#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocz h GLN 12 N 0.00 0.00 -3.09 2.98 1.08 -2.07 -3.50 115.11 110.51 1ocz h GLN 12 Ca 0.00 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 1ocz h GLN 12 Cb 0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 27.35 1ocz h GLN 12 CO 0.00 0.00 0.17 -0.08 -0.95 0.00 0.00 178.83 177.97 1ocz s THR 13 N -1.37 0.01 0.12 -0.54 -1.32 -1.26 -5.13 115.64 106.14 1ocz s THR 13 Ca -0.03 -0.68 -0.36 0.00 -1.21 0.00 0.00 61.69 59.41 1ocz s THR 13 Cb 0.00 -1.63 -0.16 0.00 -1.51 0.00 0.00 72.50 69.20 1ocz s THR 13 CO 0.04 -0.02 1.40 0.00 -2.21 0.00 0.00 174.62 173.83 1ocz n ALA 14 N -0.41 -0.27 -1.94 11.08 0.00 -1.26 -4.98 120.51 122.73 1ocz n ALA 14 Ca -0.09 0.49 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 1ocz n ALA 14 Cb 0.62 -2.15 0.16 0.00 0.00 0.00 0.00 19.45 18.08 1ocz n ALA 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ocz s PRO 15 N 0.53 0.94 0.28 0.00 0.04 -1.26 -5.01 135.00 130.51 1ocz s PRO 15 Ca 0.82 -0.46 -0.30 0.00 0.04 0.00 0.00 61.00 61.10 1ocz s PRO 15 Cb -0.87 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 31.64 1ocz s PRO 15 CO 0.45 -2.18 1.41 0.12 0.04 0.00 0.00 177.00 176.84 1ocz s PHE 16 N -3.74 3.00 -0.33 0.56 5.36 -1.26 -5.00 117.98 116.58 1ocz s PHE 16 Ca 0.72 1.14 0.03 0.00 -0.96 0.00 0.00 56.93 57.85 1ocz s PHE 16 Cb -0.05 -3.79 0.10 0.00 -0.34 0.00 0.00 43.02 38.94 1ocz s PHE 16 CO 0.51 -2.46 0.05 0.34 -1.46 0.00 0.00 175.22 172.20 1ocz s ASP 17 N 0.11 4.59 0.47 6.13 -1.08 -1.26 -4.99 116.67 120.63 1ocz s ASP 17 Ca 0.56 -2.00 0.31 0.00 -0.52 0.00 0.00 52.55 50.90 1ocz s ASP 17 Cb -0.41 -1.46 1.41 0.00 -1.46 0.00 0.00 42.92 40.99 1ocz s ASP 17 CO 0.47 -0.38 1.70 0.77 0.52 0.00 0.00 175.17 178.25 1ocz h SER 18 N 7.72 0.21 0.60 -0.34 4.64 -1.98 1.03 113.55 125.43 1ocz h SER 18 Ca -0.07 0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1ocz h SER 18 Cb 1.02 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 1ocz h SER 18 CO 0.51 -0.05 -0.20 0.08 -0.87 0.00 0.00 176.83 176.30 1ocz h ARG 19 N 0.14 0.00 -2.18 4.77 0.11 -2.03 -3.13 114.38 112.05 1ocz h ARG 19 Ca 0.72 0.00 -0.60 0.00 0.10 0.00 0.00 59.98 60.20 1ocz h ARG 19 Cb 2.37 0.00 -0.42 0.00 1.11 0.00 0.00 29.97 33.03 1ocz h ARG 19 CO -0.24 0.20 -0.65 1.19 0.10 0.00 0.00 179.97 180.56 1ocz n PHE 20 N -3.57 3.21 1.50 4.08 3.72 0.36 -4.93 117.46 121.82 1ocz n PHE 20 Ca -0.01 -4.10 0.13 0.00 -0.05 0.00 0.00 57.45 53.43 1ocz n PHE 20 Cb 0.34 -0.54 0.53 0.00 -0.94 0.00 0.00 39.48 38.87 1ocz n PHE 20 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1ocz n PRO 21 N 0.92 1.60 -4.13 -1.08 -0.04 -1.17 -4.55 135.00 126.55 1ocz n PRO 21 Ca 0.29 -0.88 -0.23 0.00 -0.04 0.00 0.00 63.50 62.64 1ocz n PRO 21 Cb 0.42 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 32.36 1ocz n PRO 21 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1ocz s ASN 22 N -1.89 4.65 0.44 3.54 0.01 -1.26 -5.00 114.94 115.44 1ocz s ASN 22 Ca 0.37 -0.77 0.32 0.00 -0.71 0.00 0.00 52.86 52.07 1ocz s ASN 22 Cb 0.20 -0.73 1.48 0.00 0.41 0.00 0.00 41.25 42.61 1ocz s ASN 22 CO 0.32 -0.27 1.59 -0.61 -1.51 0.00 0.00 177.10 176.62 1ocz h GLN 23 N 1.58 0.03 -5.91 -0.60 4.15 -2.05 -3.31 115.11 108.99 1ocz h GLN 23 Ca -0.44 -0.00 -0.61 0.00 0.77 0.00 0.00 58.65 58.37 1ocz h GLN 23 Cb 1.25 -0.01 -0.12 0.00 0.21 0.00 0.00 27.48 28.82 1ocz h GLN 23 CO 0.63 0.02 0.57 1.21 -1.93 0.00 0.00 178.83 179.33 1ocz s ASN 24 N -4.33 6.37 0.00 -0.69 3.84 -1.26 -4.87 114.94 113.99 1ocz s ASN 24 Ca -0.08 -0.26 0.25 0.00 0.21 0.00 0.00 52.86 52.98 1ocz s ASN 24 Cb 0.31 -2.44 0.44 0.00 -0.55 0.00 0.00 41.25 39.01 1ocz s ASN 24 CO 0.82 -1.19 1.37 0.00 -2.79 0.00 0.00 177.10 175.32 1ocz n GLN 25 N 7.40 1.21 -0.33 0.43 1.13 -1.25 -4.61 117.38 121.36 1ocz n GLN 25 Ca 0.03 -0.88 0.16 0.00 -1.94 0.00 0.00 57.00 54.37 1ocz n GLN 25 Cb 0.48 -1.48 0.32 0.00 0.11 0.00 0.00 30.24 29.66 1ocz n GLN 25 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1ocz n THR 26 N -0.13 -0.41 0.21 5.09 -1.04 -1.26 0.71 114.28 117.46 1ocz n THR 26 Ca 0.12 2.12 0.08 0.00 -2.04 0.00 0.00 64.05 64.33 1ocz n THR 26 Cb 0.42 -3.13 0.44 0.00 -1.82 0.00 0.00 70.33 66.24 1ocz n THR 26 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1ocz h ARG 27 N 0.00 0.00 -0.33 -2.82 2.47 -1.99 -2.74 114.38 108.96 1ocz h ARG 27 Ca 0.62 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.31 1ocz h ARG 27 Cb 1.33 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.63 1ocz h ARG 27 CO -0.90 0.28 0.10 -0.97 0.56 0.00 0.00 179.97 179.04 1ocz h ASN 28 N 0.00 0.49 0.00 7.04 -0.73 -0.05 0.49 115.58 122.83 1ocz h ASN 28 Ca -0.00 -0.21 -0.00 0.00 1.87 0.00 0.00 56.30 57.96 1ocz h ASN 28 Cb 0.75 -0.13 0.00 0.00 0.27 0.00 0.00 38.32 39.21 1ocz h ASN 28 CO 0.04 0.56 -0.00 0.00 -0.37 0.00 0.00 177.43 177.66 1ocz h TRP 30 N -0.05 0.15 -0.04 0.00 2.91 -1.24 -1.65 115.95 116.04 1ocz h TRP 30 Ca -0.00 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.05 1ocz h TRP 30 Cb 0.04 -0.05 -0.05 0.00 -0.51 0.00 0.00 29.16 28.59 1ocz h TRP 30 CO -0.07 0.17 -0.30 0.37 -1.03 0.00 0.00 178.44 177.58 1ocz h GLN 31 N 0.09 -0.41 -0.74 2.65 5.75 -0.04 -1.82 115.11 120.59 1ocz h GLN 31 Ca 0.04 0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.54 1ocz h GLN 31 Cb 0.07 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1ocz h GLN 31 CO -0.01 -0.27 0.35 -0.91 -2.65 0.00 0.00 178.83 175.34 1ocz h ASN 32 N -0.43 0.98 -0.96 -0.69 2.35 -1.49 0.38 115.58 115.71 1ocz h ASN 32 Ca 0.07 -0.14 0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1ocz h ASN 32 Cb 0.53 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.60 1ocz h ASN 32 CO -0.28 0.84 0.63 0.22 -1.65 0.00 0.00 177.43 177.19 1ocz h TYR 33 N 1.05 1.19 0.08 1.19 5.03 -0.97 0.21 116.97 124.74 1ocz h TYR 33 Ca 0.25 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.59 1ocz h TYR 33 Cb 0.13 -0.40 0.00 0.00 1.55 0.00 0.00 36.73 38.01 1ocz h TYR 33 CO 0.01 0.71 -0.04 -0.07 -1.32 0.00 0.00 178.16 177.45 1ocz h LEU 34 N 1.25 -0.09 -0.49 2.82 3.38 -0.94 -2.94 115.31 118.30 1ocz h LEU 34 Ca 0.37 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 58.05 1ocz h LEU 34 Cb -0.05 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.62 1ocz h LEU 34 CO -0.11 0.36 -0.25 0.44 0.09 0.00 0.00 178.44 178.98 1ocz h ASP 35 N -0.58 -0.84 0.37 -0.43 3.32 0.37 -0.18 116.42 118.44 1ocz h ASP 35 Ca -0.01 0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1ocz h ASP 35 Cb 0.48 0.44 -0.02 0.00 0.22 0.00 0.00 39.33 40.46 1ocz h ASP 35 CO 0.02 -0.26 -0.38 0.15 -1.72 0.00 0.00 179.24 177.04 1ocz h PHE 36 N -0.14 -1.06 -0.59 4.55 3.57 -0.66 -0.07 116.94 122.54 1ocz h PHE 36 Ca 0.22 0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.86 1ocz h PHE 36 Cb 0.49 0.41 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 1ocz h PHE 36 CO -0.52 -0.50 0.40 0.45 -2.23 0.00 0.00 178.31 175.92 1ocz h HIS 37 N -0.75 0.28 -0.19 0.41 3.86 -1.30 0.12 115.15 117.58 1ocz h HIS 37 Ca -0.05 0.01 -0.16 0.00 -1.16 0.00 0.00 60.37 59.01 1ocz h HIS 37 Cb 0.65 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 29.04 1ocz h HIS 37 CO -0.22 0.12 -0.49 0.00 0.86 0.00 0.00 177.93 178.21 1ocz h ARG 38 N 0.26 0.68 -0.07 2.45 3.08 -0.72 -1.40 114.38 118.65 1ocz h ARG 38 Ca 0.28 -0.47 -0.08 0.00 0.07 0.00 0.00 59.98 59.79 1ocz h ARG 38 Cb 0.76 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1ocz h ARG 38 CO -0.06 1.09 -0.31 0.00 -1.07 0.00 0.00 179.97 179.62 1ocz h GLU 40 N 0.11 -0.38 -0.99 0.00 4.81 -0.70 -2.69 114.58 114.74 1ocz h GLU 40 Ca 0.01 0.03 0.26 0.00 -0.13 0.00 0.00 59.36 59.53 1ocz h GLU 40 Cb 0.61 0.09 -0.18 0.00 0.63 0.00 0.00 28.75 29.89 1ocz h GLU 40 CO 0.04 -0.25 -0.03 -0.22 -0.73 0.00 0.00 179.01 177.82 1ocz h LYS 41 N -0.57 0.01 0.25 1.92 3.64 -1.13 0.77 116.57 121.46 1ocz h LYS 41 Ca -0.04 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ocz h LYS 41 Cb 0.30 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 1ocz h LYS 41 CO 0.07 0.00 -0.52 0.00 -2.27 0.00 0.00 179.45 176.73 1ocz h ALA 42 N 1.99 -1.05 -0.63 5.00 0.00 -1.20 0.11 119.26 123.46 1ocz h ALA 42 Ca 0.57 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.43 1ocz h ALA 42 Cb 1.12 0.85 -0.07 0.00 0.00 0.00 0.00 17.79 19.69 1ocz h ALA 42 CO -0.95 -1.15 0.28 0.52 0.00 0.00 0.00 179.25 177.96 1ocz h MET 43 N -0.84 0.48 -0.39 0.00 2.86 -0.57 -1.99 114.93 114.49 1ocz h MET 43 Ca -0.03 -0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.65 1ocz h MET 43 Cb 0.79 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 32.29 1ocz h MET 43 CO -0.21 0.32 0.07 1.15 1.06 0.00 0.00 176.91 179.30 1ocz h THR 44 N 0.50 0.79 -0.30 2.22 2.02 -0.45 1.19 112.91 118.88 1ocz h THR 44 Ca 0.31 -0.07 -0.23 0.00 0.77 0.00 0.00 66.41 67.20 1ocz h THR 44 Cb 0.34 0.58 -0.09 0.00 -1.74 0.00 0.00 68.15 67.24 1ocz h THR 44 CO -0.27 0.04 0.00 0.00 0.37 0.00 0.00 175.52 175.66 1ocz n ALA 45 N -2.44 5.59 -0.10 6.16 0.00 0.31 -3.19 120.51 126.84 1ocz n ALA 45 Ca 0.02 -1.59 0.00 0.00 0.00 0.00 0.00 53.44 51.87 1ocz n ALA 45 Cb 0.18 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 17.83 1ocz n ALA 45 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ocz n LYS 46 N 1.56 0.00 0.00 0.00 4.81 -0.60 -4.98 118.16 118.95 1ocz n LYS 46 Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 1ocz n LYS 46 Cb 0.68 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.73 1ocz n LYS 46 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ocz n GLY 47 N 0.00 1.17 3.10 3.14 0.00 0.40 -4.65 105.19 108.35 1ocz n GLY 47 Ca 0.00 0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 1ocz n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ocz n GLY 48 N 0.00 -0.25 2.72 -0.02 0.00 -1.26 -0.99 105.19 105.39 1ocz n GLY 48 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 1ocz n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ocz n ASP 49 N -2.48 -5.31 -1.85 1.61 9.92 -1.26 -1.88 116.55 115.31 1ocz n ASP 49 Ca -0.12 0.12 -0.04 0.00 -0.53 0.00 0.00 54.79 54.22 1ocz n ASP 49 Cb 0.59 -3.25 0.02 0.00 -0.64 0.00 0.00 41.12 37.85 1ocz n ASP 49 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1ocz n VAL 50 N -2.28 -2.56 -1.94 2.53 0.31 -0.17 -5.07 118.33 109.15 1ocz n VAL 50 Ca -0.05 -0.27 -0.31 0.00 -0.01 0.00 0.00 64.34 63.70 1ocz n VAL 50 Cb 0.45 -3.63 0.01 0.00 -0.91 0.00 0.00 33.84 29.75 1ocz n VAL 50 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1ocz s SER 51 N -3.23 6.15 -0.17 4.52 1.04 -0.79 -5.10 113.70 116.14 1ocz s SER 51 Ca 0.07 1.50 -0.06 0.00 0.48 0.00 0.00 55.95 57.95 1ocz s SER 51 Cb -0.01 -2.49 0.08 0.00 0.10 0.00 0.00 66.02 63.70 1ocz s SER 51 CO 0.20 -0.92 0.35 0.68 0.98 0.00 0.00 173.24 174.54 1ocz s VAL 52 N -3.00 -0.55 -1.29 5.02 -7.23 -1.26 -4.87 120.40 107.22 1ocz s VAL 52 Ca 0.57 0.22 -0.16 0.00 -1.81 0.00 0.00 61.98 60.80 1ocz s VAL 52 Cb -0.12 -0.57 0.10 0.00 0.56 0.00 0.00 36.38 36.36 1ocz s VAL 52 CO 0.48 0.09 1.71 0.00 -0.31 0.00 0.00 175.10 177.07 1ocz h GLU 54 N 7.15 0.50 -0.75 0.00 4.57 -1.98 -3.38 114.58 120.69 1ocz h GLU 54 Ca 0.42 -0.51 0.16 0.00 -1.18 0.00 0.00 59.36 58.25 1ocz h GLU 54 Cb 0.83 0.14 -0.14 0.00 -0.16 0.00 0.00 28.75 29.42 1ocz h GLU 54 CO 1.45 1.15 -0.11 2.35 -1.18 0.00 0.00 179.01 182.67 1ocz h TRP 55 N 0.30 -0.26 -0.03 0.92 2.91 -2.00 0.28 115.95 118.05 1ocz h TRP 55 Ca -0.08 0.06 0.01 0.00 1.13 0.00 0.00 58.89 60.01 1ocz h TRP 55 Cb 1.56 0.24 -0.00 0.00 -0.51 0.00 0.00 29.16 30.44 1ocz h TRP 55 CO 0.07 -0.30 0.02 1.88 -1.03 0.00 0.00 178.44 179.09 1ocz h TYR 56 N 0.03 0.00 0.06 2.65 0.05 -1.91 -2.06 116.97 115.79 1ocz h TYR 56 Ca 0.38 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 59.05 1ocz h TYR 56 Cb 0.63 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.38 1ocz h TYR 56 CO -0.53 0.00 -0.46 -0.09 -1.05 0.00 0.00 178.16 176.03 1ocz h ARG 57 N 0.00 0.21 -0.99 4.88 2.43 -0.70 -2.46 114.38 117.75 1ocz h ARG 57 Ca 0.01 -0.30 0.08 0.00 -0.81 0.00 0.00 59.98 58.96 1ocz h ARG 57 Cb 0.06 0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 29.65 1ocz h ARG 57 CO -0.00 1.10 0.64 0.00 -1.51 0.00 0.00 179.97 180.20 1ocz h ARG 58 N -0.53 1.08 0.35 0.20 2.47 -1.02 0.15 114.38 117.07 1ocz h ARG 58 Ca -0.08 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.56 1ocz h ARG 58 Cb 1.31 -0.24 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1ocz h ARG 58 CO 0.09 0.71 -0.17 0.28 0.56 0.00 0.00 179.97 181.44 1ocz h VAL 59 N 1.11 0.00 -0.13 2.04 2.07 -1.48 -2.27 116.25 117.59 1ocz h VAL 59 Ca 0.44 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1ocz h VAL 59 Cb 0.25 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1ocz h VAL 59 CO -0.19 0.00 0.34 0.10 0.02 0.00 0.00 177.57 177.84 1ocz h TYR 60 N -0.88 0.00 -0.21 1.57 -0.00 -1.40 0.21 116.97 116.26 1ocz h TYR 60 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.54 1ocz h TYR 60 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.09 1ocz h TYR 60 CO 0.03 0.00 -0.42 0.87 -0.00 0.00 0.00 178.16 178.63 1ocz h LYS 61 N 0.00 0.65 -0.10 0.10 1.79 -0.87 -1.73 116.57 116.42 1ocz h LYS 61 Ca 0.06 -0.42 -0.02 0.00 -2.18 0.00 0.00 60.65 58.09 1ocz h LYS 61 Cb 0.74 0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1ocz h LYS 61 CO -0.00 1.04 -0.01 0.77 -1.08 0.00 0.00 179.45 180.17 1ocz h SER 62 N 0.34 0.18 0.19 0.86 0.02 -0.00 -3.38 113.55 111.76 1ocz h SER 62 Ca 0.01 -0.33 -0.29 0.00 -0.84 0.00 0.00 61.79 60.34 1ocz h SER 62 Cb 1.02 -0.05 0.02 0.00 0.14 0.00 0.00 62.40 63.54 1ocz h SER 62 CO 0.09 0.46 -1.33 -0.07 -1.14 0.00 0.00 176.83 174.84 1ocz h LEU 63 N -0.12 0.64 -9.56 5.07 3.38 -1.46 -3.47 115.31 109.79 1ocz h LEU 63 Ca 0.03 -0.92 -0.53 0.00 0.09 0.00 0.00 57.88 56.55 1ocz h LEU 63 Cb 0.38 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1ocz h LEU 63 CO 0.01 1.63 0.48 0.00 0.09 0.00 0.00 178.44 180.64 1ocz s PRO 65 N 0.32 3.58 0.25 0.00 0.04 -1.26 -4.87 135.00 133.05 1ocz s PRO 65 Ca 0.52 1.75 -0.09 0.00 0.04 0.00 0.00 61.00 63.22 1ocz s PRO 65 Cb -0.28 -2.26 0.41 0.00 0.04 0.00 0.00 34.50 32.42 1ocz s PRO 65 CO 0.32 -0.70 1.59 0.82 0.04 0.00 0.00 177.00 179.07 1ocz h ILE 66 N 1.61 0.17 -0.77 0.56 5.03 -1.94 -1.00 117.51 121.16 1ocz h ILE 66 Ca -0.50 -0.01 0.12 0.00 -0.12 0.00 0.00 64.86 64.36 1ocz h ILE 66 Cb 1.26 0.15 -0.09 0.00 -3.03 0.00 0.00 36.82 35.11 1ocz h ILE 66 CO 0.59 0.00 0.36 0.28 -0.68 0.00 0.00 178.15 178.70 1ocz h SER 67 N 0.01 0.43 0.35 1.72 0.02 -1.99 0.95 113.55 115.04 1ocz h SER 67 Ca 0.42 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.44 1ocz h SER 67 Cb 0.69 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1ocz h SER 67 CO -0.84 0.20 -0.18 -0.50 -1.14 0.00 0.00 176.83 174.37 1ocz h TRP 68 N 0.56 -0.47 -0.37 3.45 4.06 -1.55 -0.96 115.95 120.68 1ocz h TRP 68 Ca 0.41 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.35 1ocz h TRP 68 Cb 0.54 0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.84 1ocz h TRP 68 CO -0.12 -0.29 0.23 0.28 -3.56 0.00 0.00 178.44 174.98 1ocz h VAL 69 N -0.49 1.11 0.01 1.49 2.07 -1.18 0.14 116.25 119.39 1ocz h VAL 69 Ca -0.05 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.27 1ocz h VAL 69 Cb 0.39 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 1ocz h VAL 69 CO 0.07 0.11 -0.23 0.28 0.02 0.00 0.00 177.57 177.82 1ocz h SER 70 N 0.48 -0.67 0.44 0.57 0.02 -0.70 -0.00 113.55 113.70 1ocz h SER 70 Ca 0.13 0.09 -0.08 0.00 -0.84 0.00 0.00 61.79 61.09 1ocz h SER 70 Cb -0.02 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1ocz h SER 70 CO -0.03 -0.30 -0.40 0.71 -1.14 0.00 0.00 176.83 175.68 1ocz h THR 71 N -0.36 1.23 -0.14 -2.27 1.35 -0.91 -1.60 112.91 110.21 1ocz h THR 71 Ca 0.06 -1.39 -0.03 0.00 -0.55 0.00 0.00 66.41 64.50 1ocz h THR 71 Cb 0.44 1.76 -0.00 0.00 -1.73 0.00 0.00 68.15 68.62 1ocz h THR 71 CO -0.20 0.39 -0.03 -0.50 -0.25 0.00 0.00 175.52 174.93 1ocz h TRP 72 N 0.00 0.30 0.29 4.73 6.55 -0.15 -1.94 115.95 125.73 1ocz h TRP 72 Ca -0.00 -0.06 -0.00 0.00 0.95 0.00 0.00 58.89 59.77 1ocz h TRP 72 Cb 0.73 -0.07 -0.01 0.00 -0.86 0.00 0.00 29.16 28.94 1ocz h TRP 72 CO 0.00 0.55 -0.21 -0.44 -1.05 0.00 0.00 178.44 177.29 1ocz h ASP 73 N -0.03 -0.54 -0.90 -3.49 3.32 -0.81 0.06 116.42 114.04 1ocz h ASP 73 Ca 0.04 0.04 0.25 0.00 0.02 0.00 0.00 57.03 57.37 1ocz h ASP 73 Cb 0.45 0.17 -0.14 0.00 0.22 0.00 0.00 39.33 40.02 1ocz h ASP 73 CO 0.01 -0.33 0.27 0.44 -1.72 0.00 0.00 179.24 177.91 1ocz h ASP 74 N -0.50 0.04 -0.42 6.45 5.19 -1.27 0.46 116.42 126.38 1ocz h ASP 74 Ca -0.02 0.20 -0.05 0.00 -0.62 0.00 0.00 57.03 56.53 1ocz h ASP 74 Cb 0.43 0.26 -0.02 0.00 0.18 0.00 0.00 39.33 40.19 1ocz h ASP 74 CO -0.00 -0.16 0.05 0.03 -3.12 0.00 0.00 179.24 176.03 1ocz h ARG 75 N 0.21 0.70 -0.20 3.56 -0.00 -0.60 0.08 114.38 118.13 1ocz h ARG 75 Ca 0.58 -0.20 -0.04 0.00 -0.50 0.00 0.00 59.98 59.81 1ocz h ARG 75 Cb 1.19 -0.08 -0.01 0.00 0.00 0.00 0.00 29.97 31.07 1ocz h ARG 75 CO -0.66 0.76 -0.06 0.00 0.00 0.00 0.00 179.97 180.00 1ocz h ARG 76 N 0.55 0.31 0.43 0.04 3.08 0.17 0.32 114.38 119.27 1ocz h ARG 76 Ca 0.12 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 1ocz h ARG 76 Cb 0.41 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1ocz h ARG 76 CO 0.01 0.39 -0.21 0.00 -1.07 0.00 0.00 179.97 179.09 1ocz h ALA 77 N 1.65 -0.57 0.00 0.04 0.00 -0.31 -3.00 119.26 117.07 1ocz h ALA 77 Ca 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ocz h ALA 77 Cb 0.30 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ocz h ALA 77 CO 0.01 -0.59 0.00 -0.85 0.00 0.00 0.00 179.25 177.82 1ocz n GLU 78 N -5.18 0.61 -1.18 0.00 0.28 -0.02 -4.83 120.64 110.33 1ocz n GLU 78 Ca -0.09 0.00 -0.06 0.00 -0.16 0.00 0.00 57.16 56.85 1ocz n GLU 78 Cb 0.28 -1.36 -0.03 0.00 1.43 0.00 0.00 31.44 31.76 1ocz n GLU 78 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ocz n GLY 79 N 0.19 0.82 1.43 -1.84 0.00 0.79 -4.91 105.19 101.68 1ocz n GLY 79 Ca 0.11 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.79 1ocz n GLY 79 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ocz n THR 80 N -2.68 2.21 -2.59 2.61 -2.24 0.67 -4.94 114.28 107.33 1ocz n THR 80 Ca -0.06 -1.44 -0.43 0.00 -2.27 0.00 0.00 64.05 59.85 1ocz n THR 80 Cb 0.27 -0.08 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1ocz n THR 80 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1ocz s PHE 81 N -2.36 2.79 -2.00 4.78 5.36 -1.11 -4.89 117.98 120.55 1ocz s PHE 81 Ca 0.48 0.70 0.12 0.00 -0.96 0.00 0.00 56.93 57.27 1ocz s PHE 81 Cb 0.35 -4.45 0.72 0.00 -0.34 0.00 0.00 43.02 39.30 1ocz s PHE 81 CO 0.17 -1.32 1.14 -0.35 -1.46 0.00 0.00 175.22 173.40 1ocz n PRO 82 N 7.88 0.46 -3.21 10.12 -0.04 -1.26 -4.77 135.00 144.18 1ocz n PRO 82 Ca 0.12 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.27 1ocz n PRO 82 Cb 0.49 -1.41 -0.05 0.00 -0.04 0.00 0.00 33.50 32.49 1ocz n PRO 82 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ocz s GLY 83 N -1.92 2.20 -0.46 0.55 0.00 -1.26 -5.04 107.32 101.39 1ocz s GLY 83 Ca 0.18 -0.17 -0.18 0.00 0.00 0.00 0.00 44.72 44.55 1ocz s GLY 83 CO 0.14 -0.00 0.50 1.25 0.00 0.00 0.00 173.10 174.98 1ocz s LYS 84 N -3.13 3.08 0.00 2.90 2.47 -1.26 -5.18 119.74 118.61 1ocz s LYS 84 Ca 0.50 -0.94 0.05 0.00 -1.56 0.00 0.00 55.97 54.01 1ocz s LYS 84 Cb -0.11 -4.05 0.04 0.00 -1.46 0.00 0.00 37.83 32.25 1ocz s LYS 84 CO 0.22 -1.03 0.65 -0.89 0.16 0.00 0.00 175.35 174.47