#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ic7 s VAL 2 N 0.00 3.99 0.42 0.58 1.01 -1.26 -1.16 120.40 123.99 1ic7 s VAL 2 Ca 0.00 -0.70 -0.17 0.00 0.00 0.00 0.00 61.98 61.11 1ic7 s VAL 2 Cb 0.00 -3.07 -0.09 0.00 0.00 0.00 0.00 36.38 33.22 1ic7 s VAL 2 CO 0.00 0.07 0.89 -0.36 0.00 0.00 0.00 175.10 175.70 1ic7 s PHE 3 N 1.50 3.38 0.65 5.22 0.40 -0.17 -5.00 117.98 123.96 1ic7 s PHE 3 Ca 0.03 1.43 -0.11 0.00 -0.60 0.00 0.00 56.93 57.67 1ic7 s PHE 3 Cb -0.17 -2.72 -0.02 0.00 0.51 0.00 0.00 43.02 40.62 1ic7 s PHE 3 CO 0.03 -0.13 1.04 0.20 0.70 0.00 0.00 175.22 177.06 1ic7 s GLY 4 N -2.52 1.68 0.08 4.36 0.00 -1.26 -4.86 107.32 104.80 1ic7 s GLY 4 Ca 0.58 0.00 -0.33 0.00 0.00 0.00 0.00 44.72 44.98 1ic7 s GLY 4 CO 0.20 0.29 1.61 -0.09 0.00 0.00 0.00 173.10 175.12 1ic7 h ARG 5 N -0.45 -0.85 -0.34 2.90 2.43 -1.97 -0.02 114.38 116.09 1ic7 h ARG 5 Ca -0.44 0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 58.71 1ic7 h ARG 5 Cb 1.20 0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.93 1ic7 h ARG 5 CO 0.60 -0.56 -0.14 0.00 -1.51 0.00 0.00 179.97 178.35 1ic7 h GLU 7 N 0.54 -0.00 -0.88 0.00 4.81 -1.89 -0.75 114.58 116.41 1ic7 h GLU 7 Ca 0.09 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1ic7 h GLU 7 Cb 0.55 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.89 1ic7 h GLU 7 CO 0.03 -0.00 0.47 1.25 -0.73 0.00 0.00 179.01 180.03 1ic7 h LEU 8 N -0.00 1.11 -0.63 1.64 5.85 -0.84 -1.89 115.31 120.53 1ic7 h LEU 8 Ca 0.02 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1ic7 h LEU 8 Cb 0.04 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1ic7 h LEU 8 CO -0.04 0.90 0.41 0.00 -0.34 0.00 0.00 178.44 179.37 1ic7 h ALA 9 N 1.26 0.80 -0.43 1.25 0.00 -0.96 0.17 119.26 121.34 1ic7 h ALA 9 Ca 0.31 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 1ic7 h ALA 9 Cb 0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ic7 h ALA 9 CO -0.05 0.24 -0.30 0.00 0.00 0.00 0.00 179.25 179.15 1ic7 h ALA 10 N 1.23 0.64 -0.39 0.00 0.00 -1.00 -2.35 119.26 117.39 1ic7 h ALA 10 Ca 0.23 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1ic7 h ALA 10 Cb -0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1ic7 h ALA 10 CO -0.05 0.68 0.14 0.00 0.00 0.00 0.00 179.25 180.02 1ic7 h ALA 11 N 0.84 0.51 -0.09 0.00 0.00 -0.88 -1.88 119.26 117.76 1ic7 h ALA 11 Ca 0.09 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1ic7 h ALA 11 Cb 0.89 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1ic7 h ALA 11 CO 0.08 0.13 -0.21 0.52 0.00 0.00 0.00 179.25 179.77 1ic7 h MET 12 N 0.49 0.15 -0.44 0.00 2.86 -0.64 0.04 114.93 117.39 1ic7 h MET 12 Ca 0.13 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 1ic7 h MET 12 Cb 0.22 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1ic7 h MET 12 CO -0.01 0.37 0.05 -0.22 1.06 0.00 0.00 176.91 178.16 1ic7 h LYS 13 N 0.14 0.75 -0.11 1.72 3.64 -1.32 -1.49 116.57 119.91 1ic7 h LYS 13 Ca 0.03 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.12 1ic7 h LYS 13 Cb 0.47 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1ic7 h LYS 13 CO 0.03 0.79 -0.27 -0.09 -2.27 0.00 0.00 179.45 177.64 1ic7 h ARG 14 N 0.60 0.21 -0.63 1.90 2.43 -0.74 -2.04 114.38 116.11 1ic7 h ARG 14 Ca 0.13 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1ic7 h ARG 14 Cb 0.42 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1ic7 h ARG 14 CO 0.01 0.46 0.00 0.72 -1.51 0.00 0.00 179.97 179.66 1ic7 n HIS 15 N -4.16 0.47 -2.32 2.20 8.25 -0.05 -4.89 115.22 114.72 1ic7 n HIS 15 Ca -0.01 -0.18 -0.10 0.00 -0.26 0.00 0.00 57.72 57.17 1ic7 n HIS 15 Cb 0.36 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.34 1ic7 n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ic7 n GLY 16 N 0.42 0.04 0.26 -1.41 0.00 -0.76 -4.95 105.19 98.78 1ic7 n GLY 16 Ca 0.08 -0.45 0.11 0.00 0.00 0.00 0.00 46.02 45.75 1ic7 n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ic7 n LEU 17 N -1.55 1.36 -4.60 0.99 4.77 -0.60 -4.58 117.00 112.80 1ic7 n LEU 17 Ca -0.09 -0.49 -0.43 0.00 -0.03 0.00 0.00 56.01 54.98 1ic7 n LEU 17 Cb 0.57 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1ic7 n LEU 17 CO 0.16 0.27 1.52 -0.62 -1.33 0.00 0.00 177.39 177.39 1ic7 s ASP 18 N -2.68 5.88 -0.93 -1.43 -1.08 -1.26 -3.00 116.67 112.17 1ic7 s ASP 18 Ca 0.16 1.20 -0.00 0.00 -0.52 0.00 0.00 52.55 53.39 1ic7 s ASP 18 Cb 0.18 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.11 1ic7 s ASP 18 CO 0.65 -1.74 0.06 0.59 0.52 0.00 0.00 175.17 175.25 1ic7 n ASN 19 N 10.36 -3.69 -4.68 -0.34 4.13 -0.05 -4.84 115.26 116.14 1ic7 n ASN 19 Ca 0.22 -0.04 -0.43 0.00 1.68 0.00 0.00 54.58 56.02 1ic7 n ASN 19 Cb 0.47 -2.86 -0.02 0.00 -1.54 0.00 0.00 39.78 35.82 1ic7 n ASN 19 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1ic7 s TYR 20 N -2.62 3.37 -1.68 3.10 5.04 -1.16 -3.76 117.35 119.64 1ic7 s TYR 20 Ca 0.03 1.45 -0.15 0.00 -2.44 0.00 0.00 57.07 55.96 1ic7 s TYR 20 Cb -0.01 -3.27 0.14 0.00 0.35 0.00 0.00 41.96 39.16 1ic7 s TYR 20 CO 0.04 -0.59 0.61 0.54 -1.34 0.00 0.00 175.55 174.80 1ic7 n ARG 21 N 5.47 -2.42 -0.71 4.97 5.12 -1.26 -1.30 116.66 126.53 1ic7 n ARG 21 Ca 0.10 0.30 0.00 0.00 -1.93 0.00 0.00 57.85 56.32 1ic7 n ARG 21 Cb 0.47 -4.77 0.00 0.00 -1.16 0.00 0.00 32.46 27.00 1ic7 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ic7 n GLY 22 N -1.54 0.68 3.31 -0.13 0.00 -1.25 -5.03 105.19 101.23 1ic7 n GLY 22 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1ic7 n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ic7 s TYR 23 N -2.26 3.05 0.68 1.61 2.02 -0.42 -4.97 117.35 117.06 1ic7 s TYR 23 Ca 0.00 -1.04 -0.15 0.00 -0.37 0.00 0.00 57.07 55.51 1ic7 s TYR 23 Cb 0.00 -2.15 0.01 0.00 -0.40 0.00 0.00 41.96 39.42 1ic7 s TYR 23 CO 0.00 -0.58 1.12 -1.54 -1.57 0.00 0.00 175.55 172.98 1ic7 s SER 24 N 1.46 4.94 0.29 2.29 1.04 -1.26 -0.88 113.70 121.59 1ic7 s SER 24 Ca 0.04 2.03 0.03 0.00 0.48 0.00 0.00 55.95 58.53 1ic7 s SER 24 Cb -0.16 -2.55 0.69 0.00 0.10 0.00 0.00 66.02 64.10 1ic7 s SER 24 CO -0.01 -1.74 1.72 0.25 0.98 0.00 0.00 173.24 174.44 1ic7 h LEU 25 N -0.09 0.44 -1.69 2.42 5.85 -1.89 -1.46 115.31 118.90 1ic7 h LEU 25 Ca -0.47 0.13 0.14 0.00 0.84 0.00 0.00 57.88 58.53 1ic7 h LEU 25 Cb 1.25 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.32 1ic7 h LEU 25 CO 0.53 0.09 0.46 1.23 -0.34 0.00 0.00 178.44 180.41 1ic7 h GLY 26 N 0.50 0.52 0.55 3.75 0.00 -1.91 -1.28 103.07 105.20 1ic7 h GLY 26 Ca 0.54 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.78 1ic7 h GLY 26 CO -0.47 0.05 -0.03 3.43 0.00 0.00 0.00 176.54 179.52 1ic7 h ASN 27 N 0.32 -0.17 -0.20 0.19 2.35 -1.49 -0.86 115.58 115.73 1ic7 h ASN 27 Ca 0.33 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 56.10 1ic7 h ASN 27 Cb 0.83 0.13 -0.02 0.00 0.05 0.00 0.00 38.32 39.31 1ic7 h ASN 27 CO -0.08 -0.05 0.01 -0.50 -1.65 0.00 0.00 177.43 175.15 1ic7 h TRP 28 N 0.04 0.47 -0.05 1.19 4.06 -1.39 -0.58 115.95 119.69 1ic7 h TRP 28 Ca 0.12 -0.04 -0.17 0.00 2.06 0.00 0.00 58.89 60.87 1ic7 h TRP 28 Cb 0.17 -0.14 0.01 0.00 -1.00 0.00 0.00 29.16 28.20 1ic7 h TRP 28 CO -0.23 0.47 -0.62 0.28 -3.56 0.00 0.00 178.44 174.78 1ic7 h VAL 29 N 0.45 1.38 -0.56 1.49 2.07 -1.41 -1.57 116.25 118.09 1ic7 h VAL 29 Ca 0.10 -2.00 -0.01 0.00 0.82 0.00 0.00 66.70 65.61 1ic7 h VAL 29 Cb 0.28 2.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.42 1ic7 h VAL 29 CO 0.01 0.59 0.30 0.00 0.02 0.00 0.00 177.57 178.49 1ic7 h ALA 31 N 1.13 0.70 -0.60 0.00 0.00 -0.99 -2.68 119.26 116.83 1ic7 h ALA 31 Ca 0.20 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1ic7 h ALA 31 Cb 0.06 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.59 1ic7 h ALA 31 CO -0.03 0.28 0.34 0.00 0.00 0.00 0.00 179.25 179.84 1ic7 h ALA 32 N 1.09 0.78 0.15 0.00 0.00 -0.99 0.15 119.26 120.44 1ic7 h ALA 32 Ca 0.18 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1ic7 h ALA 32 Cb 0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ic7 h ALA 32 CO -0.02 0.03 -0.17 -0.22 0.00 0.00 0.00 179.25 178.87 1ic7 h LYS 33 N 0.65 -0.34 0.00 0.00 1.63 -1.10 -1.30 116.57 116.10 1ic7 h LYS 33 Ca 0.25 0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 60.01 1ic7 h LYS 33 Cb 0.11 0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 1ic7 h LYS 33 CO -0.14 -0.23 -0.35 0.74 -3.45 0.00 0.00 179.45 176.02 1ic7 h PHE 34 N -0.35 0.00 0.16 1.91 0.04 -1.38 -0.05 116.94 117.27 1ic7 h PHE 34 Ca 0.01 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.53 1ic7 h PHE 34 Cb 0.34 0.00 0.03 0.00 2.20 0.00 0.00 35.95 38.52 1ic7 h PHE 34 CO -0.15 0.31 -1.06 0.93 -0.60 0.00 0.00 178.31 177.74 1ic7 h GLU 35 N 0.00 0.44 0.00 1.51 4.39 -0.65 -3.42 114.58 116.85 1ic7 h GLU 35 Ca -0.01 -0.69 0.00 0.00 0.34 0.00 0.00 59.36 59.01 1ic7 h GLU 35 Cb 1.24 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 1ic7 h GLU 35 CO 0.04 1.31 0.00 -1.13 -1.16 0.00 0.00 179.01 178.07 1ic7 n SER 36 N -3.96 0.27 -2.68 1.42 3.41 -0.53 -4.87 113.62 106.67 1ic7 n SER 36 Ca -0.14 -0.87 -0.21 0.00 -0.26 0.00 0.00 58.87 57.39 1ic7 n SER 36 Cb 0.92 0.05 0.02 0.00 -0.26 0.00 0.00 64.21 64.94 1ic7 n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ic7 n ASN 37 N -0.05 -5.79 -1.11 4.04 2.85 -0.03 -2.59 115.26 112.58 1ic7 n ASN 37 Ca 0.00 -0.21 -0.13 0.00 -0.11 0.00 0.00 54.58 54.12 1ic7 n ASN 37 Cb 0.15 -4.65 -0.05 0.00 1.24 0.00 0.00 39.78 36.46 1ic7 n ASN 37 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1ic7 n PHE 38 N -4.35 -0.11 -3.60 1.20 3.72 -1.12 -4.84 117.46 108.36 1ic7 n PHE 38 Ca -0.13 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.87 1ic7 n PHE 38 Cb 0.63 -2.50 -0.11 0.00 -0.94 0.00 0.00 39.48 36.56 1ic7 n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1ic7 s ASN 39 N -2.78 5.73 0.32 4.37 3.04 -1.07 -0.99 114.94 123.56 1ic7 s ASN 39 Ca 0.00 -0.62 0.25 0.00 0.04 0.00 0.00 52.86 52.53 1ic7 s ASN 39 Cb 0.00 -2.05 1.13 0.00 -1.54 0.00 0.00 41.25 38.80 1ic7 s ASN 39 CO 0.00 -0.26 1.76 0.71 -3.04 0.00 0.00 177.10 176.27 1ic7 h THR 40 N 5.67 0.00 -0.52 -5.21 1.35 -1.47 -2.91 112.91 109.82 1ic7 h THR 40 Ca -0.30 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1ic7 h THR 40 Cb 1.14 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 68.45 1ic7 h THR 40 CO 0.64 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.91 1ic7 n GLN 41 N -2.37 2.58 -1.95 4.72 1.13 -1.26 -4.06 117.38 116.17 1ic7 n GLN 41 Ca 0.01 -2.41 -0.40 0.00 -1.94 0.00 0.00 57.00 52.26 1ic7 n GLN 41 Cb 0.18 -1.52 -0.00 0.00 0.11 0.00 0.00 30.24 29.01 1ic7 n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ic7 s ALA 42 N -1.25 3.42 0.01 -1.58 0.00 -1.10 -4.78 121.76 116.47 1ic7 s ALA 42 Ca 0.41 1.39 -0.01 0.00 0.00 0.00 0.00 51.96 53.75 1ic7 s ALA 42 Cb 0.23 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 1ic7 s ALA 42 CO 0.31 -0.91 0.00 0.95 0.00 0.00 0.00 175.76 176.12 1ic7 s THR 43 N -1.18 0.08 -0.16 0.00 -4.23 -1.26 -0.54 115.64 108.35 1ic7 s THR 43 Ca 0.54 -0.64 -0.04 0.00 -1.18 0.00 0.00 61.69 60.37 1ic7 s THR 43 Cb -0.42 -0.22 0.07 0.00 1.34 0.00 0.00 72.50 73.27 1ic7 s THR 43 CO 0.56 -0.35 0.19 0.21 -0.54 0.00 0.00 174.62 174.68 1ic7 s ASN 44 N -1.06 1.27 -0.10 3.99 3.84 -0.70 -4.96 114.94 117.22 1ic7 s ASN 44 Ca -0.12 -0.06 -0.30 0.00 0.21 0.00 0.00 52.86 52.59 1ic7 s ASN 44 Cb -0.07 0.28 -0.02 0.00 -0.55 0.00 0.00 41.25 40.89 1ic7 s ASN 44 CO -0.00 -0.30 1.11 -0.60 -2.79 0.00 0.00 177.10 174.51 1ic7 s ARG 45 N 2.30 4.37 0.57 0.43 3.52 -1.26 -0.84 118.95 128.03 1ic7 s ARG 45 Ca 0.05 1.52 -0.02 0.00 -0.13 0.00 0.00 55.73 57.15 1ic7 s ARG 45 Cb -0.14 -3.57 0.03 0.00 -1.56 0.00 0.00 34.95 29.70 1ic7 s ARG 45 CO -0.10 -0.42 0.82 -0.80 -0.81 0.00 0.00 175.30 173.99 1ic7 s ASN 46 N 1.32 5.36 0.38 -2.12 -0.87 0.11 -4.97 114.94 114.15 1ic7 s ASN 46 Ca 0.51 0.28 0.18 0.00 -1.57 0.00 0.00 52.86 52.26 1ic7 s ASN 46 Cb -0.21 -1.22 0.75 0.00 -0.02 0.00 0.00 41.25 40.55 1ic7 s ASN 46 CO 0.18 -1.12 1.78 0.71 -2.57 0.00 0.00 177.10 176.08 1ic7 h THR 47 N -0.04 0.99 0.00 1.60 1.35 -1.96 -2.94 112.91 111.90 1ic7 h THR 47 Ca -0.44 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.01 1ic7 h THR 47 Cb 1.28 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 1ic7 h THR 47 CO 0.57 0.36 0.00 -0.90 -0.25 0.00 0.00 175.52 175.30 1ic7 n ASP 48 N -3.69 0.00 0.00 5.36 3.85 -1.26 -4.85 116.55 115.96 1ic7 n ASP 48 Ca -0.01 -0.85 0.00 0.00 -0.71 0.00 0.00 54.79 53.22 1ic7 n ASP 48 Cb 0.47 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.24 1ic7 n ASP 48 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ic7 n GLY 49 N 0.47 2.79 3.89 6.12 0.00 -1.11 -4.92 105.19 112.43 1ic7 n GLY 49 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1ic7 n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ic7 s SER 50 N -1.24 5.01 -0.01 1.61 1.04 -1.26 -4.73 113.70 114.12 1ic7 s SER 50 Ca 0.00 0.94 0.05 0.00 0.48 0.00 0.00 55.95 57.42 1ic7 s SER 50 Cb 0.00 -1.60 -0.01 0.00 0.10 0.00 0.00 66.02 64.51 1ic7 s SER 50 CO 0.00 -1.59 -0.15 -0.89 0.98 0.00 0.00 173.24 171.59 1ic7 s THR 51 N -3.44 1.18 -0.17 2.02 2.01 -1.26 0.06 115.64 116.04 1ic7 s THR 51 Ca 0.60 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.85 1ic7 s THR 51 Cb -0.11 -0.99 -0.05 0.00 0.01 0.00 0.00 72.50 71.37 1ic7 s THR 51 CO 0.50 0.34 0.21 -1.81 -0.69 0.00 0.00 174.62 173.16 1ic7 s ASP 52 N -0.34 6.35 -0.05 3.53 1.01 -0.02 -0.97 116.67 126.19 1ic7 s ASP 52 Ca 0.06 0.40 0.06 0.00 0.71 0.00 0.00 52.55 53.78 1ic7 s ASP 52 Cb -0.06 -2.13 -0.01 0.00 1.01 0.00 0.00 42.92 41.73 1ic7 s ASP 52 CO -0.01 0.18 -0.24 -0.31 0.21 0.00 0.00 175.17 175.00 1ic7 s TYR 53 N 0.16 2.43 0.00 4.23 1.51 0.58 -1.72 117.35 124.54 1ic7 s TYR 53 Ca 0.13 -0.60 0.00 0.00 -1.01 0.00 0.00 57.07 55.59 1ic7 s TYR 53 Cb -0.12 -1.57 0.00 0.00 -0.11 0.00 0.00 41.96 40.16 1ic7 s TYR 53 CO 0.02 -0.14 0.00 0.41 -1.11 0.00 0.00 175.55 174.73 1ic7 n GLY 54 N 2.76 -1.35 0.30 0.71 0.00 0.30 -1.56 105.19 106.34 1ic7 n GLY 54 Ca -0.17 -1.27 0.15 0.00 0.00 0.00 0.00 46.02 44.73 1ic7 n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ic7 h ILE 55 N 0.00 0.54 -0.13 -0.61 2.10 -1.70 -1.61 117.51 116.09 1ic7 h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1ic7 h ILE 55 Cb 0.00 0.97 0.00 0.00 -1.09 0.00 0.00 36.82 36.70 1ic7 h ILE 55 CO 0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.25 1ic7 n LEU 56 N -3.87 2.46 -3.84 2.19 4.77 -1.26 -4.20 117.00 113.24 1ic7 n LEU 56 Ca -0.02 -2.16 -0.34 0.00 -0.03 0.00 0.00 56.01 53.47 1ic7 n LEU 56 Cb 0.13 -0.15 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 1ic7 n LEU 56 CO 0.28 0.61 -0.14 0.00 -1.33 0.00 0.00 177.39 176.80 1ic7 n GLN 57 N -0.24 -0.93 -2.89 3.23 1.13 -0.61 -4.88 117.38 112.19 1ic7 n GLN 57 Ca 0.07 0.46 -0.41 0.00 -1.94 0.00 0.00 57.00 55.18 1ic7 n GLN 57 Cb 0.38 -2.96 -0.04 0.00 0.11 0.00 0.00 30.24 27.73 1ic7 n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ic7 s ILE 58 N -3.30 4.93 0.05 5.09 1.01 -0.60 -4.40 121.20 123.97 1ic7 s ILE 58 Ca 0.30 1.68 -0.30 0.00 0.00 0.00 0.00 60.65 62.33 1ic7 s ILE 58 Cb -0.15 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 1ic7 s ILE 58 CO 0.91 0.12 1.01 0.21 0.00 0.00 0.00 174.94 177.19 1ic7 s ASN 59 N 1.01 7.37 0.07 3.58 2.47 -1.26 -0.30 114.94 127.87 1ic7 s ASN 59 Ca 0.41 1.77 0.21 0.00 0.42 0.00 0.00 52.86 55.68 1ic7 s ASN 59 Cb -0.18 -2.58 0.87 0.00 -1.45 0.00 0.00 41.25 37.92 1ic7 s ASN 59 CO 0.18 -0.23 1.67 -1.54 -3.72 0.00 0.00 177.10 173.46 1ic7 n SER 60 N 3.48 0.22 0.05 -4.21 3.41 -0.14 -1.19 113.62 115.23 1ic7 n SER 60 Ca 0.05 0.54 -0.18 0.00 -0.26 0.00 0.00 58.87 59.02 1ic7 n SER 60 Cb 0.50 -0.59 -0.09 0.00 -0.26 0.00 0.00 64.21 63.77 1ic7 n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1ic7 h ARG 61 N 0.00 0.62 0.00 4.33 9.65 -1.84 -3.41 114.38 123.73 1ic7 h ARG 61 Ca 0.00 -0.67 -0.28 0.00 -1.10 0.00 0.00 59.98 57.93 1ic7 h ARG 61 Cb 0.39 0.19 -0.05 0.00 -1.39 0.00 0.00 29.97 29.11 1ic7 h ARG 61 CO 0.00 1.27 -2.05 0.91 2.80 0.00 0.00 179.97 182.89 1ic7 n TRP 62 N -3.82 0.00 -0.13 2.20 7.02 -1.19 -1.97 117.44 119.56 1ic7 n TRP 62 Ca -0.10 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.21 1ic7 n TRP 62 Cb 0.87 -0.71 -0.12 0.00 -2.42 0.00 0.00 31.31 28.93 1ic7 n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1ic7 n TRP 63 N -3.02 0.00 -4.34 -5.99 7.02 -0.33 -0.48 117.44 110.30 1ic7 n TRP 63 Ca -0.32 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 55.98 1ic7 n TRP 63 Cb 0.85 -0.98 -0.10 0.00 -2.42 0.00 0.00 31.31 28.67 1ic7 n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ic7 s ASN 65 N -3.32 4.59 0.00 0.00 2.47 -0.12 -4.46 114.94 114.10 1ic7 s ASN 65 Ca 0.29 -0.52 0.13 0.00 0.42 0.00 0.00 52.86 53.18 1ic7 s ASN 65 Cb 0.06 -1.78 0.27 0.00 -1.45 0.00 0.00 41.25 38.34 1ic7 s ASN 65 CO 0.09 -0.08 1.16 -0.90 -3.72 0.00 0.00 177.10 173.66 1ic7 n ASP 66 N 4.81 2.73 0.00 -4.21 5.68 -1.26 -0.69 116.55 123.61 1ic7 n ASP 66 Ca -0.17 -1.83 0.00 0.00 -0.50 0.00 0.00 54.79 52.29 1ic7 n ASP 66 Cb 0.50 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 1ic7 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ic7 n GLY 67 N 0.72 0.54 0.12 6.12 0.00 -1.26 -4.76 105.19 106.67 1ic7 n GLY 67 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1ic7 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ic7 n ARG 68 N -2.00 1.32 -4.02 1.61 1.74 -1.26 -4.99 116.66 109.06 1ic7 n ARG 68 Ca 0.00 -2.07 -0.34 0.00 -0.77 0.00 0.00 57.85 54.67 1ic7 n ARG 68 Cb 0.00 -1.22 -0.15 0.00 -1.02 0.00 0.00 32.46 30.07 1ic7 n ARG 68 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1ic7 s THR 69 N -2.01 2.63 0.00 0.55 2.01 -1.26 -4.90 115.64 112.66 1ic7 s THR 69 Ca 0.20 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.32 1ic7 s THR 69 Cb 0.18 -2.22 0.00 0.00 0.01 0.00 0.00 72.50 70.46 1ic7 s THR 69 CO 0.02 0.38 0.07 -2.65 -0.69 0.00 0.00 174.62 171.75 1ic7 n PRO 70 N 4.67 0.00 -1.20 4.92 -0.01 -1.26 -2.58 135.00 139.54 1ic7 n PRO 70 Ca -0.19 0.07 -0.18 0.00 -0.01 0.00 0.00 63.50 63.19 1ic7 n PRO 70 Cb 0.49 -0.57 -0.11 0.00 -0.01 0.00 0.00 33.50 33.30 1ic7 n PRO 70 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1ic7 n GLY 71 N -0.14 3.60 3.70 -1.23 0.00 -1.26 -4.96 105.19 104.91 1ic7 n GLY 71 Ca 0.00 -1.47 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 1ic7 n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ic7 n SER 72 N 1.71 3.82 0.01 1.61 2.88 -1.07 -4.86 113.62 117.73 1ic7 n SER 72 Ca 0.44 1.04 0.11 0.00 -1.33 0.00 0.00 58.87 59.13 1ic7 n SER 72 Cb 0.74 -1.53 -0.11 0.00 -0.75 0.00 0.00 64.21 62.56 1ic7 n SER 72 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ic7 n ARG 73 N 4.36 0.52 -4.07 -1.46 5.12 -0.83 -5.01 116.66 115.28 1ic7 n ARG 73 Ca 0.17 -0.10 -0.27 0.00 -1.93 0.00 0.00 57.85 55.72 1ic7 n ARG 73 Cb 0.34 -1.57 -0.05 0.00 -1.16 0.00 0.00 32.46 30.02 1ic7 n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1ic7 n ASN 74 N -2.19 0.10 0.03 0.55 4.05 -1.17 -4.85 115.26 111.79 1ic7 n ASN 74 Ca -0.02 -1.09 0.09 0.00 0.45 0.00 0.00 54.58 54.01 1ic7 n ASN 74 Cb 0.52 -2.58 0.53 0.00 1.23 0.00 0.00 39.78 39.47 1ic7 n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1ic7 h LEU 75 N -1.82 0.28 -0.49 1.20 3.38 -0.80 0.52 115.31 117.58 1ic7 h LEU 75 Ca -0.64 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.33 1ic7 h LEU 75 Cb 1.38 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1ic7 h LEU 75 CO 0.65 0.19 -0.10 0.00 0.09 0.00 0.00 178.44 179.26 1ic7 n ASN 77 N -0.55 -3.43 -3.76 0.00 4.05 0.17 -4.99 115.26 106.76 1ic7 n ASN 77 Ca 0.16 -0.67 -0.13 0.00 0.45 0.00 0.00 54.58 54.39 1ic7 n ASN 77 Cb 0.30 -5.05 -0.09 0.00 1.23 0.00 0.00 39.78 36.17 1ic7 n ASN 77 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 1ic7 s ILE 78 N -3.39 0.05 0.26 -1.44 2.07 -1.26 -5.06 121.20 112.42 1ic7 s ILE 78 Ca 0.15 -0.39 -0.29 0.00 -1.41 0.00 0.00 60.65 58.70 1ic7 s ILE 78 Cb -0.02 -0.58 -0.09 0.00 0.13 0.00 0.00 42.46 41.89 1ic7 s ILE 78 CO 0.74 -0.21 1.21 -2.16 -1.91 0.00 0.00 174.94 172.61 1ic7 s PRO 79 N -1.04 4.49 0.48 3.50 0.04 -1.26 -0.94 135.00 140.27 1ic7 s PRO 79 Ca -0.11 1.97 0.20 0.00 0.04 0.00 0.00 61.00 63.10 1ic7 s PRO 79 Cb -0.05 -3.17 1.22 0.00 0.04 0.00 0.00 34.50 32.55 1ic7 s PRO 79 CO 0.03 -0.03 1.98 0.00 0.04 0.00 0.00 177.00 179.03 1ic7 h SER 81 N 0.19 0.00 0.18 0.00 4.64 -1.91 0.59 113.55 117.24 1ic7 h SER 81 Ca 0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.59 1ic7 h SER 81 Cb 0.82 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1ic7 h SER 81 CO -0.05 0.16 -0.03 0.00 -0.87 0.00 0.00 176.83 176.04 1ic7 h ALA 82 N 1.84 1.22 -0.00 5.18 0.00 -1.79 -1.80 119.26 123.91 1ic7 h ALA 82 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ic7 h ALA 82 Cb 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ic7 h ALA 82 CO 0.02 0.03 -0.01 1.28 0.00 0.00 0.00 179.25 180.57 1ic7 n LEU 83 N -3.43 0.10 -3.31 0.00 4.77 0.20 -4.09 117.00 111.23 1ic7 n LEU 83 Ca -0.02 0.13 -0.35 0.00 -0.03 0.00 0.00 56.01 55.74 1ic7 n LEU 83 Cb 0.13 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 1ic7 n LEU 83 CO 0.25 0.02 0.86 0.18 -1.33 0.00 0.00 177.39 177.37 1ic7 n LEU 84 N -1.11 6.09 -4.27 2.23 4.77 -0.68 -4.24 117.00 119.79 1ic7 n LEU 84 Ca 0.18 -5.51 -0.17 0.00 -0.03 0.00 0.00 56.01 50.48 1ic7 n LEU 84 Cb 0.20 -0.89 -0.10 0.00 -2.33 0.00 0.00 43.42 40.29 1ic7 n LEU 84 CO 0.21 2.18 -0.43 -0.55 -1.33 0.00 0.00 177.39 177.48 1ic7 s SER 85 N -2.30 2.07 0.00 -1.43 0.15 -1.26 -4.93 113.70 106.00 1ic7 s SER 85 Ca 0.44 -0.95 0.28 0.00 0.70 0.00 0.00 55.95 56.42 1ic7 s SER 85 Cb 0.23 -0.06 1.12 0.00 -1.71 0.00 0.00 66.02 65.60 1ic7 s SER 85 CO -0.14 -0.22 1.84 -1.54 1.20 0.00 0.00 173.24 174.38 1ic7 n SER 86 N -0.00 0.10 -4.67 5.45 3.41 -1.26 -4.57 113.62 112.07 1ic7 n SER 86 Ca -0.11 0.31 -0.40 0.00 -0.26 0.00 0.00 58.87 58.41 1ic7 n SER 86 Cb 0.59 -0.35 -0.05 0.00 -0.26 0.00 0.00 64.21 64.14 1ic7 n SER 86 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ic7 s ASP 87 N -2.97 6.78 0.00 4.04 -1.08 -1.26 -4.97 116.67 117.22 1ic7 s ASP 87 Ca 0.14 0.95 0.29 0.00 -0.52 0.00 0.00 52.55 53.42 1ic7 s ASP 87 Cb 0.19 -2.38 1.37 0.00 -1.46 0.00 0.00 42.92 40.64 1ic7 s ASP 87 CO 0.56 -0.27 1.93 2.30 0.52 0.00 0.00 175.17 180.21 1ic7 n ILE 88 N 4.54 0.00 -0.29 4.11 -5.35 -1.26 -4.49 119.36 116.62 1ic7 n ILE 88 Ca -0.00 -0.11 -0.12 0.00 -0.27 0.00 0.00 62.75 62.25 1ic7 n ILE 88 Cb 0.50 -0.01 -0.09 0.00 -1.74 0.00 0.00 39.64 38.30 1ic7 n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1ic7 h THR 89 N 1.01 0.01 -0.44 7.28 2.02 -1.95 0.03 112.91 120.87 1ic7 h THR 89 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1ic7 h THR 89 Cb 0.29 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1ic7 h THR 89 CO 0.00 0.00 0.01 0.00 0.37 0.00 0.00 175.52 175.90 1ic7 h ALA 90 N 0.32 1.20 -0.60 6.16 0.00 -1.86 -1.03 119.26 123.45 1ic7 h ALA 90 Ca 0.13 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1ic7 h ALA 90 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1ic7 h ALA 90 CO -0.78 0.53 0.16 0.77 0.00 0.00 0.00 179.25 179.92 1ic7 h SER 91 N 0.67 0.91 -0.38 0.00 0.02 -1.68 -2.35 113.55 110.74 1ic7 h SER 91 Ca 0.13 -0.23 -0.14 0.00 -0.84 0.00 0.00 61.79 60.72 1ic7 h SER 91 Cb 0.40 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1ic7 h SER 91 CO 0.02 0.90 -0.30 0.58 -1.14 0.00 0.00 176.83 176.88 1ic7 h VAL 92 N 0.87 1.28 -0.64 2.27 2.07 -0.75 -0.71 116.25 120.64 1ic7 h VAL 92 Ca 0.19 -1.46 0.05 0.00 0.82 0.00 0.00 66.70 66.30 1ic7 h VAL 92 Cb 0.34 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1ic7 h VAL 92 CO -0.00 0.49 0.36 0.78 0.02 0.00 0.00 177.57 179.22 1ic7 h ASN 93 N 0.68 0.55 -0.26 0.57 2.35 -1.16 -1.28 115.58 117.03 1ic7 h ASN 93 Ca 0.07 0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.76 1ic7 h ASN 93 Cb 0.88 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.16 1ic7 h ASN 93 CO 0.08 0.36 -0.18 0.00 -1.65 0.00 0.00 177.43 176.04 1ic7 h ALA 95 N 0.71 1.16 -0.39 0.00 0.00 -0.79 -0.47 119.26 119.48 1ic7 h ALA 95 Ca 0.05 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ic7 h ALA 95 Cb 0.72 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1ic7 h ALA 95 CO 0.05 0.19 0.13 0.87 0.00 0.00 0.00 179.25 180.50 1ic7 h LYS 96 N 0.88 0.55 -0.02 0.00 1.57 -1.16 -1.69 116.57 116.71 1ic7 h LYS 96 Ca 0.38 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1ic7 h LYS 96 Cb 0.25 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1ic7 h LYS 96 CO -0.20 0.48 -0.01 -0.22 -0.57 0.00 0.00 179.45 178.93 1ic7 h LYS 97 N 0.55 0.03 -0.48 3.15 3.64 -1.28 -2.88 116.57 119.31 1ic7 h LYS 97 Ca 0.13 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.59 1ic7 h LYS 97 Cb 0.15 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.88 1ic7 h LYS 97 CO -0.01 0.41 -0.01 0.82 -2.27 0.00 0.00 179.45 178.39 1ic7 h ILE 98 N -0.35 0.62 0.00 2.00 2.04 -0.82 -1.92 117.51 119.08 1ic7 h ILE 98 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1ic7 h ILE 98 Cb 0.40 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1ic7 h ILE 98 CO 0.00 0.02 0.00 0.55 0.00 0.00 0.00 178.15 178.72 1ic7 n VAL 99 N -5.23 0.47 1.38 1.67 3.14 -0.66 -2.45 118.33 116.65 1ic7 n VAL 99 Ca 0.05 0.05 0.14 0.00 -2.96 0.00 0.00 64.34 61.62 1ic7 n VAL 99 Cb 0.26 -0.73 0.67 0.00 -1.06 0.00 0.00 33.84 32.98 1ic7 n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1ic7 n SER 100 N -1.72 0.22 -4.86 6.55 7.64 -0.72 -4.17 113.62 116.56 1ic7 n SER 100 Ca 0.05 -0.29 -0.31 0.00 1.01 0.00 0.00 58.87 59.33 1ic7 n SER 100 Cb 0.30 -0.19 0.03 0.00 -1.01 0.00 0.00 64.21 63.34 1ic7 n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ic7 s ASP 101 N -2.57 5.79 0.48 6.43 2.15 -1.03 -4.95 116.67 122.97 1ic7 s ASP 101 Ca 0.27 1.41 0.33 0.00 0.43 0.00 0.00 52.55 54.98 1ic7 s ASP 101 Cb 0.20 -2.35 1.69 0.00 -0.30 0.00 0.00 42.92 42.16 1ic7 s ASP 101 CO 0.48 -1.16 1.99 1.23 -0.17 0.00 0.00 175.17 177.55 1ic7 h GLY 102 N -0.52 0.00 2.00 2.66 0.00 -1.89 -0.55 103.07 104.77 1ic7 h GLY 102 Ca -0.44 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.84 1ic7 h GLY 102 CO 0.61 0.00 -0.22 3.43 0.00 0.00 0.00 176.54 180.36 1ic7 h ASN 103 N 0.00 0.00 0.00 0.19 2.35 -1.90 -3.48 115.58 112.74 1ic7 h ASN 103 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ic7 h ASN 103 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1ic7 h ASN 103 CO 0.00 0.22 0.00 0.61 -1.65 0.00 0.00 177.43 176.61 1ic7 n GLY 104 N 0.37 3.16 0.00 2.83 0.00 -0.22 -1.95 105.19 109.37 1ic7 n GLY 104 Ca 0.01 -0.28 0.14 0.00 0.00 0.00 0.00 46.02 45.89 1ic7 n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ic7 n MET 105 N 13.93 0.36 0.18 1.61 2.81 -1.26 -3.35 117.12 131.39 1ic7 n MET 105 Ca 0.00 0.01 0.13 0.00 -1.81 0.00 0.00 57.70 56.03 1ic7 n MET 105 Cb 0.00 -1.50 0.65 0.00 -0.71 0.00 0.00 33.22 31.66 1ic7 n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1ic7 h ASN 106 N 0.00 0.00 -0.59 7.83 2.35 -1.80 -1.67 115.58 121.70 1ic7 h ASN 106 Ca 0.00 0.00 0.15 0.00 -0.55 0.00 0.00 56.30 55.90 1ic7 h ASN 106 Cb 0.30 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 1ic7 h ASN 106 CO 0.00 0.00 0.41 0.00 -1.65 0.00 0.00 177.43 176.19 1ic7 h ALA 107 N 2.05 2.35 -1.93 -0.83 0.00 -1.73 -3.38 119.26 115.79 1ic7 h ALA 107 Ca 0.00 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.26 1ic7 h ALA 107 Cb 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.74 1ic7 h ALA 107 CO 0.00 -0.51 0.36 -1.58 0.00 0.00 0.00 179.25 177.52 1ic7 s TRP 108 N -5.16 2.90 0.27 0.00 0.51 -0.63 -4.94 118.94 111.88 1ic7 s TRP 108 Ca -0.06 -0.19 -0.04 0.00 -2.12 0.00 0.00 56.10 53.69 1ic7 s TRP 108 Cb 0.20 -3.85 0.36 0.00 -0.81 0.00 0.00 33.47 29.37 1ic7 s TRP 108 CO 0.74 -1.21 1.91 0.28 -0.51 0.00 0.00 176.95 178.16 1ic7 h VAL 109 N 5.96 1.17 0.00 4.03 2.07 -1.86 -1.32 116.25 126.29 1ic7 h VAL 109 Ca -0.27 -0.43 -0.10 0.00 0.82 0.00 0.00 66.70 66.72 1ic7 h VAL 109 Cb 1.08 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1ic7 h VAL 109 CO 1.03 0.23 -0.50 0.00 0.02 0.00 0.00 177.57 178.35 1ic7 h ALA 110 N 1.43 1.04 -0.21 1.67 0.00 -1.92 -0.97 119.26 120.30 1ic7 h ALA 110 Ca 0.39 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ic7 h ALA 110 Cb 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1ic7 h ALA 110 CO -0.12 0.62 0.01 2.35 0.00 0.00 0.00 179.25 182.12 1ic7 h TRP 111 N 0.00 0.39 -0.84 0.00 7.01 -1.70 0.27 115.95 121.08 1ic7 h TRP 111 Ca -0.00 -0.06 -0.03 0.00 2.11 0.00 0.00 58.89 60.90 1ic7 h TRP 111 Cb 0.96 -0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 27.88 1ic7 h TRP 111 CO 0.00 0.53 0.40 -0.09 -2.79 0.00 0.00 178.44 176.49 1ic7 h ARG 112 N 0.14 1.21 0.00 2.65 2.43 -1.01 0.42 114.38 120.22 1ic7 h ARG 112 Ca 0.06 -0.18 -0.15 0.00 -0.81 0.00 0.00 59.98 58.90 1ic7 h ARG 112 Cb 0.36 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1ic7 h ARG 112 CO 0.01 0.93 -0.89 -0.91 -1.51 0.00 0.00 179.97 177.59 1ic7 h ASN 113 N 1.20 0.00 0.00 -3.80 2.35 -0.99 -3.37 115.58 110.97 1ic7 h ASN 113 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 1ic7 h ASN 113 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1ic7 h ASN 113 CO -0.04 0.66 -0.48 0.54 -1.65 0.00 0.00 177.43 176.46 1ic7 n ARG 114 N -3.16 3.46 -0.07 0.81 5.12 0.94 -4.89 116.66 118.87 1ic7 n ARG 114 Ca -0.02 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.77 1ic7 n ARG 114 Cb 0.82 -0.73 -0.05 0.00 -1.16 0.00 0.00 32.46 31.34 1ic7 n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ic7 n LYS 116 N -3.35 2.37 -0.23 0.00 4.81 -0.06 -1.42 118.16 120.29 1ic7 n LYS 116 Ca -0.25 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 1ic7 n LYS 116 Cb 0.71 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 33.09 1ic7 n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ic7 n GLY 117 N 3.74 0.72 3.85 3.14 0.00 -1.26 -4.95 105.19 110.43 1ic7 n GLY 117 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1ic7 n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ic7 s THR 118 N -2.53 2.07 -1.16 2.61 -4.23 -0.51 -5.02 115.64 106.87 1ic7 s THR 118 Ca 0.00 -1.53 -0.20 0.00 -1.18 0.00 0.00 61.69 58.78 1ic7 s THR 118 Cb 0.00 -2.59 0.06 0.00 1.34 0.00 0.00 72.50 71.31 1ic7 s THR 118 CO 0.00 0.00 1.59 -0.62 -0.54 0.00 0.00 174.62 175.05 1ic7 s ASP 119 N -4.13 6.67 0.48 3.99 2.15 -1.26 -4.81 116.67 119.77 1ic7 s ASP 119 Ca 0.38 -1.96 0.27 0.00 0.43 0.00 0.00 52.55 51.67 1ic7 s ASP 119 Cb -0.01 -2.57 1.14 0.00 -0.30 0.00 0.00 42.92 41.18 1ic7 s ASP 119 CO 0.23 -1.33 1.91 -0.37 -0.17 0.00 0.00 175.17 175.44 1ic7 h VAL 120 N 6.17 0.45 0.00 1.11 -1.51 -1.91 -2.32 116.25 118.24 1ic7 h VAL 120 Ca 0.32 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 64.92 1ic7 h VAL 120 Cb 0.94 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 1ic7 h VAL 120 CO 1.44 0.16 0.00 1.56 -1.23 0.00 0.00 177.57 179.50 1ic7 h GLN 121 N 0.00 0.00 0.00 5.19 1.08 -1.87 -1.06 115.11 118.46 1ic7 h GLN 121 Ca -0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ic7 h GLN 121 Cb 0.61 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.04 1ic7 h GLN 121 CO 0.02 0.00 -0.01 0.00 -0.95 0.00 0.00 178.83 177.89 1ic7 h ALA 122 N 2.08 1.86 0.00 3.87 0.00 -1.81 -1.37 119.26 123.90 1ic7 h ALA 122 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ic7 h ALA 122 Cb 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ic7 h ALA 122 CO 0.00 0.01 0.00 -1.49 0.00 0.00 0.00 179.25 177.77 1ic7 h TRP 123 N 0.00 0.00 -0.01 0.00 4.06 -1.39 -2.90 115.95 115.71 1ic7 h TRP 123 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1ic7 h TRP 123 Cb 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.18 1ic7 h TRP 123 CO 0.00 0.00 -0.13 0.44 -3.56 0.00 0.00 178.44 175.19 1ic7 n ILE 124 N -2.44 0.00 -1.79 1.49 -5.35 -0.54 -4.87 119.36 105.86 1ic7 n ILE 124 Ca 0.02 -0.44 -0.33 0.00 -0.27 0.00 0.00 62.75 61.73 1ic7 n ILE 124 Cb 0.25 1.12 0.04 0.00 -1.74 0.00 0.00 39.64 39.31 1ic7 n ILE 124 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1ic7 s ARG 125 N -1.09 2.92 -0.25 6.28 0.52 -1.04 -3.51 118.95 122.78 1ic7 s ARG 125 Ca 0.08 1.29 0.00 0.00 -0.52 0.00 0.00 55.73 56.58 1ic7 s ARG 125 Cb 0.07 -1.97 0.00 0.00 0.52 0.00 0.00 34.95 33.57 1ic7 s ARG 125 CO 0.18 -1.14 0.00 0.41 0.02 0.00 0.00 175.30 174.77 1ic7 n GLY 126 N -0.81 0.57 3.22 -3.53 0.00 -1.26 -5.04 105.19 98.35 1ic7 n GLY 126 Ca 0.10 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 1ic7 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ic7 s ARG 128 N -0.61 4.36 0.00 0.00 1.81 -1.26 -5.13 118.95 118.11 1ic7 s ARG 128 Ca 0.08 0.93 0.25 0.00 -1.72 0.00 0.00 55.73 55.27 1ic7 s ARG 128 Cb -0.08 -3.51 0.41 0.00 -0.45 0.00 0.00 34.95 31.32 1ic7 s ARG 128 CO -0.00 -0.13 1.38 1.28 -0.68 0.00 0.00 175.30 177.15