#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ip7 n ASP 2 N 0.00 0.20 -4.55 7.83 8.00 -1.26 -4.68 116.55 122.08 3ip7 n ASP 2 Ca 0.00 0.45 -0.42 0.00 0.71 0.00 0.00 54.79 55.54 3ip7 n ASP 2 Cb 0.00 -1.45 -0.07 0.00 -0.02 0.00 0.00 41.12 39.58 3ip7 n ASP 2 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3ip7 s VAL 3 N -2.47 4.97 -0.26 2.53 1.01 0.15 -4.90 120.40 121.43 3ip7 s VAL 3 Ca 0.67 0.34 -0.26 0.00 0.00 0.00 0.00 61.98 62.74 3ip7 s VAL 3 Cb -0.25 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.12 3ip7 s VAL 3 CO 0.57 -0.29 0.89 -0.69 0.00 0.00 0.00 175.10 175.59 3ip7 s VAL 4 N 2.50 4.76 -0.10 2.92 1.01 -1.26 -0.52 120.40 129.70 3ip7 s VAL 4 Ca 0.20 1.61 0.02 0.00 0.00 0.00 0.00 61.98 63.81 3ip7 s VAL 4 Cb -0.15 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 32.04 3ip7 s VAL 4 CO 0.14 -0.18 -0.16 -0.63 0.00 0.00 0.00 175.10 174.28 3ip7 s ILE 5 N 3.03 1.52 0.09 2.22 1.01 -0.51 -1.45 121.20 127.11 3ip7 s ILE 5 Ca 0.37 -0.67 -0.01 0.00 0.00 0.00 0.00 60.65 60.35 3ip7 s ILE 5 Cb -0.15 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 3ip7 s ILE 5 CO 0.09 0.44 0.25 0.00 0.00 0.00 0.00 174.94 175.73 3ip7 s ALA 6 N 0.88 3.96 -0.27 9.38 0.00 0.13 -1.70 121.76 134.14 3ip7 s ALA 6 Ca -0.09 -0.79 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 3ip7 s ALA 6 Cb -0.15 -1.90 0.01 0.00 0.00 0.00 0.00 23.12 21.08 3ip7 s ALA 6 CO 0.00 0.77 0.03 0.08 0.00 0.00 0.00 175.76 176.65 3ip7 s VAL 7 N -1.56 3.70 -0.32 0.00 1.01 0.28 -0.72 120.40 122.79 3ip7 s VAL 7 Ca 0.36 -0.68 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 3ip7 s VAL 7 Cb -0.13 -2.85 0.02 0.00 0.00 0.00 0.00 36.38 33.43 3ip7 s VAL 7 CO 0.27 0.18 0.11 -0.83 0.00 0.00 0.00 175.10 174.83 3ip7 s GLY 8 N 1.47 1.83 0.25 4.51 0.00 -0.81 -0.95 107.32 113.63 3ip7 s GLY 8 Ca 0.03 -1.61 -0.20 0.00 0.00 0.00 0.00 44.72 42.94 3ip7 s GLY 8 CO 0.00 0.73 0.65 0.00 0.00 0.00 0.00 173.10 174.48 3ip7 s ALA 9 N 1.47 -1.09 -1.07 3.20 0.00 -0.90 -3.99 121.76 119.37 3ip7 s ALA 9 Ca 0.01 -0.28 -0.22 0.00 0.00 0.00 0.00 51.96 51.46 3ip7 s ALA 9 Cb -0.18 0.88 0.03 0.00 0.00 0.00 0.00 23.12 23.85 3ip7 s ALA 9 CO 0.03 -0.95 1.64 -2.14 0.00 0.00 0.00 175.76 174.34 3ip7 s PRO 10 N -3.91 3.41 0.38 0.00 0.02 -1.26 -0.85 135.00 132.79 3ip7 s PRO 10 Ca 0.11 -1.16 0.23 0.00 0.02 0.00 0.00 61.00 60.20 3ip7 s PRO 10 Cb -0.04 -5.34 0.25 0.00 0.02 0.00 0.00 34.50 29.39 3ip7 s PRO 10 CO 0.04 -2.56 1.47 -0.07 -0.33 0.00 0.00 177.00 175.54 3ip7 h LEU 11 N 14.02 0.00 -9.42 -5.54 3.38 -1.88 -3.18 115.31 112.70 3ip7 h LEU 11 Ca 0.24 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.66 3ip7 h LEU 11 Cb 0.97 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.59 3ip7 h LEU 11 CO 1.38 0.01 -0.54 0.42 0.09 0.00 0.00 178.44 179.80 3ip7 s THR 12 N -3.24 0.78 0.00 0.22 -4.23 -1.26 -4.69 115.64 103.22 3ip7 s THR 12 Ca 0.05 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 3ip7 s THR 12 Cb 0.06 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.45 3ip7 s THR 12 CO 0.70 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.39 3ip7 n GLY 13 N -0.87 -1.92 0.32 3.99 0.00 -1.26 -4.22 105.19 101.22 3ip7 n GLY 13 Ca -0.06 -1.88 0.14 0.00 0.00 0.00 0.00 46.02 44.23 3ip7 n GLY 13 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ip7 h PRO 14 N 0.00 0.00 -0.48 1.61 0.11 -1.96 -2.26 132.00 129.02 3ip7 h PRO 14 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3ip7 h PRO 14 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3ip7 h PRO 14 CO 0.00 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.88 3ip7 n ASN 15 N -4.31 4.99 -0.30 -2.05 3.02 -1.26 -4.65 115.26 110.71 3ip7 n ASN 15 Ca 0.02 -2.88 0.08 0.00 -0.03 0.00 0.00 54.58 51.77 3ip7 n ASN 15 Cb 0.31 -0.62 0.24 0.00 -0.61 0.00 0.00 39.78 39.10 3ip7 n ASN 15 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ip7 h ALA 16 N 3.28 1.31 -0.89 5.41 0.00 -1.49 -0.95 119.26 125.93 3ip7 h ALA 16 Ca 0.00 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3ip7 h ALA 16 Cb 1.73 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.48 3ip7 h ALA 16 CO 0.37 -0.12 0.59 0.00 0.00 0.00 0.00 179.25 180.09 3ip7 h ALA 17 N 1.58 1.39 -0.30 0.00 0.00 -1.84 0.21 119.26 120.29 3ip7 h ALA 17 Ca 0.48 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 3ip7 h ALA 17 Cb 0.71 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3ip7 h ALA 17 CO -0.38 0.55 0.06 0.74 0.00 0.00 0.00 179.25 180.22 3ip7 h PHE 18 N 1.18 0.52 -0.93 0.00 0.04 -1.58 -1.56 116.94 114.61 3ip7 h PHE 18 Ca 0.34 -0.07 0.10 0.00 2.80 0.00 0.00 57.97 61.14 3ip7 h PHE 18 Cb -0.09 -0.14 -0.07 0.00 2.20 0.00 0.00 35.95 37.85 3ip7 h PHE 18 CO -0.00 0.56 0.60 0.78 -0.60 0.00 0.00 178.31 179.65 3ip7 h GLY 19 N 0.32 1.38 1.33 -1.45 0.00 -0.28 -1.46 103.07 102.91 3ip7 h GLY 19 Ca 0.09 -0.39 -0.16 0.00 0.00 0.00 0.00 47.33 46.87 3ip7 h GLY 19 CO 0.00 0.22 -0.45 0.00 0.00 0.00 0.00 176.54 176.31 3ip7 h ALA 20 N 1.54 0.67 -0.44 3.60 0.00 -0.47 -0.92 119.26 123.24 3ip7 h ALA 20 Ca 0.43 -0.47 0.09 0.00 0.00 0.00 0.00 54.91 54.95 3ip7 h ALA 20 Cb 0.39 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 3ip7 h ALA 20 CO -0.19 0.67 -0.05 1.96 0.00 0.00 0.00 179.25 181.64 3ip7 h GLN 21 N 0.58 0.06 -0.21 0.00 4.20 -0.29 -0.47 115.11 118.97 3ip7 h GLN 21 Ca 0.04 -0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.67 3ip7 h GLN 21 Cb 1.01 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.77 3ip7 h GLN 21 CO 0.10 0.04 -0.16 0.82 -0.67 0.00 0.00 178.83 178.96 3ip7 h ILE 22 N 0.06 1.32 0.26 2.54 2.04 -1.18 -1.78 117.51 120.76 3ip7 h ILE 22 Ca 0.22 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 3ip7 h ILE 22 Cb 0.32 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 3ip7 h ILE 22 CO -0.40 0.39 -0.13 -0.61 0.00 0.00 0.00 178.15 177.40 3ip7 h GLN 23 N 0.17 -0.34 -0.81 2.37 4.15 -1.06 -0.91 115.11 118.68 3ip7 h GLN 23 Ca 0.04 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 3ip7 h GLN 23 Cb 0.68 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.41 3ip7 h GLN 23 CO 0.04 -0.20 0.46 0.87 -1.93 0.00 0.00 178.83 178.07 3ip7 h LYS 24 N -0.38 1.11 -0.30 1.69 1.79 -1.09 0.11 116.57 119.50 3ip7 h LYS 24 Ca -0.04 -0.11 -0.16 0.00 -2.18 0.00 0.00 60.65 58.17 3ip7 h LYS 24 Cb 0.29 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 3ip7 h LYS 24 CO 0.06 0.80 -0.43 0.78 -1.08 0.00 0.00 179.45 179.58 3ip7 h GLY 25 N 1.15 0.84 1.53 3.86 0.00 -1.24 -1.45 103.07 107.75 3ip7 h GLY 25 Ca 0.29 -0.88 -0.20 0.00 0.00 0.00 0.00 47.33 46.54 3ip7 h GLY 25 CO -0.05 0.79 -0.78 0.00 0.00 0.00 0.00 176.54 176.50 3ip7 h ALA 26 N 0.89 0.51 -0.26 3.60 0.00 -0.69 -2.80 119.26 120.50 3ip7 h ALA 26 Ca 0.04 -0.63 -0.20 0.00 0.00 0.00 0.00 54.91 54.13 3ip7 h ALA 26 Cb 1.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3ip7 h ALA 26 CO 0.09 0.77 -0.60 0.93 0.00 0.00 0.00 179.25 180.44 3ip7 h GLU 27 N 0.30 0.86 -0.47 0.00 5.08 -0.70 -2.50 114.58 117.15 3ip7 h GLU 27 Ca -0.04 -0.58 -0.06 0.00 -1.00 0.00 0.00 59.36 57.68 3ip7 h GLU 27 Cb 1.38 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.69 3ip7 h GLU 27 CO 0.14 1.21 0.06 0.37 -1.00 0.00 0.00 179.01 179.79 3ip7 h GLN 28 N 0.64 0.74 -0.33 2.33 5.75 -1.32 -0.78 115.11 122.14 3ip7 h GLN 28 Ca -0.00 -0.16 -0.17 0.00 -0.15 0.00 0.00 58.65 58.17 3ip7 h GLN 28 Cb 1.22 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.66 3ip7 h GLN 28 CO 0.13 0.71 -0.46 0.00 -2.65 0.00 0.00 178.83 176.57 3ip7 h ALA 29 N 1.36 0.56 -0.39 3.38 0.00 -1.42 -0.59 119.26 122.16 3ip7 h ALA 29 Ca 0.15 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 3ip7 h ALA 29 Cb 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3ip7 h ALA 29 CO 0.01 0.68 0.12 0.00 0.00 0.00 0.00 179.25 180.05 3ip7 h ALA 30 N 0.78 0.51 -0.20 0.00 0.00 -1.28 0.14 119.26 119.21 3ip7 h ALA 30 Ca 0.04 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.82 3ip7 h ALA 30 Cb 1.05 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3ip7 h ALA 30 CO 0.10 0.16 -0.02 -0.22 0.00 0.00 0.00 179.25 179.27 3ip7 h LYS 31 N 0.48 0.04 0.04 0.00 3.64 -0.99 0.78 116.57 120.56 3ip7 h LYS 31 Ca 0.12 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3ip7 h LYS 31 Cb 0.27 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3ip7 h LYS 31 CO -0.00 0.02 -0.02 -0.44 -2.27 0.00 0.00 179.45 176.74 3ip7 h ASP 32 N 0.04 -0.04 -0.48 4.20 3.32 -0.86 -2.44 116.42 120.15 3ip7 h ASP 32 Ca 0.10 -0.21 0.06 0.00 0.02 0.00 0.00 57.03 56.99 3ip7 h ASP 32 Cb 0.13 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.64 3ip7 h ASP 32 CO -0.18 0.18 0.20 0.40 -1.72 0.00 0.00 179.24 178.12 3ip7 h ILE 33 N -0.27 0.89 -0.17 0.35 2.04 -0.64 -2.52 117.51 117.19 3ip7 h ILE 33 Ca -0.01 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.73 3ip7 h ILE 33 Cb 0.25 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3ip7 h ILE 33 CO 0.01 0.07 0.06 0.78 0.00 0.00 0.00 178.15 179.07 3ip7 h ASN 34 N 0.40 0.08 0.01 1.72 2.35 -0.81 0.32 115.58 119.65 3ip7 h ASN 34 Ca 0.22 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3ip7 h ASN 34 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 3ip7 h ASN 34 CO -0.20 0.07 0.00 0.00 -1.65 0.00 0.00 177.43 175.65 3ip7 h ALA 35 N 1.10 1.00 -0.15 -0.83 0.00 -1.31 0.82 119.26 119.89 3ip7 h ALA 35 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ip7 h ALA 35 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3ip7 h ALA 35 CO -0.07 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.18 3ip7 n ALA 36 N -1.92 2.49 0.00 0.00 0.00 -0.06 -4.90 120.51 116.12 3ip7 n ALA 36 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.76 3ip7 n ALA 36 Cb 0.05 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3ip7 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ip7 n GLY 37 N 1.29 0.96 7.00 0.00 0.00 0.27 -5.05 105.19 109.67 3ip7 n GLY 37 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3ip7 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ip7 n GLY 38 N -0.83 -1.34 3.56 -0.02 0.00 -0.29 -3.52 105.19 102.76 3ip7 n GLY 38 Ca 0.00 -1.27 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 3ip7 n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ip7 s ILE 39 N 0.00 5.18 -1.32 -0.61 1.01 0.20 -4.49 121.20 121.18 3ip7 s ILE 39 Ca 0.00 0.16 -0.16 0.00 0.00 0.00 0.00 60.65 60.66 3ip7 s ILE 39 Cb 0.00 -3.77 0.01 0.00 0.01 0.00 0.00 42.46 38.72 3ip7 s ILE 39 CO 0.00 -0.01 0.50 0.59 0.00 0.00 0.00 174.94 176.02 3ip7 n ASN 40 N 5.34 -2.37 0.00 3.58 3.02 -1.26 -0.58 115.26 122.99 3ip7 n ASN 40 Ca -0.09 -1.16 0.00 0.00 -0.03 0.00 0.00 54.58 53.30 3ip7 n ASN 40 Cb 0.50 -2.40 0.00 0.00 -0.61 0.00 0.00 39.78 37.27 3ip7 n ASN 40 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ip7 n GLY 41 N -2.08 0.50 3.43 7.41 0.00 -1.23 -5.01 105.19 108.22 3ip7 n GLY 41 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 3ip7 n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ip7 s GLU 42 N -0.52 1.98 0.38 1.61 0.41 0.26 -4.93 118.70 117.88 3ip7 s GLU 42 Ca 0.00 -1.03 -0.24 0.00 -0.41 0.00 0.00 54.97 53.29 3ip7 s GLU 42 Cb 0.00 -2.13 -0.10 0.00 -1.78 0.00 0.00 34.13 30.12 3ip7 s GLU 42 CO 0.00 0.53 0.95 -0.65 -0.49 0.00 0.00 175.26 175.60 3ip7 s GLN 43 N -1.44 4.41 -0.10 1.61 -1.52 -1.26 0.61 119.66 121.96 3ip7 s GLN 43 Ca 0.14 1.23 -0.17 0.00 -1.95 0.00 0.00 55.36 54.61 3ip7 s GLN 43 Cb -0.10 -2.50 -0.05 0.00 -0.22 0.00 0.00 33.01 30.15 3ip7 s GLN 43 CO 0.05 0.12 0.44 0.42 -0.25 0.00 0.00 175.29 176.07 3ip7 s ILE 44 N -1.89 5.18 -0.29 1.08 1.01 -1.26 0.33 121.20 125.35 3ip7 s ILE 44 Ca 0.56 0.87 -0.04 0.00 0.00 0.00 0.00 60.65 62.04 3ip7 s ILE 44 Cb -0.14 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.59 3ip7 s ILE 44 CO 0.19 0.38 0.03 -0.75 0.00 0.00 0.00 174.94 174.78 3ip7 s LYS 45 N 0.32 2.78 0.01 2.79 2.47 0.32 -4.89 119.74 123.55 3ip7 s LYS 45 Ca 0.24 -1.05 -0.29 0.00 -1.56 0.00 0.00 55.97 53.32 3ip7 s LYS 45 Cb -0.15 -3.25 -0.04 0.00 -1.46 0.00 0.00 37.83 32.93 3ip7 s LYS 45 CO 0.10 -0.52 0.92 0.42 0.16 0.00 0.00 175.35 176.43 3ip7 s ILE 46 N 1.38 4.84 0.18 5.43 -1.09 -1.26 -1.42 121.20 129.26 3ip7 s ILE 46 Ca -0.01 1.93 0.10 0.00 -2.23 0.00 0.00 60.65 60.45 3ip7 s ILE 46 Cb -0.18 -4.26 -0.04 0.00 -1.58 0.00 0.00 42.46 36.39 3ip7 s ILE 46 CO -0.00 0.21 -0.16 0.68 -1.23 0.00 0.00 174.94 174.44 3ip7 s VAL 47 N 0.77 2.83 0.00 2.92 -7.23 -0.69 -4.96 120.40 114.03 3ip7 s VAL 47 Ca 0.48 -1.79 0.07 0.00 -1.81 0.00 0.00 61.98 58.93 3ip7 s VAL 47 Cb -0.21 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.33 3ip7 s VAL 47 CO 0.26 -0.09 -0.22 -0.76 -0.31 0.00 0.00 175.10 173.98 3ip7 s LEU 48 N -2.71 2.34 -0.04 1.32 1.43 -1.26 -0.55 118.68 119.20 3ip7 s LEU 48 Ca 0.23 -0.43 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 3ip7 s LEU 48 Cb -0.09 -1.41 0.03 0.00 0.03 0.00 0.00 46.19 44.76 3ip7 s LEU 48 CO 0.13 0.30 0.07 -0.83 0.23 0.00 0.00 176.35 176.24 3ip7 s GLY 49 N -0.97 0.17 -0.42 -3.19 0.00 -0.13 -4.92 107.32 97.86 3ip7 s GLY 49 Ca 0.12 0.26 -0.19 0.00 0.00 0.00 0.00 44.72 44.91 3ip7 s GLY 49 CO 0.01 1.32 0.54 -0.35 0.00 0.00 0.00 173.10 174.63 3ip7 s ASP 50 N 2.01 6.27 0.00 1.64 2.15 -1.26 -2.11 116.67 125.37 3ip7 s ASP 50 Ca 0.03 -0.43 0.28 0.00 0.43 0.00 0.00 52.55 52.85 3ip7 s ASP 50 Cb -0.12 -2.27 1.08 0.00 -0.30 0.00 0.00 42.92 41.31 3ip7 s ASP 50 CO -0.03 -0.65 1.76 -0.90 -0.17 0.00 0.00 175.17 175.17 3ip7 n ASP 51 N 5.92 1.33 -2.37 -0.34 5.68 -0.03 -4.87 116.55 121.87 3ip7 n ASP 51 Ca -0.04 -1.39 -0.04 0.00 -0.50 0.00 0.00 54.79 52.82 3ip7 n ASP 51 Cb 0.48 0.01 -0.00 0.00 -1.14 0.00 0.00 41.12 40.47 3ip7 n ASP 51 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 3ip7 n VAL 52 N -0.01 -0.19 -1.75 2.12 0.31 -1.26 0.10 118.33 117.66 3ip7 n VAL 52 Ca 0.19 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.31 3ip7 n VAL 52 Cb 0.34 -0.59 -0.07 0.00 -0.91 0.00 0.00 33.84 32.61 3ip7 n VAL 52 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3ip7 n SER 53 N -1.43 -5.42 -4.21 4.52 7.64 -1.26 -4.90 113.62 108.56 3ip7 n SER 53 Ca -0.05 0.40 -0.34 0.00 1.01 0.00 0.00 58.87 59.90 3ip7 n SER 53 Cb 0.51 -4.74 -0.15 0.00 -1.01 0.00 0.00 64.21 58.81 3ip7 n SER 53 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3ip7 s ASP 54 N -2.59 3.61 0.20 6.43 -1.08 0.12 -4.91 116.67 118.44 3ip7 s ASP 54 Ca 0.00 -0.53 -0.14 0.00 -0.52 0.00 0.00 52.55 51.37 3ip7 s ASP 54 Cb 0.00 -1.58 0.22 0.00 -1.46 0.00 0.00 42.92 40.10 3ip7 s ASP 54 CO 0.00 0.02 1.65 -0.65 0.52 0.00 0.00 175.17 176.70 3ip7 h PRO 55 N 7.82 0.03 -0.62 4.34 0.11 -1.83 0.22 132.00 142.07 3ip7 h PRO 55 Ca -0.41 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.64 3ip7 h PRO 55 Cb 1.16 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3ip7 h PRO 55 CO 0.61 0.02 0.16 0.87 -0.21 0.00 0.00 178.00 179.45 3ip7 h LYS 56 N 0.03 0.96 -0.34 1.05 1.79 -1.93 0.59 116.57 118.72 3ip7 h LYS 56 Ca 0.28 -0.20 -0.11 0.00 -2.18 0.00 0.00 60.65 58.44 3ip7 h LYS 56 Cb 0.44 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 3ip7 h LYS 56 CO -0.56 0.85 -0.24 0.37 -1.08 0.00 0.00 179.45 178.79 3ip7 h GLN 57 N 0.92 0.67 -0.59 3.15 5.75 -1.64 -2.54 115.11 120.82 3ip7 h GLN 57 Ca 0.20 -0.27 -0.10 0.00 -0.15 0.00 0.00 58.65 58.33 3ip7 h GLN 57 Cb 0.31 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.81 3ip7 h GLN 57 CO -0.00 0.85 -0.03 0.78 -2.65 0.00 0.00 178.83 177.78 3ip7 h GLY 58 N 0.99 1.13 0.98 2.39 0.00 0.70 -0.87 103.07 108.39 3ip7 h GLY 58 Ca 0.08 -0.85 -0.00 0.00 0.00 0.00 0.00 47.33 46.56 3ip7 h GLY 58 CO 0.06 0.78 0.19 -2.22 0.00 0.00 0.00 176.54 175.34 3ip7 h ILE 59 N 0.95 1.11 -0.91 2.60 2.04 -0.81 0.02 117.51 122.51 3ip7 h ILE 59 Ca 0.16 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.82 3ip7 h ILE 59 Cb 0.58 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.33 3ip7 h ILE 59 CO 0.03 0.11 0.58 0.28 0.00 0.00 0.00 178.15 179.15 3ip7 h SER 60 N 0.40 0.94 -0.83 1.72 0.02 -1.26 -0.92 113.55 113.63 3ip7 h SER 60 Ca 0.11 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3ip7 h SER 60 Cb 0.01 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 3ip7 h SER 60 CO -0.02 0.62 0.44 0.58 -1.14 0.00 0.00 176.83 177.31 3ip7 h VAL 61 N 1.09 1.25 -0.35 2.27 2.07 -0.70 -2.12 116.25 119.75 3ip7 h VAL 61 Ca 0.38 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 3ip7 h VAL 61 Cb 0.09 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 3ip7 h VAL 61 CO -0.15 0.28 -0.14 0.00 0.02 0.00 0.00 177.57 177.59 3ip7 h ALA 62 N 1.23 0.49 -0.53 1.67 0.00 -0.18 -1.44 119.26 120.50 3ip7 h ALA 62 Ca 0.29 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3ip7 h ALA 62 Cb 0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3ip7 h ALA 62 CO -0.04 0.39 0.17 -0.91 0.00 0.00 0.00 179.25 178.85 3ip7 h ASN 63 N 0.50 0.72 -0.15 0.00 2.35 -1.11 -1.55 115.58 116.34 3ip7 h ASN 63 Ca 0.08 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 3ip7 h ASN 63 Cb 0.67 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 3ip7 h ASN 63 CO 0.05 0.68 0.06 0.50 -1.65 0.00 0.00 177.43 177.06 3ip7 h LYS 64 N 0.76 0.22 -0.10 0.81 3.64 -0.95 -1.83 116.57 119.12 3ip7 h LYS 64 Ca 0.18 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 3ip7 h LYS 64 Cb 0.22 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.94 3ip7 h LYS 64 CO -0.01 0.32 -0.32 0.74 -2.27 0.00 0.00 179.45 177.91 3ip7 h PHE 65 N 0.08 -0.88 -0.80 1.91 0.04 -0.93 0.58 116.94 116.94 3ip7 h PHE 65 Ca 0.05 0.04 0.17 0.00 2.80 0.00 0.00 57.97 61.02 3ip7 h PHE 65 Cb 0.18 0.40 -0.15 0.00 2.20 0.00 0.00 35.95 38.58 3ip7 h PHE 65 CO -0.01 -0.40 -0.17 0.28 -0.60 0.00 0.00 178.31 177.41 3ip7 h VAL 66 N -0.41 0.21 -0.34 -0.55 2.07 -1.09 0.69 116.25 116.83 3ip7 h VAL 66 Ca 0.09 -0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.55 3ip7 h VAL 66 Cb 0.55 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 3ip7 h VAL 66 CO -0.33 0.00 -0.04 0.00 0.02 0.00 0.00 177.57 177.22 3ip7 h ALA 67 N 1.79 1.31 -0.12 1.67 0.00 -0.33 -2.76 119.26 120.82 3ip7 h ALA 67 Ca 0.39 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3ip7 h ALA 67 Cb 0.62 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3ip7 h ALA 67 CO -0.81 0.46 0.00 -0.25 0.00 0.00 0.00 179.25 178.66 3ip7 n ASP 68 N -4.25 0.87 -0.14 0.00 8.00 0.18 -4.86 116.55 116.35 3ip7 n ASP 68 Ca 0.01 -1.76 -0.01 0.00 0.71 0.00 0.00 54.79 53.74 3ip7 n ASP 68 Cb 0.27 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.29 3ip7 n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ip7 n GLY 69 N 0.88 0.41 3.77 0.44 0.00 -0.96 -5.01 105.19 104.73 3ip7 n GLY 69 Ca 0.11 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.79 3ip7 n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ip7 s VAL 70 N -2.06 2.23 -0.02 1.61 1.01 -0.87 -4.71 120.40 117.58 3ip7 s VAL 70 Ca 0.00 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.23 3ip7 s VAL 70 Cb 0.00 -3.13 -0.06 0.00 0.00 0.00 0.00 36.38 33.19 3ip7 s VAL 70 CO 0.00 0.04 0.06 0.29 0.00 0.00 0.00 175.10 175.49 3ip7 n LYS 71 N 0.09 1.36 -3.85 2.72 4.76 -0.53 -4.77 118.16 117.93 3ip7 n LYS 71 Ca 0.03 -0.03 -0.12 0.00 -2.87 0.00 0.00 58.31 55.33 3ip7 n LYS 71 Cb 0.42 -1.10 -0.14 0.00 -1.84 0.00 0.00 35.03 32.36 3ip7 n LYS 71 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3ip7 s PHE 72 N -2.22 -0.02 -0.14 2.13 0.08 -1.16 -2.31 117.98 114.34 3ip7 s PHE 72 Ca -0.02 0.07 0.01 0.00 0.12 0.00 0.00 56.93 57.11 3ip7 s PHE 72 Cb 0.02 -0.01 0.02 0.00 -0.57 0.00 0.00 43.02 42.48 3ip7 s PHE 72 CO 0.18 -0.02 -0.16 0.08 -0.10 0.00 0.00 175.22 175.20 3ip7 s VAL 73 N 0.10 1.66 -0.34 -0.44 1.01 -0.06 0.21 120.40 122.55 3ip7 s VAL 73 Ca -0.01 -0.71 -0.19 0.00 0.00 0.00 0.00 61.98 61.07 3ip7 s VAL 73 Cb -0.01 -1.53 -0.00 0.00 0.00 0.00 0.00 36.38 34.84 3ip7 s VAL 73 CO -0.00 0.47 0.55 -0.69 0.00 0.00 0.00 175.10 175.44 3ip7 s VAL 74 N 1.24 4.98 -5.00 2.92 1.01 0.10 -0.92 120.40 124.74 3ip7 s VAL 74 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.48 3ip7 s VAL 74 Cb -0.14 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.26 3ip7 s VAL 74 CO -0.07 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.43 3ip7 n GLY 75 N 4.69 -0.01 0.00 4.51 0.00 -0.61 -1.92 105.19 111.86 3ip7 n GLY 75 Ca -0.03 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3ip7 n GLY 75 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ip7 n HIS 76 N -0.65 -1.11 -0.08 1.61 8.25 -1.26 -2.94 115.22 119.04 3ip7 n HIS 76 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 3ip7 n HIS 76 Cb 0.00 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.07 3ip7 n HIS 76 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3ip7 h PHE 77 N -0.08 0.00 -3.66 4.41 3.57 -1.94 -3.34 116.94 115.89 3ip7 h PHE 77 Ca 0.00 0.00 -0.50 0.00 3.53 0.00 0.00 57.97 61.00 3ip7 h PHE 77 Cb 0.00 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3ip7 h PHE 77 CO 0.00 0.31 0.37 -0.80 -2.23 0.00 0.00 178.31 175.97 3ip7 s ASN 78 N -5.95 7.53 0.26 0.41 0.01 -1.26 -2.93 114.94 113.02 3ip7 s ASN 78 Ca -0.17 1.92 -0.03 0.00 -0.71 0.00 0.00 52.86 53.88 3ip7 s ASN 78 Cb 0.03 -2.60 0.41 0.00 0.41 0.00 0.00 41.25 39.50 3ip7 s ASN 78 CO 0.28 0.02 1.87 0.28 -1.51 0.00 0.00 177.10 178.04 3ip7 h SER 79 N 4.77 0.98 1.06 -1.22 0.02 -1.91 -0.37 113.55 116.87 3ip7 h SER 79 Ca -0.44 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 3ip7 h SER 79 Cb 1.21 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.56 3ip7 h SER 79 CO 0.70 0.61 0.00 1.23 -1.14 0.00 0.00 176.83 178.23 3ip7 h GLY 80 N 1.10 0.00 0.36 -3.77 0.00 -1.94 -0.95 103.07 97.88 3ip7 h GLY 80 Ca 0.43 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.48 3ip7 h GLY 80 CO -0.19 0.00 -1.51 -2.08 0.00 0.00 0.00 176.54 172.77 3ip7 h VAL 81 N 0.00 0.88 -0.52 4.60 2.07 -1.80 -3.40 116.25 118.08 3ip7 h VAL 81 Ca 0.00 -2.30 -0.01 0.00 0.82 0.00 0.00 66.70 65.21 3ip7 h VAL 81 Cb 0.53 2.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 3ip7 h VAL 81 CO 0.00 0.62 0.27 0.28 0.02 0.00 0.00 177.57 178.76 3ip7 h SER 82 N -0.46 0.66 0.30 0.57 0.02 -0.75 -2.28 113.55 111.61 3ip7 h SER 82 Ca -0.35 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3ip7 h SER 82 Cb 1.66 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 64.02 3ip7 h SER 82 CO -0.03 0.58 -0.28 0.40 -1.14 0.00 0.00 176.83 176.36 3ip7 h ILE 83 N 0.69 0.41 -0.47 3.27 2.04 -1.41 0.49 117.51 122.54 3ip7 h ILE 83 Ca 0.18 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.91 3ip7 h ILE 83 Cb 0.07 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3ip7 h ILE 83 CO -0.03 0.00 -0.21 1.55 0.00 0.00 0.00 178.15 179.46 3ip7 h PRO 84 N -0.60 0.96 -0.36 2.37 0.13 -1.77 -3.08 132.00 129.65 3ip7 h PRO 84 Ca -0.01 -0.40 -0.03 0.00 -0.87 0.00 0.00 66.00 64.68 3ip7 h PRO 84 Cb 0.54 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.62 3ip7 h PRO 84 CO -0.05 1.07 0.09 0.00 -0.23 0.00 0.00 178.00 178.88 3ip7 h ALA 85 N 0.92 1.49 0.00 -0.56 0.00 -1.29 -2.11 119.26 117.72 3ip7 h ALA 85 Ca 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3ip7 h ALA 85 Cb 0.78 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3ip7 h ALA 85 CO 0.06 0.38 -0.12 0.66 0.00 0.00 0.00 179.25 180.24 3ip7 h SER 86 N 0.51 0.00 -0.16 0.00 4.64 -0.81 -1.03 113.55 116.71 3ip7 h SER 86 Ca 0.12 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 3ip7 h SER 86 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 3ip7 h SER 86 CO -0.00 0.12 -0.03 -0.33 -0.87 0.00 0.00 176.83 175.71 3ip7 h GLU 87 N 0.00 0.31 -0.97 4.77 5.08 -1.41 0.29 114.58 122.65 3ip7 h GLU 87 Ca -0.00 -0.11 0.09 0.00 -1.00 0.00 0.00 59.36 58.34 3ip7 h GLU 87 Cb 0.22 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.38 3ip7 h GLU 87 CO 0.02 0.57 0.61 0.28 -1.00 0.00 0.00 179.01 179.49 3ip7 h VAL 88 N 0.02 1.00 -0.14 3.13 2.07 -1.36 -1.54 116.25 119.43 3ip7 h VAL 88 Ca 0.04 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 3ip7 h VAL 88 Cb 0.45 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 3ip7 h VAL 88 CO 0.01 0.19 -0.27 1.88 0.02 0.00 0.00 177.57 179.40 3ip7 h TYR 89 N 1.04 0.55 -0.91 1.57 0.99 -0.90 -2.92 116.97 116.38 3ip7 h TYR 89 Ca 0.45 -0.20 0.16 0.00 2.00 0.00 0.00 58.73 61.15 3ip7 h TYR 89 Cb 0.32 -0.10 -0.07 0.00 1.00 0.00 0.00 36.73 37.87 3ip7 h TYR 89 CO -0.01 0.90 0.59 0.00 -0.00 0.00 0.00 178.16 179.63 3ip7 h ALA 90 N 0.55 1.89 0.00 3.88 0.00 0.11 -1.25 119.26 124.44 3ip7 h ALA 90 Ca 0.01 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3ip7 h ALA 90 Cb 0.87 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3ip7 h ALA 90 CO 0.06 -0.16 -0.41 0.93 0.00 0.00 0.00 179.25 179.67 3ip7 h GLU 91 N 0.64 0.00 -0.25 0.00 4.39 -1.25 -3.33 114.58 114.78 3ip7 h GLU 91 Ca 0.47 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 60.00 3ip7 h GLU 91 Cb 0.84 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.37 3ip7 h GLU 91 CO -0.22 0.27 -0.46 0.09 -1.16 0.00 0.00 179.01 177.53 3ip7 n ASN 92 N -3.12 2.67 -3.26 1.42 4.13 -0.53 -4.99 115.26 111.57 3ip7 n ASN 92 Ca 0.02 -3.85 -0.21 0.00 1.68 0.00 0.00 54.58 52.22 3ip7 n ASN 92 Cb 0.66 -0.52 0.07 0.00 -1.54 0.00 0.00 39.78 38.45 3ip7 n ASN 92 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ip7 n GLY 93 N -1.03 -0.38 3.04 7.41 0.00 -0.95 -4.99 105.19 108.29 3ip7 n GLY 93 Ca 0.28 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 3ip7 n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ip7 s ILE 94 N -3.29 1.59 -0.09 -0.61 1.01 -0.85 -4.67 121.20 114.29 3ip7 s ILE 94 Ca 0.49 -0.66 -0.28 0.00 0.00 0.00 0.00 60.65 60.19 3ip7 s ILE 94 Cb -0.22 -1.47 -0.02 0.00 0.01 0.00 0.00 42.46 40.76 3ip7 s ILE 94 CO 0.65 0.46 0.94 -0.22 0.00 0.00 0.00 174.94 176.77 3ip7 s LEU 95 N 1.30 4.27 -0.19 2.97 0.20 -0.98 -4.25 118.68 121.99 3ip7 s LEU 95 Ca 0.01 1.46 -0.03 0.00 0.69 0.00 0.00 54.13 56.26 3ip7 s LEU 95 Cb -0.14 -3.45 -0.01 0.00 -0.43 0.00 0.00 46.19 42.16 3ip7 s LEU 95 CO -0.08 -0.37 -0.05 -0.70 -0.29 0.00 0.00 176.35 174.86 3ip7 s GLU 96 N 1.71 3.44 -0.22 1.98 2.12 -0.10 -0.88 118.70 126.76 3ip7 s GLU 96 Ca 0.46 -0.61 0.02 0.00 0.36 0.00 0.00 54.97 55.20 3ip7 s GLU 96 Cb -0.18 -2.94 0.04 0.00 0.26 0.00 0.00 34.13 31.31 3ip7 s GLU 96 CO 0.19 -0.04 -0.13 -1.50 -0.54 0.00 0.00 175.26 173.24 3ip7 s ILE 97 N 1.08 1.95 0.02 -3.70 2.07 -0.09 -1.39 121.20 121.14 3ip7 s ILE 97 Ca 0.01 -1.24 -0.22 0.00 -1.41 0.00 0.00 60.65 57.79 3ip7 s ILE 97 Cb -0.15 -1.98 -0.06 0.00 0.13 0.00 0.00 42.46 40.41 3ip7 s ILE 97 CO -0.00 0.18 0.64 0.28 -1.91 0.00 0.00 174.94 174.13 3ip7 s THR 98 N 1.25 4.83 -1.99 4.00 -1.32 -0.47 -1.57 115.64 120.38 3ip7 s THR 98 Ca -0.03 1.35 0.28 0.00 -1.21 0.00 0.00 61.69 62.09 3ip7 s THR 98 Cb -0.17 -3.98 0.50 0.00 -1.51 0.00 0.00 72.50 67.35 3ip7 s THR 98 CO -0.08 0.42 1.81 -0.81 -2.21 0.00 0.00 174.62 173.75 3ip7 n PRO 99 N 2.59 1.07 0.00 7.08 -0.04 -1.26 -1.19 135.00 143.25 3ip7 n PRO 99 Ca -0.06 -0.49 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 3ip7 n PRO 99 Cb 0.51 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 3ip7 n PRO 99 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ip7 n ALA 100 N -0.54 0.15 -2.38 0.55 0.00 -1.26 -4.38 120.51 112.64 3ip7 n ALA 100 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.18 3ip7 n ALA 100 Cb 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.72 3ip7 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ip7 s ALA 101 N -0.33 3.61 -0.92 0.00 0.00 -1.15 -4.90 121.76 118.07 3ip7 s ALA 101 Ca 0.00 0.58 0.11 0.00 0.00 0.00 0.00 51.96 52.64 3ip7 s ALA 101 Cb 0.00 -3.60 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 3ip7 s ALA 101 CO 0.00 -1.06 0.63 0.25 0.00 0.00 0.00 175.76 175.59 3ip7 n THR 102 N 5.11 0.00 -2.10 0.00 -2.24 -1.26 -4.90 114.28 108.88 3ip7 n THR 102 Ca 0.13 -0.38 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 3ip7 n THR 102 Cb 0.45 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.76 3ip7 n THR 102 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ip7 s ASN 103 N -1.46 6.76 0.41 3.42 3.84 -1.26 -0.81 114.94 125.84 3ip7 s ASN 103 Ca 0.08 2.35 0.19 0.00 0.21 0.00 0.00 52.86 55.70 3ip7 s ASN 103 Cb 0.08 -2.58 1.13 0.00 -0.55 0.00 0.00 41.25 39.33 3ip7 s ASN 103 CO 0.28 -0.73 1.79 -0.65 -2.79 0.00 0.00 177.10 175.00 3ip7 h PRO 104 N 7.29 0.36 -0.40 0.43 0.11 -1.94 -1.62 132.00 136.23 3ip7 h PRO 104 Ca -0.41 -0.02 0.12 0.00 0.11 0.00 0.00 66.00 65.79 3ip7 h PRO 104 Cb 1.20 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3ip7 h PRO 104 CO 0.89 0.24 0.36 0.28 -0.21 0.00 0.00 178.00 179.56 3ip7 h VAL 105 N 0.37 0.53 -0.87 3.15 2.07 -1.94 -2.34 116.25 117.23 3ip7 h VAL 105 Ca 0.57 0.00 0.03 0.00 0.82 0.00 0.00 66.70 68.12 3ip7 h VAL 105 Cb 1.49 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.93 3ip7 h VAL 105 CO -0.25 0.00 0.56 0.15 0.02 0.00 0.00 177.57 178.05 3ip7 h PHE 106 N 0.00 1.05 -0.35 1.57 3.57 -1.68 -2.65 116.94 118.46 3ip7 h PHE 106 Ca 0.19 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3ip7 h PHE 106 Cb 0.91 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.30 3ip7 h PHE 106 CO 0.00 0.61 0.00 0.25 -2.23 0.00 0.00 178.31 176.94 3ip7 n THR 107 N -4.53 1.51 -1.05 4.41 -2.24 -0.90 -4.54 114.28 106.94 3ip7 n THR 107 Ca 0.11 -1.32 0.06 0.00 -2.27 0.00 0.00 64.05 60.63 3ip7 n THR 107 Cb 0.08 0.21 0.27 0.00 -2.10 0.00 0.00 70.33 68.79 3ip7 n THR 107 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ip7 n GLU 108 N 0.24 3.02 -0.09 -0.78 -0.58 -1.00 -4.48 120.64 116.96 3ip7 n GLU 108 Ca 0.16 -2.93 0.04 0.00 -0.42 0.00 0.00 57.16 54.01 3ip7 n GLU 108 Cb 0.63 -1.91 0.09 0.00 -0.57 0.00 0.00 31.44 29.68 3ip7 n GLU 108 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3ip7 n ARG 109 N -0.47 2.20 -1.06 3.49 1.74 -1.25 -4.98 116.66 116.32 3ip7 n ARG 109 Ca 0.25 -1.66 -0.02 0.00 -0.77 0.00 0.00 57.85 55.65 3ip7 n ARG 109 Cb 0.98 -1.18 -0.01 0.00 -1.02 0.00 0.00 32.46 31.23 3ip7 n ARG 109 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ip7 n GLY 110 N 0.28 0.46 3.77 -0.13 0.00 -1.26 -4.99 105.19 103.31 3ip7 n GLY 110 Ca 0.07 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 3ip7 n GLY 110 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ip7 s LEU 111 N -0.43 4.41 0.52 0.99 1.43 -1.26 -4.93 118.68 119.41 3ip7 s LEU 111 Ca 0.00 2.72 0.31 0.00 -1.03 0.00 0.00 54.13 56.12 3ip7 s LEU 111 Cb 0.00 -3.66 1.33 0.00 0.03 0.00 0.00 46.19 43.89 3ip7 s LEU 111 CO 0.00 -0.57 1.98 4.11 0.23 0.00 0.00 176.35 182.10 3ip7 h TRP 112 N 3.32 0.00 -0.13 0.29 5.08 -1.95 -3.35 115.95 119.21 3ip7 h TRP 112 Ca -0.49 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.48 3ip7 h TRP 112 Cb 1.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 3ip7 h TRP 112 CO 0.55 0.08 0.00 0.27 -1.28 0.00 0.00 178.44 178.07 3ip7 n ASN 113 N -3.25 2.33 -4.48 0.11 6.94 -1.26 -4.91 115.26 110.75 3ip7 n ASN 113 Ca -0.00 -1.67 -0.40 0.00 -0.02 0.00 0.00 54.58 52.50 3ip7 n ASN 113 Cb 0.31 -0.08 -0.11 0.00 -2.36 0.00 0.00 39.78 37.54 3ip7 n ASN 113 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 3ip7 s THR 114 N -1.01 4.92 0.28 5.53 -4.23 -1.26 -0.92 115.64 118.95 3ip7 s THR 114 Ca 0.18 -0.35 0.05 0.00 -1.18 0.00 0.00 61.69 60.38 3ip7 s THR 114 Cb 0.11 -3.54 -0.06 0.00 1.34 0.00 0.00 72.50 70.36 3ip7 s THR 114 CO 0.16 0.01 0.00 -0.36 -0.54 0.00 0.00 174.62 173.89 3ip7 s PHE 115 N 1.66 1.81 0.07 3.99 0.08 -0.49 -4.19 117.98 120.92 3ip7 s PHE 115 Ca 0.05 -0.87 0.00 0.00 0.12 0.00 0.00 56.93 56.23 3ip7 s PHE 115 Cb -0.17 -1.10 -0.04 0.00 -0.57 0.00 0.00 43.02 41.14 3ip7 s PHE 115 CO 0.08 0.07 -0.04 1.03 -0.10 0.00 0.00 175.22 176.26 3ip7 s ARG 116 N -3.83 0.69 0.00 0.44 0.52 -0.96 -1.36 118.95 114.44 3ip7 s ARG 116 Ca 0.31 -1.25 0.14 0.00 -0.52 0.00 0.00 55.73 54.41 3ip7 s ARG 116 Cb 0.06 0.04 0.13 0.00 0.52 0.00 0.00 34.95 35.70 3ip7 s ARG 116 CO 0.12 -0.07 0.96 0.25 0.02 0.00 0.00 175.30 176.57 3ip7 n THR 117 N 0.10 0.07 -4.05 0.02 -2.24 -0.34 -4.06 114.28 103.78 3ip7 n THR 117 Ca -0.14 -0.53 -0.25 0.00 -2.27 0.00 0.00 64.05 60.86 3ip7 n THR 117 Cb 0.61 1.23 -0.06 0.00 -2.10 0.00 0.00 70.33 70.01 3ip7 n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ip7 n GLY 119 N -1.35 -1.40 3.26 0.00 0.00 -1.26 -4.59 105.19 99.85 3ip7 n GLY 119 Ca -0.01 -1.63 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 3ip7 n GLY 119 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ip7 s ARG 120 N -3.27 1.09 0.28 1.61 1.70 -1.26 -4.42 118.95 114.67 3ip7 s ARG 120 Ca 0.07 -1.47 0.25 0.00 -0.47 0.00 0.00 55.73 54.12 3ip7 s ARG 120 Cb -0.00 -0.67 0.73 0.00 -0.57 0.00 0.00 34.95 34.44 3ip7 s ARG 120 CO 0.05 0.08 1.74 -0.44 -1.08 0.00 0.00 175.30 175.65 3ip7 h ASP 121 N 2.76 0.00 -0.48 -2.89 3.32 -1.31 -1.52 116.42 116.30 3ip7 h ASP 121 Ca -0.37 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.62 3ip7 h ASP 121 Cb 1.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.72 3ip7 h ASP 121 CO 0.63 0.00 0.06 -2.24 -1.72 0.00 0.00 179.24 175.98 3ip7 h ASP 122 N 0.00 0.83 0.12 6.45 2.03 -1.93 0.21 116.42 124.13 3ip7 h ASP 122 Ca 0.00 -0.18 -0.01 0.00 -0.73 0.00 0.00 57.03 56.11 3ip7 h ASP 122 Cb 0.77 -0.22 0.00 0.00 -0.83 0.00 0.00 39.33 39.05 3ip7 h ASP 122 CO 0.00 0.85 -0.06 1.56 -1.03 0.00 0.00 179.24 180.57 3ip7 h GLN 123 N 0.82 -0.15 -0.59 4.15 4.20 -1.72 -2.10 115.11 119.71 3ip7 h GLN 123 Ca 0.17 0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.83 3ip7 h GLN 123 Cb 0.40 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 3ip7 h GLN 123 CO 0.01 0.15 0.16 0.37 -0.67 0.00 0.00 178.83 178.85 3ip7 h GLN 124 N -0.46 0.94 -0.11 1.46 4.15 -1.17 -2.08 115.11 117.84 3ip7 h GLN 124 Ca -0.02 -0.22 -0.12 0.00 0.77 0.00 0.00 58.65 59.06 3ip7 h GLN 124 Cb 0.38 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 3ip7 h GLN 124 CO 0.03 0.86 -0.48 0.78 -1.93 0.00 0.00 178.83 178.09 3ip7 h GLY 125 N 0.85 0.30 0.24 2.39 0.00 -0.67 -1.89 103.07 104.29 3ip7 h GLY 125 Ca 0.19 -0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.21 3ip7 h GLY 125 CO -0.00 0.29 -0.50 -1.33 0.00 0.00 0.00 176.54 174.99 3ip7 h GLY 126 N 1.29 -1.12 0.53 4.60 0.00 -1.00 0.18 103.07 107.55 3ip7 h GLY 126 Ca 0.01 0.60 0.06 0.00 0.00 0.00 0.00 47.33 48.01 3ip7 h GLY 126 CO 0.08 -0.29 0.08 -2.22 0.00 0.00 0.00 176.54 174.19 3ip7 h ILE 127 N -0.79 0.80 -0.07 2.60 1.08 -1.14 -1.77 117.51 118.23 3ip7 h ILE 127 Ca -0.01 -0.07 -0.03 0.00 -0.39 0.00 0.00 64.86 64.36 3ip7 h ILE 127 Cb 0.77 0.57 -0.00 0.00 -3.07 0.00 0.00 36.82 35.09 3ip7 h ILE 127 CO -0.23 0.04 -0.06 0.00 -0.69 0.00 0.00 178.15 177.21 3ip7 h ALA 128 N 1.29 0.10 -0.45 1.87 0.00 -1.19 -0.59 119.26 120.29 3ip7 h ALA 128 Ca 0.19 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 54.91 3ip7 h ALA 128 Cb 0.22 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 3ip7 h ALA 128 CO -0.24 -0.10 0.02 0.78 0.00 0.00 0.00 179.25 179.71 3ip7 h GLY 129 N -0.26 0.48 1.00 0.00 0.00 -0.55 0.59 103.07 104.32 3ip7 h GLY 129 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3ip7 h GLY 129 CO 0.02 -0.11 0.00 1.70 0.00 0.00 0.00 176.54 178.15 3ip7 h LYS 130 N 0.14 0.00 -1.01 4.80 3.64 -1.27 -2.63 116.57 120.24 3ip7 h LYS 130 Ca 0.23 -0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.70 3ip7 h LYS 130 Cb 0.32 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.07 3ip7 h LYS 130 CO -0.36 0.01 0.64 -0.92 -2.27 0.00 0.00 179.45 176.55 3ip7 h TYR 131 N -0.00 1.17 -0.30 1.91 5.03 -0.28 0.49 116.97 124.99 3ip7 h TYR 131 Ca 0.00 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.35 3ip7 h TYR 131 Cb 0.00 -0.38 -0.02 0.00 1.55 0.00 0.00 36.73 37.89 3ip7 h TYR 131 CO -0.08 0.53 0.20 -0.07 -1.32 0.00 0.00 178.16 177.42 3ip7 h LEU 132 N 1.08 0.33 0.12 2.82 3.38 -0.67 -1.29 115.31 121.07 3ip7 h LEU 132 Ca 0.47 -0.01 -0.28 0.00 0.09 0.00 0.00 57.88 58.16 3ip7 h LEU 132 Cb 0.35 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.03 3ip7 h LEU 132 CO -0.23 0.24 -1.25 0.00 0.09 0.00 0.00 178.44 177.29 3ip7 h ALA 133 N 1.81 0.08 0.00 1.53 0.00 0.03 -0.91 119.26 121.81 3ip7 h ALA 133 Ca 0.11 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.16 3ip7 h ALA 133 Cb -0.01 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3ip7 h ALA 133 CO -0.03 0.93 0.00 -0.25 0.00 0.00 0.00 179.25 179.90 3ip7 n ASP 134 N -3.57 0.01 0.00 0.00 9.92 0.13 -3.96 116.55 119.08 3ip7 n ASP 134 Ca -0.09 0.50 0.00 0.00 -0.53 0.00 0.00 54.79 54.67 3ip7 n ASP 134 Cb 1.02 -0.50 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 3ip7 n ASP 134 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 3ip7 n HIS 135 N -1.51 0.00 -2.26 1.24 8.25 -0.55 -4.88 115.22 115.51 3ip7 n HIS 135 Ca 0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.42 3ip7 n HIS 135 Cb 0.32 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.48 3ip7 n HIS 135 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3ip7 n PHE 136 N 0.00 1.69 -0.25 4.41 3.72 -0.36 -4.94 117.46 121.74 3ip7 n PHE 136 Ca 0.00 -1.95 0.04 0.00 -0.05 0.00 0.00 57.45 55.48 3ip7 n PHE 136 Cb 0.00 -0.28 0.09 0.00 -0.94 0.00 0.00 39.48 38.35 3ip7 n PHE 136 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3ip7 n LYS 137 N -0.63 -0.07 -0.40 -1.08 4.81 -1.17 -1.02 118.16 118.60 3ip7 n LYS 137 Ca 0.26 1.06 0.08 0.00 -0.87 0.00 0.00 58.31 58.85 3ip7 n LYS 137 Cb 0.90 -1.59 0.24 0.00 0.02 0.00 0.00 35.03 34.60 3ip7 n LYS 137 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3ip7 n ASP 138 N -5.10 3.71 -4.81 3.14 9.92 -1.26 -4.87 116.55 117.27 3ip7 n ASP 138 Ca 0.11 -2.82 -0.33 0.00 -0.53 0.00 0.00 54.79 51.21 3ip7 n ASP 138 Cb 0.34 -0.49 -0.04 0.00 -0.64 0.00 0.00 41.12 40.29 3ip7 n ASP 138 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ip7 s ALA 139 N -2.48 2.95 -0.54 2.24 0.00 -0.19 -4.99 121.76 118.76 3ip7 s ALA 139 Ca 0.39 0.44 -0.26 0.00 0.00 0.00 0.00 51.96 52.52 3ip7 s ALA 139 Cb 0.30 -3.19 0.03 0.00 0.00 0.00 0.00 23.12 20.27 3ip7 s ALA 139 CO 0.10 -0.18 1.02 0.15 0.00 0.00 0.00 175.76 176.85 3ip7 s LYS 140 N -3.44 3.44 -0.20 0.00 1.02 -1.26 -4.96 119.74 114.34 3ip7 s LYS 140 Ca 0.63 0.01 -0.11 0.00 0.02 0.00 0.00 55.97 56.53 3ip7 s LYS 140 Cb -0.12 -4.01 -0.05 0.00 -0.52 0.00 0.00 37.83 33.13 3ip7 s LYS 140 CO 0.21 -1.48 0.17 0.08 -0.92 0.00 0.00 175.35 173.40 3ip7 s VAL 141 N 4.22 5.38 -0.09 3.17 1.01 -1.26 -1.29 120.40 131.54 3ip7 s VAL 141 Ca 0.36 0.25 -0.08 0.00 0.00 0.00 0.00 61.98 62.52 3ip7 s VAL 141 Cb -0.10 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 3ip7 s VAL 141 CO 0.23 0.41 0.18 0.00 0.00 0.00 0.00 175.10 175.92 3ip7 s ALA 142 N 0.53 3.86 -0.29 5.51 0.00 0.04 0.28 121.76 131.70 3ip7 s ALA 142 Ca 0.09 -0.59 -0.05 0.00 0.00 0.00 0.00 51.96 51.41 3ip7 s ALA 142 Cb -0.12 -2.02 0.02 0.00 0.00 0.00 0.00 23.12 21.00 3ip7 s ALA 142 CO 0.00 0.61 0.04 0.42 0.00 0.00 0.00 175.76 176.83 3ip7 s ILE 143 N -1.06 3.58 0.06 0.00 1.01 -0.23 -0.37 121.20 124.18 3ip7 s ILE 143 Ca 0.17 -0.87 0.09 0.00 0.00 0.00 0.00 60.65 60.04 3ip7 s ILE 143 Cb -0.13 -2.87 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 3ip7 s ILE 143 CO 0.06 0.07 -0.25 -0.63 0.00 0.00 0.00 174.94 174.20 3ip7 s ILE 144 N 1.42 2.26 0.08 2.92 -1.09 0.66 -1.28 121.20 126.18 3ip7 s ILE 144 Ca 0.01 -1.44 -0.07 0.00 -2.23 0.00 0.00 60.65 56.92 3ip7 s ILE 144 Cb -0.17 -1.92 -0.01 0.00 -1.58 0.00 0.00 42.46 38.78 3ip7 s ILE 144 CO 0.00 0.31 0.14 -1.38 -1.23 0.00 0.00 174.94 172.78 3ip7 s HIS 145 N -0.87 0.23 -0.70 3.97 -3.43 -0.55 -1.08 115.29 112.85 3ip7 s HIS 145 Ca 0.13 -0.68 0.11 0.00 -0.80 0.00 0.00 55.06 53.82 3ip7 s HIS 145 Cb -0.10 -0.13 0.59 0.00 -1.43 0.00 0.00 32.58 31.51 3ip7 s HIS 145 CO 0.03 -0.50 1.42 -0.40 -2.00 0.00 0.00 174.74 173.30 3ip7 n ASP 146 N 0.02 4.27 -1.65 7.38 5.75 -0.90 -0.37 116.55 131.05 3ip7 n ASP 146 Ca -0.15 -2.58 -0.21 0.00 -0.01 0.00 0.00 54.79 51.85 3ip7 n ASP 146 Cb 0.62 -0.59 -0.08 0.00 -1.03 0.00 0.00 41.12 40.03 3ip7 n ASP 146 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3ip7 n LYS 147 N 0.57 -1.45 -3.73 0.11 5.02 -1.23 -4.13 118.16 113.33 3ip7 n LYS 147 Ca 0.20 1.20 -0.20 0.00 -2.02 0.00 0.00 58.31 57.50 3ip7 n LYS 147 Cb 0.88 -5.60 -0.01 0.00 -0.02 0.00 0.00 35.03 30.27 3ip7 n LYS 147 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3ip7 s THR 148 N -2.79 4.64 0.27 -0.18 -4.23 -1.26 -4.88 115.64 107.21 3ip7 s THR 148 Ca 0.00 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 3ip7 s THR 148 Cb 0.00 -3.62 0.26 0.00 1.34 0.00 0.00 72.50 70.48 3ip7 s THR 148 CO 0.00 -0.24 1.80 -0.65 -0.54 0.00 0.00 174.62 174.98 3ip7 h PRO 149 N 1.04 0.77 -0.12 3.99 0.11 -1.96 -0.78 132.00 135.06 3ip7 h PRO 149 Ca -0.49 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 3ip7 h PRO 149 Cb 1.24 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3ip7 h PRO 149 CO 0.57 0.51 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.92 3ip7 h TYR 150 N 0.79 0.26 -0.01 0.65 3.20 -1.94 -2.13 116.97 117.79 3ip7 h TYR 150 Ca 0.48 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.26 3ip7 h TYR 150 Cb 0.58 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.79 3ip7 h TYR 150 CO -0.05 0.54 -0.13 0.78 -1.64 0.00 0.00 178.16 177.66 3ip7 h GLY 151 N -0.09 0.12 1.22 1.82 0.00 -1.66 -1.02 103.07 103.46 3ip7 h GLY 151 Ca 0.03 -0.19 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 3ip7 h GLY 151 CO 0.01 0.17 0.05 -1.61 0.00 0.00 0.00 176.54 175.16 3ip7 h GLN 152 N -0.54 0.95 -0.35 4.80 4.15 -1.32 -2.02 115.11 120.78 3ip7 h GLN 152 Ca -0.01 -0.25 0.03 0.00 0.77 0.00 0.00 58.65 59.18 3ip7 h GLN 152 Cb 0.83 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.38 3ip7 h GLN 152 CO 0.03 0.91 0.15 0.78 -1.93 0.00 0.00 178.83 178.76 3ip7 h GLY 153 N 1.01 0.46 0.97 2.39 0.00 -1.25 0.77 103.07 107.42 3ip7 h GLY 153 Ca 0.17 -0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.31 3ip7 h GLY 153 CO 0.02 0.07 -0.12 -2.00 0.00 0.00 0.00 176.54 174.50 3ip7 h LEU 154 N 0.32 0.75 -1.59 3.11 5.85 -1.15 -1.11 115.31 121.50 3ip7 h LEU 154 Ca 0.15 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 3ip7 h LEU 154 Cb 0.09 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3ip7 h LEU 154 CO -0.13 0.96 0.17 0.00 -0.34 0.00 0.00 178.44 179.10 3ip7 h ALA 155 N 0.81 1.69 -0.05 1.25 0.00 -1.12 0.71 119.26 122.55 3ip7 h ALA 155 Ca 0.09 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.72 3ip7 h ALA 155 Cb 0.65 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.32 3ip7 h ALA 155 CO 0.04 0.27 -0.80 -0.44 0.00 0.00 0.00 179.25 178.32 3ip7 h ASP 156 N 0.45 0.79 -0.24 0.00 3.32 -0.62 0.19 116.42 120.32 3ip7 h ASP 156 Ca 0.12 -0.70 -0.04 0.00 0.02 0.00 0.00 57.03 56.42 3ip7 h ASP 156 Cb 0.03 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3ip7 h ASP 156 CO -0.02 1.38 0.02 -0.33 -1.72 0.00 0.00 179.24 178.58 3ip7 h GLU 157 N 0.27 0.52 -0.05 3.56 4.39 -0.76 0.18 114.58 122.69 3ip7 h GLU 157 Ca -0.09 -0.10 -0.09 0.00 0.34 0.00 0.00 59.36 59.42 3ip7 h GLU 157 Cb 1.46 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 3ip7 h GLU 157 CO 0.16 0.53 -0.31 1.15 -1.16 0.00 0.00 179.01 179.38 3ip7 h THR 158 N 0.50 1.44 -0.29 1.13 2.02 -0.80 -2.29 112.91 114.62 3ip7 h THR 158 Ca 0.11 -1.76 0.02 0.00 0.77 0.00 0.00 66.41 65.55 3ip7 h THR 158 Cb 0.29 2.40 -0.03 0.00 -1.74 0.00 0.00 68.15 69.08 3ip7 h THR 158 CO 0.01 0.50 0.13 0.50 0.37 0.00 0.00 175.52 177.03 3ip7 h LYS 159 N -0.22 0.27 -0.29 6.66 3.64 -0.80 0.87 116.57 126.70 3ip7 h LYS 159 Ca -0.02 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.40 3ip7 h LYS 159 Cb 0.97 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.68 3ip7 h LYS 159 CO 0.06 0.18 -0.08 -0.22 -2.27 0.00 0.00 179.45 177.13 3ip7 h LYS 160 N 0.28 -0.01 -0.48 1.90 3.64 -0.65 0.18 116.57 121.42 3ip7 h LYS 160 Ca 0.12 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.37 3ip7 h LYS 160 Cb 0.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3ip7 h LYS 160 CO -0.09 -0.01 -0.23 0.00 -2.27 0.00 0.00 179.45 176.86 3ip7 h ALA 161 N 1.28 0.68 0.55 5.00 0.00 -1.06 -2.47 119.26 123.24 3ip7 h ALA 161 Ca 0.14 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3ip7 h ALA 161 Cb 0.22 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.85 3ip7 h ALA 161 CO -0.31 0.68 -0.26 0.00 0.00 0.00 0.00 179.25 179.36 3ip7 h ALA 162 N 0.87 -0.74 -0.83 0.00 0.00 -0.48 -1.86 119.26 116.22 3ip7 h ALA 162 Ca 0.11 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 55.15 3ip7 h ALA 162 Cb 0.81 0.28 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 3ip7 h ALA 162 CO 0.07 -0.70 0.28 0.09 0.00 0.00 0.00 179.25 179.00 3ip7 n ASN 163 N -5.27 0.14 -0.03 0.00 3.02 0.59 -0.72 115.26 112.99 3ip7 n ASN 163 Ca -0.10 1.38 -0.17 0.00 -0.03 0.00 0.00 54.58 55.67 3ip7 n ASN 163 Cb 0.30 -0.61 -0.08 0.00 -0.61 0.00 0.00 39.78 38.78 3ip7 n ASN 163 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ip7 h ALA 164 N 1.65 0.25 0.00 5.41 0.00 -1.34 -3.18 119.26 122.05 3ip7 h ALA 164 Ca 0.63 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ip7 h ALA 164 Cb 1.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3ip7 h ALA 164 CO -0.69 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.09 3ip7 n ALA 165 N -2.58 2.38 0.00 0.00 0.00 0.10 -4.87 120.51 115.54 3ip7 n ALA 165 Ca -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.22 3ip7 n ALA 165 Cb 0.68 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.69 3ip7 n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ip7 n GLY 166 N 0.88 1.54 3.63 0.00 0.00 -0.64 -5.00 105.19 105.61 3ip7 n GLY 166 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3ip7 n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ip7 s VAL 167 N -1.93 5.10 -0.34 1.61 1.01 -0.44 -4.94 120.40 120.47 3ip7 s VAL 167 Ca 0.00 0.84 -0.02 0.00 0.00 0.00 0.00 61.98 62.81 3ip7 s VAL 167 Cb 0.00 -3.81 0.07 0.00 0.00 0.00 0.00 36.38 32.65 3ip7 s VAL 167 CO 0.00 0.13 0.07 -0.89 0.00 0.00 0.00 175.10 174.42 3ip7 s THR 168 N 2.01 3.03 0.66 3.92 2.01 -1.26 -1.37 115.64 124.64 3ip7 s THR 168 Ca 0.21 -1.70 -0.17 0.00 0.31 0.00 0.00 61.69 60.34 3ip7 s THR 168 Cb -0.15 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 3ip7 s THR 168 CO 0.09 -0.35 0.92 -1.84 -0.69 0.00 0.00 174.62 172.75 3ip7 n GLU 169 N 4.58 0.69 0.00 4.92 0.00 -1.26 -4.74 120.64 124.83 3ip7 n GLU 169 Ca -0.08 0.28 0.10 0.00 0.00 0.00 0.00 57.16 57.47 3ip7 n GLU 169 Cb 0.43 -2.15 -0.07 0.00 0.00 0.00 0.00 31.44 29.64 3ip7 n GLU 169 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 3ip7 n VAL 170 N -2.09 0.02 -3.71 3.84 0.24 0.14 -4.92 118.33 111.85 3ip7 n VAL 170 Ca 0.13 -0.08 -0.14 0.00 -2.04 0.00 0.00 64.34 62.21 3ip7 n VAL 170 Cb 0.48 0.73 -0.08 0.00 -1.47 0.00 0.00 33.84 33.50 3ip7 n VAL 170 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3ip7 s MET 171 N -3.08 0.72 -0.20 7.34 -1.94 -1.23 -5.02 119.30 115.89 3ip7 s MET 171 Ca 0.06 -0.01 -0.04 0.00 -1.71 0.00 0.00 55.69 53.99 3ip7 s MET 171 Cb 0.16 0.33 0.09 0.00 2.01 0.00 0.00 34.83 37.42 3ip7 s MET 171 CO 0.85 -0.20 0.24 -0.47 -0.01 0.00 0.00 175.02 175.43 3ip7 s TYR 172 N -1.12 -0.33 0.02 -0.03 5.04 -1.25 -1.07 117.35 118.60 3ip7 s TYR 172 Ca -0.11 0.32 -0.00 0.00 -2.44 0.00 0.00 57.07 54.83 3ip7 s TYR 172 Cb -0.04 -0.31 -0.02 0.00 0.35 0.00 0.00 41.96 41.94 3ip7 s TYR 172 CO 0.05 -0.60 -0.02 -1.21 -1.34 0.00 0.00 175.55 172.43 3ip7 s GLU 173 N 2.35 0.26 -0.01 4.97 0.41 -0.40 -5.01 118.70 121.26 3ip7 s GLU 173 Ca 0.07 -0.49 0.02 0.00 -0.41 0.00 0.00 54.97 54.16 3ip7 s GLU 173 Cb -0.15 0.09 -0.03 0.00 -1.78 0.00 0.00 34.13 32.25 3ip7 s GLU 173 CO -0.12 -0.04 -0.04 0.20 -0.49 0.00 0.00 175.26 174.76 3ip7 s GLY 174 N -1.18 1.79 0.35 -1.39 0.00 -1.26 -1.49 107.32 104.13 3ip7 s GLY 174 Ca -0.13 -0.98 0.08 0.00 0.00 0.00 0.00 44.72 43.69 3ip7 s GLY 174 CO -0.01 -0.83 -0.06 -1.34 0.00 0.00 0.00 173.10 170.86 3ip7 s VAL 175 N -1.00 2.04 -0.15 1.40 -7.23 0.51 -4.93 120.40 111.03 3ip7 s VAL 175 Ca 0.17 -2.14 -0.08 0.00 -1.81 0.00 0.00 61.98 58.13 3ip7 s VAL 175 Cb -0.11 -2.70 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 3ip7 s VAL 175 CO 0.07 -0.16 0.12 0.20 -0.31 0.00 0.00 175.10 175.03 3ip7 s ASN 176 N -3.60 6.21 0.24 4.85 0.01 -1.26 -3.49 114.94 117.89 3ip7 s ASN 176 Ca 0.33 0.33 -0.31 0.00 -0.71 0.00 0.00 52.86 52.50 3ip7 s ASN 176 Cb 0.05 -2.04 -0.13 0.00 0.41 0.00 0.00 41.25 39.54 3ip7 s ASN 176 CO 0.16 0.30 1.54 0.52 -1.51 0.00 0.00 177.10 178.11 3ip7 n VAL 177 N 2.69 0.66 0.00 1.60 0.31 -1.26 -1.25 118.33 121.08 3ip7 n VAL 177 Ca -0.18 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 3ip7 n VAL 177 Cb 0.54 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 3ip7 n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ip7 n GLY 178 N 2.65 3.15 3.75 2.92 0.00 -1.26 -5.06 105.19 111.34 3ip7 n GLY 178 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 3ip7 n GLY 178 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ip7 n ASP 179 N 0.00 3.15 -0.00 1.61 8.00 -0.38 -4.92 116.55 124.00 3ip7 n ASP 179 Ca 0.00 1.12 0.01 0.00 0.71 0.00 0.00 54.79 56.63 3ip7 n ASP 179 Cb 0.00 -1.58 -0.01 0.00 -0.02 0.00 0.00 41.12 39.51 3ip7 n ASP 179 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ip7 n LYS 180 N -0.12 4.20 -4.06 -1.24 4.76 -1.26 -4.94 118.16 115.50 3ip7 n LYS 180 Ca 0.05 -0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.17 3ip7 n LYS 180 Cb 0.41 -0.73 -0.15 0.00 -1.84 0.00 0.00 35.03 32.71 3ip7 n LYS 180 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3ip7 s ASP 181 N -1.50 4.49 -0.15 4.39 2.15 -1.26 -4.96 116.67 119.82 3ip7 s ASP 181 Ca 0.00 -1.50 0.16 0.00 0.43 0.00 0.00 52.55 51.64 3ip7 s ASP 181 Cb 0.01 -1.56 0.54 0.00 -0.30 0.00 0.00 42.92 41.61 3ip7 s ASP 181 CO 0.06 -0.21 1.45 0.49 -0.17 0.00 0.00 175.17 176.78 3ip7 n PHE 182 N 4.41 1.03 -0.16 -5.34 3.72 -1.26 -4.73 117.46 115.14 3ip7 n PHE 182 Ca -0.12 -0.79 -0.03 0.00 -0.05 0.00 0.00 57.45 56.47 3ip7 n PHE 182 Cb 0.42 -0.29 0.06 0.00 -0.94 0.00 0.00 39.48 38.74 3ip7 n PHE 182 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ip7 h SER 183 N 2.22 0.04 0.08 4.37 4.64 -1.97 0.31 113.55 123.23 3ip7 h SER 183 Ca 0.00 0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3ip7 h SER 183 Cb 1.40 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 3ip7 h SER 183 CO 0.22 0.05 -0.04 0.00 -0.87 0.00 0.00 176.83 176.19 3ip7 h ALA 184 N 1.37 -0.10 -0.50 5.18 0.00 -1.98 0.75 119.26 123.98 3ip7 h ALA 184 Ca 0.25 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3ip7 h ALA 184 Cb 0.32 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3ip7 h ALA 184 CO -0.31 -0.55 0.32 1.25 0.00 0.00 0.00 179.25 179.96 3ip7 h LEU 185 N -0.11 0.54 -0.59 0.00 5.85 -1.82 0.20 115.31 119.38 3ip7 h LEU 185 Ca -0.01 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3ip7 h LEU 185 Cb 0.09 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3ip7 h LEU 185 CO 0.02 0.39 0.35 0.40 -0.34 0.00 0.00 178.44 179.25 3ip7 h ILE 186 N 0.65 1.18 -0.70 4.05 2.04 0.08 0.32 117.51 125.13 3ip7 h ILE 186 Ca 0.19 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 3ip7 h ILE 186 Cb -0.05 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 3ip7 h ILE 186 CO -0.06 0.19 0.39 0.28 0.00 0.00 0.00 178.15 178.96 3ip7 h SER 187 N 0.80 0.86 -0.45 1.72 0.02 0.97 -0.73 113.55 116.74 3ip7 h SER 187 Ca 0.21 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 3ip7 h SER 187 Cb 0.00 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 3ip7 h SER 187 CO -0.04 0.68 0.16 0.50 -1.14 0.00 0.00 176.83 177.00 3ip7 h LYS 188 N 0.98 0.69 -0.37 3.45 3.64 0.42 -2.89 116.57 122.48 3ip7 h LYS 188 Ca 0.25 -0.14 -0.07 0.00 -1.27 0.00 0.00 60.65 59.43 3ip7 h LYS 188 Cb 0.01 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 3ip7 h LYS 188 CO -0.04 0.64 -0.05 0.52 -2.27 0.00 0.00 179.45 178.25 3ip7 h MET 189 N 0.59 0.61 -0.61 1.90 2.86 0.58 -2.45 114.93 118.41 3ip7 h MET 189 Ca 0.15 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 3ip7 h MET 189 Cb 0.23 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 3ip7 h MET 189 CO -0.01 0.67 0.32 0.87 1.06 0.00 0.00 176.91 179.81 3ip7 h LYS 190 N 0.57 0.86 -0.48 1.72 1.57 -1.12 -2.04 116.57 117.65 3ip7 h LYS 190 Ca 0.11 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3ip7 h LYS 190 Cb 0.44 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3ip7 h LYS 190 CO 0.02 0.67 0.18 0.93 -0.57 0.00 0.00 179.45 180.68 3ip7 h GLU 191 N 0.83 0.69 0.00 3.15 5.08 -1.28 -2.39 114.58 120.66 3ip7 h GLU 191 Ca 0.21 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3ip7 h GLU 191 Cb 0.08 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.20 3ip7 h GLU 191 CO -0.03 0.58 0.00 0.00 -1.00 0.00 0.00 179.01 178.56 3ip7 n ALA 192 N -2.46 2.06 -1.02 3.43 0.00 -0.88 -4.89 120.51 116.74 3ip7 n ALA 192 Ca 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 3ip7 n ALA 192 Cb 0.16 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.22 3ip7 n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ip7 n GLY 193 N 0.89 0.45 3.68 0.00 0.00 -0.90 -4.98 105.19 104.34 3ip7 n GLY 193 Ca 0.05 -0.94 -0.46 0.00 0.00 0.00 0.00 46.02 44.68 3ip7 n GLY 193 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ip7 n VAL 194 N -2.97 0.38 0.21 1.61 0.31 -0.82 -4.50 118.33 112.55 3ip7 n VAL 194 Ca -0.01 -0.07 0.02 0.00 -0.01 0.00 0.00 64.34 64.28 3ip7 n VAL 194 Cb 0.03 -1.87 -0.00 0.00 -0.91 0.00 0.00 33.84 31.08 3ip7 n VAL 194 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3ip7 n SER 195 N 5.58 0.77 -3.78 4.52 3.41 -0.41 -4.54 113.62 119.18 3ip7 n SER 195 Ca 0.20 -0.89 -0.17 0.00 -0.26 0.00 0.00 58.87 57.75 3ip7 n SER 195 Cb 0.32 0.53 -0.16 0.00 -0.26 0.00 0.00 64.21 64.64 3ip7 n SER 195 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ip7 s ILE 196 N -0.94 0.09 -0.29 -1.33 -1.09 -1.10 -2.08 121.20 114.47 3ip7 s ILE 196 Ca 0.04 0.17 -0.04 0.00 -2.23 0.00 0.00 60.65 58.58 3ip7 s ILE 196 Cb 0.04 -0.22 0.03 0.00 -1.58 0.00 0.00 42.46 40.72 3ip7 s ILE 196 CO 0.12 0.14 0.03 -0.63 -1.23 0.00 0.00 174.94 173.37 3ip7 s ILE 197 N 1.24 3.42 -0.25 2.92 1.01 0.12 -0.78 121.20 128.88 3ip7 s ILE 197 Ca -0.07 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.46 3ip7 s ILE 197 Cb -0.13 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.47 3ip7 s ILE 197 CO -0.02 0.04 0.27 -0.47 0.00 0.00 0.00 174.94 174.75 3ip7 s TYR 198 N 1.39 3.28 -0.30 3.97 6.14 0.50 -0.45 117.35 131.86 3ip7 s TYR 198 Ca -0.00 0.31 -0.04 0.00 0.64 0.00 0.00 57.07 57.98 3ip7 s TYR 198 Cb -0.18 -2.43 0.04 0.00 0.42 0.00 0.00 41.96 39.81 3ip7 s TYR 198 CO -0.00 -0.10 0.04 -0.46 0.64 0.00 0.00 175.55 175.66 3ip7 s TRP 199 N 1.60 3.21 -0.63 4.97 -0.11 -0.44 -0.24 118.94 127.30 3ip7 s TRP 199 Ca 0.11 -1.52 -0.20 0.00 1.22 0.00 0.00 56.10 55.71 3ip7 s TRP 199 Cb -0.15 -2.18 0.10 0.00 -1.50 0.00 0.00 33.47 29.74 3ip7 s TRP 199 CO 0.09 -0.73 0.80 0.20 -4.62 0.00 0.00 176.95 172.68 3ip7 s GLY 200 N 1.36 1.68 0.00 5.86 0.00 -0.24 -4.08 107.32 111.90 3ip7 s GLY 200 Ca -0.02 -2.16 0.00 0.00 0.00 0.00 0.00 44.72 42.54 3ip7 s GLY 200 CO 0.00 1.73 0.00 0.61 0.00 0.00 0.00 173.10 175.44 3ip7 n GLY 201 N 5.28 -0.65 2.95 0.20 0.00 -1.26 -2.11 105.19 109.60 3ip7 n GLY 201 Ca -0.06 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 44.98 3ip7 n GLY 201 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ip7 n LEU 202 N 0.00 0.00 0.08 0.99 4.77 -1.26 -4.29 117.00 117.29 3ip7 n LEU 202 Ca 0.00 -2.01 -0.08 0.00 -0.03 0.00 0.00 56.01 53.89 3ip7 n LEU 202 Cb 0.00 -0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 40.87 3ip7 n LEU 202 CO 0.00 -0.61 0.26 1.12 -1.33 0.00 0.00 177.39 176.84 3ip7 h HIS 203 N 0.28 0.29 0.60 -1.77 2.07 -1.70 -2.79 115.15 112.13 3ip7 h HIS 203 Ca -0.23 -0.16 -0.02 0.00 -2.85 0.00 0.00 60.37 57.11 3ip7 h HIS 203 Cb 0.96 -0.03 -0.02 0.00 2.57 0.00 0.00 27.41 30.89 3ip7 h HIS 203 CO 0.00 0.97 -0.49 1.15 -3.07 0.00 0.00 177.93 176.48 3ip7 h THR 204 N 0.11 0.03 -0.45 6.12 2.02 -1.91 0.13 112.91 118.95 3ip7 h THR 204 Ca -0.04 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.08 3ip7 h THR 204 Cb 1.48 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 3ip7 h THR 204 CO 0.13 0.00 0.04 -0.33 0.37 0.00 0.00 175.52 175.73 3ip7 h GLU 205 N -1.07 0.72 -0.37 6.66 3.07 -1.92 -2.58 114.58 119.09 3ip7 h GLU 205 Ca -0.08 -0.17 0.01 0.00 -0.50 0.00 0.00 59.36 58.63 3ip7 h GLU 205 Cb 0.90 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.69 3ip7 h GLU 205 CO -0.01 0.71 0.23 0.00 -1.40 0.00 0.00 179.01 178.54 3ip7 h ALA 206 N 1.36 0.46 -0.38 3.43 0.00 -1.27 -1.15 119.26 121.72 3ip7 h ALA 206 Ca 0.14 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3ip7 h ALA 206 Cb 0.37 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3ip7 h ALA 206 CO 0.01 -0.11 -0.07 0.78 0.00 0.00 0.00 179.25 179.87 3ip7 h GLY 207 N 0.46 0.68 1.04 0.00 0.00 -0.47 -1.46 103.07 103.31 3ip7 h GLY 207 Ca 0.14 -0.46 -0.12 0.00 0.00 0.00 0.00 47.33 46.89 3ip7 h GLY 207 CO -0.05 0.43 -0.21 1.41 0.00 0.00 0.00 176.54 178.11 3ip7 h LEU 208 N 0.59 0.88 -0.30 3.11 3.38 -1.21 -1.11 115.31 120.64 3ip7 h LEU 208 Ca 0.11 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 3ip7 h LEU 208 Cb 0.47 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3ip7 h LEU 208 CO 0.02 1.10 0.12 0.40 0.09 0.00 0.00 178.44 180.17 3ip7 h ILE 209 N 0.66 1.18 -0.29 1.22 2.04 -0.94 0.47 117.51 121.85 3ip7 h ILE 209 Ca 0.09 -0.54 0.05 0.00 1.00 0.00 0.00 64.86 65.45 3ip7 h ILE 209 Cb 0.78 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 3ip7 h ILE 209 CO 0.06 0.19 -0.02 0.40 0.00 0.00 0.00 178.15 178.78 3ip7 h ILE 210 N 0.33 0.77 0.89 -0.67 2.04 -1.26 0.19 117.51 119.80 3ip7 h ILE 210 Ca 0.10 -0.02 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 3ip7 h ILE 210 Cb 0.18 0.70 0.01 0.00 -0.74 0.00 0.00 36.82 36.97 3ip7 h ILE 210 CO -0.01 0.01 -0.43 -0.09 0.00 0.00 0.00 178.15 177.63 3ip7 h ARG 211 N 0.06 -1.15 -0.86 2.37 2.43 -0.78 -2.63 114.38 113.81 3ip7 h ARG 211 Ca 0.14 0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.39 3ip7 h ARG 211 Cb 0.19 0.26 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 3ip7 h ARG 211 CO -0.25 -0.77 0.56 1.96 -1.51 0.00 0.00 179.97 179.96 3ip7 h GLN 212 N -1.30 1.14 -0.45 0.20 4.20 -0.92 -2.22 115.11 115.76 3ip7 h GLN 212 Ca -0.12 -0.07 0.07 0.00 0.06 0.00 0.00 58.65 58.59 3ip7 h GLN 212 Cb 0.92 -0.26 -0.06 0.00 0.30 0.00 0.00 27.48 28.38 3ip7 h GLN 212 CO 0.20 0.76 0.08 0.00 -0.67 0.00 0.00 178.83 179.20 3ip7 h ALA 213 N 1.45 0.48 -0.49 3.87 0.00 -0.56 -0.35 119.26 123.67 3ip7 h ALA 213 Ca 0.32 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 3ip7 h ALA 213 Cb -0.12 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3ip7 h ALA 213 CO -0.07 -0.33 0.27 0.00 0.00 0.00 0.00 179.25 179.13 3ip7 h ALA 214 N 1.35 0.62 -0.00 0.00 0.00 -1.08 -1.07 119.26 119.08 3ip7 h ALA 214 Ca 0.22 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3ip7 h ALA 214 Cb 0.29 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3ip7 h ALA 214 CO -0.30 0.14 -0.20 -0.44 0.00 0.00 0.00 179.25 178.45 3ip7 h ASP 215 N 0.65 0.00 -0.08 0.00 3.32 -0.80 -1.74 116.42 117.77 3ip7 h ASP 215 Ca 0.17 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3ip7 h ASP 215 Cb 0.05 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3ip7 h ASP 215 CO -0.03 0.21 0.00 0.00 -1.72 0.00 0.00 179.24 177.70 3ip7 n GLN 216 N -4.30 1.69 -1.00 3.56 6.02 -0.20 -4.94 117.38 118.20 3ip7 n GLN 216 Ca -0.02 -1.01 -0.00 0.00 -0.01 0.00 0.00 57.00 55.95 3ip7 n GLN 216 Cb 0.26 -1.44 -0.00 0.00 1.02 0.00 0.00 30.24 30.08 3ip7 n GLN 216 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ip7 n GLY 217 N 1.16 0.47 3.60 1.08 0.00 -0.65 -4.97 105.19 105.86 3ip7 n GLY 217 Ca 0.18 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 3ip7 n GLY 217 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ip7 s LEU 218 N -0.04 3.54 -0.96 0.99 2.96 -0.44 -4.93 118.68 119.80 3ip7 s LEU 218 Ca 0.00 0.78 -0.20 0.00 -0.22 0.00 0.00 54.13 54.50 3ip7 s LEU 218 Cb 0.00 -3.44 0.11 0.00 0.50 0.00 0.00 46.19 43.36 3ip7 s LEU 218 CO 0.00 -1.53 1.22 -0.54 -1.32 0.00 0.00 176.35 174.18 3ip7 s LYS 219 N 5.15 3.61 -0.00 1.98 1.02 -1.26 -4.25 119.74 125.99 3ip7 s LYS 219 Ca 0.62 -1.61 -0.01 0.00 0.02 0.00 0.00 55.97 54.99 3ip7 s LYS 219 Cb -0.14 -5.04 -0.00 0.00 -0.52 0.00 0.00 37.83 32.13 3ip7 s LYS 219 CO 0.31 -1.89 0.02 0.00 -0.92 0.00 0.00 175.35 172.87 3ip7 s ALA 220 N 3.28 -0.04 0.04 5.17 0.00 -1.26 -4.57 121.76 124.37 3ip7 s ALA 220 Ca 0.37 -0.08 -0.23 0.00 0.00 0.00 0.00 51.96 52.01 3ip7 s ALA 220 Cb -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 23.12 23.03 3ip7 s ALA 220 CO -0.09 -0.06 0.71 0.21 0.00 0.00 0.00 175.76 176.53 3ip7 s LYS 221 N -0.39 4.43 -0.11 0.00 2.20 -0.88 -4.87 119.74 120.12 3ip7 s LYS 221 Ca -0.04 0.95 -0.17 0.00 -0.36 0.00 0.00 55.97 56.35 3ip7 s LYS 221 Cb -0.03 -3.35 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 3ip7 s LYS 221 CO -0.00 0.33 0.45 -1.17 -0.36 0.00 0.00 175.35 174.60 3ip7 s LEU 222 N -0.18 4.29 -0.11 5.43 0.20 -1.26 0.13 118.68 127.17 3ip7 s LEU 222 Ca 0.36 0.79 0.03 0.00 0.69 0.00 0.00 54.13 56.00 3ip7 s LEU 222 Cb -0.20 -2.64 0.00 0.00 -0.43 0.00 0.00 46.19 42.92 3ip7 s LEU 222 CO 0.21 0.05 -0.23 -0.69 -0.29 0.00 0.00 176.35 175.40 3ip7 s VAL 223 N 0.43 2.06 0.00 1.68 1.01 0.40 -1.13 120.40 124.85 3ip7 s VAL 223 Ca 0.24 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.22 3ip7 s VAL 223 Cb -0.15 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.44 3ip7 s VAL 223 CO 0.10 0.56 0.00 -0.24 0.00 0.00 0.00 175.10 175.51 3ip7 n SER 224 N 3.71 0.00 0.00 3.32 2.88 0.38 -1.32 113.62 122.59 3ip7 n SER 224 Ca -0.19 -0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.15 3ip7 n SER 224 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 3ip7 n SER 224 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ip7 n GLY 225 N 0.00 5.45 0.31 0.46 0.00 -1.26 -1.62 105.19 108.53 3ip7 n GLY 225 Ca 0.00 -1.64 0.18 0.00 0.00 0.00 0.00 46.02 44.56 3ip7 n GLY 225 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3ip7 h ASP 226 N 0.00 0.00 0.39 1.61 3.04 -1.82 -2.69 116.42 116.94 3ip7 h ASP 226 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3ip7 h ASP 226 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 3ip7 h ASP 226 CO 0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 3ip7 n GLY 227 N -1.19 -0.89 0.85 7.15 0.00 -1.26 -2.73 105.19 107.11 3ip7 n GLY 227 Ca -0.03 -0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.00 3ip7 n GLY 227 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ip7 n ILE 228 N -1.37 0.83 -2.00 -0.61 -5.35 -1.01 -1.85 119.36 108.00 3ip7 n ILE 228 Ca 0.06 -0.92 -0.41 0.00 -0.27 0.00 0.00 62.75 61.21 3ip7 n ILE 228 Cb 0.15 0.64 -0.00 0.00 -1.74 0.00 0.00 39.64 38.68 3ip7 n ILE 228 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 3ip7 n VAL 229 N 0.91 4.66 -4.11 7.28 0.24 -1.11 -4.82 118.33 121.39 3ip7 n VAL 229 Ca 0.15 -4.01 -0.14 0.00 -2.04 0.00 0.00 64.34 58.30 3ip7 n VAL 229 Cb 0.48 -2.29 -0.13 0.00 -1.47 0.00 0.00 33.84 30.43 3ip7 n VAL 229 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3ip7 s SER 230 N 1.00 0.71 0.00 -1.34 0.15 -1.26 -4.79 113.70 108.18 3ip7 s SER 230 Ca 0.50 -0.31 0.13 0.00 0.70 0.00 0.00 55.95 56.97 3ip7 s SER 230 Cb 0.15 -0.02 0.69 0.00 -1.71 0.00 0.00 66.02 65.13 3ip7 s SER 230 CO -0.05 -0.06 1.25 0.59 1.20 0.00 0.00 173.24 176.16 3ip7 n ASN 231 N 2.25 0.00 0.23 5.45 3.02 -1.26 -1.99 115.26 122.97 3ip7 n ASN 231 Ca -0.18 -0.14 0.13 0.00 -0.03 0.00 0.00 54.58 54.36 3ip7 n ASN 231 Cb 0.57 -0.14 0.37 0.00 -0.61 0.00 0.00 39.78 39.97 3ip7 n ASN 231 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3ip7 h GLU 232 N 0.00 0.00 -0.67 3.52 5.08 -1.96 -3.30 114.58 117.26 3ip7 h GLU 232 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3ip7 h GLU 232 Cb 0.06 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.25 3ip7 h GLU 232 CO 0.00 0.07 0.37 1.25 -1.00 0.00 0.00 179.01 179.70 3ip7 h LEU 233 N 0.00 0.55 -1.23 1.33 5.85 -1.72 -1.24 115.31 118.85 3ip7 h LEU 233 Ca -0.00 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.88 3ip7 h LEU 233 Cb 0.83 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.71 3ip7 h LEU 233 CO 0.01 0.36 0.58 0.00 -0.34 0.00 0.00 178.44 179.05 3ip7 h ALA 234 N 1.35 1.75 0.23 1.25 0.00 -1.81 0.48 119.26 122.51 3ip7 h ALA 234 Ca 0.30 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 3ip7 h ALA 234 Cb 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ip7 h ALA 234 CO -0.18 0.03 -0.11 0.77 0.00 0.00 0.00 179.25 179.76 3ip7 h SER 235 N 0.77 -0.26 -0.36 0.00 0.02 -1.46 0.38 113.55 112.63 3ip7 h SER 235 Ca 0.44 -0.22 0.07 0.00 -0.84 0.00 0.00 61.79 61.25 3ip7 h SER 235 Cb 0.61 0.07 -0.09 0.00 0.14 0.00 0.00 62.40 63.13 3ip7 h SER 235 CO -0.21 0.25 -0.34 0.40 -1.14 0.00 0.00 176.83 175.80 3ip7 h ILE 236 N -0.96 0.22 -0.01 3.27 2.04 -1.10 -3.08 117.51 117.88 3ip7 h ILE 236 Ca -0.03 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.63 3ip7 h ILE 236 Cb 0.47 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 3ip7 h ILE 236 CO 0.05 0.00 -0.85 0.00 0.00 0.00 0.00 178.15 177.36 3ip7 h ALA 237 N 0.67 0.52 0.00 1.87 0.00 -0.14 -3.43 119.26 118.76 3ip7 h ALA 237 Ca 0.16 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3ip7 h ALA 237 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3ip7 h ALA 237 CO -0.52 0.85 0.00 0.41 0.00 0.00 0.00 179.25 180.00 3ip7 n GLY 238 N 0.79 -1.95 0.20 0.00 0.00 0.12 -4.07 105.19 100.29 3ip7 n GLY 238 Ca -0.04 -1.43 0.15 0.00 0.00 0.00 0.00 46.02 44.69 3ip7 n GLY 238 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ip7 h ASP 239 N 0.00 0.00 0.14 1.61 3.32 -1.94 -1.00 116.42 118.55 3ip7 h ASP 239 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ip7 h ASP 239 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3ip7 h ASP 239 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3ip7 h ALA 240 N 2.11 1.00 0.00 3.45 0.00 -1.93 -2.51 119.26 121.38 3ip7 h ALA 240 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ip7 h ALA 240 Cb 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3ip7 h ALA 240 CO 0.00 0.00 -0.01 -0.24 0.00 0.00 0.00 179.25 179.00 3ip7 h VAL 241 N 0.00 0.29 -2.26 0.00 3.04 -1.40 -3.44 116.25 112.48 3ip7 h VAL 241 Ca 0.00 -0.07 -0.58 0.00 -1.01 0.00 0.00 66.70 65.04 3ip7 h VAL 241 Cb 0.07 1.05 0.04 0.00 -2.01 0.00 0.00 31.29 30.44 3ip7 h VAL 241 CO 0.00 0.01 0.93 1.21 -1.01 0.00 0.00 177.57 178.71 3ip7 n GLU 242 N -3.48 2.28 -0.05 4.17 2.13 -0.95 -1.73 120.64 123.01 3ip7 n GLU 242 Ca -0.03 0.83 0.00 0.00 0.66 0.00 0.00 57.16 58.62 3ip7 n GLU 242 Cb 0.10 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.17 3ip7 n GLU 242 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ip7 n GLY 243 N 3.82 0.75 3.68 8.31 0.00 -0.41 -5.01 105.19 116.33 3ip7 n GLY 243 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 3ip7 n GLY 243 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ip7 n THR 244 N -2.00 3.55 -4.53 2.61 -1.04 -0.70 -4.71 114.28 107.46 3ip7 n THR 244 Ca 0.00 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.22 3ip7 n THR 244 Cb 0.00 -1.40 -0.13 0.00 -1.82 0.00 0.00 70.33 66.97 3ip7 n THR 244 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3ip7 s LEU 245 N -2.45 2.29 -0.02 -4.42 1.43 -0.28 -1.25 118.68 113.98 3ip7 s LEU 245 Ca 0.72 -0.70 -0.27 0.00 -1.03 0.00 0.00 54.13 52.85 3ip7 s LEU 245 Cb -0.44 -1.25 0.06 0.00 0.03 0.00 0.00 46.19 44.59 3ip7 s LEU 245 CO 0.50 0.20 0.59 0.54 0.23 0.00 0.00 176.35 178.41 3ip7 s ASN 246 N -1.84 -0.55 0.37 2.29 4.22 -0.30 -0.47 114.94 118.65 3ip7 s ASN 246 Ca 0.14 0.50 -0.10 0.00 -2.14 0.00 0.00 52.86 51.26 3ip7 s ASN 246 Cb -0.10 0.50 -0.06 0.00 1.28 0.00 0.00 41.25 42.86 3ip7 s ASN 246 CO 0.05 -0.62 0.71 0.42 -2.04 0.00 0.00 177.10 175.63 3ip7 s THR 247 N -1.52 4.83 -0.14 0.54 -4.23 -0.64 0.59 115.64 115.07 3ip7 s THR 247 Ca -0.10 0.53 -0.34 0.00 -1.18 0.00 0.00 61.69 60.60 3ip7 s THR 247 Cb -0.01 -3.72 0.13 0.00 1.34 0.00 0.00 72.50 70.25 3ip7 s THR 247 CO 0.06 -0.43 1.21 0.12 -0.54 0.00 0.00 174.62 175.04 3ip7 s PHE 248 N -2.26 -0.12 1.10 3.99 5.36 -0.75 -2.39 117.98 122.92 3ip7 s PHE 248 Ca 0.50 0.05 -0.12 0.00 -0.96 0.00 0.00 56.93 56.40 3ip7 s PHE 248 Cb -0.10 0.52 0.24 0.00 -0.34 0.00 0.00 43.02 43.34 3ip7 s PHE 248 CO 0.29 -0.24 1.01 0.41 -1.46 0.00 0.00 175.22 175.23 3ip7 n GLY 249 N -0.19 -1.59 3.73 13.12 0.00 -1.26 -0.81 105.19 118.18 3ip7 n GLY 249 Ca -0.02 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 3ip7 n GLY 249 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ip7 n PRO 250 N -4.63 2.47 -1.79 1.61 -0.02 -1.26 -4.75 135.00 126.62 3ip7 n PRO 250 Ca 0.05 0.88 -0.43 0.00 -2.02 0.00 0.00 63.50 61.98 3ip7 n PRO 250 Cb 0.54 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.39 3ip7 n PRO 250 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3ip7 s ASP 251 N 0.25 5.95 0.33 2.55 -1.08 -1.26 -4.83 116.67 118.58 3ip7 s ASP 251 Ca 0.62 1.91 0.26 0.00 -0.52 0.00 0.00 52.55 54.82 3ip7 s ASP 251 Cb -0.54 -2.52 1.16 0.00 -1.46 0.00 0.00 42.92 39.56 3ip7 s ASP 251 CO 0.53 -1.57 1.77 1.55 0.52 0.00 0.00 175.17 177.97 3ip7 h PRO 252 N 12.78 0.00 -0.00 4.34 0.14 -1.89 -1.06 132.00 146.32 3ip7 h PRO 252 Ca -0.40 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.74 3ip7 h PRO 252 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.35 3ip7 h PRO 252 CO 0.98 0.00 -0.02 0.25 0.14 0.00 0.00 178.00 179.35 3ip7 n THR 253 N -2.40 0.00 1.15 1.56 -2.24 -1.26 -2.42 114.28 108.67 3ip7 n THR 253 Ca 0.01 -0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.91 3ip7 n THR 253 Cb 0.18 -0.47 0.21 0.00 -2.10 0.00 0.00 70.33 68.15 3ip7 n THR 253 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3ip7 n LEU 254 N -1.49 1.88 -4.67 3.22 4.77 -0.40 -4.82 117.00 115.49 3ip7 n LEU 254 Ca 0.07 -0.63 -0.42 0.00 -0.03 0.00 0.00 56.01 55.00 3ip7 n LEU 254 Cb 0.33 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 3ip7 n LEU 254 CO 0.27 0.33 1.24 -0.13 -1.33 0.00 0.00 177.39 177.77 3ip7 s ARG 255 N -2.30 4.22 0.26 3.23 0.52 -1.01 -4.90 118.95 118.95 3ip7 s ARG 255 Ca 0.25 1.99 -0.02 0.00 -0.52 0.00 0.00 55.73 57.43 3ip7 s ARG 255 Cb 0.19 -3.84 0.57 0.00 0.52 0.00 0.00 34.95 32.39 3ip7 s ARG 255 CO 0.46 -0.75 1.69 -1.35 0.02 0.00 0.00 175.30 175.37 3ip7 h PRO 256 N 8.79 0.30 -0.05 3.54 0.11 -1.90 0.11 132.00 142.90 3ip7 h PRO 256 Ca -0.35 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.76 3ip7 h PRO 256 Cb 1.15 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 3ip7 h PRO 256 CO 0.95 0.20 0.19 0.93 -0.21 0.00 0.00 178.00 180.05 3ip7 h GLU 257 N 0.31 0.00 -0.01 1.05 3.07 -1.96 -0.93 114.58 116.12 3ip7 h GLU 257 Ca 0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 3ip7 h GLU 257 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 3ip7 h GLU 257 CO -0.53 0.00 -0.40 0.09 -1.40 0.00 0.00 179.01 176.77 3ip7 n ASN 258 N -3.20 1.36 -0.38 1.42 3.02 0.36 -4.59 115.26 113.25 3ip7 n ASN 258 Ca -0.01 -1.09 -0.03 0.00 -0.03 0.00 0.00 54.58 53.42 3ip7 n ASN 258 Cb 0.26 0.32 0.01 0.00 -0.61 0.00 0.00 39.78 39.77 3ip7 n ASN 258 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3ip7 n LYS 259 N -0.52 -0.27 -0.12 3.52 4.81 -0.35 -0.48 118.16 124.75 3ip7 n LYS 259 Ca 0.10 1.48 -0.08 0.00 -0.87 0.00 0.00 58.31 58.94 3ip7 n LYS 259 Cb 0.39 -2.19 0.07 0.00 0.02 0.00 0.00 35.03 33.32 3ip7 n LYS 259 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3ip7 h GLU 260 N 0.00 0.87 -0.34 1.64 4.81 -1.82 -1.66 114.58 118.08 3ip7 h GLU 260 Ca 0.30 -0.34 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 3ip7 h GLU 260 Cb 0.54 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3ip7 h GLU 260 CO -0.95 0.98 0.12 1.25 -0.73 0.00 0.00 179.01 179.67 3ip7 h LEU 261 N 0.77 0.48 -0.50 1.64 5.85 -1.26 -0.97 115.31 121.32 3ip7 h LEU 261 Ca 0.11 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.66 3ip7 h LEU 261 Cb 0.70 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 3ip7 h LEU 261 CO 0.05 0.55 0.31 0.58 -0.34 0.00 0.00 178.44 179.59 3ip7 h VAL 262 N 0.39 1.08 -0.31 1.05 2.07 -0.64 -2.05 116.25 117.86 3ip7 h VAL 262 Ca 0.11 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 3ip7 h VAL 262 Cb 0.23 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3ip7 h VAL 262 CO -0.01 0.11 0.03 -0.33 0.02 0.00 0.00 177.57 177.40 3ip7 h GLU 263 N 0.63 0.45 -0.11 1.57 5.08 -1.05 -1.58 114.58 119.57 3ip7 h GLU 263 Ca 0.19 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3ip7 h GLU 263 Cb -0.02 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 3ip7 h GLU 263 CO -0.07 0.46 0.02 -0.22 -1.00 0.00 0.00 179.01 178.20 3ip7 h LYS 264 N 0.44 0.17 -0.65 2.33 3.64 -0.70 -0.66 116.57 121.14 3ip7 h LYS 264 Ca 0.10 -0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.52 3ip7 h LYS 264 Cb 0.24 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 3ip7 h LYS 264 CO 0.00 0.35 0.30 0.74 -2.27 0.00 0.00 179.45 178.58 3ip7 h PHE 265 N -0.04 0.54 -0.02 1.91 0.04 -1.02 -2.36 116.94 115.98 3ip7 h PHE 265 Ca 0.03 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.74 3ip7 h PHE 265 Cb 0.26 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.25 3ip7 h PHE 265 CO 0.01 0.19 -0.43 0.87 -0.60 0.00 0.00 178.31 178.35 3ip7 h LYS 266 N 0.53 0.05 0.00 1.51 1.57 -1.08 -1.10 116.57 118.05 3ip7 h LYS 266 Ca 0.32 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 59.03 3ip7 h LYS 266 Cb 0.33 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 3ip7 h LYS 266 CO -0.26 0.48 -0.22 0.00 -0.57 0.00 0.00 179.45 178.87 3ip7 h ALA 267 N 1.52 1.04 -0.01 3.86 0.00 -0.69 -1.69 119.26 123.29 3ip7 h ALA 267 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3ip7 h ALA 267 Cb 0.78 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3ip7 h ALA 267 CO 0.06 0.27 -0.08 0.00 0.00 0.00 0.00 179.25 179.50 3ip7 n ALA 268 N -2.23 2.74 -0.61 0.00 0.00 -0.50 -4.92 120.51 114.99 3ip7 n ALA 268 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3ip7 n ALA 268 Cb 0.42 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3ip7 n ALA 268 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ip7 n GLY 269 N 1.21 0.69 3.35 0.00 0.00 -0.64 -5.06 105.19 104.75 3ip7 n GLY 269 Ca 0.17 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3ip7 n GLY 269 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ip7 s PHE 270 N -2.00 2.79 -0.52 1.61 5.36 -0.70 -4.99 117.98 119.53 3ip7 s PHE 270 Ca 0.00 -0.73 -0.26 0.00 -0.96 0.00 0.00 56.93 54.99 3ip7 s PHE 270 Cb 0.00 -1.84 0.03 0.00 -0.34 0.00 0.00 43.02 40.87 3ip7 s PHE 270 CO 0.00 -0.26 1.00 1.21 -1.46 0.00 0.00 175.22 175.71 3ip7 s ASN 271 N 0.43 6.44 -0.47 6.13 2.47 -1.26 -3.03 114.94 125.64 3ip7 s ASN 271 Ca -0.11 -0.03 -0.07 0.00 0.42 0.00 0.00 52.86 53.07 3ip7 s ASN 271 Cb -0.16 -2.47 -0.20 0.00 -1.45 0.00 0.00 41.25 36.96 3ip7 s ASN 271 CO 0.05 -1.22 3.41 -0.81 -3.72 0.00 0.00 177.10 174.81 3ip7 n PRO 272 N 7.59 2.51 -1.51 0.43 -0.04 -1.26 -4.92 135.00 137.80 3ip7 n PRO 272 Ca 0.05 -1.40 -0.31 0.00 -0.04 0.00 0.00 63.50 61.81 3ip7 n PRO 272 Cb 0.48 -2.23 0.07 0.00 -0.04 0.00 0.00 33.50 31.79 3ip7 n PRO 272 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3ip7 s GLU 273 N 1.19 2.44 5.24 0.54 -1.05 -1.26 -4.43 118.70 121.37 3ip7 s GLU 273 Ca 0.67 0.85 0.00 0.00 -0.15 0.00 0.00 54.97 56.34 3ip7 s GLU 273 Cb 0.28 -1.94 0.00 0.00 -0.44 0.00 0.00 34.13 32.03 3ip7 s GLU 273 CO -0.03 -1.42 0.00 0.00 0.95 0.00 0.00 175.26 174.76 3ip7 n ALA 274 N -3.33 0.00 1.49 -0.84 0.00 -1.26 -2.11 120.51 114.46 3ip7 n ALA 274 Ca 0.07 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.66 3ip7 n ALA 274 Cb 0.55 0.00 0.58 0.00 0.00 0.00 0.00 19.45 20.57 3ip7 n ALA 274 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ip7 n TYR 275 N 0.00 0.00 -0.05 0.00 4.01 -1.26 -4.13 117.16 115.73 3ip7 n TYR 275 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.66 3ip7 n TYR 275 Cb 0.00 -0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 38.94 3ip7 n TYR 275 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3ip7 h THR 276 N 1.32 0.87 0.00 -0.72 2.02 -1.58 -1.10 112.91 113.72 3ip7 h THR 276 Ca 0.00 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 3ip7 h THR 276 Cb 0.39 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 3ip7 h THR 276 CO 0.00 0.02 -0.18 -0.07 0.37 0.00 0.00 175.52 175.65 3ip7 h LEU 277 N 0.09 0.00 -0.98 2.58 3.38 -1.78 -1.70 115.31 116.90 3ip7 h LEU 277 Ca 0.10 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 3ip7 h LEU 277 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3ip7 h LEU 277 CO -0.15 0.18 -0.15 1.88 0.09 0.00 0.00 178.44 180.29 3ip7 h TYR 278 N 0.00 0.62 -0.06 1.13 0.05 -1.61 -0.37 116.97 116.73 3ip7 h TYR 278 Ca -0.00 -0.11 -0.15 0.00 0.05 0.00 0.00 58.73 58.53 3ip7 h TYR 278 Cb 1.13 -0.16 0.01 0.00 1.01 0.00 0.00 36.73 38.72 3ip7 h TYR 278 CO 0.00 0.69 -0.53 1.03 -1.05 0.00 0.00 178.16 178.30 3ip7 h SER 279 N 0.52 0.57 -0.49 3.88 0.87 -1.02 -2.32 113.55 115.56 3ip7 h SER 279 Ca 0.09 -0.69 0.10 0.00 -1.23 0.00 0.00 61.79 60.06 3ip7 h SER 279 Cb 0.55 -0.17 -0.08 0.00 -0.44 0.00 0.00 62.40 62.26 3ip7 h SER 279 CO 0.04 1.17 -0.01 0.22 -0.53 0.00 0.00 176.83 177.72 3ip7 h TYR 280 N 0.02 -0.04 -0.40 2.24 3.20 -1.17 -1.92 116.97 118.90 3ip7 h TYR 280 Ca -0.05 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 3ip7 h TYR 280 Cb 1.20 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.54 3ip7 h TYR 280 CO 0.13 -0.12 0.03 0.00 -1.64 0.00 0.00 178.16 176.56 3ip7 h ALA 281 N 1.44 1.31 -0.71 1.82 0.00 -1.07 -1.29 119.26 120.77 3ip7 h ALA 281 Ca 0.25 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 55.03 3ip7 h ALA 281 Cb 0.37 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 3ip7 h ALA 281 CO -0.42 0.47 0.37 0.00 0.00 0.00 0.00 179.25 179.68 3ip7 h ALA 282 N 1.44 0.97 -0.42 0.00 0.00 -0.77 0.75 119.26 121.24 3ip7 h ALA 282 Ca 0.13 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 3ip7 h ALA 282 Cb 0.33 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3ip7 h ALA 282 CO 0.01 0.01 -0.17 1.98 0.00 0.00 0.00 179.25 181.08 3ip7 h MET 283 N 0.66 0.86 -0.56 0.00 -1.53 -1.01 -2.55 114.93 110.80 3ip7 h MET 283 Ca 0.34 -0.36 0.05 0.00 -3.44 0.00 0.00 59.70 56.28 3ip7 h MET 283 Cb 0.30 -0.03 -0.05 0.00 -0.55 0.00 0.00 31.60 31.27 3ip7 h MET 283 CO -0.24 1.00 0.30 1.96 0.14 0.00 0.00 176.91 180.08 3ip7 h GLN 284 N 0.68 0.57 -0.55 0.39 4.20 -0.43 -2.44 115.11 117.53 3ip7 h GLN 284 Ca 0.10 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 3ip7 h GLN 284 Cb 0.72 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 3ip7 h GLN 284 CO 0.05 0.38 0.27 0.00 -0.67 0.00 0.00 178.83 178.86 3ip7 h ALA 285 N 1.29 0.71 -0.13 3.87 0.00 -0.69 0.95 119.26 125.26 3ip7 h ALA 285 Ca 0.25 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.06 3ip7 h ALA 285 Cb 0.13 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3ip7 h ALA 285 CO -0.15 0.27 -0.06 0.82 0.00 0.00 0.00 179.25 180.13 3ip7 h ILE 286 N 0.75 0.81 -0.45 0.00 2.04 -1.28 0.97 117.51 120.34 3ip7 h ILE 286 Ca 0.19 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 3ip7 h ILE 286 Cb 0.11 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 3ip7 h ILE 286 CO -0.02 0.00 0.23 0.00 0.00 0.00 0.00 178.15 178.36 3ip7 h ALA 287 N 1.09 0.58 -0.81 1.87 0.00 -0.98 0.07 119.26 121.08 3ip7 h ALA 287 Ca 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3ip7 h ALA 287 Cb 0.15 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3ip7 h ALA 287 CO -0.16 0.12 0.42 0.78 0.00 0.00 0.00 179.25 180.41 3ip7 h GLY 288 N 0.59 1.22 1.13 0.00 0.00 -0.58 -2.28 103.07 103.14 3ip7 h GLY 288 Ca 0.16 -0.57 -0.18 0.00 0.00 0.00 0.00 47.33 46.74 3ip7 h GLY 288 CO -0.02 0.55 -0.52 0.00 0.00 0.00 0.00 176.54 176.55 3ip7 h ALA 289 N 1.22 0.46 -0.45 3.60 0.00 -0.51 -2.32 119.26 121.27 3ip7 h ALA 289 Ca 0.28 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 3ip7 h ALA 289 Cb 0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3ip7 h ALA 289 CO -0.04 0.65 0.10 0.00 0.00 0.00 0.00 179.25 179.97 3ip7 h ALA 290 N 0.68 1.35 -0.04 0.00 0.00 -0.89 0.18 119.26 120.54 3ip7 h ALA 290 Ca 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3ip7 h ALA 290 Cb 1.12 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3ip7 h ALA 290 CO 0.12 0.47 -0.06 -0.22 0.00 0.00 0.00 179.25 179.55 3ip7 h LYS 291 N 0.65 0.12 -0.73 0.00 3.64 -1.39 0.44 116.57 119.31 3ip7 h LYS 291 Ca 0.15 -0.07 0.13 0.00 -1.27 0.00 0.00 60.65 59.59 3ip7 h LYS 291 Cb 0.25 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.03 3ip7 h LYS 291 CO -0.00 0.62 0.48 0.00 -2.27 0.00 0.00 179.45 178.28 3ip7 h ALA 292 N 0.50 2.03 0.00 5.00 0.00 -1.14 -2.17 119.26 123.48 3ip7 h ALA 292 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ip7 h ALA 292 Cb 0.60 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3ip7 h ALA 292 CO 0.01 -0.22 -0.50 0.00 0.00 0.00 0.00 179.25 178.55 3ip7 n ALA 293 N -2.51 3.35 -2.38 0.00 0.00 0.59 -4.95 120.51 114.63 3ip7 n ALA 293 Ca 0.13 -0.32 -0.20 0.00 0.00 0.00 0.00 53.44 53.06 3ip7 n ALA 293 Cb 0.46 -1.15 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 3ip7 n ALA 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ip7 n GLY 294 N 1.47 -0.41 3.46 0.00 0.00 0.07 -4.96 105.19 104.82 3ip7 n GLY 294 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 3ip7 n GLY 294 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ip7 s SER 295 N -2.07 -0.56 0.00 1.61 0.15 -0.76 -5.04 113.70 107.04 3ip7 s SER 295 Ca 0.00 0.52 0.09 0.00 0.70 0.00 0.00 55.95 57.26 3ip7 s SER 295 Cb 0.00 0.50 0.24 0.00 -1.71 0.00 0.00 66.02 65.06 3ip7 s SER 295 CO 0.00 -0.62 1.17 1.33 1.20 0.00 0.00 173.24 176.33 3ip7 n VAL 296 N 0.84 0.88 -2.07 4.45 0.24 -1.26 -4.47 118.33 116.94 3ip7 n VAL 296 Ca -0.19 -0.94 -0.42 0.00 -2.04 0.00 0.00 64.34 60.74 3ip7 n VAL 296 Cb 0.58 0.58 -0.03 0.00 -1.47 0.00 0.00 33.84 33.50 3ip7 n VAL 296 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3ip7 s GLU 297 N -0.98 4.21 0.25 7.34 2.12 -1.26 -4.93 118.70 125.45 3ip7 s GLU 297 Ca 0.19 2.13 -0.03 0.00 0.36 0.00 0.00 54.97 57.62 3ip7 s GLU 297 Cb 0.10 -3.80 0.47 0.00 0.26 0.00 0.00 34.13 31.16 3ip7 s GLU 297 CO 0.13 -0.75 1.78 -1.35 -0.54 0.00 0.00 175.26 174.53 3ip7 h PRO 298 N 8.80 0.64 -0.71 4.30 0.11 -1.86 -0.92 132.00 142.37 3ip7 h PRO 298 Ca -0.39 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.71 3ip7 h PRO 298 Cb 1.18 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 3ip7 h PRO 298 CO 0.94 0.42 0.47 0.93 -0.21 0.00 0.00 178.00 180.55 3ip7 h GLU 299 N 0.66 0.87 -0.05 1.05 3.07 -1.92 -0.50 114.58 117.76 3ip7 h GLU 299 Ca 0.43 -0.05 -0.25 0.00 -0.50 0.00 0.00 59.36 58.99 3ip7 h GLU 299 Cb 0.53 -0.20 0.02 0.00 -0.84 0.00 0.00 28.75 28.27 3ip7 h GLU 299 CO -0.32 0.57 -0.93 0.87 -1.40 0.00 0.00 179.01 177.81 3ip7 h LYS 300 N 0.89 0.72 -0.78 2.33 1.79 -1.61 -2.68 116.57 117.24 3ip7 h LYS 300 Ca 0.28 -0.70 -0.02 0.00 -2.18 0.00 0.00 60.65 58.02 3ip7 h LYS 300 Cb 0.00 0.18 -0.04 0.00 -1.58 0.00 0.00 32.23 30.80 3ip7 h LYS 300 CO -0.07 1.29 0.39 0.28 -1.08 0.00 0.00 179.45 180.26 3ip7 h VAL 301 N 0.41 1.24 -0.40 0.50 2.07 -1.00 -1.14 116.25 117.94 3ip7 h VAL 301 Ca -0.10 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 66.77 3ip7 h VAL 301 Cb 1.58 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 3ip7 h VAL 301 CO 0.19 0.28 0.26 0.00 0.02 0.00 0.00 177.57 178.31 3ip7 h ALA 302 N 1.32 0.50 -0.63 1.67 0.00 -1.08 0.33 119.26 121.37 3ip7 h ALA 302 Ca 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3ip7 h ALA 302 Cb 0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3ip7 h ALA 302 CO -0.04 -0.06 0.33 0.93 0.00 0.00 0.00 179.25 180.41 3ip7 h GLU 303 N 0.52 0.88 -0.50 0.00 4.39 -1.10 -2.69 114.58 116.08 3ip7 h GLU 303 Ca 0.15 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 3ip7 h GLU 303 Cb -0.04 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 3ip7 h GLU 303 CO -0.04 0.66 0.17 0.00 -1.16 0.00 0.00 179.01 178.64 3ip7 h ALA 304 N 1.48 0.65 -0.87 3.43 0.00 -0.33 -2.51 119.26 121.12 3ip7 h ALA 304 Ca 0.22 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3ip7 h ALA 304 Cb 0.05 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.59 3ip7 h ALA 304 CO -0.03 0.29 0.55 -0.07 0.00 0.00 0.00 179.25 179.99 3ip7 h LEU 305 N 0.67 0.91 -1.03 0.00 3.38 -0.65 0.53 115.31 119.10 3ip7 h LEU 305 Ca 0.16 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 3ip7 h LEU 305 Cb 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3ip7 h LEU 305 CO -0.01 0.61 -0.46 0.11 0.09 0.00 0.00 178.44 178.79 3ip7 h LYS 306 N 1.06 0.00 0.00 1.13 1.57 -1.28 -3.30 116.57 115.76 3ip7 h LYS 306 Ca 0.35 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.95 3ip7 h LYS 306 Cb 0.05 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 3ip7 h LYS 306 CO -0.13 0.46 -1.03 0.87 -0.57 0.00 0.00 179.45 179.05 3ip7 h LYS 307 N 0.00 0.00 0.00 3.15 1.57 -0.99 -3.43 116.57 116.87 3ip7 h LYS 307 Ca -0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 3ip7 h LYS 307 Cb 0.86 0.00 0.10 0.00 0.08 0.00 0.00 32.23 33.27 3ip7 h LYS 307 CO 0.06 0.90 0.22 0.41 -0.57 0.00 0.00 179.45 180.48 3ip7 n GLY 308 N 1.47 -1.06 2.98 3.86 0.00 0.18 -4.98 105.19 107.64 3ip7 n GLY 308 Ca -0.27 -1.74 -0.11 0.00 0.00 0.00 0.00 46.02 43.90 3ip7 n GLY 308 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ip7 s SER 309 N -3.79 0.06 -0.04 1.61 1.04 -1.26 -4.42 113.70 106.89 3ip7 s SER 309 Ca 0.44 -0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.67 3ip7 s SER 309 Cb -0.01 0.12 0.02 0.00 0.10 0.00 0.00 66.02 66.25 3ip7 s SER 309 CO 0.30 -0.18 0.11 -0.36 0.98 0.00 0.00 173.24 174.10 3ip7 s PHE 310 N -0.73 -0.12 0.15 5.02 0.40 0.36 -4.93 117.98 118.12 3ip7 s PHE 310 Ca -0.08 0.32 -0.31 0.00 -0.60 0.00 0.00 56.93 56.26 3ip7 s PHE 310 Cb -0.05 0.00 -0.09 0.00 0.51 0.00 0.00 43.02 43.39 3ip7 s PHE 310 CO -0.00 -0.08 1.51 -2.14 0.70 0.00 0.00 175.22 175.21 3ip7 s PRO 311 N 0.33 4.25 0.21 0.24 0.02 -1.26 0.17 135.00 138.96 3ip7 s PRO 311 Ca -0.02 2.27 -0.04 0.00 0.02 0.00 0.00 61.00 63.23 3ip7 s PRO 311 Cb -0.03 -3.19 -0.03 0.00 0.02 0.00 0.00 34.50 31.26 3ip7 s PRO 311 CO -0.01 -0.55 0.22 0.95 -0.33 0.00 0.00 177.00 177.27 3ip7 s THR 312 N 1.15 0.00 0.12 0.99 -4.23 -0.41 -4.81 115.64 108.44 3ip7 s THR 312 Ca 0.68 -1.85 0.26 0.00 -1.18 0.00 0.00 61.69 59.59 3ip7 s THR 312 Cb -0.41 -2.43 0.26 0.00 1.34 0.00 0.00 72.50 71.25 3ip7 s THR 312 CO 0.31 0.00 1.77 0.00 -0.54 0.00 0.00 174.62 176.15 3ip7 h ALA 313 N 2.52 1.08 -0.02 3.99 0.00 -1.92 -0.16 119.26 124.75 3ip7 h ALA 313 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3ip7 h ALA 313 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3ip7 h ALA 313 CO 0.48 -0.08 -0.20 1.28 0.00 0.00 0.00 179.25 180.74 3ip7 n LEU 314 N -2.46 2.17 0.00 0.00 4.77 -1.26 -4.91 117.00 115.31 3ip7 n LEU 314 Ca -0.02 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.22 3ip7 n LEU 314 Cb 0.14 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3ip7 n LEU 314 CO 0.11 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3ip7 n GLY 315 N 1.35 -0.70 3.64 -0.72 0.00 -0.07 -4.95 105.19 103.73 3ip7 n GLY 315 Ca 0.13 -2.20 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 3ip7 n GLY 315 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ip7 s GLU 316 N -0.05 3.89 -0.15 1.61 2.56 -1.26 -1.29 118.70 124.00 3ip7 s GLU 316 Ca 0.00 1.69 -0.04 0.00 0.00 0.00 0.00 54.97 56.62 3ip7 s GLU 316 Cb 0.00 -3.99 -0.03 0.00 2.00 0.00 0.00 34.13 32.10 3ip7 s GLU 316 CO 0.00 -1.18 -0.01 -1.50 -0.56 0.00 0.00 175.26 172.01 3ip7 s ILE 317 N 4.85 4.16 0.29 -3.70 2.07 0.13 -4.89 121.20 124.11 3ip7 s ILE 317 Ca 0.69 -0.27 0.02 0.00 -1.41 0.00 0.00 60.65 59.69 3ip7 s ILE 317 Cb -0.25 -2.82 -0.06 0.00 0.13 0.00 0.00 42.46 39.46 3ip7 s ILE 317 CO 0.28 0.51 0.08 -0.94 -1.91 0.00 0.00 174.94 172.95 3ip7 s SER 318 N 0.12 1.73 0.03 4.50 1.04 -1.26 -0.49 113.70 119.36 3ip7 s SER 318 Ca 0.01 -1.38 0.03 0.00 0.48 0.00 0.00 55.95 55.10 3ip7 s SER 318 Cb -0.13 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.02 3ip7 s SER 318 CO 0.02 -0.67 -0.10 -0.36 0.98 0.00 0.00 173.24 173.11 3ip7 s PHE 319 N -3.54 0.89 0.14 5.02 0.08 -1.25 -0.92 117.98 118.40 3ip7 s PHE 319 Ca 0.37 -0.33 -0.01 0.00 0.12 0.00 0.00 56.93 57.08 3ip7 s PHE 319 Cb 0.08 -0.54 0.03 0.00 -0.57 0.00 0.00 43.02 42.03 3ip7 s PHE 319 CO 0.14 -0.01 0.19 -0.40 -0.10 0.00 0.00 175.22 175.05 3ip7 n ASP 320 N 2.05 0.12 0.11 1.36 5.68 0.26 -4.68 116.55 121.45 3ip7 n ASP 320 Ca -0.18 -1.13 0.10 0.00 -0.50 0.00 0.00 54.79 53.08 3ip7 n ASP 320 Cb 0.56 -0.14 0.45 0.00 -1.14 0.00 0.00 41.12 40.85 3ip7 n ASP 320 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3ip7 n GLU 321 N -1.39 0.14 -0.00 0.11 0.00 -1.26 -1.96 120.64 116.28 3ip7 n GLU 321 Ca 0.03 0.44 0.10 0.00 0.00 0.00 0.00 57.16 57.73 3ip7 n GLU 321 Cb 0.10 -1.81 -0.13 0.00 0.00 0.00 0.00 31.44 29.60 3ip7 n GLU 321 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3ip7 n LYS 322 N -2.08 0.41 0.00 3.44 5.02 -1.26 -4.96 118.16 118.74 3ip7 n LYS 322 Ca 0.01 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3ip7 n LYS 322 Cb 0.17 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 3ip7 n LYS 322 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ip7 n GLY 323 N 1.43 0.98 3.79 0.72 0.00 -0.83 -4.72 105.19 106.56 3ip7 n GLY 323 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 3ip7 n GLY 323 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ip7 s ASP 324 N -2.03 7.30 0.38 1.61 1.01 -1.26 -2.27 116.67 121.42 3ip7 s ASP 324 Ca 0.00 1.55 -0.22 0.00 0.71 0.00 0.00 52.55 54.60 3ip7 s ASP 324 Cb 0.00 -2.46 -0.10 0.00 1.01 0.00 0.00 42.92 41.36 3ip7 s ASP 324 CO 0.00 0.22 0.92 -2.16 0.21 0.00 0.00 175.17 174.36 3ip7 s PRO 325 N -1.17 4.29 -0.61 8.23 0.04 -1.26 -0.57 135.00 143.95 3ip7 s PRO 325 Ca 0.34 1.12 -0.16 0.00 0.04 0.00 0.00 61.00 62.34 3ip7 s PRO 325 Cb -0.22 -2.38 0.15 0.00 0.04 0.00 0.00 34.50 32.08 3ip7 s PRO 325 CO 0.24 0.08 0.58 0.15 0.04 0.00 0.00 177.00 178.10 3ip7 s LYS 326 N -2.84 3.14 0.25 4.56 1.02 -0.10 -4.89 119.74 120.88 3ip7 s LYS 326 Ca 0.58 -1.85 0.01 0.00 0.02 0.00 0.00 55.97 54.72 3ip7 s LYS 326 Cb -0.12 -4.33 -0.03 0.00 -0.52 0.00 0.00 37.83 32.82 3ip7 s LYS 326 CO 0.16 -1.34 0.21 -0.51 -0.92 0.00 0.00 175.35 172.95 3ip7 s LEU 327 N 1.37 1.29 0.30 3.17 1.43 -1.26 -4.32 118.68 120.67 3ip7 s LEU 327 Ca 0.07 -1.49 -0.29 0.00 -1.03 0.00 0.00 54.13 51.39 3ip7 s LEU 327 Cb -0.25 0.56 -0.11 0.00 0.03 0.00 0.00 46.19 46.43 3ip7 s LEU 327 CO 0.00 -0.95 1.46 -2.84 0.23 0.00 0.00 176.35 174.25 3ip7 s PRO 328 N -3.87 4.22 0.95 1.29 0.02 -1.26 -4.98 135.00 131.37 3ip7 s PRO 328 Ca 0.38 2.41 -0.16 0.00 0.02 0.00 0.00 61.00 63.65 3ip7 s PRO 328 Cb 0.05 -3.05 0.23 0.00 0.02 0.00 0.00 34.50 31.75 3ip7 s PRO 328 CO 0.17 -0.45 0.93 0.41 -0.33 0.00 0.00 177.00 177.73 3ip7 n GLY 329 N 1.55 -2.43 3.77 0.52 0.00 -1.26 -4.73 105.19 102.61 3ip7 n GLY 329 Ca 0.05 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 3ip7 n GLY 329 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ip7 s TYR 330 N -2.77 3.15 0.26 1.61 2.02 -1.26 -4.33 117.35 116.03 3ip7 s TYR 330 Ca 0.58 1.47 0.06 0.00 -0.37 0.00 0.00 57.07 58.81 3ip7 s TYR 330 Cb -0.05 -3.60 -0.05 0.00 -0.40 0.00 0.00 41.96 37.86 3ip7 s TYR 330 CO 0.44 -1.60 -0.05 0.14 -1.57 0.00 0.00 175.55 172.91 3ip7 s VAL 331 N -1.15 1.48 -0.04 0.71 -7.23 0.00 -4.92 120.40 109.26 3ip7 s VAL 331 Ca 0.48 -2.11 -0.13 0.00 -1.81 0.00 0.00 61.98 58.41 3ip7 s VAL 331 Cb -0.38 -2.37 -0.05 0.00 0.56 0.00 0.00 36.38 34.13 3ip7 s VAL 331 CO 0.51 -0.34 0.34 -0.32 -0.31 0.00 0.00 175.10 174.98 3ip7 s MET 332 N -3.76 3.85 0.16 4.82 1.75 -1.26 -1.80 119.30 123.05 3ip7 s MET 332 Ca 0.28 0.27 0.10 0.00 -1.25 0.00 0.00 55.69 55.09 3ip7 s MET 332 Cb 0.04 -3.23 -0.04 0.00 2.84 0.00 0.00 34.83 34.43 3ip7 s MET 332 CO 0.10 0.66 -0.19 0.71 -0.65 0.00 0.00 175.02 175.66 3ip7 s TYR 333 N -0.91 2.45 0.06 4.11 2.02 0.20 -1.59 117.35 123.69 3ip7 s TYR 333 Ca 0.21 -0.30 0.09 0.00 -0.37 0.00 0.00 57.07 56.70 3ip7 s TYR 333 Cb -0.15 -1.25 -0.03 0.00 -0.40 0.00 0.00 41.96 40.12 3ip7 s TYR 333 CO 0.11 0.44 -0.24 -2.00 -1.57 0.00 0.00 175.55 172.29 3ip7 s GLU 334 N -2.46 1.56 -0.32 -0.62 2.12 0.20 -1.15 118.70 118.03 3ip7 s GLU 334 Ca 0.20 -1.09 -0.21 0.00 0.36 0.00 0.00 54.97 54.22 3ip7 s GLU 334 Cb -0.09 -1.77 -0.00 0.00 0.26 0.00 0.00 34.13 32.53 3ip7 s GLU 334 CO 0.11 0.45 0.67 -1.58 -0.54 0.00 0.00 175.26 174.37 3ip7 s TRP 335 N -0.87 3.19 0.19 5.30 0.52 -0.38 -0.88 118.94 126.01 3ip7 s TRP 335 Ca 0.10 0.56 -0.01 0.00 0.02 0.00 0.00 56.10 56.77 3ip7 s TRP 335 Cb -0.10 -3.11 -0.04 0.00 -1.15 0.00 0.00 33.47 29.08 3ip7 s TRP 335 CO 0.03 -0.55 0.12 0.15 0.02 0.00 0.00 176.95 176.71 3ip7 s LYS 336 N 2.74 1.17 0.08 4.98 1.02 -0.43 -1.29 119.74 128.02 3ip7 s LYS 336 Ca 0.27 -1.61 -0.31 0.00 0.02 0.00 0.00 55.97 54.34 3ip7 s LYS 336 Cb -0.14 0.23 -0.07 0.00 -0.52 0.00 0.00 37.83 37.32 3ip7 s LYS 336 CO 0.13 -0.36 1.34 0.15 -0.92 0.00 0.00 175.35 175.69 3ip7 s LYS 337 N -4.13 4.35 0.85 1.68 1.02 -1.26 -0.86 119.74 121.38 3ip7 s LYS 337 Ca 0.37 1.97 -0.07 0.00 0.02 0.00 0.00 55.97 58.25 3ip7 s LYS 337 Cb 0.07 -3.33 0.17 0.00 -0.52 0.00 0.00 37.83 34.23 3ip7 s LYS 337 CO 0.11 -0.41 1.16 0.20 -0.92 0.00 0.00 175.35 175.49 3ip7 s GLY 338 N 1.22 1.78 0.22 -3.33 0.00 -0.27 -4.88 107.32 102.05 3ip7 s GLY 338 Ca 0.63 -1.59 -0.15 0.00 0.00 0.00 0.00 44.72 43.60 3ip7 s GLY 338 CO 0.29 -0.90 1.60 -2.55 0.00 0.00 0.00 173.10 171.54 3ip7 h PRO 339 N -1.08 -0.05 0.00 2.90 0.11 -1.96 0.39 132.00 132.31 3ip7 h PRO 339 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3ip7 h PRO 339 Cb 1.24 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3ip7 h PRO 339 CO 0.36 -0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.72 3ip7 n ASP 340 N -5.47 0.50 0.00 -2.05 5.68 -1.26 -4.84 116.55 109.11 3ip7 n ASP 340 Ca 0.08 0.71 0.00 0.00 -0.50 0.00 0.00 54.79 55.08 3ip7 n ASP 340 Cb 0.37 -0.78 0.00 0.00 -1.14 0.00 0.00 41.12 39.57 3ip7 n ASP 340 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ip7 n GLY 341 N -1.02 0.59 3.85 6.12 0.00 0.14 -5.06 105.19 109.81 3ip7 n GLY 341 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3ip7 n GLY 341 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ip7 s LYS 342 N -0.83 3.14 0.08 1.61 -2.85 -1.26 -4.69 119.74 114.94 3ip7 s LYS 342 Ca 0.00 -0.62 -0.31 0.00 -1.00 0.00 0.00 55.97 54.04 3ip7 s LYS 342 Cb 0.00 -2.85 -0.06 0.00 -2.06 0.00 0.00 37.83 32.86 3ip7 s LYS 342 CO 0.00 0.56 1.24 -0.06 0.10 0.00 0.00 175.35 177.20 3ip7 s PHE 343 N -1.52 3.39 0.31 1.78 0.08 -1.26 -1.11 117.98 119.65 3ip7 s PHE 343 Ca 0.32 1.23 -0.01 0.00 0.12 0.00 0.00 56.93 58.59 3ip7 s PHE 343 Cb -0.12 -3.48 -0.01 0.00 -0.57 0.00 0.00 43.02 38.84 3ip7 s PHE 343 CO 0.25 -1.52 0.39 -0.08 -0.10 0.00 0.00 175.22 174.16 3ip7 s THR 344 N 0.96 0.00 -0.18 0.64 -1.32 -0.04 -4.78 115.64 110.92 3ip7 s THR 344 Ca 0.59 -1.72 -0.16 0.00 -1.21 0.00 0.00 61.69 59.20 3ip7 s THR 344 Cb -0.31 -2.55 -0.04 0.00 -1.51 0.00 0.00 72.50 68.09 3ip7 s THR 344 CO 0.30 0.00 0.39 -0.72 -2.21 0.00 0.00 174.62 172.38 3ip7 s TYR 345 N -3.37 3.41 -0.02 9.09 -0.85 -1.26 -1.31 117.35 123.04 3ip7 s TYR 345 Ca 0.33 0.65 0.05 0.00 -0.52 0.00 0.00 57.07 57.58 3ip7 s TYR 345 Cb 0.01 -2.50 -0.01 0.00 0.38 0.00 0.00 41.96 39.85 3ip7 s TYR 345 CO 0.20 0.06 -0.16 0.42 -1.52 0.00 0.00 175.55 174.55 3ip7 s ILE 346 N 1.06 1.29 0.38 -3.49 -1.09 -0.06 -4.93 121.20 114.36 3ip7 s ILE 346 Ca 0.19 -0.68 -0.27 0.00 -2.23 0.00 0.00 60.65 57.66 3ip7 s ILE 346 Cb -0.14 -1.08 -0.10 0.00 -1.58 0.00 0.00 42.46 39.55 3ip7 s ILE 346 CO 0.07 0.37 1.37 -1.58 -1.23 0.00 0.00 174.94 173.95 3ip7 s GLN 347 N -0.25 4.11 0.00 2.79 0.74 -1.26 -0.62 119.66 125.16 3ip7 s GLN 347 Ca 0.03 2.33 0.21 0.00 0.05 0.00 0.00 55.36 57.99 3ip7 s GLN 347 Cb -0.08 -2.92 1.26 0.00 1.10 0.00 0.00 33.01 32.37 3ip7 s GLN 347 CO 0.00 -0.44 1.64 1.04 -0.55 0.00 0.00 175.29 176.98