09 -1.30 0.00 0.00 0.03 0.00 0.00 46.19 44.83 1i48 s LEU 134 CO 0.02 0.03 0.02 0.23 0.23 0.00 0.00 176.35 176.88 1i48 n MET 135 N 4.30 0.94 0.00 1.70 2.81 0.11 -4.38 117.12 122.60 1i48 n MET 135 Ca -0.19 -0.08 0.12 0.00 -1.81 0.00 0.00 57.70 55.74 1i48 n MET 135 Cb 0.51 -0.01 0.25 0.00 -0.71 0.00 0.00 33.22 33.26 1i48 n MET 135 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1i48 n ALA 136 N -2.98 3.52 -3.64 3.04 0.00 -0.90 -3.37 120.51 116.17 1i48 n ALA 136 Ca -0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 53.44 53.01 1i48 n ALA 136 Cb 0.02 -1.08 -0.06 0.00 0.00 0.00 0.00 19.45 18.32 1i48 n ALA 136 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1i48 s SER 137 N -2.84 -0.07 0.24 0.00 1.04 -1.26 -3.47 113.70 107.34 1i48 s SER 137 Ca 0.15 0.10 -0.12 0.00 0.48 0.00 0.00 55.95 56.56 1i48 s SER 137 Cb 0.18 0.09 0.33 0.00 0.10 0.00 0.00 66.02 66.72 1i48 s SER 137 CO 0.66 -0.04 1.59 1.23 0.98 0.00 0.00 173.24 177.66 1i48 h GLY 138 N 2.66 0.49 -0.18 7.32 0.00 -1.83 0.55 103.07 112.08 1i48 h GLY 138 Ca -0.18 0.31 0.12 0.00 0.00 0.00 0.00 47.33 47.58 1i48 h GLY 138 CO 0.20 -0.30 -0.12 -0.33 0.00 0.00 0.00 176.54 175.99 1i48 h MET 139 N -0.02 0.02 -0.05 4.80 2.86 -1.95 0.13 114.93 120.72 1i48 h MET 139 Ca 0.38 -0.00 0.04 0.00 -2.06 0.00 0.00 59.70 58.06 1i48 h MET 139 Cb 0.61 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.21 1i48 h MET 139 CO -0.86 0.01 -0.24 0.00 1.06 0.00 0.00 176.91 176.88 1i48 n ALA 141 N -2.68 -0.08 -0.20 0.00 0.00 0.32 0.98 120.51 118.85 1i48 n ALA 141 Ca -0.04 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.32 1i48 n ALA 141 Cb 0.28 0.25 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1i48 n ALA 141 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1i48 h SER 142 N 0.00 -1.48 -0.59 0.00 4.64 -1.20 0.35 113.55 115.27 1i48 h SER 142 Ca 0.00 0.24 0.09 0.00 -0.47 0.00 0.00 61.79 61.66 1i48 h SER 142 Cb 0.00 0.67 -0.11 0.00 -0.31 0.00 0.00 62.40 62.65 1i48 h SER 142 CO 0.00 -0.34 -0.40 0.74 -0.87 0.00 0.00 176.83 175.96 1i48 h THR 143 N -0.23 0.11 0.75 2.95 2.02 -0.52 0.02 112.91 118.01 1i48 h THR 143 Ca 0.18 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.32 1i48 h THR 143 Cb 0.56 0.11 0.01 0.00 -1.74 0.00 0.00 68.15 67.09 1i48 h THR 143 CO -0.68 0.00 -0.36 0.58 0.37 0.00 0.00 175.52 175.43 1i48 h VAL 144 N -0.20 0.18 -0.92 3.16 2.07 0.18 -2.88 116.25 117.84 1i48 h VAL 144 Ca 0.20 -0.15 0.34 0.00 0.82 0.00 0.00 66.70 67.90 1i48 h VAL 144 Cb 0.56 0.21 -0.17 0.00 -1.52 0.00 0.00 31.29 30.38 1i48 h VAL 144 CO -0.69 0.01 0.32 0.80 0.02 0.00 0.00 177.57 178.03 1i48 n MET 145 N -5.48 -0.06 0.14 1.57 0.00 0.11 0.04 117.12 113.44 1i48 n MET 145 Ca -0.14 1.31 -0.05 0.00 0.00 0.00 0.00 57.70 58.82 1i48 n MET 145 Cb 0.41 -2.24 -0.03 0.00 0.00 0.00 0.00 33.22 31.36 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 -0.30 -1.63 -0.89 3.38 -0.83 -1.47 115.31 113.58 1i48 h LEU 146 Ca 0.70 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.68 1i48 h LEU 146 Cb 1.73 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.56 1i48 h LEU 146 CO -0.76 -0.19 0.31 -0.07 0.09 0.00 0.00 178.44 177.82 1i48 h LEU 147 N -0.41 0.00 0.07 1.67 3.38 -0.78 -0.42 115.31 118.83 1i48 h LEU 147 Ca -0.04 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1i48 h LEU 147 Cb 0.27 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 1i48 h LEU 147 CO 0.06 0.00 -0.57 0.00 0.09 0.00 0.00 178.44 178.02 1i48 h ALA 148 N 1.31 -0.01 0.05 1.53 0.00 -0.10 -3.42 119.26 118.63 1i48 h ALA 148 Ca 0.00 -0.69 -0.37 0.00 0.00 0.00 0.00 54.91 53.85 1i48 h ALA 148 Cb 0.63 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 1i48 h ALA 148 CO 0.00 0.29 -2.16 1.28 0.00 0.00 0.00 179.25 178.66 1i48 n LEU 149 N -4.32 2.57 -4.65 0.00 4.77 -0.58 -4.88 117.00 109.91 1i48 n LEU 149 Ca -0.14 0.13 -0.43 0.00 -0.03 0.00 0.00 56.01 55.54 1i48 n LEU 149 Cb 0.68 -0.98 -0.02 0.00 -2.33 0.00 0.00 43.42 40.77 1i48 n LEU 149 CO 0.40 0.77 1.29 -0.69 -1.33 0.00 0.00 177.39 177.84 1i48 s VAL 150 N -2.51 3.81 0.97 4.08 1.01 -0.25 -5.00 120.40 122.50 1i48 s VAL 150 Ca -0.30 0.95 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 1i48 s VAL 150 Cb 0.09 -3.70 0.18 0.00 0.00 0.00 0.00 36.38 32.95 1i48 s VAL 150 CO 0.65 -0.18 1.18 -2.84 0.00 0.00 0.00 175.10 173.91 1i48 s PRO 151 N 4.14 0.63 0.38 2.72 0.02 -1.26 -4.73 135.00 136.90 1i48 s PRO 151 Ca 0.68 0.03 -0.27 0.00 0.02 0.00 0.00 61.00 61.46 1i48 s PRO 151 Cb -0.27 -1.80 -0.09 0.00 0.02 0.00 0.00 34.50 32.36 1i48 s PRO 151 CO 0.26 -2.49 1.27 0.00 -0.33 0.00 0.00 177.00 175.70 1i48 s ALA 152 N -3.40 3.31 0.00 -1.55 0.00 -1.26 -2.23 121.76 116.63 1i48 s ALA 152 Ca 0.68 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.80 1i48 s ALA 152 Cb -0.11 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1i48 s ALA 152 CO 0.53 -0.68 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1i48 n GLY 153 N 0.73 0.24 3.65 0.00 0.00 -0.40 -4.94 105.19 104.47 1i48 n GLY 153 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1i48 n GLY 153 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1i48 s GLY 154 N -2.00 1.62 0.08 -0.02 0.00 -0.95 -4.66 107.32 101.40 1i48 s GLY 154 Ca 0.00 -1.07 0.07 0.00 0.00 0.00 0.00 44.72 43.72 1i48 s GLY 154 CO 0.00 -0.17 -0.18 -1.58 0.00 0.00 0.00 173.10 171.17 1i48 s HIS 155 N -3.17 1.56 0.02 1.90 5.65 -1.26 -1.83 115.29 118.15 1i48 s HIS 155 Ca 0.72 -0.43 -0.02 0.00 0.25 0.00 0.00 55.06 55.59 1i48 s HIS 155 Cb -0.07 -0.87 -0.02 0.00 -1.18 0.00 0.00 32.58 30.44 1i48 s HIS 155 CO 0.55 0.14 0.01 -1.50 -0.65 0.00 0.00 174.74 173.29 1i48 s ILE 156 N -1.16 0.11 -0.04 0.89 2.07 -0.87 0.35 121.20 122.54 1i48 s ILE 156 Ca 0.03 -0.92 0.06 0.00 -1.41 0.00 0.00 60.65 58.40 1i48 s ILE 156 Cb -0.10 -0.40 -0.02 0.00 0.13 0.00 0.00 42.46 42.07 1i48 s ILE 156 CO 0.03 -0.51 -0.21 -0.69 -1.91 0.00 0.00 174.94 171.65 1i48 s VAL 157 N -1.64 2.44 0.04 4.00 1.01 -0.61 -1.20 120.40 124.44 1i48 s VAL 157 Ca -0.14 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.76 1i48 s VAL 157 Cb -0.08 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.41 1i48 s VAL 157 CO -0.01 0.58 0.28 0.28 0.00 0.00 0.00 175.10 176.22 1i48 s THR 158 N -0.49 0.09 0.76 3.92 -1.32 -0.57 0.05 115.64 118.07 1i48 s THR 158 Ca 0.06 -0.72 -0.11 0.00 -1.21 0.00 0.00 61.69 59.71 1i48 s THR 158 Cb -0.11 -0.92 0.05 0.00 -1.51 0.00 0.00 72.50 70.00 1i48 s THR 158 CO 0.01 -0.40 1.08 0.42 -2.21 0.00 0.00 174.62 173.52 1i48 s THR 159 N -2.51 3.51 0.06 5.08 -4.23 -1.24 -1.58 115.64 114.73 1i48 s THR 159 Ca -0.05 0.49 -0.19 0.00 -1.18 0.00 0.00 61.69 60.76 1i48 s THR 159 Cb -0.01 -3.10 -0.13 0.00 1.34 0.00 0.00 72.50 70.60 1i48 s THR 159 CO -0.03 -0.64 1.37 0.71 -0.54 0.00 0.00 174.62 175.49 1i48 h THR 160 N -1.01 1.33 -2.94 3.99 1.35 -0.98 -3.41 112.91 111.24 1i48 h THR 160 Ca -0.44 -1.32 -0.56 0.00 -0.55 0.00 0.00 66.41 63.53 1i48 h THR 160 Cb 1.23 1.78 -0.04 0.00 -1.73 0.00 0.00 68.15 69.39 1i48 h THR 160 CO 0.54 0.40 1.16 -1.81 -0.25 0.00 0.00 175.52 175.57 1i48 s ASP 161 N -6.21 6.09 0.16 5.36 1.11 -1.26 -4.95 116.67 116.96 1i48 s ASP 161 Ca -0.14 0.90 -0.01 0.00 0.18 0.00 0.00 52.55 53.48 1i48 s ASP 161 Cb 0.06 -2.54 -0.04 0.00 1.07 0.00 0.00 42.92 41.48 1i48 s ASP 161 CO 0.77 -1.62 0.09 0.00 1.18 0.00 0.00 175.17 175.59 1i48 s TYR 163 N -4.10 2.64 0.01 0.00 5.04 -1.26 -4.87 117.35 114.81 1i48 s TYR 163 Ca 0.31 0.84 -0.02 0.00 -2.44 0.00 0.00 57.07 55.76 1i48 s TYR 163 Cb 0.07 -3.90 -0.01 0.00 0.35 0.00 0.00 41.96 38.48 1i48 s TYR 163 CO 0.06 -1.83 0.16 -2.13 -1.34 0.00 0.00 175.55 170.47 1i48 n ARG 164 N 7.32 -0.03 0.29 4.97 3.00 -1.26 0.50 116.66 131.44 1i48 n ARG 164 Ca 0.15 0.16 -0.18 0.00 -0.00 0.00 0.00 57.85 57.97 1i48 n ARG 164 Cb 0.46 -0.23 -0.10 0.00 0.00 0.00 0.00 32.46 32.59 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 -0.97 -1.02 -0.14 6.56 -1.98 -1.73 116.57 117.29 1i48 h LYS 165 Ca 0.01 0.07 0.36 0.00 -1.06 0.00 0.00 60.65 60.03 1i48 h LYS 165 Cb 0.03 0.22 -0.16 0.00 -0.57 0.00 0.00 32.23 31.75 1i48 h LYS 165 CO -0.07 -0.65 0.57 1.15 -2.06 0.00 0.00 179.45 178.40 1i48 h THR 166 N -1.01 0.19 0.07 -0.16 2.02 -0.34 -0.62 112.91 113.06 1i48 h THR 166 Ca -0.06 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.05 1i48 h THR 166 Cb 0.88 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1i48 h THR 166 CO -0.08 0.04 -0.08 -0.09 0.37 0.00 0.00 175.52 175.69 1i48 h ARG 167 N 0.20 -0.14 -0.89 6.66 2.43 -0.30 -2.99 114.38 119.35 1i48 h ARG 167 Ca 0.78 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 60.09 1i48 h ARG 167 Cb 1.92 0.03 -0.14 0.00 -0.42 0.00 0.00 29.97 31.36 1i48 h ARG 167 CO -0.65 -0.09 -0.41 0.82 -1.51 0.00 0.00 179.97 178.12 1i48 h ILE 168 N -0.14 0.04 -0.95 1.20 2.04 -0.87 0.22 117.51 119.03 1i48 h ILE 168 Ca -0.01 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.13 1i48 h ILE 168 Cb 0.13 0.04 -0.14 0.00 -0.74 0.00 0.00 36.82 36.10 1i48 h ILE 168 CO -0.01 0.00 0.43 0.15 0.00 0.00 0.00 178.15 178.71 1i48 h PHE 169 N -0.05 0.69 -0.06 1.37 3.57 -1.43 0.81 116.94 121.84 1i48 h PHE 169 Ca 0.28 0.04 -0.24 0.00 3.53 0.00 0.00 57.97 61.59 1i48 h PHE 169 Cb 0.56 -0.15 0.01 0.00 2.79 0.00 0.00 35.95 39.16 1i48 h PHE 169 CO -0.84 -0.16 -0.91 0.82 -2.23 0.00 0.00 178.31 174.99 1i48 h ILE 170 N 0.30 1.30 -0.00 1.41 2.04 -0.50 0.45 117.51 122.51 1i48 h ILE 170 Ca 0.65 -2.16 0.00 0.00 1.00 0.00 0.00 64.86 64.35 1i48 h ILE 170 Cb 1.38 2.21 0.00 0.00 -0.74 0.00 0.00 36.82 39.67 1i48 h ILE 170 CO -0.61 0.67 -0.08 -0.62 0.00 0.00 0.00 178.15 177.51 1i48 n GLU 171 N -3.87 0.20 0.00 2.37 1.02 0.91 -4.09 120.64 117.18 1i48 n GLU 171 Ca -0.09 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1i48 n GLU 171 Cb 0.81 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1i48 n GLU 171 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1i48 n THR 172 N -1.37 0.00 -0.11 2.62 -2.24 0.25 -4.85 114.28 108.58 1i48 n THR 172 Ca 0.10 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.70 1i48 n THR 172 Cb 0.31 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.20 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 -0.94 1.50 -0.30 2.28 2.08 0.08 -4.40 119.36 119.67 1i48 n ILE 173 Ca 0.00 -0.05 0.12 0.00 0.56 0.00 0.00 62.75 63.38 1i48 n ILE 173 Cb 0.15 -2.15 0.28 0.00 -0.75 0.00 0.00 39.64 37.17 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 0.28 -2.01 1.39 3.38 -1.53 0.42 115.31 116.25 1i48 h LEU 174 Ca -0.29 0.15 0.16 0.00 0.09 0.00 0.00 57.88 57.99 1i48 h LEU 174 Cb 1.18 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 1i48 h LEU 174 CO -0.18 -0.00 0.44 1.55 0.09 0.00 0.00 178.44 180.34 1i48 h PRO 175 N 0.38 0.00 -0.99 1.13 0.13 -1.71 0.17 132.00 131.12 1i48 h PRO 175 Ca 0.53 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.68 1i48 h PRO 175 Cb 1.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.07 1i48 h PRO 175 CO -0.53 0.00 0.66 0.87 -0.23 0.00 0.00 178.00 178.77 1i48 h LYS 176 N 0.00 1.28 -0.51 0.86 1.57 -0.36 0.16 116.57 119.57 1i48 h LYS 176 Ca 0.27 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1i48 h LYS 176 Cb 1.15 -0.29 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1i48 h LYS 176 CO -0.00 0.85 0.00 -1.33 -0.57 0.00 0.00 179.45 178.40 1i48 n MET 177 N -4.40 1.64 -1.29 3.15 2.81 0.53 -4.83 117.12 114.74 1i48 n MET 177 Ca 0.12 -0.68 -0.10 0.00 -1.81 0.00 0.00 57.70 55.23 1i48 n MET 177 Cb 0.03 -1.39 -0.04 0.00 -0.71 0.00 0.00 33.22 31.11 1i48 n MET 177 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i48 n GLY 178 N 0.48 1.12 3.58 3.03 0.00 0.56 -1.27 105.19 112.69 1i48 n GLY 178 Ca 0.06 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.26 4.56 0.19 -0.61 1.01 -0.79 -3.09 121.20 120.20 1i48 s ILE 179 Ca 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 60.65 61.52 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 -0.67 0.39 0.28 0.00 0.00 0.00 174.94 174.94 1i48 s THR 180 N 3.54 5.19 0.14 2.92 -1.32 -0.76 -3.54 115.64 121.81 1i48 s THR 180 Ca 0.36 -0.26 -0.03 0.00 -1.21 0.00 0.00 61.69 60.55 1i48 s THR 180 Cb -0.11 -3.71 -0.03 0.00 -1.51 0.00 0.00 72.50 67.14 1i48 s THR 180 CO 0.22 -0.13 0.11 0.00 -2.21 0.00 0.00 174.62 172.62 1i48 s ALA 181 N -1.82 0.63 -0.07 11.08 0.00 -1.26 -2.05 121.76 128.27 1i48 s ALA 181 Ca 0.39 -1.31 0.03 0.00 0.00 0.00 0.00 51.96 51.07 1i48 s ALA 181 Cb -0.11 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.87 1i48 s ALA 181 CO 0.28 -0.53 -0.16 0.99 0.00 0.00 0.00 175.76 176.34 1i48 s THR 182 N -4.02 1.42 -0.24 0.00 2.01 -0.34 -4.94 115.64 109.52 1i48 s THR 182 Ca 0.22 -0.66 -0.10 0.00 0.31 0.00 0.00 61.69 61.45 1i48 s THR 182 Cb 0.06 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.28 1i48 s THR 182 CO 0.01 0.41 0.15 -0.69 -0.69 0.00 0.00 174.62 173.82 1i48 s VAL 183 N 0.40 5.23 0.22 3.82 1.01 -1.26 -1.52 120.40 128.31 1i48 s VAL 183 Ca -0.12 0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.04 1i48 s VAL 183 Cb -0.15 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 1i48 s VAL 183 CO 0.04 0.34 -0.05 0.27 0.00 0.00 0.00 175.10 175.70 1i48 s ILE 184 N 1.18 1.23 0.34 2.22 -4.36 -0.61 -4.88 121.20 116.31 1i48 s ILE 184 Ca 0.07 -2.07 -0.27 0.00 -0.26 0.00 0.00 60.65 58.12 1i48 s ILE 184 Cb -0.14 -2.23 -0.09 0.00 1.25 0.00 0.00 42.46 41.25 1i48 s ILE 184 CO 0.05 -0.44 1.07 -0.62 0.24 0.00 0.00 174.94 175.25 1i48 s ASP 185 N -3.30 7.02 0.48 4.36 2.15 -1.26 -0.28 116.67 125.84 1i48 s ASP 185 Ca 0.25 2.16 0.23 0.00 0.43 0.00 0.00 52.55 55.62 1i48 s ASP 185 Cb 0.04 -2.61 1.27 0.00 -0.30 0.00 0.00 42.92 41.33 1i48 s ASP 185 CO 0.07 -0.31 1.91 -0.65 -0.17 0.00 0.00 175.17 176.02 1i48 h PRO 186 N 3.19 0.18 0.08 4.34 0.11 -1.94 -2.83 132.00 135.13 1i48 h PRO 186 Ca -0.47 -0.01 -0.31 0.00 0.11 0.00 0.00 66.00 65.31 1i48 h PRO 186 Cb 1.21 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1i48 h PRO 186 CO 0.65 0.12 -1.68 0.00 -0.21 0.00 0.00 178.00 176.87 1i48 h ALA 187 N 1.63 0.35 -0.03 -0.75 0.00 -1.92 -3.44 119.26 115.10 1i48 h ALA 187 Ca 0.39 -1.30 -0.06 0.00 0.00 0.00 0.00 54.91 53.94 1i48 h ALA 187 Cb 1.25 0.70 0.01 0.00 0.00 0.00 0.00 17.79 19.75 1i48 h ALA 187 CO -0.08 1.05 0.64 -3.47 0.00 0.00 0.00 179.25 177.40 1i48 n ASP 188 N -3.87 -0.50 0.13 0.00 -0.08 -1.07 -4.63 116.55 106.54 1i48 n ASP 188 Ca -0.31 -1.75 0.02 0.00 -1.51 0.00 0.00 54.79 51.24 1i48 n ASP 188 Cb 0.90 -0.88 0.37 0.00 2.34 0.00 0.00 41.12 43.85 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 6.44 1.20 0.08 5.18 2.07 -1.85 -2.92 116.25 126.45 1i48 h VAL 189 Ca 0.03 -0.94 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1i48 h VAL 189 Cb 0.90 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1i48 h VAL 189 CO 1.04 0.28 -0.33 1.23 0.02 0.00 0.00 177.57 179.81 1i48 h GLY 190 N 0.84 -0.60 -0.09 2.17 0.00 -1.97 -0.16 103.07 103.26 1i48 h GLY 190 Ca 0.03 0.39 0.13 0.00 0.00 0.00 0.00 47.33 47.88 1i48 h GLY 190 CO 0.03 -0.24 -0.04 0.00 0.00 0.00 0.00 176.54 176.29 1i48 h ALA 191 N 0.14 0.54 0.21 3.60 0.00 -1.91 0.64 119.26 122.49 1i48 h ALA 191 Ca 0.04 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1i48 h ALA 191 Cb 0.58 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1i48 h ALA 191 CO -0.22 -0.41 -0.25 1.25 0.00 0.00 0.00 179.25 179.63 1i48 h LEU 192 N 0.08 -0.68 -0.58 0.00 5.85 -1.35 0.46 115.31 119.08 1i48 h LEU 192 Ca 0.31 0.07 0.05 0.00 0.84 0.00 0.00 57.88 59.15 1i48 h LEU 192 Cb 0.50 0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.72 1i48 h LEU 192 CO -0.55 -0.35 0.31 -0.08 -0.34 0.00 0.00 178.44 177.42 1i48 h GLU 193 N -0.51 0.56 0.55 1.25 4.81 0.14 0.54 114.58 121.92 1i48 h GLU 193 Ca 0.01 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1i48 h GLU 193 Cb 0.49 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 1i48 h GLU 193 CO -0.08 0.37 -0.33 1.25 -0.73 0.00 0.00 179.01 179.49 1i48 h LEU 194 N 0.58 -0.82 -1.17 1.64 5.85 0.76 -2.48 115.31 119.67 1i48 h LEU 194 Ca 0.26 0.04 0.21 0.00 0.84 0.00 0.00 57.88 59.23 1i48 h LEU 194 Cb 0.17 0.24 -0.10 0.00 0.37 0.00 0.00 40.66 41.33 1i48 h LEU 194 CO -0.17 -0.51 0.62 0.00 -0.34 0.00 0.00 178.44 178.04 1i48 h ALA 195 N -1.45 1.89 -0.49 1.25 0.00 0.13 0.57 119.26 121.17 1i48 h ALA 195 Ca -0.07 0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.04 1i48 h ALA 195 Cb 0.65 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1i48 h ALA 195 CO 0.08 -0.26 0.44 1.25 0.00 0.00 0.00 179.25 180.76 1i48 h LEU 196 N 0.61 0.00 0.01 0.00 7.12 0.53 -2.70 115.31 120.89 1i48 h LEU 196 Ca 0.56 0.00 -0.40 0.00 0.13 0.00 0.00 57.88 58.17 1i48 h LEU 196 Cb 1.09 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 41.16 1i48 h LEU 196 CO -0.33 0.00 -2.30 0.59 -0.13 0.00 0.00 178.44 176.26 1i48 n ASN 197 N -3.95 1.97 -0.00 1.25 3.02 0.19 -4.66 115.26 113.08 1i48 n ASN 197 Ca 0.09 0.17 -0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1i48 n ASN 197 Cb 0.64 -0.70 -0.00 0.00 -0.61 0.00 0.00 39.78 39.11 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 -0.53 -0.00 0.00 3.52 4.20 -0.90 -3.44 115.11 117.95 1i48 h GLN 198 Ca -0.59 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 57.69 1i48 h GLN 198 Cb 1.72 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.52 1i48 h GLN 198 CO -0.23 -0.00 -0.07 1.63 -0.67 0.00 0.00 178.83 179.49 1i48 n LYS 199 N -2.63 0.66 -3.44 1.46 4.01 -1.09 -5.06 118.16 112.07 1i48 n LYS 199 Ca -0.00 -2.75 -0.44 0.00 -0.51 0.00 0.00 58.31 54.61 1i48 n LYS 199 Cb 0.00 -0.17 -0.04 0.00 -0.51 0.00 0.00 35.03 34.31 1i48 n LYS 199 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1i48 s LYS 200 N -4.28 3.42 0.18 1.97 2.36 -1.26 -4.72 119.74 117.41 1i48 s LYS 200 Ca 0.52 -2.63 -0.31 0.00 -2.55 0.00 0.00 55.97 51.00 1i48 s LYS 200 Cb -0.04 -4.25 -0.09 0.00 -1.05 0.00 0.00 37.83 32.40 1i48 s LYS 200 CO 0.33 -1.26 1.42 0.08 1.55 0.00 0.00 175.35 177.47 1i48 s VAL 201 N -0.17 2.98 -0.07 4.02 1.01 -1.26 -4.18 120.40 122.73 1i48 s VAL 201 Ca 0.20 0.75 0.05 0.00 0.00 0.00 0.00 61.98 62.98 1i48 s VAL 201 Cb -0.12 -3.48 -0.24 0.00 0.00 0.00 0.00 36.38 32.53 1i48 s VAL 201 CO -0.08 0.09 0.57 0.78 0.00 0.00 0.00 175.10 176.46 1i48 h ASN 202 N 6.02 0.16 -3.48 3.32 4.21 -0.48 -3.39 115.58 121.94 1i48 h ASN 202 Ca -0.44 -0.36 0.04 0.00 1.21 0.00 0.00 56.30 56.75 1i48 h ASN 202 Cb 1.21 -0.05 -0.25 0.00 -1.12 0.00 0.00 38.32 38.11 1i48 h ASN 202 CO 0.83 1.33 0.40 -0.22 -1.29 0.00 0.00 177.43 178.48 1i48 s LEU 203 N -6.47 -0.50 -0.27 1.61 0.20 -1.23 -2.41 118.68 109.61 1i48 s LEU 203 Ca -0.11 0.91 -0.09 0.00 0.69 0.00 0.00 54.13 55.52 1i48 s LEU 203 Cb 0.07 2.00 -0.03 0.00 -0.43 0.00 0.00 46.19 47.80 1i48 s LEU 203 CO 0.81 -0.20 0.13 0.12 -0.29 0.00 0.00 176.35 176.92 1i48 s PHE 204 N 0.07 3.15 -0.08 5.38 5.36 0.53 -1.57 117.98 130.83 1i48 s PHE 204 Ca 0.02 -0.21 0.05 0.00 -0.96 0.00 0.00 56.93 55.83 1i48 s PHE 204 Cb -0.04 -2.32 -0.01 0.00 -0.34 0.00 0.00 43.02 40.31 1i48 s PHE 204 CO -0.04 -0.29 -0.24 0.12 -1.46 0.00 0.00 175.22 173.32 1i48 s PHE 205 N 1.68 2.51 -0.07 10.12 5.36 0.11 -0.73 117.98 136.95 1i48 s PHE 205 Ca 0.06 -0.82 -0.31 0.00 -0.96 0.00 0.00 56.93 54.91 1i48 s PHE 205 Cb -0.16 -1.65 0.12 0.00 -0.34 0.00 0.00 43.02 40.99 1i48 s PHE 205 CO 0.07 -0.28 1.01 -0.08 -1.46 0.00 0.00 175.22 174.48 1i48 s THR 206 N 0.02 0.00 0.01 0.12 -1.32 -0.73 -3.70 115.64 110.04 1i48 s THR 206 Ca -0.09 -0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.43 1i48 s THR 206 Cb -0.15 -1.01 -0.03 0.00 -1.51 0.00 0.00 72.50 69.80 1i48 s THR 206 CO 0.06 0.00 -0.08 -1.83 -2.21 0.00 0.00 174.62 170.56 1i48 s GLU 207 N -2.86 2.49 -0.15 7.08 1.03 -1.26 -0.97 118.70 124.07 1i48 s GLU 207 Ca 0.07 -0.76 -0.05 0.00 0.03 0.00 0.00 54.97 54.25 1i48 s GLU 207 Cb -0.01 -2.47 0.07 0.00 -0.80 0.00 0.00 34.13 30.92 1i48 s GLU 207 CO -0.07 0.59 0.30 0.45 -1.33 0.00 0.00 175.26 175.20 1i48 s SER 208 N -1.49 0.20 0.90 0.83 0.15 -1.20 -3.53 113.70 109.57 1i48 s SER 208 Ca 0.17 0.69 -0.12 0.00 0.70 0.00 0.00 55.95 57.40 1i48 s SER 208 Cb -0.11 0.86 0.09 0.00 -1.71 0.00 0.00 66.02 65.15 1i48 s SER 208 CO 0.08 -0.24 0.86 -2.65 1.20 0.00 0.00 173.24 172.49 1i48 n PRO 209 N 5.36 -0.27 -2.58 5.44 -0.02 -1.26 -4.52 135.00 137.14 1i48 n PRO 209 Ca -0.07 -0.02 -0.23 0.00 -2.02 0.00 0.00 63.50 61.17 1i48 n PRO 209 Cb 0.50 -2.17 0.08 0.00 -0.02 0.00 0.00 33.50 31.88 1i48 n PRO 209 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1i48 s THR 210 N -2.44 2.36 -0.03 3.45 -1.32 0.21 -4.71 115.64 113.17 1i48 s THR 210 Ca 0.64 -0.60 0.05 0.00 -1.21 0.00 0.00 61.69 60.57 1i48 s THR 210 Cb -0.24 -2.76 -0.01 0.00 -1.51 0.00 0.00 72.50 67.98 1i48 s THR 210 CO 0.60 0.00 -0.17 0.21 -2.21 0.00 0.00 174.62 173.05 1i48 s ASN 211 N -4.59 2.11 -0.07 8.08 3.04 -1.26 -0.29 114.94 121.96 1i48 s ASN 211 Ca 0.62 -0.33 0.19 0.00 0.04 0.00 0.00 52.86 53.38 1i48 s ASN 211 Cb -0.08 -0.39 0.67 0.00 -1.54 0.00 0.00 41.25 39.91 1i48 s ASN 211 CO 0.42 0.19 1.57 -0.81 -3.04 0.00 0.00 177.10 175.43 1i48 n PRO 212 N 2.87 3.30 -0.25 0.43 -0.04 -1.26 -3.96 135.00 136.09 1i48 n PRO 212 Ca -0.16 -2.76 0.10 0.00 -0.04 0.00 0.00 63.50 60.64 1i48 n PRO 212 Cb 0.53 -1.73 0.27 0.00 -0.04 0.00 0.00 33.50 32.53 1i48 n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1i48 n PHE 213 N 1.25 0.65 -3.02 0.54 3.72 -1.26 -4.55 117.46 114.79 1i48 n PHE 213 Ca 0.24 -0.32 -0.15 0.00 -0.05 0.00 0.00 57.45 57.17 1i48 n PHE 213 Cb 0.76 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.29 1i48 n PHE 213 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1i48 n LEU 214 N 1.22 -0.78 -4.77 4.37 4.32 0.61 -4.74 117.00 117.23 1i48 n LEU 214 Ca 0.19 -0.05 -0.41 0.00 -0.02 0.00 0.00 56.01 55.72 1i48 n LEU 214 Cb 0.51 -1.63 -0.01 0.00 -1.62 0.00 0.00 43.42 40.68 1i48 n LEU 214 CO 0.14 0.03 1.10 -0.13 -1.22 0.00 0.00 177.39 177.32 1i48 s ARG 215 N -5.60 4.20 0.21 3.23 1.81 -1.25 -3.83 118.95 117.72 1i48 s ARG 215 Ca 0.23 2.43 0.07 0.00 -1.72 0.00 0.00 55.73 56.74 1i48 s ARG 215 Cb -0.13 -3.02 -0.04 0.00 -0.45 0.00 0.00 34.95 31.31 1i48 s ARG 215 CO 0.28 -0.43 0.10 0.00 -0.68 0.00 0.00 175.30 174.57 1i48 s VAL 217 N -1.97 2.08 -1.17 0.00 1.01 -1.26 -4.71 120.40 114.37 1i48 s VAL 217 Ca 0.31 -1.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.03 1i48 s VAL 217 Cb -0.09 -1.78 -0.11 0.00 0.00 0.00 0.00 36.38 34.41 1i48 s VAL 217 CO 0.22 0.56 1.96 -0.67 0.00 0.00 0.00 175.10 177.17 1i48 n ASP 218 N 3.36 2.85 -0.09 3.32 -0.08 -1.26 -4.79 116.55 119.86 1i48 n ASP 218 Ca -0.19 -2.67 -0.02 0.00 -1.51 0.00 0.00 54.79 50.40 1i48 n ASP 218 Cb 0.53 -1.73 -0.02 0.00 2.34 0.00 0.00 41.12 42.24 1i48 n ASP 218 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1i48 n ILE 219 N 7.93 -0.14 -0.33 5.18 -0.00 -1.26 -1.41 119.36 129.34 1i48 n ILE 219 Ca 0.45 1.62 0.02 0.00 -0.00 0.00 0.00 62.75 64.84 1i48 n ILE 219 Cb 0.46 -2.12 0.08 0.00 -0.00 0.00 0.00 39.64 38.06 1i48 n ILE 219 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1i48 n GLU 220 N -3.44 -0.15 0.46 0.38 2.13 -1.20 0.61 120.64 119.44 1i48 n GLU 220 Ca 0.00 1.35 -0.18 0.00 0.66 0.00 0.00 57.16 59.00 1i48 n GLU 220 Cb 0.05 -2.02 -0.09 0.00 0.27 0.00 0.00 31.44 29.66 1i48 n GLU 220 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1i48 h LEU 221 N 0.00 -1.02 -0.43 4.31 5.85 -1.54 -2.49 115.31 120.00 1i48 h LEU 221 Ca 0.36 0.04 0.09 0.00 0.84 0.00 0.00 57.88 59.20 1i48 h LEU 221 Cb 0.58 0.27 -0.09 0.00 0.37 0.00 0.00 40.66 41.79 1i48 h LEU 221 CO -0.88 -0.72 -0.15 0.58 -0.34 0.00 0.00 178.44 176.93 1i48 h VAL 222 N -1.18 0.49 -0.77 1.05 2.07 0.11 -0.27 116.25 117.75 1i48 h VAL 222 Ca -0.12 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.58 1i48 h VAL 222 Cb 0.91 0.49 -0.12 0.00 -1.52 0.00 0.00 31.29 31.05 1i48 h VAL 222 CO 0.19 0.00 0.17 0.28 0.02 0.00 0.00 177.57 178.23 1i48 h SER 223 N -0.05 -0.04 0.43 0.57 0.02 0.20 0.97 113.55 115.65 1i48 h SER 223 Ca 0.21 0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.30 1i48 h SER 223 Cb 0.37 0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1i48 h SER 223 CO -0.47 -0.08 -0.23 0.50 -1.14 0.00 0.00 176.83 175.41 1i48 h LYS 224 N 0.23 -0.59 -0.96 3.45 3.64 -0.60 0.29 116.57 122.04 1i48 h LYS 224 Ca 0.45 0.04 0.29 0.00 -1.27 0.00 0.00 60.65 60.16 1i48 h LYS 224 Cb 0.80 0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 32.61 1i48 h LYS 224 CO -0.56 -0.39 0.46 -0.07 -2.27 0.00 0.00 179.45 176.61 1i48 h LEU 225 N -0.61 0.35 0.36 5.20 3.38 -0.74 0.17 115.31 123.41 1i48 h LEU 225 Ca -0.06 0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1i48 h LEU 225 Cb 0.47 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1i48 h LEU 225 CO 0.08 -0.14 -0.17 0.00 0.09 0.00 0.00 178.44 178.31 1i48 h HIS 227 N -1.04 0.00 -0.51 0.00 3.86 0.42 0.41 115.15 118.30 1i48 h HIS 227 Ca -0.05 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.06 1i48 h HIS 227 Cb 0.48 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 1i48 h HIS 227 CO 0.03 0.00 -0.07 1.49 0.86 0.00 0.00 177.93 180.24 1i48 h GLU 228 N 0.00 0.91 -0.65 2.45 4.81 -0.94 -2.61 114.58 118.56 1i48 h GLU 228 Ca 0.19 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1i48 h GLU 228 Cb 1.19 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1i48 h GLU 228 CO -0.00 0.95 0.00 1.63 -0.73 0.00 0.00 179.01 180.85 1i48 n LYS 229 N -4.17 3.33 -0.95 1.92 4.76 0.14 -4.92 118.16 118.27 1i48 n LYS 229 Ca 0.02 -2.53 0.00 0.00 -2.87 0.00 0.00 58.31 52.93 1i48 n LYS 229 Cb 0.36 -1.79 0.00 0.00 -1.84 0.00 0.00 35.03 31.76 1i48 n LYS 229 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1i48 n GLY 230 N 1.12 0.43 3.84 0.72 0.00 -0.76 -4.90 105.19 105.64 1i48 n GLY 230 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 1i48 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 s ALA 231 N -2.06 2.93 0.03 4.61 0.00 -0.86 -4.93 121.76 121.48 1i48 s ALA 231 Ca 0.00 0.14 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 1i48 s ALA 231 Cb 0.00 -3.15 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 1i48 s ALA 231 CO 0.00 -0.67 0.22 -0.51 0.00 0.00 0.00 175.76 174.81 1i48 s LEU 232 N -4.73 4.36 -0.23 0.00 1.43 -1.01 -3.84 118.68 114.65 1i48 s LEU 232 Ca 0.59 0.38 -0.00 0.00 -1.03 0.00 0.00 54.13 54.07 1i48 s LEU 232 Cb -0.12 -2.80 0.03 0.00 0.03 0.00 0.00 46.19 43.33 1i48 s LEU 232 CO 0.43 0.21 -0.10 -0.69 0.23 0.00 0.00 176.35 176.43 1i48 s VAL 233 N -1.41 2.60 -0.21 -1.59 1.01 -1.26 0.20 120.40 119.75 1i48 s VAL 233 Ca 0.31 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1i48 s VAL 233 Cb -0.13 -2.30 0.03 0.00 0.00 0.00 0.00 36.38 33.98 1i48 s VAL 233 CO 0.22 0.25 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 1i48 s ILE 235 N 1.26 4.51 -0.85 0.00 -1.09 0.68 -1.78 121.20 123.93 1i48 s ILE 235 Ca 0.01 -0.17 -0.09 0.00 -2.23 0.00 0.00 60.65 58.17 1i48 s ILE 235 Cb -0.15 -2.93 0.22 0.00 -1.58 0.00 0.00 42.46 38.02 1i48 s ILE 235 CO -0.10 0.59 0.77 -0.62 -1.23 0.00 0.00 174.94 174.36 1i48 s ASP 236 N -0.72 6.47 0.00 3.58 -1.08 -0.14 -1.44 116.67 123.34 1i48 s ASP 236 Ca 0.12 -3.04 0.00 0.00 -0.52 0.00 0.00 52.55 49.10 1i48 s ASP 236 Cb -0.12 -2.10 0.00 0.00 -1.46 0.00 0.00 42.92 39.24 1i48 s ASP 236 CO 0.02 -0.42 0.89 0.61 0.52 0.00 0.00 175.17 176.80 1i48 n GLY 237 N 3.40 1.86 0.16 2.66 0.00 -1.03 -3.20 105.19 109.04 1i48 n GLY 237 Ca 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 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 0.03 0.00 -0.72 2.61 2.02 -1.87 0.31 112.91 115.28 1i48 h THR 238 Ca 0.00 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.36 1i48 h THR 238 Cb 0.89 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 1i48 h THR 238 CO 0.00 0.00 0.50 -0.26 0.37 0.00 0.00 175.52 176.13 1i48 h PHE 239 N -0.13 0.24 0.24 3.16 0.04 -1.84 -3.16 116.94 115.49 1i48 h PHE 239 Ca 0.03 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1i48 h PHE 239 Cb 0.21 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.28 1i48 h PHE 239 CO -0.67 0.08 -0.11 0.00 -0.60 0.00 0.00 178.31 177.01 1i48 h ALA 240 N 1.66 -0.47 0.00 2.45 0.00 -1.28 -3.41 119.26 118.20 1i48 h ALA 240 Ca 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1i48 h ALA 240 Cb 1.10 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1i48 h ALA 240 CO -0.07 -0.45 0.00 2.41 0.00 0.00 0.00 179.25 181.14 1i48 n THR 241 N -3.89 -0.32 0.26 0.00 -1.04 -0.09 -4.04 114.28 105.16 1i48 n THR 241 Ca -0.04 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.09 1i48 n THR 241 Cb 0.13 -0.05 0.63 0.00 -1.82 0.00 0.00 70.33 69.21 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 0.09 -2.82 0.13 -1.85 0.03 132.00 127.59 1i48 h PRO 242 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.86 1i48 h PRO 242 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1i48 h PRO 242 CO 0.00 0.00 -1.15 -0.07 -0.23 0.00 0.00 178.00 176.55 1i48 h LEU 243 N 0.00 0.57 -0.36 1.56 3.38 -1.93 -3.30 115.31 115.23 1i48 h LEU 243 Ca 0.00 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1i48 h LEU 243 Cb 0.61 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1i48 h LEU 243 CO 0.00 1.38 -0.19 0.59 0.09 0.00 0.00 178.44 180.31 1i48 n ASN 244 N -3.67 0.74 0.00 -0.43 4.13 -0.02 -4.82 115.26 111.19 1i48 n ASN 244 Ca -0.09 -0.71 0.00 0.00 1.68 0.00 0.00 54.58 55.46 1i48 n ASN 244 Cb 0.96 0.03 0.00 0.00 -1.54 0.00 0.00 39.78 39.23 1i48 n ASN 244 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1i48 n GLN 245 N -0.82 0.00 -3.33 3.52 10.64 -1.11 -2.11 117.38 124.17 1i48 n GLN 245 Ca 0.13 0.00 -0.28 0.00 -1.83 0.00 0.00 57.00 55.02 1i48 n GLN 245 Cb 0.32 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.63 1i48 n GLN 245 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1i48 n LYS 246 N -0.04 2.74 -0.45 2.61 4.76 -1.26 -4.25 118.16 122.27 1i48 n LYS 246 Ca 0.00 -4.70 0.38 0.00 -2.87 0.00 0.00 58.31 51.12 1i48 n LYS 246 Cb 0.00 -2.27 0.64 0.00 -1.84 0.00 0.00 35.03 31.56 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 0.71 1.30 0.02 7.82 0.00 -1.26 0.45 120.51 129.56 1i48 n ALA 247 Ca 0.30 0.79 -0.11 0.00 0.00 0.00 0.00 53.44 54.42 1i48 n ALA 247 Cb 0.40 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.81 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 -0.07 -1.61 0.00 3.38 -1.86 -1.57 115.31 113.58 1i48 h LEU 248 Ca 0.82 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.76 1i48 h LEU 248 Cb 2.69 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 43.48 1i48 h LEU 248 CO -0.40 -0.03 -0.21 0.00 0.09 0.00 0.00 178.44 177.89 1i48 h ALA 249 N 1.03 1.53 0.00 1.53 0.00 -0.30 -1.00 119.26 122.05 1i48 h ALA 249 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1i48 h ALA 249 Cb 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1i48 h ALA 249 CO -0.06 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.74 1i48 n LEU 250 N -4.11 0.16 0.00 0.00 4.77 -0.71 -4.85 117.00 112.27 1i48 n LEU 250 Ca -0.02 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.50 1i48 n LEU 250 Cb 0.28 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1i48 n LEU 250 CO 0.35 -0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.70 1i48 n GLY 251 N 0.02 1.98 3.45 -0.72 0.00 -0.38 -3.27 105.19 106.26 1i48 n GLY 251 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1i48 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 n ALA 252 N 0.00 -1.53 -0.02 4.61 0.00 -0.67 -4.92 120.51 117.97 1i48 n ALA 252 Ca 0.00 -0.17 -0.21 0.00 0.00 0.00 0.00 53.44 53.05 1i48 n ALA 252 Cb 0.00 -1.81 -0.13 0.00 0.00 0.00 0.00 19.45 17.50 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 -0.17 0.28 -3.91 0.00 3.32 -1.24 -3.42 116.42 111.28 1i48 h ASP 253 Ca -0.45 -0.80 -0.30 0.00 0.02 0.00 0.00 57.03 55.49 1i48 h ASP 253 Cb 1.37 -0.09 -0.28 0.00 0.22 0.00 0.00 39.33 40.54 1i48 h ASP 253 CO 0.43 1.59 -0.75 -0.76 -1.72 0.00 0.00 179.24 178.04 1i48 s LEU 254 N -7.58 2.02 -0.02 1.55 1.43 -0.72 -4.26 118.68 111.09 1i48 s LEU 254 Ca -0.22 -0.10 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 1i48 s LEU 254 Cb 0.05 -0.21 -0.01 0.00 0.03 0.00 0.00 46.19 46.05 1i48 s LEU 254 CO 0.73 0.04 -0.16 0.54 0.23 0.00 0.00 176.35 177.72 1i48 s VAL 255 N -0.16 1.31 -0.01 -1.59 0.11 -0.75 -0.23 120.40 119.08 1i48 s VAL 255 Ca 0.01 -0.68 -0.04 0.00 -2.93 0.00 0.00 61.98 58.34 1i48 s VAL 255 Cb -0.02 -1.11 0.00 0.00 -1.53 0.00 0.00 36.38 33.72 1i48 s VAL 255 CO -0.00 0.38 0.08 -1.48 -3.33 0.00 0.00 175.10 170.75 1i48 s LEU 256 N -0.20 1.73 0.17 2.54 0.05 -0.52 -0.51 118.68 121.95 1i48 s LEU 256 Ca 0.02 -0.06 0.04 0.00 0.05 0.00 0.00 54.13 54.19 1i48 s LEU 256 Cb -0.08 0.38 -0.05 0.00 -2.05 0.00 0.00 46.19 44.39 1i48 s LEU 256 CO 0.00 -0.18 -0.07 -1.00 -0.55 0.00 0.00 176.35 174.55 1i48 s HIS 257 N -0.65 1.36 -1.03 3.48 0.09 -0.86 -2.46 115.29 115.21 1i48 s HIS 257 Ca -0.07 -0.82 -0.11 0.00 -0.00 0.00 0.00 55.06 54.06 1i48 s HIS 257 Cb -0.04 -0.73 0.25 0.00 -0.00 0.00 0.00 32.58 32.06 1i48 s HIS 257 CO 0.00 0.04 1.02 0.45 -0.00 0.00 0.00 174.74 176.25 1i48 s SER 258 N -3.21 7.12 0.59 1.40 0.15 -1.26 -2.42 113.70 116.06 1i48 s SER 258 Ca 0.21 -3.24 0.11 0.00 0.70 0.00 0.00 55.95 53.72 1i48 s SER 258 Cb 0.04 -2.23 0.57 0.00 -1.71 0.00 0.00 66.02 62.69 1i48 s SER 258 CO 0.03 -0.42 1.28 0.00 1.20 0.00 0.00 173.24 175.33 1i48 h ALA 259 N 7.10 1.66 -0.49 5.45 0.00 -1.48 0.60 119.26 132.10 1i48 h ALA 259 Ca 0.16 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.22 1i48 h ALA 259 Cb 0.93 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1i48 h ALA 259 CO 0.95 -0.66 0.40 1.15 0.00 0.00 0.00 179.25 181.09 1i48 h THR 260 N 0.00 0.59 0.00 0.00 2.02 -1.67 -1.10 112.91 112.75 1i48 h THR 260 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1i48 h THR 260 Cb 1.39 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 1i48 h THR 260 CO 0.00 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.18 1i48 n LYS 261 N -4.12 0.00 -0.07 6.66 4.76 0.21 -4.57 118.16 121.03 1i48 n LYS 261 Ca 0.09 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.42 1i48 n LYS 261 Cb 0.61 -0.07 -0.09 0.00 -1.84 0.00 0.00 35.03 33.64 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 -0.82 2.13 0.04 -1.73 0.18 116.94 116.74 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 -0.15 0.00 2.20 0.00 0.00 35.95 38.00 1i48 h PHE 262 CO 0.00 0.78 -0.23 -0.07 -0.60 0.00 0.00 178.31 178.19 1i48 h LEU 263 N -1.00 -0.85 0.22 1.54 3.38 -1.84 0.19 115.31 116.94 1i48 h LEU 263 Ca -0.05 0.25 -0.33 0.00 0.09 0.00 0.00 57.88 57.85 1i48 h LEU 263 Cb 0.78 0.54 0.03 0.00 0.09 0.00 0.00 40.66 42.10 1i48 h LEU 263 CO -0.03 -0.28 -1.41 1.23 0.09 0.00 0.00 178.44 178.04 1i48 h GLY 264 N -0.01 0.62 -4.81 0.83 0.00 -1.35 -3.27 103.07 95.08 1i48 h GLY 264 Ca 0.38 -1.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.13 1i48 h GLY 264 CO -0.85 1.32 -0.10 0.61 0.00 0.00 0.00 176.54 177.52 1i48 n GLY 265 N 1.63 -0.50 0.00 4.60 0.00 0.65 -4.69 105.19 106.88 1i48 n GLY 265 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.76 0.00 -3.39 1.61 8.25 -1.26 -1.55 115.22 116.12 1i48 n HIS 266 Ca -0.03 -0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.18 1i48 n HIS 266 Cb 0.52 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.67 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 -0.00 -5.37 -1.08 0.41 3.02 -1.26 -4.82 115.26 106.15 1i48 n ASN 267 Ca 0.00 -0.46 0.04 0.00 -0.03 0.00 0.00 54.58 54.13 1i48 n ASN 267 Cb 0.16 -4.32 0.04 0.00 -0.61 0.00 0.00 39.78 35.05 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 -2.62 0.91 -3.63 6.41 5.75 -1.26 -5.08 116.55 117.02 1i48 n ASP 268 Ca -0.04 -2.28 -0.04 0.00 -0.01 0.00 0.00 54.79 52.42 1i48 n ASP 268 Cb 0.57 -0.31 -0.06 0.00 -1.03 0.00 0.00 41.12 40.29 1i48 n ASP 268 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1i48 s VAL 269 N -0.53 0.00 0.05 2.12 0.11 -1.26 -5.10 120.40 115.79 1i48 s VAL 269 Ca 0.26 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.35 1i48 s VAL 269 Cb 0.29 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1i48 s VAL 269 CO -0.11 0.00 -0.01 -0.76 -3.33 0.00 0.00 175.10 170.89 1i48 s LEU 270 N -0.49 3.42 -0.29 2.54 1.43 -1.26 -4.41 118.68 119.61 1i48 s LEU 270 Ca 0.06 -0.14 -0.27 0.00 -1.03 0.00 0.00 54.13 52.75 1i48 s LEU 270 Cb -0.03 -2.08 0.20 0.00 0.03 0.00 0.00 46.19 44.31 1i48 s LEU 270 CO -0.09 0.22 1.42 0.00 0.23 0.00 0.00 176.35 178.12 1i48 s ALA 271 N -1.20 -2.18 0.20 4.21 0.00 -1.23 -4.66 121.76 116.90 1i48 s ALA 271 Ca 0.23 1.81 0.08 0.00 0.00 0.00 0.00 51.96 54.07 1i48 s ALA 271 Cb -0.12 -1.67 -0.05 0.00 0.00 0.00 0.00 23.12 21.29 1i48 s ALA 271 CO 0.15 -0.17 -0.15 0.20 0.00 0.00 0.00 175.76 175.79 1i48 s GLY 272 N -0.58 1.41 -0.17 0.00 0.00 -1.22 -1.16 107.32 105.60 1i48 s GLY 272 Ca 0.09 -1.64 -0.23 0.00 0.00 0.00 0.00 44.72 42.94 1i48 s GLY 272 CO -0.12 -1.73 0.60 0.00 0.00 0.00 0.00 173.10 171.86 1i48 s ILE 274 N -0.14 1.43 0.07 0.00 1.01 -0.23 -2.03 121.20 121.31 1i48 s ILE 274 Ca -0.04 -0.68 0.07 0.00 0.00 0.00 0.00 60.65 60.01 1i48 s ILE 274 Cb -0.03 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 1i48 s ILE 274 CO 0.03 0.42 -0.18 -0.44 0.00 0.00 0.00 174.94 174.77 1i48 s SER 275 N 0.35 2.17 0.00 3.58 0.01 0.33 0.38 113.70 120.52 1i48 s SER 275 Ca -0.11 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.57 1i48 s SER 275 Cb -0.15 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 65.95 1i48 s SER 275 CO 0.04 0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.35 1i48 n GLY 276 N 1.49 -1.16 3.75 3.44 0.00 -0.61 -1.81 105.19 110.30 1i48 n GLY 276 Ca -0.19 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 1i48 n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1i48 s PRO 277 N -1.27 3.31 0.10 1.61 0.04 -1.26 -2.06 135.00 135.47 1i48 s PRO 277 Ca 0.00 2.29 -0.33 0.00 0.04 0.00 0.00 61.00 63.00 1i48 s PRO 277 Cb 0.00 -2.38 -0.13 0.00 0.04 0.00 0.00 34.50 32.03 1i48 s PRO 277 CO 0.00 -1.07 1.58 1.25 0.04 0.00 0.00 177.00 178.80 1i48 h LEU 278 N 1.72 -1.23 -1.56 -3.56 6.46 -1.88 -0.28 115.31 114.98 1i48 h LEU 278 Ca -0.51 0.12 0.50 0.00 -0.12 0.00 0.00 57.88 57.87 1i48 h LEU 278 Cb 1.29 0.43 -0.11 0.00 -0.73 0.00 0.00 40.66 41.54 1i48 h LEU 278 CO 0.58 -0.55 1.06 1.17 -0.62 0.00 0.00 178.44 180.08 1i48 n LYS 279 N -5.50 -0.02 -0.05 1.25 0.00 -1.26 -1.01 118.16 111.57 1i48 n LYS 279 Ca -0.09 1.15 -0.03 0.00 0.00 0.00 0.00 58.31 59.34 1i48 n LYS 279 Cb 0.40 -2.40 -0.01 0.00 0.00 0.00 0.00 35.03 33.02 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 -4.35 1.15 -0.29 3.14 4.77 -0.70 -4.17 117.00 116.56 1i48 n LEU 280 Ca 0.41 0.48 0.10 0.00 -0.03 0.00 0.00 56.01 56.97 1i48 n LEU 280 Cb 1.69 -0.73 0.25 0.00 -2.33 0.00 0.00 43.42 42.29 1i48 n LEU 280 CO 0.27 -0.48 0.91 1.62 -1.33 0.00 0.00 177.39 178.38 1i48 h VAL 281 N -0.63 0.33 -0.51 4.08 3.04 -0.57 0.04 116.25 122.03 1i48 h VAL 281 Ca 0.00 -0.06 0.10 0.00 -1.01 0.00 0.00 66.70 65.72 1i48 h VAL 281 Cb 0.34 0.13 -0.08 0.00 -2.01 0.00 0.00 31.29 29.67 1i48 h VAL 281 CO 0.00 0.03 0.03 0.77 -1.01 0.00 0.00 177.57 177.40 1i48 h SER 282 N 0.18 -0.15 -0.97 3.17 4.64 -1.30 0.13 113.55 119.26 1i48 h SER 282 Ca 0.51 0.11 0.24 0.00 -0.47 0.00 0.00 61.79 62.18 1i48 h SER 282 Cb 0.98 0.19 -0.07 0.00 -0.31 0.00 0.00 62.40 63.19 1i48 h SER 282 CO -0.65 -0.05 0.65 -0.33 -0.87 0.00 0.00 176.83 175.58 1i48 h GLU 283 N 0.15 0.32 0.01 4.77 4.39 -1.14 0.24 114.58 123.32 1i48 h GLU 283 Ca 0.26 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.89 1i48 h GLU 283 Cb 0.38 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1i48 h GLU 283 CO -0.40 0.21 -0.19 0.82 -1.16 0.00 0.00 179.01 178.29 1i48 h ILE 284 N 0.33 1.63 -1.02 3.13 2.04 -0.78 -3.23 117.51 119.60 1i48 h ILE 284 Ca 0.52 -2.09 0.24 0.00 1.00 0.00 0.00 64.86 64.54 1i48 h ILE 284 Cb 1.44 3.00 -0.11 0.00 -0.74 0.00 0.00 36.82 40.41 1i48 h ILE 284 CO -0.19 0.56 0.63 -0.09 0.00 0.00 0.00 178.15 179.06 1i48 h ARG 285 N -0.68 0.51 0.94 2.37 2.43 0.81 0.26 114.38 121.03 1i48 h ARG 285 Ca -0.03 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 1i48 h ARG 285 Cb 1.02 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1i48 h ARG 285 CO 0.04 0.34 -0.45 -0.91 -1.51 0.00 0.00 179.97 177.47 1i48 h ASN 286 N 0.53 -1.07 -0.39 -3.80 2.35 -1.17 0.85 115.58 112.88 1i48 h ASN 286 Ca 0.61 0.04 0.08 0.00 -0.55 0.00 0.00 56.30 56.48 1i48 h ASN 286 Cb 1.29 0.28 -0.02 0.00 0.05 0.00 0.00 38.32 39.92 1i48 h ASN 286 CO -0.38 -0.75 0.27 0.25 -1.65 0.00 0.00 177.43 175.16 1i48 h LEU 287 N -1.29 0.15 -0.48 1.61 5.85 -1.24 -0.34 115.31 119.58 1i48 h LEU 287 Ca -0.13 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 1i48 h LEU 287 Cb 0.97 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1i48 h LEU 287 CO 0.21 0.10 0.11 -0.74 -0.34 0.00 0.00 178.44 177.78 1i48 h HIS 288 N 0.17 0.81 -0.12 1.25 2.76 -0.00 -1.26 115.15 118.76 1i48 h HIS 288 Ca 0.18 -0.10 0.03 0.00 -2.20 0.00 0.00 60.37 58.28 1i48 h HIS 288 Cb 0.48 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 29.21 1i48 h HIS 288 CO -0.00 0.73 0.17 0.45 -1.30 0.00 0.00 177.93 177.98 1i48 h HIS 289 N 0.65 0.00 0.00 5.26 3.86 0.96 -0.43 115.15 125.44 1i48 h HIS 289 Ca 0.15 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 1i48 h HIS 289 Cb 0.34 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1i48 h HIS 289 CO 0.02 0.00 -0.28 0.82 0.86 0.00 0.00 177.93 179.35 1i48 h ILE 290 N 0.00 0.00 0.00 2.45 2.04 -1.19 -3.34 117.51 117.46 1i48 h ILE 290 Ca 0.06 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1i48 h ILE 290 Cb 0.39 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1i48 h ILE 290 CO -0.00 0.00 0.21 -0.07 0.00 0.00 0.00 178.15 178.29 1i48 h LEU 291 N -0.84 0.00 -2.83 1.44 3.38 -1.15 -3.46 115.31 111.85 1i48 h LEU 291 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1i48 h LEU 291 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1i48 h LEU 291 CO 0.00 0.00 -0.49 0.61 0.09 0.00 0.00 178.44 178.65 1i48 n GLY 292 N -1.21 -1.14 0.83 0.83 0.00 -0.18 -4.95 105.19 99.36 1i48 n GLY 292 Ca -0.02 0.71 0.01 0.00 0.00 0.00 0.00 46.02 46.73 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 -1.33 5.31 3.40 -0.02 0.00 -1.25 -5.08 105.19 106.21 1i48 n GLY 293 Ca -0.07 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.07 -1.96 -2.71 4.61 0.00 -1.26 -2.11 120.51 116.02 1i48 n ALA 294 Ca 0.23 0.09 -0.37 0.00 0.00 0.00 0.00 53.44 53.39 1i48 n ALA 294 Cb 0.75 -1.67 -0.07 0.00 0.00 0.00 0.00 19.45 18.46 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 2.54 4.30 0.28 0.00 2.96 -1.26 -4.48 118.68 123.02 1i48 s LEU 295 Ca 0.63 0.58 -0.29 0.00 -0.22 0.00 0.00 54.13 54.82 1i48 s LEU 295 Cb -0.56 -2.37 -0.10 0.00 0.50 0.00 0.00 46.19 43.66 1i48 s LEU 295 CO 0.59 0.18 1.33 0.21 -1.32 0.00 0.00 176.35 177.34 1i48 s ASN 296 N 0.01 6.79 0.17 3.68 3.84 -1.26 -4.87 114.94 123.30 1i48 s ASN 296 Ca 0.17 2.61 -0.22 0.00 0.21 0.00 0.00 52.86 55.63 1i48 s ASN 296 Cb -0.13 -2.63 0.07 0.00 -0.55 0.00 0.00 41.25 38.01 1i48 s ASN 296 CO 0.05 -0.56 1.60 -0.65 -2.79 0.00 0.00 177.10 174.75 1i48 h PRO 297 N 4.23 -0.22 -0.96 0.43 0.11 -1.97 0.08 132.00 133.70 1i48 h PRO 297 Ca -0.47 0.02 0.24 0.00 0.11 0.00 0.00 66.00 65.90 1i48 h PRO 297 Cb 1.22 0.05 -0.13 0.00 0.11 0.00 0.00 31.00 32.25 1i48 h PRO 297 CO 0.71 -0.15 0.51 -0.91 -0.21 0.00 0.00 178.00 177.95 1i48 h ASN 298 N -0.23 0.51 0.19 -2.05 2.35 -1.92 0.36 115.58 114.79 1i48 h ASN 298 Ca 0.19 0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 56.08 1i48 h ASN 298 Cb 0.54 0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1i48 h ASN 298 CO -0.57 0.03 -0.09 0.00 -1.65 0.00 0.00 177.43 175.15 1i48 h ALA 299 N 1.74 -0.26 -0.65 -0.83 0.00 -1.40 -2.27 119.26 115.59 1i48 h ALA 299 Ca 0.62 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.52 1i48 h ALA 299 Cb 1.21 0.10 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 1i48 h ALA 299 CO -0.51 -0.53 -0.16 0.00 0.00 0.00 0.00 179.25 178.04 1i48 h ALA 300 N 0.27 0.42 0.06 0.00 0.00 0.67 -1.24 119.26 119.45 1i48 h ALA 300 Ca -0.03 0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1i48 h ALA 300 Cb 0.37 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1i48 h ALA 300 CO 0.04 -0.43 -0.10 -0.92 0.00 0.00 0.00 179.25 177.84 1i48 h TYR 301 N -0.00 -0.27 -0.93 0.00 3.20 -0.56 -0.32 116.97 118.10 1i48 h TYR 301 Ca 0.31 0.00 0.23 0.00 3.14 0.00 0.00 58.73 62.41 1i48 h TYR 301 Cb 0.48 0.11 -0.12 0.00 1.54 0.00 0.00 36.73 38.73 1i48 h TYR 301 CO -0.53 -0.16 0.46 -0.07 -1.64 0.00 0.00 178.16 176.22 1i48 h LEU 302 N -0.21 0.45 0.32 2.82 3.38 -0.65 0.75 115.31 122.18 1i48 h LEU 302 Ca 0.02 0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1i48 h LEU 302 Cb 0.23 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1i48 h LEU 302 CO -0.06 0.04 -0.16 0.40 0.09 0.00 0.00 178.44 178.75 1i48 h ILE 303 N 0.47 0.66 -1.02 1.22 2.04 -0.74 0.73 117.51 120.87 1i48 h ILE 303 Ca 0.58 -0.56 0.25 0.00 1.00 0.00 0.00 64.86 66.13 1i48 h ILE 303 Cb 1.10 0.94 -0.11 0.00 -0.74 0.00 0.00 36.82 38.01 1i48 h ILE 303 CO -0.50 0.11 0.63 0.40 0.00 0.00 0.00 178.15 178.78 1i48 h ILE 304 N -0.76 0.55 -0.28 -0.67 2.04 0.76 0.57 117.51 119.71 1i48 h ILE 304 Ca -0.04 -0.18 -0.14 0.00 1.00 0.00 0.00 64.86 65.49 1i48 h ILE 304 Cb 0.51 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1i48 h ILE 304 CO 0.07 0.09 -0.41 -0.09 0.00 0.00 0.00 178.15 177.82 1i48 h ARG 305 N 0.52 0.68 -0.19 2.37 2.43 0.75 -3.21 114.38 117.73 1i48 h ARG 305 Ca 0.62 -0.35 -0.09 0.00 -0.81 0.00 0.00 59.98 59.35 1i48 h ARG 305 Cb 1.32 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1i48 h ARG 305 CO -0.39 0.96 -0.23 0.78 -1.51 0.00 0.00 179.97 179.58 1i48 h GLY 306 N 0.97 0.53 2.00 2.80 0.00 0.25 -2.99 103.07 106.63 1i48 h GLY 306 Ca 0.04 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.81 1i48 h GLY 306 CO 0.09 0.51 0.00 1.03 0.00 0.00 0.00 176.54 178.17 1i48 n MET 307 N -4.43 0.09 0.30 4.80 2.81 0.16 -1.30 117.12 119.55 1i48 n MET 307 Ca -0.06 0.56 0.16 0.00 -1.81 0.00 0.00 57.70 56.56 1i48 n MET 307 Cb 0.42 -1.79 0.95 0.00 -0.71 0.00 0.00 33.22 32.09 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 -1.53 -1.83 116.57 115.04 1i48 h LYS 308 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1i48 h LYS 308 Cb 0.04 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.61 1i48 h LYS 308 CO 0.00 0.00 -0.51 0.25 -1.08 0.00 0.00 179.45 178.11 1i48 n THR 309 N -3.77 1.55 0.07 -0.16 -2.24 -0.42 -4.76 114.28 104.55 1i48 n THR 309 Ca -0.03 -2.38 -0.05 0.00 -2.27 0.00 0.00 64.05 59.32 1i48 n THR 309 Cb 0.08 0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 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 0.74 -0.38 -0.45 3.22 5.85 -1.35 -1.39 115.31 121.55 1i48 h LEU 310 Ca -0.05 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.77 1i48 h LEU 310 Cb 1.21 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 42.27 1i48 h LEU 310 CO 0.02 -0.17 -0.49 1.12 -0.34 0.00 0.00 178.44 178.57 1i48 h HIS 311 N -0.26 -1.47 -0.98 1.25 2.07 -1.90 0.23 115.15 114.08 1i48 h HIS 311 Ca -0.01 0.08 0.13 0.00 -2.85 0.00 0.00 60.37 57.72 1i48 h HIS 311 Cb 0.23 0.71 -0.15 0.00 2.57 0.00 0.00 27.41 30.77 1i48 h HIS 311 CO -0.15 -0.46 -0.45 1.28 -3.07 0.00 0.00 177.93 175.08 1i48 n LEU 312 N -5.39 -0.77 0.12 6.12 7.99 -1.16 -0.94 117.00 122.96 1i48 n LEU 312 Ca -0.01 1.73 -0.05 0.00 -0.01 0.00 0.00 56.01 57.67 1i48 n LEU 312 Cb 0.35 -0.34 -0.02 0.00 -0.11 0.00 0.00 43.42 43.30 1i48 n LEU 312 CO 0.01 -1.50 0.42 0.03 -1.51 0.00 0.00 177.39 174.84 1i48 h ARG 313 N 0.00 -0.29 -0.83 3.23 3.08 -0.05 -2.97 114.38 116.56 1i48 h ARG 313 Ca 0.28 0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.51 1i48 h ARG 313 Cb 0.53 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.49 1i48 h ARG 313 CO -0.96 -0.19 -0.25 0.28 -1.07 0.00 0.00 179.97 177.78 1i48 n VAL 314 N -2.93 -0.38 0.00 2.04 0.31 -0.06 -0.55 118.33 116.76 1i48 n VAL 314 Ca -0.04 1.92 0.00 0.00 -0.01 0.00 0.00 64.34 66.21 1i48 n VAL 314 Cb 0.12 -2.61 0.00 0.00 -0.91 0.00 0.00 33.84 30.44 1i48 n VAL 314 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1i48 n GLN 315 N -5.31 0.00 -0.29 5.55 6.02 -0.12 0.71 117.38 123.94 1i48 n GLN 315 Ca 0.12 0.76 0.07 0.00 -0.01 0.00 0.00 57.00 57.94 1i48 n GLN 315 Cb 0.39 -1.46 0.17 0.00 1.02 0.00 0.00 30.24 30.36 1i48 n GLN 315 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 1i48 h GLN 316 N 0.00 0.05 0.26 -1.09 5.75 -0.66 0.08 115.11 119.51 1i48 h GLN 316 Ca 0.00 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1i48 h GLN 316 Cb 0.00 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.54 1i48 h GLN 316 CO 0.00 0.03 -0.15 1.96 -2.65 0.00 0.00 178.83 178.03 1i48 h GLN 317 N 0.05 -0.37 -0.79 1.69 4.20 -0.13 -2.11 115.11 117.65 1i48 h GLN 317 Ca 0.46 0.03 0.18 0.00 0.06 0.00 0.00 58.65 59.37 1i48 h GLN 317 Cb 0.81 0.08 -0.12 0.00 0.30 0.00 0.00 27.48 28.56 1i48 h GLN 317 CO -0.79 -0.25 0.23 -0.91 -0.67 0.00 0.00 178.83 176.44 1i48 h ASN 318 N -0.39 0.08 0.27 1.46 2.35 0.23 -1.21 115.58 118.37 1i48 h ASN 318 Ca -0.03 0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1i48 h ASN 318 Cb 0.31 0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1i48 h ASN 318 CO 0.04 -0.04 -0.13 0.28 -1.65 0.00 0.00 177.43 175.93 1i48 h SER 319 N 0.30 -0.30 -0.96 5.81 0.02 -1.08 -2.56 113.55 114.77 1i48 h SER 319 Ca 0.46 0.01 0.28 0.00 -0.84 0.00 0.00 61.79 61.71 1i48 h SER 319 Cb 0.83 0.08 -0.17 0.00 0.14 0.00 0.00 62.40 63.28 1i48 h SER 319 CO -0.53 -0.18 0.15 0.74 -1.14 0.00 0.00 176.83 175.86 1i48 h THR 320 N -0.43 0.09 0.24 -2.27 2.02 -1.20 -0.23 112.91 111.13 1i48 h THR 320 Ca -0.04 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 1i48 h THR 320 Cb 0.27 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 1i48 h THR 320 CO 0.06 0.01 -0.24 0.00 0.37 0.00 0.00 175.52 175.72 1i48 h ALA 321 N 1.93 -0.94 -0.37 6.16 0.00 -1.22 -1.24 119.26 123.59 1i48 h ALA 321 Ca 0.62 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1i48 h ALA 321 Cb 1.34 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1i48 h ALA 321 CO -0.84 -0.95 0.00 -0.11 0.00 0.00 0.00 179.25 177.35 1i48 n LEU 322 N -3.82 0.00 -0.32 0.00 7.94 -0.17 0.10 117.00 120.73 1i48 n LEU 322 Ca -0.06 0.94 -0.08 0.00 -1.11 0.00 0.00 56.01 55.70 1i48 n LEU 322 Cb 0.22 -0.44 -0.05 0.00 0.53 0.00 0.00 43.42 43.68 1i48 n LEU 322 CO 0.12 -0.44 0.53 0.03 -1.11 0.00 0.00 177.39 176.53 1i48 h ARG 323 N 0.00 -0.10 -0.69 1.96 3.08 -1.41 0.48 114.38 117.70 1i48 h ARG 323 Ca 0.00 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.14 1i48 h ARG 323 Cb 0.00 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.00 1i48 h ARG 323 CO 0.00 -0.07 0.34 0.52 -1.07 0.00 0.00 179.97 179.69 1i48 h MET 324 N -0.11 0.57 -0.11 0.04 2.86 -0.75 0.21 114.93 117.64 1i48 h MET 324 Ca 0.20 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.82 1i48 h MET 324 Cb 0.52 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1i48 h MET 324 CO -0.85 0.37 -0.32 0.00 1.06 0.00 0.00 176.91 177.18 1i48 h ALA 325 N 1.41 -0.69 0.03 6.32 0.00 0.55 0.72 119.26 127.61 1i48 h ALA 325 Ca 0.33 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.24 1i48 h ALA 325 Cb 0.34 0.85 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 1i48 h ALA 325 CO -0.26 -0.81 -0.47 0.93 0.00 0.00 0.00 179.25 178.64 1i48 h GLU 326 N -0.33 -0.62 -1.07 0.00 5.08 -0.71 0.33 114.58 117.27 1i48 h GLU 326 Ca 0.02 0.04 0.30 0.00 -1.00 0.00 0.00 59.36 58.73 1i48 h GLU 326 Cb 0.39 0.14 -0.12 0.00 0.50 0.00 0.00 28.75 29.66 1i48 h GLU 326 CO -0.27 -0.41 0.65 0.82 -1.00 0.00 0.00 179.01 178.80 1i48 h ILE 327 N -0.64 0.40 -0.01 3.13 2.04 -0.40 0.12 117.51 122.17 1i48 h ILE 327 Ca 0.03 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1i48 h ILE 327 Cb 0.69 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1i48 h ILE 327 CO -0.32 0.07 -0.02 -0.07 0.00 0.00 0.00 178.15 177.81 1i48 h LEU 328 N 0.37 0.03 -1.02 1.44 3.38 0.25 -2.56 115.31 117.20 1i48 h LEU 328 Ca 0.68 -0.60 0.17 0.00 0.09 0.00 0.00 57.88 58.22 1i48 h LEU 328 Cb 1.66 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 42.30 1i48 h LEU 328 CO -0.44 0.62 0.62 -0.08 0.09 0.00 0.00 178.44 179.25 1i48 h GLU 329 N -0.57 0.81 0.00 1.13 4.81 0.20 0.89 114.58 121.86 1i48 h GLU 329 Ca -0.00 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1i48 h GLU 329 Cb 0.62 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1i48 h GLU 329 CO 0.00 0.54 -0.19 0.00 -0.73 0.00 0.00 179.01 178.63 1i48 h ALA 330 N 1.61 0.94 -2.84 2.92 0.00 -0.99 -3.45 119.26 117.44 1i48 h ALA 330 Ca 0.55 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.76 1i48 h ALA 330 Cb 0.76 -0.03 0.08 0.00 0.00 0.00 0.00 17.79 18.60 1i48 h ALA 330 CO -0.34 0.24 0.75 -1.58 0.00 0.00 0.00 179.25 178.32 1i48 s HIS 331 N -3.39 2.87 0.14 0.00 5.65 0.31 -4.93 115.29 115.92 1i48 s HIS 331 Ca 0.03 1.13 -0.14 0.00 0.25 0.00 0.00 55.06 56.34 1i48 s HIS 331 Cb 0.08 -3.87 -0.00 0.00 -1.18 0.00 0.00 32.58 27.60 1i48 s HIS 331 CO 0.65 -2.68 1.59 -1.00 -0.65 0.00 0.00 174.74 172.65 1i48 h PRO 332 N 4.02 0.78 0.00 2.88 0.13 -1.87 -2.92 132.00 135.02 1i48 h PRO 332 Ca -0.48 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.40 1i48 h PRO 332 Cb 1.23 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1i48 h PRO 332 CO 0.71 0.84 0.00 1.63 -0.23 0.00 0.00 178.00 180.95 1i48 n LYS 333 N -4.39 0.16 -3.33 0.86 5.02 -1.26 -4.49 118.16 110.73 1i48 n LYS 333 Ca -0.00 0.17 -0.43 0.00 -2.02 0.00 0.00 58.31 56.02 1i48 n LYS 333 Cb 0.30 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 1i48 n LYS 333 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1i48 s VAL 334 N -2.69 5.10 0.03 -0.18 1.01 -1.10 0.52 120.40 123.08 1i48 s VAL 334 Ca 0.13 -0.46 -0.26 0.00 0.00 0.00 0.00 61.98 61.39 1i48 s VAL 334 Cb 0.10 -4.06 -0.17 0.00 0.00 0.00 0.00 36.38 32.25 1i48 s VAL 334 CO 0.25 -0.46 1.40 -0.09 0.00 0.00 0.00 175.10 176.20 1i48 h ARG 335 N 8.75 -0.26 -3.83 2.72 2.43 -1.51 -3.46 114.38 119.22 1i48 h ARG 335 Ca -0.27 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 58.81 1i48 h ARG 335 Cb 1.11 0.06 -0.16 0.00 -0.42 0.00 0.00 29.97 30.56 1i48 h ARG 335 CO 0.81 0.01 -0.47 -1.58 -1.51 0.00 0.00 179.97 177.23 1i48 s HIS 336 N -5.07 0.21 -0.02 2.20 5.04 -1.12 -4.99 115.29 111.53 1i48 s HIS 336 Ca -0.15 -0.58 0.00 0.00 -1.54 0.00 0.00 55.06 52.80 1i48 s HIS 336 Cb 0.03 -0.13 0.02 0.00 0.04 0.00 0.00 32.58 32.54 1i48 s HIS 336 CO 0.61 -0.44 0.01 0.08 -2.34 0.00 0.00 174.74 172.66 1i48 s VAL 337 N -3.23 0.02 -0.18 0.89 1.01 -1.26 -1.40 120.40 116.25 1i48 s VAL 337 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1i48 s VAL 337 Cb 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.26 1i48 s VAL 337 CO -0.08 0.09 -0.03 -0.31 0.00 0.00 0.00 175.10 174.77 1i48 s TYR 338 N 0.81 3.00 -0.30 5.22 1.51 0.22 -4.85 117.35 122.96 1i48 s TYR 338 Ca -0.07 -0.49 -0.17 0.00 -1.01 0.00 0.00 57.07 55.33 1i48 s TYR 338 Cb -0.10 -2.03 0.18 0.00 -0.11 0.00 0.00 41.96 39.90 1i48 s TYR 338 CO -0.02 -0.22 1.13 -0.47 -1.11 0.00 0.00 175.55 174.86 1i48 s TYR 339 N 0.81 -0.40 0.63 2.71 5.04 -1.26 -2.81 117.35 122.07 1i48 s TYR 339 Ca -0.01 0.66 0.28 0.00 -2.44 0.00 0.00 57.07 55.55 1i48 s TYR 339 Cb -0.14 0.23 1.45 0.00 0.35 0.00 0.00 41.96 43.85 1i48 s TYR 339 CO 0.02 -0.20 1.84 -1.35 -1.34 0.00 0.00 175.55 174.52 1i48 h PRO 340 N 7.38 0.00 -0.12 4.97 0.11 -1.87 0.25 132.00 142.72 1i48 h PRO 340 Ca -0.14 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.87 1i48 h PRO 340 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1i48 h PRO 340 CO 0.05 0.00 -0.37 0.78 -0.21 0.00 0.00 178.00 178.25 1i48 h GLY 341 N 0.00 0.27 -1.52 -0.55 0.00 -1.94 -3.43 103.07 95.91 1i48 h GLY 341 Ca 0.09 -0.24 -0.49 0.00 0.00 0.00 0.00 47.33 46.69 1i48 h GLY 341 CO -0.00 0.22 0.40 1.08 0.00 0.00 0.00 176.54 178.24 1i48 s LEU 342 N -8.33 3.39 0.18 3.11 1.43 0.08 -4.97 118.68 113.57 1i48 s LEU 342 Ca -0.05 1.48 0.08 0.00 -1.03 0.00 0.00 54.13 54.62 1i48 s LEU 342 Cb 0.14 -4.49 0.02 0.00 0.03 0.00 0.00 46.19 41.89 1i48 s LEU 342 CO 0.77 -0.76 1.41 1.56 0.23 0.00 0.00 176.35 179.56 1i48 h GLN 343 N 0.18 0.00 0.00 1.70 4.20 -1.86 -3.06 115.11 116.28 1i48 h GLN 343 Ca -0.45 -0.01 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 0.85 0.13 0.66 -0.67 0.00 0.00 178.83 180.41 1i48 h SER 344 N 0.00 0.00 -3.20 1.46 4.64 -1.93 -3.42 113.55 111.10 1i48 h SER 344 Ca -0.01 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.77 1i48 h SER 344 Cb 1.50 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1i48 h SER 344 CO 0.11 0.00 0.56 -2.28 -0.87 0.00 0.00 176.83 174.35 1i48 s HIS 345 N -3.93 3.43 0.05 4.77 5.04 -1.16 -4.98 115.29 118.51 1i48 s HIS 345 Ca -0.04 1.34 -0.13 0.00 -1.54 0.00 0.00 55.06 54.70 1i48 s HIS 345 Cb 0.09 -3.38 -0.04 0.00 0.04 0.00 0.00 32.58 29.30 1i48 s HIS 345 CO 0.30 -1.10 1.21 -1.35 -2.34 0.00 0.00 174.74 171.46 1i48 h PRO 346 N 6.92 -0.10 -0.91 2.88 0.11 -1.91 -1.54 132.00 137.46 1i48 h PRO 346 Ca -0.40 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 1i48 h PRO 346 Cb 1.21 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1i48 h PRO 346 CO 0.81 -0.07 0.01 -0.85 -0.21 0.00 0.00 178.00 177.69 1i48 n GLU 347 N -3.79 1.86 -0.32 1.05 0.00 -1.26 -4.43 120.64 113.75 1i48 n GLU 347 Ca -0.01 -0.71 0.19 0.00 0.00 0.00 0.00 57.16 56.63 1i48 n GLU 347 Cb 0.12 -1.66 0.39 0.00 0.00 0.00 0.00 31.44 30.29 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 0.88 0.64 -0.81 -1.84 2.76 -1.54 0.47 115.15 115.71 1i48 h HIS 348 Ca 0.01 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.18 1i48 h HIS 348 Cb 0.86 -0.13 -0.04 0.00 1.55 0.00 0.00 27.41 29.66 1i48 h HIS 348 CO 0.25 -0.20 0.36 1.12 -1.30 0.00 0.00 177.93 178.17 1i48 h HIS 349 N 0.27 1.20 -0.44 5.26 2.07 -1.82 -1.01 115.15 120.67 1i48 h HIS 349 Ca 0.65 -0.07 -0.15 0.00 -2.85 0.00 0.00 60.37 57.95 1i48 h HIS 349 Cb 1.41 -0.37 -0.01 0.00 2.57 0.00 0.00 27.41 31.01 1i48 h HIS 349 CO -0.14 0.88 -0.30 0.82 -3.07 0.00 0.00 177.93 176.13 1i48 h ILE 350 N 1.17 1.27 -0.23 6.12 2.04 -0.54 -1.25 117.51 126.08 1i48 h ILE 350 Ca 0.28 -1.47 0.05 0.00 1.00 0.00 0.00 64.86 64.72 1i48 h ILE 350 Cb 0.16 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.43 1i48 h ILE 350 CO -0.03 0.50 -0.12 0.00 0.00 0.00 0.00 178.15 178.50 1i48 h ALA 351 N 0.82 0.06 -0.63 1.87 0.00 -0.32 -0.65 119.26 120.42 1i48 h ALA 351 Ca 0.09 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1i48 h ALA 351 Cb 0.89 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1i48 h ALA 351 CO 0.08 -0.54 0.38 0.87 0.00 0.00 0.00 179.25 180.05 1i48 h LYS 352 N -0.10 0.86 -0.17 0.00 1.57 -1.02 0.44 116.57 118.15 1i48 h LYS 352 Ca 0.13 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1i48 h LYS 352 Cb 0.29 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1i48 h LYS 352 CO -0.30 0.61 -0.26 1.57 -0.57 0.00 0.00 179.45 180.50 1i48 h LYS 353 N 0.86 0.31 0.00 3.15 2.10 -0.51 -3.33 116.57 119.16 1i48 h LYS 353 Ca 0.23 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 1i48 h LYS 353 Cb -0.03 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.28 1i48 h LYS 353 CO -0.04 0.56 -1.15 0.00 -2.00 0.00 0.00 179.45 176.82 1i48 n GLN 354 N -4.14 1.27 -4.14 0.07 10.64 -0.32 -5.03 117.38 115.73 1i48 n GLN 354 Ca -0.01 -0.06 -0.23 0.00 -1.83 0.00 0.00 57.00 54.88 1i48 n GLN 354 Cb 0.38 -1.13 -0.05 0.00 -0.86 0.00 0.00 30.24 28.58 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 -2.41 2.82 0.00 2.61 -1.94 0.15 -4.67 119.30 115.87 1i48 s MET 355 Ca -0.02 -1.09 0.02 0.00 -1.71 0.00 0.00 55.69 52.89 1i48 s MET 355 Cb 0.06 -2.51 -0.00 0.00 2.01 0.00 0.00 34.83 34.39 1i48 s MET 355 CO 0.36 0.41 0.31 0.25 -0.01 0.00 0.00 175.02 176.34 1i48 n THR 356 N -1.03 0.00 -4.05 2.05 -2.24 -0.90 -4.63 114.28 103.47 1i48 n THR 356 Ca -0.08 -0.48 -0.14 0.00 -2.27 0.00 0.00 64.05 61.08 1i48 n THR 356 Cb 0.58 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.80 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 -0.65 1.42 -0.03 3.38 0.00 -1.26 -5.02 107.32 105.17 1i48 s GLY 357 Ca 0.01 -1.46 0.13 0.00 0.00 0.00 0.00 44.72 43.40 1i48 s GLY 357 CO 0.04 -0.92 1.10 0.69 0.00 0.00 0.00 173.10 174.01 1i48 n PHE 358 N -0.59 0.00 -3.80 1.90 3.72 -1.26 -4.98 117.46 112.45 1i48 n PHE 358 Ca -0.00 -0.39 0.02 0.00 -0.05 0.00 0.00 57.45 57.03 1i48 n PHE 358 Cb 0.61 -0.11 -0.01 0.00 -0.94 0.00 0.00 39.48 39.03 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 -0.00 -1.58 0.12 1.37 0.00 -1.26 -4.51 105.19 99.34 1i48 n GLY 359 Ca 0.05 -1.21 0.08 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.57 4.18 3.63 -0.02 0.00 -1.26 -3.76 105.19 107.39 1i48 n GLY 360 Ca 0.00 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 1i48 n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i48 s ALA 361 N -2.40 3.38 -0.04 4.61 0.00 -1.26 -1.09 121.76 124.96 1i48 s ALA 361 Ca 0.26 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1i48 s ALA 361 Cb 0.23 -1.87 0.03 0.00 0.00 0.00 0.00 23.12 21.51 1i48 s ALA 361 CO 0.02 0.22 -0.00 0.08 0.00 0.00 0.00 175.76 176.08 1i48 s VAL 362 N 0.26 0.24 -0.01 0.00 1.01 -0.63 -4.91 120.40 116.36 1i48 s VAL 362 Ca 0.03 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.12 1i48 s VAL 362 Cb -0.12 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.87 1i48 s VAL 362 CO 0.01 0.18 -0.05 -0.44 0.00 0.00 0.00 175.10 174.79 1i48 s SER 363 N 1.26 4.73 -0.14 3.32 0.01 -1.12 -0.49 113.70 121.26 1i48 s SER 363 Ca -0.06 -0.09 -0.29 0.00 1.31 0.00 0.00 55.95 56.82 1i48 s SER 363 Cb -0.13 -1.15 0.08 0.00 0.21 0.00 0.00 66.02 65.02 1i48 s SER 363 CO -0.02 0.30 0.73 0.72 0.41 0.00 0.00 173.24 175.37 1i48 s PHE 364 N -0.98 -0.68 -0.10 2.43 -0.71 0.09 0.68 117.98 118.72 1i48 s PHE 364 Ca 0.17 1.39 -0.15 0.00 -1.04 0.00 0.00 56.93 57.30 1i48 s PHE 364 Cb -0.11 0.36 -0.05 0.00 -1.21 0.00 0.00 43.02 42.01 1i48 s PHE 364 CO 0.07 -0.50 0.36 -1.21 -1.34 0.00 0.00 175.22 172.60 1i48 s GLU 365 N -0.57 4.11 0.15 1.99 2.02 -0.49 -0.67 118.70 125.24 1i48 s GLU 365 Ca -0.06 0.26 -0.11 0.00 0.02 0.00 0.00 54.97 55.08 1i48 s GLU 365 Cb -0.02 -3.35 -0.07 0.00 0.10 0.00 0.00 34.13 30.80 1i48 s GLU 365 CO 0.06 0.40 0.50 0.08 0.02 0.00 0.00 175.26 176.32 1i48 s VAL 366 N -0.10 4.95 -1.13 2.63 1.01 -1.19 -1.54 120.40 125.03 1i48 s VAL 366 Ca 0.21 0.59 -0.20 0.00 0.00 0.00 0.00 61.98 62.58 1i48 s VAL 366 Cb -0.15 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 1i48 s VAL 366 CO 0.08 0.16 1.96 -0.67 0.00 0.00 0.00 175.10 176.63 1i48 n ASP 367 N 0.53 3.43 -0.61 3.32 2.03 0.18 -4.65 116.55 120.78 1i48 n ASP 367 Ca -0.04 -2.77 0.00 0.00 0.52 0.00 0.00 54.79 52.50 1i48 n ASP 367 Cb 0.52 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.41 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 4.92 1.47 3.81 0.27 0.00 -1.26 -5.00 105.19 109.40 1i48 n GLY 368 Ca 0.49 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 45.46 1i48 n GLY 368 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1i48 s ASP 369 N 0.17 4.69 0.10 1.61 -4.77 -1.26 -4.78 116.67 112.43 1i48 s ASP 369 Ca 0.00 -0.97 -0.20 0.00 -3.30 0.00 0.00 52.55 48.08 1i48 s ASP 369 Cb 0.00 -0.40 -0.05 0.00 -1.09 0.00 0.00 42.92 41.39 1i48 s ASP 369 CO 0.00 -0.66 1.16 -0.11 0.70 0.00 0.00 175.17 176.26 1i48 n LEU 370 N -1.43 -0.69 -0.12 2.11 -0.00 -1.26 0.36 117.00 115.97 1i48 n LEU 370 Ca 0.01 1.32 -0.05 0.00 -0.00 0.00 0.00 56.01 57.29 1i48 n LEU 370 Cb 0.63 -0.23 0.03 0.00 -0.00 0.00 0.00 43.42 43.86 1i48 n LEU 370 CO 0.44 -1.02 0.90 -0.07 -0.00 0.00 0.00 177.39 177.63 1i48 h LEU 371 N 0.00 -0.00 0.70 -1.96 -0.00 -1.96 -1.49 115.31 110.60 1i48 h LEU 371 Ca 0.10 0.07 -0.03 0.00 -0.00 0.00 0.00 57.88 58.02 1i48 h LEU 371 Cb 0.27 0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.03 1i48 h LEU 371 CO -0.61 0.03 -0.37 0.74 -0.00 0.00 0.00 178.44 178.23 1i48 h THR 372 N 0.20 0.24 -0.77 0.22 2.02 -0.95 -1.31 112.91 112.56 1i48 h THR 372 Ca 0.20 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.54 1i48 h THR 372 Cb 0.24 0.24 -0.14 0.00 -1.74 0.00 0.00 68.15 66.75 1i48 h THR 372 CO -0.26 0.00 -0.15 0.74 0.37 0.00 0.00 175.52 176.22 1i48 h THR 373 N -0.99 0.24 -0.28 3.16 2.02 0.11 0.38 112.91 117.56 1i48 h THR 373 Ca -0.09 -0.01 0.06 0.00 0.77 0.00 0.00 66.41 67.14 1i48 h THR 373 Cb 0.78 0.22 -0.06 0.00 -1.74 0.00 0.00 68.15 67.35 1i48 h THR 373 CO 0.13 0.00 -0.12 0.00 0.37 0.00 0.00 175.52 175.90 1i48 h ALA 374 N 1.77 0.12 -1.12 6.16 0.00 -0.94 0.11 119.26 125.36 1i48 h ALA 374 Ca 0.38 0.11 0.31 0.00 0.00 0.00 0.00 54.91 55.71 1i48 h ALA 374 Cb 0.61 0.30 -0.08 0.00 0.00 0.00 0.00 17.79 18.63 1i48 h ALA 374 CO -0.77 -0.52 0.76 -0.22 0.00 0.00 0.00 179.25 178.50 1i48 h LYS 375 N -0.07 0.19 0.43 0.00 3.64 0.91 0.50 116.57 122.18 1i48 h LYS 375 Ca 0.15 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1i48 h LYS 375 Cb 0.29 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1i48 h LYS 375 CO -0.33 0.13 -0.21 0.35 -2.27 0.00 0.00 179.45 177.12 1i48 h PHE 376 N 0.20 -0.54 -0.96 1.91 3.57 -0.04 -2.13 116.94 118.95 1i48 h PHE 376 Ca 0.59 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 62.25 1i48 h PHE 376 Cb 1.91 0.18 -0.09 0.00 2.79 0.00 0.00 35.95 40.74 1i48 h PHE 376 CO -0.00 -0.33 0.61 -0.39 -2.23 0.00 0.00 178.31 175.96 1i48 h VAL 377 N -0.72 0.77 -0.14 1.41 -1.51 -1.06 0.40 116.25 115.39 1i48 h VAL 377 Ca -0.06 -0.24 -0.00 0.00 -1.23 0.00 0.00 66.70 65.16 1i48 h VAL 377 Cb 0.44 -0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 29.59 1i48 h VAL 377 CO 0.10 0.13 0.06 0.44 -1.23 0.00 0.00 177.57 177.07 1i48 h ASP 378 N 0.71 0.17 0.29 4.19 3.32 -0.89 -2.06 116.42 122.14 1i48 h ASP 378 Ca 0.51 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.40 1i48 h ASP 378 Cb 0.84 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 1i48 h ASP 378 CO -0.27 0.15 -0.62 0.00 -1.72 0.00 0.00 179.24 176.78 1i48 h ALA 379 N 1.88 0.77 -2.56 3.45 0.00 0.50 -3.45 119.26 119.86 1i48 h ALA 379 Ca 0.05 -0.55 -0.58 0.00 0.00 0.00 0.00 54.91 53.83 1i48 h ALA 379 Cb 0.03 -0.08 0.15 0.00 0.00 0.00 0.00 17.79 17.89 1i48 h ALA 379 CO -0.01 0.73 -0.02 1.28 0.00 0.00 0.00 179.25 181.23 1i48 n LEU 380 N -3.88 2.38 0.00 0.00 4.77 -0.78 -4.81 117.00 114.69 1i48 n LEU 380 Ca -0.03 0.87 0.00 0.00 -0.03 0.00 0.00 56.01 56.83 1i48 n LEU 380 Cb 0.63 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 1i48 n LEU 380 CO 0.46 -2.08 -0.25 0.29 -1.33 0.00 0.00 177.39 174.47 1i48 n LYS 381 N -0.28 3.32 -0.10 3.23 5.02 -1.26 -4.89 118.16 123.21 1i48 n LYS 381 Ca 0.12 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.26 1i48 n LYS 381 Cb 0.44 -0.74 -0.05 0.00 -0.02 0.00 0.00 35.03 34.65 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 -1.22 1.50 -2.13 -0.18 5.41 -1.26 -4.98 119.36 116.50 1i48 n ILE 382 Ca 0.00 0.01 -0.37 0.00 1.00 0.00 0.00 62.75 63.39 1i48 n ILE 382 Cb 0.00 -2.22 0.01 0.00 -0.71 0.00 0.00 39.64 36.72 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 -2.69 3.44 0.20 0.38 0.04 -1.26 -4.75 135.00 130.36 1i48 s PRO 383 Ca -0.30 1.84 -0.14 0.00 0.04 0.00 0.00 61.00 62.44 1i48 s PRO 383 Cb 0.07 -2.22 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 1i48 s PRO 383 CO 0.43 -0.83 0.60 0.71 0.04 0.00 0.00 177.00 177.95 1i48 s TYR 384 N -1.55 3.54 -0.52 0.56 2.02 -0.29 -4.77 117.35 116.35 1i48 s TYR 384 Ca 0.69 1.09 -0.22 0.00 -0.37 0.00 0.00 57.07 58.27 1i48 s TYR 384 Cb -0.30 -2.41 0.05 0.00 -0.40 0.00 0.00 41.96 38.90 1i48 s TYR 384 CO 0.35 0.34 0.77 0.42 -1.57 0.00 0.00 175.55 175.86 1i48 s ILE 385 N -1.62 4.66 -0.05 2.71 1.01 -1.26 -1.14 121.20 125.51 1i48 s ILE 385 Ca 0.43 -0.08 -0.31 0.00 0.00 0.00 0.00 60.65 60.69 1i48 s ILE 385 Cb -0.14 -4.39 0.12 0.00 0.01 0.00 0.00 42.46 38.06 1i48 s ILE 385 CO 0.20 -0.91 1.23 0.00 0.00 0.00 0.00 174.94 175.45 1i48 s ALA 386 N 3.23 -2.14 1.00 9.38 0.00 -0.93 -4.98 121.76 127.32 1i48 s ALA 386 Ca 0.23 0.90 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1i48 s ALA 386 Cb -0.16 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1i48 s ALA 386 CO 0.16 -0.92 0.00 -2.30 0.00 0.00 0.00 175.76 172.70 1i48 n PRO 387 N -0.37 2.32 -1.04 0.00 -0.02 -1.26 -4.51 135.00 130.12 1i48 n PRO 387 Ca -0.06 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.54 1i48 n PRO 387 Cb 0.61 0.00 -0.04 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 -5.62 0.00 2.55 2.88 -1.26 -4.95 113.62 107.22 1i48 n SER 388 Ca 0.00 0.53 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1i48 n SER 388 Cb 0.00 -3.32 0.00 0.00 -0.75 0.00 0.00 64.21 60.14 1i48 n SER 388 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 1i48 n PHE 389 N -3.23 0.00 -0.20 0.66 1.16 -1.26 -4.95 117.46 109.63 1i48 n PHE 389 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.57 1i48 n PHE 389 Cb 0.62 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.49 1i48 n PHE 389 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1i48 n GLY 390 N -0.01 0.64 3.93 4.97 0.00 -1.26 -4.19 105.19 109.27 1i48 n GLY 390 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.38 1.53 0.41 -0.02 0.00 -1.25 -4.21 107.32 102.40 1i48 s GLY 391 Ca 0.00 -0.82 0.17 0.00 0.00 0.00 0.00 44.72 44.07 1i48 s GLY 391 CO 0.00 -0.63 1.84 0.00 0.00 0.00 0.00 173.10 174.30 1i48 s GLU 393 N -5.47 4.63 0.51 0.00 8.01 -1.26 0.81 118.70 125.94 1i48 s GLU 393 Ca -0.08 1.31 -0.18 0.00 0.01 0.00 0.00 54.97 56.03 1i48 s GLU 393 Cb 0.23 -3.02 -0.08 0.00 -4.31 0.00 0.00 34.13 26.95 1i48 s GLU 393 CO 0.79 0.41 1.00 -1.12 0.01 0.00 0.00 175.26 176.34 1i48 s SER 394 N -1.42 6.51 -0.03 -0.19 0.01 -1.26 -4.31 113.70 113.01 1i48 s SER 394 Ca 0.44 1.67 -0.04 0.00 1.31 0.00 0.00 55.95 59.33 1i48 s SER 394 Cb -0.21 -2.52 0.01 0.00 0.21 0.00 0.00 66.02 63.50 1i48 s SER 394 CO 0.26 -0.66 0.09 -0.63 0.41 0.00 0.00 173.24 172.71 1i48 s ILE 395 N -2.46 0.02 0.14 1.44 1.01 -0.23 -1.14 121.20 119.98 1i48 s ILE 395 Ca 0.61 -0.13 0.05 0.00 0.00 0.00 0.00 60.65 61.17 1i48 s ILE 395 Cb -0.11 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.13 1i48 s ILE 395 CO 0.28 -0.07 -0.11 0.68 0.00 0.00 0.00 174.94 175.72 1i48 s VAL 396 N -0.20 1.20 -0.02 2.92 -7.23 -0.29 0.32 120.40 117.10 1i48 s VAL 396 Ca -0.03 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 57.84 1i48 s VAL 396 Cb -0.02 -1.80 0.10 0.00 0.56 0.00 0.00 36.38 35.22 1i48 s VAL 396 CO 0.00 -0.70 0.89 1.51 -0.31 0.00 0.00 175.10 176.50 1i48 s ASP 397 N -3.07 -0.36 -0.78 4.85 -4.77 -1.04 -2.20 116.67 109.30 1i48 s ASP 397 Ca 0.16 0.02 0.03 0.00 -3.30 0.00 0.00 52.55 49.45 1i48 s ASP 397 Cb 0.01 0.38 0.21 0.00 -1.09 0.00 0.00 42.92 42.43 1i48 s ASP 397 CO 0.01 -0.60 0.70 1.67 0.70 0.00 0.00 175.17 177.64 1i48 n GLN 398 N -0.19 2.39 -0.06 2.11 7.27 -1.26 -2.19 117.38 125.45 1i48 n GLN 398 Ca -0.09 -4.53 0.01 0.00 0.07 0.00 0.00 57.00 52.46 1i48 n GLN 398 Cb 0.62 -2.34 0.02 0.00 2.41 0.00 0.00 30.24 30.95 1i48 n GLN 398 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 1i48 n PRO 399 N 1.81 -0.02 -0.35 3.69 -0.02 -1.26 0.24 135.00 139.10 1i48 n PRO 399 Ca 0.23 0.26 0.27 0.00 -2.02 0.00 0.00 63.50 62.23 1i48 n PRO 399 Cb 0.37 -0.38 0.52 0.00 -0.02 0.00 0.00 33.50 33.98 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 0.32 2.10 0.00 3.55 0.00 -1.85 -0.96 119.26 122.42 1i48 h ALA 400 Ca 0.08 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1i48 h ALA 400 Cb 0.12 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1i48 h ALA 400 CO -0.17 -0.73 -0.74 -0.89 0.00 0.00 0.00 179.25 176.72 1i48 n ILE 401 N -5.02 1.13 -0.24 0.00 5.41 0.65 -0.65 119.36 120.63 1i48 n ILE 401 Ca 0.33 0.23 0.09 0.00 1.00 0.00 0.00 62.75 64.40 1i48 n ILE 401 Cb 1.08 -2.13 0.17 0.00 -0.71 0.00 0.00 39.64 38.06 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 -3.96 -0.06 -0.44 0.38 1.56 -0.56 -2.90 117.12 111.14 1i48 n MET 402 Ca -0.10 1.05 0.00 0.00 -0.27 0.00 0.00 57.70 58.38 1i48 n MET 402 Cb 0.39 -1.65 0.00 0.00 2.15 0.00 0.00 33.22 34.11 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 -5.00 0.00 0.00 6.12 3.41 -0.48 -4.86 113.62 112.82 1i48 n SER 403 Ca 0.15 -1.66 0.00 0.00 -0.26 0.00 0.00 58.87 57.10 1i48 n SER 403 Cb 0.48 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 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 0.30 7.33 4.02 -0.54 -4.80 117.16 123.46 1i48 n TYR 404 Ca 0.00 -0.01 0.16 0.00 -0.01 0.00 0.00 57.90 58.03 1i48 n TYR 404 Cb 0.63 -0.00 0.93 0.00 -0.02 0.00 0.00 39.34 40.88 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 -0.75 -0.17 115.95 114.31 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 0.02 0.00 -0.40 -0.00 0.00 0.00 178.44 178.06 1i48 n ASP 406 N -3.70 0.48 -4.97 2.65 5.75 -1.26 -4.75 116.55 110.75 1i48 n ASP 406 Ca -0.03 0.63 -0.19 0.00 -0.01 0.00 0.00 54.79 55.20 1i48 n ASP 406 Cb 0.11 -0.73 -0.01 0.00 -1.03 0.00 0.00 41.12 39.47 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 -4.09 3.72 0.41 -2.12 1.43 -0.08 -5.11 118.68 112.86 1i48 s LEU 407 Ca 0.04 -0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 52.59 1i48 s LEU 407 Cb 0.09 -2.56 -0.09 0.00 0.03 0.00 0.00 46.19 43.66 1i48 s LEU 407 CO 0.33 -0.59 0.85 -0.94 0.23 0.00 0.00 176.35 176.24 1i48 s SER 408 N -4.22 6.71 0.41 2.29 1.04 -1.26 -4.85 113.70 113.81 1i48 s SER 408 Ca 0.49 1.41 0.22 0.00 0.48 0.00 0.00 55.95 58.55 1i48 s SER 408 Cb -0.08 -2.43 1.21 0.00 0.10 0.00 0.00 66.02 64.81 1i48 s SER 408 CO 0.31 -0.38 1.72 -0.61 0.98 0.00 0.00 173.24 175.26 1i48 h GLN 409 N 1.60 0.28 0.23 4.02 5.75 -1.96 0.28 115.11 125.32 1i48 h GLN 409 Ca -0.48 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 57.99 1i48 h GLN 409 Cb 1.18 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.67 1i48 h GLN 409 CO 0.63 0.18 -0.11 0.77 -2.65 0.00 0.00 178.83 177.65 1i48 h SER 410 N 0.29 -0.27 -0.54 -0.69 0.02 -1.99 -3.18 113.55 107.20 1i48 h SER 410 Ca 0.67 -0.10 0.16 0.00 -0.84 0.00 0.00 61.79 61.68 1i48 h SER 410 Cb 1.86 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 64.45 1i48 h SER 410 CO -0.35 0.23 0.41 0.44 -1.14 0.00 0.00 176.83 176.42 1i48 h ASP 411 N -1.05 0.00 -0.12 3.07 3.32 -1.71 -0.43 116.42 119.51 1i48 h ASP 411 Ca -0.03 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1i48 h ASP 411 Cb 0.35 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1i48 h ASP 411 CO 0.05 0.00 0.06 0.03 -1.72 0.00 0.00 179.24 177.67 1i48 h ARG 412 N 0.00 0.16 0.00 3.56 3.08 -0.53 -2.01 114.38 118.65 1i48 h ARG 412 Ca 0.25 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 1i48 h ARG 412 Cb 1.08 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 1i48 h ARG 412 CO -0.00 0.19 -0.01 0.00 -1.07 0.00 0.00 179.97 179.08 1i48 h ALA 413 N 0.97 1.08 0.00 0.04 0.00 -1.05 -1.88 119.26 118.42 1i48 h ALA 413 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1i48 h ALA 413 Cb 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1i48 h ALA 413 CO -0.01 0.01 0.17 -0.22 0.00 0.00 0.00 179.25 179.20 1i48 h LYS 414 N 0.00 0.00 -0.02 0.00 3.64 -1.16 -0.19 116.57 118.84 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 0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 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 -2.87 0.03 -0.30 1.91 4.01 -0.72 -4.97 117.16 114.24 1i48 n TYR 415 Ca -0.02 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 1i48 n TYR 415 Cb 0.22 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 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 -0.22 1.45 3.55 2.72 0.00 -0.08 -4.97 105.19 107.64 1i48 n GLY 416 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1i48 n GLY 416 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i48 s ILE 417 N -2.96 3.25 0.08 -0.61 -1.09 -1.16 -4.94 121.20 113.76 1i48 s ILE 417 Ca 0.00 0.12 -0.05 0.00 -2.23 0.00 0.00 60.65 58.49 1i48 s ILE 417 Cb 0.00 -3.66 -0.05 0.00 -1.58 0.00 0.00 42.46 37.17 1i48 s ILE 417 CO 0.00 -0.64 0.32 -0.04 -1.23 0.00 0.00 174.94 173.35 1i48 s MET 418 N 7.43 3.60 0.00 2.79 -1.94 -1.26 -3.97 119.30 125.95 1i48 s MET 418 Ca 0.76 -0.09 0.02 0.00 -1.71 0.00 0.00 55.69 54.68 1i48 s MET 418 Cb -0.14 -2.97 0.12 0.00 2.01 0.00 0.00 34.83 33.85 1i48 s MET 418 CO 0.21 0.56 0.98 -0.25 -0.01 0.00 0.00 175.02 176.51 1i48 n ASP 419 N 0.56 0.00 -0.04 3.03 9.92 -1.26 -1.22 116.55 127.54 1i48 n ASP 419 Ca -0.06 0.37 -0.11 0.00 -0.53 0.00 0.00 54.79 54.46 1i48 n ASP 419 Cb 0.52 -0.39 -0.09 0.00 -0.64 0.00 0.00 41.12 40.51 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 -0.03 -1.48 -2.24 -0.00 -1.89 -3.37 115.58 106.56 1i48 h ASN 420 Ca 0.00 -0.66 -0.66 0.00 -0.00 0.00 0.00 56.30 54.98 1i48 h ASN 420 Cb 0.03 0.01 0.10 0.00 -0.00 0.00 0.00 38.32 38.46 1i48 h ASN 420 CO 0.00 0.76 -0.21 -0.11 -0.00 0.00 0.00 177.43 177.87 1i48 n LEU 421 N -4.71 -0.02 -3.74 0.34 7.94 -0.35 -3.19 117.00 113.26 1i48 n LEU 421 Ca -0.08 1.15 -0.15 0.00 -1.11 0.00 0.00 56.01 55.82 1i48 n LEU 421 Cb 0.33 -1.06 -0.16 0.00 0.53 0.00 0.00 43.42 43.06 1i48 n LEU 421 CO 0.26 -2.28 -0.30 -0.69 -1.11 0.00 0.00 177.39 173.27 1i48 s VAL 422 N -0.81 -0.08 -0.12 1.96 1.01 0.15 -4.44 120.40 118.07 1i48 s VAL 422 Ca 0.67 0.24 -0.07 0.00 0.00 0.00 0.00 61.98 62.82 1i48 s VAL 422 Cb -0.90 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1i48 s VAL 422 CO 0.57 0.10 0.14 -0.13 0.00 0.00 0.00 175.10 175.78 1i48 s ARG 423 N 1.34 3.44 -0.19 2.72 0.52 -0.93 -0.73 118.95 125.12 1i48 s ARG 423 Ca -0.06 -0.13 -0.03 0.00 -0.52 0.00 0.00 55.73 54.99 1i48 s ARG 423 Cb -0.12 -3.19 0.06 0.00 0.52 0.00 0.00 34.95 32.22 1i48 s ARG 423 CO -0.04 0.78 0.04 0.12 0.02 0.00 0.00 175.30 176.21 1i48 s PHE 424 N -1.02 0.98 -0.67 -0.53 2.19 0.36 -2.49 117.98 116.79 1i48 s PHE 424 Ca 0.15 -0.82 -0.20 0.00 0.33 0.00 0.00 56.93 56.39 1i48 s PHE 424 Cb -0.12 -1.01 0.10 0.00 -1.31 0.00 0.00 43.02 40.68 1i48 s PHE 424 CO 0.04 -0.60 0.86 0.45 1.83 0.00 0.00 175.22 177.80 1i48 s SER 425 N 1.87 6.25 0.05 6.13 0.15 0.15 -1.61 113.70 126.71 1i48 s SER 425 Ca -0.01 -1.39 -0.30 0.00 0.70 0.00 0.00 55.95 54.95 1i48 s SER 425 Cb -0.17 -2.36 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 1i48 s SER 425 CO -0.08 -1.22 1.74 -0.36 1.20 0.00 0.00 173.24 174.52 1i48 s PHE 426 N 3.13 2.11 0.00 3.44 0.08 -0.25 -1.07 117.98 125.42 1i48 s PHE 426 Ca 0.18 0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.34 1i48 s PHE 426 Cb -0.18 -4.04 0.00 0.00 -0.57 0.00 0.00 43.02 38.22 1i48 s PHE 426 CO 0.05 -4.33 0.00 0.41 -0.10 0.00 0.00 175.22 171.25 1i48 n GLY 427 N 4.15 -1.15 0.67 4.36 0.00 -1.26 -4.84 105.19 107.12 1i48 n GLY 427 Ca 0.17 -1.39 0.07 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.19 0.61 -0.41 1.61 3.14 0.24 -4.69 118.33 118.64 1i48 n VAL 428 Ca 0.00 -0.80 -0.29 0.00 -2.96 0.00 0.00 64.34 60.29 1i48 n VAL 428 Cb 0.00 0.81 0.26 0.00 -1.06 0.00 0.00 33.84 33.85 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 0.73 -3.28 -2.40 1.45 4.71 -1.25 -4.91 120.64 115.69 1i48 n GLU 429 Ca 0.11 -0.95 -0.41 0.00 -0.01 0.00 0.00 57.16 55.90 1i48 n GLU 429 Cb 0.41 -1.98 -0.04 0.00 -1.01 0.00 0.00 31.44 28.82 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 -2.52 7.12 0.03 1.62 2.15 -1.26 -4.93 116.67 118.88 1i48 s ASP 430 Ca 0.65 2.21 -0.08 0.00 0.43 0.00 0.00 52.55 55.76 1i48 s ASP 430 Cb -0.19 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 39.80 1i48 s ASP 430 CO 0.61 -0.35 1.13 0.15 -0.17 0.00 0.00 175.17 176.55 1i48 h PHE 431 N 5.19 -0.42 -0.88 -5.34 3.04 -1.99 -1.36 116.94 115.19 1i48 h PHE 431 Ca -0.45 0.02 0.17 0.00 3.98 0.00 0.00 57.97 61.69 1i48 h PHE 431 Cb 1.21 0.20 -0.16 0.00 2.56 0.00 0.00 35.95 39.76 1i48 h PHE 431 CO 0.62 -0.12 -0.25 -0.44 -2.02 0.00 0.00 178.31 176.10 1i48 h ASP 432 N -0.09 -0.93 -0.59 0.41 3.32 -1.98 0.55 116.42 117.11 1i48 h ASP 432 Ca 0.02 0.27 0.10 0.00 0.02 0.00 0.00 57.03 57.44 1i48 h ASP 432 Cb 0.14 0.58 -0.08 0.00 0.22 0.00 0.00 39.33 40.19 1i48 h ASP 432 CO -0.15 -0.29 0.18 0.44 -1.72 0.00 0.00 179.24 177.70 1i48 h ASP 433 N -0.01 0.14 0.36 6.45 3.32 -1.79 0.15 116.42 125.03 1i48 h ASP 433 Ca 0.40 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.52 1i48 h ASP 433 Cb 0.64 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1i48 h ASP 433 CO -0.91 0.08 -0.17 -0.07 -1.72 0.00 0.00 179.24 176.46 1i48 h LEU 434 N 0.34 -0.40 -0.31 1.55 3.38 0.85 -2.73 115.31 117.99 1i48 h LEU 434 Ca 0.30 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.18 1i48 h LEU 434 Cb 0.40 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.17 1i48 h LEU 434 CO -0.33 0.01 -0.41 0.50 0.09 0.00 0.00 178.44 178.30 1i48 h LYS 435 N -0.91 -0.36 -0.71 1.13 3.64 0.08 0.54 116.57 119.99 1i48 h LYS 435 Ca -0.05 0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.51 1i48 h LYS 435 Cb 0.53 0.08 -0.13 0.00 -0.41 0.00 0.00 32.23 32.31 1i48 h LYS 435 CO 0.08 -0.24 -0.03 0.00 -2.27 0.00 0.00 179.45 176.99 1i48 h ALA 436 N 0.37 0.68 0.56 5.00 0.00 -0.77 0.11 119.26 125.21 1i48 h ALA 436 Ca 0.12 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1i48 h ALA 436 Cb 0.59 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1i48 h ALA 436 CO -0.51 -0.42 -0.32 0.22 0.00 0.00 0.00 179.25 178.22 1i48 h ASP 437 N 0.09 -0.80 -0.15 0.00 3.58 -0.73 0.10 116.42 118.51 1i48 h ASP 437 Ca 0.38 0.04 0.05 0.00 0.42 0.00 0.00 57.03 57.92 1i48 h ASP 437 Cb 0.64 0.23 -0.07 0.00 1.72 0.00 0.00 39.33 41.86 1i48 h ASP 437 CO -0.64 -0.52 -0.34 0.40 -2.88 0.00 0.00 179.24 175.26 1i48 h ILE 438 N -0.83 0.26 0.21 2.25 2.04 0.06 0.23 117.51 121.73 1i48 h ILE 438 Ca -0.07 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.80 1i48 h ILE 438 Cb 0.67 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1i48 h ILE 438 CO 0.08 0.00 -0.36 -0.07 0.00 0.00 0.00 178.15 177.80 1i48 h LEU 439 N -0.40 -1.02 -1.14 1.44 3.38 -0.73 0.14 115.31 116.97 1i48 h LEU 439 Ca 0.10 0.11 0.17 0.00 0.09 0.00 0.00 57.88 58.34 1i48 h LEU 439 Cb 0.56 0.37 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 1i48 h LEU 439 CO -0.37 -0.46 0.61 -0.61 0.09 0.00 0.00 178.44 177.69 1i48 h GLN 440 N -0.65 0.72 0.00 1.13 -0.00 -0.47 0.53 115.11 116.37 1i48 h GLN 440 Ca 0.01 -0.04 -0.08 0.00 -0.00 0.00 0.00 58.65 58.54 1i48 h GLN 440 Cb 0.64 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.95 1i48 h GLN 440 CO -0.15 0.48 -0.37 0.00 0.00 0.00 0.00 178.83 178.78 1i48 h ALA 441 N 1.61 1.37 -0.15 3.38 0.00 0.60 -2.33 119.26 123.74 1i48 h ALA 441 Ca 0.52 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1i48 h ALA 441 Cb 0.84 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1i48 h ALA 441 CO -0.29 0.46 0.00 1.28 0.00 0.00 0.00 179.25 180.70 1i48 n LEU 442 N -4.08 0.91 -0.09 0.00 4.77 0.18 -3.48 117.00 115.22 1i48 n LEU 442 Ca -0.02 -0.44 -0.09 0.00 -0.03 0.00 0.00 56.01 55.43 1i48 n LEU 442 Cb 0.41 -0.10 -0.16 0.00 -2.33 0.00 0.00 43.42 41.24 1i48 n LEU 442 CO 0.39 0.22 -1.11 0.47 -1.33 0.00 0.00 177.39 176.02 1i48 n ASP 443 N -0.05 0.05 0.00 -1.43 9.92 -0.88 -4.36 116.55 119.80 1i48 n ASP 443 Ca 0.08 0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.37 1i48 n ASP 443 Cb 0.16 0.96 0.00 0.00 -0.64 0.00 0.00 41.12 41.60 1i48 n ASP 443 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1i48 n SER 444 N -2.76 0.00 -0.21 -2.24 7.64 -1.23 -5.14 113.62 109.69 1i48 n SER 444 Ca -0.31 0.27 0.03 0.00 1.01 0.00 0.00 58.87 59.86 1i48 n SER 444 Cb 1.14 -0.27 0.02 0.00 -1.01 0.00 0.00 64.21 64.09 1i48 n SER 444 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65