#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibk h ARG 3 N 0.00 0.96 0.09 0.00 2.43 -2.07 -3.37 114.38 112.42 1ibk h ARG 3 Ca 0.00 -0.24 -0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1ibk h ARG 3 Cb 0.00 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1ibk h ARG 3 CO 0.00 0.89 -0.04 -0.09 -1.51 0.00 0.00 179.97 179.21 1ibk h ARG 4 N 0.86 -0.12 0.00 0.20 2.43 -2.12 -3.48 114.38 112.16 1ibk h ARG 4 Ca 0.18 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1ibk h ARG 4 Cb 0.37 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1ibk h ARG 4 CO 0.00 -0.08 0.00 0.54 -1.51 0.00 0.00 179.97 178.93 1ibk n ARG 5 N -3.30 2.44 -2.53 0.20 1.74 -1.26 -5.05 116.66 108.89 1ibk n ARG 5 Ca -0.01 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.91 1ibk n ARG 5 Cb 0.05 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.51 1ibk n ARG 5 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1ibk n ARG 6 N 0.00 2.37 0.00 5.56 0.63 -1.26 -4.92 116.66 119.04 1ibk n ARG 6 Ca 0.00 -3.83 0.00 0.00 -0.92 0.00 0.00 57.85 53.10 1ibk n ARG 6 Cb 0.00 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.11 1ibk n ARG 6 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ibk n ALA 7 N -0.41 -0.58 -1.43 5.13 0.00 -1.26 -4.91 120.51 117.05 1ibk n ALA 7 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.38 1ibk n ALA 7 Cb 0.80 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.35 1ibk n ALA 7 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ibk s GLU 8 N 0.00 1.88 -0.30 0.00 8.01 -1.26 -5.01 118.70 122.03 1ibk s GLU 8 Ca 0.00 0.73 -0.13 0.00 0.01 0.00 0.00 54.97 55.59 1ibk s GLU 8 Cb 0.00 -1.89 -0.04 0.00 -4.31 0.00 0.00 34.13 27.90 1ibk s GLU 8 CO 0.00 -1.79 0.27 0.08 0.01 0.00 0.00 175.26 173.83 1ibk s VAL 9 N -3.07 5.25 -0.23 2.63 1.01 -1.26 -5.02 120.40 119.71 1ibk s VAL 9 Ca 0.61 0.17 -0.37 0.00 0.00 0.00 0.00 61.98 62.38 1ibk s VAL 9 Cb -0.16 -3.65 -0.14 0.00 0.00 0.00 0.00 36.38 32.44 1ibk s VAL 9 CO 0.55 0.13 1.86 0.54 0.00 0.00 0.00 175.10 178.18 1ibk n ARG 10 N 5.18 1.48 -3.40 2.72 1.74 -1.26 -4.93 116.66 118.18 1ibk n ARG 10 Ca -0.12 0.53 -0.35 0.00 -0.77 0.00 0.00 57.85 57.14 1ibk n ARG 10 Cb 0.51 -2.34 -0.06 0.00 -1.02 0.00 0.00 32.46 29.56 1ibk n ARG 10 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ibk s GLN 11 N 4.16 3.92 0.17 5.56 1.11 -1.26 -5.08 119.66 128.24 1ibk s GLN 11 Ca 0.98 0.41 0.08 0.00 0.01 0.00 0.00 55.36 56.85 1ibk s GLN 11 Cb -0.92 -2.90 -0.04 0.00 -1.01 0.00 0.00 33.01 28.14 1ibk s GLN 11 CO 0.59 0.47 -0.17 -0.51 0.01 0.00 0.00 175.29 175.67 1ibk s LEU 12 N -2.08 2.45 -0.03 2.90 1.02 -1.26 -5.10 118.68 116.60 1ibk s LEU 12 Ca 0.38 -0.88 -0.30 0.00 0.02 0.00 0.00 54.13 53.35 1ibk s LEU 12 Cb -0.14 -0.78 -0.06 0.00 0.02 0.00 0.00 46.19 45.23 1ibk s LEU 12 CO 0.19 -0.07 1.60 -1.10 0.02 0.00 0.00 176.35 176.99 1ibk s GLN 13 N -2.92 4.20 0.99 1.70 -1.52 -1.26 -4.84 119.66 116.01 1ibk s GLN 13 Ca 0.16 2.16 -0.16 0.00 -1.95 0.00 0.00 55.36 55.58 1ibk s GLN 13 Cb -0.05 -3.83 0.09 0.00 -0.22 0.00 0.00 33.01 28.99 1ibk s GLN 13 CO 0.06 -0.77 -0.06 -0.35 -0.25 0.00 0.00 175.29 173.92 1ibk n PRO 14 N 6.53 -1.59 -1.87 2.91 -0.04 -1.26 -4.79 135.00 134.88 1ibk n PRO 14 Ca 0.16 -0.46 -0.42 0.00 -0.04 0.00 0.00 63.50 62.74 1ibk n PRO 14 Cb 0.43 -1.42 -0.02 0.00 -0.04 0.00 0.00 33.50 32.44 1ibk n PRO 14 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1ibk s ASP 15 N -1.72 6.51 0.00 3.54 2.15 -0.32 -4.69 116.67 122.14 1ibk s ASP 15 Ca 0.38 2.76 0.09 0.00 0.43 0.00 0.00 52.55 56.21 1ibk s ASP 15 Cb -0.04 -2.61 0.44 0.00 -0.30 0.00 0.00 42.92 40.41 1ibk s ASP 15 CO 0.43 -0.85 1.19 0.18 -0.17 0.00 0.00 175.17 175.95 1ibk n LEU 16 N 3.15 0.00 0.03 -1.34 7.99 -1.26 -0.25 117.00 125.32 1ibk n LEU 16 Ca 0.11 0.33 0.00 0.00 -0.01 0.00 0.00 56.01 56.44 1ibk n LEU 16 Cb 0.38 -0.33 0.00 0.00 -0.11 0.00 0.00 43.42 43.36 1ibk n LEU 16 CO 0.62 -0.23 -0.24 0.52 -1.51 0.00 0.00 177.39 176.56 1ibk n VAL 17 N -1.33 0.42 0.71 4.08 0.31 -1.26 -4.79 118.33 116.47 1ibk n VAL 17 Ca 0.04 0.14 0.11 0.00 -0.01 0.00 0.00 64.34 64.62 1ibk n VAL 17 Cb 0.08 -1.34 0.09 0.00 -0.91 0.00 0.00 33.84 31.76 1ibk n VAL 17 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1ibk n TYR 18 N -3.15 0.23 -2.23 3.52 4.02 -1.25 -4.95 117.16 113.35 1ibk n TYR 18 Ca 0.00 0.07 -0.14 0.00 -0.01 0.00 0.00 57.90 57.81 1ibk n TYR 18 Cb 0.24 -0.39 -0.01 0.00 -0.02 0.00 0.00 39.34 39.16 1ibk n TYR 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ibk n GLY 19 N 1.41 -0.13 3.41 2.72 0.00 0.65 -4.83 105.19 108.41 1ibk n GLY 19 Ca 0.03 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 1ibk n GLY 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ibk s ASP 20 N -2.38 4.28 0.18 1.61 -1.08 -1.26 -4.05 116.67 113.98 1ibk s ASP 20 Ca 0.00 -0.27 -0.13 0.00 -0.52 0.00 0.00 52.55 51.64 1ibk s ASP 20 Cb 0.00 -1.67 0.14 0.00 -1.46 0.00 0.00 42.92 39.93 1ibk s ASP 20 CO 0.00 0.15 1.80 -0.37 0.52 0.00 0.00 175.17 177.27 1ibk h VAL 21 N 5.34 0.99 -0.91 1.11 -1.51 -1.87 -0.66 116.25 118.74 1ibk h VAL 21 Ca -0.28 -0.20 0.15 0.00 -1.23 0.00 0.00 66.70 65.14 1ibk h VAL 21 Cb 1.20 0.37 -0.07 0.00 -2.13 0.00 0.00 31.29 30.65 1ibk h VAL 21 CO 0.58 0.11 0.59 0.25 -1.23 0.00 0.00 177.57 177.86 1ibk h LEU 22 N 0.58 0.66 -1.46 4.19 5.85 -1.95 0.71 115.31 123.88 1ibk h LEU 22 Ca 0.23 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1ibk h LEU 22 Cb 0.10 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1ibk h LEU 22 CO -0.14 0.32 0.00 0.58 -0.34 0.00 0.00 178.44 178.86 1ibk h VAL 23 N 0.69 0.00 0.00 1.05 2.07 -1.81 0.11 116.25 118.37 1ibk h VAL 23 Ca 0.47 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.75 1ibk h VAL 23 Cb 0.77 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1ibk h VAL 23 CO -0.23 0.00 -0.00 0.74 0.02 0.00 0.00 177.57 178.10 1ibk h THR 24 N 0.00 0.59 -0.95 2.57 2.02 0.36 -2.48 112.91 115.03 1ibk h THR 24 Ca 0.00 -1.44 0.16 0.00 0.77 0.00 0.00 66.41 65.90 1ibk h THR 24 Cb 0.29 1.12 -0.16 0.00 -1.74 0.00 0.00 68.15 67.65 1ibk h THR 24 CO 0.00 0.20 -0.32 0.00 0.37 0.00 0.00 175.52 175.77 1ibk n ALA 25 N -2.72 -0.00 0.13 6.16 0.00 -0.53 0.28 120.51 123.82 1ibk n ALA 25 Ca -0.03 0.98 -0.14 0.00 0.00 0.00 0.00 53.44 54.25 1ibk n ALA 25 Cb 0.16 -0.49 -0.08 0.00 0.00 0.00 0.00 19.45 19.04 1ibk n ALA 25 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1ibk h PHE 26 N 0.00 -0.25 -0.66 0.00 3.57 -0.92 -2.59 116.94 116.09 1ibk h PHE 26 Ca 0.37 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.99 1ibk h PHE 26 Cb 0.61 0.08 -0.09 0.00 2.79 0.00 0.00 35.95 39.34 1ibk h PHE 26 CO -0.80 -0.05 0.17 0.82 -2.23 0.00 0.00 178.31 176.22 1ibk h ILE 27 N -0.41 0.62 0.30 1.41 2.04 0.16 -1.29 117.51 120.34 1ibk h ILE 27 Ca -0.03 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1ibk h ILE 27 Cb 0.32 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 1ibk h ILE 27 CO 0.05 0.05 -0.39 0.78 0.00 0.00 0.00 178.15 178.64 1ibk h ASN 28 N 0.30 -1.08 -0.75 1.72 2.35 -0.03 0.17 115.58 118.27 1ibk h ASN 28 Ca 0.35 0.10 0.22 0.00 -0.55 0.00 0.00 56.30 56.42 1ibk h ASN 28 Cb 0.54 0.38 -0.03 0.00 0.05 0.00 0.00 38.32 39.26 1ibk h ASN 28 CO -0.42 -0.51 0.58 0.11 -1.65 0.00 0.00 177.43 175.54 1ibk h LYS 29 N -0.74 0.00 0.06 0.81 1.79 -0.92 0.77 116.57 118.34 1ibk h LYS 29 Ca -0.01 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.17 1ibk h LYS 29 Cb 0.69 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.36 1ibk h LYS 29 CO -0.11 0.00 -1.14 0.82 -1.08 0.00 0.00 179.45 177.94 1ibk h ILE 30 N 0.00 1.29 -3.76 1.86 2.04 -0.08 -3.45 117.51 115.40 1ibk h ILE 30 Ca 0.36 -2.37 -0.55 0.00 1.00 0.00 0.00 64.86 63.30 1ibk h ILE 30 Cb 1.52 2.54 0.11 0.00 -0.74 0.00 0.00 36.82 40.25 1ibk h ILE 30 CO -0.00 0.73 0.67 0.80 0.00 0.00 0.00 178.15 180.34 1ibk n MET 31 N -3.81 2.38 -3.75 2.37 1.56 0.27 -4.93 117.12 111.20 1ibk n MET 31 Ca -0.12 0.84 -0.14 0.00 -0.27 0.00 0.00 57.70 58.01 1ibk n MET 31 Cb 0.93 -2.56 -0.14 0.00 2.15 0.00 0.00 33.22 33.60 1ibk n MET 31 CO 0.00 0.00 0.00 -0.98 -0.73 0.00 0.00 175.97 174.26 1ibk s ARG 32 N -2.16 0.09 -0.52 2.12 1.70 -1.26 -4.82 118.95 114.10 1ibk s ARG 32 Ca 0.56 0.34 -0.02 0.00 -0.47 0.00 0.00 55.73 56.14 1ibk s ARG 32 Cb -0.49 -0.17 0.00 0.00 -0.57 0.00 0.00 34.95 33.72 1ibk s ARG 32 CO 0.61 -0.16 0.31 -0.25 -1.08 0.00 0.00 175.30 174.74 1ibk n ASP 33 N 4.12 -3.35 -4.22 -2.89 8.00 -1.26 -3.76 116.55 113.19 1ibk n ASP 33 Ca -0.26 -0.14 -0.34 0.00 0.71 0.00 0.00 54.79 54.76 1ibk n ASP 33 Cb 0.52 -2.09 -0.04 0.00 -0.02 0.00 0.00 41.12 39.49 1ibk n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ibk n GLY 34 N -1.03 -0.34 2.76 0.44 0.00 -1.26 -4.85 105.19 100.91 1ibk n GLY 34 Ca -0.02 0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1ibk n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ibk n LYS 35 N -4.37 4.59 0.00 1.61 5.02 -1.25 -4.84 118.16 118.92 1ibk n LYS 35 Ca -0.07 -4.75 0.00 0.00 -2.02 0.00 0.00 58.31 51.47 1ibk n LYS 35 Cb 0.56 -2.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.19 1ibk n LYS 35 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1ibk n LYS 36 N -0.12 0.00 -0.00 1.97 4.81 -1.26 -1.73 118.16 121.83 1ibk n LYS 36 Ca 0.41 0.04 -0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1ibk n LYS 36 Cb 0.31 -1.52 -0.00 0.00 0.02 0.00 0.00 35.03 33.84 1ibk n LYS 36 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1ibk n ASN 37 N -0.91 0.05 -0.30 3.14 2.85 -1.26 -2.46 115.26 116.37 1ibk n ASN 37 Ca 0.00 0.19 0.34 0.00 -0.11 0.00 0.00 54.58 55.00 1ibk n ASN 37 Cb 0.02 -0.51 0.65 0.00 1.24 0.00 0.00 39.78 41.18 1ibk n ASN 37 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1ibk h LEU 38 N -0.03 0.00 0.00 1.20 5.85 -1.85 0.76 115.31 121.24 1ibk h LEU 38 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ibk h LEU 38 Cb 0.02 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 1ibk h LEU 38 CO 0.00 0.00 -0.13 0.00 -0.34 0.00 0.00 178.44 177.97 1ibk h ALA 39 N 0.99 0.00 -0.91 1.25 0.00 -1.50 -3.09 119.26 116.00 1ibk h ALA 39 Ca 0.56 -0.15 0.20 0.00 0.00 0.00 0.00 54.91 55.52 1ibk h ALA 39 Cb 2.68 0.12 -0.11 0.00 0.00 0.00 0.00 17.79 20.47 1ibk h ALA 39 CO -0.01 0.12 0.46 0.00 0.00 0.00 0.00 179.25 179.82 1ibk h ALA 40 N -0.94 1.47 -3.00 0.00 0.00 -0.45 -2.16 119.26 114.18 1ibk h ALA 40 Ca -0.01 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ibk h ALA 40 Cb 0.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ibk h ALA 40 CO -0.00 -0.24 0.00 -2.13 0.00 0.00 0.00 179.25 176.88 1ibk n ARG 41 N -4.95 0.00 -0.12 0.00 0.63 0.24 -1.55 116.66 110.90 1ibk n ARG 41 Ca 0.22 0.21 -0.03 0.00 -0.92 0.00 0.00 57.85 57.32 1ibk n ARG 41 Cb 0.60 -0.92 -0.03 0.00 0.45 0.00 0.00 32.46 32.56 1ibk n ARG 41 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1ibk n ILE 42 N -0.63 -0.20 -0.18 5.15 5.41 -0.89 0.11 119.36 128.14 1ibk n ILE 42 Ca 0.00 0.87 -0.06 0.00 1.00 0.00 0.00 62.75 64.55 1ibk n ILE 42 Cb 0.00 -1.08 -0.01 0.00 -0.71 0.00 0.00 39.64 37.84 1ibk n ILE 42 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 1ibk h PHE 43 N 0.00 -0.98 0.24 1.39 3.57 -1.29 0.94 116.94 120.81 1ibk h PHE 43 Ca 0.05 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1ibk h PHE 43 Cb 0.12 0.51 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 1ibk h PHE 43 CO -0.40 -0.39 -0.27 1.88 -2.23 0.00 0.00 178.31 176.90 1ibk h TYR 44 N -0.20 -0.73 0.02 0.41 0.99 0.19 1.24 116.97 118.89 1ibk h TYR 44 Ca 0.21 0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.95 1ibk h TYR 44 Cb 0.55 0.29 -0.02 0.00 1.00 0.00 0.00 36.73 38.55 1ibk h TYR 44 CO -0.62 -0.39 -0.20 -0.44 -0.00 0.00 0.00 178.16 176.51 1ibk h ASP 45 N -0.56 -0.61 -0.34 3.88 3.32 -0.53 0.42 116.42 122.01 1ibk h ASP 45 Ca -0.00 0.07 0.10 0.00 0.02 0.00 0.00 57.03 57.21 1ibk h ASP 45 Cb 0.53 0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 1ibk h ASP 45 CO -0.08 -0.20 0.45 0.00 -1.72 0.00 0.00 179.24 177.69 1ibk h ALA 46 N -1.13 1.98 0.00 3.45 0.00 -0.75 1.14 119.26 123.94 1ibk h ALA 46 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ibk h ALA 46 Cb 0.27 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ibk h ALA 46 CO -0.12 -0.62 0.00 0.00 0.00 0.00 0.00 179.25 178.50 1ibk n LYS 48 N -3.04 2.56 -0.01 0.00 5.02 0.39 -4.02 118.16 119.06 1ibk n LYS 48 Ca 0.03 -3.03 0.02 0.00 -2.02 0.00 0.00 58.31 53.31 1ibk n LYS 48 Cb 0.43 -1.91 -0.06 0.00 -0.02 0.00 0.00 35.03 33.47 1ibk n LYS 48 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1ibk n ILE 49 N -0.75 0.11 0.15 -0.18 5.41 -0.96 -3.99 119.36 119.14 1ibk n ILE 49 Ca 0.32 -0.19 0.01 0.00 1.00 0.00 0.00 62.75 63.88 1ibk n ILE 49 Cb 1.08 0.07 0.23 0.00 -0.71 0.00 0.00 39.64 40.31 1ibk n ILE 49 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1ibk h ILE 50 N 0.00 1.30 0.38 1.39 2.04 -1.68 -3.14 117.51 117.81 1ibk h ILE 50 Ca -0.04 -1.89 -0.02 0.00 1.00 0.00 0.00 64.86 63.91 1ibk h ILE 50 Cb 0.58 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1ibk h ILE 50 CO 0.00 0.53 -0.18 1.56 0.00 0.00 0.00 178.15 180.05 1ibk h GLN 51 N 0.00 -0.50 0.00 2.37 1.08 -1.76 -0.01 115.11 116.30 1ibk h GLN 51 Ca -0.01 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1ibk h GLN 51 Cb 1.00 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 1ibk h GLN 51 CO 0.07 -0.28 0.00 -1.91 -0.95 0.00 0.00 178.83 175.76 1ibk n GLU 52 N -5.12 0.01 -0.10 1.46 2.13 -1.23 -1.04 120.64 116.75 1ibk n GLU 52 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 1ibk n GLU 52 Cb 0.23 -1.02 0.00 0.00 0.27 0.00 0.00 31.44 30.92 1ibk n GLU 52 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1ibk n LYS 53 N -0.52 0.00 -3.61 5.31 5.02 -1.14 -5.07 118.16 118.15 1ibk n LYS 53 Ca 0.00 -0.47 -0.10 0.00 -2.02 0.00 0.00 58.31 55.72 1ibk n LYS 53 Cb 0.00 -0.39 -0.06 0.00 -0.02 0.00 0.00 35.03 34.55 1ibk n LYS 53 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1ibk s THR 54 N 0.00 0.00 -1.10 -0.18 2.01 -0.03 -5.00 115.64 111.34 1ibk s THR 54 Ca 0.00 0.00 0.19 0.00 0.31 0.00 0.00 61.69 62.19 1ibk s THR 54 Cb 0.00 -1.00 0.20 0.00 0.01 0.00 0.00 72.50 71.71 1ibk s THR 54 CO 0.00 0.00 1.61 0.61 -0.69 0.00 0.00 174.62 176.15 1ibk n GLY 55 N 1.48 -1.11 3.75 4.40 0.00 -1.26 -4.43 105.19 108.03 1ibk n GLY 55 Ca -0.11 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 1ibk n GLY 55 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ibk s GLN 56 N -2.90 4.78 0.12 1.61 -0.21 -1.26 -4.99 119.66 116.81 1ibk s GLN 56 Ca 0.11 1.60 -0.31 0.00 0.02 0.00 0.00 55.36 56.78 1ibk s GLN 56 Cb 0.13 -3.25 -0.10 0.00 1.00 0.00 0.00 33.01 30.78 1ibk s GLN 56 CO 0.34 0.41 1.82 -1.21 -2.12 0.00 0.00 175.29 174.54 1ibk s GLU 57 N -1.26 4.14 0.18 2.91 2.02 -1.26 -4.60 118.70 120.82 1ibk s GLU 57 Ca 0.42 2.59 -0.22 0.00 0.02 0.00 0.00 54.97 57.78 1ibk s GLU 57 Cb -0.28 -3.59 0.08 0.00 0.10 0.00 0.00 34.13 30.45 1ibk s GLU 57 CO 0.35 -0.84 1.43 -0.35 0.02 0.00 0.00 175.26 175.87 1ibk n PRO 58 N 5.65 -0.31 0.00 0.39 -0.04 -1.26 -2.36 135.00 137.08 1ibk n PRO 58 Ca 0.18 1.41 0.00 0.00 -0.04 0.00 0.00 63.50 65.05 1ibk n PRO 58 Cb 0.38 -2.08 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 1ibk n PRO 58 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1ibk n LEU 59 N -5.26 0.00 -0.37 1.53 7.94 -1.26 -1.22 117.00 118.37 1ibk n LEU 59 Ca 0.06 0.80 0.32 0.00 -1.11 0.00 0.00 56.01 56.07 1ibk n LEU 59 Cb 0.31 -0.30 0.54 0.00 0.53 0.00 0.00 43.42 44.50 1ibk n LEU 59 CO -0.14 -0.30 0.98 1.17 -1.11 0.00 0.00 177.39 177.99 1ibk n LYS 60 N -2.07 -0.03 0.39 1.96 4.81 -0.99 0.70 118.16 122.93 1ibk n LYS 60 Ca 0.00 1.05 -0.15 0.00 -0.87 0.00 0.00 58.31 58.33 1ibk n LYS 60 Cb 0.00 -2.03 -0.07 0.00 0.02 0.00 0.00 35.03 32.95 1ibk n LYS 60 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1ibk h VAL 61 N 0.00 0.00 -0.28 3.15 2.07 -1.00 -0.46 116.25 119.73 1ibk h VAL 61 Ca 0.72 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 68.12 1ibk h VAL 61 Cb 2.24 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.93 1ibk h VAL 61 CO -0.43 0.00 -0.45 0.15 0.02 0.00 0.00 177.57 176.87 1ibk h PHE 62 N -1.18 -1.30 -1.06 1.57 3.57 0.82 0.77 116.94 120.12 1ibk h PHE 62 Ca -0.10 0.06 0.29 0.00 3.53 0.00 0.00 57.97 61.75 1ibk h PHE 62 Cb 0.77 0.61 -0.06 0.00 2.79 0.00 0.00 35.95 40.06 1ibk h PHE 62 CO 0.02 -0.47 0.73 0.87 -2.23 0.00 0.00 178.31 177.23 1ibk h LYS 63 N -0.42 0.16 0.01 1.11 1.79 -0.91 0.71 116.57 119.02 1ibk h LYS 63 Ca 0.10 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.54 1ibk h LYS 63 Cb 0.61 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1ibk h LYS 63 CO -0.50 0.10 -0.09 0.37 -1.08 0.00 0.00 179.45 178.25 1ibk h GLN 64 N 0.16 0.05 -0.83 3.15 5.75 0.20 -2.91 115.11 120.69 1ibk h GLN 64 Ca 0.54 -0.06 0.14 0.00 -0.15 0.00 0.00 58.65 59.12 1ibk h GLN 64 Cb 1.83 0.02 -0.09 0.00 1.07 0.00 0.00 27.48 30.31 1ibk h GLN 64 CO -0.12 0.90 0.43 0.00 -2.65 0.00 0.00 178.83 177.39 1ibk h ALA 65 N 0.15 1.23 0.28 3.38 0.00 0.18 -2.27 119.26 122.21 1ibk h ALA 65 Ca -0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ibk h ALA 65 Cb 0.94 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ibk h ALA 65 CO 0.02 -0.07 -0.15 0.28 0.00 0.00 0.00 179.25 179.32 1ibk h VAL 66 N 0.63 0.00 0.00 0.00 2.07 -1.03 -2.19 116.25 115.73 1ibk h VAL 66 Ca 0.44 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.96 1ibk h VAL 66 Cb 0.60 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1ibk h VAL 66 CO -0.34 0.00 0.70 1.21 0.02 0.00 0.00 177.57 179.15 1ibk n GLU 67 N -3.18 0.02 -0.12 1.57 4.07 -0.89 0.04 120.64 122.16 1ibk n GLU 67 Ca -0.05 0.46 -0.16 0.00 -0.06 0.00 0.00 57.16 57.35 1ibk n GLU 67 Cb 0.16 -2.25 -0.13 0.00 -0.06 0.00 0.00 31.44 29.16 1ibk n GLU 67 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1ibk n ASN 68 N -1.73 1.59 0.00 4.31 3.02 -0.91 -4.35 115.26 117.19 1ibk n ASN 68 Ca -0.00 -0.11 0.09 0.00 -0.03 0.00 0.00 54.58 54.54 1ibk n ASN 68 Cb 0.70 -0.09 0.47 0.00 -0.61 0.00 0.00 39.78 40.25 1ibk n ASN 68 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1ibk n VAL 69 N -3.13 0.46 -2.07 2.41 0.31 0.11 -4.77 118.33 111.63 1ibk n VAL 69 Ca -0.42 0.11 -0.43 0.00 -0.01 0.00 0.00 64.34 63.59 1ibk n VAL 69 Cb 1.02 -0.80 -0.03 0.00 -0.91 0.00 0.00 33.84 33.13 1ibk n VAL 69 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1ibk s LYS 70 N -2.63 3.89 0.05 5.55 1.02 -1.11 -4.38 119.74 122.13 1ibk s LYS 70 Ca 0.17 1.82 -0.30 0.00 0.02 0.00 0.00 55.97 57.68 1ibk s LYS 70 Cb 0.13 -4.03 -0.05 0.00 -0.52 0.00 0.00 37.83 33.36 1ibk s LYS 70 CO 0.30 -1.18 1.07 -1.25 -0.92 0.00 0.00 175.35 173.37 1ibk s PRO 71 N 4.53 4.53 0.09 -1.68 0.04 -1.26 -4.94 135.00 136.31 1ibk s PRO 71 Ca 0.73 1.59 0.17 0.00 0.04 0.00 0.00 61.00 63.52 1ibk s PRO 71 Cb -0.27 -3.39 -0.11 0.00 0.04 0.00 0.00 34.50 30.77 1ibk s PRO 71 CO 0.29 -0.09 0.90 0.00 0.04 0.00 0.00 177.00 178.14 1ibk h ARG 72 N 6.48 0.00 -4.04 4.56 3.08 -1.94 -3.45 114.38 119.08 1ibk h ARG 72 Ca -0.42 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.48 1ibk h ARG 72 Cb 1.22 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.07 1ibk h ARG 72 CO 0.77 0.31 -0.69 -1.64 -1.07 0.00 0.00 179.97 177.65 1ibk s MET 73 N -2.94 0.40 0.34 0.04 -1.94 -1.26 -3.31 119.30 110.62 1ibk s MET 73 Ca -0.02 -0.77 -0.06 0.00 -1.71 0.00 0.00 55.69 53.13 1ibk s MET 73 Cb 0.09 0.14 0.01 0.00 2.01 0.00 0.00 34.83 37.08 1ibk s MET 73 CO 0.80 -0.07 0.52 -1.83 -0.01 0.00 0.00 175.02 174.44 1ibk s GLU 74 N -2.14 1.92 -0.19 2.03 -1.05 -0.89 -3.82 118.70 114.55 1ibk s GLU 74 Ca -0.10 -1.65 -0.01 0.00 -0.15 0.00 0.00 54.97 53.06 1ibk s GLU 74 Cb -0.05 0.47 0.05 0.00 -0.44 0.00 0.00 34.13 34.17 1ibk s GLU 74 CO -0.03 -0.81 -0.01 0.08 0.95 0.00 0.00 175.26 175.44 1ibk s VAL 75 N -3.05 0.89 -0.03 1.83 1.01 -1.26 -1.16 120.40 118.62 1ibk s VAL 75 Ca 0.27 -0.70 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 1ibk s VAL 75 Cb -0.01 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 1ibk s VAL 75 CO 0.17 -0.08 0.55 -0.13 0.00 0.00 0.00 175.10 175.62 1ibk s ARG 76 N 1.70 4.29 1.18 2.72 0.52 -0.41 -4.82 118.95 124.12 1ibk s ARG 76 Ca -0.01 0.64 -0.20 0.00 -0.52 0.00 0.00 55.73 55.64 1ibk s ARG 76 Cb -0.17 -3.36 0.31 0.00 0.52 0.00 0.00 34.95 32.25 1ibk s ARG 76 CO -0.07 0.34 0.71 0.45 0.02 0.00 0.00 175.30 176.74 1ibk n SER 77 N 2.90 -3.67 0.00 0.23 2.88 -1.26 -1.08 113.62 113.61 1ibk n SER 77 Ca -0.07 -0.72 0.00 0.00 -1.33 0.00 0.00 58.87 56.74 1ibk n SER 77 Cb 0.51 -0.80 0.00 0.00 -0.75 0.00 0.00 64.21 63.17 1ibk n SER 77 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1ibk n ARG 78 N -5.04 -1.44 -4.04 -1.46 0.63 -0.57 -4.48 116.66 100.26 1ibk n ARG 78 Ca 0.11 0.00 -0.19 0.00 -0.92 0.00 0.00 57.85 56.85 1ibk n ARG 78 Cb 0.48 0.00 -0.16 0.00 0.45 0.00 0.00 32.46 33.23 1ibk n ARG 78 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1ibk s ARG 79 N -2.00 0.65 -0.11 -0.14 0.52 -1.25 -2.11 118.95 114.51 1ibk s ARG 79 Ca 0.00 -0.03 -0.00 0.00 -0.52 0.00 0.00 55.73 55.18 1ibk s ARG 79 Cb 0.00 -0.75 0.02 0.00 0.52 0.00 0.00 34.95 34.74 1ibk s ARG 79 CO 0.00 -0.12 -0.08 0.08 0.02 0.00 0.00 175.30 175.20 1ibk s VAL 80 N 1.08 1.03 0.00 3.52 1.01 0.35 -4.79 120.40 122.59 1ibk s VAL 80 Ca -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1ibk s VAL 80 Cb -0.14 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1ibk s VAL 80 CO -0.01 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.07 1ibk n GLY 81 N 4.89 0.52 0.00 4.51 0.00 -1.26 -1.69 105.19 112.15 1ibk n GLY 81 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1ibk n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ibk n GLY 82 N -2.00 1.66 3.15 -0.02 0.00 -1.26 -5.14 105.19 101.58 1ibk n GLY 82 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1ibk n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ibk s ALA 83 N -1.66 1.17 -1.12 4.61 0.00 -0.68 -5.09 121.76 118.99 1ibk s ALA 83 Ca 0.00 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 1ibk s ALA 83 Cb 0.00 -0.15 0.28 0.00 0.00 0.00 0.00 23.12 23.25 1ibk s ALA 83 CO 0.00 0.20 1.30 0.09 0.00 0.00 0.00 175.76 177.35 1ibk n ASN 84 N 1.69 5.83 -4.87 0.00 3.02 -1.26 -0.50 115.26 119.19 1ibk n ASN 84 Ca -0.19 -3.18 -0.30 0.00 -0.03 0.00 0.00 54.58 50.88 1ibk n ASN 84 Cb 0.54 -1.35 0.06 0.00 -0.61 0.00 0.00 39.78 38.42 1ibk n ASN 84 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1ibk s TYR 85 N -1.65 3.15 -0.39 3.10 4.12 -0.90 -4.80 117.35 120.00 1ibk s TYR 85 Ca 0.32 1.02 -0.03 0.00 0.02 0.00 0.00 57.07 58.41 1ibk s TYR 85 Cb -0.04 -3.15 0.10 0.00 -1.52 0.00 0.00 41.96 37.36 1ibk s TYR 85 CO -0.00 -1.42 0.16 -0.65 0.02 0.00 0.00 175.55 173.66 1ibk s GLN 86 N -5.34 2.06 -0.15 -0.62 -1.52 -1.26 -1.51 119.66 111.32 1ibk s GLN 86 Ca 0.59 -1.71 -0.29 0.00 -1.95 0.00 0.00 55.36 52.00 1ibk s GLN 86 Cb -0.12 -3.50 -0.01 0.00 -0.22 0.00 0.00 33.01 29.17 1ibk s GLN 86 CO 0.52 -0.98 1.06 0.08 -0.25 0.00 0.00 175.29 175.72 1ibk s VAL 87 N 1.16 4.65 -0.37 1.09 1.01 -0.24 -4.86 120.40 122.84 1ibk s VAL 87 Ca 0.06 1.96 -0.29 0.00 0.00 0.00 0.00 61.98 63.71 1ibk s VAL 87 Cb -0.22 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 31.91 1ibk s VAL 87 CO -0.04 -0.08 1.22 -2.16 0.00 0.00 0.00 175.10 174.05 1ibk s PRO 88 N 2.59 3.86 0.05 2.72 0.04 -1.26 -1.29 135.00 141.71 1ibk s PRO 88 Ca 0.48 0.98 -0.00 0.00 0.04 0.00 0.00 61.00 62.50 1ibk s PRO 88 Cb -0.18 -3.87 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 1ibk s PRO 88 CO 0.14 -1.20 -0.04 0.00 0.04 0.00 0.00 177.00 175.94 1ibk s MET 89 N 4.22 0.58 1.10 4.56 0.23 -0.31 -4.89 119.30 124.79 1ibk s MET 89 Ca 0.52 -1.08 -0.20 0.00 -1.03 0.00 0.00 55.69 53.91 1ibk s MET 89 Cb -0.13 0.09 0.07 0.00 -1.53 0.00 0.00 34.83 33.34 1ibk s MET 89 CO 0.25 -0.07 -0.19 0.39 -2.03 0.00 0.00 175.02 173.37 1ibk n GLU 90 N 0.49 -1.50 -4.47 3.16 -0.58 -1.26 -2.09 120.64 114.38 1ibk n GLU 90 Ca -0.16 -0.43 -0.25 0.00 -0.42 0.00 0.00 57.16 55.90 1ibk n GLU 90 Cb 0.59 -1.57 -0.17 0.00 -0.57 0.00 0.00 31.44 29.72 1ibk n GLU 90 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1ibk s VAL 91 N -2.18 1.10 -0.07 2.62 1.01 -1.21 -4.60 120.40 117.08 1ibk s VAL 91 Ca 0.51 -0.44 -0.38 0.00 0.00 0.00 0.00 61.98 61.67 1ibk s VAL 91 Cb -0.08 -1.02 -0.16 0.00 0.00 0.00 0.00 36.38 35.11 1ibk s VAL 91 CO 0.62 0.35 1.49 -0.24 0.00 0.00 0.00 175.10 177.33 1ibk n SER 92 N 3.99 1.87 0.06 3.32 2.88 -1.26 -4.69 113.62 119.79 1ibk n SER 92 Ca -0.22 1.10 0.20 0.00 -1.33 0.00 0.00 58.87 58.63 1ibk n SER 92 Cb 0.51 -1.16 0.60 0.00 -0.75 0.00 0.00 64.21 63.41 1ibk n SER 92 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1ibk h PRO 93 N 5.54 0.00 0.00 -1.46 0.13 -1.99 0.34 132.00 134.57 1ibk h PRO 93 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ibk h PRO 93 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1ibk h PRO 93 CO 0.85 0.00 -0.00 -0.09 -0.23 0.00 0.00 178.00 178.52 1ibk h ARG 94 N 0.00 -0.01 -1.10 0.86 9.65 -2.02 -3.34 114.38 118.42 1ibk h ARG 94 Ca 0.23 0.00 0.30 0.00 -1.10 0.00 0.00 59.98 59.42 1ibk h ARG 94 Cb 1.65 0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 30.13 1ibk h ARG 94 CO -0.00 -0.00 0.71 -0.09 2.80 0.00 0.00 179.97 183.38 1ibk h ARG 95 N -0.68 0.31 -0.10 0.20 2.43 -1.00 -1.14 114.38 114.40 1ibk h ARG 95 Ca -0.00 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1ibk h ARG 95 Cb 0.00 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.42 1ibk h ARG 95 CO 0.00 0.20 -0.46 1.96 -1.51 0.00 0.00 179.97 180.17 1ibk h GLN 96 N 0.32 -0.53 -0.24 0.20 4.20 -0.62 0.51 115.11 118.94 1ibk h GLN 96 Ca 0.64 0.04 0.06 0.00 0.06 0.00 0.00 58.65 59.45 1ibk h GLN 96 Cb 1.74 0.12 -0.06 0.00 0.30 0.00 0.00 27.48 29.58 1ibk h GLN 96 CO -0.32 -0.35 -0.17 0.37 -0.67 0.00 0.00 178.83 177.69 1ibk h GLN 97 N -0.55 -0.15 -0.69 1.46 4.15 -1.34 -0.22 115.11 117.78 1ibk h GLN 97 Ca 0.06 0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.62 1ibk h GLN 97 Cb 0.66 0.03 -0.13 0.00 0.21 0.00 0.00 27.48 28.25 1ibk h GLN 97 CO -0.39 -0.10 -0.20 0.77 -1.93 0.00 0.00 178.83 176.98 1ibk h SER 98 N -0.15 -0.73 -0.08 -0.69 0.02 -0.92 0.15 113.55 111.14 1ibk h SER 98 Ca 0.14 0.21 -0.07 0.00 -0.84 0.00 0.00 61.79 61.23 1ibk h SER 98 Cb 0.36 0.46 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1ibk h SER 98 CO -0.34 -0.24 -0.23 -0.07 -1.14 0.00 0.00 176.83 174.81 1ibk h LEU 99 N -0.02 0.34 0.40 5.07 3.38 -0.29 -2.11 115.31 122.08 1ibk h LEU 99 Ca 0.32 -0.60 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1ibk h LEU 99 Cb 0.52 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1ibk h LEU 99 CO -0.72 0.88 -0.43 0.00 0.09 0.00 0.00 178.44 178.26 1ibk h ALA 100 N 0.47 -0.93 -0.22 1.53 0.00 -0.58 0.71 119.26 120.24 1ibk h ALA 100 Ca -0.01 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ibk h ALA 100 Cb 0.85 0.63 -0.07 0.00 0.00 0.00 0.00 17.79 19.19 1ibk h ALA 100 CO 0.05 -1.06 -0.31 -0.07 0.00 0.00 0.00 179.25 177.86 1ibk h LEU 101 N -0.85 -0.97 0.44 0.00 3.38 -1.07 0.10 115.31 116.35 1ibk h LEU 101 Ca -0.04 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1ibk h LEU 101 Cb 0.76 0.43 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1ibk h LEU 101 CO -0.08 -0.33 -0.44 -0.09 0.09 0.00 0.00 178.44 177.59 1ibk h ARG 102 N -0.33 -0.86 -1.00 1.13 2.43 -1.10 -2.22 114.38 112.43 1ibk h ARG 102 Ca 0.12 0.06 0.29 0.00 -0.81 0.00 0.00 59.98 59.64 1ibk h ARG 102 Cb 0.52 0.20 -0.14 0.00 -0.42 0.00 0.00 29.97 30.13 1ibk h ARG 102 CO -0.41 -0.57 0.56 -1.49 -1.51 0.00 0.00 179.97 176.55 1ibk h TRP 103 N -0.89 0.94 0.38 2.20 6.55 0.11 -1.30 115.95 123.94 1ibk h TRP 103 Ca -0.04 0.04 -0.02 0.00 0.95 0.00 0.00 58.89 59.82 1ibk h TRP 103 Cb 0.79 -0.25 -0.00 0.00 -0.86 0.00 0.00 29.16 28.83 1ibk h TRP 103 CO -0.23 -0.09 -0.27 -0.07 -1.05 0.00 0.00 178.44 176.74 1ibk h LEU 104 N 0.42 -0.69 -0.92 -4.49 3.38 -0.20 0.28 115.31 113.08 1ibk h LEU 104 Ca 0.69 0.04 0.23 0.00 0.09 0.00 0.00 57.88 58.93 1ibk h LEU 104 Cb 1.48 0.21 -0.13 0.00 0.09 0.00 0.00 40.66 42.31 1ibk h LEU 104 CO -0.56 -0.39 0.43 0.58 0.09 0.00 0.00 178.44 178.59 1ibk h VAL 105 N -0.62 0.48 0.49 1.22 2.07 -0.98 0.70 116.25 119.61 1ibk h VAL 105 Ca -0.05 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1ibk h VAL 105 Cb 0.51 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1ibk h VAL 105 CO 0.03 0.08 -0.24 1.56 0.02 0.00 0.00 177.57 179.02 1ibk h GLN 106 N 0.43 -0.64 -0.94 1.57 4.20 -1.22 -2.04 115.11 116.47 1ibk h GLN 106 Ca 0.58 0.04 0.11 0.00 0.06 0.00 0.00 58.65 59.45 1ibk h GLN 106 Cb 1.12 0.15 -0.07 0.00 0.30 0.00 0.00 27.48 28.97 1ibk h GLN 106 CO -0.52 -0.34 0.60 0.00 -0.67 0.00 0.00 178.83 177.90 1ibk h ALA 107 N -0.53 1.61 0.72 3.87 0.00 0.04 -2.49 119.26 122.47 1ibk h ALA 107 Ca -0.07 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ibk h ALA 107 Cb 0.59 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ibk h ALA 107 CO 0.11 0.18 -0.48 0.00 0.00 0.00 0.00 179.25 179.06 1ibk h ALA 108 N 1.55 -1.20 0.00 0.00 0.00 0.59 -0.44 119.26 119.76 1ibk h ALA 108 Ca 0.45 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ibk h ALA 108 Cb 0.46 0.61 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1ibk h ALA 108 CO -0.21 -1.20 0.00 0.09 0.00 0.00 0.00 179.25 177.93 1ibk n ASN 109 N -5.60 0.00 0.07 0.00 5.03 -0.79 -0.38 115.26 113.58 1ibk n ASN 109 Ca -0.14 -0.60 0.09 0.00 0.87 0.00 0.00 54.58 54.80 1ibk n ASN 109 Cb 0.49 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.19 1ibk n ASN 109 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ibk n GLN 110 N -0.58 0.62 -0.62 3.52 1.13 -0.18 -4.96 117.38 116.31 1ibk n GLN 110 Ca 0.01 0.06 -0.29 0.00 -1.94 0.00 0.00 57.00 54.84 1ibk n GLN 110 Cb 0.01 -1.75 0.26 0.00 0.11 0.00 0.00 30.24 28.86 1ibk n GLN 110 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1ibk s ARG 111 N -3.32 -1.48 -0.04 -1.09 0.52 0.48 -5.01 118.95 109.01 1ibk s ARG 111 Ca -0.03 0.47 0.01 0.00 -0.52 0.00 0.00 55.73 55.66 1ibk s ARG 111 Cb 0.10 -1.52 -0.26 0.00 0.52 0.00 0.00 34.95 33.80 1ibk s ARG 111 CO 0.82 -4.00 0.69 -1.00 0.02 0.00 0.00 175.30 171.83 1ibk h PRO 112 N -2.81 0.17 -6.17 3.54 0.13 -1.93 -3.48 132.00 121.45 1ibk h PRO 112 Ca -0.54 -0.29 -0.67 0.00 -0.87 0.00 0.00 66.00 63.63 1ibk h PRO 112 Cb 1.33 0.11 0.09 0.00 0.13 0.00 0.00 31.00 32.66 1ibk h PRO 112 CO 0.43 0.95 -0.12 -0.85 -0.23 0.00 0.00 178.00 178.18 1ibk n GLU 113 N -3.33 0.53 0.16 0.86 0.00 -1.26 -4.91 120.64 112.69 1ibk n GLU 113 Ca -0.20 0.19 -0.11 0.00 0.00 0.00 0.00 57.16 57.04 1ibk n GLU 113 Cb 1.04 -1.45 -0.06 0.00 0.00 0.00 0.00 31.44 30.97 1ibk n GLU 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ibk h ARG 114 N 2.05 -0.45 -6.28 3.44 3.08 -2.02 -3.43 114.38 110.77 1ibk h ARG 114 Ca -0.37 0.03 -0.57 0.00 0.07 0.00 0.00 59.98 59.14 1ibk h ARG 114 Cb 1.40 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.52 1ibk h ARG 114 CO 0.62 -0.15 1.21 1.03 -1.07 0.00 0.00 179.97 181.62 1ibk s ARG 115 N -3.80 3.55 0.12 0.04 0.52 -1.26 -4.92 118.95 113.19 1ibk s ARG 115 Ca -0.11 1.56 -0.27 0.00 -0.52 0.00 0.00 55.73 56.39 1ibk s ARG 115 Cb 0.01 -4.13 -0.08 0.00 0.52 0.00 0.00 34.95 31.27 1ibk s ARG 115 CO 0.40 -1.60 1.45 0.00 0.02 0.00 0.00 175.30 175.57 1ibk h ALA 116 N 11.93 -0.62 -0.87 2.13 0.00 -2.01 -1.98 119.26 127.84 1ibk h ALA 116 Ca -0.34 0.03 0.23 0.00 0.00 0.00 0.00 54.91 54.83 1ibk h ALA 116 Cb 1.16 1.14 -0.16 0.00 0.00 0.00 0.00 17.79 19.93 1ibk h ALA 116 CO 1.02 -0.88 -0.02 0.00 0.00 0.00 0.00 179.25 179.36 1ibk n ALA 117 N -3.08 0.40 -0.11 0.00 0.00 -1.26 0.11 120.51 116.58 1ibk n ALA 117 Ca -0.01 0.93 -0.07 0.00 0.00 0.00 0.00 53.44 54.29 1ibk n ALA 117 Cb 0.26 -0.66 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 1ibk n ALA 117 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ibk h VAL 118 N 0.00 0.27 -0.30 0.00 2.07 -1.72 0.06 116.25 116.63 1ibk h VAL 118 Ca 0.51 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.08 1ibk h VAL 118 Cb 1.01 0.27 -0.08 0.00 -1.52 0.00 0.00 31.29 30.97 1ibk h VAL 118 CO -0.83 0.00 -0.44 0.03 0.02 0.00 0.00 177.57 176.36 1ibk h ARG 119 N -0.24 -0.38 -0.14 1.57 3.08 0.81 0.93 114.38 120.00 1ibk h ARG 119 Ca 0.17 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.29 1ibk h ARG 119 Cb 0.52 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 1ibk h ARG 119 CO -0.51 -0.26 -0.14 0.82 -1.07 0.00 0.00 179.97 178.81 1ibk h ILE 120 N -0.40 0.61 -0.32 2.04 2.04 -1.25 0.43 117.51 120.65 1ibk h ILE 120 Ca 0.11 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.02 1ibk h ILE 120 Cb 0.60 0.61 -0.08 0.00 -0.74 0.00 0.00 36.82 37.21 1ibk h ILE 120 CO -0.51 0.00 -0.49 0.00 0.00 0.00 0.00 178.15 177.15 1ibk h ALA 121 N 0.91 -0.65 -2.16 1.87 0.00 0.23 0.80 119.26 120.26 1ibk h ALA 121 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ibk h ALA 121 Cb 0.31 0.98 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1ibk h ALA 121 CO -0.25 -0.97 0.00 0.72 0.00 0.00 0.00 179.25 178.75 1ibk n HIS 122 N -5.41 0.00 -0.20 0.00 8.25 0.31 -2.59 115.22 115.58 1ibk n HIS 122 Ca -0.03 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.53 1ibk n HIS 122 Cb 0.36 -0.14 0.19 0.00 1.12 0.00 0.00 29.99 31.52 1ibk n HIS 122 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1ibk n GLU 123 N -0.92 -0.05 0.08 -0.41 4.07 0.14 0.14 120.64 123.70 1ibk n GLU 123 Ca 0.00 0.89 -0.16 0.00 -0.06 0.00 0.00 57.16 57.83 1ibk n GLU 123 Cb 0.00 -1.42 -0.10 0.00 -0.06 0.00 0.00 31.44 29.86 1ibk n GLU 123 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1ibk h LEU 124 N 0.00 -1.62 -0.20 4.31 3.38 -0.79 0.27 115.31 120.66 1ibk h LEU 124 Ca 0.37 0.18 0.05 0.00 0.09 0.00 0.00 57.88 58.57 1ibk h LEU 124 Cb 0.79 0.61 -0.07 0.00 0.09 0.00 0.00 40.66 42.08 1ibk h LEU 124 CO -0.55 -0.54 -0.35 0.24 0.09 0.00 0.00 178.44 177.33 1ibk h MET 125 N -0.71 -0.37 -0.67 1.13 2.86 0.14 0.60 114.93 117.92 1ibk h MET 125 Ca 0.00 0.03 0.14 0.00 -2.06 0.00 0.00 59.70 57.81 1ibk h MET 125 Cb 0.74 0.08 -0.11 0.00 0.06 0.00 0.00 31.60 32.37 1ibk h MET 125 CO -0.32 -0.24 0.05 -0.44 1.06 0.00 0.00 176.91 177.01 1ibk h ASP 126 N -0.38 -0.20 -0.20 1.22 5.19 -0.95 0.56 116.42 121.65 1ibk h ASP 126 Ca 0.11 0.16 0.06 0.00 -0.62 0.00 0.00 57.03 56.73 1ibk h ASP 126 Cb 0.56 0.26 -0.07 0.00 0.18 0.00 0.00 39.33 40.27 1ibk h ASP 126 CO -0.41 -0.10 -0.24 0.00 -3.12 0.00 0.00 179.24 175.36 1ibk h ALA 127 N 1.59 -0.17 -0.05 3.45 0.00 0.14 0.53 119.26 124.76 1ibk h ALA 127 Ca 0.36 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.34 1ibk h ALA 127 Cb 0.60 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1ibk h ALA 127 CO -0.54 -0.68 -0.25 0.00 0.00 0.00 0.00 179.25 177.78 1ibk h ALA 128 N 0.74 -0.65 -0.48 0.00 0.00 0.20 -2.30 119.26 116.77 1ibk h ALA 128 Ca 0.12 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1ibk h ALA 128 Cb 0.46 0.76 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 1ibk h ALA 128 CO -0.36 -0.74 -0.43 0.93 0.00 0.00 0.00 179.25 178.65 1ibk h GLU 129 N -0.27 -0.27 0.00 0.00 4.39 -0.22 -3.46 114.58 114.75 1ibk h GLU 129 Ca 0.01 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1ibk h GLU 129 Cb 0.31 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1ibk h GLU 129 CO -0.19 -0.18 0.00 0.41 -1.16 0.00 0.00 179.01 177.89 1ibk n GLY 130 N -1.41 -0.69 3.56 -3.84 0.00 0.17 -5.09 105.19 97.89 1ibk n GLY 130 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1ibk n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ibk s LYS 131 N 0.00 2.02 0.00 1.61 0.00 -0.26 -4.97 119.74 118.15 1ibk s LYS 131 Ca 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 55.97 53.72 1ibk s LYS 131 Cb 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 37.83 37.10 1ibk s LYS 131 CO 0.00 -0.50 0.00 0.41 0.00 0.00 0.00 175.35 175.26 1ibk n GLY 132 N -1.00 3.08 0.62 0.59 0.00 -1.26 -2.72 105.19 104.50 1ibk n GLY 132 Ca -0.09 -1.72 0.46 0.00 0.00 0.00 0.00 46.02 44.68 1ibk n GLY 132 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ibk h GLY 133 N 0.00 0.36 0.36 -0.02 0.00 -1.96 0.19 103.07 102.00 1ibk h GLY 133 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1ibk h GLY 133 CO 0.00 -0.11 -0.06 0.00 0.00 0.00 0.00 176.54 176.37 1ibk h ALA 134 N 1.23 -0.17 -0.59 3.60 0.00 -1.88 -2.51 119.26 118.94 1ibk h ALA 134 Ca 0.85 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.60 1ibk h ALA 134 Cb 3.24 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 21.03 1ibk h ALA 134 CO -0.12 -0.27 0.24 0.28 0.00 0.00 0.00 179.25 179.37 1ibk h VAL 135 N -0.82 0.82 0.00 0.00 2.07 -1.04 -0.32 116.25 116.96 1ibk h VAL 135 Ca -0.02 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1ibk h VAL 135 Cb 0.55 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1ibk h VAL 135 CO 0.03 0.08 0.00 1.17 0.02 0.00 0.00 177.57 178.87 1ibk n LYS 136 N -4.97 0.00 -0.29 1.57 4.81 0.40 0.10 118.16 119.79 1ibk n LYS 136 Ca 0.08 0.63 -0.01 0.00 -0.87 0.00 0.00 58.31 58.14 1ibk n LYS 136 Cb 0.24 -1.15 0.06 0.00 0.02 0.00 0.00 35.03 34.20 1ibk n LYS 136 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1ibk h LYS 137 N 0.00 -0.05 -0.31 1.64 1.57 -1.15 0.79 116.57 119.06 1ibk h LYS 137 Ca 0.00 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1ibk h LYS 137 Cb 0.00 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.25 1ibk h LYS 137 CO 0.00 -0.03 -0.15 -0.22 -0.57 0.00 0.00 179.45 178.48 1ibk h LYS 138 N -0.05 -0.10 -0.64 3.15 3.11 -0.02 0.52 116.57 122.54 1ibk h LYS 138 Ca 0.33 0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 58.15 1ibk h LYS 138 Cb 0.59 0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 31.81 1ibk h LYS 138 CO -0.83 -0.06 0.29 0.93 -2.81 0.00 0.00 179.45 176.96 1ibk h GLU 139 N -0.10 0.94 0.17 1.90 5.08 0.35 -2.51 114.58 120.41 1ibk h GLU 139 Ca 0.16 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1ibk h GLU 139 Cb 0.34 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1ibk h GLU 139 CO -0.37 0.76 -0.29 -0.44 -1.00 0.00 0.00 179.01 177.67 1ibk h ASP 140 N 0.89 -0.82 -0.07 1.42 3.32 0.23 -1.79 116.42 119.60 1ibk h ASP 140 Ca 0.22 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.37 1ibk h ASP 140 Cb 0.15 0.30 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1ibk h ASP 140 CO -0.02 -0.39 -0.26 0.58 -1.72 0.00 0.00 179.24 177.43 1ibk h VAL 141 N -0.54 0.00 -1.39 -1.35 2.07 0.13 0.21 116.25 115.38 1ibk h VAL 141 Ca 0.02 0.00 0.40 0.00 0.82 0.00 0.00 66.70 67.94 1ibk h VAL 141 Cb 0.54 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 1ibk h VAL 141 CO -0.14 0.00 1.01 -0.33 0.02 0.00 0.00 177.57 178.14 1ibk h GLU 142 N -0.27 0.00 -0.06 1.57 5.08 -1.35 0.97 114.58 120.52 1ibk h GLU 142 Ca 0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1ibk h GLU 142 Cb 0.32 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ibk h GLU 142 CO -0.21 0.00 0.01 0.00 -1.00 0.00 0.00 179.01 177.81 1ibk h ARG 143 N 0.00 0.09 -0.95 2.33 3.08 0.28 -2.79 114.38 116.42 1ibk h ARG 143 Ca 0.66 -0.02 0.13 0.00 0.07 0.00 0.00 59.98 60.81 1ibk h ARG 143 Cb 2.68 -0.01 -0.08 0.00 0.08 0.00 0.00 29.97 32.64 1ibk h ARG 143 CO -0.01 0.31 0.61 0.52 -1.07 0.00 0.00 179.97 180.33 1ibk h MET 144 N -0.14 0.85 0.00 0.04 2.86 0.20 -3.29 114.93 115.46 1ibk h MET 144 Ca 0.02 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.54 1ibk h MET 144 Cb 0.26 -0.19 0.03 0.00 0.06 0.00 0.00 31.60 31.76 1ibk h MET 144 CO 0.00 0.57 0.04 0.00 1.06 0.00 0.00 176.91 178.58 1ibk n ALA 145 N -2.38 -0.38 -1.36 6.32 0.00 -0.89 -2.53 120.51 119.29 1ibk n ALA 145 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ibk n ALA 145 Cb 0.39 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.83 1ibk n ALA 145 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ibk n GLU 146 N -1.72 -1.65 0.00 0.00 -0.58 -1.26 -3.99 120.64 111.45 1ibk n GLU 146 Ca 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.76 1ibk n GLU 146 Cb 0.09 -2.92 0.00 0.00 -0.57 0.00 0.00 31.44 28.04 1ibk n GLU 146 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ibk n ALA 147 N -1.27 2.09 -0.90 0.62 0.00 -1.22 -4.55 120.51 115.29 1ibk n ALA 147 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1ibk n ALA 147 Cb 0.20 0.11 0.30 0.00 0.00 0.00 0.00 19.45 20.05 1ibk n ALA 147 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ibk n ASN 148 N -1.79 4.78 -0.39 0.00 5.03 -1.05 -4.44 115.26 117.39 1ibk n ASN 148 Ca 0.00 -3.13 0.37 0.00 0.87 0.00 0.00 54.58 52.69 1ibk n ASN 148 Cb 0.11 -0.73 0.73 0.00 -1.02 0.00 0.00 39.78 38.86 1ibk n ASN 148 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.26 175.34 1ibk h ARG 149 N 2.65 0.05 -0.22 3.52 1.12 -1.83 0.27 114.38 119.95 1ibk h ARG 149 Ca 0.24 -0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 59.10 1ibk h ARG 149 Cb 2.24 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 32.18 1ibk h ARG 149 CO 0.69 0.04 0.13 0.00 -3.11 0.00 0.00 179.97 177.72 1ibk h ALA 150 N 1.39 0.28 0.00 2.80 0.00 -1.96 -2.90 119.26 118.87 1ibk h ALA 150 Ca 0.65 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.50 1ibk h ALA 150 Cb 2.43 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 20.13 1ibk h ALA 150 CO -0.07 -0.21 -0.01 0.66 0.00 0.00 0.00 179.25 179.62 1ibk n TYR 151 N -4.90 0.00 -0.07 0.00 0.53 0.96 -4.06 117.16 109.63 1ibk n TYR 151 Ca -0.03 -0.71 -0.09 0.00 -1.02 0.00 0.00 57.90 56.04 1ibk n TYR 151 Cb 0.06 -0.48 -0.07 0.00 -1.03 0.00 0.00 39.34 37.81 1ibk n TYR 151 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1ibk h ALA 152 N 2.09 0.04 0.00 -0.72 0.00 -1.64 -3.35 119.26 115.68 1ibk h ALA 152 Ca 0.01 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1ibk h ALA 152 Cb 0.71 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ibk h ALA 152 CO 0.02 0.15 0.72 1.12 0.00 0.00 0.00 179.25 181.26 1ibk h HIS 153 N -1.00 0.00 0.00 0.00 2.07 -1.86 0.75 115.15 115.11 1ibk h HIS 153 Ca -0.05 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.47 1ibk h HIS 153 Cb 0.66 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.64 1ibk h HIS 153 CO 0.11 0.00 0.00 0.66 -3.07 0.00 0.00 177.93 175.63 1ibk n TYR 154 N -2.02 0.00 0.00 6.12 0.53 -1.26 -4.85 117.16 115.69 1ibk n TYR 154 Ca -0.00 -0.11 0.00 0.00 -1.02 0.00 0.00 57.90 56.77 1ibk n TYR 154 Cb 0.72 -0.13 0.00 0.00 -1.03 0.00 0.00 39.34 38.91 1ibk n TYR 154 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 1ibk n ARG 155 N 0.14 0.00 -0.41 -0.72 5.12 0.26 -5.06 116.66 115.99 1ibk n ARG 155 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1ibk n ARG 155 Cb 0.29 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.59 1ibk n ARG 155 CO 0.00 0.00 0.00 1.87 -1.93 0.00 0.00 177.63 177.57