#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i4z n PHE 2 N 0.00 2.57 -2.32 1.61 3.72 -1.26 -4.92 117.46 116.85 1i4z n PHE 2 Ca 0.00 0.03 -0.43 0.00 -0.05 0.00 0.00 57.45 57.00 1i4z n PHE 2 Cb 0.00 -2.66 -0.02 0.00 -0.94 0.00 0.00 39.48 35.86 1i4z n PHE 2 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1i4z s PRO 3 N 1.82 3.87 -0.49 -1.08 0.04 -1.26 -4.97 135.00 132.93 1i4z s PRO 3 Ca 0.79 1.36 -0.28 0.00 0.04 0.00 0.00 61.00 62.92 1i4z s PRO 3 Cb -0.55 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.06 1i4z s PRO 3 CO 0.37 -1.19 1.52 0.42 0.04 0.00 0.00 177.00 178.16 1i4z s ILE 4 N 4.66 3.72 0.68 0.56 -1.09 -1.26 -4.97 121.20 123.51 1i4z s ILE 4 Ca 0.61 0.66 -0.17 0.00 -2.23 0.00 0.00 60.65 59.52 1i4z s ILE 4 Cb -0.19 -4.20 0.01 0.00 -1.58 0.00 0.00 42.46 36.50 1i4z s ILE 4 CO 0.25 -0.91 1.28 -2.16 -1.23 0.00 0.00 174.94 172.17 1i4z s PRO 5 N 5.55 2.36 -0.15 2.79 0.04 -1.26 -5.00 135.00 139.33 1i4z s PRO 5 Ca 0.61 2.01 -0.04 0.00 0.04 0.00 0.00 61.00 63.62 1i4z s PRO 5 Cb -0.13 -1.83 0.07 0.00 0.04 0.00 0.00 34.50 32.64 1i4z s PRO 5 CO 0.28 -1.73 0.16 0.34 0.04 0.00 0.00 177.00 176.09 1i4z s ASP 6 N -1.53 1.40 0.50 6.66 -1.08 -1.26 -2.92 116.67 118.44 1i4z s ASP 6 Ca 0.81 -0.12 -0.21 0.00 -0.52 0.00 0.00 52.55 52.51 1i4z s ASP 6 Cb -0.36 0.16 -0.06 0.00 -1.46 0.00 0.00 42.92 41.20 1i4z s ASP 6 CO 0.42 -0.30 1.18 -2.16 0.52 0.00 0.00 175.17 174.83 1i4z s PRO 7 N 2.26 3.51 -0.94 4.34 0.04 -1.26 -5.02 135.00 137.93 1i4z s PRO 7 Ca 0.04 1.78 -0.26 0.00 0.04 0.00 0.00 61.00 62.60 1i4z s PRO 7 Cb -0.14 -2.23 -0.15 0.00 0.04 0.00 0.00 34.50 32.01 1i4z s PRO 7 CO -0.09 -0.76 2.21 -0.47 0.04 0.00 0.00 177.00 177.94 1i4z s TYR 8 N -1.59 1.32 -0.04 0.56 6.14 -1.15 -4.82 117.35 117.77 1i4z s TYR 8 Ca 0.68 1.81 0.03 0.00 0.64 0.00 0.00 57.07 60.23 1i4z s TYR 8 Cb -0.29 -3.52 0.00 0.00 0.42 0.00 0.00 41.96 38.58 1i4z s TYR 8 CO 0.33 -1.26 -0.11 0.08 0.64 0.00 0.00 175.55 175.23 1i4z s VAL 9 N 14.66 1.00 0.23 3.14 1.01 -1.26 -4.60 120.40 134.57 1i4z s VAL 9 Ca 0.84 -0.46 -0.31 0.00 0.00 0.00 0.00 61.98 62.05 1i4z s VAL 9 Cb -0.08 -0.89 -0.10 0.00 0.00 0.00 0.00 36.38 35.30 1i4z s VAL 9 CO 0.11 0.31 1.53 0.86 0.00 0.00 0.00 175.10 177.91 1i4z s TRP 10 N 0.29 2.97 0.23 5.22 -0.00 -1.26 -4.93 118.94 121.45 1i4z s TRP 10 Ca -0.06 0.80 0.09 0.00 -0.00 0.00 0.00 56.10 56.93 1i4z s TRP 10 Cb -0.11 -3.93 -0.05 0.00 -0.00 0.00 0.00 33.47 29.38 1i4z s TRP 10 CO 0.01 -3.21 -0.16 0.16 -0.00 0.00 0.00 176.95 173.76 1i4z s ASP 11 N 0.69 2.92 0.61 5.86 1.47 -1.26 -5.04 116.67 121.93 1i4z s ASP 11 Ca 0.65 -1.03 0.26 0.00 1.18 0.00 0.00 52.55 53.60 1i4z s ASP 11 Cb -0.44 -0.19 1.21 0.00 -0.34 0.00 0.00 42.92 43.16 1i4z s ASP 11 CO 0.40 -0.11 1.65 -0.65 0.68 0.00 0.00 175.17 177.14 1i4z h PRO 12 N 2.45 0.00 0.00 2.11 0.11 -2.02 -1.51 132.00 133.14 1i4z h PRO 12 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1i4z h PRO 12 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1i4z h PRO 12 CO 0.62 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.28 1i4z n SER 13 N -3.33 0.00 -0.79 -2.05 3.41 -1.26 -1.46 113.62 108.14 1i4z n SER 13 Ca 0.10 0.18 0.12 0.00 -0.26 0.00 0.00 58.87 59.00 1i4z n SER 13 Cb 0.89 -0.31 0.10 0.00 -0.26 0.00 0.00 64.21 64.63 1i4z n SER 13 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1i4z n PHE 14 N -1.31 0.00 -1.65 7.33 3.01 -0.57 -5.01 117.46 119.26 1i4z n PHE 14 Ca 0.05 0.00 -0.49 0.00 1.01 0.00 0.00 57.45 58.02 1i4z n PHE 14 Cb 0.09 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.51 1i4z n PHE 14 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1i4z n ARG 15 N 0.87 1.84 -0.01 -1.08 1.74 -0.54 -4.86 116.66 114.62 1i4z n ARG 15 Ca 0.13 0.67 0.11 0.00 -0.77 0.00 0.00 57.85 57.98 1i4z n ARG 15 Cb 0.55 -2.41 -0.15 0.00 -1.02 0.00 0.00 32.46 29.43 1i4z n ARG 15 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1i4z n THR 16 N 3.55 0.00 -0.91 0.55 -2.24 -1.26 -4.97 114.28 109.00 1i4z n THR 16 Ca 0.19 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1i4z n THR 16 Cb 0.25 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 1i4z n THR 16 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1i4z n PHE 17 N -1.97 0.00 -3.60 4.78 3.72 -1.26 -4.79 117.46 114.34 1i4z n PHE 17 Ca -0.01 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.01 1i4z n PHE 17 Cb 0.48 -0.03 -0.07 0.00 -0.94 0.00 0.00 39.48 38.93 1i4z n PHE 17 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1i4z s TYR 18 N -2.00 3.71 0.17 1.38 2.02 -1.26 -4.99 117.35 116.39 1i4z s TYR 18 Ca 0.00 -2.74 -0.01 0.00 -0.37 0.00 0.00 57.07 53.95 1i4z s TYR 18 Cb 0.00 -3.35 0.37 0.00 -0.40 0.00 0.00 41.96 38.58 1i4z s TYR 18 CO 0.00 -0.83 0.90 0.45 -1.57 0.00 0.00 175.55 174.50 1i4z n SER 19 N 3.02 -0.12 -0.18 2.29 2.88 -1.26 0.54 113.62 120.79 1i4z n SER 19 Ca 0.15 0.98 -0.09 0.00 -1.33 0.00 0.00 58.87 58.59 1i4z n SER 19 Cb 0.39 -0.33 0.05 0.00 -0.75 0.00 0.00 64.21 63.56 1i4z n SER 19 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 1i4z h ILE 20 N 0.00 1.26 -0.13 2.46 6.09 -1.99 -1.54 117.51 123.66 1i4z h ILE 20 Ca 0.32 -1.18 -0.10 0.00 -1.37 0.00 0.00 64.86 62.53 1i4z h ILE 20 Cb 0.60 0.88 -0.01 0.00 0.47 0.00 0.00 36.82 38.75 1i4z h ILE 20 CO -0.56 0.42 -0.35 0.40 -3.07 0.00 0.00 178.15 174.99 1i4z h ILE 21 N 0.91 1.29 -0.01 2.19 2.04 -0.33 -2.24 117.51 121.36 1i4z h ILE 21 Ca 0.16 -1.38 -0.22 0.00 1.00 0.00 0.00 64.86 64.41 1i4z h ILE 21 Cb 0.59 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 1i4z h ILE 21 CO 0.04 0.42 -0.91 0.44 0.00 0.00 0.00 178.15 178.14 1i4z h ASP 22 N 0.23 0.52 -0.42 1.72 3.32 -0.93 -1.86 116.42 119.01 1i4z h ASP 22 Ca 0.03 -0.41 -0.10 0.00 0.02 0.00 0.00 57.03 56.57 1i4z h ASP 22 Cb 0.73 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1i4z h ASP 22 CO 0.06 1.20 -0.11 0.44 -1.72 0.00 0.00 179.24 179.11 1i4z h ASP 23 N 0.24 0.87 0.54 6.45 3.45 -1.16 -0.73 116.42 126.08 1i4z h ASP 23 Ca -0.07 -0.27 -0.09 0.00 0.43 0.00 0.00 57.03 57.03 1i4z h ASP 23 Cb 1.53 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 40.06 1i4z h ASP 23 CO 0.16 0.99 -0.45 -0.33 -1.57 0.00 0.00 179.24 178.04 1i4z h GLU 24 N 0.79 0.00 0.00 3.56 5.08 -1.35 -2.58 114.58 120.08 1i4z h GLU 24 Ca 0.13 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1i4z h GLU 24 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1i4z h GLU 24 CO 0.04 0.45 -0.30 0.45 -1.00 0.00 0.00 179.01 178.65 1i4z h HIS 25 N 0.00 0.00 -0.03 4.33 3.86 -0.61 -2.01 115.15 120.69 1i4z h HIS 25 Ca -0.00 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.95 1i4z h HIS 25 Cb 0.84 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.32 1i4z h HIS 25 CO 0.00 0.30 -0.98 0.87 0.86 0.00 0.00 177.93 178.98 1i4z h LYS 26 N 0.00 0.68 0.00 2.45 1.57 -0.77 -2.90 116.57 117.60 1i4z h LYS 26 Ca -0.00 -0.69 -0.14 0.00 -1.87 0.00 0.00 60.65 57.94 1i4z h LYS 26 Cb 0.89 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 1i4z h LYS 26 CO 0.04 1.28 -0.68 1.79 -0.57 0.00 0.00 179.45 181.31 1i4z h THR 27 N 0.40 1.46 0.00 -0.16 1.35 -1.42 -2.89 112.91 111.65 1i4z h THR 27 Ca -0.11 -2.35 -0.06 0.00 -0.55 0.00 0.00 66.41 63.34 1i4z h THR 27 Cb 1.63 2.28 -0.01 0.00 -1.73 0.00 0.00 68.15 70.32 1i4z h THR 27 CO 0.19 0.67 -0.27 0.25 -0.25 0.00 0.00 175.52 176.10 1i4z h LEU 28 N 0.00 0.00 -0.17 3.87 6.46 -1.37 -2.62 115.31 121.47 1i4z h LEU 28 Ca -0.01 0.00 -0.22 0.00 -0.12 0.00 0.00 57.88 57.53 1i4z h LEU 28 Cb 1.22 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 41.16 1i4z h LEU 28 CO 0.09 0.27 -0.78 -0.26 -0.62 0.00 0.00 178.44 177.14 1i4z h PHE 29 N 0.00 1.05 -0.32 1.25 -1.00 -1.45 -3.05 116.94 113.42 1i4z h PHE 29 Ca -0.00 -0.47 -0.00 0.00 2.81 0.00 0.00 57.97 60.31 1i4z h PHE 29 Cb 0.98 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 40.36 1i4z h PHE 29 CO 0.00 1.30 0.20 -0.97 -1.61 0.00 0.00 178.31 177.23 1i4z h ASN 30 N 0.53 0.39 -0.63 2.17 -1.24 -1.32 -0.10 115.58 115.38 1i4z h ASN 30 Ca -0.05 -0.04 0.03 0.00 0.71 0.00 0.00 56.30 56.95 1i4z h ASN 30 Cb 1.41 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 40.32 1i4z h ASN 30 CO 0.16 0.32 0.38 1.23 -1.29 0.00 0.00 177.43 178.22 1i4z h GLY 31 N 0.42 0.90 1.10 1.57 0.00 -1.49 -2.00 103.07 103.57 1i4z h GLY 31 Ca 0.12 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 47.04 1i4z h GLY 31 CO -0.02 0.23 -0.17 -2.22 0.00 0.00 0.00 176.54 174.36 1i4z h ILE 32 N 0.74 1.27 -0.89 2.60 2.04 -1.39 -1.14 117.51 120.74 1i4z h ILE 32 Ca 0.26 -1.33 0.14 0.00 1.00 0.00 0.00 64.86 64.92 1i4z h ILE 32 Cb 0.05 1.07 -0.09 0.00 -0.74 0.00 0.00 36.82 37.11 1i4z h ILE 32 CO -0.12 0.46 0.50 0.15 0.00 0.00 0.00 178.15 179.15 1i4z h PHE 33 N 0.87 0.90 0.11 1.37 3.57 -0.59 -0.22 116.94 122.95 1i4z h PHE 33 Ca 0.12 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.43 1i4z h PHE 33 Cb 0.74 -0.27 0.02 0.00 2.79 0.00 0.00 35.95 39.24 1i4z h PHE 33 CO 0.05 0.28 -0.94 0.45 -2.23 0.00 0.00 178.31 175.92 1i4z h HIS 34 N 0.75 0.73 -0.41 0.41 3.86 -1.09 -3.16 115.15 116.24 1i4z h HIS 34 Ca 0.47 -0.48 0.12 0.00 -1.16 0.00 0.00 60.37 59.32 1i4z h HIS 34 Cb 0.59 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.99 1i4z h HIS 34 CO -0.06 1.34 0.30 1.25 0.86 0.00 0.00 177.93 181.62 1i4z h LEU 35 N -0.09 0.00 -0.11 2.43 7.12 -0.77 0.23 115.31 124.13 1i4z h LEU 35 Ca -0.15 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.83 1i4z h LEU 35 Cb 1.69 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.81 1i4z h LEU 35 CO 0.18 0.00 -0.05 0.00 -0.13 0.00 0.00 178.44 178.44 1i4z h ALA 36 N 1.79 0.15 -0.24 1.25 0.00 -1.06 -2.58 119.26 118.57 1i4z h ALA 36 Ca 0.20 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1i4z h ALA 36 Cb 0.79 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1i4z h ALA 36 CO -0.00 -0.07 -0.27 0.82 0.00 0.00 0.00 179.25 179.73 1i4z h ILE 37 N -0.13 1.27 -1.42 0.00 2.04 -1.10 -3.41 117.51 114.76 1i4z h ILE 37 Ca 0.02 -1.29 -0.08 0.00 1.00 0.00 0.00 64.86 64.51 1i4z h ILE 37 Cb 0.51 1.38 -0.25 0.00 -0.74 0.00 0.00 36.82 37.71 1i4z h ILE 37 CO 0.02 0.41 -0.44 -0.62 0.00 0.00 0.00 178.15 177.51 1i4z s ASP 38 N -6.82 -0.51 0.00 1.72 -1.08 -0.09 -5.03 116.67 104.87 1i4z s ASP 38 Ca -0.07 0.07 0.00 0.00 -0.52 0.00 0.00 52.55 52.03 1i4z s ASP 38 Cb 0.14 1.55 0.00 0.00 -1.46 0.00 0.00 42.92 43.14 1i4z s ASP 38 CO 0.79 -0.32 0.05 -0.67 0.52 0.00 0.00 175.17 175.54 1i4z n ASP 39 N 5.39 0.00 -4.71 -0.34 2.03 -0.98 -4.39 116.55 113.55 1i4z n ASP 39 Ca 0.01 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.99 1i4z n ASP 39 Cb 0.51 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 41.03 1i4z n ASP 39 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1i4z s ASN 40 N -1.83 3.76 0.33 1.67 6.03 -1.26 -4.71 114.94 118.93 1i4z s ASN 40 Ca 0.00 2.31 0.10 0.00 -1.03 0.00 0.00 52.86 54.24 1i4z s ASN 40 Cb 0.00 -2.58 0.89 0.00 -3.03 0.00 0.00 41.25 36.53 1i4z s ASN 40 CO 0.00 -2.55 1.74 0.00 -2.03 0.00 0.00 177.10 174.26 1i4z h ALA 41 N -0.83 1.83 0.00 3.54 0.00 -1.98 0.11 119.26 121.94 1i4z h ALA 41 Ca -0.46 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1i4z h ALA 41 Cb 1.29 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1i4z h ALA 41 CO 0.47 -0.28 -0.43 -0.44 0.00 0.00 0.00 179.25 178.56 1i4z h ASP 42 N 0.59 0.00 0.33 0.00 3.45 -1.94 0.11 116.42 118.95 1i4z h ASP 42 Ca 0.63 0.00 -0.33 0.00 0.43 0.00 0.00 57.03 57.76 1i4z h ASP 42 Cb 1.21 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.98 1i4z h ASP 42 CO -0.44 0.43 -1.68 0.78 -1.57 0.00 0.00 179.24 176.77 1i4z h ASN 43 N 0.00 0.44 -0.45 6.45 2.35 -1.60 -2.94 115.58 119.83 1i4z h ASN 43 Ca -0.00 -0.69 -0.07 0.00 -0.55 0.00 0.00 56.30 54.99 1i4z h ASN 43 Cb 1.10 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 39.31 1i4z h ASN 43 CO 0.06 1.58 -0.01 0.25 -1.65 0.00 0.00 177.43 177.66 1i4z h LEU 44 N 0.08 0.79 0.33 1.61 5.85 -1.02 -1.93 115.31 121.01 1i4z h LEU 44 Ca -0.30 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.10 1i4z h LEU 44 Cb 2.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.86 1i4z h LEU 44 CO 0.15 0.91 -0.22 1.23 -0.34 0.00 0.00 178.44 180.17 1i4z h GLY 45 N 0.65 -0.56 -0.01 3.75 0.00 -0.88 0.21 103.07 106.22 1i4z h GLY 45 Ca 0.13 0.25 0.13 0.00 0.00 0.00 0.00 47.33 47.84 1i4z h GLY 45 CO 0.02 -0.22 0.08 -2.09 0.00 0.00 0.00 176.54 174.33 1i4z h GLU 46 N -0.54 0.19 -0.19 4.80 4.57 -1.44 0.56 114.58 122.52 1i4z h GLU 46 Ca -0.03 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.10 1i4z h GLU 46 Cb 0.46 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 1i4z h GLU 46 CO 0.02 0.12 -0.04 1.25 -1.18 0.00 0.00 179.01 179.18 1i4z h LEU 47 N 0.19 0.36 -1.41 1.64 5.85 -1.09 -2.40 115.31 118.47 1i4z h LEU 47 Ca 0.35 -0.36 0.11 0.00 0.84 0.00 0.00 57.88 58.82 1i4z h LEU 47 Cb 0.56 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1i4z h LEU 47 CO -0.49 0.63 0.51 -0.09 -0.34 0.00 0.00 178.44 178.66 1i4z h ARG 48 N 0.08 0.62 0.34 1.25 9.65 0.57 -0.10 114.38 126.80 1i4z h ARG 48 Ca 0.05 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1i4z h ARG 48 Cb 0.47 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1i4z h ARG 48 CO 0.02 0.41 -0.17 -0.09 2.80 0.00 0.00 179.97 182.94 1i4z h ARG 49 N 0.64 -0.45 -0.55 0.20 2.43 -0.71 -1.59 114.38 114.36 1i4z h ARG 49 Ca 0.37 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.63 1i4z h ARG 49 Cb 0.57 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1i4z h ARG 49 CO -0.14 -0.30 0.37 0.00 -1.51 0.00 0.00 179.97 178.39 1i4z h THR 51 N 0.52 0.65 -0.21 0.00 2.02 -1.04 0.98 112.91 115.83 1i4z h THR 51 Ca 0.24 -0.22 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 1i4z h THR 51 Cb 0.28 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1i4z h THR 51 CO -0.07 0.04 -0.19 1.23 0.37 0.00 0.00 175.52 176.91 1i4z h GLY 52 N -0.61 0.39 0.72 2.16 0.00 -0.97 0.77 103.07 105.53 1i4z h GLY 52 Ca -0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 1i4z h GLY 52 CO 0.08 0.26 -0.04 0.07 0.00 0.00 0.00 176.54 176.91 1i4z h LYS 53 N 0.33 -0.11 -0.86 4.80 2.10 -1.12 -1.93 116.57 119.77 1i4z h LYS 53 Ca 0.06 0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.70 1i4z h LYS 53 Cb 0.52 0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 31.84 1i4z h LYS 53 CO 0.03 0.17 0.47 1.25 -2.00 0.00 0.00 179.45 179.38 1i4z h HIS 54 N -0.40 1.18 -0.49 0.07 6.17 -0.59 0.25 115.15 121.33 1i4z h HIS 54 Ca -0.01 -0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.01 1i4z h HIS 54 Cb 0.34 -0.38 -0.02 0.00 2.52 0.00 0.00 27.41 29.87 1i4z h HIS 54 CO 0.02 0.81 0.20 0.74 0.71 0.00 0.00 177.93 180.41 1i4z h PHE 55 N 1.20 0.74 -0.26 5.26 0.04 -0.77 -0.60 116.94 122.55 1i4z h PHE 55 Ca 0.30 -0.06 -0.16 0.00 2.80 0.00 0.00 57.97 60.85 1i4z h PHE 55 Cb 0.02 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 37.95 1i4z h PHE 55 CO 0.01 0.62 -0.48 1.25 -0.60 0.00 0.00 178.31 179.11 1i4z h LEU 56 N 0.65 0.87 -1.33 1.54 5.85 -0.95 -1.11 115.31 120.83 1i4z h LEU 56 Ca 0.16 -0.53 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 1i4z h LEU 56 Cb 0.19 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1i4z h LEU 56 CO -0.01 1.24 0.19 0.78 -0.34 0.00 0.00 178.44 180.30 1i4z h ASN 57 N 0.53 0.58 1.16 1.25 -0.26 -0.40 0.11 115.58 118.55 1i4z h ASN 57 Ca 0.01 -0.06 -0.17 0.00 -0.56 0.00 0.00 56.30 55.53 1i4z h ASN 57 Cb 1.08 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 38.17 1i4z h ASN 57 CO 0.11 0.52 -0.86 -0.08 -1.06 0.00 0.00 177.43 176.06 1i4z h GLU 58 N 0.65 0.00 -0.03 0.81 4.81 -1.00 -2.18 114.58 117.64 1i4z h GLU 58 Ca 0.16 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.23 1i4z h GLU 58 Cb 0.11 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1i4z h GLU 58 CO -0.02 0.73 -0.72 1.96 -0.73 0.00 0.00 179.01 180.23 1i4z h GLN 59 N 0.00 0.15 0.00 1.92 4.20 -0.62 -1.36 115.11 119.41 1i4z h GLN 59 Ca -0.03 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.46 1i4z h GLN 59 Cb 1.61 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.41 1i4z h GLN 59 CO 0.10 0.81 -0.39 0.28 -0.67 0.00 0.00 178.83 178.95 1i4z h VAL 60 N 0.10 0.79 0.14 -0.54 2.07 -0.93 -0.89 116.25 116.99 1i4z h VAL 60 Ca -0.02 -1.72 -0.28 0.00 0.82 0.00 0.00 66.70 65.50 1i4z h VAL 60 Cb 1.27 2.10 0.01 0.00 -1.52 0.00 0.00 31.29 33.15 1i4z h VAL 60 CO 0.11 0.38 -1.26 -0.07 0.02 0.00 0.00 177.57 176.75 1i4z h LEU 61 N 0.00 0.51 -0.01 2.57 4.07 -1.20 -2.97 115.31 118.28 1i4z h LEU 61 Ca -0.00 -0.53 -0.00 0.00 0.08 0.00 0.00 57.88 57.42 1i4z h LEU 61 Cb 1.07 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.65 1i4z h LEU 61 CO 0.05 1.41 -0.01 0.24 -1.08 0.00 0.00 178.44 179.05 1i4z h MET 62 N 0.10 0.02 0.00 1.13 2.07 -1.12 -3.15 114.93 113.98 1i4z h MET 62 Ca -0.15 -0.01 -0.02 0.00 -2.07 0.00 0.00 59.70 57.45 1i4z h MET 62 Cb 1.97 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 31.70 1i4z h MET 62 CO 0.21 0.49 -0.08 1.96 1.07 0.00 0.00 176.91 180.56 1i4z h GLN 63 N -0.44 0.00 -0.12 1.72 4.20 -1.29 -0.93 115.11 118.25 1i4z h GLN 63 Ca 0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.74 1i4z h GLN 63 Cb 0.48 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 1i4z h GLN 63 CO 0.00 0.08 -0.05 0.00 -0.67 0.00 0.00 178.83 178.20 1i4z h ALA 64 N 1.92 0.06 -0.38 3.87 0.00 -1.48 -2.26 119.26 120.99 1i4z h ALA 64 Ca -0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1i4z h ALA 64 Cb 0.22 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1i4z h ALA 64 CO 0.01 -0.50 0.02 0.43 0.00 0.00 0.00 179.25 179.21 1i4z n SER 65 N -5.18 4.06 -4.28 0.00 7.64 -1.02 -4.93 113.62 109.91 1i4z n SER 65 Ca -0.04 -2.62 -0.33 0.00 1.01 0.00 0.00 58.87 56.89 1i4z n SER 65 Cb 0.11 -0.63 -0.07 0.00 -1.01 0.00 0.00 64.21 62.61 1i4z n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i4z n GLN 66 N 0.37 -1.62 -1.49 1.43 6.02 -0.85 -4.78 117.38 116.44 1i4z n GLN 66 Ca 0.19 0.20 -0.51 0.00 -0.01 0.00 0.00 57.00 56.86 1i4z n GLN 66 Cb 0.88 -4.19 -0.05 0.00 1.02 0.00 0.00 30.24 27.91 1i4z n GLN 66 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 1i4z n TYR 67 N -4.42 0.46 -0.17 1.08 -0.00 -0.38 -4.90 117.16 108.83 1i4z n TYR 67 Ca -0.18 0.89 -0.09 0.00 -0.00 0.00 0.00 57.90 58.51 1i4z n TYR 67 Cb 0.62 -2.11 0.00 0.00 -0.00 0.00 0.00 39.34 37.85 1i4z n TYR 67 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.86 177.23 1i4z h GLN 68 N 2.31 0.80 -1.89 2.98 4.15 -1.91 -3.22 115.11 118.34 1i4z h GLN 68 Ca -0.40 -0.22 -0.73 0.00 0.77 0.00 0.00 58.65 58.07 1i4z h GLN 68 Cb 1.40 -0.09 -0.31 0.00 0.21 0.00 0.00 27.48 28.70 1i4z h GLN 68 CO 0.63 0.82 0.63 1.19 -1.93 0.00 0.00 178.83 180.17 1i4z n PHE 69 N -4.42 3.09 -0.06 3.99 3.01 -1.26 -4.65 117.46 117.16 1i4z n PHE 69 Ca 0.01 -2.53 -0.15 0.00 1.01 0.00 0.00 57.45 55.79 1i4z n PHE 69 Cb 0.26 -0.92 -0.06 0.00 -0.01 0.00 0.00 39.48 38.75 1i4z n PHE 69 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 1i4z h TYR 70 N 2.93 0.86 0.77 1.38 5.03 -1.94 -3.24 116.97 122.75 1i4z h TYR 70 Ca 0.50 -0.32 -0.03 0.00 2.58 0.00 0.00 58.73 61.46 1i4z h TYR 70 Cb 0.24 -0.16 -0.00 0.00 1.55 0.00 0.00 36.73 38.36 1i4z h TYR 70 CO 1.10 1.10 -0.46 -0.44 -1.32 0.00 0.00 178.16 178.13 1i4z h ASP 71 N 0.38 -1.17 -0.75 -2.11 3.32 -1.89 -0.16 116.42 114.05 1i4z h ASP 71 Ca 0.00 0.06 0.14 0.00 0.02 0.00 0.00 57.03 57.26 1i4z h ASP 71 Cb 1.06 0.34 -0.05 0.00 0.22 0.00 0.00 39.33 40.90 1i4z h ASP 71 CO 0.10 -0.72 0.50 1.05 -1.72 0.00 0.00 179.24 178.45 1i4z h GLU 72 N -1.15 0.42 0.00 3.56 4.11 -1.94 0.16 114.58 119.74 1i4z h GLU 72 Ca -0.10 -0.03 -0.12 0.00 0.07 0.00 0.00 59.36 59.18 1i4z h GLU 72 Cb 0.92 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1i4z h GLU 72 CO 0.11 0.28 -0.58 1.25 0.07 0.00 0.00 179.01 180.14 1i4z h HIS 73 N 0.43 0.00 -0.00 2.06 2.76 -1.52 -1.82 115.15 117.07 1i4z h HIS 73 Ca 0.37 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.53 1i4z h HIS 73 Cb 0.82 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.78 1i4z h HIS 73 CO -0.00 0.58 -0.02 -0.22 -1.30 0.00 0.00 177.93 176.96 1i4z h LYS 74 N 0.00 0.02 -0.51 5.26 3.64 0.11 -2.83 116.57 122.26 1i4z h LYS 74 Ca -0.01 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.46 1i4z h LYS 74 Cb 1.16 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.88 1i4z h LYS 74 CO 0.08 0.78 -0.16 0.87 -2.27 0.00 0.00 179.45 178.75 1i4z h LYS 75 N -0.73 -0.03 -0.24 1.90 1.79 -0.96 0.85 116.57 119.14 1i4z h LYS 75 Ca -0.00 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.53 1i4z h LYS 75 Cb 0.79 0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 31.37 1i4z h LYS 75 CO 0.00 -0.02 -0.26 0.93 -1.08 0.00 0.00 179.45 179.02 1i4z h GLU 76 N -0.03 -0.26 -0.54 3.15 4.39 -1.40 -1.17 114.58 118.73 1i4z h GLU 76 Ca 0.25 0.02 0.06 0.00 0.34 0.00 0.00 59.36 60.02 1i4z h GLU 76 Cb 0.41 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.07 1i4z h GLU 76 CO -0.55 -0.17 0.26 0.45 -1.16 0.00 0.00 179.01 177.84 1i4z h HIS 77 N -0.27 0.47 -0.53 4.33 3.86 -0.67 -1.57 115.15 120.77 1i4z h HIS 77 Ca 0.14 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1i4z h HIS 77 Cb 0.48 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.79 1i4z h HIS 77 CO -0.41 0.21 0.33 0.93 0.86 0.00 0.00 177.93 179.84 1i4z h GLU 78 N 0.49 0.71 -0.27 2.45 5.08 -0.41 -1.67 114.58 120.96 1i4z h GLU 78 Ca 0.24 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1i4z h GLU 78 Cb 0.19 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1i4z h GLU 78 CO -0.19 0.49 0.10 1.79 -1.00 0.00 0.00 179.01 180.21 1i4z h THR 79 N 0.72 1.18 -0.04 1.13 1.35 -0.22 -1.12 112.91 115.91 1i4z h THR 79 Ca 0.19 -0.54 -0.11 0.00 -0.55 0.00 0.00 66.41 65.40 1i4z h THR 79 Cb -0.04 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 67.40 1i4z h THR 79 CO -0.04 0.18 -0.50 0.15 -0.25 0.00 0.00 175.52 175.07 1i4z h PHE 80 N 0.28 0.13 -0.27 4.73 3.57 -1.13 -1.93 116.94 122.32 1i4z h PHE 80 Ca 0.09 -0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.42 1i4z h PHE 80 Cb 0.19 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1i4z h PHE 80 CO -0.01 0.59 -0.35 0.82 -2.23 0.00 0.00 178.31 177.13 1i4z h ILE 81 N 0.09 1.30 -0.36 1.41 1.08 -1.17 -2.37 117.51 117.49 1i4z h ILE 81 Ca 0.00 -1.54 0.03 0.00 -0.39 0.00 0.00 64.86 62.96 1i4z h ILE 81 Cb 0.91 1.66 -0.03 0.00 -3.07 0.00 0.00 36.82 36.29 1i4z h ILE 81 CO 0.07 0.49 0.16 -0.74 -0.69 0.00 0.00 178.15 177.44 1i4z h HIS 82 N 0.44 0.30 -0.15 1.37 2.76 -1.03 0.83 115.15 119.67 1i4z h HIS 82 Ca 0.03 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.27 1i4z h HIS 82 Cb 0.93 -0.08 -0.06 0.00 1.55 0.00 0.00 27.41 29.75 1i4z h HIS 82 CO 0.08 0.15 -0.23 0.00 -1.30 0.00 0.00 177.93 176.63 1i4z h ALA 83 N 1.20 -0.18 -0.90 5.26 0.00 -1.25 0.78 119.26 124.17 1i4z h ALA 83 Ca 0.16 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1i4z h ALA 83 Cb 0.09 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1i4z h ALA 83 CO -0.13 -0.68 0.59 -0.07 0.00 0.00 0.00 179.25 178.96 1i4z h LEU 84 N -0.28 0.91 -0.04 0.00 3.38 -0.86 -0.71 115.31 117.71 1i4z h LEU 84 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1i4z h LEU 84 Cb 0.44 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1i4z h LEU 84 CO -0.32 0.60 -0.01 0.47 0.09 0.00 0.00 178.44 179.27 1i4z n ASP 85 N -4.48 0.08 -2.67 -0.43 10.43 0.23 -3.21 116.55 116.50 1i4z n ASP 85 Ca 0.13 -0.53 -0.09 0.00 2.57 0.00 0.00 54.79 56.88 1i4z n ASP 85 Cb 0.18 -0.15 0.03 0.00 1.84 0.00 0.00 41.12 43.02 1i4z n ASP 85 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1i4z n ASN 86 N -1.12 1.72 -4.67 -2.24 3.02 0.11 -5.05 115.26 107.03 1i4z n ASN 86 Ca 0.18 -2.66 -0.47 0.00 -0.03 0.00 0.00 54.58 51.60 1i4z n ASN 86 Cb 0.20 -0.51 -0.04 0.00 -0.61 0.00 0.00 39.78 38.81 1i4z n ASN 86 CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 1i4z n TRP 87 N -0.20 2.26 -0.70 3.10 -0.00 -0.41 -4.85 117.44 116.64 1i4z n TRP 87 Ca 0.11 0.20 0.07 0.00 -0.00 0.00 0.00 57.50 57.87 1i4z n TRP 87 Cb 0.81 -2.57 0.14 0.00 -0.00 0.00 0.00 31.31 29.68 1i4z n TRP 87 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 177.69 178.05 1i4z n LYS 88 N 4.44 2.24 -0.95 5.87 -0.00 -1.26 -4.97 118.16 123.52 1i4z n LYS 88 Ca 0.19 -2.33 0.00 0.00 -0.00 0.00 0.00 58.31 56.17 1i4z n LYS 88 Cb 0.28 -1.43 0.00 0.00 -0.00 0.00 0.00 35.03 33.88 1i4z n LYS 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1i4z n GLY 89 N -0.78 0.33 3.28 2.58 0.00 -1.26 -4.92 105.19 104.41 1i4z n GLY 89 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1i4z n GLY 89 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1i4z n ASP 90 N -0.36 4.37 0.23 1.61 4.64 -1.26 -4.75 116.55 121.03 1i4z n ASP 90 Ca 0.00 -2.87 0.16 0.00 -1.38 0.00 0.00 54.79 50.70 1i4z n ASP 90 Cb 0.18 -1.69 0.65 0.00 -1.04 0.00 0.00 41.12 39.21 1i4z n ASP 90 CO 0.00 0.00 0.00 1.62 -0.82 0.00 0.00 177.20 178.00 1i4z h VAL 91 N 5.04 0.00 -0.00 5.18 3.04 -1.93 -3.06 116.25 124.52 1i4z h VAL 91 Ca 0.47 -0.37 -0.02 0.00 -1.01 0.00 0.00 66.70 65.78 1i4z h VAL 91 Cb 0.79 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 1i4z h VAL 91 CO 1.61 0.00 -0.06 0.11 -1.01 0.00 0.00 177.57 178.22 1i4z h LYS 92 N 0.00 0.05 -0.35 4.17 1.57 -1.99 -2.71 116.57 117.30 1i4z h LYS 92 Ca 0.00 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1i4z h LYS 92 Cb 0.41 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 1i4z h LYS 92 CO 0.00 0.80 0.09 2.35 -0.57 0.00 0.00 179.45 182.12 1i4z h TRP 93 N -0.69 0.15 -0.43 -1.35 7.01 -1.95 -0.56 115.95 118.13 1i4z h TRP 93 Ca -0.01 0.02 0.08 0.00 2.11 0.00 0.00 58.89 61.09 1i4z h TRP 93 Cb 0.82 -0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.80 1i4z h TRP 93 CO 0.19 0.04 0.05 0.00 -2.79 0.00 0.00 178.44 175.93 1i4z h ALA 94 N 1.25 0.44 -0.63 2.65 0.00 -1.61 1.22 119.26 122.57 1i4z h ALA 94 Ca 0.17 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1i4z h ALA 94 Cb 0.17 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1i4z h ALA 94 CO -0.20 -0.35 0.30 0.87 0.00 0.00 0.00 179.25 179.87 1i4z h LYS 95 N 0.16 0.89 0.09 0.00 1.57 -1.10 -0.76 116.57 117.43 1i4z h LYS 95 Ca 0.21 -0.12 -0.23 0.00 -1.87 0.00 0.00 60.65 58.65 1i4z h LYS 95 Cb 0.29 -0.17 0.02 0.00 0.08 0.00 0.00 32.23 32.45 1i4z h LYS 95 CO -0.32 0.69 -0.94 0.66 -0.57 0.00 0.00 179.45 178.98 1i4z h SER 96 N 0.89 0.67 0.63 0.86 4.64 0.42 -3.10 113.55 118.57 1i4z h SER 96 Ca 0.22 -0.84 -0.03 0.00 -0.47 0.00 0.00 61.79 60.68 1i4z h SER 96 Cb 0.09 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1i4z h SER 96 CO -0.03 1.44 -0.38 -0.25 -0.87 0.00 0.00 176.83 176.74 1i4z h TRP 97 N -0.01 -1.02 -0.58 4.77 7.01 0.16 -2.06 115.95 124.22 1i4z h TRP 97 Ca -0.14 -0.01 0.09 0.00 2.11 0.00 0.00 58.89 60.94 1i4z h TRP 97 Cb 1.66 0.36 -0.07 0.00 -2.10 0.00 0.00 29.16 29.02 1i4z h TRP 97 CO 0.15 -0.58 0.21 -0.92 -2.79 0.00 0.00 178.44 174.50 1i4z h TYR 98 N -0.96 0.36 -0.68 2.65 3.20 -1.27 0.39 116.97 120.66 1i4z h TYR 98 Ca -0.08 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.83 1i4z h TYR 98 Cb 0.77 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.94 1i4z h TYR 98 CO -0.10 0.09 0.45 0.28 -1.64 0.00 0.00 178.16 177.24 1i4z h VAL 99 N 0.39 1.18 -0.09 1.81 2.07 -1.52 -2.41 116.25 117.67 1i4z h VAL 99 Ca 0.29 -0.33 -0.13 0.00 0.82 0.00 0.00 66.70 67.35 1i4z h VAL 99 Cb 0.35 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1i4z h VAL 99 CO -0.30 0.17 -0.52 0.78 0.02 0.00 0.00 177.57 177.73 1i4z h ASN 100 N 0.92 0.27 0.26 0.57 4.21 -0.46 -2.72 115.58 118.63 1i4z h ASN 100 Ca 0.25 -0.13 -0.01 0.00 1.21 0.00 0.00 56.30 57.61 1i4z h ASN 100 Cb -0.10 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.03 1i4z h ASN 100 CO -0.05 0.74 -0.12 -0.74 -1.29 0.00 0.00 177.43 175.96 1i4z h HIS 101 N 0.19 -0.32 0.72 1.19 2.76 0.12 -1.26 115.15 118.55 1i4z h HIS 101 Ca 0.01 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1i4z h HIS 101 Cb 0.98 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 30.04 1i4z h HIS 101 CO 0.02 -0.06 -0.48 0.82 -1.30 0.00 0.00 177.93 176.93 1i4z h ILE 102 N -0.56 0.00 0.00 6.26 2.04 -1.49 0.46 117.51 124.21 1i4z h ILE 102 Ca -0.04 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 1i4z h ILE 102 Cb 0.41 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1i4z h ILE 102 CO 0.06 0.00 -0.01 0.11 0.00 0.00 0.00 178.15 178.31 1i4z h LYS 103 N -1.14 0.00 0.00 2.37 1.57 -1.53 0.13 116.57 117.97 1i4z h LYS 103 Ca -0.10 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1i4z h LYS 103 Cb 0.92 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.23 1i4z h LYS 103 CO 0.07 0.01 -1.04 0.25 -0.57 0.00 0.00 179.45 178.18 1i4z n THR 104 N -3.33 0.03 -0.11 -0.16 -2.24 -0.48 -4.59 114.28 103.40 1i4z n THR 104 Ca -0.03 -0.02 -0.15 0.00 -2.27 0.00 0.00 64.05 61.58 1i4z n THR 104 Cb 0.11 -0.49 -0.10 0.00 -2.10 0.00 0.00 70.33 67.76 1i4z n THR 104 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1i4z n ILE 105 N -1.85 1.23 -0.00 2.28 2.08 0.14 -4.24 119.36 119.00 1i4z n ILE 105 Ca -0.01 -0.46 -0.18 0.00 0.56 0.00 0.00 62.75 62.66 1i4z n ILE 105 Cb 0.35 -1.29 -0.09 0.00 -0.75 0.00 0.00 39.64 37.86 1i4z n ILE 105 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1i4z h ASP 106 N -0.04 0.71 -0.11 4.38 3.32 -0.10 -3.16 116.42 121.42 1i4z h ASP 106 Ca -0.49 -0.70 0.03 0.00 0.02 0.00 0.00 57.03 55.90 1i4z h ASP 106 Cb 1.73 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 41.07 1i4z h ASP 106 CO -0.09 1.30 0.38 -0.26 -1.72 0.00 0.00 179.24 178.85 1i4z h PHE 107 N 0.18 0.00 -0.36 4.55 0.05 -1.24 0.16 116.94 120.27 1i4z h PHE 107 Ca -0.07 0.00 -0.14 0.00 3.82 0.00 0.00 57.97 61.58 1i4z h PHE 107 Cb 1.36 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.30 1i4z h PHE 107 CO 0.12 0.00 -0.34 0.87 -0.18 0.00 0.00 178.31 178.78 1i4z h LYS 108 N 0.00 0.82 0.00 1.51 1.57 -1.72 -3.10 116.57 115.65 1i4z h LYS 108 Ca 0.05 -0.39 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1i4z h LYS 108 Cb 0.80 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1i4z h LYS 108 CO -0.00 1.03 0.00 2.48 -0.57 0.00 0.00 179.45 182.39 1i4z n TYR 109 N -4.07 0.00 -1.71 -1.35 0.18 0.04 -4.80 117.16 105.46 1i4z n TYR 109 Ca -0.01 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.35 1i4z n TYR 109 Cb 0.51 -0.01 -0.03 0.00 -0.38 0.00 0.00 39.34 39.43 1i4z n TYR 109 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 1i4z s LYS 110 N -2.01 4.12 0.00 -3.48 1.02 -1.17 -0.86 119.74 117.36 1i4z s LYS 110 Ca 0.44 2.62 0.00 0.00 0.02 0.00 0.00 55.97 59.05 1i4z s LYS 110 Cb 0.20 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 1i4z s LYS 110 CO 0.34 -0.79 0.00 0.41 -0.92 0.00 0.00 175.35 174.39 1i4z n GLY 111 N 4.09 1.48 0.53 -3.33 0.00 -1.26 -4.85 105.19 101.84 1i4z n GLY 111 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1i4z n GLY 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i4z n LYS 112 N -2.00 1.42 0.00 1.61 5.02 -0.03 -5.26 118.16 118.91 1i4z n LYS 112 Ca 0.00 -1.50 0.00 0.00 -2.02 0.00 0.00 58.31 54.79 1i4z n LYS 112 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1i4z n LYS 112 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32