#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7o s LYS 5 N 0.00 4.30 0.36 1.64 -2.85 -1.26 -5.00 119.74 116.93 1l7o s LYS 5 Ca 0.00 1.65 0.09 0.00 -1.00 0.00 0.00 55.97 56.71 1l7o s LYS 5 Cb 0.00 -2.77 -0.07 0.00 -2.06 0.00 0.00 37.83 32.94 1l7o s LYS 5 CO 0.00 -0.06 -0.04 0.15 0.10 0.00 0.00 175.35 175.50 1l7o s LYS 6 N -2.13 1.91 -0.03 1.78 1.02 -0.94 -4.79 119.74 116.56 1l7o s LYS 6 Ca 0.53 -1.95 0.04 0.00 0.02 0.00 0.00 55.97 54.62 1l7o s LYS 6 Cb -0.26 -1.73 -0.00 0.00 -0.52 0.00 0.00 37.83 35.31 1l7o s LYS 6 CO 0.33 0.08 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.53 1l7o s LEU 7 N -3.66 1.92 -0.07 3.17 2.96 -0.59 -0.41 118.68 122.00 1l7o s LEU 7 Ca 0.34 -0.28 0.03 0.00 -0.22 0.00 0.00 54.13 54.00 1l7o s LEU 7 Cb 0.04 -0.79 0.01 0.00 0.50 0.00 0.00 46.19 45.94 1l7o s LEU 7 CO 0.18 0.14 -0.16 -0.51 -1.32 0.00 0.00 176.35 174.68 1l7o s ILE 8 N -0.06 1.43 -0.19 6.68 2.07 -0.82 0.13 121.20 130.45 1l7o s ILE 8 Ca -0.00 -0.66 0.01 0.00 -1.41 0.00 0.00 60.65 58.59 1l7o s ILE 8 Cb -0.09 -1.27 0.02 0.00 0.13 0.00 0.00 42.46 41.25 1l7o s ILE 8 CO 0.01 0.42 -0.18 -0.22 -1.91 0.00 0.00 174.94 173.06 1l7o s LEU 9 N 0.52 2.25 -0.06 8.50 2.96 0.13 -1.98 118.68 131.00 1l7o s LEU 9 Ca -0.15 -0.64 -0.07 0.00 -0.22 0.00 0.00 54.13 53.05 1l7o s LEU 9 Cb -0.16 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 1l7o s LEU 9 CO 0.05 -0.01 0.20 -0.36 -1.32 0.00 0.00 176.35 174.92 1l7o s PHE 10 N 1.31 3.60 0.37 5.38 0.08 -0.09 -0.78 117.98 127.84 1l7o s PHE 10 Ca 0.05 0.55 -0.24 0.00 0.12 0.00 0.00 56.93 57.40 1l7o s PHE 10 Cb -0.13 -1.96 -0.10 0.00 -0.57 0.00 0.00 43.02 40.26 1l7o s PHE 10 CO -0.12 0.68 0.98 1.21 -0.10 0.00 0.00 175.22 177.88 1l7o s ASN 11 N -1.37 7.07 -0.00 1.36 3.04 0.32 -1.07 114.94 124.29 1l7o s ASN 11 Ca 0.21 1.88 -0.00 0.00 0.04 0.00 0.00 52.86 54.99 1l7o s ASN 11 Cb -0.13 -2.57 -0.00 0.00 -1.54 0.00 0.00 41.25 37.01 1l7o s ASN 11 CO 0.10 -0.27 0.02 0.15 -3.04 0.00 0.00 177.10 174.06 1l7o h PHE 12 N 2.71 -0.00 -2.31 0.43 3.57 -1.69 -2.79 116.94 116.87 1l7o h PHE 12 Ca -0.48 -0.00 -0.55 0.00 3.53 0.00 0.00 57.97 60.47 1l7o h PHE 12 Cb 1.20 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.96 1l7o h PHE 12 CO 0.60 -0.00 1.15 -0.25 -2.23 0.00 0.00 178.31 177.59 1l7o n ASP 13 N -2.07 3.93 0.00 0.41 8.00 -1.26 -1.76 116.55 123.79 1l7o n ASP 13 Ca -0.00 0.95 0.00 0.00 0.71 0.00 0.00 54.79 56.45 1l7o n ASP 13 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 39.61 1l7o n ASP 13 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1l7o n SER 14 N 6.67 0.00 0.00 -2.24 7.64 0.02 -4.78 113.62 120.92 1l7o n SER 14 Ca 0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1l7o n SER 14 Cb 0.37 -0.56 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 1l7o n SER 14 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1l7o n THR 15 N -2.00 0.00 0.08 0.44 -1.04 -0.89 -4.76 114.28 106.11 1l7o n THR 15 Ca 0.00 0.26 -0.04 0.00 -2.04 0.00 0.00 64.05 62.23 1l7o n THR 15 Cb 0.00 -1.23 0.15 0.00 -1.82 0.00 0.00 70.33 67.43 1l7o n THR 15 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1l7o h LEU 16 N 0.00 0.30 -9.16 -4.42 5.85 -1.05 -3.42 115.31 103.41 1l7o h LEU 16 Ca 0.00 -0.15 -0.59 0.00 0.84 0.00 0.00 57.88 57.98 1l7o h LEU 16 Cb 0.00 -0.08 -0.14 0.00 0.37 0.00 0.00 40.66 40.80 1l7o h LEU 16 CO 0.00 0.78 -0.76 0.68 -0.34 0.00 0.00 178.44 178.80 1l7o s VAL 17 N -3.90 2.36 0.25 1.05 -7.23 -1.01 -0.37 120.40 111.56 1l7o s VAL 17 Ca -0.04 -2.37 0.09 0.00 -1.81 0.00 0.00 61.98 57.85 1l7o s VAL 17 Cb 0.12 -2.25 -0.05 0.00 0.56 0.00 0.00 36.38 34.76 1l7o s VAL 17 CO 0.79 -0.42 1.57 0.78 -0.31 0.00 0.00 175.10 177.51 1l7o h ASN 18 N 2.34 0.03 -6.04 4.85 2.35 -1.47 -2.62 115.58 115.02 1l7o h ASN 18 Ca -0.40 -0.02 -0.48 0.00 -0.55 0.00 0.00 56.30 54.85 1l7o h ASN 18 Cb 1.25 -0.01 0.06 0.00 0.05 0.00 0.00 38.32 39.67 1l7o h ASN 18 CO 0.60 0.68 0.04 0.59 -1.65 0.00 0.00 177.43 177.69 1l7o n ASN 19 N -3.76 1.71 -4.01 5.81 4.13 -1.26 -4.39 115.26 113.48 1l7o n ASN 19 Ca -0.01 -2.34 -0.31 0.00 1.68 0.00 0.00 54.58 53.60 1l7o n ASN 19 Cb 0.65 -0.56 -0.16 0.00 -1.54 0.00 0.00 39.78 38.17 1l7o n ASN 19 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1l7o s GLU 20 N -4.96 2.02 0.05 3.52 2.12 -1.26 -0.80 118.70 119.40 1l7o s GLU 20 Ca 0.65 -1.02 -0.11 0.00 0.36 0.00 0.00 54.97 54.85 1l7o s GLU 20 Cb -0.04 -2.60 -0.03 0.00 0.26 0.00 0.00 34.13 31.72 1l7o s GLU 20 CO 0.42 -0.50 1.19 1.15 -0.54 0.00 0.00 175.26 176.98 1l7o h THR 21 N 6.55 0.00 -0.89 -1.70 2.02 -1.98 -2.26 112.91 114.64 1l7o h THR 21 Ca -0.24 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.15 1l7o h THR 21 Cb 1.08 0.00 -0.17 0.00 -1.74 0.00 0.00 68.15 67.32 1l7o h THR 21 CO 0.46 0.00 -0.11 -0.29 0.37 0.00 0.00 175.52 175.96 1l7o h ILE 22 N -0.02 0.13 -0.82 3.11 6.09 -1.98 0.15 117.51 124.17 1l7o h ILE 22 Ca 0.05 -0.01 -0.03 0.00 -1.37 0.00 0.00 64.86 63.50 1l7o h ILE 22 Cb 0.15 0.11 -0.04 0.00 0.47 0.00 0.00 36.82 37.51 1l7o h ILE 22 CO -0.31 0.00 0.38 0.44 -3.07 0.00 0.00 178.15 175.59 1l7o h ASP 23 N 0.03 1.09 -0.71 2.19 3.32 -1.85 0.26 116.42 120.74 1l7o h ASP 23 Ca 0.47 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 57.32 1l7o h ASP 23 Cb 0.82 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 1l7o h ASP 23 CO -0.87 0.93 0.21 -0.33 -1.72 0.00 0.00 179.24 177.47 1l7o h GLU 24 N 1.18 1.10 0.00 3.56 4.39 -0.35 -1.21 114.58 123.25 1l7o h GLU 24 Ca 0.28 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 1l7o h GLU 24 Cb 0.14 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1l7o h GLU 24 CO -0.03 0.95 -0.00 0.82 -1.16 0.00 0.00 179.01 179.58 1l7o h ILE 25 N 1.04 0.01 0.20 3.13 2.04 -0.75 -3.09 117.51 120.10 1l7o h ILE 25 Ca 0.23 -0.68 -0.27 0.00 1.00 0.00 0.00 64.86 65.14 1l7o h ILE 25 Cb 0.31 1.67 0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1l7o h ILE 25 CO -0.01 0.00 -1.18 0.00 0.00 0.00 0.00 178.15 176.97 1l7o h ALA 26 N 2.00 -0.13 -0.95 1.87 0.00 -0.37 -3.19 119.26 118.49 1l7o h ALA 26 Ca -0.00 -0.79 0.12 0.00 0.00 0.00 0.00 54.91 54.24 1l7o h ALA 26 Cb 0.67 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.53 1l7o h ALA 26 CO 0.00 0.55 0.60 -0.09 0.00 0.00 0.00 179.25 180.31 1l7o h ARG 27 N -0.09 0.86 0.00 0.00 2.43 -1.16 0.70 114.38 117.11 1l7o h ARG 27 Ca -0.21 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 1l7o h ARG 27 Cb 1.93 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 31.28 1l7o h ARG 27 CO 0.22 0.57 -0.22 0.93 -1.51 0.00 0.00 179.97 179.96 1l7o h GLU 28 N 0.88 0.00 -0.64 0.20 4.39 -1.61 -1.97 114.58 115.83 1l7o h GLU 28 Ca 0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.17 1l7o h GLU 28 Cb 0.54 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1l7o h GLU 28 CO -0.23 0.22 0.00 0.00 -1.16 0.00 0.00 179.01 177.84 1l7o n ALA 29 N -2.22 3.39 -0.48 3.43 0.00 0.15 -4.93 120.51 119.85 1l7o n ALA 29 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 53.44 51.94 1l7o n ALA 29 Cb 0.43 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1l7o n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l7o n GLY 30 N 0.75 0.00 1.58 0.00 0.00 -0.69 -4.75 105.19 102.08 1l7o n GLY 30 Ca 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 1l7o n GLY 30 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1l7o n VAL 31 N -0.98 2.81 0.34 1.61 0.24 -1.08 -4.68 118.33 116.59 1l7o n VAL 31 Ca 0.00 -2.41 0.13 0.00 -2.04 0.00 0.00 64.34 60.02 1l7o n VAL 31 Cb 0.22 -0.38 0.56 0.00 -1.47 0.00 0.00 33.84 32.77 1l7o n VAL 31 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1l7o h GLU 32 N 1.06 0.00 0.13 7.34 4.11 -1.85 -2.93 114.58 122.43 1l7o h GLU 32 Ca 0.38 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.49 1l7o h GLU 32 Cb 2.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.37 1l7o h GLU 32 CO 0.66 0.00 -1.61 0.93 0.07 0.00 0.00 179.01 179.06 1l7o h GLU 33 N 0.00 0.28 0.00 1.06 4.39 -1.93 -3.10 114.58 115.28 1l7o h GLU 33 Ca 0.00 -0.48 -0.08 0.00 0.34 0.00 0.00 59.36 59.14 1l7o h GLU 33 Cb 0.33 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1l7o h GLU 33 CO 0.00 1.15 -0.37 1.49 -1.16 0.00 0.00 179.01 180.11 1l7o h GLU 34 N 0.08 0.00 0.00 2.33 4.57 -1.85 -1.54 114.58 118.17 1l7o h GLU 34 Ca -0.28 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 57.79 1l7o h GLU 34 Cb 2.04 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.61 1l7o h GLU 34 CO 0.16 0.37 -0.87 -0.24 -1.18 0.00 0.00 179.01 177.25 1l7o h VAL 35 N 0.00 0.64 0.00 0.32 3.04 -1.63 -3.26 116.25 115.36 1l7o h VAL 35 Ca -0.00 -2.01 -0.10 0.00 -1.01 0.00 0.00 66.70 63.57 1l7o h VAL 35 Cb 0.93 2.20 -0.02 0.00 -2.01 0.00 0.00 31.29 32.39 1l7o h VAL 35 CO 0.05 0.36 -0.93 0.50 -1.01 0.00 0.00 177.57 176.54 1l7o h LYS 36 N 0.00 0.00 -3.53 4.17 1.63 -1.44 -2.93 116.57 114.47 1l7o h LYS 36 Ca -0.06 0.00 -0.80 0.00 -0.85 0.00 0.00 60.65 58.94 1l7o h LYS 36 Cb 1.42 0.00 -0.27 0.00 -0.60 0.00 0.00 32.23 32.78 1l7o h LYS 36 CO 0.05 0.25 0.60 1.63 -3.45 0.00 0.00 179.45 178.54 1l7o n LYS 37 N -2.96 3.70 0.00 1.90 4.01 -0.59 -2.30 118.16 121.92 1l7o n LYS 37 Ca -0.03 -4.42 0.00 0.00 -0.51 0.00 0.00 58.31 53.35 1l7o n LYS 37 Cb 0.72 -2.58 0.00 0.00 -0.51 0.00 0.00 35.03 32.65 1l7o n LYS 37 CO 0.00 0.00 0.00 1.51 -1.11 0.00 0.00 177.40 177.80 1l7o n ILE 38 N 2.59 0.00 0.00 -0.18 0.13 -1.26 -4.85 119.36 115.79 1l7o n ILE 38 Ca 0.26 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.91 1l7o n ILE 38 Cb 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.18 1l7o n ILE 38 CO 0.00 0.00 0.00 1.07 2.80 0.00 0.00 176.55 180.42 1l7o n THR 39 N 0.00 0.00 0.00 9.51 5.66 -0.97 -5.00 114.28 123.48 1l7o n THR 39 Ca 0.00 0.07 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1l7o n THR 39 Cb 0.00 -0.29 0.00 0.00 -1.55 0.00 0.00 70.33 68.49 1l7o n THR 39 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1l7o n ASN 48 N -0.18 0.00 -0.30 1.09 2.85 -1.26 -4.93 115.26 112.53 1l7o n ASN 48 Ca 0.00 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.50 1l7o n ASN 48 Cb 0.07 0.00 0.17 0.00 1.24 0.00 0.00 39.78 41.26 1l7o n ASN 48 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 1l7o h PHE 49 N 0.00 0.89 0.72 1.20 3.57 -1.96 0.15 116.94 121.51 1l7o h PHE 49 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1l7o h PHE 49 Cb 0.00 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 38.47 1l7o h PHE 49 CO 0.00 0.37 -0.35 1.49 -2.23 0.00 0.00 178.31 177.60 1l7o h GLU 50 N 0.83 -0.94 -1.04 1.11 4.81 -1.94 0.51 114.58 117.92 1l7o h GLU 50 Ca 0.40 0.06 0.35 0.00 -0.13 0.00 0.00 59.36 60.04 1l7o h GLU 50 Cb 0.35 0.21 -0.15 0.00 0.63 0.00 0.00 28.75 29.79 1l7o h GLU 50 CO -0.24 -0.63 0.60 1.96 -0.73 0.00 0.00 179.01 179.97 1l7o h GLN 51 N -0.98 0.25 -0.28 1.92 4.20 -1.80 1.19 115.11 119.61 1l7o h GLN 51 Ca -0.10 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.45 1l7o h GLN 51 Cb 0.75 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1l7o h GLN 51 CO 0.16 0.16 -0.42 1.03 -0.67 0.00 0.00 178.83 179.10 1l7o h SER 52 N 0.25 0.74 -0.07 1.46 0.87 -0.44 -1.15 113.55 115.21 1l7o h SER 52 Ca 0.76 -0.34 -0.02 0.00 -1.23 0.00 0.00 61.79 60.96 1l7o h SER 52 Cb 1.85 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 63.60 1l7o h SER 52 CO -0.60 1.07 -0.02 0.25 -0.53 0.00 0.00 176.83 176.99 1l7o h LEU 53 N 0.57 0.15 -0.63 2.23 5.85 0.36 -1.41 115.31 122.42 1l7o h LEU 53 Ca 0.04 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.42 1l7o h LEU 53 Cb 0.96 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 1l7o h LEU 53 CO 0.09 0.50 0.36 0.03 -0.34 0.00 0.00 178.44 179.08 1l7o h ARG 54 N -0.21 0.67 -0.04 1.25 3.08 -0.59 0.79 114.38 119.33 1l7o h ARG 54 Ca 0.02 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.04 1l7o h ARG 54 Cb 0.44 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1l7o h ARG 54 CO 0.01 0.44 -0.05 -0.22 -1.07 0.00 0.00 179.97 179.09 1l7o h LYS 55 N 0.69 -0.06 -0.29 0.04 3.64 -1.11 -1.92 116.57 117.55 1l7o h LYS 55 Ca 0.27 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1l7o h LYS 55 Cb 0.12 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1l7o h LYS 55 CO -0.15 -0.04 0.17 0.00 -2.27 0.00 0.00 179.45 177.16 1l7o h ARG 56 N -0.06 0.41 -1.00 1.90 3.08 -0.77 -2.96 114.38 114.97 1l7o h ARG 56 Ca 0.03 -0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.12 1l7o h ARG 56 Cb 0.11 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.01 1l7o h ARG 56 CO -0.08 0.34 0.64 0.28 -1.07 0.00 0.00 179.97 180.08 1l7o h VAL 57 N 0.36 1.03 -0.82 2.04 2.07 -0.67 -2.39 116.25 117.88 1l7o h VAL 57 Ca 0.10 -0.38 0.13 0.00 0.82 0.00 0.00 66.70 67.38 1l7o h VAL 57 Cb 0.04 -0.18 -0.09 0.00 -1.52 0.00 0.00 31.29 29.55 1l7o h VAL 57 CO -0.02 0.20 0.41 0.28 0.02 0.00 0.00 177.57 178.47 1l7o h SER 58 N 1.11 0.51 0.00 0.57 0.02 -1.17 0.17 113.55 114.76 1l7o h SER 58 Ca 0.45 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 1l7o h SER 58 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1l7o h SER 58 CO -0.20 0.23 0.00 0.18 -1.14 0.00 0.00 176.83 175.90 1l7o n LEU 59 N -4.87 0.00 -1.92 5.07 4.77 -0.90 -0.17 117.00 118.98 1l7o n LEU 59 Ca 0.16 0.02 -0.23 0.00 -0.03 0.00 0.00 56.01 55.93 1l7o n LEU 59 Cb 0.40 -0.02 0.10 0.00 -2.33 0.00 0.00 43.42 41.56 1l7o n LEU 59 CO 0.22 -0.02 0.81 0.18 -1.33 0.00 0.00 177.39 177.25 1l7o n LEU 60 N -1.02 5.78 -0.32 2.23 4.32 0.60 -4.87 117.00 123.71 1l7o n LEU 60 Ca 0.01 -4.28 0.14 0.00 -0.02 0.00 0.00 56.01 51.86 1l7o n LEU 60 Cb 0.01 -0.66 0.30 0.00 -1.62 0.00 0.00 43.42 41.44 1l7o n LEU 60 CO 0.01 1.62 0.87 0.50 -1.22 0.00 0.00 177.39 179.16 1l7o h LYS 61 N 1.74 0.08 0.00 3.23 1.63 -0.71 -3.20 116.57 119.34 1l7o h LYS 61 Ca 0.43 -0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 60.15 1l7o h LYS 61 Cb 1.42 -0.02 -0.17 0.00 -0.60 0.00 0.00 32.23 32.86 1l7o h LYS 61 CO 0.97 0.05 -0.69 -0.25 -3.45 0.00 0.00 179.45 176.08 1l7o n ASP 62 N -5.38 0.85 -4.65 4.20 8.00 -1.23 -3.57 116.55 114.78 1l7o n ASP 62 Ca 0.23 -2.32 -0.46 0.00 0.71 0.00 0.00 54.79 52.95 1l7o n ASP 62 Cb 0.75 -0.30 -0.03 0.00 -0.02 0.00 0.00 41.12 41.51 1l7o n ASP 62 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1l7o n LEU 63 N -0.04 2.79 -4.73 0.64 0.00 -1.21 -4.53 117.00 109.92 1l7o n LEU 63 Ca 0.06 1.14 -0.41 0.00 0.00 0.00 0.00 56.01 56.80 1l7o n LEU 63 Cb 0.89 -1.39 -0.04 0.00 0.00 0.00 0.00 43.42 42.89 1l7o n LEU 63 CO -0.02 -0.65 0.75 -2.84 0.00 0.00 0.00 177.39 174.64 1l7o s PRO 64 N -0.37 4.59 0.43 1.96 0.02 -1.26 -0.68 135.00 139.70 1l7o s PRO 64 Ca 0.69 1.61 0.26 0.00 0.02 0.00 0.00 61.00 63.58 1l7o s PRO 64 Cb -0.69 -3.34 1.30 0.00 0.02 0.00 0.00 34.50 31.79 1l7o s PRO 64 CO 0.50 0.05 1.71 0.97 -0.33 0.00 0.00 177.00 179.89 1l7o h ILE 65 N 4.09 0.33 -0.92 2.83 6.09 -1.07 0.95 117.51 129.81 1l7o h ILE 65 Ca -0.43 -0.07 0.12 0.00 -1.37 0.00 0.00 64.86 63.11 1l7o h ILE 65 Cb 1.21 0.10 -0.09 0.00 0.47 0.00 0.00 36.82 38.52 1l7o h ILE 65 CO 0.74 0.04 0.54 -0.33 -3.07 0.00 0.00 178.15 176.07 1l7o h GLU 66 N 0.21 0.81 -0.33 2.19 4.39 -1.91 -0.03 114.58 119.92 1l7o h GLU 66 Ca 0.69 -0.05 -0.15 0.00 0.34 0.00 0.00 59.36 60.20 1l7o h GLU 66 Cb 2.08 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 30.54 1l7o h GLU 66 CO -0.31 0.53 -0.39 0.87 -1.16 0.00 0.00 179.01 178.56 1l7o h LYS 67 N 0.83 0.80 -0.05 2.33 1.79 0.56 -2.66 116.57 120.17 1l7o h LYS 67 Ca 0.47 -0.41 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1l7o h LYS 67 Cb 0.52 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.18 1l7o h LYS 67 CO -0.29 1.04 0.03 0.28 -1.08 0.00 0.00 179.45 179.43 1l7o h VAL 68 N 0.65 1.10 -0.59 0.50 2.07 -0.90 -1.03 116.25 118.05 1l7o h VAL 68 Ca 0.06 -0.28 0.13 0.00 0.82 0.00 0.00 66.70 67.42 1l7o h VAL 68 Cb 0.95 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1l7o h VAL 68 CO 0.09 0.08 0.41 -0.33 0.02 0.00 0.00 177.57 177.83 1l7o h GLU 69 N -0.03 0.25 -0.09 1.57 4.39 -1.05 0.26 114.58 119.88 1l7o h GLU 69 Ca 0.02 -0.02 -0.20 0.00 0.34 0.00 0.00 59.36 59.50 1l7o h GLU 69 Cb 0.11 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1l7o h GLU 69 CO -0.00 0.17 -0.77 -0.22 -1.16 0.00 0.00 179.01 177.02 1l7o h LYS 70 N 0.26 0.54 0.31 2.33 3.64 -1.02 -3.00 116.57 119.63 1l7o h LYS 70 Ca 0.28 -0.46 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 1l7o h LYS 70 Cb 0.75 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1l7o h LYS 70 CO -0.06 1.09 -0.15 0.00 -2.27 0.00 0.00 179.45 178.06 1l7o h ALA 71 N 0.78 -0.41 -0.15 5.00 0.00 0.27 -3.21 119.26 121.54 1l7o h ALA 71 Ca -0.04 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.72 1l7o h ALA 71 Cb 1.37 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1l7o h ALA 71 CO 0.14 -0.49 0.26 -0.84 0.00 0.00 0.00 179.25 178.32 1l7o h ILE 72 N -0.89 0.26 0.00 0.00 3.07 -1.19 -0.03 117.51 118.73 1l7o h ILE 72 Ca -0.04 0.00 -0.02 0.00 1.55 0.00 0.00 64.86 66.35 1l7o h ILE 72 Cb 0.52 0.78 -0.00 0.00 -0.27 0.00 0.00 36.82 37.84 1l7o h ILE 72 CO 0.07 0.00 -0.08 0.50 -1.05 0.00 0.00 178.15 177.59 1l7o h LYS 73 N 0.00 0.00 0.00 0.16 3.64 -1.52 -1.94 116.57 116.91 1l7o h LYS 73 Ca 0.07 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1l7o h LYS 73 Cb 0.58 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1l7o h LYS 73 CO -0.00 0.08 -0.18 0.00 -2.27 0.00 0.00 179.45 177.08 1l7o h ARG 74 N 0.00 0.00 -6.18 1.90 3.08 -1.12 -3.44 114.38 108.62 1l7o h ARG 74 Ca -0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 1l7o h ARG 74 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.45 1l7o h ARG 74 CO 0.01 0.18 1.30 -0.89 -1.07 0.00 0.00 179.97 179.50 1l7o n ILE 75 N -3.22 0.53 -4.45 2.04 2.08 -0.73 -4.97 119.36 110.63 1l7o n ILE 75 Ca 0.02 -0.24 -0.30 0.00 0.56 0.00 0.00 62.75 62.79 1l7o n ILE 75 Cb 0.49 -2.19 -0.12 0.00 -0.75 0.00 0.00 39.64 37.06 1l7o n ILE 75 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1l7o s THR 76 N 5.85 2.55 0.47 1.39 -1.32 -1.26 -5.04 115.64 118.29 1l7o s THR 76 Ca 0.96 -1.54 -0.22 0.00 -1.21 0.00 0.00 61.69 59.68 1l7o s THR 76 Cb -0.53 -2.13 -0.07 0.00 -1.51 0.00 0.00 72.50 68.27 1l7o s THR 76 CO 0.44 0.16 1.15 -2.84 -2.21 0.00 0.00 174.62 171.32 1l7o s PRO 77 N -1.91 3.69 0.53 7.08 0.02 -1.26 -1.37 135.00 141.78 1l7o s PRO 77 Ca 0.15 1.73 -0.21 0.00 0.02 0.00 0.00 61.00 62.68 1l7o s PRO 77 Cb -0.10 -2.33 -0.05 0.00 0.02 0.00 0.00 34.50 32.04 1l7o s PRO 77 CO 0.07 -0.59 1.27 0.99 -0.33 0.00 0.00 177.00 178.41 1l7o s THR 78 N -1.60 2.49 -0.13 0.99 2.01 0.50 -4.60 115.64 115.29 1l7o s THR 78 Ca 0.65 0.35 -0.39 0.00 0.31 0.00 0.00 61.69 62.61 1l7o s THR 78 Cb -0.27 -3.17 -0.17 0.00 0.01 0.00 0.00 72.50 68.90 1l7o s THR 78 CO 0.33 -0.02 1.51 1.21 -0.69 0.00 0.00 174.62 176.96 1l7o n GLU 79 N -0.98 0.93 -0.05 4.92 4.07 -1.26 -1.19 120.64 127.08 1l7o n GLU 79 Ca 0.10 0.34 0.00 0.00 -0.06 0.00 0.00 57.16 57.54 1l7o n GLU 79 Cb 0.47 -1.97 0.00 0.00 -0.06 0.00 0.00 31.44 29.88 1l7o n GLU 79 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1l7o n GLY 80 N 3.27 1.07 0.41 8.31 0.00 -1.26 -1.23 105.19 115.77 1l7o n GLY 80 Ca 0.23 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.14 1l7o n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7o h ALA 81 N 0.00 -0.54 -0.05 4.61 0.00 -1.49 -0.62 119.26 121.17 1l7o h ALA 81 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1l7o h ALA 81 Cb 0.00 0.95 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1l7o h ALA 81 CO 0.00 -0.92 -0.12 0.93 0.00 0.00 0.00 179.25 179.14 1l7o h GLU 82 N -0.36 -0.17 -0.73 0.00 5.08 -1.94 -0.88 114.58 115.57 1l7o h GLU 82 Ca 0.12 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1l7o h GLU 82 Cb 0.60 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 1l7o h GLU 82 CO -0.57 -0.11 0.44 0.93 -1.00 0.00 0.00 179.01 178.70 1l7o h GLU 83 N -0.17 0.99 -0.41 2.33 3.07 -1.93 -1.39 114.58 117.06 1l7o h GLU 83 Ca 0.06 -0.09 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 1l7o h GLU 83 Cb 0.26 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.94 1l7o h GLU 83 CO -0.15 0.70 0.15 1.15 -1.40 0.00 0.00 179.01 179.46 1l7o h THR 84 N 1.00 1.21 -0.56 1.13 2.02 -0.85 -0.79 112.91 116.07 1l7o h THR 84 Ca 0.26 -0.66 -0.06 0.00 0.77 0.00 0.00 66.41 66.73 1l7o h THR 84 Cb -0.04 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1l7o h THR 84 CO -0.05 0.24 0.10 0.40 0.37 0.00 0.00 175.52 176.58 1l7o h ILE 85 N 0.52 1.24 0.02 3.11 2.04 -0.99 -0.49 117.51 122.96 1l7o h ILE 85 Ca 0.14 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 1l7o h ILE 85 Cb 0.22 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1l7o h ILE 85 CO -0.01 0.33 -0.01 0.50 0.00 0.00 0.00 178.15 178.96 1l7o h LYS 86 N 0.84 -0.03 -0.61 2.37 3.64 -0.90 -2.25 116.57 119.63 1l7o h LYS 86 Ca 0.18 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1l7o h LYS 86 Cb 0.36 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 1l7o h LYS 86 CO 0.01 0.20 0.29 1.49 -2.27 0.00 0.00 179.45 179.16 1l7o h GLU 87 N -0.26 0.86 -0.73 1.90 4.57 -0.98 -2.33 114.58 117.61 1l7o h GLU 87 Ca -0.00 -0.11 -0.05 0.00 -1.18 0.00 0.00 59.36 58.01 1l7o h GLU 87 Cb 0.24 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 1l7o h GLU 87 CO 0.00 0.67 0.25 -0.07 -1.18 0.00 0.00 179.01 178.68 1l7o h LEU 88 N 0.86 1.04 -0.45 1.64 3.38 -0.89 -1.95 115.31 118.93 1l7o h LEU 88 Ca 0.21 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1l7o h LEU 88 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1l7o h LEU 88 CO -0.03 0.95 -0.03 0.11 0.09 0.00 0.00 178.44 179.54 1l7o h LYS 89 N 1.08 0.81 0.00 1.13 1.57 -1.14 -1.04 116.57 118.99 1l7o h LYS 89 Ca 0.24 -0.27 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1l7o h LYS 89 Cb 0.27 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 1l7o h LYS 89 CO -0.01 0.89 -0.02 -0.97 -0.57 0.00 0.00 179.45 178.77 1l7o h ASN 90 N 0.65 0.00 -0.50 0.86 -1.24 -1.12 -0.09 115.58 114.14 1l7o h ASN 90 Ca 0.12 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.13 1l7o h ASN 90 Cb 0.54 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.59 1l7o h ASN 90 CO 0.03 0.02 0.00 0.54 -1.29 0.00 0.00 177.43 176.73 1l7o n ARG 91 N -3.40 3.16 -1.02 6.67 1.74 -0.76 -4.92 116.66 118.13 1l7o n ARG 91 Ca -0.03 -2.23 0.00 0.00 -0.77 0.00 0.00 57.85 54.83 1l7o n ARG 91 Cb 0.12 -1.77 0.00 0.00 -1.02 0.00 0.00 32.46 29.79 1l7o n ARG 91 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1l7o n GLY 92 N 0.94 0.56 3.90 -0.13 0.00 -0.05 -4.92 105.19 105.49 1l7o n GLY 92 Ca 0.20 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 45.06 1l7o n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l7o s TYR 93 N -2.00 3.54 -0.09 1.61 1.51 -0.46 -2.21 117.35 119.25 1l7o s TYR 93 Ca 0.00 0.34 -0.19 0.00 -1.01 0.00 0.00 57.07 56.21 1l7o s TYR 93 Cb 0.00 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.99 1l7o s TYR 93 CO 0.00 0.64 0.53 0.08 -1.11 0.00 0.00 175.55 175.69 1l7o s VAL 94 N -1.34 5.13 -0.18 0.71 1.01 0.45 -4.32 120.40 121.86 1l7o s VAL 94 Ca 0.28 1.07 -0.04 0.00 0.00 0.00 0.00 61.98 63.29 1l7o s VAL 94 Cb -0.13 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 1l7o s VAL 94 CO 0.20 0.33 -0.03 -0.69 0.00 0.00 0.00 175.10 174.91 1l7o s VAL 95 N 0.51 3.79 0.09 2.92 1.01 -1.26 -1.94 120.40 125.53 1l7o s VAL 95 Ca 0.29 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.91 1l7o s VAL 95 Cb -0.16 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1l7o s VAL 95 CO 0.13 0.46 -0.07 0.00 0.00 0.00 0.00 175.10 175.61 1l7o s ALA 96 N 0.80 0.96 0.06 5.51 0.00 -0.84 0.49 121.76 128.75 1l7o s ALA 96 Ca -0.01 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 50.70 1l7o s ALA 96 Cb -0.14 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.08 1l7o s ALA 96 CO 0.02 -0.19 -0.10 0.54 0.00 0.00 0.00 175.76 176.03 1l7o s VAL 97 N -3.30 0.79 -0.02 0.00 0.11 -0.77 -0.91 120.40 116.31 1l7o s VAL 97 Ca 0.09 -1.30 -0.02 0.00 -2.93 0.00 0.00 61.98 57.82 1l7o s VAL 97 Cb 0.03 -0.95 0.01 0.00 -1.53 0.00 0.00 36.38 33.94 1l7o s VAL 97 CO -0.04 -0.40 0.06 0.54 -3.33 0.00 0.00 175.10 171.93 1l7o s VAL 98 N -1.69 -0.02 0.01 2.04 0.11 -0.24 -2.04 120.40 118.57 1l7o s VAL 98 Ca -0.03 0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.11 1l7o s VAL 98 Cb -0.08 -0.09 -0.01 0.00 -1.53 0.00 0.00 36.38 34.67 1l7o s VAL 98 CO 0.01 0.02 -0.10 -0.55 -3.33 0.00 0.00 175.10 171.15 1l7o s SER 99 N 0.33 1.18 0.00 3.54 0.15 1.00 -1.75 113.70 118.15 1l7o s SER 99 Ca -0.03 -0.25 0.29 0.00 0.70 0.00 0.00 55.95 56.66 1l7o s SER 99 Cb -0.04 -0.11 1.20 0.00 -1.71 0.00 0.00 66.02 65.36 1l7o s SER 99 CO -0.01 0.07 1.84 0.61 1.20 0.00 0.00 173.24 176.95 1l7o n GLY 100 N 2.56 -0.77 0.00 9.45 0.00 -1.26 -3.69 105.19 111.48 1l7o n GLY 100 Ca -0.15 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1l7o n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l7o n GLY 101 N 1.25 1.04 3.33 -0.02 0.00 -1.26 -4.56 105.19 104.97 1l7o n GLY 101 Ca 0.16 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.39 1l7o n GLY 101 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l7o s PHE 102 N 0.56 2.34 0.26 1.61 0.08 -1.26 -0.29 117.98 121.28 1l7o s PHE 102 Ca 0.00 -0.42 -0.07 0.00 0.12 0.00 0.00 56.93 56.57 1l7o s PHE 102 Cb 0.00 -1.45 0.47 0.00 -0.57 0.00 0.00 43.02 41.47 1l7o s PHE 102 CO 0.00 0.05 1.59 -0.44 -0.10 0.00 0.00 175.22 176.32 1l7o h ASP 103 N 5.13 -0.63 -0.11 1.36 5.19 -0.55 -1.00 116.42 125.82 1l7o h ASP 103 Ca -0.45 0.25 0.03 0.00 -0.62 0.00 0.00 57.03 56.24 1l7o h ASP 103 Cb 1.13 0.48 -0.00 0.00 0.18 0.00 0.00 39.33 41.12 1l7o h ASP 103 CO 0.45 -0.28 0.26 -0.29 -3.12 0.00 0.00 179.24 176.27 1l7o h ILE 104 N 0.03 0.17 0.00 0.35 2.10 -1.96 -1.88 117.51 116.32 1l7o h ILE 104 Ca 0.46 0.00 -0.37 0.00 1.08 0.00 0.00 64.86 66.03 1l7o h ILE 104 Cb 0.79 0.76 -0.06 0.00 -1.09 0.00 0.00 36.82 37.21 1l7o h ILE 104 CO -0.85 0.00 -2.33 0.00 -1.08 0.00 0.00 178.15 173.89 1l7o n ALA 105 N -2.09 1.47 0.15 0.18 0.00 -0.41 -4.55 120.51 115.26 1l7o n ALA 105 Ca 0.00 -0.98 -0.00 0.00 0.00 0.00 0.00 53.44 52.46 1l7o n ALA 105 Cb 0.35 0.05 0.21 0.00 0.00 0.00 0.00 19.45 20.07 1l7o n ALA 105 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1l7o h VAL 106 N -0.33 1.40 -0.36 0.00 -1.51 -1.28 -3.01 116.25 111.15 1l7o h VAL 106 Ca -0.55 -1.93 -0.09 0.00 -1.23 0.00 0.00 66.70 62.90 1l7o h VAL 106 Cb 1.70 2.04 -0.02 0.00 -2.13 0.00 0.00 31.29 32.88 1l7o h VAL 106 CO -0.19 0.55 -0.13 0.78 -1.23 0.00 0.00 177.57 177.35 1l7o h ASN 107 N 0.00 0.63 -0.51 4.19 -0.26 -1.61 0.61 115.58 118.64 1l7o h ASN 107 Ca -0.01 -0.18 -0.08 0.00 -0.56 0.00 0.00 56.30 55.47 1l7o h ASN 107 Cb 1.00 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 38.07 1l7o h ASN 107 CO 0.07 0.79 -0.01 0.11 -1.06 0.00 0.00 177.43 177.33 1l7o h LYS 108 N 0.59 0.90 -0.65 0.81 1.57 -1.77 -2.30 116.57 115.72 1l7o h LYS 108 Ca 0.10 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 1l7o h LYS 108 Cb 0.56 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1l7o h LYS 108 CO 0.04 0.94 0.20 0.82 -0.57 0.00 0.00 179.45 180.87 1l7o h ILE 109 N 0.77 1.25 -0.52 1.86 1.08 -1.36 -1.20 117.51 119.38 1l7o h ILE 109 Ca 0.14 -0.86 0.07 0.00 -0.39 0.00 0.00 64.86 63.82 1l7o h ILE 109 Cb 0.54 0.59 -0.06 0.00 -3.07 0.00 0.00 36.82 34.81 1l7o h ILE 109 CO 0.03 0.33 0.19 0.50 -0.69 0.00 0.00 178.15 178.51 1l7o h LYS 110 N 0.94 0.36 -0.09 2.37 3.64 -0.64 0.34 116.57 123.47 1l7o h LYS 110 Ca 0.21 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.43 1l7o h LYS 110 Cb 0.30 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1l7o h LYS 110 CO -0.01 0.24 -0.48 0.93 -2.27 0.00 0.00 179.45 177.86 1l7o h GLU 111 N 0.37 0.49 -0.15 1.90 4.39 -1.32 0.29 114.58 120.54 1l7o h GLU 111 Ca 0.25 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1l7o h GLU 111 Cb 0.28 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1l7o h GLU 111 CO -0.26 1.03 -0.00 0.87 -1.16 0.00 0.00 179.01 179.49 1l7o h LYS 112 N 0.07 0.21 -0.01 2.33 1.57 -0.79 -2.19 116.57 117.76 1l7o h LYS 112 Ca -0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1l7o h LYS 112 Cb 1.13 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1l7o h LYS 112 CO 0.10 0.24 -0.59 1.28 -0.57 0.00 0.00 179.45 179.90 1l7o n LEU 113 N -4.41 1.74 -2.18 2.94 4.77 0.12 -4.98 117.00 115.01 1l7o n LEU 113 Ca -0.01 -0.70 -0.13 0.00 -0.03 0.00 0.00 56.01 55.15 1l7o n LEU 113 Cb 0.16 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.29 1l7o n LEU 113 CO 0.36 0.34 0.13 0.61 -1.33 0.00 0.00 177.39 177.50 1l7o n GLY 114 N 1.42 0.13 3.80 -0.72 0.00 0.20 -4.98 105.19 105.04 1l7o n GLY 114 Ca 0.08 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1l7o n GLY 114 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7o s LEU 115 N -4.43 3.68 0.11 0.99 1.43 0.78 -4.98 118.68 116.26 1l7o s LEU 115 Ca 0.32 1.91 -0.00 0.00 -1.03 0.00 0.00 54.13 55.33 1l7o s LEU 115 Cb -0.14 -4.55 -0.20 0.00 0.03 0.00 0.00 46.19 41.33 1l7o s LEU 115 CO 0.39 -1.01 1.23 0.44 0.23 0.00 0.00 176.35 177.63 1l7o h ASP 116 N 1.03 0.29 -5.04 2.29 3.45 -0.28 -3.46 116.42 114.71 1l7o h ASP 116 Ca -0.48 -0.29 -0.14 0.00 0.43 0.00 0.00 57.03 56.54 1l7o h ASP 116 Cb 1.23 -0.09 -0.19 0.00 -0.56 0.00 0.00 39.33 39.71 1l7o h ASP 116 CO 0.58 1.20 -0.58 -0.31 -1.57 0.00 0.00 179.24 178.56 1l7o s TYR 117 N -2.80 0.20 -0.12 4.55 2.02 -1.14 -5.01 117.35 115.04 1l7o s TYR 117 Ca -0.03 -0.45 -0.06 0.00 -0.37 0.00 0.00 57.07 56.17 1l7o s TYR 117 Cb 0.08 -0.15 0.05 0.00 -0.40 0.00 0.00 41.96 41.55 1l7o s TYR 117 CO 0.86 -0.29 0.28 0.00 -1.57 0.00 0.00 175.55 174.83 1l7o s ALA 118 N -2.00 -0.66 -0.02 3.71 0.00 -1.26 -1.84 121.76 119.68 1l7o s ALA 118 Ca -0.10 1.11 0.03 0.00 0.00 0.00 0.00 51.96 53.00 1l7o s ALA 118 Cb -0.05 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.36 1l7o s ALA 118 CO -0.02 -0.23 -0.09 -0.06 0.00 0.00 0.00 175.76 175.35 1l7o s PHE 119 N 1.34 0.97 0.34 0.00 0.08 -0.87 -5.00 117.98 114.85 1l7o s PHE 119 Ca -0.09 -0.24 -0.17 0.00 0.12 0.00 0.00 56.93 56.55 1l7o s PHE 119 Cb -0.10 -0.68 0.06 0.00 -0.57 0.00 0.00 43.02 41.73 1l7o s PHE 119 CO -0.09 -0.09 0.84 0.00 -0.10 0.00 0.00 175.22 175.78 1l7o s ALA 120 N 0.12 -0.93 0.72 5.36 0.00 -1.26 -0.00 121.76 125.78 1l7o s ALA 120 Ca -0.02 -0.66 -0.03 0.00 0.00 0.00 0.00 51.96 51.25 1l7o s ALA 120 Cb -0.08 0.69 0.11 0.00 0.00 0.00 0.00 23.12 23.85 1l7o s ALA 120 CO 0.00 -1.00 1.00 -0.80 0.00 0.00 0.00 175.76 174.96 1l7o s ASN 121 N -3.14 4.40 -0.12 0.00 0.01 0.60 -4.58 114.94 112.10 1l7o s ASN 121 Ca 0.17 -0.12 0.03 0.00 -0.71 0.00 0.00 52.86 52.22 1l7o s ASN 121 Cb -0.05 -0.33 0.00 0.00 0.41 0.00 0.00 41.25 41.29 1l7o s ASN 121 CO 0.10 -1.83 -0.22 -0.13 -1.51 0.00 0.00 177.10 173.51 1l7o s ARG 122 N -5.19 3.06 -0.67 -0.60 0.52 -0.04 0.17 118.95 116.20 1l7o s ARG 122 Ca 0.65 -0.86 -0.23 0.00 -0.52 0.00 0.00 55.73 54.77 1l7o s ARG 122 Cb -0.07 -2.38 0.07 0.00 0.52 0.00 0.00 34.95 33.09 1l7o s ARG 122 CO 0.45 0.09 1.00 -0.51 0.02 0.00 0.00 175.30 176.35 1l7o s LEU 123 N 0.56 4.24 0.13 2.53 1.43 -1.26 -2.27 118.68 124.04 1l7o s LEU 123 Ca -0.13 -0.94 -0.31 0.00 -1.03 0.00 0.00 54.13 51.72 1l7o s LEU 123 Cb -0.17 -2.44 -0.11 0.00 0.03 0.00 0.00 46.19 43.51 1l7o s LEU 123 CO 0.04 -1.49 1.84 -0.38 0.23 0.00 0.00 176.35 176.59 1l7o n ILE 124 N 5.98 0.35 -4.33 -0.59 2.08 -1.09 -5.00 119.36 116.77 1l7o n ILE 124 Ca -0.03 -0.06 -0.27 0.00 0.56 0.00 0.00 62.75 62.95 1l7o n ILE 124 Cb 0.46 -2.13 -0.10 0.00 -0.75 0.00 0.00 39.64 37.12 1l7o n ILE 124 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 1l7o s VAL 125 N 2.68 2.94 -0.16 1.39 -7.23 -1.26 -2.46 120.40 116.31 1l7o s VAL 125 Ca 0.82 -1.75 -0.06 0.00 -1.81 0.00 0.00 61.98 59.18 1l7o s VAL 125 Cb -0.48 -2.44 0.07 0.00 0.56 0.00 0.00 36.38 34.09 1l7o s VAL 125 CO 0.37 -0.10 0.34 -0.75 -0.31 0.00 0.00 175.10 174.65 1l7o s LYS 126 N -2.74 0.25 -1.18 4.82 2.20 0.60 -4.90 119.74 118.78 1l7o s LYS 126 Ca 0.23 0.84 -0.19 0.00 -0.36 0.00 0.00 55.97 56.48 1l7o s LYS 126 Cb -0.09 0.09 -0.00 0.00 -1.51 0.00 0.00 37.83 36.32 1l7o s LYS 126 CO 0.13 -0.24 0.73 -0.25 -0.36 0.00 0.00 175.35 175.36 1l7o n ASP 127 N 5.11 -4.48 -1.71 1.43 8.00 -1.26 -0.91 116.55 122.73 1l7o n ASP 127 Ca -0.11 -1.04 -0.15 0.00 0.71 0.00 0.00 54.79 54.19 1l7o n ASP 127 Cb 0.51 -3.17 -0.05 0.00 -0.02 0.00 0.00 41.12 38.39 1l7o n ASP 127 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l7o n GLY 128 N -1.76 0.95 2.92 0.44 0.00 -1.26 -4.94 105.19 101.54 1l7o n GLY 128 Ca -0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1l7o n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l7o s LYS 129 N -3.76 0.15 -0.02 1.61 1.02 -0.09 -0.39 119.74 118.25 1l7o s LYS 129 Ca 0.00 -0.29 -0.30 0.00 0.02 0.00 0.00 55.97 55.40 1l7o s LYS 129 Cb 0.00 0.05 -0.04 0.00 -0.52 0.00 0.00 37.83 37.32 1l7o s LYS 129 CO 0.00 -0.02 1.23 -0.51 -0.92 0.00 0.00 175.35 175.13 1l7o s LEU 130 N -0.70 4.31 -0.02 3.17 1.43 0.15 -0.29 118.68 126.72 1l7o s LEU 130 Ca -0.08 1.91 0.02 0.00 -1.03 0.00 0.00 54.13 54.96 1l7o s LEU 130 Cb -0.05 -3.56 0.11 0.00 0.03 0.00 0.00 46.19 42.72 1l7o s LEU 130 CO -0.00 -0.58 0.78 0.35 0.23 0.00 0.00 176.35 177.12 1l7o n THR 131 N 4.46 0.32 -0.77 5.49 -2.24 -1.03 -3.49 114.28 117.02 1l7o n THR 131 Ca 0.11 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1l7o n THR 131 Cb 0.46 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1l7o n THR 131 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l7o n GLY 132 N 0.23 0.11 3.54 3.38 0.00 -1.23 -4.95 105.19 106.26 1l7o n GLY 132 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1l7o n GLY 132 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l7o s ASP 133 N -2.08 4.06 0.05 1.61 -1.08 -1.26 -2.93 116.67 115.05 1l7o s ASP 133 Ca 0.00 -0.65 0.03 0.00 -0.52 0.00 0.00 52.55 51.41 1l7o s ASP 133 Cb 0.00 -0.61 -0.03 0.00 -1.46 0.00 0.00 42.92 40.82 1l7o s ASP 133 CO 0.00 0.11 -0.09 0.54 0.52 0.00 0.00 175.17 176.25 1l7o s VAL 134 N -1.70 0.67 0.31 1.11 0.11 -1.26 -2.66 120.40 116.98 1l7o s VAL 134 Ca 0.24 -1.21 0.04 0.00 -2.93 0.00 0.00 61.98 58.12 1l7o s VAL 134 Cb -0.09 -0.81 -0.06 0.00 -1.53 0.00 0.00 36.38 33.90 1l7o s VAL 134 CO 0.14 -0.40 0.05 -1.61 -3.33 0.00 0.00 175.10 169.95 1l7o s GLU 135 N -1.83 1.60 0.00 1.54 2.02 -0.96 -4.99 118.70 116.08 1l7o s GLU 135 Ca -0.06 -1.88 0.00 0.00 0.02 0.00 0.00 54.97 53.05 1l7o s GLU 135 Cb -0.09 -0.82 0.00 0.00 0.10 0.00 0.00 34.13 33.33 1l7o s GLU 135 CO 0.00 -0.17 0.00 0.41 0.02 0.00 0.00 175.26 175.52 1l7o n GLY 136 N -0.64 3.27 1.03 -1.39 0.00 -1.26 -0.86 105.19 105.34 1l7o n GLY 136 Ca -0.02 -1.30 0.08 0.00 0.00 0.00 0.00 46.02 44.78 1l7o n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l7o n GLU 137 N -1.50 3.20 -2.59 1.61 4.71 -1.26 -4.43 120.64 120.38 1l7o n GLU 137 Ca 0.00 -2.60 -0.22 0.00 -0.01 0.00 0.00 57.16 54.33 1l7o n GLU 137 Cb 0.00 -1.68 0.00 0.00 -1.01 0.00 0.00 31.44 28.76 1l7o n GLU 137 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1l7o n VAL 138 N 0.32 1.94 -0.02 2.62 0.31 -1.26 -4.80 118.33 117.44 1l7o n VAL 138 Ca 0.20 -4.43 -0.04 0.00 -0.01 0.00 0.00 64.34 60.05 1l7o n VAL 138 Cb 0.75 -0.69 -0.02 0.00 -0.91 0.00 0.00 33.84 32.97 1l7o n VAL 138 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1l7o n LEU 139 N -0.32 1.33 -4.68 7.52 4.77 -1.26 -4.62 117.00 119.74 1l7o n LEU 139 Ca 0.29 0.03 -0.31 0.00 -0.03 0.00 0.00 56.01 55.99 1l7o n LEU 139 Cb 0.69 -0.14 0.15 0.00 -2.33 0.00 0.00 43.42 41.79 1l7o n LEU 139 CO 0.31 0.28 0.67 -0.54 -1.33 0.00 0.00 177.39 176.78 1l7o s LYS 140 N -2.09 1.18 0.54 3.23 -0.14 -1.26 -3.80 119.74 117.39 1l7o s LYS 140 Ca -0.06 1.40 0.30 0.00 -1.36 0.00 0.00 55.97 56.25 1l7o s LYS 140 Cb 0.02 -1.76 1.46 0.00 -1.68 0.00 0.00 37.83 35.87 1l7o s LYS 140 CO 0.09 -2.47 1.92 1.49 -0.76 0.00 0.00 175.35 175.62 1l7o h GLU 141 N -1.75 0.00 -0.31 1.68 4.81 -2.00 -1.90 114.58 115.11 1l7o h GLU 141 Ca -0.44 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1l7o h GLU 141 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1l7o h GLU 141 CO 0.45 0.00 0.00 0.27 -0.73 0.00 0.00 179.01 179.00 1l7o n ASN 142 N -4.29 3.11 -0.14 1.04 6.94 -1.26 -4.66 115.26 116.00 1l7o n ASN 142 Ca 0.15 -2.24 -0.05 0.00 -0.02 0.00 0.00 54.58 52.42 1l7o n ASN 142 Cb 0.84 -0.30 0.01 0.00 -2.36 0.00 0.00 39.78 37.98 1l7o n ASN 142 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1l7o h ALA 143 N 1.88 0.10 -0.61 -2.53 0.00 -1.66 -2.40 119.26 114.04 1l7o h ALA 143 Ca 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1l7o h ALA 143 Cb 0.89 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 19.18 1l7o h ALA 143 CO 0.05 -0.57 0.15 0.87 0.00 0.00 0.00 179.25 179.75 1l7o h LYS 144 N -0.13 0.95 -0.67 0.00 1.57 -1.85 -0.86 116.57 115.58 1l7o h LYS 144 Ca 0.21 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1l7o h LYS 144 Cb 0.46 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1l7o h LYS 144 CO -0.53 0.84 0.33 0.78 -0.57 0.00 0.00 179.45 180.30 1l7o h GLY 145 N 1.02 1.02 1.03 3.86 0.00 -1.61 0.61 103.07 109.00 1l7o h GLY 145 Ca 0.19 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1l7o h GLY 145 CO -0.00 0.46 0.12 0.83 0.00 0.00 0.00 176.54 177.95 1l7o h GLU 146 N 0.95 0.98 -0.51 4.80 4.39 -0.88 -1.28 114.58 123.03 1l7o h GLU 146 Ca 0.23 -0.25 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1l7o h GLU 146 Cb 0.09 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1l7o h GLU 146 CO -0.03 0.91 0.25 0.82 -1.16 0.00 0.00 179.01 179.80 1l7o h ILE 147 N 0.89 1.19 -0.31 3.13 1.08 -0.44 0.46 117.51 123.51 1l7o h ILE 147 Ca 0.19 -0.54 0.03 0.00 -0.39 0.00 0.00 64.86 64.15 1l7o h ILE 147 Cb 0.39 0.60 -0.03 0.00 -3.07 0.00 0.00 36.82 34.71 1l7o h ILE 147 CO 0.01 0.21 0.14 0.25 -0.69 0.00 0.00 178.15 178.07 1l7o h LEU 148 N 0.68 0.19 -0.29 1.44 5.85 -0.58 -1.56 115.31 121.04 1l7o h LEU 148 Ca 0.18 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1l7o h LEU 148 Cb 0.11 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1l7o h LEU 148 CO -0.02 0.14 0.19 -0.33 -0.34 0.00 0.00 178.44 178.08 1l7o h GLU 149 N 0.29 0.39 -0.32 1.25 5.08 -0.93 -2.26 114.58 118.08 1l7o h GLU 149 Ca 0.13 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1l7o h GLU 149 Cb 0.07 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.17 1l7o h GLU 149 CO -0.11 0.27 -0.10 -0.22 -1.00 0.00 0.00 179.01 177.85 1l7o h LYS 150 N 0.38 -0.03 -0.60 2.33 3.64 -0.51 0.16 116.57 121.94 1l7o h LYS 150 Ca 0.11 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.40 1l7o h LYS 150 Cb -0.02 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1l7o h LYS 150 CO -0.02 -0.02 0.03 0.82 -2.27 0.00 0.00 179.45 177.99 1l7o h ILE 151 N -0.03 1.26 -0.55 2.00 2.04 -1.24 -1.31 117.51 119.68 1l7o h ILE 151 Ca 0.16 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 1l7o h ILE 151 Cb 0.27 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1l7o h ILE 151 CO -0.35 0.40 0.24 0.00 0.00 0.00 0.00 178.15 178.44 1l7o h ALA 152 N 0.99 0.71 -0.11 1.87 0.00 -0.95 -1.23 119.26 120.55 1l7o h ALA 152 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1l7o h ALA 152 Cb 0.51 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1l7o h ALA 152 CO 0.02 0.29 0.07 -0.22 0.00 0.00 0.00 179.25 179.42 1l7o h LYS 153 N 0.74 0.15 -0.68 0.00 3.64 -0.48 0.54 116.57 120.48 1l7o h LYS 153 Ca 0.19 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1l7o h LYS 153 Cb 0.15 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1l7o h LYS 153 CO -0.02 0.11 0.40 0.82 -2.27 0.00 0.00 179.45 178.50 1l7o h ILE 154 N 0.14 1.19 0.00 2.00 2.04 -1.08 -2.50 117.51 119.31 1l7o h ILE 154 Ca 0.04 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1l7o h ILE 154 Cb -0.00 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 1l7o h ILE 154 CO -0.01 0.20 -0.47 -0.62 0.00 0.00 0.00 178.15 177.25 1l7o n GLU 155 N -4.40 0.13 -3.09 2.37 -0.58 -0.48 -4.96 120.64 109.64 1l7o n GLU 155 Ca 0.07 0.04 -0.14 0.00 -0.42 0.00 0.00 57.16 56.72 1l7o n GLU 155 Cb 0.07 -1.59 0.05 0.00 -0.57 0.00 0.00 31.44 29.41 1l7o n GLU 155 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1l7o n GLY 156 N 1.43 -0.04 3.54 0.62 0.00 0.17 -5.01 105.19 105.90 1l7o n GLY 156 Ca 0.05 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1l7o n GLY 156 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l7o s ILE 157 N -3.22 3.76 0.32 -0.61 1.01 -0.17 -5.00 121.20 117.30 1l7o s ILE 157 Ca 0.22 -0.43 -0.28 0.00 0.00 0.00 0.00 60.65 60.17 1l7o s ILE 157 Cb -0.10 -2.59 -0.09 0.00 0.01 0.00 0.00 42.46 39.69 1l7o s ILE 157 CO 0.47 0.55 1.07 0.20 0.00 0.00 0.00 174.94 177.23 1l7o s ASN 158 N -0.26 7.11 0.52 3.58 0.01 -1.26 -4.55 114.94 120.09 1l7o s ASN 158 Ca 0.04 2.17 0.27 0.00 -0.71 0.00 0.00 52.86 54.62 1l7o s ASN 158 Cb -0.13 -2.61 1.39 0.00 0.41 0.00 0.00 41.25 40.31 1l7o s ASN 158 CO 0.02 -0.25 1.94 -0.07 -1.51 0.00 0.00 177.10 177.23 1l7o h LEU 159 N 3.37 0.06 -0.77 0.60 3.38 -1.96 0.28 115.31 120.26 1l7o h LEU 159 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1l7o h LEU 159 Cb 1.21 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1l7o h LEU 159 CO 0.65 0.03 0.00 -1.84 0.09 0.00 0.00 178.44 177.37 1l7o n GLU 160 N -4.35 0.18 -1.06 1.13 0.28 -1.26 -1.91 120.64 113.65 1l7o n GLU 160 Ca 0.14 0.45 -0.15 0.00 -0.16 0.00 0.00 57.16 57.44 1l7o n GLU 160 Cb 0.76 -1.87 0.21 0.00 1.43 0.00 0.00 31.44 31.97 1l7o n GLU 160 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1l7o n ASP 161 N -2.21 3.55 -4.49 -1.84 8.00 0.98 -4.57 116.55 115.97 1l7o n ASP 161 Ca 0.02 -3.59 -0.29 0.00 0.71 0.00 0.00 54.79 51.64 1l7o n ASP 161 Cb 0.20 -0.76 -0.11 0.00 -0.02 0.00 0.00 41.12 40.43 1l7o n ASP 161 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1l7o s THR 162 N -3.23 2.84 -0.06 -3.53 -4.23 -0.80 -1.54 115.64 105.09 1l7o s THR 162 Ca 0.53 -1.56 0.03 0.00 -1.18 0.00 0.00 61.69 59.51 1l7o s THR 162 Cb 0.45 -2.32 0.01 0.00 1.34 0.00 0.00 72.50 71.98 1l7o s THR 162 CO 0.08 0.07 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.41 1l7o s VAL 163 N -1.23 1.18 -0.10 2.29 1.01 0.12 -1.36 120.40 122.30 1l7o s VAL 163 Ca 0.19 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1l7o s VAL 163 Cb -0.10 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1l7o s VAL 163 CO 0.11 0.36 -0.13 0.00 0.00 0.00 0.00 175.10 175.43 1l7o s ALA 164 N 0.52 2.64 -0.27 5.51 0.00 -0.28 0.20 121.76 130.07 1l7o s ALA 164 Ca -0.12 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 50.95 1l7o s ALA 164 Cb -0.15 -1.14 0.07 0.00 0.00 0.00 0.00 23.12 21.90 1l7o s ALA 164 CO 0.03 0.35 -0.07 0.08 0.00 0.00 0.00 175.76 176.15 1l7o s VAL 165 N -0.00 2.08 0.48 0.00 1.01 0.04 -0.78 120.40 123.22 1l7o s VAL 165 Ca -0.04 -1.71 0.02 0.00 0.00 0.00 0.00 61.98 60.26 1l7o s VAL 165 Cb -0.14 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1l7o s VAL 165 CO 0.04 -0.15 0.02 -0.83 0.00 0.00 0.00 175.10 174.18 1l7o s GLY 166 N 1.11 2.88 -0.03 4.51 0.00 -0.67 -0.52 107.32 114.60 1l7o s GLY 166 Ca -0.05 -0.82 -0.00 0.00 0.00 0.00 0.00 44.72 43.85 1l7o s GLY 166 CO -0.06 -2.14 -0.03 1.34 0.00 0.00 0.00 173.10 172.20 1l7o n ASP 167 N -1.21 2.79 0.00 1.64 -0.08 -1.26 -1.96 116.55 116.47 1l7o n ASP 167 Ca -0.15 -0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 1l7o n ASP 167 Cb 0.67 -0.07 0.00 0.00 2.34 0.00 0.00 41.12 44.06 1l7o n ASP 167 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1l7o n GLY 168 N 3.19 3.88 0.42 0.27 0.00 -1.26 -0.75 105.19 110.95 1l7o n GLY 168 Ca -0.06 -0.94 0.27 0.00 0.00 0.00 0.00 46.02 45.29 1l7o n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7o h ALA 169 N 1.63 2.38 -0.00 4.61 0.00 -1.94 0.16 119.26 126.10 1l7o h ALA 169 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1l7o h ALA 169 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1l7o h ALA 169 CO 0.00 -0.86 0.00 0.09 0.00 0.00 0.00 179.25 178.48 1l7o n ASN 170 N -4.66 0.08 -0.58 0.00 4.13 -1.26 -2.77 115.26 110.20 1l7o n ASN 170 Ca 0.29 -1.13 0.12 0.00 1.68 0.00 0.00 54.58 55.53 1l7o n ASN 170 Cb 1.05 -0.00 0.08 0.00 -1.54 0.00 0.00 39.78 39.37 1l7o n ASN 170 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1l7o n ASP 171 N -0.89 2.13 -0.32 6.41 8.00 0.55 -4.38 116.55 128.06 1l7o n ASP 171 Ca 0.21 -1.56 -0.04 0.00 0.71 0.00 0.00 54.79 54.11 1l7o n ASP 171 Cb 0.11 0.32 0.09 0.00 -0.02 0.00 0.00 41.12 41.61 1l7o n ASP 171 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1l7o h ILE 172 N 2.83 1.26 0.00 0.53 2.04 -1.60 -1.15 117.51 121.42 1l7o h ILE 172 Ca 0.00 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1l7o h ILE 172 Cb 0.78 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1l7o h ILE 172 CO 0.00 0.31 0.00 -1.54 0.00 0.00 0.00 178.15 176.92 1l7o n SER 173 N -4.31 0.40 0.00 1.72 3.41 -1.26 -1.44 113.62 112.14 1l7o n SER 173 Ca 0.09 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1l7o n SER 173 Cb 0.12 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1l7o n SER 173 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1l7o n PHE 175 N 0.88 0.00 0.26 7.33 3.01 -0.44 -3.44 117.46 125.07 1l7o n PHE 175 Ca 0.00 0.00 0.18 0.00 1.01 0.00 0.00 57.45 58.64 1l7o n PHE 175 Cb 0.07 0.00 0.92 0.00 -0.01 0.00 0.00 39.48 40.46 1l7o n PHE 175 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1l7o h LYS 176 N 0.00 0.00 0.00 -1.08 1.57 -1.53 -2.22 116.57 113.31 1l7o h LYS 176 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1l7o h LYS 176 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1l7o h LYS 176 CO 0.00 0.00 -1.27 1.63 -0.57 0.00 0.00 179.45 179.24 1l7o n LYS 177 N -3.49 0.96 -2.99 3.15 4.76 -1.22 -5.00 118.16 114.33 1l7o n LYS 177 Ca -0.00 -0.08 -0.34 0.00 -2.87 0.00 0.00 58.31 55.02 1l7o n LYS 177 Cb 0.26 -1.36 -0.06 0.00 -1.84 0.00 0.00 35.03 32.03 1l7o n LYS 177 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1l7o s ALA 178 N -2.90 3.26 0.11 7.82 0.00 -0.84 -4.84 121.76 124.38 1l7o s ALA 178 Ca 0.00 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.10 1l7o s ALA 178 Cb 0.12 -2.95 -0.12 0.00 0.00 0.00 0.00 23.12 20.17 1l7o s ALA 178 CO 0.72 0.25 1.33 0.78 0.00 0.00 0.00 175.76 178.85 1l7o h GLY 179 N 2.68 0.85 -5.79 0.00 0.00 -0.95 -3.43 103.07 96.43 1l7o h GLY 179 Ca -0.48 -1.17 -0.57 0.00 0.00 0.00 0.00 47.33 45.11 1l7o h GLY 179 CO 0.64 1.04 -0.83 -2.27 0.00 0.00 0.00 176.54 175.12 1l7o s LEU 180 N -8.42 1.75 -0.23 3.11 2.96 -0.47 -4.99 118.68 112.40 1l7o s LEU 180 Ca -0.10 -0.39 -0.06 0.00 -0.22 0.00 0.00 54.13 53.36 1l7o s LEU 180 Cb 0.09 -1.02 -0.02 0.00 0.50 0.00 0.00 46.19 45.74 1l7o s LEU 180 CO 0.90 0.05 0.03 -0.54 -1.32 0.00 0.00 176.35 175.47 1l7o s LYS 181 N 0.69 3.59 -0.16 1.98 1.02 -1.26 -1.13 119.74 124.46 1l7o s LYS 181 Ca -0.13 -0.52 0.02 0.00 0.02 0.00 0.00 55.97 55.36 1l7o s LYS 181 Cb -0.16 -3.19 0.01 0.00 -0.52 0.00 0.00 37.83 33.97 1l7o s LYS 181 CO 0.03 -0.14 -0.21 0.42 -0.92 0.00 0.00 175.35 174.53 1l7o s ILE 182 N 1.43 2.05 -0.31 2.17 1.01 0.04 -0.09 121.20 127.49 1l7o s ILE 182 Ca 0.05 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.57 1l7o s ILE 182 Cb -0.15 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.47 1l7o s ILE 182 CO 0.02 0.54 0.46 0.00 0.00 0.00 0.00 174.94 175.96 1l7o s ALA 183 N 1.02 3.52 -0.38 9.38 0.00 0.47 -1.68 121.76 134.10 1l7o s ALA 183 Ca -0.02 -0.90 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 1l7o s ALA 183 Cb -0.14 -2.90 0.06 0.00 0.00 0.00 0.00 23.12 20.14 1l7o s ALA 183 CO -0.07 -0.97 0.18 0.12 0.00 0.00 0.00 175.76 175.02 1l7o s PHE 184 N 2.26 3.30 -1.58 0.00 5.36 -0.83 -0.14 117.98 126.36 1l7o s PHE 184 Ca 0.18 -1.47 -0.04 0.00 -0.96 0.00 0.00 56.93 54.64 1l7o s PHE 184 Cb -0.16 -2.59 0.04 0.00 -0.34 0.00 0.00 43.02 39.97 1l7o s PHE 184 CO 0.11 -0.78 0.09 0.00 -1.46 0.00 0.00 175.22 173.19 1l7o s ALA 186 N -4.18 2.90 0.49 0.00 0.00 -1.26 -5.01 121.76 114.70 1l7o s ALA 186 Ca 0.13 -1.40 -0.20 0.00 0.00 0.00 0.00 51.96 50.49 1l7o s ALA 186 Cb -0.08 -2.45 -0.08 0.00 0.00 0.00 0.00 23.12 20.51 1l7o s ALA 186 CO 0.99 -1.97 1.04 0.15 0.00 0.00 0.00 175.76 175.97 1l7o s LYS 187 N -5.54 3.79 0.27 0.00 -0.14 0.08 -4.89 119.74 113.30 1l7o s LYS 187 Ca 0.70 1.34 0.01 0.00 -1.36 0.00 0.00 55.97 56.65 1l7o s LYS 187 Cb -0.05 -2.09 0.61 0.00 -1.68 0.00 0.00 37.83 34.62 1l7o s LYS 187 CO 0.49 -0.44 1.72 -1.00 -0.76 0.00 0.00 175.35 175.36 1l7o h PRO 188 N 1.49 0.47 -0.37 -1.68 0.13 -1.97 -0.21 132.00 129.86 1l7o h PRO 188 Ca -0.49 -0.03 0.11 0.00 -0.87 0.00 0.00 66.00 64.72 1l7o h PRO 188 Cb 1.22 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1l7o h PRO 188 CO 0.59 0.31 0.43 0.97 -0.23 0.00 0.00 178.00 180.07 1l7o h ILE 189 N 0.48 0.34 0.03 -3.56 2.10 -1.95 -1.83 117.51 113.12 1l7o h ILE 189 Ca 0.50 0.00 -0.31 0.00 1.08 0.00 0.00 64.86 66.13 1l7o h ILE 189 Cb 0.84 0.65 -0.04 0.00 -1.09 0.00 0.00 36.82 37.18 1l7o h ILE 189 CO -0.45 0.00 -1.77 -0.11 -1.08 0.00 0.00 178.15 174.74 1l7o n LEU 190 N -3.64 1.23 -0.16 2.19 7.94 -0.10 -4.51 117.00 119.95 1l7o n LEU 190 Ca 0.06 0.37 -0.02 0.00 -1.11 0.00 0.00 56.01 55.32 1l7o n LEU 190 Cb 0.59 -0.09 0.06 0.00 0.53 0.00 0.00 43.42 44.51 1l7o n LEU 190 CO 0.26 0.48 0.86 0.11 -1.11 0.00 0.00 177.39 177.99 1l7o h LYS 191 N 0.01 0.14 0.00 1.96 1.57 -1.24 -2.08 116.57 116.94 1l7o h LYS 191 Ca -0.31 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1l7o h LYS 191 Cb 2.02 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.30 1l7o h LYS 191 CO 0.08 0.09 0.00 0.93 -0.57 0.00 0.00 179.45 179.98 1l7o h GLU 192 N 0.14 0.00 0.00 3.15 5.08 -1.80 -2.99 114.58 118.17 1l7o h GLU 192 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1l7o h GLU 192 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1l7o h GLU 192 CO -0.39 0.00 -0.39 0.87 -1.00 0.00 0.00 179.01 178.10 1l7o h LYS 193 N 0.00 0.00 -7.45 2.33 1.57 -1.61 -3.47 116.57 107.93 1l7o h LYS 193 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 1l7o h LYS 193 Cb 0.65 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.05 1l7o h LYS 193 CO 0.00 0.00 0.39 0.00 -0.57 0.00 0.00 179.45 179.27 1l7o s ALA 194 N -3.22 2.71 -0.00 3.86 0.00 -1.09 -4.98 121.76 119.04 1l7o s ALA 194 Ca 0.05 -0.29 0.04 0.00 0.00 0.00 0.00 51.96 51.76 1l7o s ALA 194 Cb 0.09 -3.05 -0.25 0.00 0.00 0.00 0.00 23.12 19.91 1l7o s ALA 194 CO 0.70 -1.30 0.83 -0.44 0.00 0.00 0.00 175.76 175.55 1l7o h ASP 195 N -0.77 0.18 -3.42 0.00 3.32 -0.82 -3.46 116.42 111.44 1l7o h ASP 195 Ca -0.45 -0.29 -0.48 0.00 0.02 0.00 0.00 57.03 55.82 1l7o h ASP 195 Cb 1.26 -0.06 -0.34 0.00 0.22 0.00 0.00 39.33 40.41 1l7o h ASP 195 CO 0.62 1.25 -0.80 -0.63 -1.72 0.00 0.00 179.24 177.96 1l7o s ILE 196 N -2.62 0.96 -0.21 0.35 1.01 -0.75 -5.03 121.20 114.91 1l7o s ILE 196 Ca -0.07 -0.37 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 1l7o s ILE 196 Cb 0.08 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.64 1l7o s ILE 196 CO 0.83 0.32 -0.06 0.00 0.00 0.00 0.00 174.94 176.03 1l7o s ILE 198 N 1.31 3.92 -0.52 0.00 1.01 0.80 -4.97 121.20 122.75 1l7o s ILE 198 Ca 0.04 -0.32 0.20 0.00 0.00 0.00 0.00 60.65 60.57 1l7o s ILE 198 Cb -0.14 -2.83 -0.26 0.00 0.01 0.00 0.00 42.46 39.24 1l7o s ILE 198 CO -0.03 0.36 0.66 -0.62 0.00 0.00 0.00 174.94 175.32 1l7o n GLU 199 N 4.87 0.54 -3.44 2.79 -0.58 -1.26 -0.18 120.64 123.38 1l7o n GLU 199 Ca -0.17 -0.08 -0.37 0.00 -0.42 0.00 0.00 57.16 56.12 1l7o n GLU 199 Cb 0.51 -1.46 -0.07 0.00 -0.57 0.00 0.00 31.44 29.86 1l7o n GLU 199 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1l7o s LYS 200 N -3.12 4.27 -1.21 3.49 1.02 -1.26 -4.83 119.74 118.10 1l7o s LYS 200 Ca 0.01 0.27 -0.17 0.00 0.02 0.00 0.00 55.97 56.09 1l7o s LYS 200 Cb 0.14 -3.42 -0.03 0.00 -0.52 0.00 0.00 37.83 34.00 1l7o s LYS 200 CO 0.83 0.23 2.07 -2.13 -0.92 0.00 0.00 175.35 175.43 1l7o n ARG 201 N 3.52 2.38 -3.56 1.68 0.63 -1.26 -4.77 116.66 115.29 1l7o n ARG 201 Ca -0.10 -2.41 -0.09 0.00 -0.92 0.00 0.00 57.85 54.33 1l7o n ARG 201 Cb 0.52 -3.21 -0.09 0.00 0.45 0.00 0.00 32.46 30.13 1l7o n ARG 201 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1l7o s ASP 202 N 4.03 -0.08 0.66 6.15 -1.08 -1.26 -4.59 116.67 120.51 1l7o s ASP 202 Ca 0.52 0.73 0.44 0.00 -0.52 0.00 0.00 52.55 53.72 1l7o s ASP 202 Cb 0.13 1.25 2.36 0.00 -1.46 0.00 0.00 42.92 45.19 1l7o s ASP 202 CO 0.00 -0.25 2.35 -0.07 0.52 0.00 0.00 175.17 177.72 1l7o h LEU 203 N 8.18 0.00 -1.19 -1.34 3.38 -1.45 -1.56 115.31 121.33 1l7o h LEU 203 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1l7o h LEU 203 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1l7o h LEU 203 CO 0.17 0.00 0.00 0.03 0.09 0.00 0.00 178.44 178.73 1l7o h ARG 204 N 0.00 0.00 0.00 1.13 3.08 -1.80 -2.43 114.38 114.36 1l7o h ARG 204 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1l7o h ARG 204 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1l7o h ARG 204 CO 0.00 0.00 -0.04 0.93 -1.07 0.00 0.00 179.97 179.79 1l7o h GLU 205 N 0.00 0.00 0.00 0.04 4.39 -1.65 -1.67 114.58 115.70 1l7o h GLU 205 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1l7o h GLU 205 Cb 0.26 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1l7o h GLU 205 CO 0.00 0.04 -0.20 -0.84 -1.16 0.00 0.00 179.01 176.85 1l7o h ILE 206 N 0.00 0.48 0.00 3.13 -0.00 -1.66 -2.97 117.51 116.49 1l7o h ILE 206 Ca -0.00 -1.10 -0.00 0.00 -0.00 0.00 0.00 64.86 63.76 1l7o h ILE 206 Cb 0.07 1.78 -0.00 0.00 -0.00 0.00 0.00 36.82 38.67 1l7o h ILE 206 CO 0.01 0.20 -0.00 -0.07 -0.00 0.00 0.00 178.15 178.28 1l7o h LEU 207 N 0.00 0.00 -0.76 0.16 3.38 -1.48 0.12 115.31 116.74 1l7o h LEU 207 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1l7o h LEU 207 Cb 0.76 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1l7o h LEU 207 CO 0.03 0.00 -0.04 0.11 0.09 0.00 0.00 178.44 178.63 1l7o h LYS 208 N 0.00 0.00 0.00 1.13 1.57 -1.67 -3.29 116.57 114.31 1l7o h LYS 208 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1l7o h LYS 208 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1l7o h LYS 208 CO 0.00 0.04 -0.88 0.66 -0.57 0.00 0.00 179.45 178.70 1l7o n TYR 209 N -3.13 0.00 -3.28 -1.35 4.01 0.35 -5.01 117.16 108.76 1l7o n TYR 209 Ca 0.02 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.38 1l7o n TYR 209 Cb 0.43 -0.08 -0.06 0.00 -0.31 0.00 0.00 39.34 39.31 1l7o n TYR 209 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1l7o s ILE 210 N -2.40 5.15 -2.00 -0.72 1.09 -0.80 -5.14 121.20 116.37 1l7o s ILE 210 Ca 0.02 0.96 0.28 0.00 -1.10 0.00 0.00 60.65 60.82 1l7o s ILE 210 Cb 0.09 -3.83 0.80 0.00 -1.06 0.00 0.00 42.46 38.46 1l7o s ILE 210 CO 0.53 0.26 2.02 1.17 -0.10 0.00 0.00 174.94 178.83