#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iv7 s SER 4 N 0.00 4.78 0.04 0.53 1.04 -1.26 -5.07 113.70 113.76 3iv7 s SER 4 Ca 0.00 -0.70 -0.37 0.00 0.48 0.00 0.00 55.95 55.36 3iv7 s SER 4 Cb 0.00 -0.80 -0.16 0.00 0.10 0.00 0.00 66.02 65.16 3iv7 s SER 4 CO 0.00 -0.27 1.46 -0.11 0.98 0.00 0.00 173.24 175.30 3iv7 n LEU 5 N -1.16 2.09 -3.71 2.42 7.94 -1.26 -4.99 117.00 118.33 3iv7 n LEU 5 Ca -0.03 1.10 -0.11 0.00 -1.11 0.00 0.00 56.01 55.85 3iv7 n LEU 5 Cb 0.61 -1.23 -0.12 0.00 0.53 0.00 0.00 43.42 43.21 3iv7 n LEU 5 CO 0.43 -0.78 -0.01 0.00 -1.11 0.00 0.00 177.39 175.92 3iv7 s ALA 6 N 1.14 -0.87 0.04 1.96 0.00 -1.26 -5.16 121.76 117.60 3iv7 s ALA 6 Ca 0.86 1.31 -0.28 0.00 0.00 0.00 0.00 51.96 53.85 3iv7 s ALA 6 Cb -0.91 -0.80 0.09 0.00 0.00 0.00 0.00 23.12 21.50 3iv7 s ALA 6 CO 0.48 -0.23 0.94 -0.59 0.00 0.00 0.00 175.76 176.35 3iv7 s PHE 7 N 1.25 -0.26 -0.15 0.00 -0.71 -1.26 -5.04 117.98 111.81 3iv7 s PHE 7 Ca -0.09 0.07 -0.01 0.00 -1.04 0.00 0.00 56.93 55.86 3iv7 s PHE 7 Cb -0.09 0.57 0.04 0.00 -1.21 0.00 0.00 43.02 42.34 3iv7 s PHE 7 CO -0.10 -0.61 -0.01 1.21 -1.34 0.00 0.00 175.22 174.37 3iv7 s ASN 8 N -2.64 2.56 -0.04 1.98 3.84 -1.26 -5.13 114.94 114.25 3iv7 s ASN 8 Ca 0.08 -0.58 0.06 0.00 0.21 0.00 0.00 52.86 52.63 3iv7 s ASN 8 Cb -0.01 -0.70 -0.02 0.00 -0.55 0.00 0.00 41.25 39.97 3iv7 s ASN 8 CO -0.05 -0.23 -0.22 -2.28 -2.79 0.00 0.00 177.10 171.53 3iv7 s HIS 9 N 1.79 2.46 -0.22 0.43 5.65 -1.26 -5.04 115.29 119.10 3iv7 s HIS 9 Ca 0.01 -0.42 -0.03 0.00 0.25 0.00 0.00 55.06 54.88 3iv7 s HIS 9 Cb -0.15 -1.56 0.00 0.00 -1.18 0.00 0.00 32.58 29.69 3iv7 s HIS 9 CO -0.07 -0.01 -0.07 -0.51 -0.65 0.00 0.00 174.74 173.42 3iv7 s ASP 10 N -0.54 4.09 -0.25 9.88 1.01 -1.26 -5.09 116.67 124.51 3iv7 s ASP 10 Ca 0.08 -0.50 -0.11 0.00 0.71 0.00 0.00 52.55 52.73 3iv7 s ASP 10 Cb -0.11 -1.68 -0.05 0.00 1.01 0.00 0.00 42.92 42.09 3iv7 s ASP 10 CO 0.00 -0.03 0.16 -0.89 0.21 0.00 0.00 175.17 174.63 3iv7 s THR 11 N 1.43 5.34 0.14 -1.27 2.01 -1.26 -4.88 115.64 117.15 3iv7 s THR 11 Ca 0.05 0.17 -0.17 0.00 0.31 0.00 0.00 61.69 62.06 3iv7 s THR 11 Cb -0.14 -3.50 -0.07 0.00 0.01 0.00 0.00 72.50 68.80 3iv7 s THR 11 CO -0.05 0.33 0.58 -0.76 -0.69 0.00 0.00 174.62 174.03 3iv7 s LEU 12 N 1.18 4.39 0.15 4.42 1.43 -1.26 -5.04 118.68 123.95 3iv7 s LEU 12 Ca 0.07 1.19 -0.30 0.00 -1.03 0.00 0.00 54.13 54.06 3iv7 s LEU 12 Cb -0.14 -3.21 -0.08 0.00 0.03 0.00 0.00 46.19 42.79 3iv7 s LEU 12 CO 0.06 0.14 1.24 -2.16 0.23 0.00 0.00 176.35 175.86 3iv7 s PRO 13 N -1.72 4.44 -0.23 1.29 0.04 -1.26 -5.02 135.00 132.54 3iv7 s PRO 13 Ca 0.36 1.90 -0.27 0.00 0.04 0.00 0.00 61.00 63.04 3iv7 s PRO 13 Cb -0.17 -3.26 0.11 0.00 0.04 0.00 0.00 34.50 31.22 3iv7 s PRO 13 CO 0.19 -0.21 0.94 -1.14 0.04 0.00 0.00 177.00 176.83 3iv7 s GLN 14 N 0.30 0.63 -0.14 4.56 0.74 -1.26 -4.85 119.66 119.64 3iv7 s GLN 14 Ca 0.57 0.53 -0.07 0.00 0.05 0.00 0.00 55.36 56.43 3iv7 s GLN 14 Cb -0.33 0.30 -0.04 0.00 1.10 0.00 0.00 33.01 34.04 3iv7 s GLN 14 CO 0.34 -0.12 0.11 0.21 -0.55 0.00 0.00 175.29 175.28 3iv7 s LYS 15 N -0.19 3.59 0.41 1.67 2.20 0.12 -5.01 119.74 122.54 3iv7 s LYS 15 Ca 0.00 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.42 3iv7 s LYS 15 Cb -0.03 -3.19 -0.00 0.00 -1.51 0.00 0.00 37.83 33.09 3iv7 s LYS 15 CO -0.02 0.62 0.05 0.28 -0.36 0.00 0.00 175.35 175.92 3iv7 n VAL 16 N 2.46 0.00 0.00 4.02 0.31 -1.26 -0.45 118.33 123.41 3iv7 n VAL 16 Ca -0.19 -2.09 0.00 0.00 -0.01 0.00 0.00 64.34 62.06 3iv7 n VAL 16 Cb 0.54 0.54 0.00 0.00 -0.91 0.00 0.00 33.84 34.01 3iv7 n VAL 16 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 3iv7 n PHE 18 N -0.99 0.00 0.00 3.52 -0.00 -1.26 -4.97 117.46 113.75 3iv7 n PHE 18 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.31 3iv7 n PHE 18 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.03 3iv7 n PHE 18 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3iv7 n GLY 19 N 0.00 2.18 3.72 7.13 0.00 -0.07 -4.99 105.19 113.15 3iv7 n GLY 19 Ca 0.00 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3iv7 n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3iv7 s TYR 20 N -0.32 2.92 0.00 1.61 6.14 -1.26 -2.24 117.35 124.20 3iv7 s TYR 20 Ca 0.00 0.45 0.00 0.00 0.64 0.00 0.00 57.07 58.16 3iv7 s TYR 20 Cb 0.00 -4.04 0.00 0.00 0.42 0.00 0.00 41.96 38.34 3iv7 s TYR 20 CO 0.00 -3.93 0.00 0.41 0.64 0.00 0.00 175.55 172.67 3iv7 n GLY 21 N 3.89 0.54 0.94 8.97 0.00 -1.26 -4.90 105.19 113.38 3iv7 n GLY 21 Ca 0.15 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 3iv7 n GLY 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iv7 n LYS 22 N -1.98 2.36 -0.16 1.61 4.76 -0.95 -4.65 118.16 119.15 3iv7 n LYS 22 Ca 0.00 -2.12 -0.09 0.00 -2.87 0.00 0.00 58.31 53.23 3iv7 n LYS 22 Cb 0.07 -1.41 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 3iv7 n LYS 22 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 3iv7 h SER 23 N 3.42 0.64 -0.16 4.39 4.64 -1.91 0.29 113.55 124.86 3iv7 h SER 23 Ca 0.00 -0.18 -0.10 0.00 -0.47 0.00 0.00 61.79 61.04 3iv7 h SER 23 Cb 0.84 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 3iv7 h SER 23 CO 0.00 0.65 -0.23 0.77 -0.87 0.00 0.00 176.83 177.14 3iv7 h SER 24 N 0.59 0.61 -0.06 4.97 4.64 -1.83 0.28 113.55 122.76 3iv7 h SER 24 Ca 0.15 -0.21 -0.17 0.00 -0.47 0.00 0.00 61.79 61.09 3iv7 h SER 24 Cb 0.22 -0.17 0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3iv7 h SER 24 CO -0.01 0.84 -0.63 0.00 -0.87 0.00 0.00 176.83 176.15 3iv7 h ALA 25 N 1.21 0.16 -0.66 5.18 0.00 -1.78 -2.06 119.26 121.32 3iv7 h ALA 25 Ca 0.08 -0.56 0.05 0.00 0.00 0.00 0.00 54.91 54.48 3iv7 h ALA 25 Cb 0.69 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 3iv7 h ALA 25 CO 0.05 0.44 0.38 0.74 0.00 0.00 0.00 179.25 180.87 3iv7 h PHE 26 N 0.13 0.70 -0.55 0.00 0.04 -0.25 -1.76 116.94 115.25 3iv7 h PHE 26 Ca -0.06 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.68 3iv7 h PHE 26 Cb 1.30 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 39.21 3iv7 h PHE 26 CO 0.12 0.36 0.15 1.25 -0.60 0.00 0.00 178.31 179.59 3iv7 h LEU 27 N 0.72 0.82 -0.44 1.54 5.85 -0.89 -0.20 115.31 122.71 3iv7 h LEU 27 Ca 0.29 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.82 3iv7 h LEU 27 Cb 0.14 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 3iv7 h LEU 27 CO -0.16 0.83 0.22 0.50 -0.34 0.00 0.00 178.44 179.49 3iv7 h LYS 28 N 0.77 0.44 -0.72 1.25 3.64 -1.22 0.35 116.57 121.08 3iv7 h LYS 28 Ca 0.17 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 3iv7 h LYS 28 Cb 0.31 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 3iv7 h LYS 28 CO -0.00 0.29 0.25 0.37 -2.27 0.00 0.00 179.45 178.09 3iv7 h GLN 29 N 0.45 1.09 -0.27 1.90 4.15 -0.85 -0.30 115.11 121.28 3iv7 h GLN 29 Ca 0.19 -0.22 -0.06 0.00 0.77 0.00 0.00 58.65 59.32 3iv7 h GLN 29 Cb 0.08 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 3iv7 h GLN 29 CO -0.12 0.92 -0.08 1.49 -1.93 0.00 0.00 178.83 179.11 3iv7 h GLU 30 N 1.04 0.53 -0.30 1.69 4.57 -0.74 0.22 114.58 121.60 3iv7 h GLU 30 Ca 0.23 -0.21 -0.08 0.00 -1.18 0.00 0.00 59.36 58.12 3iv7 h GLU 30 Cb 0.27 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 3iv7 h GLU 30 CO -0.01 0.75 -0.15 0.28 -1.18 0.00 0.00 179.01 178.70 3iv7 h VAL 31 N 0.28 1.24 0.12 0.32 2.07 -0.80 -1.00 116.25 118.49 3iv7 h VAL 31 Ca 0.07 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 3iv7 h VAL 31 Cb 0.56 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3iv7 h VAL 31 CO 0.03 0.36 -0.06 -0.33 0.02 0.00 0.00 177.57 177.59 3iv7 h GLU 32 N 0.48 -0.16 -0.99 1.57 5.08 -0.90 0.22 114.58 119.89 3iv7 h GLU 32 Ca 0.08 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.63 3iv7 h GLU 32 Cb 0.54 0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.72 3iv7 h GLU 32 CO 0.03 0.18 0.59 -0.09 -1.00 0.00 0.00 179.01 178.72 3iv7 h ARG 33 N -0.51 0.74 0.03 2.33 2.43 -0.42 -2.09 114.38 116.89 3iv7 h ARG 33 Ca -0.02 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 58.88 3iv7 h ARG 33 Cb 0.41 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 3iv7 h ARG 33 CO 0.03 0.49 -1.10 0.00 -1.51 0.00 0.00 179.97 177.87 3iv7 h ARG 34 N 0.76 0.06 -0.17 0.20 3.08 -1.12 -3.48 114.38 113.71 3iv7 h ARG 34 Ca 0.56 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.48 3iv7 h ARG 34 Cb 0.84 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 3iv7 h ARG 34 CO -0.37 1.01 -0.04 0.41 -1.07 0.00 0.00 179.97 179.91 3iv7 n GLY 35 N 1.41 0.40 3.73 0.04 0.00 0.04 -5.00 105.19 105.81 3iv7 n GLY 35 Ca -0.03 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 3iv7 n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iv7 s SER 36 N -2.95 6.61 -0.06 1.61 0.01 -1.07 -4.93 113.70 112.93 3iv7 s SER 36 Ca 0.00 2.66 0.20 0.00 1.31 0.00 0.00 55.95 60.12 3iv7 s SER 36 Cb 0.00 -2.61 -0.31 0.00 0.21 0.00 0.00 66.02 63.31 3iv7 s SER 36 CO 0.00 -0.77 0.39 0.00 0.41 0.00 0.00 173.24 173.27 3iv7 n ALA 37 N 3.03 2.54 -3.44 1.44 0.00 -1.26 -4.81 120.51 118.01 3iv7 n ALA 37 Ca 0.10 -0.65 -0.27 0.00 0.00 0.00 0.00 53.44 52.62 3iv7 n ALA 37 Cb 0.39 -0.62 -0.11 0.00 0.00 0.00 0.00 19.45 19.11 3iv7 n ALA 37 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3iv7 s LYS 38 N -3.28 0.58 0.00 0.00 3.01 -1.26 -4.92 119.74 113.88 3iv7 s LYS 38 Ca -0.08 -1.31 0.00 0.00 -1.01 0.00 0.00 55.97 53.57 3iv7 s LYS 38 Cb 0.12 -1.21 0.00 0.00 -1.01 0.00 0.00 37.83 35.73 3iv7 s LYS 38 CO 0.86 -1.22 0.00 0.28 0.51 0.00 0.00 175.35 175.78 3iv7 n VAL 39 N 3.98 0.00 -3.54 3.17 0.31 -1.26 -1.52 118.33 119.46 3iv7 n VAL 39 Ca 0.13 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.45 3iv7 n VAL 39 Cb 0.39 -1.65 -0.05 0.00 -0.91 0.00 0.00 33.84 31.62 3iv7 n VAL 39 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3iv7 s VAL 41 N 0.09 -0.48 -0.25 2.52 1.01 0.12 -0.90 120.40 122.52 3iv7 s VAL 41 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 3iv7 s VAL 41 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.38 3iv7 s VAL 41 CO 0.00 0.00 0.01 -0.63 0.00 0.00 0.00 175.10 174.48 3iv7 s ILE 42 N 2.26 3.60 -0.14 2.22 1.01 0.68 -0.24 121.20 130.59 3iv7 s ILE 42 Ca -0.06 -0.60 -0.13 0.00 0.00 0.00 0.00 60.65 59.86 3iv7 s ILE 42 Cb -0.07 -2.75 0.04 0.00 0.01 0.00 0.00 42.46 39.69 3iv7 s ILE 42 CO -0.18 0.27 0.38 0.00 0.00 0.00 0.00 174.94 175.41 3iv7 s ALA 43 N 1.48 -0.93 0.51 9.38 0.00 -0.99 -1.01 121.76 130.19 3iv7 s ALA 43 Ca 0.04 1.04 -0.23 0.00 0.00 0.00 0.00 51.96 52.82 3iv7 s ALA 43 Cb -0.16 -0.60 -0.06 0.00 0.00 0.00 0.00 23.12 22.30 3iv7 s ALA 43 CO -0.01 -0.18 1.33 0.41 0.00 0.00 0.00 175.76 177.31 3iv7 n GLY 44 N 2.81 0.70 0.32 0.00 0.00 -1.26 -3.92 105.19 103.83 3iv7 n GLY 44 Ca -0.13 0.07 0.28 0.00 0.00 0.00 0.00 46.02 46.24 3iv7 n GLY 44 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3iv7 n GLU 45 N -0.67 -0.06 0.13 1.61 2.13 -1.09 0.13 120.64 122.81 3iv7 n GLU 45 Ca 0.09 1.37 0.12 0.00 0.66 0.00 0.00 57.16 59.40 3iv7 n GLU 45 Cb 0.43 -2.40 0.25 0.00 0.27 0.00 0.00 31.44 29.99 3iv7 n GLU 45 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3iv7 h ARG 46 N 0.00 0.00 -2.95 5.31 3.08 -1.91 -3.43 114.38 114.49 3iv7 h ARG 46 Ca 0.78 0.00 -0.80 0.00 0.07 0.00 0.00 59.98 60.03 3iv7 h ARG 46 Cb 1.98 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 31.78 3iv7 h ARG 46 CO -0.79 0.00 1.08 0.39 -1.07 0.00 0.00 179.97 179.59 3iv7 n GLU 47 N -2.51 4.43 0.00 0.04 1.02 0.34 -4.89 120.64 119.06 3iv7 n GLU 47 Ca 0.04 -4.35 0.00 0.00 -0.02 0.00 0.00 57.16 52.83 3iv7 n GLU 47 Cb 0.47 -2.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.31 3iv7 n GLU 47 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3iv7 n SER 49 N 1.66 0.00 -0.00 1.62 3.41 -1.26 -2.52 113.62 116.52 3iv7 n SER 49 Ca 0.31 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.81 3iv7 n SER 49 Cb 0.33 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.21 3iv7 n SER 49 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3iv7 h ILE 50 N 0.00 1.11 -1.01 -1.33 2.04 -1.98 -2.81 117.51 113.53 3iv7 h ILE 50 Ca 0.00 -0.31 0.18 0.00 1.00 0.00 0.00 64.86 65.73 3iv7 h ILE 50 Cb 0.00 1.18 -0.10 0.00 -0.74 0.00 0.00 36.82 37.16 3iv7 h ILE 50 CO 0.00 0.09 0.62 0.00 0.00 0.00 0.00 178.15 178.86 3iv7 h ALA 51 N 0.91 1.64 -0.75 1.87 0.00 -1.85 0.12 119.26 121.20 3iv7 h ALA 51 Ca 0.02 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3iv7 h ALA 51 Cb 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3iv7 h ALA 51 CO -0.00 0.01 0.37 0.45 0.00 0.00 0.00 179.25 180.08 3iv7 h HIS 52 N 0.81 1.08 -0.22 0.00 3.86 -1.81 0.16 115.15 119.02 3iv7 h HIS 52 Ca 0.56 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.68 3iv7 h HIS 52 Cb 0.82 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 3iv7 h HIS 52 CO -0.00 0.79 -0.05 0.87 0.86 0.00 0.00 177.93 180.39 3iv7 h LYS 53 N 1.06 0.42 -0.88 2.45 1.57 -0.87 -1.53 116.57 118.79 3iv7 h LYS 53 Ca 0.26 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3iv7 h LYS 53 Cb 0.10 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 3iv7 h LYS 53 CO -0.03 0.66 0.57 0.28 -0.57 0.00 0.00 179.45 180.36 3iv7 h VAL 54 N 0.15 1.16 -0.44 0.50 2.07 -0.53 -2.24 116.25 116.92 3iv7 h VAL 54 Ca 0.06 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3iv7 h VAL 54 Cb 0.51 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 3iv7 h VAL 54 CO 0.02 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.82 3iv7 n ALA 55 N -2.35 3.16 0.26 1.67 0.00 0.52 -3.91 120.51 119.86 3iv7 n ALA 55 Ca 0.11 -1.22 0.09 0.00 0.00 0.00 0.00 53.44 52.42 3iv7 n ALA 55 Cb 0.07 -1.05 0.68 0.00 0.00 0.00 0.00 19.45 19.15 3iv7 n ALA 55 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3iv7 h SER 56 N 2.89 0.00 -0.31 0.00 4.64 -0.64 -2.62 113.55 117.50 3iv7 h SER 56 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3iv7 h SER 56 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3iv7 h SER 56 CO 0.24 0.02 0.00 -0.62 -0.87 0.00 0.00 176.83 175.60 3iv7 n GLU 57 N -4.36 2.09 -4.31 4.77 1.02 -1.26 -4.90 120.64 113.68 3iv7 n GLU 57 Ca -0.03 -1.66 -0.17 0.00 -0.02 0.00 0.00 57.16 55.28 3iv7 n GLU 57 Cb 0.11 -1.43 -0.10 0.00 -0.02 0.00 0.00 31.44 29.99 3iv7 n GLU 57 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3iv7 s ILE 58 N -1.59 1.55 -0.06 -3.67 -4.36 -0.99 -4.81 121.20 107.27 3iv7 s ILE 58 Ca 0.35 -2.14 -0.26 0.00 -0.26 0.00 0.00 60.65 58.33 3iv7 s ILE 58 Cb 0.19 -1.96 -0.03 0.00 1.25 0.00 0.00 42.46 41.92 3iv7 s ILE 58 CO 0.27 -0.63 0.83 -1.61 0.24 0.00 0.00 174.94 174.05 3iv7 s GLU 59 N -3.61 4.45 -0.15 0.37 8.01 -1.26 -5.00 118.70 121.51 3iv7 s GLU 59 Ca 0.20 1.11 -0.01 0.00 0.01 0.00 0.00 54.97 56.28 3iv7 s GLU 59 Cb -0.00 -3.48 -0.02 0.00 -4.31 0.00 0.00 34.13 26.32 3iv7 s GLU 59 CO 0.05 -0.06 -0.10 0.08 0.01 0.00 0.00 175.26 175.24 3iv7 s VAL 60 N 1.18 3.28 0.02 2.63 1.01 -1.26 -4.45 120.40 122.80 3iv7 s VAL 60 Ca 0.43 -0.57 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 3iv7 s VAL 60 Cb -0.19 -2.41 -0.32 0.00 0.00 0.00 0.00 36.38 33.47 3iv7 s VAL 60 CO 0.20 0.50 0.94 0.00 0.00 0.00 0.00 175.10 176.75 3iv7 h ALA 61 N 6.92 0.04 -3.54 5.51 0.00 -1.34 -3.47 119.26 123.37 3iv7 h ALA 61 Ca -0.29 -0.97 -0.26 0.00 0.00 0.00 0.00 54.91 53.38 3iv7 h ALA 61 Cb 1.20 0.21 -0.31 0.00 0.00 0.00 0.00 17.79 18.89 3iv7 h ALA 61 CO 0.58 0.91 -0.70 0.42 0.00 0.00 0.00 179.25 180.46 3iv7 s ILE 62 N -2.61 -0.04 -0.31 0.00 -1.09 -1.03 -5.02 121.20 111.09 3iv7 s ILE 62 Ca -0.09 0.13 -0.07 0.00 -2.23 0.00 0.00 60.65 58.39 3iv7 s ILE 62 Cb 0.06 -0.09 0.02 0.00 -1.58 0.00 0.00 42.46 40.87 3iv7 s ILE 62 CO 0.90 0.05 0.09 0.26 -1.23 0.00 0.00 174.94 175.01 3iv7 s TRP 63 N 0.69 3.18 -0.25 3.97 0.52 -1.26 0.14 118.94 125.93 3iv7 s TRP 63 Ca -0.06 -1.11 -0.02 0.00 0.02 0.00 0.00 56.10 54.93 3iv7 s TRP 63 Cb -0.08 -2.26 0.02 0.00 -1.15 0.00 0.00 33.47 30.00 3iv7 s TRP 63 CO -0.02 -0.62 -0.05 -1.58 0.02 0.00 0.00 176.95 174.69 3iv7 s HIS 64 N 1.47 3.05 -1.06 -1.98 2.46 0.66 -4.98 115.29 114.90 3iv7 s HIS 64 Ca 0.01 -1.42 0.11 0.00 0.47 0.00 0.00 55.06 54.24 3iv7 s HIS 64 Cb -0.18 -2.08 0.29 0.00 -0.13 0.00 0.00 32.58 30.49 3iv7 s HIS 64 CO 0.02 -0.69 1.21 -0.40 -2.47 0.00 0.00 174.74 172.41 3iv7 n ASP 65 N 4.70 2.84 -4.53 9.88 5.75 -1.25 -2.36 116.55 131.58 3iv7 n ASP 65 Ca -0.17 -1.93 -0.43 0.00 -0.01 0.00 0.00 54.79 52.26 3iv7 n ASP 65 Cb 0.48 -0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 40.34 3iv7 n ASP 65 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 3iv7 s GLU 66 N -1.00 3.82 -0.19 0.11 2.12 -1.26 -2.68 118.70 119.61 3iv7 s GLU 66 Ca 0.23 -1.81 -0.02 0.00 0.36 0.00 0.00 54.97 53.74 3iv7 s GLU 66 Cb 0.12 -5.27 -0.00 0.00 0.26 0.00 0.00 34.13 29.24 3iv7 s GLU 66 CO 0.17 -2.05 -0.10 0.08 -0.54 0.00 0.00 175.26 172.81 3iv7 s VAL 67 N 3.63 3.02 0.00 3.70 1.01 -1.26 -5.00 120.40 125.50 3iv7 s VAL 67 Ca 0.45 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.81 3iv7 s VAL 67 Cb -0.00 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 34.05 3iv7 s VAL 67 CO -0.02 0.47 0.00 0.52 0.00 0.00 0.00 175.10 176.07 3iv7 n VAL 68 N 4.43 0.00 0.00 2.92 0.31 -1.26 -4.85 118.33 119.87 3iv7 n VAL 68 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3iv7 n VAL 68 Cb 0.51 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 3iv7 n VAL 68 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3iv7 n HIS 70 N 0.00 0.00 -3.61 3.52 8.25 -1.26 -4.52 115.22 117.60 3iv7 n HIS 70 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.20 3iv7 n HIS 70 Cb 0.00 -0.03 0.01 0.00 1.12 0.00 0.00 29.99 31.09 3iv7 n HIS 70 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3iv7 n VAL 71 N 0.02 -4.49 -1.70 1.59 0.31 -1.26 -2.50 118.33 110.29 3iv7 n VAL 71 Ca 0.00 0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.95 3iv7 n VAL 71 Cb 0.00 -3.67 0.01 0.00 -0.91 0.00 0.00 33.84 29.27 3iv7 n VAL 71 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3iv7 n PRO 72 N -1.78 1.98 0.02 5.55 -0.02 -1.26 -2.18 135.00 137.31 3iv7 n PRO 72 Ca -0.21 0.70 0.03 0.00 -2.02 0.00 0.00 63.50 62.00 3iv7 n PRO 72 Cb 0.66 -2.39 0.40 0.00 -0.02 0.00 0.00 33.50 32.15 3iv7 n PRO 72 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3iv7 h ILE 73 N 2.16 1.13 -0.18 4.25 6.09 -1.22 0.17 117.51 129.91 3iv7 h ILE 73 Ca -0.48 -0.37 -0.12 0.00 -1.37 0.00 0.00 64.86 62.53 3iv7 h ILE 73 Cb 1.29 0.68 -0.01 0.00 0.47 0.00 0.00 36.82 39.25 3iv7 h ILE 73 CO 0.60 0.15 -0.39 -0.33 -3.07 0.00 0.00 178.15 175.11 3iv7 h GLU 74 N 0.49 0.40 -0.26 2.19 3.07 -1.90 0.42 114.58 118.99 3iv7 h GLU 74 Ca 0.13 -0.19 -0.06 0.00 -0.50 0.00 0.00 59.36 58.74 3iv7 h GLU 74 Cb 0.07 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 3iv7 h GLU 74 CO -0.02 0.73 -0.06 0.28 -1.40 0.00 0.00 179.01 178.54 3iv7 h VAL 75 N 0.33 1.28 -0.80 3.13 2.07 -1.56 -0.88 116.25 119.82 3iv7 h VAL 75 Ca 0.03 -1.06 -0.03 0.00 0.82 0.00 0.00 66.70 66.46 3iv7 h VAL 75 Cb 0.83 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 3iv7 h VAL 75 CO 0.07 0.33 0.38 0.00 0.02 0.00 0.00 177.57 178.38 3iv7 h ALA 76 N 0.77 1.17 -0.50 1.67 0.00 -0.58 -0.68 119.26 121.11 3iv7 h ALA 76 Ca 0.07 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 3iv7 h ALA 76 Cb 0.52 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3iv7 h ALA 76 CO 0.02 0.63 -0.19 0.93 0.00 0.00 0.00 179.25 180.65 3iv7 h GLU 77 N 1.14 1.01 -0.65 0.00 4.39 -0.03 -0.26 114.58 120.17 3iv7 h GLU 77 Ca 0.28 -0.42 -0.03 0.00 0.34 0.00 0.00 59.36 59.53 3iv7 h GLU 77 Cb 0.11 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 3iv7 h GLU 77 CO -0.04 1.10 0.30 0.00 -1.16 0.00 0.00 179.01 179.21 3iv7 h ARG 78 N 0.87 0.95 -0.49 2.33 3.08 -0.82 -2.17 114.38 118.12 3iv7 h ARG 78 Ca 0.12 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 3iv7 h ARG 78 Cb 0.77 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.63 3iv7 h ARG 78 CO 0.06 0.77 0.05 0.00 -1.07 0.00 0.00 179.97 179.78 3iv7 h ALA 79 N 1.13 0.66 -1.00 0.04 0.00 -0.88 -1.46 119.26 117.75 3iv7 h ALA 79 Ca 0.22 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3iv7 h ALA 79 Cb 0.14 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 3iv7 h ALA 79 CO -0.03 0.42 0.66 0.00 0.00 0.00 0.00 179.25 180.31 3iv7 h ARG 80 N 0.71 1.31 -0.46 0.00 3.08 -0.95 -1.24 114.38 116.82 3iv7 h ARG 80 Ca 0.15 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 3iv7 h ARG 80 Cb 0.44 -0.30 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 3iv7 h ARG 80 CO 0.02 0.87 0.13 0.00 -1.07 0.00 0.00 179.97 179.91 3iv7 h ALA 81 N 1.37 0.60 -0.32 0.04 0.00 -1.03 0.97 119.26 120.90 3iv7 h ALA 81 Ca 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3iv7 h ALA 81 Cb -0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3iv7 h ALA 81 CO -0.08 0.27 0.17 0.28 0.00 0.00 0.00 179.25 179.89 3iv7 h VAL 82 N 0.61 1.13 -0.30 0.00 2.07 -0.97 0.58 116.25 119.36 3iv7 h VAL 82 Ca 0.15 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.34 3iv7 h VAL 82 Cb 0.30 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3iv7 h VAL 82 CO -0.00 0.13 0.17 0.00 0.02 0.00 0.00 177.57 177.89 3iv7 h ALA 83 N 1.04 0.38 -0.17 1.67 0.00 -0.98 -1.77 119.26 119.44 3iv7 h ALA 83 Ca 0.11 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3iv7 h ALA 83 Cb 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3iv7 h ALA 83 CO -0.02 -0.20 -0.29 1.15 0.00 0.00 0.00 179.25 179.89 3iv7 h THR 84 N 0.35 1.35 0.00 0.00 2.02 -0.59 -1.64 112.91 114.41 3iv7 h THR 84 Ca 0.12 -1.53 -0.07 0.00 0.77 0.00 0.00 66.41 65.69 3iv7 h THR 84 Cb 0.01 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 3iv7 h THR 84 CO -0.06 0.46 -0.34 0.44 0.37 0.00 0.00 175.52 176.39 3iv7 h ASP 85 N 0.13 0.00 -0.57 4.18 3.32 0.18 -2.95 116.42 120.71 3iv7 h ASP 85 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3iv7 h ASP 85 Cb 0.88 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.43 3iv7 h ASP 85 CO 0.07 0.34 0.00 0.59 -1.72 0.00 0.00 179.24 178.52 3iv7 n ASN 86 N -4.10 3.14 -3.54 6.45 3.02 -0.67 -4.95 115.26 114.61 3iv7 n ASN 86 Ca -0.02 -1.99 -0.26 0.00 -0.03 0.00 0.00 54.58 52.28 3iv7 n ASN 86 Cb 0.39 -0.38 0.04 0.00 -0.61 0.00 0.00 39.78 39.21 3iv7 n ASN 86 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3iv7 n GLU 87 N 1.22 -5.63 -2.18 3.52 1.02 -1.04 -4.91 120.64 112.64 3iv7 n GLU 87 Ca 0.20 0.71 -0.40 0.00 -0.02 0.00 0.00 57.16 57.64 3iv7 n GLU 87 Cb 0.50 -5.61 -0.02 0.00 -0.02 0.00 0.00 31.44 26.29 3iv7 n GLU 87 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3iv7 s ILE 88 N -3.22 2.87 0.00 -3.67 -1.09 -0.64 -4.71 121.20 110.73 3iv7 s ILE 88 Ca 0.52 0.83 0.00 0.00 -2.23 0.00 0.00 60.65 59.77 3iv7 s ILE 88 Cb -0.25 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.12 3iv7 s ILE 88 CO 0.64 0.17 0.62 -0.90 -1.23 0.00 0.00 174.94 174.24 3iv7 n ASP 89 N 0.61 1.15 -3.69 3.58 5.75 -0.58 -4.92 116.55 118.46 3iv7 n ASP 89 Ca 0.01 -1.36 -0.10 0.00 -0.01 0.00 0.00 54.79 53.33 3iv7 n ASP 89 Cb 0.43 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.42 3iv7 n ASP 89 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3iv7 s LEU 90 N -0.36 -0.19 -0.16 -2.12 2.96 -1.22 -4.61 118.68 112.98 3iv7 s LEU 90 Ca 0.00 1.00 -0.10 0.00 -0.22 0.00 0.00 54.13 54.81 3iv7 s LEU 90 Cb 0.00 1.55 -0.05 0.00 0.50 0.00 0.00 46.19 48.19 3iv7 s LEU 90 CO 0.00 -0.20 0.17 -0.76 -1.32 0.00 0.00 176.35 174.25 3iv7 s LEU 91 N 1.30 4.28 -0.18 -0.68 1.43 -0.60 -4.46 118.68 119.77 3iv7 s LEU 91 Ca -0.08 0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 53.40 3iv7 s LEU 91 Cb -0.07 -2.16 0.05 0.00 0.03 0.00 0.00 46.19 44.04 3iv7 s LEU 91 CO -0.12 0.24 -0.05 -0.69 0.23 0.00 0.00 176.35 175.96 3iv7 s VAL 92 N -0.12 1.17 -0.11 -1.59 1.01 -1.26 -1.19 120.40 118.31 3iv7 s VAL 92 Ca 0.12 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 3iv7 s VAL 92 Cb -0.12 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 3iv7 s VAL 92 CO 0.02 0.06 -0.04 0.00 0.00 0.00 0.00 175.10 175.13 3iv7 s VAL 94 N -0.26 1.45 -5.00 0.00 1.01 -0.18 0.00 120.40 117.42 3iv7 s VAL 94 Ca 0.04 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 60.66 3iv7 s VAL 94 Cb -0.13 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.41 3iv7 s VAL 94 CO 0.02 -0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.46 3iv7 n GLY 95 N 4.67 -0.07 0.00 4.51 0.00 -0.96 -4.46 105.19 108.88 3iv7 n GLY 95 Ca -0.08 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.74 3iv7 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iv7 n GLY 96 N 0.00 0.88 0.34 -0.02 0.00 -1.26 -1.89 105.19 103.24 3iv7 n GLY 96 Ca 0.00 -1.88 0.04 0.00 0.00 0.00 0.00 46.02 44.17 3iv7 n GLY 96 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3iv7 h GLY 97 N 0.00 1.46 1.77 -0.02 0.00 -1.98 -0.38 103.07 103.93 3iv7 h GLY 97 Ca 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.83 3iv7 h GLY 97 CO 0.00 0.22 -0.35 1.76 0.00 0.00 0.00 176.54 178.17 3iv7 h SER 98 N 0.99 0.26 -0.01 0.19 0.02 -1.94 0.66 113.55 113.72 3iv7 h SER 98 Ca 0.43 -0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 61.26 3iv7 h SER 98 Cb 0.31 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.78 3iv7 h SER 98 CO -0.22 0.60 -0.10 0.74 -1.14 0.00 0.00 176.83 176.71 3iv7 h THR 99 N 0.22 1.55 -0.94 -2.27 2.02 -1.71 -1.45 112.91 110.34 3iv7 h THR 99 Ca 0.03 -1.77 0.02 0.00 0.77 0.00 0.00 66.41 65.46 3iv7 h THR 99 Cb 0.72 2.70 -0.05 0.00 -1.74 0.00 0.00 68.15 69.78 3iv7 h THR 99 CO 0.05 0.47 0.62 0.40 0.37 0.00 0.00 175.52 177.44 3iv7 h ILE 100 N -0.60 1.22 -1.01 3.11 2.04 -1.01 -2.41 117.51 118.85 3iv7 h ILE 100 Ca -0.01 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.44 3iv7 h ILE 100 Cb 0.83 -0.14 -0.05 0.00 -0.74 0.00 0.00 36.82 36.72 3iv7 h ILE 100 CO 0.02 0.23 0.67 1.23 0.00 0.00 0.00 178.15 180.29 3iv7 h GLY 101 N 1.24 1.43 0.81 5.37 0.00 0.40 -0.21 103.07 112.11 3iv7 h GLY 101 Ca 0.35 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 3iv7 h GLY 101 CO -0.09 0.50 0.01 -2.00 0.00 0.00 0.00 176.54 174.96 3iv7 h LEU 102 N 1.35 0.30 -0.67 3.11 5.85 -0.82 -1.35 115.31 123.08 3iv7 h LEU 102 Ca 0.38 -0.30 0.11 0.00 0.84 0.00 0.00 57.88 58.91 3iv7 h LEU 102 Cb -0.12 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 40.75 3iv7 h LEU 102 CO -0.09 0.52 0.27 0.00 -0.34 0.00 0.00 178.44 178.81 3iv7 h ALA 103 N 0.79 0.91 -0.47 1.25 0.00 -1.04 -1.52 119.26 119.17 3iv7 h ALA 103 Ca 0.05 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3iv7 h ALA 103 Cb 0.37 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3iv7 h ALA 103 CO 0.01 -0.17 0.30 0.87 0.00 0.00 0.00 179.25 180.26 3iv7 h LYS 104 N 0.45 0.63 -0.65 0.00 1.57 -0.85 -0.85 116.57 116.87 3iv7 h LYS 104 Ca 0.35 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3iv7 h LYS 104 Cb 0.45 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 3iv7 h LYS 104 CO -0.33 0.43 0.38 0.00 -0.57 0.00 0.00 179.45 179.37 3iv7 h ALA 105 N 1.16 1.46 -0.34 3.86 0.00 -0.54 -0.93 119.26 123.93 3iv7 h ALA 105 Ca 0.17 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 3iv7 h ALA 105 Cb -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3iv7 h ALA 105 CO -0.04 0.47 -0.28 0.82 0.00 0.00 0.00 179.25 180.23 3iv7 h ILE 106 N 0.89 1.29 0.00 0.00 2.04 -0.85 -3.35 117.51 117.53 3iv7 h ILE 106 Ca 0.23 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.66 3iv7 h ILE 106 Cb -0.03 1.45 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3iv7 h ILE 106 CO -0.04 0.47 0.14 0.00 0.00 0.00 0.00 178.15 178.71 3iv7 n ALA 107 N -2.50 1.40 0.00 1.87 0.00 -0.35 -1.74 120.51 119.18 3iv7 n ALA 107 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3iv7 n ALA 107 Cb 0.47 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.86 3iv7 n ALA 107 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3iv7 n THR 109 N 2.27 0.00 -0.02 0.00 -2.24 -1.26 0.54 114.28 113.57 3iv7 n THR 109 Ca 0.00 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.85 3iv7 n THR 109 Cb 0.01 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.08 3iv7 n THR 109 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3iv7 n THR 110 N -0.27 0.20 -1.98 4.28 -2.24 -0.71 -4.98 114.28 108.57 3iv7 n THR 110 Ca 0.00 -0.51 -0.21 0.00 -2.27 0.00 0.00 64.05 61.07 3iv7 n THR 110 Cb 0.00 -0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.14 3iv7 n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3iv7 n ALA 111 N -2.27 -0.46 -1.77 6.98 0.00 0.19 -4.97 120.51 118.21 3iv7 n ALA 111 Ca -0.08 0.25 -0.37 0.00 0.00 0.00 0.00 53.44 53.24 3iv7 n ALA 111 Cb 0.61 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.93 3iv7 n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3iv7 s LEU 112 N -5.29 4.16 0.44 0.00 1.43 -1.26 -5.01 118.68 113.15 3iv7 s LEU 112 Ca 0.00 2.20 -0.22 0.00 -1.03 0.00 0.00 54.13 55.07 3iv7 s LEU 112 Cb 0.00 -4.11 -0.09 0.00 0.03 0.00 0.00 46.19 42.02 3iv7 s LEU 112 CO 0.00 -0.60 1.03 -2.16 0.23 0.00 0.00 176.35 174.85 3iv7 s PRO 113 N -2.40 4.02 -0.10 1.29 0.04 -1.26 -4.65 135.00 131.94 3iv7 s PRO 113 Ca 0.58 1.40 0.02 0.00 0.04 0.00 0.00 61.00 63.04 3iv7 s PRO 113 Cb -0.26 -2.32 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 3iv7 s PRO 113 CO 0.33 -0.25 -0.18 0.42 0.04 0.00 0.00 177.00 177.36 3iv7 s ILE 114 N -1.85 2.60 -0.31 0.56 1.01 -1.26 -1.55 121.20 120.41 3iv7 s ILE 114 Ca 0.62 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 60.36 3iv7 s ILE 114 Cb -0.18 -2.04 0.01 0.00 0.01 0.00 0.00 42.46 40.26 3iv7 s ILE 114 CO 0.23 0.55 0.10 -0.69 0.00 0.00 0.00 174.94 175.13 3iv7 s VAL 115 N 0.15 4.07 -0.16 2.92 1.01 -0.33 -0.96 120.40 127.11 3iv7 s VAL 115 Ca -0.10 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.07 3iv7 s VAL 115 Cb -0.16 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 3iv7 s VAL 115 CO 0.06 0.02 0.12 0.00 0.00 0.00 0.00 175.10 175.30 3iv7 s ALA 116 N 1.51 3.70 -0.55 5.51 0.00 0.18 -1.81 121.76 130.30 3iv7 s ALA 116 Ca 0.02 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 51.33 3iv7 s ALA 116 Cb -0.18 -2.03 0.15 0.00 0.00 0.00 0.00 23.12 21.06 3iv7 s ALA 116 CO 0.03 0.34 0.33 0.42 0.00 0.00 0.00 175.76 176.89 3iv7 s ILE 117 N -0.18 2.24 0.47 0.00 1.01 0.10 -0.55 121.20 124.30 3iv7 s ILE 117 Ca 0.10 -3.38 -0.15 0.00 0.00 0.00 0.00 60.65 57.22 3iv7 s ILE 117 Cb -0.12 -2.53 -0.08 0.00 0.01 0.00 0.00 42.46 39.75 3iv7 s ILE 117 CO 0.01 -0.91 0.92 -2.84 0.00 0.00 0.00 174.94 172.11 3iv7 s PRO 118 N -0.46 3.93 0.00 2.79 0.02 -1.25 -2.26 135.00 137.77 3iv7 s PRO 118 Ca 0.20 0.84 0.00 0.00 0.02 0.00 0.00 61.00 62.07 3iv7 s PRO 118 Cb -0.17 -2.21 0.00 0.00 0.02 0.00 0.00 34.50 32.14 3iv7 s PRO 118 CO -0.06 -0.18 0.73 0.25 -0.33 0.00 0.00 177.00 177.41 3iv7 n THR 119 N -1.39 0.53 -4.20 0.99 -2.24 -0.79 -4.72 114.28 102.46 3iv7 n THR 119 Ca 0.05 -0.63 -0.13 0.00 -2.27 0.00 0.00 64.05 61.07 3iv7 n THR 119 Cb 0.54 0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 69.53 3iv7 n THR 119 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3iv7 n THR 120 N -0.27 0.00 -0.77 4.28 -2.24 -1.26 -4.61 114.28 109.41 3iv7 n THR 120 Ca 0.00 -1.55 0.08 0.00 -2.27 0.00 0.00 64.05 60.31 3iv7 n THR 120 Cb 0.25 0.75 0.33 0.00 -2.10 0.00 0.00 70.33 69.55 3iv7 n THR 120 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3iv7 n TYR 121 N -0.43 1.42 0.22 4.78 4.01 -1.26 -4.63 117.16 121.27 3iv7 n TYR 121 Ca 0.04 -0.71 0.10 0.00 -0.16 0.00 0.00 57.90 57.17 3iv7 n TYR 121 Cb 0.39 -0.32 0.45 0.00 -0.31 0.00 0.00 39.34 39.54 3iv7 n TYR 121 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3iv7 h ALA 122 N 3.22 1.01 -0.05 -0.72 0.00 -1.94 -3.35 119.26 117.44 3iv7 h ALA 122 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3iv7 h ALA 122 Cb 1.54 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 3iv7 h ALA 122 CO 0.29 0.28 -0.02 0.41 0.00 0.00 0.00 179.25 180.20 3iv7 n GLY 123 N 0.19 0.46 0.31 0.00 0.00 -1.26 -4.88 105.19 100.01 3iv7 n GLY 123 Ca 0.00 -0.18 0.14 0.00 0.00 0.00 0.00 46.02 45.97 3iv7 n GLY 123 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3iv7 h SER 124 N 0.00 0.00 0.06 1.61 0.87 -1.95 -0.21 113.55 113.93 3iv7 h SER 124 Ca -0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 3iv7 h SER 124 Cb 0.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 3iv7 h SER 124 CO 0.03 0.00 0.00 1.05 -0.53 0.00 0.00 176.83 177.38 3iv7 h GLU 125 N 0.00 0.00 -0.36 2.24 9.09 -1.97 -2.66 114.58 120.93 3iv7 h GLU 125 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 3iv7 h GLU 125 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.49 3iv7 h GLU 125 CO -0.00 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.06 3iv7 n ALA 126 N -2.00 2.39 -2.50 1.06 0.00 -0.09 -4.14 120.51 115.23 3iv7 n ALA 126 Ca -0.02 -0.99 -0.25 0.00 0.00 0.00 0.00 53.44 52.18 3iv7 n ALA 126 Cb 0.07 -0.75 -0.10 0.00 0.00 0.00 0.00 19.45 18.67 3iv7 n ALA 126 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3iv7 s THR 127 N -1.33 2.67 -0.35 0.00 -4.23 -1.00 -4.47 115.64 106.93 3iv7 s THR 127 Ca 0.34 -2.19 0.09 0.00 -1.18 0.00 0.00 61.69 58.75 3iv7 s THR 127 Cb 0.20 -2.38 0.69 0.00 1.34 0.00 0.00 72.50 72.35 3iv7 s THR 127 CO 0.27 -0.31 1.71 -0.46 -0.54 0.00 0.00 174.62 175.29 3iv7 n ASN 128 N -0.43 4.64 -4.63 3.99 6.94 -1.26 -4.14 115.26 120.37 3iv7 n ASN 128 Ca -0.07 -3.08 -0.36 0.00 -0.02 0.00 0.00 54.58 51.04 3iv7 n ASN 128 Cb 0.59 -0.72 -0.10 0.00 -2.36 0.00 0.00 39.78 37.18 3iv7 n ASN 128 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3iv7 s VAL 129 N -2.74 5.15 0.24 3.53 1.01 -1.26 -0.61 120.40 125.72 3iv7 s VAL 129 Ca 0.50 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.65 3iv7 s VAL 129 Cb 0.40 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 3iv7 s VAL 129 CO 0.13 0.36 0.21 -1.66 0.00 0.00 0.00 175.10 174.14 3iv7 s TRP 130 N 0.99 3.16 -0.06 5.22 1.48 -0.12 -4.97 118.94 124.65 3iv7 s TRP 130 Ca 0.07 -0.09 -0.05 0.00 -1.06 0.00 0.00 56.10 54.97 3iv7 s TRP 130 Cb -0.13 -1.43 0.02 0.00 -1.16 0.00 0.00 33.47 30.76 3iv7 s TRP 130 CO 0.04 0.51 0.17 0.20 -4.06 0.00 0.00 176.95 173.80 3iv7 s GLY 131 N -3.78 -0.11 0.02 3.67 0.00 -1.26 -2.20 107.32 103.67 3iv7 s GLY 131 Ca 0.33 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.59 3iv7 s GLY 131 CO 0.25 0.56 -0.03 1.08 0.00 0.00 0.00 173.10 174.97 3iv7 s LEU 132 N 0.36 2.18 -0.08 0.66 1.43 0.61 -4.68 118.68 119.16 3iv7 s LEU 132 Ca -0.02 -0.38 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 3iv7 s LEU 132 Cb -0.04 0.05 -0.02 0.00 0.03 0.00 0.00 46.19 46.21 3iv7 s LEU 132 CO -0.02 -0.22 -0.14 -0.89 0.23 0.00 0.00 176.35 175.32 3iv7 s THR 133 N -1.10 3.03 -0.23 5.49 2.01 -0.92 0.12 115.64 124.05 3iv7 s THR 133 Ca -0.12 -0.71 -0.05 0.00 0.31 0.00 0.00 61.69 61.13 3iv7 s THR 133 Cb -0.08 -2.22 0.12 0.00 0.01 0.00 0.00 72.50 70.33 3iv7 s THR 133 CO -0.01 0.56 0.42 -0.70 -0.69 0.00 0.00 174.62 174.21 3iv7 s GLU 134 N -0.28 0.36 -0.85 4.92 2.12 -0.19 -0.66 118.70 124.12 3iv7 s GLU 134 Ca 0.02 0.82 -0.00 0.00 0.36 0.00 0.00 54.97 56.17 3iv7 s GLU 134 Cb -0.13 -0.00 0.00 0.00 0.26 0.00 0.00 34.13 34.26 3iv7 s GLU 134 CO 0.03 -0.45 0.71 0.00 -0.54 0.00 0.00 175.26 175.00 3iv7 n ALA 135 N 5.38 -1.41 -0.89 6.30 0.00 -1.26 -2.63 120.51 126.00 3iv7 n ALA 135 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3iv7 n ALA 135 Cb 0.50 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.04 3iv7 n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iv7 n ALA 136 N -3.23 0.00 -3.47 0.00 0.00 -1.26 -4.94 120.51 107.60 3iv7 n ALA 136 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.89 3iv7 n ALA 136 Cb 0.62 -1.17 -0.14 0.00 0.00 0.00 0.00 19.45 18.76 3iv7 n ALA 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3iv7 s ARG 137 N -1.48 3.02 0.09 0.00 6.06 -1.08 -5.09 118.95 120.46 3iv7 s ARG 137 Ca 0.00 -0.88 -0.26 0.00 -2.50 0.00 0.00 55.73 52.09 3iv7 s ARG 137 Cb 0.00 -3.14 -0.06 0.00 0.06 0.00 0.00 34.95 31.81 3iv7 s ARG 137 CO 0.00 -0.39 0.81 -1.59 -2.50 0.00 0.00 175.30 171.63 3iv7 s LYS 138 N 1.42 4.56 0.01 5.12 -2.85 -1.26 -1.02 119.74 125.72 3iv7 s LYS 138 Ca 0.02 1.16 0.04 0.00 -1.00 0.00 0.00 55.97 56.20 3iv7 s LYS 138 Cb -0.16 -3.34 -0.02 0.00 -2.06 0.00 0.00 37.83 32.25 3iv7 s LYS 138 CO -0.02 0.35 -0.13 0.95 0.10 0.00 0.00 175.35 176.60 3iv7 s THR 139 N -0.33 1.03 0.21 3.79 -4.23 0.33 -4.96 115.64 111.47 3iv7 s THR 139 Ca 0.39 -0.76 0.05 0.00 -1.18 0.00 0.00 61.69 60.19 3iv7 s THR 139 Cb -0.22 -0.90 -0.05 0.00 1.34 0.00 0.00 72.50 72.67 3iv7 s THR 139 CO 0.25 0.14 -0.05 0.42 -0.54 0.00 0.00 174.62 174.84 3iv7 s THR 140 N -0.57 1.21 0.19 3.99 -4.23 -1.26 -0.29 115.64 114.68 3iv7 s THR 140 Ca 0.03 -2.07 -0.23 0.00 -1.18 0.00 0.00 61.69 58.24 3iv7 s THR 140 Cb -0.06 -2.17 0.07 0.00 1.34 0.00 0.00 72.50 71.68 3iv7 s THR 140 CO 0.00 -0.48 0.98 -0.83 -0.54 0.00 0.00 174.62 173.75 3iv7 s GLY 141 N -3.28 -0.02 -0.07 3.99 0.00 -0.93 -5.00 107.32 102.01 3iv7 s GLY 141 Ca 0.24 -0.16 0.05 0.00 0.00 0.00 0.00 44.72 44.85 3iv7 s GLY 141 CO 0.06 1.07 -0.24 0.14 0.00 0.00 0.00 173.10 174.13 3iv7 s VAL 142 N -2.68 2.16 -0.29 1.40 1.01 -1.26 -0.94 120.40 119.79 3iv7 s VAL 142 Ca 0.17 -1.01 -0.14 0.00 0.00 0.00 0.00 61.98 61.00 3iv7 s VAL 142 Cb -0.02 -1.80 0.10 0.00 0.00 0.00 0.00 36.38 34.65 3iv7 s VAL 142 CO 0.04 0.57 0.67 -0.62 0.00 0.00 0.00 175.10 175.76 3iv7 s ASP 143 N 0.00 -1.01 0.55 3.32 -1.08 0.22 -4.98 116.67 113.69 3iv7 s ASP 143 Ca -0.08 1.53 0.26 0.00 -0.52 0.00 0.00 52.55 53.74 3iv7 s ASP 143 Cb -0.15 1.69 1.46 0.00 -1.46 0.00 0.00 42.92 44.46 3iv7 s ASP 143 CO 0.05 -0.23 2.01 0.25 0.52 0.00 0.00 175.17 177.77 3iv7 h LEU 144 N 7.34 0.00 -2.29 -1.34 5.85 -1.98 -0.77 115.31 122.12 3iv7 h LEU 144 Ca -0.26 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.46 3iv7 h LEU 144 Cb 1.19 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 3iv7 h LEU 144 CO 0.14 0.00 -0.01 0.11 -0.34 0.00 0.00 178.44 178.34 3iv7 h LYS 145 N 0.00 0.00 0.00 1.25 1.57 -1.93 -2.73 116.57 114.72 3iv7 h LYS 145 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3iv7 h LYS 145 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3iv7 h LYS 145 CO -0.00 0.01 -0.57 1.33 -0.57 0.00 0.00 179.45 179.65 3iv7 n VAL 146 N -4.04 0.14 -2.19 0.50 0.24 -0.30 -4.84 118.33 107.84 3iv7 n VAL 146 Ca -0.03 -0.11 -0.42 0.00 -2.04 0.00 0.00 64.34 61.73 3iv7 n VAL 146 Cb 0.10 0.09 -0.03 0.00 -1.47 0.00 0.00 33.84 32.53 3iv7 n VAL 146 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3iv7 s LEU 147 N -3.50 4.28 0.26 1.34 2.96 -1.03 -4.70 118.68 118.29 3iv7 s LEU 147 Ca 0.09 2.05 -0.31 0.00 -0.22 0.00 0.00 54.13 55.74 3iv7 s LEU 147 Cb 0.16 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 43.18 3iv7 s LEU 147 CO 0.71 -0.82 1.56 -2.65 -1.32 0.00 0.00 176.35 173.84 3iv7 n PRO 148 N 6.42 2.50 0.12 0.98 -0.02 -1.26 -4.76 135.00 138.99 3iv7 n PRO 148 Ca 0.15 0.89 -0.02 0.00 -2.02 0.00 0.00 63.50 62.50 3iv7 n PRO 148 Cb 0.44 -2.65 0.16 0.00 -0.02 0.00 0.00 33.50 31.43 3iv7 n PRO 148 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3iv7 h GLU 149 N 5.00 0.06 -3.86 -0.52 5.08 -1.38 -3.44 114.58 115.53 3iv7 h GLU 149 Ca -0.46 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 57.58 3iv7 h GLU 149 Cb 1.24 0.01 -0.30 0.00 0.50 0.00 0.00 28.75 30.20 3iv7 h GLU 149 CO 0.81 0.65 -0.73 0.99 -1.00 0.00 0.00 179.01 179.73 3iv7 s THR 150 N -3.67 0.13 -0.13 1.13 2.01 -1.13 -0.70 115.64 113.28 3iv7 s THR 150 Ca -0.02 -0.02 0.03 0.00 0.31 0.00 0.00 61.69 61.98 3iv7 s THR 150 Cb 0.13 -0.15 0.01 0.00 0.01 0.00 0.00 72.50 72.49 3iv7 s THR 150 CO 0.77 0.06 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.86 3iv7 s VAL 151 N 0.25 2.02 -0.34 3.82 1.01 0.40 -0.65 120.40 126.92 3iv7 s VAL 151 Ca -0.02 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 60.92 3iv7 s VAL 151 Cb -0.04 -1.78 0.03 0.00 0.00 0.00 0.00 36.38 34.58 3iv7 s VAL 151 CO -0.01 0.54 0.13 -0.63 0.00 0.00 0.00 175.10 175.13 3iv7 s ILE 152 N 0.79 4.03 -0.31 2.22 1.01 0.29 -4.27 121.20 124.95 3iv7 s ILE 152 Ca -0.08 -0.96 -0.11 0.00 0.00 0.00 0.00 60.65 59.50 3iv7 s ILE 152 Cb -0.16 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.06 3iv7 s ILE 152 CO -0.01 -0.13 0.20 -0.31 0.00 0.00 0.00 174.94 174.68 3iv7 s TYR 153 N 1.46 3.21 -0.27 3.97 2.02 -1.26 -3.88 117.35 122.60 3iv7 s TYR 153 Ca 0.00 -0.20 0.00 0.00 -0.37 0.00 0.00 57.07 56.50 3iv7 s TYR 153 Cb -0.19 -2.41 0.08 0.00 -0.40 0.00 0.00 41.96 39.04 3iv7 s TYR 153 CO 0.04 -0.32 0.04 0.34 -1.57 0.00 0.00 175.55 174.07 3iv7 s ASP 154 N 1.70 3.92 0.63 2.29 -1.08 -1.26 -0.89 116.67 121.97 3iv7 s ASP 154 Ca 0.06 -1.45 0.36 0.00 -0.52 0.00 0.00 52.55 50.99 3iv7 s ASP 154 Cb -0.17 -1.03 2.02 0.00 -1.46 0.00 0.00 42.92 42.28 3iv7 s ASP 154 CO 0.09 -0.34 2.24 0.77 0.52 0.00 0.00 175.17 178.45 3iv7 h SER 155 N 8.00 0.00 -0.21 -0.34 4.64 -1.90 -1.03 113.55 122.71 3iv7 h SER 155 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3iv7 h SER 155 Cb 1.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 3iv7 h SER 155 CO 0.44 0.00 0.14 -0.08 -0.87 0.00 0.00 176.83 176.46 3iv7 h GLU 156 N 0.00 0.28 0.00 4.77 4.81 -1.94 -1.42 114.58 121.08 3iv7 h GLU 156 Ca 0.02 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3iv7 h GLU 156 Cb 0.17 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3iv7 h GLU 156 CO -0.00 0.19 0.00 1.28 -0.73 0.00 0.00 179.01 179.75 3iv7 n LEU 157 N -4.50 0.28 -3.66 1.64 4.77 -0.39 -4.50 117.00 110.63 3iv7 n LEU 157 Ca 0.00 0.55 -0.40 0.00 -0.03 0.00 0.00 56.01 56.13 3iv7 n LEU 157 Cb 0.08 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.68 3iv7 n LEU 157 CO 0.35 -0.27 1.28 0.35 -1.33 0.00 0.00 177.39 177.77 3iv7 n THR 158 N -1.79 5.74 0.00 -5.08 -2.24 -0.54 -4.78 114.28 105.60 3iv7 n THR 158 Ca 0.04 -5.95 0.00 0.00 -2.27 0.00 0.00 64.05 55.87 3iv7 n THR 158 Cb 0.25 -1.65 0.00 0.00 -2.10 0.00 0.00 70.33 66.83 3iv7 n THR 158 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3iv7 n SER 160 N 0.20 0.00 -4.66 3.42 3.41 -1.26 -4.85 113.62 109.89 3iv7 n SER 160 Ca 0.42 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.60 3iv7 n SER 160 Cb 0.28 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 3iv7 n SER 160 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3iv7 s LEU 161 N 0.00 4.27 0.75 1.04 2.96 -1.26 -4.95 118.68 121.50 3iv7 s LEU 161 Ca 0.00 2.11 -0.15 0.00 -0.22 0.00 0.00 54.13 55.87 3iv7 s LEU 161 Cb 0.00 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.17 3iv7 s LEU 161 CO 0.00 -0.92 0.90 -2.65 -1.32 0.00 0.00 176.35 172.36 3iv7 n PRO 162 N 7.08 0.36 -0.19 0.98 -0.02 -1.26 -4.56 135.00 137.39 3iv7 n PRO 162 Ca 0.17 0.18 -0.02 0.00 -2.02 0.00 0.00 63.50 61.81 3iv7 n PRO 162 Cb 0.43 -2.17 0.09 0.00 -0.02 0.00 0.00 33.50 31.83 3iv7 n PRO 162 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3iv7 h VAL 163 N -0.48 0.83 0.00 -1.45 2.07 -1.94 0.18 116.25 115.47 3iv7 h VAL 163 Ca -0.47 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3iv7 h VAL 163 Cb 1.33 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 3iv7 h VAL 163 CO 0.45 0.08 0.00 -0.62 0.02 0.00 0.00 177.57 177.50 3iv7 n GLU 164 N -4.96 0.11 0.00 1.57 1.02 -1.26 -0.88 120.64 116.24 3iv7 n GLU 164 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 3iv7 n GLU 164 Cb 0.23 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 3iv7 n GLU 164 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3iv7 n SER 166 N 0.22 0.00 -0.04 1.62 7.64 0.64 -0.92 113.62 122.79 3iv7 n SER 166 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 3iv7 n SER 166 Cb 0.02 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.15 3iv7 n SER 166 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3iv7 h VAL 167 N 0.00 1.28 -0.16 0.44 2.07 -1.24 -0.60 116.25 118.04 3iv7 h VAL 167 Ca 0.00 -0.93 0.03 0.00 0.82 0.00 0.00 66.70 66.62 3iv7 h VAL 167 Cb 0.00 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 3iv7 h VAL 167 CO 0.00 0.27 -0.06 0.00 0.02 0.00 0.00 177.57 177.80 3iv7 h ALA 168 N 0.71 0.08 -0.69 1.67 0.00 -1.28 -1.30 119.26 118.45 3iv7 h ALA 168 Ca 0.03 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3iv7 h ALA 168 Cb 0.43 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3iv7 h ALA 168 CO 0.01 -0.50 0.25 1.03 0.00 0.00 0.00 179.25 180.04 3iv7 h SER 169 N -0.03 0.95 -0.41 0.00 0.87 -1.81 -2.42 113.55 110.70 3iv7 h SER 169 Ca 0.08 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 3iv7 h SER 169 Cb 0.16 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 3iv7 h SER 169 CO -0.18 0.87 0.09 1.23 -0.53 0.00 0.00 176.83 178.30 3iv7 h GLY 170 N 1.07 0.79 2.00 5.77 0.00 -0.62 -2.18 103.07 109.91 3iv7 h GLY 170 Ca 0.23 -0.46 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 3iv7 h GLY 170 CO -0.02 0.43 -0.41 1.41 0.00 0.00 0.00 176.54 177.96 3iv7 h LEU 171 N 0.71 0.00 -0.32 3.11 3.38 -0.87 0.66 115.31 121.98 3iv7 h LEU 171 Ca 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 3iv7 h LEU 171 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3iv7 h LEU 171 CO 0.00 0.41 0.13 -1.13 0.09 0.00 0.00 178.44 177.94 3iv7 h ASN 172 N 0.00 0.43 -0.59 -0.43 -0.73 -1.11 0.04 115.58 113.19 3iv7 h ASN 172 Ca -0.00 -0.17 -0.02 0.00 1.87 0.00 0.00 56.30 57.98 3iv7 h ASN 172 Cb 1.09 -0.11 -0.03 0.00 0.27 0.00 0.00 38.32 39.54 3iv7 h ASN 172 CO 0.05 0.48 0.28 1.23 -0.37 0.00 0.00 177.43 179.11 3iv7 h GLY 173 N 0.36 0.91 1.84 1.57 0.00 -0.97 -1.88 103.07 104.91 3iv7 h GLY 173 Ca 0.11 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 3iv7 h GLY 173 CO -0.01 0.43 0.05 -2.00 0.00 0.00 0.00 176.54 175.01 3iv7 h LEU 174 N 0.80 0.18 -0.53 3.11 5.85 -0.60 -1.98 115.31 122.15 3iv7 h LEU 174 Ca 0.20 -0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.75 3iv7 h LEU 174 Cb 0.12 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3iv7 h LEU 174 CO -0.03 0.18 -0.63 0.00 -0.34 0.00 0.00 178.44 177.63 3iv7 h ALA 175 N 1.85 0.72 -0.97 1.25 0.00 -0.32 -0.41 119.26 121.37 3iv7 h ALA 175 Ca 0.05 -0.55 0.07 0.00 0.00 0.00 0.00 54.91 54.48 3iv7 h ALA 175 Cb 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 3iv7 h ALA 175 CO -0.00 0.72 0.62 0.45 0.00 0.00 0.00 179.25 181.04 3iv7 h HIS 176 N 0.29 1.14 0.40 0.00 3.86 -0.62 -1.65 115.15 118.58 3iv7 h HIS 176 Ca -0.01 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 3iv7 h HIS 176 Cb 1.16 -0.37 0.00 0.00 1.06 0.00 0.00 27.41 29.26 3iv7 h HIS 176 CO 0.04 0.58 -0.19 0.00 0.86 0.00 0.00 177.93 179.22 3iv7 h ILE 178 N -0.96 1.26 -0.31 0.00 2.04 -1.09 -2.72 117.51 115.72 3iv7 h ILE 178 Ca -0.05 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 3iv7 h ILE 178 Cb 0.55 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 3iv7 h ILE 178 CO 0.09 0.27 0.14 -0.78 0.00 0.00 0.00 178.15 177.87 3iv7 h ASP 179 N 0.09 0.39 0.82 1.72 3.58 -1.46 -2.31 116.42 119.24 3iv7 h ASP 179 Ca 0.05 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 3iv7 h ASP 179 Cb 0.40 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.35 3iv7 h ASP 179 CO 0.01 0.34 -0.08 0.28 -2.88 0.00 0.00 179.24 176.91 3iv7 h SER 180 N 0.44 0.00 0.30 2.28 0.02 -1.34 -2.29 113.55 112.95 3iv7 h SER 180 Ca 0.11 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3iv7 h SER 180 Cb 0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 3iv7 h SER 180 CO -0.01 0.08 -0.02 -0.07 -1.14 0.00 0.00 176.83 175.67 3iv7 h LEU 181 N 0.00 0.00 -2.87 5.07 3.38 -1.25 -2.19 115.31 117.44 3iv7 h LEU 181 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3iv7 h LEU 181 Cb 0.51 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.12 3iv7 h LEU 181 CO 0.01 0.02 -0.64 -2.67 0.09 0.00 0.00 178.44 175.25 3iv7 n TRP 182 N -3.21 0.00 -1.08 1.13 2.14 -0.93 -4.76 117.44 110.74 3iv7 n TRP 182 Ca -0.02 -0.87 -0.30 0.00 2.07 0.00 0.00 57.50 58.38 3iv7 n TRP 182 Cb 0.15 -0.17 0.13 0.00 -0.81 0.00 0.00 31.31 30.61 3iv7 n TRP 182 CO 0.00 0.00 0.00 0.20 2.07 0.00 0.00 177.69 179.96 3iv7 s GLY 183 N -2.44 1.65 0.51 -1.67 0.00 -0.82 -4.75 107.32 99.80 3iv7 s GLY 183 Ca 0.31 0.21 0.27 0.00 0.00 0.00 0.00 44.72 45.51 3iv7 s GLY 183 CO -0.09 0.64 1.90 -0.56 0.00 0.00 0.00 173.10 174.99 3iv7 h PRO 184 N -1.51 0.09 -0.53 2.90 0.13 -1.75 -1.77 132.00 129.57 3iv7 h PRO 184 Ca -0.46 -0.01 -0.39 0.00 -0.87 0.00 0.00 66.00 64.28 3iv7 h PRO 184 Cb 1.26 -0.02 -0.33 0.00 0.13 0.00 0.00 31.00 32.04 3iv7 h PRO 184 CO 0.50 0.06 -0.78 0.09 -0.23 0.00 0.00 178.00 177.64 3iv7 n ASN 185 N -4.34 3.78 -4.69 1.44 5.03 0.31 -5.02 115.26 111.77 3iv7 n ASN 185 Ca 0.17 -3.58 -0.43 0.00 0.87 0.00 0.00 54.58 51.61 3iv7 n ASN 185 Cb 0.84 -0.39 -0.01 0.00 -1.02 0.00 0.00 39.78 39.19 3iv7 n ASN 185 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3iv7 n ALA 186 N -0.76 1.21 -3.05 5.41 0.00 -0.67 -4.35 120.51 118.31 3iv7 n ALA 186 Ca 0.34 0.38 -0.10 0.00 0.00 0.00 0.00 53.44 54.05 3iv7 n ALA 186 Cb 0.90 -2.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.04 3iv7 n ALA 186 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3iv7 s ASP 187 N -0.15 0.14 0.44 0.00 1.47 -1.26 -5.00 116.67 112.30 3iv7 s ASP 187 Ca 0.59 -1.10 0.18 0.00 1.18 0.00 0.00 52.55 53.41 3iv7 s ASP 187 Cb -0.59 0.59 1.02 0.00 -0.34 0.00 0.00 42.92 43.60 3iv7 s ASP 187 CO 0.59 -1.17 1.93 -0.65 0.68 0.00 0.00 175.17 176.55 3iv7 h PRO 188 N 2.25 0.00 0.09 2.11 0.11 -1.96 -0.37 132.00 134.23 3iv7 h PRO 188 Ca -0.28 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 3iv7 h PRO 188 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3iv7 h PRO 188 CO 0.38 0.25 -0.04 0.82 -0.21 0.00 0.00 178.00 179.19 3iv7 h ILE 189 N 0.00 0.95 0.00 4.15 2.04 -1.99 -2.41 117.51 120.24 3iv7 h ILE 189 Ca -0.00 -1.41 -0.01 0.00 1.00 0.00 0.00 64.86 64.43 3iv7 h ILE 189 Cb 0.50 1.68 -0.00 0.00 -0.74 0.00 0.00 36.82 38.26 3iv7 h ILE 189 CO 0.03 0.28 -0.06 -0.55 0.00 0.00 0.00 178.15 177.85 3iv7 h ASN 190 N -0.91 0.00 -0.38 1.72 7.08 -1.90 -2.23 115.58 118.96 3iv7 h ASN 190 Ca -0.01 0.00 -0.05 0.00 -3.08 0.00 0.00 56.30 53.16 3iv7 h ASN 190 Cb 0.55 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.78 3iv7 h ASN 190 CO 0.02 0.06 0.05 0.00 -2.08 0.00 0.00 177.43 175.49 3iv7 h ALA 191 N 1.94 0.50 -0.48 4.14 0.00 -1.07 -0.35 119.26 123.94 3iv7 h ALA 191 Ca -0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 3iv7 h ALA 191 Cb 0.14 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3iv7 h ALA 191 CO 0.01 0.22 -0.07 -0.39 0.00 0.00 0.00 179.25 179.02 3iv7 h VAL 192 N 0.47 1.26 -0.36 0.00 -1.51 -0.89 -1.91 116.25 113.32 3iv7 h VAL 192 Ca 0.11 -1.14 -0.15 0.00 -1.23 0.00 0.00 66.70 64.29 3iv7 h VAL 192 Cb 0.38 0.96 -0.01 0.00 -2.13 0.00 0.00 31.29 30.49 3iv7 h VAL 192 CO 0.01 0.40 -0.37 -0.07 -1.23 0.00 0.00 177.57 176.31 3iv7 h LEU 193 N 0.78 0.91 -0.71 4.19 3.38 -1.35 -1.40 115.31 121.11 3iv7 h LEU 193 Ca 0.14 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 3iv7 h LEU 193 Cb 0.56 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3iv7 h LEU 193 CO 0.03 1.17 0.41 0.00 0.09 0.00 0.00 178.44 180.14 3iv7 h ALA 194 N 0.87 0.90 -0.53 1.53 0.00 -0.88 -1.04 119.26 120.12 3iv7 h ALA 194 Ca 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3iv7 h ALA 194 Cb 0.94 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3iv7 h ALA 194 CO 0.09 0.40 0.25 0.00 0.00 0.00 0.00 179.25 179.99 3iv7 h ALA 195 N 1.21 0.69 -0.80 0.00 0.00 -1.11 0.03 119.26 119.28 3iv7 h ALA 195 Ca 0.25 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3iv7 h ALA 195 Cb 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 3iv7 h ALA 195 CO -0.04 0.25 0.36 1.49 0.00 0.00 0.00 179.25 181.31 3iv7 h GLU 196 N 0.71 1.16 -0.40 0.00 4.57 -1.08 -0.44 114.58 119.10 3iv7 h GLU 196 Ca 0.18 -0.18 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 3iv7 h GLU 196 Cb 0.13 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 3iv7 h GLU 196 CO -0.02 0.91 0.23 0.78 -1.18 0.00 0.00 179.01 179.73 3iv7 h GLY 197 N 1.17 0.56 0.96 1.92 0.00 -0.54 -1.67 103.07 105.47 3iv7 h GLY 197 Ca 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.44 3iv7 h GLY 197 CO -0.03 0.14 0.30 -2.22 0.00 0.00 0.00 176.54 174.74 3iv7 h ILE 198 N 0.46 1.10 -0.34 2.60 2.04 -0.48 -0.53 117.51 122.35 3iv7 h ILE 198 Ca 0.16 -0.21 0.05 0.00 1.00 0.00 0.00 64.86 65.86 3iv7 h ILE 198 Cb 0.03 0.42 -0.05 0.00 -0.74 0.00 0.00 36.82 36.48 3iv7 h ILE 198 CO -0.09 0.11 0.06 -0.09 0.00 0.00 0.00 178.15 178.15 3iv7 h ARG 199 N 0.62 0.18 -0.13 2.37 2.43 -0.85 -0.30 114.38 118.69 3iv7 h ARG 199 Ca 0.18 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 3iv7 h ARG 199 Cb -0.04 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3iv7 h ARG 199 CO -0.06 0.12 -0.07 0.00 -1.51 0.00 0.00 179.97 178.45 3iv7 h ALA 200 N 1.26 0.18 -0.56 2.80 0.00 -1.03 -2.19 119.26 119.72 3iv7 h ALA 200 Ca 0.16 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3iv7 h ALA 200 Cb 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3iv7 h ALA 200 CO -0.22 -0.02 0.04 -0.07 0.00 0.00 0.00 179.25 178.99 3iv7 h LEU 201 N -0.08 0.88 -0.92 0.00 3.38 -1.02 0.38 115.31 117.93 3iv7 h LEU 201 Ca 0.03 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3iv7 h LEU 201 Cb 0.55 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3iv7 h LEU 201 CO 0.02 0.92 0.20 -1.13 0.09 0.00 0.00 178.44 178.54 3iv7 h ASN 202 N 0.86 0.92 -0.10 -0.43 -1.24 -1.02 -0.86 115.58 113.70 3iv7 h ASN 202 Ca 0.17 -0.16 -0.10 0.00 0.71 0.00 0.00 56.30 56.92 3iv7 h ASN 202 Cb 0.45 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 39.26 3iv7 h ASN 202 CO 0.02 0.86 -0.32 1.56 -1.29 0.00 0.00 177.43 178.26 3iv7 h GLN 203 N 0.96 0.39 -0.14 6.67 1.08 -1.18 -3.39 115.11 119.49 3iv7 h GLN 203 Ca 0.21 -0.29 -0.15 0.00 -1.45 0.00 0.00 58.65 56.97 3iv7 h GLN 203 Cb 0.27 0.05 0.01 0.00 -0.05 0.00 0.00 27.48 27.76 3iv7 h GLN 203 CO -0.01 0.91 -0.50 0.78 -0.95 0.00 0.00 178.83 179.06 3iv7 h GLY 204 N -0.05 0.66 1.00 3.46 0.00 -0.74 -3.35 103.07 104.04 3iv7 h GLY 204 Ca -0.01 -0.87 -0.01 0.00 0.00 0.00 0.00 47.33 46.44 3iv7 h GLY 204 CO 0.07 0.78 0.34 1.41 0.00 0.00 0.00 176.54 179.14 3iv7 h LEU 205 N 0.24 0.78 -1.39 3.11 3.38 -1.34 -1.25 115.31 118.84 3iv7 h LEU 205 Ca -0.02 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3iv7 h LEU 205 Cb 1.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 3iv7 h LEU 205 CO 0.11 0.64 0.24 -0.65 0.09 0.00 0.00 178.44 178.87 3iv7 h PRO 206 N 0.85 0.66 -0.57 1.13 0.11 -1.75 -1.82 132.00 130.61 3iv7 h PRO 206 Ca 0.22 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.19 3iv7 h PRO 206 Cb 0.04 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 30.99 3iv7 h PRO 206 CO -0.04 0.50 0.08 0.87 -0.21 0.00 0.00 178.00 179.20 3iv7 h LYS 207 N 0.66 0.92 -0.34 1.05 1.57 -1.45 -1.91 116.57 117.08 3iv7 h LYS 207 Ca 0.17 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3iv7 h LYS 207 Cb 0.05 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3iv7 h LYS 207 CO -0.02 0.86 0.09 0.82 -0.57 0.00 0.00 179.45 180.62 3iv7 h ILE 208 N 0.86 1.22 -0.81 1.86 2.04 -0.68 0.52 117.51 122.51 3iv7 h ILE 208 Ca 0.18 -0.73 0.04 0.00 1.00 0.00 0.00 64.86 65.34 3iv7 h ILE 208 Cb 0.40 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 3iv7 h ILE 208 CO 0.01 0.25 0.52 0.58 0.00 0.00 0.00 178.15 179.51 3iv7 h VAL 209 N 0.39 1.11 -0.02 1.67 2.07 -1.04 -0.69 116.25 119.75 3iv7 h VAL 209 Ca 0.11 -0.34 -0.20 0.00 0.82 0.00 0.00 66.70 67.09 3iv7 h VAL 209 Cb 0.29 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 3iv7 h VAL 209 CO -0.00 0.18 -0.84 0.00 0.02 0.00 0.00 177.57 176.94 3iv7 h ALA 210 N 1.35 0.52 -1.70 1.67 0.00 -1.04 -3.42 119.26 116.64 3iv7 h ALA 210 Ca 0.33 -0.68 -0.24 0.00 0.00 0.00 0.00 54.91 54.32 3iv7 h ALA 210 Cb 0.03 -0.06 -0.28 0.00 0.00 0.00 0.00 17.79 17.49 3iv7 h ALA 210 CO -0.12 0.83 -0.58 1.21 0.00 0.00 0.00 179.25 180.59 3iv7 s ASN 211 N -6.98 0.41 0.51 0.00 2.47 0.18 -5.02 114.94 106.51 3iv7 s ASN 211 Ca -0.04 -0.91 0.31 0.00 0.42 0.00 0.00 52.86 52.64 3iv7 s ASN 211 Cb 0.10 1.02 1.69 0.00 -1.45 0.00 0.00 41.25 42.61 3iv7 s ASN 211 CO 0.84 -0.29 1.94 -0.65 -3.72 0.00 0.00 177.10 175.22 3iv7 h PRO 212 N 7.57 0.00 -0.52 0.43 0.11 -1.36 0.18 132.00 138.42 3iv7 h PRO 212 Ca -0.01 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.98 3iv7 h PRO 212 Cb 1.10 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 3iv7 h PRO 212 CO 0.22 0.00 0.11 0.72 -0.21 0.00 0.00 178.00 178.83 3iv7 n HIS 213 N -2.66 1.75 -2.15 0.65 8.25 -1.26 -4.82 115.22 114.99 3iv7 n HIS 213 Ca -0.02 -1.10 -0.43 0.00 -0.26 0.00 0.00 57.72 55.92 3iv7 n HIS 213 Cb 0.14 -0.52 -0.02 0.00 1.12 0.00 0.00 29.99 30.70 3iv7 n HIS 213 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3iv7 s SER 214 N -1.50 6.52 0.03 0.41 0.15 0.64 -4.90 113.70 115.06 3iv7 s SER 214 Ca 0.50 1.72 -0.25 0.00 0.70 0.00 0.00 55.95 58.62 3iv7 s SER 214 Cb 0.40 -2.53 -0.17 0.00 -1.71 0.00 0.00 66.02 62.00 3iv7 s SER 214 CO 0.10 -1.12 1.47 0.40 1.20 0.00 0.00 173.24 175.29 3iv7 h ILE 215 N 5.94 1.06 -0.12 6.45 2.04 -1.93 0.41 117.51 131.36 3iv7 h ILE 215 Ca -0.33 -0.54 0.04 0.00 1.00 0.00 0.00 64.86 65.03 3iv7 h ILE 215 Cb 1.15 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 38.60 3iv7 h ILE 215 CO 0.99 0.13 -0.11 -0.08 0.00 0.00 0.00 178.15 179.08 3iv7 h GLU 216 N -0.36 -0.13 -0.35 2.37 4.81 -1.98 0.50 114.58 119.43 3iv7 h GLU 216 Ca -0.01 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 3iv7 h GLU 216 Cb 0.31 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3iv7 h GLU 216 CO 0.02 -0.08 -0.15 0.78 -0.73 0.00 0.00 179.01 178.85 3iv7 h GLY 217 N -0.13 0.78 1.69 1.92 0.00 -1.84 -1.73 103.07 103.76 3iv7 h GLY 217 Ca 0.08 -0.69 -0.09 0.00 0.00 0.00 0.00 47.33 46.64 3iv7 h GLY 217 CO -0.20 0.63 -0.27 3.21 0.00 0.00 0.00 176.54 179.90 3iv7 h ARG 218 N 0.51 0.36 -0.20 4.80 2.47 -0.83 -1.97 114.38 119.52 3iv7 h ARG 218 Ca 0.08 -0.13 -0.03 0.00 -1.26 0.00 0.00 59.98 58.64 3iv7 h ARG 218 Cb 0.68 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.97 3iv7 h ARG 218 CO 0.05 0.61 0.02 -0.44 0.56 0.00 0.00 179.97 180.77 3iv7 h ASP 219 N 0.32 0.32 -0.80 7.04 3.32 -0.76 -1.97 116.42 123.90 3iv7 h ASP 219 Ca 0.05 -0.27 0.02 0.00 0.02 0.00 0.00 57.03 56.85 3iv7 h ASP 219 Cb 0.65 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 40.07 3iv7 h ASP 219 CO 0.05 0.51 0.52 -0.33 -1.72 0.00 0.00 179.24 178.26 3iv7 h GLU 220 N 0.12 1.00 -0.58 3.56 5.08 -1.18 -0.12 114.58 122.45 3iv7 h GLU 220 Ca 0.06 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 3iv7 h GLU 220 Cb 0.33 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3iv7 h GLU 220 CO 0.01 0.66 -0.00 0.00 -1.00 0.00 0.00 179.01 178.67 3iv7 h ALA 221 N 1.32 0.78 -0.12 3.43 0.00 -1.33 0.14 119.26 123.49 3iv7 h ALA 221 Ca 0.31 -0.31 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 3iv7 h ALA 221 Cb -0.05 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.54 3iv7 h ALA 221 CO -0.09 0.62 -0.69 1.25 0.00 0.00 0.00 179.25 180.33 3iv7 h LEU 222 N 0.91 0.81 -0.30 0.00 5.85 -1.02 0.11 115.31 121.68 3iv7 h LEU 222 Ca 0.16 -0.65 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 3iv7 h LEU 222 Cb 0.55 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 3iv7 h LEU 222 CO 0.03 1.33 0.18 0.22 -0.34 0.00 0.00 178.44 179.86 3iv7 h TYR 223 N 0.35 0.40 -0.95 1.25 3.20 -1.00 -2.11 116.97 118.11 3iv7 h TYR 223 Ca -0.05 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.83 3iv7 h TYR 223 Cb 1.33 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 39.42 3iv7 h TYR 223 CO 0.10 0.31 0.63 0.78 -1.64 0.00 0.00 178.16 178.33 3iv7 h GLY 224 N 0.38 1.35 1.55 1.82 0.00 -0.52 -1.68 103.07 105.98 3iv7 h GLY 224 Ca 0.11 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 3iv7 h GLY 224 CO -0.02 0.46 0.12 0.00 0.00 0.00 0.00 176.54 177.10 3iv7 h ALA 225 N 1.36 1.47 0.39 3.60 0.00 -0.49 -1.12 119.26 124.47 3iv7 h ALA 225 Ca 0.36 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3iv7 h ALA 225 Cb -0.10 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.53 3iv7 h ALA 225 CO -0.09 0.40 -0.19 -0.92 0.00 0.00 0.00 179.25 178.45 3iv7 h TYR 226 N 0.57 -0.48 -0.45 0.00 3.20 -0.63 -1.75 116.97 117.42 3iv7 h TYR 226 Ca 0.14 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 3iv7 h TYR 226 Cb 0.18 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 3iv7 h TYR 226 CO 0.01 -0.21 0.08 -0.07 -1.64 0.00 0.00 178.16 176.33 3iv7 h LEU 227 N -0.69 0.63 -0.35 2.82 3.38 -1.30 -0.67 115.31 119.14 3iv7 h LEU 227 Ca -0.05 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 57.85 3iv7 h LEU 227 Cb 0.49 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 3iv7 h LEU 227 CO 0.09 0.65 0.11 0.00 0.09 0.00 0.00 178.44 179.38 3iv7 h ALA 228 N 1.44 0.40 -0.39 1.53 0.00 -1.14 -0.98 119.26 120.12 3iv7 h ALA 228 Ca 0.15 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 3iv7 h ALA 228 Cb 0.28 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3iv7 h ALA 228 CO 0.00 -0.28 -0.35 0.00 0.00 0.00 0.00 179.25 178.62 3iv7 h ALA 229 N 1.23 0.57 -0.57 0.00 0.00 -0.73 -1.23 119.26 118.54 3iv7 h ALA 229 Ca 0.16 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3iv7 h ALA 229 Cb 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3iv7 h ALA 229 CO -0.17 0.65 0.14 0.28 0.00 0.00 0.00 179.25 180.15 3iv7 h VAL 230 N 0.75 1.23 -0.27 0.00 2.07 -0.95 -0.14 116.25 118.94 3iv7 h VAL 230 Ca 0.07 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.71 3iv7 h VAL 230 Cb 0.94 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3iv7 h VAL 230 CO 0.09 0.31 0.01 -1.28 0.02 0.00 0.00 177.57 176.72 3iv7 h SER 231 N 0.84 0.45 -0.75 0.57 0.87 -1.06 -2.88 113.55 111.59 3iv7 h SER 231 Ca 0.18 -0.30 -0.06 0.00 -1.23 0.00 0.00 61.79 60.39 3iv7 h SER 231 Cb 0.30 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.11 3iv7 h SER 231 CO -0.00 0.64 0.25 0.15 -0.53 0.00 0.00 176.83 177.34 3iv7 h PHE 232 N 0.25 1.20 -0.17 2.24 3.57 -0.93 0.21 116.94 123.31 3iv7 h PHE 232 Ca 0.08 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 3iv7 h PHE 232 Cb 0.41 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3iv7 h PHE 232 CO 0.03 0.93 0.03 0.00 -2.23 0.00 0.00 178.31 177.07 3iv7 h ALA 233 N 1.15 1.73 0.01 2.41 0.00 -0.96 0.34 119.26 123.95 3iv7 h ALA 233 Ca 0.24 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 3iv7 h ALA 233 Cb 0.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3iv7 h ALA 233 CO -0.01 0.21 -0.85 1.03 0.00 0.00 0.00 179.25 179.63 3iv7 h SER 234 N 0.24 0.04 0.90 0.00 0.87 -1.25 -3.39 113.55 110.96 3iv7 h SER 234 Ca 0.06 -0.72 -0.07 0.00 -1.23 0.00 0.00 61.79 59.84 3iv7 h SER 234 Cb 0.12 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 3iv7 h SER 234 CO -0.00 1.34 -0.31 0.00 -0.53 0.00 0.00 176.83 177.33 3iv7 h ALA 235 N -0.27 1.00 0.00 6.23 0.00 -0.50 -3.43 119.26 122.29 3iv7 h ALA 235 Ca -0.22 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3iv7 h ALA 235 Cb 1.25 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3iv7 h ALA 235 CO -0.11 0.39 0.00 0.41 0.00 0.00 0.00 179.25 179.94 3iv7 n GLY 236 N 0.22 -1.57 3.69 0.00 0.00 0.10 -0.53 105.19 107.10 3iv7 n GLY 236 Ca -0.00 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 3iv7 n GLY 236 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iv7 s SER 237 N -4.13 7.03 0.00 1.61 0.01 -1.26 -4.48 113.70 112.48 3iv7 s SER 237 Ca 0.00 1.83 0.00 0.00 1.31 0.00 0.00 55.95 59.09 3iv7 s SER 237 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 3iv7 s SER 237 CO 0.00 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 173.66 3iv7 n GLY 238 N 3.40 2.01 0.25 3.44 0.00 -1.26 -4.51 105.19 108.51 3iv7 n GLY 238 Ca 0.11 -2.10 -0.03 0.00 0.00 0.00 0.00 46.02 44.01 3iv7 n GLY 238 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3iv7 h LEU 239 N 0.00 -0.64 -0.10 0.99 5.85 -1.91 -1.32 115.31 118.19 3iv7 h LEU 239 Ca 0.00 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.94 3iv7 h LEU 239 Cb 0.00 0.39 -0.06 0.00 0.37 0.00 0.00 40.66 41.36 3iv7 h LEU 239 CO 0.00 -0.22 -0.31 -0.74 -0.34 0.00 0.00 178.44 176.83 3iv7 h HIS 240 N -0.05 -0.86 -0.30 1.25 2.76 -1.94 -1.10 115.15 114.91 3iv7 h HIS 240 Ca 0.26 0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.43 3iv7 h HIS 240 Cb 0.44 0.39 -0.02 0.00 1.55 0.00 0.00 27.41 29.78 3iv7 h HIS 240 CO -0.49 -0.39 0.05 0.45 -1.30 0.00 0.00 177.93 176.24 3iv7 h HIS 241 N -0.41 0.44 -0.43 5.26 3.86 -1.68 -1.60 115.15 120.60 3iv7 h HIS 241 Ca 0.09 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.21 3iv7 h HIS 241 Cb 0.54 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.86 3iv7 h HIS 241 CO -0.38 0.41 0.04 0.87 0.86 0.00 0.00 177.93 179.73 3iv7 h LYS 242 N 0.43 0.73 -0.26 2.45 1.79 -0.91 0.17 116.57 120.98 3iv7 h LYS 242 Ca 0.10 -0.21 0.01 0.00 -2.18 0.00 0.00 60.65 58.37 3iv7 h LYS 242 Cb 0.21 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.77 3iv7 h LYS 242 CO 0.00 0.78 0.14 0.82 -1.08 0.00 0.00 179.45 180.11 3iv7 h ILE 243 N 0.58 1.02 -0.36 1.86 2.04 -0.69 -2.38 117.51 119.57 3iv7 h ILE 243 Ca 0.13 -0.10 -0.10 0.00 1.00 0.00 0.00 64.86 65.78 3iv7 h ILE 243 Cb 0.42 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 3iv7 h ILE 243 CO 0.01 0.05 -0.19 0.00 0.00 0.00 0.00 178.15 178.03 3iv7 h HIS 245 N 0.61 0.68 -0.11 0.00 -0.00 -0.47 0.47 115.15 116.33 3iv7 h HIS 245 Ca 0.09 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.44 3iv7 h HIS 245 Cb 0.66 -0.20 -0.00 0.00 -0.00 0.00 0.00 27.41 27.87 3iv7 h HIS 245 CO 0.03 0.28 -0.15 1.15 -0.00 0.00 0.00 177.93 179.24 3iv7 h THR 246 N 0.66 1.37 -0.71 6.26 2.02 -1.02 0.15 112.91 121.64 3iv7 h THR 246 Ca 0.34 -1.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 3iv7 h THR 246 Cb 0.31 2.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.69 3iv7 h THR 246 CO -0.24 0.39 0.39 -0.07 0.37 0.00 0.00 175.52 176.36 3iv7 h LEU 247 N -0.12 0.87 0.01 2.58 3.38 -0.92 0.37 115.31 121.48 3iv7 h LEU 247 Ca 0.01 -0.07 -0.20 0.00 0.09 0.00 0.00 57.88 57.71 3iv7 h LEU 247 Cb 0.69 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 41.24 3iv7 h LEU 247 CO 0.03 0.70 -0.79 1.23 0.09 0.00 0.00 178.44 179.71 3iv7 h GLY 248 N 1.03 0.58 0.93 0.83 0.00 -0.93 -2.12 103.07 103.40 3iv7 h GLY 248 Ca 0.25 -1.03 -0.18 0.00 0.00 0.00 0.00 47.33 46.36 3iv7 h GLY 248 CO -0.04 0.91 -0.70 -1.33 0.00 0.00 0.00 176.54 175.39 3iv7 h GLY 249 N 0.08 0.59 0.52 4.60 0.00 -0.27 -2.03 103.07 106.56 3iv7 h GLY 249 Ca -0.10 -0.97 -0.36 0.00 0.00 0.00 0.00 47.33 45.90 3iv7 h GLY 249 CO 0.15 0.86 -2.07 2.41 0.00 0.00 0.00 176.54 177.90 3iv7 n THR 250 N -4.12 1.66 0.35 4.70 -1.04 0.13 -4.52 114.28 111.44 3iv7 n THR 250 Ca -0.10 -0.68 0.06 0.00 -2.04 0.00 0.00 64.05 61.29 3iv7 n THR 250 Cb 0.71 -1.44 0.07 0.00 -1.82 0.00 0.00 70.33 67.85 3iv7 n THR 250 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3iv7 n PHE 251 N -3.30 0.09 -3.09 -1.42 3.01 -1.05 -5.00 117.46 106.70 3iv7 n PHE 251 Ca -0.32 -0.09 -0.19 0.00 1.01 0.00 0.00 57.45 57.85 3iv7 n PHE 251 Cb 1.05 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.51 3iv7 n PHE 251 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3iv7 n ASN 252 N 0.63 -3.70 -4.80 4.37 0.23 -0.76 -4.91 115.26 106.31 3iv7 n ASN 252 Ca 0.08 -0.20 -0.33 0.00 -0.53 0.00 0.00 54.58 53.59 3iv7 n ASN 252 Cb 0.31 -3.09 -0.01 0.00 -2.08 0.00 0.00 39.78 34.92 3iv7 n ASN 252 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3iv7 s LEU 253 N -6.21 3.63 0.16 -4.53 1.43 -0.92 -4.95 118.68 107.29 3iv7 s LEU 253 Ca 0.28 1.83 -0.31 0.00 -1.03 0.00 0.00 54.13 54.90 3iv7 s LEU 253 Cb -0.15 -4.54 -0.11 0.00 0.03 0.00 0.00 46.19 41.42 3iv7 s LEU 253 CO 0.35 -0.97 1.74 -2.16 0.23 0.00 0.00 176.35 175.54 3iv7 s PRO 254 N -3.78 4.14 0.03 1.29 0.04 -1.26 -4.51 135.00 130.96 3iv7 s PRO 254 Ca 0.64 2.56 -0.10 0.00 0.04 0.00 0.00 61.00 64.14 3iv7 s PRO 254 Cb -0.15 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.01 3iv7 s PRO 254 CO 0.30 -0.77 1.17 1.25 0.04 0.00 0.00 177.00 178.99 3iv7 h HIS 255 N 7.63 -0.48 -0.58 0.56 2.76 -1.98 -2.14 115.15 120.92 3iv7 h HIS 255 Ca -0.44 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.75 3iv7 h HIS 255 Cb 1.21 0.21 -0.03 0.00 1.55 0.00 0.00 27.41 30.35 3iv7 h HIS 255 CO 0.71 -0.17 0.37 0.00 -1.30 0.00 0.00 177.93 177.53 3iv7 h ALA 256 N -1.16 0.74 0.00 5.26 0.00 -1.92 -2.01 119.26 120.17 3iv7 h ALA 256 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3iv7 h ALA 256 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3iv7 h ALA 256 CO -0.11 0.20 -0.29 1.96 0.00 0.00 0.00 179.25 181.00 3iv7 h GLN 257 N 0.78 0.00 -0.02 0.00 7.50 -1.82 0.01 115.11 121.56 3iv7 h GLN 257 Ca 0.21 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.29 3iv7 h GLN 257 Cb -0.05 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.48 3iv7 h GLN 257 CO -0.04 0.29 -0.26 1.15 -1.50 0.00 0.00 178.83 178.47 3iv7 h THR 258 N 0.00 1.50 -0.16 -0.54 2.02 -0.91 -0.99 112.91 113.83 3iv7 h THR 258 Ca -0.00 -1.83 0.03 0.00 0.77 0.00 0.00 66.41 65.38 3iv7 h THR 258 Cb 0.65 2.60 -0.03 0.00 -1.74 0.00 0.00 68.15 69.63 3iv7 h THR 258 CO 0.04 0.51 -0.05 0.45 0.37 0.00 0.00 175.52 176.84 3iv7 h HIS 259 N -0.39 -0.11 -0.63 3.16 3.86 -1.18 -0.10 115.15 119.76 3iv7 h HIS 259 Ca -0.03 0.02 0.12 0.00 -1.16 0.00 0.00 60.37 59.32 3iv7 h HIS 259 Cb 0.97 0.07 -0.09 0.00 1.06 0.00 0.00 27.41 29.42 3iv7 h HIS 259 CO 0.16 -0.08 0.16 0.00 0.86 0.00 0.00 177.93 179.03 3iv7 h ALA 260 N 1.14 0.78 0.01 2.45 0.00 -0.96 -1.95 119.26 120.73 3iv7 h ALA 260 Ca 0.08 0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 3iv7 h ALA 260 Cb 0.13 0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3iv7 h ALA 260 CO -0.17 -0.28 -0.61 1.15 0.00 0.00 0.00 179.25 179.33 3iv7 h THR 261 N 0.30 1.44 -0.15 0.00 2.02 -0.80 -3.32 112.91 112.39 3iv7 h THR 261 Ca 0.34 -2.11 -0.10 0.00 0.77 0.00 0.00 66.41 65.31 3iv7 h THR 261 Cb 0.50 2.64 -0.01 0.00 -1.74 0.00 0.00 68.15 69.54 3iv7 h THR 261 CO -0.40 0.61 -0.35 0.58 0.37 0.00 0.00 175.52 176.33 3iv7 h VAL 262 N -0.13 1.29 -0.45 3.16 2.07 -0.87 -3.37 116.25 117.95 3iv7 h VAL 262 Ca -0.08 -1.39 0.06 0.00 0.82 0.00 0.00 66.70 66.11 3iv7 h VAL 262 Cb 1.33 1.56 -0.09 0.00 -1.52 0.00 0.00 31.29 32.57 3iv7 h VAL 262 CO 0.12 0.42 -0.52 0.25 0.02 0.00 0.00 177.57 177.86 3iv7 h LEU 263 N 0.26 -1.76 -2.12 2.57 5.85 -1.46 -1.99 115.31 116.68 3iv7 h LEU 263 Ca 0.03 0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 3iv7 h LEU 263 Cb 0.74 0.74 -0.00 0.00 0.37 0.00 0.00 40.66 42.51 3iv7 h LEU 263 CO 0.06 -0.39 -0.03 1.55 -0.34 0.00 0.00 178.44 179.29 3iv7 h PRO 264 N -0.35 0.00 -0.13 5.25 0.13 -1.79 -1.76 132.00 133.35 3iv7 h PRO 264 Ca 0.10 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.05 3iv7 h PRO 264 Cb 0.59 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.72 3iv7 h PRO 264 CO -0.62 0.03 -0.63 1.88 -0.23 0.00 0.00 178.00 178.44 3iv7 h TYR 265 N 0.00 0.88 -0.62 1.56 0.05 -1.60 -1.51 116.97 115.74 3iv7 h TYR 265 Ca -0.00 -0.39 -0.04 0.00 0.05 0.00 0.00 58.73 58.36 3iv7 h TYR 265 Cb 0.07 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.64 3iv7 h TYR 265 CO 0.00 1.19 0.24 0.28 -1.05 0.00 0.00 178.16 178.82 3iv7 h VAL 266 N 0.31 1.23 -0.46 -2.88 2.07 -1.10 0.18 116.25 115.61 3iv7 h VAL 266 Ca -0.04 -0.73 0.01 0.00 0.82 0.00 0.00 66.70 66.76 3iv7 h VAL 266 Cb 1.26 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3iv7 h VAL 266 CO 0.13 0.28 0.29 0.25 0.02 0.00 0.00 177.57 178.54 3iv7 h LEU 267 N 0.86 0.49 -0.58 2.57 5.85 -1.28 0.96 115.31 124.18 3iv7 h LEU 267 Ca 0.20 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.80 3iv7 h LEU 267 Cb 0.21 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3iv7 h LEU 267 CO -0.02 0.35 -0.14 0.00 -0.34 0.00 0.00 178.44 178.30 3iv7 h ALA 268 N 1.19 0.78 -0.14 1.25 0.00 -0.94 0.22 119.26 121.61 3iv7 h ALA 268 Ca 0.18 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3iv7 h ALA 268 Cb -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3iv7 h ALA 268 CO -0.06 0.67 0.08 0.35 0.00 0.00 0.00 179.25 180.29 3iv7 h PHE 269 N 0.87 0.19 0.00 0.00 3.57 -0.26 -3.29 116.94 118.03 3iv7 h PHE 269 Ca 0.13 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 3iv7 h PHE 269 Cb 0.70 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 3iv7 h PHE 269 CO 0.05 0.18 -1.02 0.09 -2.23 0.00 0.00 178.31 175.38 3iv7 n ASN 270 N -4.95 0.84 -0.12 0.41 3.02 0.30 -4.54 115.26 110.22 3iv7 n ASN 270 Ca -0.05 0.33 -0.04 0.00 -0.03 0.00 0.00 54.58 54.79 3iv7 n ASN 270 Cb 0.06 0.46 0.03 0.00 -0.61 0.00 0.00 39.78 39.72 3iv7 n ASN 270 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3iv7 h ALA 271 N 2.00 0.36 -0.84 5.41 0.00 -0.64 -1.23 119.26 124.32 3iv7 h ALA 271 Ca -0.00 0.13 0.14 0.00 0.00 0.00 0.00 54.91 55.18 3iv7 h ALA 271 Cb 1.00 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 3iv7 h ALA 271 CO 0.00 -0.40 0.55 0.78 0.00 0.00 0.00 179.25 180.17 3iv7 h GLY 272 N 0.09 1.04 -0.02 0.00 0.00 -1.80 -1.67 103.07 100.71 3iv7 h GLY 272 Ca 0.20 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3iv7 h GLY 272 CO -0.35 0.09 -0.44 1.22 0.00 0.00 0.00 176.54 177.06 3iv7 n ASP 273 N -4.53 1.23 -3.15 0.19 8.00 -0.56 -4.37 116.55 113.36 3iv7 n ASP 273 Ca 0.16 -0.98 -0.25 0.00 0.71 0.00 0.00 54.79 54.42 3iv7 n ASP 273 Cb 0.48 0.34 -0.05 0.00 -0.02 0.00 0.00 41.12 41.86 3iv7 n ASP 273 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3iv7 n ALA 274 N -0.69 3.90 -0.06 2.24 0.00 -0.63 -4.81 120.51 120.47 3iv7 n ALA 274 Ca 0.09 -4.42 0.04 0.00 0.00 0.00 0.00 53.44 49.15 3iv7 n ALA 274 Cb 0.38 -0.82 0.39 0.00 0.00 0.00 0.00 19.45 19.40 3iv7 n ALA 274 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3iv7 h PRO 275 N 3.46 0.63 -0.16 0.00 0.13 -1.76 0.16 132.00 134.46 3iv7 h PRO 275 Ca 0.14 -0.04 -0.09 0.00 -0.87 0.00 0.00 66.00 65.15 3iv7 h PRO 275 Cb 0.65 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.64 3iv7 h PRO 275 CO 0.75 0.41 -0.23 0.93 -0.23 0.00 0.00 178.00 179.63 3iv7 h GLU 276 N 0.65 0.45 -0.83 0.86 5.08 -1.93 -1.06 114.58 117.79 3iv7 h GLU 276 Ca 0.20 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3iv7 h GLU 276 Cb -0.00 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 3iv7 h GLU 276 CO -0.05 0.85 0.55 0.00 -1.00 0.00 0.00 179.01 179.36 3iv7 h ALA 277 N 0.59 1.06 -0.48 3.43 0.00 -1.77 -1.70 119.26 120.40 3iv7 h ALA 277 Ca 0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3iv7 h ALA 277 Cb 0.80 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3iv7 h ALA 277 CO 0.05 0.44 0.30 1.49 0.00 0.00 0.00 179.25 181.53 3iv7 h GLU 278 N 1.11 0.65 -0.38 0.00 4.22 -0.79 -1.56 114.58 117.83 3iv7 h GLU 278 Ca 0.31 -0.05 -0.13 0.00 0.08 0.00 0.00 59.36 59.56 3iv7 h GLU 278 Cb -0.10 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 3iv7 h GLU 278 CO -0.08 0.46 -0.29 0.00 -2.18 0.00 0.00 179.01 176.92 3iv7 h ARG 279 N 0.64 0.82 -0.43 1.92 3.08 -0.83 -1.01 114.38 118.56 3iv7 h ARG 279 Ca 0.17 -0.37 -0.04 0.00 0.07 0.00 0.00 59.98 59.81 3iv7 h ARG 279 Cb -0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3iv7 h ARG 279 CO -0.03 1.00 0.10 -0.09 -1.07 0.00 0.00 179.97 179.88 3iv7 h ARG 280 N 0.70 0.69 -0.49 0.04 2.43 -1.09 -0.48 114.38 116.18 3iv7 h ARG 280 Ca 0.08 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3iv7 h ARG 280 Cb 0.84 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.27 3iv7 h ARG 280 CO 0.07 0.70 0.27 0.00 -1.51 0.00 0.00 179.97 179.51 3iv7 h ALA 281 N 0.96 0.62 -0.17 2.80 0.00 -1.16 -0.90 119.26 121.41 3iv7 h ALA 281 Ca 0.13 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3iv7 h ALA 281 Cb 0.33 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 3iv7 h ALA 281 CO 0.00 0.13 -0.17 0.00 0.00 0.00 0.00 179.25 179.22 3iv7 h ALA 282 N 1.12 -0.06 -0.77 0.00 0.00 -0.88 -0.01 119.26 118.66 3iv7 h ALA 282 Ca 0.17 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.16 3iv7 h ALA 282 Cb 0.03 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 3iv7 h ALA 282 CO -0.03 -0.60 0.51 0.00 0.00 0.00 0.00 179.25 179.13 3iv7 h ALA 283 N 0.90 1.48 -0.17 0.00 0.00 -0.83 0.10 119.26 120.74 3iv7 h ALA 283 Ca 0.11 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 3iv7 h ALA 283 Cb 0.35 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3iv7 h ALA 283 CO -0.28 0.47 -0.34 0.00 0.00 0.00 0.00 179.25 179.09 3iv7 h ALA 284 N 1.53 1.11 0.00 0.00 0.00 -0.29 -2.70 119.26 118.91 3iv7 h ALA 284 Ca 0.29 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 3iv7 h ALA 284 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3iv7 h ALA 284 CO -0.07 0.57 -0.46 0.74 0.00 0.00 0.00 179.25 180.02 3iv7 h PHE 285 N 0.30 0.00 0.00 0.00 0.04 -0.25 -3.36 116.94 113.67 3iv7 h PHE 285 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 3iv7 h PHE 285 Cb 0.75 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.90 3iv7 h PHE 285 CO 0.02 0.46 0.00 0.41 -0.60 0.00 0.00 178.31 178.60 3iv7 n GLY 286 N 1.12 0.57 3.42 -1.45 0.00 0.28 -5.00 105.19 104.13 3iv7 n GLY 286 Ca 0.02 -0.81 -0.21 0.00 0.00 0.00 0.00 46.02 45.02 3iv7 n GLY 286 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3iv7 s THR 287 N -2.00 1.68 0.35 2.61 -4.23 -0.77 -5.02 115.64 108.27 3iv7 s THR 287 Ca 0.00 -2.14 0.12 0.00 -1.18 0.00 0.00 61.69 58.49 3iv7 s THR 287 Cb 0.00 -2.41 0.07 0.00 1.34 0.00 0.00 72.50 71.50 3iv7 s THR 287 CO 0.00 -0.33 1.79 0.44 -0.54 0.00 0.00 174.62 175.98 3iv7 h ASP 288 N 2.30 0.00 -3.57 3.99 5.19 -1.98 -3.35 116.42 119.00 3iv7 h ASP 288 Ca -0.40 -0.00 -0.45 0.00 -0.62 0.00 0.00 57.03 55.56 3iv7 h ASP 288 Cb 1.23 -0.00 -0.16 0.00 0.18 0.00 0.00 39.33 40.58 3iv7 h ASP 288 CO 0.67 0.42 -0.75 0.42 -3.12 0.00 0.00 179.24 176.87 3iv7 s THR 289 N -4.09 1.61 0.09 0.35 -4.23 -1.26 -4.92 115.64 103.20 3iv7 s THR 289 Ca -0.03 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.38 3iv7 s THR 289 Cb 0.14 -1.85 -0.21 0.00 1.34 0.00 0.00 72.50 71.92 3iv7 s THR 289 CO 0.73 -0.49 1.24 0.00 -0.54 0.00 0.00 174.62 175.56 3iv7 h ALA 290 N 3.00 0.22 -0.65 3.99 0.00 -1.86 -2.66 119.26 121.30 3iv7 h ALA 290 Ca -0.39 -0.69 -0.07 0.00 0.00 0.00 0.00 54.91 53.75 3iv7 h ALA 290 Cb 1.21 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 3iv7 h ALA 290 CO 0.56 0.72 0.12 1.25 0.00 0.00 0.00 179.25 181.90 3iv7 h LEU 291 N 0.36 1.02 0.00 0.00 5.85 -1.95 -0.24 115.31 120.36 3iv7 h LEU 291 Ca -0.11 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.39 3iv7 h LEU 291 Cb 1.63 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 3iv7 h LEU 291 CO 0.19 1.01 -0.08 -0.08 -0.34 0.00 0.00 178.44 179.14 3iv7 h GLU 292 N 1.00 -0.13 -0.24 1.25 4.81 -1.99 0.23 114.58 119.51 3iv7 h GLU 292 Ca 0.20 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.50 3iv7 h GLU 292 Cb 0.42 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.76 3iv7 h GLU 292 CO 0.01 -0.09 -0.24 0.78 -0.73 0.00 0.00 179.01 178.75 3iv7 h GLY 293 N -0.14 -0.15 0.96 1.92 0.00 -1.07 -1.72 103.07 102.88 3iv7 h GLY 293 Ca 0.03 0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.65 3iv7 h GLY 293 CO -0.08 -0.20 0.15 -2.00 0.00 0.00 0.00 176.54 174.42 3iv7 h LEU 294 N -0.24 0.34 -0.75 3.11 5.85 -0.77 -2.30 115.31 120.55 3iv7 h LEU 294 Ca 0.14 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 3iv7 h LEU 294 Cb 0.45 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 3iv7 h LEU 294 CO -0.38 0.32 0.46 1.56 -0.34 0.00 0.00 178.44 180.06 3iv7 h GLN 295 N 0.33 1.01 -0.59 1.25 1.08 -0.70 0.20 115.11 117.70 3iv7 h GLN 295 Ca 0.10 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 3iv7 h GLN 295 Cb 0.05 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.24 3iv7 h GLN 295 CO -0.02 0.71 0.29 -0.09 -0.95 0.00 0.00 178.83 178.78 3iv7 h ARG 296 N 1.02 0.84 -0.14 1.46 2.43 -1.24 0.42 114.38 119.17 3iv7 h ARG 296 Ca 0.27 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 3iv7 h ARG 296 Cb -0.05 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 3iv7 h ARG 296 CO -0.05 0.67 0.06 1.25 -1.51 0.00 0.00 179.97 180.39 3iv7 h LEU 297 N 0.80 0.20 -0.50 3.80 5.85 -0.84 -0.99 115.31 123.62 3iv7 h LEU 297 Ca 0.20 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.83 3iv7 h LEU 297 Cb 0.10 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 3iv7 h LEU 297 CO -0.03 0.29 0.23 0.03 -0.34 0.00 0.00 178.44 178.62 3iv7 h ARG 298 N 0.09 0.44 0.05 1.25 3.08 -0.32 -1.10 114.38 117.86 3iv7 h ARG 298 Ca 0.05 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 3iv7 h ARG 298 Cb 0.15 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3iv7 h ARG 298 CO -0.00 0.29 -0.02 1.25 -1.07 0.00 0.00 179.97 180.41 3iv7 h LEU 299 N 0.45 -0.05 -1.87 3.04 6.46 -0.82 -0.36 115.31 122.15 3iv7 h LEU 299 Ca 0.22 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.96 3iv7 h LEU 299 Cb 0.17 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 3iv7 h LEU 299 CO -0.18 -0.01 0.00 0.77 -0.62 0.00 0.00 178.44 178.41 3iv7 h SER 300 N -0.09 0.00 -0.12 1.25 4.64 -0.60 -2.52 113.55 116.11 3iv7 h SER 300 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3iv7 h SER 300 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3iv7 h SER 300 CO 0.01 0.00 0.00 0.52 -0.87 0.00 0.00 176.83 176.49 3iv7 n VAL 301 N -2.72 0.46 -3.97 0.95 0.31 -0.47 -4.92 118.33 107.97 3iv7 n VAL 301 Ca -0.01 -0.73 -0.26 0.00 -0.01 0.00 0.00 64.34 63.33 3iv7 n VAL 301 Cb 0.13 0.86 -0.02 0.00 -0.91 0.00 0.00 33.84 33.91 3iv7 n VAL 301 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3iv7 n ASN 302 N 0.33 -0.86 -4.72 4.52 5.15 -0.24 -4.94 115.26 114.50 3iv7 n ASN 302 Ca 0.06 -0.99 -0.32 0.00 -0.60 0.00 0.00 54.58 52.74 3iv7 n ASN 302 Cb 0.28 -3.12 0.11 0.00 -0.53 0.00 0.00 39.78 36.52 3iv7 n ASN 302 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3iv7 s ALA 303 N -3.85 1.97 0.45 5.20 0.00 -0.64 -4.96 121.76 119.94 3iv7 s ALA 303 Ca 0.11 0.55 -0.25 0.00 0.00 0.00 0.00 51.96 52.37 3iv7 s ALA 303 Cb -0.06 -3.38 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 3iv7 s ALA 303 CO 0.89 -2.09 1.33 -2.30 0.00 0.00 0.00 175.76 173.58 3iv7 n PRO 304 N -3.48 1.98 -0.00 0.00 -0.02 -1.26 -4.95 135.00 127.26 3iv7 n PRO 304 Ca 0.11 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3iv7 n PRO 304 Cb 0.52 -2.48 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 3iv7 n PRO 304 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3iv7 n LYS 305 N -0.19 1.61 -3.79 -0.52 4.76 -1.26 -4.44 118.16 114.32 3iv7 n LYS 305 Ca 0.07 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.37 3iv7 n LYS 305 Cb 0.41 -1.04 -0.14 0.00 -1.84 0.00 0.00 35.03 32.42 3iv7 n LYS 305 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3iv7 s ARG 306 N -2.08 0.06 0.44 1.97 0.52 -1.26 -3.79 118.95 114.81 3iv7 s ARG 306 Ca -0.01 0.22 0.24 0.00 -0.52 0.00 0.00 55.73 55.66 3iv7 s ARG 306 Cb 0.01 -0.11 0.84 0.00 0.52 0.00 0.00 34.95 36.21 3iv7 s ARG 306 CO 0.06 -0.10 1.79 -0.07 0.02 0.00 0.00 175.30 177.00 3iv7 h LEU 307 N 6.76 0.00 -2.46 2.53 3.38 -0.99 -2.68 115.31 121.85 3iv7 h LEU 307 Ca -0.36 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 3iv7 h LEU 307 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 3iv7 h LEU 307 CO 0.45 0.21 -0.02 0.77 0.09 0.00 0.00 178.44 179.95 3iv7 h SER 308 N 0.00 0.00 0.75 -0.43 4.64 -1.34 -1.33 113.55 115.84 3iv7 h SER 308 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3iv7 h SER 308 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 3iv7 h SER 308 CO 0.03 0.02 0.00 0.47 -0.87 0.00 0.00 176.83 176.47 3iv7 n ASP 309 N -3.22 0.00 -0.44 4.97 8.00 -1.01 -2.96 116.55 121.89 3iv7 n ASP 309 Ca -0.02 0.30 0.09 0.00 0.71 0.00 0.00 54.79 55.87 3iv7 n ASP 309 Cb 0.15 -0.43 0.18 0.00 -0.02 0.00 0.00 41.12 41.00 3iv7 n ASP 309 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3iv7 n TYR 310 N -1.43 0.42 0.00 1.24 4.01 -0.52 -4.99 117.16 115.89 3iv7 n TYR 310 Ca 0.08 -0.90 0.00 0.00 -0.16 0.00 0.00 57.90 56.92 3iv7 n TYR 310 Cb 0.27 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 3iv7 n TYR 310 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iv7 n GLY 311 N -0.92 1.67 3.74 2.72 0.00 -1.15 -4.79 105.19 106.46 3iv7 n GLY 311 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3iv7 n GLY 311 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3iv7 s PHE 312 N -2.36 2.99 0.27 1.61 5.36 -1.11 -4.98 117.98 119.75 3iv7 s PHE 312 Ca 0.00 0.96 0.11 0.00 -0.96 0.00 0.00 56.93 57.04 3iv7 s PHE 312 Cb 0.00 -3.86 -0.05 0.00 -0.34 0.00 0.00 43.02 38.77 3iv7 s PHE 312 CO 0.00 -2.85 -0.11 -1.21 -1.46 0.00 0.00 175.22 169.59 3iv7 s GLU 313 N -0.25 1.95 0.43 10.12 2.02 -1.26 -3.99 118.70 127.73 3iv7 s GLU 313 Ca 0.61 -1.59 0.14 0.00 0.02 0.00 0.00 54.97 54.15 3iv7 s GLU 313 Cb -0.43 -1.96 1.03 0.00 0.10 0.00 0.00 34.13 32.88 3iv7 s GLU 313 CO 0.43 0.35 1.97 0.00 0.02 0.00 0.00 175.26 178.03 3iv7 h ALA 314 N 2.18 2.04 0.00 5.21 0.00 -1.98 -0.74 119.26 125.98 3iv7 h ALA 314 Ca -0.42 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 3iv7 h ALA 314 Cb 1.25 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3iv7 h ALA 314 CO 0.59 -0.18 -0.00 0.66 0.00 0.00 0.00 179.25 180.32 3iv7 h SER 315 N 0.41 0.00 0.07 0.00 4.64 -2.01 -2.29 113.55 114.37 3iv7 h SER 315 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3iv7 h SER 315 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3iv7 h SER 315 CO -0.08 0.00 -0.11 0.61 -0.87 0.00 0.00 176.83 176.38 3iv7 n GLY 316 N -0.81 -0.12 0.20 -0.77 0.00 -0.28 -4.39 105.19 99.01 3iv7 n GLY 316 Ca -0.02 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 3iv7 n GLY 316 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3iv7 h ILE 317 N 2.17 1.34 0.30 -0.61 2.04 -1.50 -1.91 117.51 119.34 3iv7 h ILE 317 Ca 0.00 -1.89 -0.01 0.00 1.00 0.00 0.00 64.86 63.96 3iv7 h ILE 317 Cb 0.55 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 3iv7 h ILE 317 CO 0.00 0.58 -0.19 0.00 0.00 0.00 0.00 178.15 178.54 3iv7 h ALA 318 N 1.01 -0.46 -0.74 1.87 0.00 -1.79 0.42 119.26 119.58 3iv7 h ALA 318 Ca -0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3iv7 h ALA 318 Cb 1.13 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 3iv7 h ALA 318 CO 0.11 -0.77 0.22 1.49 0.00 0.00 0.00 179.25 180.30 3iv7 h GLU 319 N -0.47 1.15 -0.00 0.00 4.81 -1.84 -0.12 114.58 118.10 3iv7 h GLU 319 Ca -0.03 -0.25 0.03 0.00 -0.13 0.00 0.00 59.36 58.98 3iv7 h GLU 319 Cb 0.39 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 3iv7 h GLU 319 CO 0.03 0.98 -0.22 0.00 -0.73 0.00 0.00 179.01 179.07 3iv7 h ALA 320 N 1.11 -0.28 -0.43 2.92 0.00 -1.06 -0.93 119.26 120.60 3iv7 h ALA 320 Ca 0.24 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.15 3iv7 h ALA 320 Cb 0.32 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3iv7 h ALA 320 CO -0.01 -0.72 0.28 0.28 0.00 0.00 0.00 179.25 179.09 3iv7 h VAL 321 N -0.35 1.11 -0.40 0.00 2.07 -0.81 -2.48 116.25 115.38 3iv7 h VAL 321 Ca 0.06 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.45 3iv7 h VAL 321 Cb 0.43 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 3iv7 h VAL 321 CO -0.20 0.11 0.07 -0.78 0.02 0.00 0.00 177.57 176.78 3iv7 h ASP 322 N 0.58 -0.02 -0.18 0.57 3.58 -0.47 -0.92 116.42 119.56 3iv7 h ASP 322 Ca 0.16 0.07 -0.19 0.00 0.42 0.00 0.00 57.03 57.49 3iv7 h ASP 322 Cb -0.06 0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.09 3iv7 h ASP 322 CO -0.04 0.03 -0.62 0.58 -2.88 0.00 0.00 179.24 176.31 3iv7 h VAL 323 N 0.19 1.28 0.05 2.25 2.07 -1.14 -3.34 116.25 117.61 3iv7 h VAL 323 Ca 0.19 -1.83 -0.24 0.00 0.82 0.00 0.00 66.70 65.64 3iv7 h VAL 323 Cb 0.24 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3iv7 h VAL 323 CO -0.27 0.59 -1.05 0.74 0.02 0.00 0.00 177.57 177.60 3iv7 h THR 324 N 0.59 1.43 -0.74 2.57 2.02 -1.22 -3.37 112.91 114.19 3iv7 h THR 324 Ca -0.01 -2.64 0.17 0.00 0.77 0.00 0.00 66.41 64.70 3iv7 h THR 324 Cb 1.23 2.59 -0.12 0.00 -1.74 0.00 0.00 68.15 70.11 3iv7 h THR 324 CO 0.13 0.78 0.07 0.25 0.37 0.00 0.00 175.52 177.12 3iv7 h LEU 325 N 0.18 -0.22 -1.44 2.58 5.85 -1.29 0.22 115.31 121.19 3iv7 h LEU 325 Ca -0.10 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3iv7 h LEU 325 Cb 1.71 0.29 -0.00 0.00 0.37 0.00 0.00 40.66 43.03 3iv7 h LEU 325 CO 0.18 -0.13 -0.09 1.05 -0.34 0.00 0.00 178.44 179.11 3iv7 h GLU 326 N 0.15 0.00 0.00 1.25 4.11 -1.79 -2.80 114.58 115.51 3iv7 h GLU 326 Ca 0.41 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.77 3iv7 h GLU 326 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3iv7 h GLU 326 CO -0.60 0.09 -0.34 0.87 0.07 0.00 0.00 179.01 179.10 3iv7 h LYS 327 N 0.00 0.00 -6.68 1.06 1.57 -0.75 -3.47 116.57 108.30 3iv7 h LYS 327 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3iv7 h LYS 327 Cb 0.56 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.92 3iv7 h LYS 327 CO 0.01 0.34 0.86 0.08 -0.57 0.00 0.00 179.45 180.16 3iv7 s VAL 328 N -3.31 2.49 0.35 0.50 1.01 -1.06 -4.94 120.40 115.43 3iv7 s VAL 328 Ca 0.03 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 62.10 3iv7 s VAL 328 Cb 0.09 -3.24 -0.11 0.00 0.00 0.00 0.00 36.38 33.12 3iv7 s VAL 328 CO 0.69 0.04 1.44 -2.84 0.00 0.00 0.00 175.10 174.44 3iv7 s PRO 329 N 0.43 4.19 0.48 2.72 0.02 -1.26 -4.87 135.00 136.70 3iv7 s PRO 329 Ca 0.66 2.46 0.20 0.00 0.02 0.00 0.00 61.00 64.34 3iv7 s PRO 329 Cb -0.44 -3.01 1.21 0.00 0.02 0.00 0.00 34.50 32.28 3iv7 s PRO 329 CO 0.38 -0.44 1.96 0.00 -0.33 0.00 0.00 177.00 178.57 3iv7 h ALA 330 N 3.40 2.29 -0.39 -1.55 0.00 -1.97 -1.59 119.26 119.45 3iv7 h ALA 330 Ca -0.50 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 3iv7 h ALA 330 Cb 1.23 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 3iv7 h ALA 330 CO 0.67 -0.46 0.06 0.27 0.00 0.00 0.00 179.25 179.79 3iv7 n ASN 331 N -4.43 3.83 -4.75 0.00 6.94 -1.26 -4.93 115.26 110.67 3iv7 n ASN 331 Ca 0.12 -2.63 -0.41 0.00 -0.02 0.00 0.00 54.58 51.63 3iv7 n ASN 331 Cb 0.55 -0.63 -0.02 0.00 -2.36 0.00 0.00 39.78 37.32 3iv7 n ASN 331 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 3iv7 s ASN 332 N -0.46 6.42 0.31 0.53 2.47 -0.60 -4.87 114.94 118.74 3iv7 s ASN 332 Ca 0.34 2.89 0.07 0.00 0.42 0.00 0.00 52.86 56.58 3iv7 s ASN 332 Cb 0.26 -2.63 0.77 0.00 -1.45 0.00 0.00 41.25 38.20 3iv7 s ASN 332 CO 0.09 -0.88 1.77 -0.65 -3.72 0.00 0.00 177.10 173.71 3iv7 h PRO 333 N 4.94 0.70 -5.22 0.43 0.11 -1.88 -3.38 132.00 127.71 3iv7 h PRO 333 Ca -0.47 -0.04 -0.64 0.00 0.11 0.00 0.00 66.00 64.96 3iv7 h PRO 333 Cb 1.22 -0.16 -0.23 0.00 0.11 0.00 0.00 31.00 31.94 3iv7 h PRO 333 CO 0.80 0.47 -0.68 0.50 -0.21 0.00 0.00 178.00 178.87 3iv7 s ARG 334 N -5.84 3.60 0.03 1.05 3.52 -1.26 -4.84 118.95 115.21 3iv7 s ARG 334 Ca -0.11 -0.55 -0.33 0.00 -0.13 0.00 0.00 55.73 54.61 3iv7 s ARG 334 Cb 0.25 -2.94 -0.12 0.00 -1.56 0.00 0.00 34.95 30.58 3iv7 s ARG 334 CO 0.80 0.13 1.78 -2.30 -0.81 0.00 0.00 175.30 174.90 3iv7 n PRO 335 N 3.86 2.29 -3.25 5.12 -0.02 -1.26 -4.94 135.00 136.80 3iv7 n PRO 335 Ca -0.17 0.83 -0.39 0.00 -2.02 0.00 0.00 63.50 61.75 3iv7 n PRO 335 Cb 0.52 -2.66 -0.06 0.00 -0.02 0.00 0.00 33.50 31.28 3iv7 n PRO 335 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3iv7 s VAL 336 N 2.84 4.99 0.21 -1.45 1.01 -1.26 -5.02 120.40 121.72 3iv7 s VAL 336 Ca 0.86 1.15 0.06 0.00 0.00 0.00 0.00 61.98 64.06 3iv7 s VAL 336 Cb -0.65 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 3iv7 s VAL 336 CO 0.45 0.40 -0.10 0.42 0.00 0.00 0.00 175.10 176.27 3iv7 s THR 337 N -0.02 1.48 0.25 3.92 -4.23 -1.26 -5.01 115.64 110.77 3iv7 s THR 337 Ca 0.30 -2.14 -0.03 0.00 -1.18 0.00 0.00 61.69 58.64 3iv7 s THR 337 Cb -0.17 -2.10 0.23 0.00 1.34 0.00 0.00 72.50 71.79 3iv7 s THR 337 CO 0.15 -0.55 1.74 -0.09 -0.54 0.00 0.00 174.62 175.34 3iv7 h ARG 338 N 2.56 0.51 -0.21 3.99 2.43 -1.98 -0.44 114.38 121.24 3iv7 h ARG 338 Ca -0.38 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 58.64 3iv7 h ARG 338 Cb 1.22 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 3iv7 h ARG 338 CO 0.64 0.34 -0.35 0.93 -1.51 0.00 0.00 179.97 180.01 3iv7 h GLU 339 N 0.52 0.62 0.00 0.20 3.07 -1.99 -0.33 114.58 116.67 3iv7 h GLU 339 Ca 0.43 -0.38 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 3iv7 h GLU 339 Cb 0.63 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 3iv7 h GLU 339 CO -0.38 0.99 0.00 -2.95 -1.40 0.00 0.00 179.01 175.27 3iv7 h ASN 340 N 0.30 0.00 0.76 1.42 7.08 -1.89 -2.02 115.58 121.23 3iv7 h ASN 340 Ca 0.02 0.00 -0.25 0.00 -3.08 0.00 0.00 56.30 52.98 3iv7 h ASN 340 Cb 0.94 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.16 3iv7 h ASN 340 CO 0.08 0.00 -1.21 0.25 -2.08 0.00 0.00 177.43 174.47 3iv7 h LEU 341 N 0.00 0.21 -0.65 6.14 5.85 -1.05 -2.73 115.31 123.07 3iv7 h LEU 341 Ca 0.00 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.42 3iv7 h LEU 341 Cb 0.98 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 3iv7 h LEU 341 CO 0.00 1.19 0.16 0.28 -0.34 0.00 0.00 178.44 179.73 3iv7 h SER 342 N 0.04 0.99 0.01 1.25 0.02 -0.87 -2.53 113.55 112.46 3iv7 h SER 342 Ca -0.11 -0.23 -0.10 0.00 -0.84 0.00 0.00 61.79 60.51 3iv7 h SER 342 Cb 1.89 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 64.16 3iv7 h SER 342 CO 0.16 0.96 -0.31 -0.09 -1.14 0.00 0.00 176.83 176.42 3iv7 h ARG 343 N 0.97 0.43 0.02 3.45 9.65 -1.40 -1.36 114.38 126.14 3iv7 h ARG 343 Ca 0.21 -0.18 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3iv7 h ARG 343 Cb 0.36 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 3iv7 h ARG 343 CO 0.00 0.70 -0.01 1.25 2.80 0.00 0.00 179.97 184.71 3iv7 h LEU 344 N 0.38 -0.02 -1.32 3.80 6.46 -1.37 -2.33 115.31 120.90 3iv7 h LEU 344 Ca 0.05 -0.17 -0.05 0.00 -0.12 0.00 0.00 57.88 57.59 3iv7 h LEU 344 Cb 0.73 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.65 3iv7 h LEU 344 CO 0.06 0.16 -0.03 -0.07 -0.62 0.00 0.00 178.44 177.93 3iv7 h LEU 345 N -0.21 0.38 -0.83 2.25 3.38 -1.29 -0.66 115.31 118.34 3iv7 h LEU 345 Ca -0.00 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 3iv7 h LEU 345 Cb 0.20 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3iv7 h LEU 345 CO 0.00 0.48 0.37 -0.33 0.09 0.00 0.00 178.44 179.05 3iv7 h GLU 346 N 0.40 1.22 -0.29 1.13 5.08 -1.11 0.39 114.58 121.39 3iv7 h GLU 346 Ca 0.09 -0.20 -0.12 0.00 -1.00 0.00 0.00 59.36 58.13 3iv7 h GLU 346 Cb 0.32 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3iv7 h GLU 346 CO 0.01 0.96 -0.27 0.00 -1.00 0.00 0.00 179.01 178.71 3iv7 h ALA 347 N 1.20 0.43 -0.02 3.43 0.00 -0.77 -2.47 119.26 121.05 3iv7 h ALA 347 Ca 0.28 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 3iv7 h ALA 347 Cb 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3iv7 h ALA 347 CO -0.03 0.43 -0.53 0.00 0.00 0.00 0.00 179.25 179.11 3iv7 h ALA 348 N 0.71 1.07 -0.35 0.00 0.00 -1.06 0.17 119.26 119.81 3iv7 h ALA 348 Ca 0.05 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 3iv7 h ALA 348 Cb 0.84 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3iv7 h ALA 348 CO 0.07 0.67 0.13 1.25 0.00 0.00 0.00 179.25 181.37 3iv7 h LEU 349 N 0.05 0.49 -1.50 0.00 5.85 -0.10 -0.89 115.31 119.21 3iv7 h LEU 349 Ca -0.00 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.54 3iv7 h LEU 349 Cb 0.96 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.86 3iv7 h LEU 349 CO 0.07 0.54 -0.04 0.59 -0.34 0.00 0.00 178.44 179.27 3iv7 n ASN 350 N -4.68 2.18 -1.98 1.25 4.13 -0.94 -1.33 115.26 113.89 3iv7 n ASN 350 Ca -0.01 -1.59 -0.09 0.00 1.68 0.00 0.00 54.58 54.57 3iv7 n ASN 350 Cb 0.15 0.06 0.04 0.00 -1.54 0.00 0.00 39.78 38.49 3iv7 n ASN 350 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3iv7 n GLY 351 N 0.88 0.17 3.78 7.41 0.00 0.47 -4.91 105.19 113.01 3iv7 n GLY 351 Ca 0.09 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 3iv7 n GLY 351 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iv7 s GLU 352 N -4.98 1.71 0.12 1.61 2.02 -0.43 -4.95 118.70 113.80 3iv7 s GLU 352 Ca 0.10 0.61 -0.31 0.00 0.02 0.00 0.00 54.97 55.39 3iv7 s GLU 352 Cb -0.04 -1.88 -0.11 0.00 0.10 0.00 0.00 34.13 32.20 3iv7 s GLU 352 CO 0.32 -1.87 1.85 -3.47 0.02 0.00 0.00 175.26 172.10 3iv7 n ASP 353 N -3.60 4.05 0.29 -0.19 -0.08 -1.26 -4.84 116.55 110.92 3iv7 n ASP 353 Ca 0.07 0.98 0.15 0.00 -1.51 0.00 0.00 54.79 54.48 3iv7 n ASP 353 Cb 0.57 -1.54 0.90 0.00 2.34 0.00 0.00 41.12 43.39 3iv7 n ASP 353 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3iv7 h PRO 354 N 8.64 0.00 -0.15 -0.67 0.11 -1.92 -1.74 132.00 136.28 3iv7 h PRO 354 Ca -0.47 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.69 3iv7 h PRO 354 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3iv7 h PRO 354 CO 0.95 0.02 0.32 0.00 -0.21 0.00 0.00 178.00 179.08 3iv7 h ALA 355 N 1.98 1.61 0.00 -0.75 0.00 -1.91 0.21 119.26 120.41 3iv7 h ALA 355 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3iv7 h ALA 355 Cb 0.05 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3iv7 h ALA 355 CO 0.00 -0.40 -0.11 -0.39 0.00 0.00 0.00 179.25 178.35 3iv7 h VAL 356 N 0.00 0.59 -0.02 0.00 -1.51 -1.69 -2.45 116.25 111.17 3iv7 h VAL 356 Ca 0.07 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 3iv7 h VAL 356 Cb 0.71 1.32 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 3iv7 h VAL 356 CO -0.00 0.11 -0.00 0.18 -1.23 0.00 0.00 177.57 176.63 3iv7 n LEU 357 N -3.69 1.77 0.00 4.19 4.77 0.06 -5.12 117.00 118.98 3iv7 n LEU 357 Ca -0.02 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 3iv7 n LEU 357 Cb 0.23 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3iv7 n LEU 357 CO 0.30 0.30 0.16 -1.20 -1.33 0.00 0.00 177.39 175.62