#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ri7 n ASP 26 N 0.00 -3.85 0.16 1.45 10.43 -1.26 -4.87 116.55 118.60 1ri7 n ASP 26 Ca 0.00 0.07 0.07 0.00 2.57 0.00 0.00 54.79 57.50 1ri7 n ASP 26 Cb 0.00 -0.71 0.07 0.00 1.84 0.00 0.00 41.12 42.32 1ri7 n ASP 26 CO 0.00 0.00 0.00 -0.08 -1.07 0.00 0.00 177.20 176.05 1ri7 h GLU 27 N -1.19 0.00 0.16 -1.24 4.57 -2.07 -3.28 114.58 111.53 1ri7 h GLU 27 Ca -0.43 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 57.44 1ri7 h GLU 27 Cb 1.35 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.95 1ri7 h GLU 27 CO 0.25 0.26 -1.43 0.82 -1.18 0.00 0.00 179.01 177.74 1ri7 h ILE 28 N 0.00 1.30 -0.45 2.32 5.03 -2.00 -3.25 117.51 120.46 1ri7 h ILE 28 Ca -0.01 -2.86 0.07 0.00 -0.12 0.00 0.00 64.86 61.94 1ri7 h ILE 28 Cb 1.23 2.90 -0.02 0.00 -3.03 0.00 0.00 36.82 37.89 1ri7 h ILE 28 CO 0.03 0.85 0.30 0.44 -0.68 0.00 0.00 178.15 179.10 1ri7 h ASP 29 N 0.09 0.27 0.15 1.72 3.32 -1.91 0.00 116.42 120.07 1ri7 h ASP 29 Ca -0.21 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.69 1ri7 h ASP 29 Cb 2.05 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 41.53 1ri7 h ASP 29 CO 0.21 0.18 -0.56 0.11 -1.72 0.00 0.00 179.24 177.46 1ri7 h LYS 30 N 0.31 0.43 -0.50 3.56 1.57 -1.65 -2.02 116.57 118.27 1ri7 h LYS 30 Ca 0.20 -0.28 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1ri7 h LYS 30 Cb 0.39 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 1ri7 h LYS 30 CO -0.04 0.88 0.13 0.87 -0.57 0.00 0.00 179.45 180.71 1ri7 h LYS 31 N 0.33 0.76 0.34 3.15 1.57 -1.05 -1.59 116.57 120.08 1ri7 h LYS 31 Ca 0.00 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1ri7 h LYS 31 Cb 1.08 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1ri7 h LYS 31 CO 0.10 0.68 -0.16 0.82 -0.57 0.00 0.00 179.45 180.32 1ri7 h ILE 32 N 0.74 0.07 -0.06 1.86 2.04 -1.24 -3.29 117.51 117.62 1ri7 h ILE 32 Ca 0.17 -0.69 0.02 0.00 1.00 0.00 0.00 64.86 65.35 1ri7 h ILE 32 Cb 0.26 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1ri7 h ILE 32 CO -0.00 0.02 0.08 0.16 0.00 0.00 0.00 178.15 178.41 1ri7 h ILE 33 N -1.11 0.45 0.00 -0.67 3.07 -1.40 0.38 117.51 118.24 1ri7 h ILE 33 Ca -0.05 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.36 1ri7 h ILE 33 Cb 0.38 0.93 0.00 0.00 -0.27 0.00 0.00 36.82 37.87 1ri7 h ILE 33 CO 0.08 0.00 0.00 1.17 -1.05 0.00 0.00 178.15 178.35 1ri7 n LYS 34 N -3.75 0.05 -0.08 0.16 4.81 -0.60 -2.28 118.16 116.47 1ri7 n LYS 34 Ca -0.01 0.21 -0.10 0.00 -0.87 0.00 0.00 58.31 57.54 1ri7 n LYS 34 Cb 0.17 -1.58 -0.10 0.00 0.02 0.00 0.00 35.03 33.54 1ri7 n LYS 34 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1ri7 n ILE 35 N -1.67 1.04 1.17 3.15 2.08 0.12 -4.10 119.36 121.14 1ri7 n ILE 35 Ca 0.04 -0.54 0.12 0.00 0.56 0.00 0.00 62.75 62.93 1ri7 n ILE 35 Cb 0.24 -0.84 0.61 0.00 -0.75 0.00 0.00 39.64 38.91 1ri7 n ILE 35 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1ri7 n LEU 36 N -2.75 0.00 -0.10 1.39 4.77 -0.17 -0.60 117.00 119.53 1ri7 n LEU 36 Ca -0.28 0.25 -0.18 0.00 -0.03 0.00 0.00 56.01 55.77 1ri7 n LEU 36 Cb 0.93 -0.25 -0.13 0.00 -2.33 0.00 0.00 43.42 41.65 1ri7 n LEU 36 CO 0.26 -0.06 -1.23 0.00 -1.33 0.00 0.00 177.39 175.04 1ri7 n GLN 37 N -1.25 0.67 0.18 3.23 6.02 -0.96 -2.86 117.38 122.41 1ri7 n GLN 37 Ca 0.12 0.16 0.03 0.00 -0.01 0.00 0.00 57.00 57.30 1ri7 n GLN 37 Cb 0.17 -1.56 0.31 0.00 1.02 0.00 0.00 30.24 30.19 1ri7 n GLN 37 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 177.06 175.08 1ri7 h ASN 38 N 0.01 0.00 -0.98 1.08 -0.73 -1.65 -3.42 115.58 109.88 1ri7 h ASN 38 Ca -0.55 0.00 0.13 0.00 1.87 0.00 0.00 56.30 57.76 1ri7 h ASN 38 Cb 1.95 0.00 -0.21 0.00 0.27 0.00 0.00 38.32 40.33 1ri7 h ASN 38 CO -0.05 0.44 -0.09 -0.62 -0.37 0.00 0.00 177.43 176.74 1ri7 s ASP 39 N -6.69 -1.03 0.00 1.15 -1.08 0.23 -5.02 116.67 104.23 1ri7 s ASP 39 Ca -0.01 0.83 0.15 0.00 -0.52 0.00 0.00 52.55 53.00 1ri7 s ASP 39 Cb 0.13 1.94 0.62 0.00 -1.46 0.00 0.00 42.92 44.14 1ri7 s ASP 39 CO 0.72 -0.19 1.44 0.61 0.52 0.00 0.00 175.17 178.26 1ri7 n GLY 40 N 5.39 -0.09 0.10 2.66 0.00 -1.14 -3.59 105.19 108.52 1ri7 n GLY 40 Ca -0.05 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 1ri7 n GLY 40 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ri7 n LYS 41 N 0.01 0.88 -0.44 1.61 3.00 -1.26 -4.99 118.16 116.96 1ri7 n LYS 41 Ca 0.12 0.02 -0.17 0.00 -0.00 0.00 0.00 58.31 58.28 1ri7 n LYS 41 Cb 0.22 -1.48 -0.02 0.00 0.00 0.00 0.00 35.03 33.74 1ri7 n LYS 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ri7 n ALA 42 N -2.80 -1.00 -1.99 3.14 0.00 -1.24 -4.89 120.51 111.73 1ri7 n ALA 42 Ca -0.33 0.16 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 1ri7 n ALA 42 Cb 1.07 -0.51 -0.06 0.00 0.00 0.00 0.00 19.45 19.95 1ri7 n ALA 42 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ri7 s PRO 43 N 0.32 4.26 0.39 0.00 0.04 -1.26 -4.92 135.00 133.83 1ri7 s PRO 43 Ca 0.27 0.97 0.17 0.00 0.04 0.00 0.00 61.00 62.45 1ri7 s PRO 43 Cb -0.38 -2.63 1.08 0.00 0.04 0.00 0.00 34.50 32.62 1ri7 s PRO 43 CO 0.18 0.23 1.76 -0.07 0.04 0.00 0.00 177.00 179.14 1ri7 h LEU 44 N 2.81 0.48 -1.75 -3.56 3.38 -1.94 0.46 115.31 115.19 1ri7 h LEU 44 Ca -0.48 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1ri7 h LEU 44 Cb 1.19 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ri7 h LEU 44 CO 0.64 0.08 0.00 -2.11 0.09 0.00 0.00 178.44 177.14 1ri7 n ARG 45 N -4.68 0.66 0.00 1.13 1.85 -1.26 -2.09 116.66 112.27 1ri7 n ARG 45 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.11 1ri7 n ARG 45 Cb 0.88 -1.21 0.00 0.00 -1.05 0.00 0.00 32.46 31.08 1ri7 n ARG 45 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1ri7 n GLU 46 N 0.54 0.00 0.08 2.89 4.07 0.15 -4.88 120.64 123.50 1ri7 n GLU 46 Ca 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 1ri7 n GLU 46 Cb 0.29 -0.26 -0.02 0.00 -0.06 0.00 0.00 31.44 31.39 1ri7 n GLU 46 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 1ri7 h ILE 47 N 0.00 0.00 -1.44 6.31 2.04 -0.88 -3.22 117.51 120.32 1ri7 h ILE 47 Ca 0.00 -0.65 0.47 0.00 1.00 0.00 0.00 64.86 65.67 1ri7 h ILE 47 Cb 0.00 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 35.96 1ri7 h ILE 47 CO 0.00 0.00 0.95 -1.28 0.00 0.00 0.00 178.15 177.82 1ri7 h SER 48 N -0.93 0.19 -0.18 1.72 0.87 -1.68 0.72 113.55 114.24 1ri7 h SER 48 Ca -0.03 0.12 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 1ri7 h SER 48 Cb 0.22 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1ri7 h SER 48 CO 0.05 -0.17 -0.09 0.11 -0.53 0.00 0.00 176.83 176.20 1ri7 h LYS 49 N 0.05 0.38 0.01 2.24 1.57 -1.79 -3.30 116.57 115.73 1ri7 h LYS 49 Ca 0.85 -0.17 -0.28 0.00 -1.87 0.00 0.00 60.65 59.18 1ri7 h LYS 49 Cb 2.82 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 35.08 1ri7 h LYS 49 CO -0.36 0.68 -1.60 0.97 -0.57 0.00 0.00 179.45 178.58 1ri7 h ILE 50 N 0.07 0.99 0.00 1.86 2.10 -0.19 -3.44 117.51 118.90 1ri7 h ILE 50 Ca 0.04 -2.81 0.00 0.00 1.08 0.00 0.00 64.86 63.18 1ri7 h ILE 50 Cb 0.57 2.51 0.00 0.00 -1.09 0.00 0.00 36.82 38.81 1ri7 h ILE 50 CO 0.03 0.60 0.00 1.07 -1.08 0.00 0.00 178.15 178.77 1ri7 n THR 51 N -3.14 0.00 0.00 2.19 5.66 0.20 -5.11 114.28 114.09 1ri7 n THR 51 Ca -0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 1ri7 n THR 51 Cb 1.03 -0.15 0.00 0.00 -1.55 0.00 0.00 70.33 69.67 1ri7 n THR 51 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ri7 n GLY 52 N 3.56 -0.41 3.30 1.09 0.00 -1.24 -5.03 105.19 106.46 1ri7 n GLY 52 Ca 0.00 0.44 -0.36 0.00 0.00 0.00 0.00 46.02 46.11 1ri7 n GLY 52 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ri7 n LEU 53 N 0.00 -1.83 -4.46 0.99 -0.00 -1.26 -4.81 117.00 105.64 1ri7 n LEU 53 Ca 0.00 0.44 -0.38 0.00 -0.00 0.00 0.00 56.01 56.07 1ri7 n LEU 53 Cb 0.00 -1.04 0.04 0.00 -0.00 0.00 0.00 43.42 42.41 1ri7 n LEU 53 CO 0.00 -4.23 0.03 0.00 -0.00 0.00 0.00 177.39 173.19 1ri7 n ALA 54 N -2.56 -1.26 -0.07 1.47 0.00 -1.26 -4.65 120.51 112.18 1ri7 n ALA 54 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1ri7 n ALA 54 Cb 0.52 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.16 1ri7 n ALA 54 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ri7 n GLU 55 N -0.00 0.55 -0.02 0.00 0.28 -1.26 -2.36 120.64 117.83 1ri7 n GLU 55 Ca 0.11 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 57.07 1ri7 n GLU 55 Cb 0.48 -1.22 -0.02 0.00 1.43 0.00 0.00 31.44 32.10 1ri7 n GLU 55 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1ri7 n SER 56 N 1.48 1.45 0.06 -1.84 2.88 -1.26 -4.45 113.62 111.94 1ri7 n SER 56 Ca 0.00 0.03 -0.05 0.00 -1.33 0.00 0.00 58.87 57.52 1ri7 n SER 56 Cb 0.28 -0.11 -0.09 0.00 -0.75 0.00 0.00 64.21 63.54 1ri7 n SER 56 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1ri7 h THR 57 N -0.10 1.28 -0.07 2.46 2.02 -1.81 -3.23 112.91 113.47 1ri7 h THR 57 Ca -0.10 -2.92 0.02 0.00 0.77 0.00 0.00 66.41 64.17 1ri7 h THR 57 Cb 1.11 2.62 -0.02 0.00 -1.74 0.00 0.00 68.15 70.11 1ri7 h THR 57 CO -0.05 0.73 -0.07 0.40 0.37 0.00 0.00 175.52 176.91 1ri7 h ILE 58 N 0.00 0.81 0.00 3.11 2.04 -1.81 1.38 117.51 123.05 1ri7 h ILE 58 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1ri7 h ILE 58 Cb 1.71 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1ri7 h ILE 58 CO 0.10 0.00 0.19 -0.74 0.00 0.00 0.00 178.15 177.70 1ri7 h HIS 59 N -0.08 0.00 0.00 1.37 2.76 -1.77 1.32 115.15 118.74 1ri7 h HIS 59 Ca 0.05 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 57.97 1ri7 h HIS 59 Cb 0.16 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.07 1ri7 h HIS 59 CO -0.17 0.00 -1.93 0.39 -1.30 0.00 0.00 177.93 174.92 1ri7 n GLU 60 N -2.51 0.65 -0.02 5.26 -0.58 0.29 -3.33 120.64 120.40 1ri7 n GLU 60 Ca -0.02 0.09 -0.07 0.00 -0.42 0.00 0.00 57.16 56.75 1ri7 n GLU 60 Cb 0.22 -1.65 -0.06 0.00 -0.57 0.00 0.00 31.44 29.38 1ri7 n GLU 60 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ri7 h ARG 61 N 0.00 -0.07 -0.07 3.49 2.47 0.89 0.43 114.38 121.53 1ri7 h ARG 61 Ca -0.31 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.43 1ri7 h ARG 61 Cb 1.84 0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 30.18 1ri7 h ARG 61 CO 0.04 0.33 0.28 0.82 0.56 0.00 0.00 179.97 182.00 1ri7 h ILE 62 N -0.98 0.10 0.06 2.04 2.04 0.10 0.52 117.51 121.39 1ri7 h ILE 62 Ca -0.01 0.00 -0.36 0.00 1.00 0.00 0.00 64.86 65.49 1ri7 h ILE 62 Cb 0.43 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1ri7 h ILE 62 CO 0.01 0.00 -2.15 -1.14 0.00 0.00 0.00 178.15 174.87 1ri7 n ARG 63 N -3.11 0.70 -0.09 2.37 0.63 -1.19 -3.10 116.66 112.87 1ri7 n ARG 63 Ca -0.01 0.21 -0.10 0.00 -0.92 0.00 0.00 57.85 57.03 1ri7 n ARG 63 Cb 0.36 -1.64 -0.03 0.00 0.45 0.00 0.00 32.46 31.60 1ri7 n ARG 63 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 1ri7 h LYS 64 N 0.03 0.44 0.55 -0.14 2.10 0.13 0.85 116.57 120.53 1ri7 h LYS 64 Ca -0.47 -0.09 -0.02 0.00 -2.00 0.00 0.00 60.65 58.07 1ri7 h LYS 64 Cb 2.01 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 33.26 1ri7 h LYS 64 CO 0.02 0.49 -0.40 -0.07 -2.00 0.00 0.00 179.45 177.49 1ri7 h LEU 65 N 0.31 -1.04 -2.29 7.07 3.38 -1.15 0.48 115.31 122.07 1ri7 h LEU 65 Ca 0.09 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1ri7 h LEU 65 Cb 0.22 0.33 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1ri7 h LEU 65 CO -0.00 -0.59 0.22 -0.09 0.09 0.00 0.00 178.44 178.06 1ri7 h ARG 66 N -0.92 0.00 0.00 1.13 2.43 -1.47 -2.73 114.38 112.83 1ri7 h ARG 66 Ca -0.06 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 1ri7 h ARG 66 Cb 0.77 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.31 1ri7 h ARG 66 CO 0.02 0.00 -0.65 0.93 -1.51 0.00 0.00 179.97 178.76 1ri7 h GLU 67 N 0.00 0.00 0.00 0.20 5.08 0.48 -3.44 114.58 116.90 1ri7 h GLU 67 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1ri7 h GLU 67 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ri7 h GLU 67 CO -0.00 0.86 0.00 -1.13 -1.00 0.00 0.00 179.01 177.74 1ri7 n SER 68 N -4.53 0.00 0.00 1.42 3.41 0.15 -4.91 113.62 109.16 1ri7 n SER 68 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1ri7 n SER 68 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1ri7 n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ri7 n GLY 69 N 0.00 0.00 1.55 5.00 0.00 -1.22 -5.10 105.19 105.43 1ri7 n GLY 69 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1ri7 n GLY 69 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ri7 n VAL 70 N -0.27 0.00 -2.36 1.61 0.31 -1.16 -4.19 118.33 112.27 1ri7 n VAL 70 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.12 1ri7 n VAL 70 Cb 0.00 -0.48 0.02 0.00 -0.91 0.00 0.00 33.84 32.47 1ri7 n VAL 70 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1ri7 n ILE 71 N -4.39 -2.04 -0.35 2.52 5.41 -1.26 -4.35 119.36 114.89 1ri7 n ILE 71 Ca 0.07 0.05 -0.02 0.00 1.00 0.00 0.00 62.75 63.85 1ri7 n ILE 71 Cb 0.29 -1.89 0.13 0.00 -0.71 0.00 0.00 39.64 37.46 1ri7 n ILE 71 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 1ri7 h LYS 72 N 1.20 1.27 -2.59 0.38 1.57 -1.92 -3.41 116.57 113.06 1ri7 h LYS 72 Ca -0.30 -0.08 0.13 0.00 -1.87 0.00 0.00 60.65 58.53 1ri7 h LYS 72 Cb 0.76 -0.28 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 1ri7 h LYS 72 CO 0.12 0.85 0.50 0.15 -0.57 0.00 0.00 179.45 180.50 1ri7 s LYS 73 N -6.05 1.47 0.08 3.15 1.02 -1.26 -5.14 119.74 113.00 1ri7 s LYS 73 Ca -0.13 -0.92 0.08 0.00 0.02 0.00 0.00 55.97 55.03 1ri7 s LYS 73 Cb 0.18 0.43 -0.03 0.00 -0.52 0.00 0.00 37.83 37.88 1ri7 s LYS 73 CO 0.81 -0.68 -0.22 -0.06 -0.92 0.00 0.00 175.35 174.28 1ri7 s PHE 74 N -2.44 1.89 0.17 3.18 0.40 -1.26 -5.15 117.98 114.77 1ri7 s PHE 74 Ca 0.19 -0.40 -0.24 0.00 -0.60 0.00 0.00 56.93 55.88 1ri7 s PHE 74 Cb -0.03 -1.08 0.06 0.00 0.51 0.00 0.00 43.02 42.48 1ri7 s PHE 74 CO 0.06 0.17 0.78 -0.08 0.70 0.00 0.00 175.22 176.84 1ri7 s THR 75 N -0.98 0.00 -0.24 0.64 -1.32 -1.26 -5.13 115.64 107.35 1ri7 s THR 75 Ca 0.08 -0.48 -0.06 0.00 -1.21 0.00 0.00 61.69 60.03 1ri7 s THR 75 Cb -0.10 -1.56 -0.02 0.00 -1.51 0.00 0.00 72.50 69.32 1ri7 s THR 75 CO 0.03 0.00 0.02 0.00 -2.21 0.00 0.00 174.62 172.46 1ri7 s ALA 76 N -3.58 3.00 -0.66 11.08 0.00 -1.26 -4.92 121.76 125.42 1ri7 s ALA 76 Ca 0.08 -1.17 -0.27 0.00 0.00 0.00 0.00 51.96 50.60 1ri7 s ALA 76 Cb -0.03 -1.92 0.02 0.00 0.00 0.00 0.00 23.12 21.19 1ri7 s ALA 76 CO -0.02 -0.49 1.43 0.42 0.00 0.00 0.00 175.76 177.10 1ri7 s ILE 77 N 1.55 3.67 0.18 0.00 -1.09 -1.26 -4.98 121.20 119.27 1ri7 s ILE 77 Ca 0.06 0.45 -0.30 0.00 -2.23 0.00 0.00 60.65 58.63 1ri7 s ILE 77 Cb -0.15 -4.59 -0.07 0.00 -1.58 0.00 0.00 42.46 36.07 1ri7 s ILE 77 CO 0.01 -1.47 1.01 -0.63 -1.23 0.00 0.00 174.94 172.63 1ri7 s ILE 78 N 6.49 4.11 -0.06 2.92 -1.09 -1.26 -5.01 121.20 127.31 1ri7 s ILE 78 Ca 0.46 1.88 -0.30 0.00 -2.23 0.00 0.00 60.65 60.47 1ri7 s ILE 78 Cb -0.10 -4.20 -0.04 0.00 -1.58 0.00 0.00 42.46 36.54 1ri7 s ILE 78 CO 0.19 0.35 1.40 -0.62 -1.23 0.00 0.00 174.94 175.03 1ri7 s ASP 79 N -0.39 6.85 0.40 3.58 -1.08 -1.26 -4.91 116.67 119.86 1ri7 s ASP 79 Ca 0.46 2.01 0.15 0.00 -0.52 0.00 0.00 52.55 54.65 1ri7 s ASP 79 Cb -0.27 -2.55 1.01 0.00 -1.46 0.00 0.00 42.92 39.66 1ri7 s ASP 79 CO 0.33 -0.76 1.85 -0.65 0.52 0.00 0.00 175.17 176.46 1ri7 h PRO 80 N 8.24 0.47 -2.22 4.34 0.11 -1.95 -2.91 132.00 138.07 1ri7 h PRO 80 Ca -0.35 -0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.07 1ri7 h PRO 80 Cb 1.16 -0.11 -0.19 0.00 0.11 0.00 0.00 31.00 31.97 1ri7 h PRO 80 CO 0.93 0.31 1.22 0.39 -0.21 0.00 0.00 178.00 180.63 1ri7 n GLU 81 N -4.54 3.60 0.00 1.05 1.02 -1.26 -0.56 120.64 119.94 1ri7 n GLU 81 Ca 0.19 -3.24 0.00 0.00 -0.02 0.00 0.00 57.16 54.09 1ri7 n GLU 81 Cb 0.65 -2.36 0.00 0.00 -0.02 0.00 0.00 31.44 29.71 1ri7 n GLU 81 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ri7 n ALA 82 N 0.75 1.12 0.99 0.62 0.00 -1.10 -4.69 120.51 118.20 1ri7 n ALA 82 Ca 0.54 0.00 0.12 0.00 0.00 0.00 0.00 53.44 54.09 1ri7 n ALA 82 Cb 0.36 0.02 0.08 0.00 0.00 0.00 0.00 19.45 19.91 1ri7 n ALA 82 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ri7 n LEU 83 N -0.66 2.84 0.00 0.00 4.77 -1.18 -4.97 117.00 117.80 1ri7 n LEU 83 Ca 0.00 -0.96 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 1ri7 n LEU 83 Cb 0.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1ri7 n LEU 83 CO 0.00 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1ri7 n GLY 84 N 1.35 0.62 3.30 -0.72 0.00 -1.14 -5.01 105.19 103.59 1ri7 n GLY 84 Ca 0.13 -0.53 -0.44 0.00 0.00 0.00 0.00 46.02 45.18 1ri7 n GLY 84 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ri7 n TYR 85 N -2.64 4.58 1.70 1.61 4.02 0.27 -4.29 117.16 122.41 1ri7 n TYR 85 Ca 0.00 -3.45 0.15 0.00 -0.01 0.00 0.00 57.90 54.59 1ri7 n TYR 85 Cb 0.00 -1.84 0.80 0.00 -0.02 0.00 0.00 39.34 38.28 1ri7 n TYR 85 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1ri7 n SER 86 N 3.63 0.24 -4.43 7.72 3.41 -1.20 -4.26 113.62 118.72 1ri7 n SER 86 Ca 0.30 -0.76 -0.33 0.00 -0.26 0.00 0.00 58.87 57.82 1ri7 n SER 86 Cb 0.39 -0.08 -0.14 0.00 -0.26 0.00 0.00 64.21 64.12 1ri7 n SER 86 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1ri7 s MET 87 N -2.23 2.58 -0.04 4.33 -2.45 -0.98 -5.02 119.30 115.49 1ri7 s MET 87 Ca 0.39 -0.73 -0.01 0.00 -1.25 0.00 0.00 55.69 54.08 1ri7 s MET 87 Cb 0.21 -2.36 0.03 0.00 1.25 0.00 0.00 34.83 33.96 1ri7 s MET 87 CO 0.41 0.55 0.08 -1.17 1.05 0.00 0.00 175.02 175.94 1ri7 s LEU 88 N -0.54 0.98 0.10 4.11 2.96 -1.26 -2.25 118.68 122.78 1ri7 s LEU 88 Ca 0.07 0.16 -0.20 0.00 -0.22 0.00 0.00 54.13 53.94 1ri7 s LEU 88 Cb -0.11 0.14 0.05 0.00 0.50 0.00 0.00 46.19 46.76 1ri7 s LEU 88 CO 0.01 -0.13 0.48 0.00 -1.32 0.00 0.00 176.35 175.39 1ri7 s ALA 89 N 1.03 -1.20 -0.02 5.97 0.00 -0.59 -0.87 121.76 126.08 1ri7 s ALA 89 Ca -0.08 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.18 1ri7 s ALA 89 Cb -0.11 0.61 -0.03 0.00 0.00 0.00 0.00 23.12 23.58 1ri7 s ALA 89 CO -0.04 -0.61 -0.02 -0.06 0.00 0.00 0.00 175.76 175.02 1ri7 s PHE 90 N -3.26 3.02 -0.18 0.00 0.40 -0.08 -0.91 117.98 116.97 1ri7 s PHE 90 Ca -0.01 0.06 0.01 0.00 -0.60 0.00 0.00 56.93 56.39 1ri7 s PHE 90 Cb 0.00 -1.67 0.03 0.00 0.51 0.00 0.00 43.02 41.89 1ri7 s PHE 90 CO -0.08 0.42 -0.15 0.42 0.70 0.00 0.00 175.22 176.53 1ri7 s ILE 91 N -1.01 1.80 -0.11 0.64 1.01 0.61 -1.32 121.20 122.81 1ri7 s ILE 91 Ca 0.17 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.71 1ri7 s ILE 91 Cb -0.11 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 1ri7 s ILE 91 CO 0.08 0.38 0.60 -0.76 0.00 0.00 0.00 174.94 175.23 1ri7 s LEU 92 N 1.37 4.27 -0.12 2.97 1.43 0.13 -1.42 118.68 127.31 1ri7 s LEU 92 Ca 0.02 0.97 0.02 0.00 -1.03 0.00 0.00 54.13 54.11 1ri7 s LEU 92 Cb -0.14 -2.89 -0.00 0.00 0.03 0.00 0.00 46.19 43.19 1ri7 s LEU 92 CO -0.10 -0.10 -0.20 -0.69 0.23 0.00 0.00 176.35 175.48 1ri7 s VAL 93 N 0.94 2.36 -0.23 -1.59 1.01 -0.50 -0.50 120.40 121.89 1ri7 s VAL 93 Ca 0.31 -0.90 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 1ri7 s VAL 93 Cb -0.16 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1ri7 s VAL 93 CO 0.13 0.55 0.45 -0.54 0.00 0.00 0.00 175.10 175.69 1ri7 s LYS 94 N 0.46 4.11 -0.06 2.72 1.02 0.24 -1.23 119.74 127.01 1ri7 s LYS 94 Ca -0.14 0.24 0.05 0.00 0.02 0.00 0.00 55.97 56.15 1ri7 s LYS 94 Cb -0.17 -3.60 -0.01 0.00 -0.52 0.00 0.00 37.83 33.53 1ri7 s LYS 94 CO 0.06 -0.20 -0.24 0.08 -0.92 0.00 0.00 175.35 174.13 1ri7 s VAL 95 N 1.84 2.18 0.38 3.17 1.01 -1.26 -0.34 120.40 127.38 1ri7 s VAL 95 Ca 0.20 -1.02 -0.26 0.00 0.00 0.00 0.00 61.98 60.89 1ri7 s VAL 95 Cb -0.15 -1.80 -0.09 0.00 0.00 0.00 0.00 36.38 34.34 1ri7 s VAL 95 CO 0.09 0.57 1.25 -0.54 0.00 0.00 0.00 175.10 176.47 1ri7 s LYS 96 N -0.14 4.09 0.01 2.72 1.02 -0.29 -4.90 119.74 122.25 1ri7 s LYS 96 Ca -0.04 2.04 -0.36 0.00 0.02 0.00 0.00 55.97 57.64 1ri7 s LYS 96 Cb -0.14 -2.81 -0.14 0.00 -0.52 0.00 0.00 37.83 34.22 1ri7 s LYS 96 CO 0.04 -0.35 1.61 0.00 -0.92 0.00 0.00 175.35 175.73 1ri7 n ALA 97 N 0.28 0.36 -0.08 5.17 0.00 -1.26 -2.14 120.51 122.84 1ri7 n ALA 97 Ca 0.03 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1ri7 n ALA 97 Cb 0.44 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1ri7 n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ri7 n GLY 98 N 3.54 0.50 0.37 0.00 0.00 -1.26 -4.96 105.19 103.39 1ri7 n GLY 98 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 1ri7 n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ri7 n LYS 99 N -2.00 2.71 0.35 1.61 4.76 -0.91 -4.83 118.16 119.85 1ri7 n LYS 99 Ca 0.00 -2.04 -0.17 0.00 -2.87 0.00 0.00 58.31 53.22 1ri7 n LYS 99 Cb 0.00 -1.29 -0.09 0.00 -1.84 0.00 0.00 35.03 31.81 1ri7 n LYS 99 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 1ri7 h TYR 100 N 1.00 -0.78 -0.94 2.13 -1.99 -1.93 -0.71 116.97 113.75 1ri7 h TYR 100 Ca 0.00 -0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.77 1ri7 h TYR 100 Cb 0.79 0.26 -0.06 0.00 2.00 0.00 0.00 36.73 39.72 1ri7 h TYR 100 CO 0.16 -0.48 0.61 0.66 -0.00 0.00 0.00 178.16 179.11 1ri7 h SER 101 N -0.87 0.96 0.59 3.88 4.64 -1.97 0.57 113.55 121.34 1ri7 h SER 101 Ca -0.09 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.21 1ri7 h SER 101 Cb 0.66 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 62.55 1ri7 h SER 101 CO 0.14 0.62 -0.28 -0.33 -0.87 0.00 0.00 176.83 176.11 1ri7 h GLU 102 N 1.09 -0.76 -0.87 4.77 4.39 -1.88 0.12 114.58 121.45 1ri7 h GLU 102 Ca 0.40 0.05 0.02 0.00 0.34 0.00 0.00 59.36 60.17 1ri7 h GLU 102 Cb 0.16 0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 28.93 1ri7 h GLU 102 CO -0.15 -0.46 0.56 0.28 -1.16 0.00 0.00 179.01 178.09 1ri7 h VAL 103 N -0.92 1.17 -0.35 3.13 2.07 -0.80 -1.63 116.25 118.92 1ri7 h VAL 103 Ca -0.08 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 66.99 1ri7 h VAL 103 Cb 0.65 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1ri7 h VAL 103 CO 0.13 0.20 -0.06 0.00 0.02 0.00 0.00 177.57 177.86 1ri7 h ALA 104 N 1.34 1.24 -0.08 1.67 0.00 0.25 -2.29 119.26 121.39 1ri7 h ALA 104 Ca 0.33 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ri7 h ALA 104 Cb -0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ri7 h ALA 104 CO -0.10 0.50 -0.04 1.03 0.00 0.00 0.00 179.25 180.64 1ri7 h SER 105 N 0.54 0.18 -0.46 0.00 0.87 -0.22 -1.27 113.55 113.18 1ri7 h SER 105 Ca 0.11 -0.42 0.09 0.00 -1.23 0.00 0.00 61.79 60.34 1ri7 h SER 105 Cb 0.44 -0.05 -0.08 0.00 -0.44 0.00 0.00 62.40 62.27 1ri7 h SER 105 CO 0.02 0.56 -0.08 -1.13 -0.53 0.00 0.00 176.83 175.67 1ri7 h ASN 106 N -0.20 -0.36 -0.25 6.23 -0.73 -1.09 -2.42 115.58 116.76 1ri7 h ASN 106 Ca 0.02 0.13 -0.13 0.00 1.87 0.00 0.00 56.30 58.19 1ri7 h ASN 106 Cb 0.49 0.26 -0.01 0.00 0.27 0.00 0.00 38.32 39.33 1ri7 h ASN 106 CO 0.01 -0.13 -0.29 -0.07 -0.37 0.00 0.00 177.43 176.59 1ri7 h LEU 107 N 0.03 0.78 -2.36 0.34 3.38 -1.38 -3.13 115.31 112.97 1ri7 h LEU 107 Ca 0.23 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1ri7 h LEU 107 Cb 0.35 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1ri7 h LEU 107 CO -0.45 1.02 -0.03 0.00 0.09 0.00 0.00 178.44 179.06 1ri7 h ALA 108 N 1.03 1.17 -0.58 1.53 0.00 -0.72 -2.82 119.26 118.88 1ri7 h ALA 108 Ca 0.08 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ri7 h ALA 108 Cb 0.81 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1ri7 h ALA 108 CO 0.07 0.04 0.34 0.87 0.00 0.00 0.00 179.25 180.57 1ri7 h LYS 109 N 0.00 0.64 -6.34 0.00 1.79 -1.47 -3.42 116.57 107.77 1ri7 h LYS 109 Ca -0.00 -0.04 -0.55 0.00 -2.18 0.00 0.00 60.65 57.88 1ri7 h LYS 109 Cb 0.18 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1ri7 h LYS 109 CO 0.00 0.42 0.76 0.71 -1.08 0.00 0.00 179.45 180.27 1ri7 s TYR 110 N -6.13 3.03 -0.44 -1.35 1.51 -1.06 -4.92 117.35 108.00 1ri7 s TYR 110 Ca -0.13 1.03 0.23 0.00 -1.01 0.00 0.00 57.07 57.19 1ri7 s TYR 110 Cb 0.14 -3.53 1.01 0.00 -0.11 0.00 0.00 41.96 39.46 1ri7 s TYR 110 CO 0.75 -1.84 1.70 -0.35 -1.11 0.00 0.00 175.55 174.70 1ri7 n PRO 111 N 5.29 0.18 0.11 -1.71 -0.04 -1.26 -1.99 135.00 135.57 1ri7 n PRO 111 Ca 0.12 0.46 -0.03 0.00 -0.04 0.00 0.00 63.50 64.01 1ri7 n PRO 111 Cb 0.45 -1.88 0.03 0.00 -0.04 0.00 0.00 33.50 32.06 1ri7 n PRO 111 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ri7 h GLU 112 N 0.00 0.00 -6.08 0.54 3.07 -1.91 -3.39 114.58 106.80 1ri7 h GLU 112 Ca 0.00 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.28 1ri7 h GLU 112 Cb 0.30 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 28.11 1ri7 h GLU 112 CO 0.00 0.76 1.14 0.42 -1.40 0.00 0.00 179.01 179.93 1ri7 s ILE 113 N -3.10 3.92 0.09 3.13 1.01 -0.84 -0.87 121.20 124.54 1ri7 s ILE 113 Ca 0.01 -0.21 0.12 0.00 0.00 0.00 0.00 60.65 60.57 1ri7 s ILE 113 Cb 0.11 -4.93 -0.03 0.00 0.01 0.00 0.00 42.46 37.62 1ri7 s ILE 113 CO 0.78 -1.82 1.49 1.62 0.00 0.00 0.00 174.94 177.01 1ri7 h VAL 114 N 6.27 1.26 -3.41 2.92 3.04 -1.18 -3.46 116.25 121.69 1ri7 h VAL 114 Ca -0.09 -2.43 -0.18 0.00 -1.01 0.00 0.00 66.70 62.99 1ri7 h VAL 114 Cb 1.04 2.39 -0.25 0.00 -2.01 0.00 0.00 31.29 32.46 1ri7 h VAL 114 CO 1.31 0.65 -0.53 -1.61 -1.01 0.00 0.00 177.57 176.37 1ri7 s GLU 115 N -3.16 0.26 -0.13 4.17 2.02 -1.07 -4.97 118.70 115.82 1ri7 s GLU 115 Ca 0.01 0.05 -0.04 0.00 0.02 0.00 0.00 54.97 55.01 1ri7 s GLU 115 Cb 0.10 0.12 0.05 0.00 0.10 0.00 0.00 34.13 34.50 1ri7 s GLU 115 CO 0.76 -0.05 0.08 0.08 0.02 0.00 0.00 175.26 176.15 1ri7 s VAL 116 N -0.31 -0.08 -0.03 2.63 1.01 -1.26 -1.47 120.40 120.89 1ri7 s VAL 116 Ca -0.04 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.02 1ri7 s VAL 116 Cb -0.03 -0.44 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 1ri7 s VAL 116 CO 0.01 -0.12 -0.18 -0.31 0.00 0.00 0.00 175.10 174.49 1ri7 s TYR 117 N 2.14 1.70 -0.14 5.22 1.51 -0.53 -4.98 117.35 122.27 1ri7 s TYR 117 Ca 0.03 -0.40 -0.18 0.00 -1.01 0.00 0.00 57.07 55.51 1ri7 s TYR 117 Cb -0.15 -1.12 -0.04 0.00 -0.11 0.00 0.00 41.96 40.54 1ri7 s TYR 117 CO -0.07 -0.09 0.46 -2.00 -1.11 0.00 0.00 175.55 172.74 1ri7 s GLU 118 N -0.23 4.29 0.32 -0.62 2.12 -1.26 -1.02 118.70 122.31 1ri7 s GLU 118 Ca 0.02 0.40 0.04 0.00 0.36 0.00 0.00 54.97 55.79 1ri7 s GLU 118 Cb -0.09 -3.47 -0.03 0.00 0.26 0.00 0.00 34.13 30.80 1ri7 s GLU 118 CO 0.01 0.09 0.19 0.95 -0.54 0.00 0.00 175.26 175.95 1ri7 s THR 119 N 0.85 0.26 0.61 -1.70 -4.23 0.05 -4.97 115.64 106.51 1ri7 s THR 119 Ca 0.24 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.81 1ri7 s THR 119 Cb -0.15 -2.48 0.09 0.00 1.34 0.00 0.00 72.50 71.30 1ri7 s THR 119 CO 0.09 0.00 0.84 0.42 -0.54 0.00 0.00 174.62 175.43 1ri7 s THR 120 N -3.53 2.22 0.00 3.99 -4.23 -1.26 -4.58 115.64 108.26 1ri7 s THR 120 Ca 0.35 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 60.00 1ri7 s THR 120 Cb 0.04 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.52 1ri7 s THR 120 CO 0.20 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.89 1ri7 n GLY 121 N -2.40 -3.38 0.36 3.99 0.00 -1.26 -4.64 105.19 97.86 1ri7 n GLY 121 Ca 0.15 -2.13 0.08 0.00 0.00 0.00 0.00 46.02 44.12 1ri7 n GLY 121 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ri7 h ASP 122 N 0.00 0.69 -1.94 1.61 3.32 -2.02 -3.42 116.42 114.66 1ri7 h ASP 122 Ca 0.00 0.02 -0.48 0.00 0.02 0.00 0.00 57.03 56.58 1ri7 h ASP 122 Cb 0.00 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 1ri7 h ASP 122 CO 0.00 0.41 -0.44 -0.31 -1.72 0.00 0.00 179.24 177.18 1ri7 s TYR 123 N -5.70 3.03 -0.05 4.55 1.51 -1.26 -4.97 117.35 114.46 1ri7 s TYR 123 Ca -0.10 -0.22 0.22 0.00 -1.01 0.00 0.00 57.07 55.95 1ri7 s TYR 123 Cb 0.20 -1.73 -0.32 0.00 -0.11 0.00 0.00 41.96 40.00 1ri7 s TYR 123 CO 0.78 0.24 0.46 -0.25 -1.11 0.00 0.00 175.55 175.67 1ri7 n ASP 124 N -1.39 0.03 -3.90 2.29 8.00 -0.36 -4.51 116.55 116.71 1ri7 n ASP 124 Ca -0.03 0.01 -0.11 0.00 0.71 0.00 0.00 54.79 55.37 1ri7 n ASP 124 Cb 0.59 1.84 -0.11 0.00 -0.02 0.00 0.00 41.12 43.43 1ri7 n ASP 124 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1ri7 s MET 125 N -3.41 0.39 -0.16 -1.24 -1.94 -0.74 -0.77 119.30 111.42 1ri7 s MET 125 Ca -0.08 -0.40 0.01 0.00 -1.71 0.00 0.00 55.69 53.50 1ri7 s MET 125 Cb 0.13 0.16 0.01 0.00 2.01 0.00 0.00 34.83 37.14 1ri7 s MET 125 CO 0.90 -0.08 -0.17 0.08 -0.01 0.00 0.00 175.02 175.73 1ri7 s VAL 126 N -1.25 2.42 -0.15 -6.03 1.01 -0.19 -1.41 120.40 114.80 1ri7 s VAL 126 Ca -0.14 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1ri7 s VAL 126 Cb -0.08 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 34.29 1ri7 s VAL 126 CO 0.01 0.52 -0.15 -0.69 0.00 0.00 0.00 175.10 174.79 1ri7 s VAL 127 N 0.99 2.70 -0.26 2.92 1.01 -0.51 -1.45 120.40 125.81 1ri7 s VAL 127 Ca -0.02 -0.76 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 1ri7 s VAL 127 Cb -0.15 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1ri7 s VAL 127 CO -0.04 0.52 0.14 -0.75 0.00 0.00 0.00 175.10 174.97 1ri7 s LYS 128 N 0.73 3.88 -0.00 2.72 2.47 -0.54 -0.28 119.74 128.71 1ri7 s LYS 128 Ca -0.07 -0.36 0.04 0.00 -1.56 0.00 0.00 55.97 54.02 1ri7 s LYS 128 Cb -0.15 -3.51 -0.01 0.00 -1.46 0.00 0.00 37.83 32.70 1ri7 s LYS 128 CO 0.01 -0.11 -0.12 -1.50 0.16 0.00 0.00 175.35 173.79 1ri7 s ILE 129 N 1.50 0.93 -0.12 5.43 2.07 -0.09 -0.81 121.20 130.11 1ri7 s ILE 129 Ca 0.07 -0.57 0.03 0.00 -1.41 0.00 0.00 60.65 58.76 1ri7 s ILE 129 Cb -0.15 -0.79 0.00 0.00 0.13 0.00 0.00 42.46 41.65 1ri7 s ILE 129 CO 0.07 0.21 -0.23 -0.13 -1.91 0.00 0.00 174.94 172.95 1ri7 s ARG 130 N -0.42 3.06 0.43 3.50 0.52 -0.05 -1.54 118.95 124.46 1ri7 s ARG 130 Ca 0.04 -0.86 0.04 0.00 -0.52 0.00 0.00 55.73 54.43 1ri7 s ARG 130 Cb -0.05 -2.37 -0.02 0.00 0.52 0.00 0.00 34.95 33.03 1ri7 s ARG 130 CO -0.00 0.11 0.14 0.95 0.02 0.00 0.00 175.30 176.52 1ri7 s THR 131 N 0.52 0.54 -0.17 0.02 -4.23 -0.95 -4.64 115.64 106.72 1ri7 s THR 131 Ca -0.14 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.38 1ri7 s THR 131 Cb -0.17 -2.27 -0.22 0.00 1.34 0.00 0.00 72.50 71.18 1ri7 s THR 131 CO 0.05 0.00 0.15 0.29 -0.54 0.00 0.00 174.62 174.56 1ri7 n LYS 132 N -0.97 0.70 -1.45 3.99 5.02 -1.26 -2.33 118.16 121.86 1ri7 n LYS 132 Ca -0.07 0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1ri7 n LYS 132 Cb 0.65 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1ri7 n LYS 132 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ri7 n ASN 133 N -3.28 0.71 0.09 4.39 4.13 -1.26 -3.90 115.26 116.14 1ri7 n ASN 133 Ca -0.36 -0.72 0.11 0.00 1.68 0.00 0.00 54.58 55.29 1ri7 n ASN 133 Cb 1.04 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 39.26 1ri7 n ASN 133 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1ri7 n SER 134 N -1.65 0.76 0.06 6.41 7.64 -1.26 -3.47 113.62 122.11 1ri7 n SER 134 Ca 0.00 0.30 -0.21 0.00 1.01 0.00 0.00 58.87 59.97 1ri7 n SER 134 Cb 0.00 0.60 -0.12 0.00 -1.01 0.00 0.00 64.21 63.69 1ri7 n SER 134 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1ri7 h GLU 135 N 0.00 0.64 -0.86 1.43 4.81 -1.98 -1.09 114.58 117.53 1ri7 h GLU 135 Ca -0.00 -0.76 -0.02 0.00 -0.13 0.00 0.00 59.36 58.45 1ri7 h GLU 135 Cb 1.01 0.23 -0.04 0.00 0.63 0.00 0.00 28.75 30.58 1ri7 h GLU 135 CO 0.00 1.33 0.46 1.49 -0.73 0.00 0.00 179.01 181.56 1ri7 h GLU 136 N 0.29 1.21 -0.66 1.92 4.81 -1.98 0.24 114.58 120.40 1ri7 h GLU 136 Ca -0.15 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 58.91 1ri7 h GLU 136 Cb 1.74 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 30.86 1ri7 h GLU 136 CO 0.21 0.89 0.33 1.25 -0.73 0.00 0.00 179.01 180.96 1ri7 h LEU 137 N 1.21 0.86 -1.13 1.64 5.85 -1.57 -1.14 115.31 121.04 1ri7 h LEU 137 Ca 0.30 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 1ri7 h LEU 137 Cb 0.04 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 1ri7 h LEU 137 CO -0.05 0.75 -0.04 -1.13 -0.34 0.00 0.00 178.44 177.63 1ri7 h ASN 138 N 0.92 0.54 -0.39 1.25 -1.24 0.03 -0.13 115.58 116.56 1ri7 h ASN 138 Ca 0.23 -0.12 -0.01 0.00 0.71 0.00 0.00 56.30 57.11 1ri7 h ASN 138 Cb 0.11 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 38.99 1ri7 h ASN 138 CO -0.03 0.64 0.19 0.78 -1.29 0.00 0.00 177.43 177.72 1ri7 h ASN 139 N 0.54 0.51 -0.07 1.15 -0.26 0.11 0.40 115.58 117.95 1ri7 h ASN 139 Ca 0.11 -0.12 -0.06 0.00 -0.56 0.00 0.00 56.30 55.67 1ri7 h ASN 139 Cb 0.40 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.52 1ri7 h ASN 139 CO 0.02 0.48 -0.13 -0.26 -1.06 0.00 0.00 177.43 176.48 1ri7 h PHE 140 N 0.50 0.42 -0.38 1.19 -1.00 -0.67 -0.70 116.94 116.29 1ri7 h PHE 140 Ca 0.14 -0.06 -0.10 0.00 2.81 0.00 0.00 57.97 60.76 1ri7 h PHE 140 Cb 0.10 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 1ri7 h PHE 140 CO -0.02 0.52 -0.16 -0.07 -1.61 0.00 0.00 178.31 176.97 1ri7 h LEU 141 N 0.37 0.79 -0.60 1.54 3.38 -0.41 0.15 115.31 120.53 1ri7 h LEU 141 Ca 0.07 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1ri7 h LEU 141 Cb 0.45 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1ri7 h LEU 141 CO 0.03 1.01 0.25 0.44 0.09 0.00 0.00 178.44 180.26 1ri7 h ASP 142 N 0.57 0.82 0.27 -0.43 3.32 -0.53 -0.28 116.42 120.16 1ri7 h ASP 142 Ca 0.09 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 1ri7 h ASP 142 Cb 0.70 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1ri7 h ASP 142 CO 0.05 0.76 -0.13 0.25 -1.72 0.00 0.00 179.24 178.45 1ri7 h LEU 143 N 0.83 -0.30 -0.72 1.55 6.46 -0.96 -2.10 115.31 120.07 1ri7 h LEU 143 Ca 0.20 -0.10 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 1ri7 h LEU 143 Cb 0.18 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.15 1ri7 h LEU 143 CO -0.02 -0.09 0.47 0.40 -0.62 0.00 0.00 178.44 178.58 1ri7 h ILE 144 N -0.51 1.16 0.00 4.05 2.04 -0.62 -1.47 117.51 122.16 1ri7 h ILE 144 Ca -0.04 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 1ri7 h ILE 144 Cb 0.38 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1ri7 h ILE 144 CO 0.06 0.17 -0.09 1.23 0.00 0.00 0.00 178.15 179.53 1ri7 h GLY 145 N 0.94 0.00 -1.95 5.37 0.00 -1.02 -2.31 103.07 104.10 1ri7 h GLY 145 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1ri7 h GLY 145 CO -0.08 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.90 1ri7 n SER 146 N -3.30 2.85 -4.76 0.19 7.64 -0.59 -4.86 113.62 110.79 1ri7 n SER 146 Ca -0.01 -1.99 -0.40 0.00 1.01 0.00 0.00 58.87 57.48 1ri7 n SER 146 Cb 0.29 -0.35 -0.05 0.00 -1.01 0.00 0.00 64.21 63.08 1ri7 n SER 146 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ri7 s ILE 147 N -1.30 4.50 -0.01 0.44 1.01 -0.87 -4.99 121.20 119.97 1ri7 s ILE 147 Ca 0.36 1.74 -0.30 0.00 0.00 0.00 0.00 60.65 62.44 1ri7 s ILE 147 Cb 0.19 -4.16 -0.06 0.00 0.01 0.00 0.00 42.46 38.43 1ri7 s ILE 147 CO 0.24 0.44 1.63 -2.84 0.00 0.00 0.00 174.94 174.41 1ri7 s PRO 148 N -0.63 4.20 0.00 2.79 0.02 -1.26 -2.25 135.00 137.87 1ri7 s PRO 148 Ca 0.38 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.61 1ri7 s PRO 148 Cb -0.22 -3.82 0.00 0.00 0.02 0.00 0.00 34.50 30.47 1ri7 s PRO 148 CO 0.26 -0.78 0.00 0.41 -0.33 0.00 0.00 177.00 176.56 1ri7 n GLY 149 N 4.04 1.44 3.65 0.52 0.00 -1.26 -4.67 105.19 108.91 1ri7 n GLY 149 Ca 0.16 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1ri7 n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ri7 s VAL 150 N -1.32 4.12 -1.24 1.61 1.01 -0.95 -1.14 120.40 122.49 1ri7 s VAL 150 Ca 0.00 1.34 0.12 0.00 0.00 0.00 0.00 61.98 63.44 1ri7 s VAL 150 Cb 0.00 -3.92 0.25 0.00 0.00 0.00 0.00 36.38 32.71 1ri7 s VAL 150 CO 0.00 -0.18 1.14 -1.84 0.00 0.00 0.00 175.10 174.21 1ri7 n GLU 151 N 6.85 2.05 0.00 2.72 0.28 0.54 -4.82 120.64 128.27 1ri7 n GLU 151 Ca 0.15 -1.79 0.00 0.00 -0.16 0.00 0.00 57.16 55.36 1ri7 n GLU 151 Cb 0.45 -1.28 0.00 0.00 1.43 0.00 0.00 31.44 32.04 1ri7 n GLU 151 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ri7 n GLY 152 N 0.66 2.93 3.05 -1.84 0.00 -1.21 -4.91 105.19 103.88 1ri7 n GLY 152 Ca 0.11 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 1ri7 n GLY 152 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ri7 s THR 153 N -1.87 0.25 -0.07 2.61 -4.23 -1.26 0.82 115.64 111.90 1ri7 s THR 153 Ca 0.00 -1.39 -0.00 0.00 -1.18 0.00 0.00 61.69 59.12 1ri7 s THR 153 Cb 0.00 -0.94 0.03 0.00 1.34 0.00 0.00 72.50 72.93 1ri7 s THR 153 CO 0.00 -0.73 -0.02 -2.28 -0.54 0.00 0.00 174.62 171.05 1ri7 s HIS 154 N -2.66 0.78 -0.00 3.99 5.04 0.34 -4.94 115.29 117.84 1ri7 s HIS 154 Ca -0.03 -0.24 -0.20 0.00 -1.54 0.00 0.00 55.06 53.04 1ri7 s HIS 154 Cb -0.01 -0.80 -0.05 0.00 0.04 0.00 0.00 32.58 31.75 1ri7 s HIS 154 CO -0.05 -0.30 0.58 0.99 -2.34 0.00 0.00 174.74 173.62 1ri7 s THR 155 N 1.59 4.91 -0.36 0.89 2.01 -1.26 -0.69 115.64 122.72 1ri7 s THR 155 Ca -0.00 1.21 0.00 0.00 0.31 0.00 0.00 61.69 63.21 1ri7 s THR 155 Cb -0.13 -3.91 0.12 0.00 0.01 0.00 0.00 72.50 68.59 1ri7 s THR 155 CO -0.04 0.43 0.18 -0.04 -0.69 0.00 0.00 174.62 174.46 1ri7 s MET 156 N -0.27 0.83 0.09 4.92 -1.94 -0.44 -5.01 119.30 117.48 1ri7 s MET 156 Ca 0.30 -1.42 -0.30 0.00 -1.71 0.00 0.00 55.69 52.56 1ri7 s MET 156 Cb -0.18 -1.87 -0.05 0.00 2.01 0.00 0.00 34.83 34.74 1ri7 s MET 156 CO 0.17 -1.11 1.02 0.42 -0.01 0.00 0.00 175.02 175.51 1ri7 s ILE 157 N 1.08 4.40 -0.34 2.53 1.01 -1.26 -0.90 121.20 127.71 1ri7 s ILE 157 Ca 0.15 1.90 -0.29 0.00 0.00 0.00 0.00 60.65 62.41 1ri7 s ILE 157 Cb -0.21 -4.22 0.01 0.00 0.01 0.00 0.00 42.46 38.05 1ri7 s ILE 157 CO -0.11 0.25 1.31 -0.69 0.00 0.00 0.00 174.94 175.70 1ri7 s VAL 158 N 0.31 4.10 -0.02 2.92 1.01 -0.05 -4.86 120.40 123.82 1ri7 s VAL 158 Ca 0.50 1.21 -0.07 0.00 0.00 0.00 0.00 61.98 63.63 1ri7 s VAL 158 Cb -0.25 -4.21 -0.29 0.00 0.00 0.00 0.00 36.38 31.63 1ri7 s VAL 158 CO 0.30 -0.58 0.79 -0.07 0.00 0.00 0.00 175.10 175.54 1ri7 h LEU 159 N 11.18 0.51 -7.26 3.92 3.38 -1.94 -3.44 115.31 121.66 1ri7 h LEU 159 Ca -0.26 -0.72 -0.11 0.00 0.09 0.00 0.00 57.88 56.89 1ri7 h LEU 159 Cb 1.09 -0.16 -0.24 0.00 0.09 0.00 0.00 40.66 41.44 1ri7 h LEU 159 CO 1.05 1.60 -0.19 -0.75 0.09 0.00 0.00 178.44 180.24 1ri7 s LYS 160 N -2.60 0.52 -0.40 1.13 2.20 -1.26 -5.12 119.74 114.22 1ri7 s LYS 160 Ca -0.12 0.66 -0.15 0.00 -0.36 0.00 0.00 55.97 56.00 1ri7 s LYS 160 Cb 0.06 0.23 0.01 0.00 -1.51 0.00 0.00 37.83 36.62 1ri7 s LYS 160 CO 0.86 -0.07 0.33 0.99 -0.36 0.00 0.00 175.35 177.09 1ri7 s THR 161 N 0.37 5.22 -0.17 3.43 2.01 -1.26 -4.92 115.64 120.32 1ri7 s THR 161 Ca -0.01 -0.46 0.17 0.00 0.31 0.00 0.00 61.69 61.70 1ri7 s THR 161 Cb -0.04 -3.91 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 1ri7 s THR 161 CO -0.01 -0.27 1.13 0.45 -0.69 0.00 0.00 174.62 175.23 1ri7 h HIS 162 N 8.62 0.00 -1.73 4.92 3.86 -2.04 -3.46 115.15 125.31 1ri7 h HIS 162 Ca -0.28 0.00 0.05 0.00 -1.16 0.00 0.00 60.37 58.99 1ri7 h HIS 162 Cb 1.13 0.00 -0.25 0.00 1.06 0.00 0.00 27.41 29.35 1ri7 h HIS 162 CO 0.60 0.44 0.28 0.21 0.86 0.00 0.00 177.93 180.31 1ri7 s LYS 163 N -3.02 0.56 -0.26 2.45 2.20 -1.26 -5.15 119.74 115.26 1ri7 s LYS 163 Ca 0.01 0.82 -0.01 0.00 -0.36 0.00 0.00 55.97 56.43 1ri7 s LYS 163 Cb 0.08 0.19 0.15 0.00 -1.51 0.00 0.00 37.83 36.74 1ri7 s LYS 163 CO 0.78 -0.09 0.43 -2.00 -0.36 0.00 0.00 175.35 174.10 1ri7 s GLU 164 N 0.94 0.40 0.07 4.03 2.12 -1.26 -5.15 118.70 119.85 1ri7 s GLU 164 Ca -0.04 0.53 -0.05 0.00 0.36 0.00 0.00 54.97 55.77 1ri7 s GLU 164 Cb -0.05 -0.25 -0.02 0.00 0.26 0.00 0.00 34.13 34.07 1ri7 s GLU 164 CO -0.11 -0.73 0.09 -0.08 -0.54 0.00 0.00 175.26 173.89 1ri7 s THR 165 N 2.61 0.18 -1.96 -1.70 -1.32 -1.26 -5.03 115.64 107.15 1ri7 s THR 165 Ca 0.13 -1.45 0.16 0.00 -1.21 0.00 0.00 61.69 59.33 1ri7 s THR 165 Cb -0.15 -1.40 0.11 0.00 -1.51 0.00 0.00 72.50 69.55 1ri7 s THR 165 CO -0.20 -0.80 0.99 0.35 -2.21 0.00 0.00 174.62 172.75 1ri7 n THR 166 N 0.05 0.00 -2.68 5.08 -2.24 -1.26 -4.99 114.28 108.24 1ri7 n THR 166 Ca -0.15 -0.47 -0.43 0.00 -2.27 0.00 0.00 64.05 60.73 1ri7 n THR 166 Cb 0.62 1.32 -0.02 0.00 -2.10 0.00 0.00 70.33 70.14 1ri7 n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ri7 s GLU 167 N -1.48 4.29 0.46 -0.78 2.02 -1.26 -5.05 118.70 116.90 1ri7 s GLU 167 Ca 0.18 1.34 -0.13 0.00 0.02 0.00 0.00 54.97 56.38 1ri7 s GLU 167 Cb 0.14 -3.62 -0.07 0.00 0.10 0.00 0.00 34.13 30.68 1ri7 s GLU 167 CO 0.24 -0.56 0.87 -0.51 0.02 0.00 0.00 175.26 175.32 1ri7 s LEU 168 N 2.93 3.72 0.59 1.80 1.43 -1.26 -5.04 118.68 122.85 1ri7 s LEU 168 Ca 0.44 1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 54.66 1ri7 s LEU 168 Cb -0.16 -4.23 -0.03 0.00 0.03 0.00 0.00 46.19 41.80 1ri7 s LEU 168 CO 0.09 -0.50 1.30 -2.84 0.23 0.00 0.00 176.35 174.63 1ri7 s PRO 169 N -4.00 2.94 0.00 1.29 0.02 -1.26 -5.07 135.00 128.91 1ri7 s PRO 169 Ca 0.54 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.64 1ri7 s PRO 169 Cb -0.10 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.36 1ri7 s PRO 169 CO 0.32 -1.30 0.00 -0.89 -0.33 0.00 0.00 177.00 174.80