#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oyi n SER 14 N 0.00 0.00 -0.05 0.55 7.64 -1.26 -4.98 113.62 115.52 1oyi n SER 14 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1oyi n SER 14 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 1oyi n SER 14 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1oyi n ASN 15 N 0.00 1.72 -0.33 6.43 5.15 -1.26 -4.28 115.26 122.69 1oyi n ASN 15 Ca 0.00 0.06 0.20 0.00 -0.60 0.00 0.00 54.58 54.24 1oyi n ASN 15 Cb 0.00 -0.24 0.39 0.00 -0.53 0.00 0.00 39.78 39.40 1oyi n ASN 15 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1oyi h ALA 16 N -0.22 1.53 -0.44 5.20 0.00 -1.96 2.12 119.26 125.48 1oyi h ALA 16 Ca -0.24 0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1oyi h ALA 16 Cb 1.27 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1oyi h ALA 16 CO -0.11 -0.67 -0.29 1.05 0.00 0.00 0.00 179.25 179.24 1oyi h GLU 17 N 0.06 0.97 -0.27 0.00 -0.00 -1.95 -0.69 114.58 112.70 1oyi h GLU 17 Ca 0.67 -0.46 -0.12 0.00 -0.00 0.00 0.00 59.36 59.46 1oyi h GLU 17 Cb 1.54 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 30.26 1oyi h GLU 17 CO -0.81 1.13 -0.32 0.82 -0.00 0.00 0.00 179.01 179.83 1oyi h ILE 18 N 0.82 1.28 -0.52 -1.06 1.08 0.23 0.25 117.51 119.60 1oyi h ILE 18 Ca 0.09 -1.42 -0.10 0.00 -0.39 0.00 0.00 64.86 63.03 1oyi h ILE 18 Cb 0.88 1.42 -0.02 0.00 -3.07 0.00 0.00 36.82 36.03 1oyi h ILE 18 CO 0.08 0.45 -0.07 0.58 -0.69 0.00 0.00 178.15 178.50 1oyi h VAL 19 N 0.49 1.27 -0.57 1.67 2.07 0.28 0.78 116.25 122.24 1oyi h VAL 19 Ca 0.06 -1.21 -0.10 0.00 0.82 0.00 0.00 66.70 66.27 1oyi h VAL 19 Cb 0.79 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1oyi h VAL 19 CO 0.06 0.42 -0.03 0.00 0.02 0.00 0.00 177.57 178.05 1oyi h GLU 21 N 0.93 0.36 0.23 0.00 4.22 -0.63 -0.95 114.58 118.73 1oyi h GLU 21 Ca 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 59.36 59.49 1oyi h GLU 21 Cb 0.59 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1oyi h GLU 21 CO 0.04 0.50 -0.11 0.00 -2.18 0.00 0.00 179.01 177.26 1oyi h ALA 22 N 1.52 -0.38 -1.08 2.92 0.00 -0.34 -0.96 119.26 120.94 1oyi h ALA 22 Ca 0.06 -0.07 0.34 0.00 0.00 0.00 0.00 54.91 55.25 1oyi h ALA 22 Cb 0.46 0.12 -0.14 0.00 0.00 0.00 0.00 17.79 18.23 1oyi h ALA 22 CO 0.03 -0.36 0.65 0.97 0.00 0.00 0.00 179.25 180.53 1oyi h ILE 23 N -0.84 0.28 -0.15 0.00 2.10 -0.64 1.01 117.51 119.28 1oyi h ILE 23 Ca -0.03 -0.09 -0.04 0.00 1.08 0.00 0.00 64.86 65.77 1oyi h ILE 23 Cb 0.24 -0.01 -0.00 0.00 -1.09 0.00 0.00 36.82 35.95 1oyi h ILE 23 CO 0.05 0.05 -0.08 0.50 -1.08 0.00 0.00 178.15 177.59 1oyi h LYS 24 N 0.27 0.32 -0.06 2.19 3.11 -1.20 -2.76 116.57 118.44 1oyi h LYS 24 Ca 0.74 -0.14 0.02 0.00 -2.81 0.00 0.00 60.65 58.45 1oyi h LYS 24 Cb 1.87 -0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 33.09 1oyi h LYS 24 CO -0.52 0.65 0.05 1.15 -2.81 0.00 0.00 179.45 177.96 1oyi h THR 25 N -0.02 0.80 0.00 1.00 2.02 0.23 -3.32 112.91 113.62 1oyi h THR 25 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.21 1oyi h THR 25 Cb 0.56 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1oyi h THR 25 CO 0.02 0.00 0.00 -0.38 0.37 0.00 0.00 175.52 175.53 1oyi n ILE 26 N -4.27 0.00 0.00 3.11 2.08 0.11 -5.01 119.36 115.38 1oyi n ILE 26 Ca -0.02 0.15 0.00 0.00 0.56 0.00 0.00 62.75 63.45 1oyi n ILE 26 Cb 0.15 -1.12 0.00 0.00 -0.75 0.00 0.00 39.64 37.92 1oyi n ILE 26 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1oyi n GLY 27 N 0.10 1.95 0.00 7.39 0.00 -1.22 -4.82 105.19 108.59 1oyi n GLY 27 Ca 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 46.02 45.66 1oyi n GLY 27 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1oyi n ILE 28 N 0.00 0.02 0.21 -0.61 -0.00 -1.26 -4.57 119.36 113.15 1oyi n ILE 28 Ca 0.00 -0.01 0.05 0.00 -0.00 0.00 0.00 62.75 62.78 1oyi n ILE 28 Cb 0.00 -0.91 0.22 0.00 -0.00 0.00 0.00 39.64 38.96 1oyi n ILE 28 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1oyi n GLU 29 N -2.10 0.04 0.00 6.28 4.07 -1.26 -4.90 120.64 122.77 1oyi n GLU 29 Ca -0.01 0.44 0.00 0.00 -0.06 0.00 0.00 57.16 57.53 1oyi n GLU 29 Cb 0.51 -1.60 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 1oyi n GLU 29 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1oyi n GLY 30 N -0.87 0.55 2.70 8.31 0.00 -1.26 -4.30 105.19 110.31 1oyi n GLY 30 Ca 0.01 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 1oyi n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oyi s ALA 31 N -0.77 2.12 0.93 4.61 0.00 0.13 -4.87 121.76 123.91 1oyi s ALA 31 Ca 0.00 -2.58 0.00 0.00 0.00 0.00 0.00 51.96 49.38 1oyi s ALA 31 Cb 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 23.12 21.24 1oyi s ALA 31 CO 0.00 -2.06 0.00 -2.37 0.00 0.00 0.00 175.76 171.33 1oyi n THR 32 N 3.55 0.00 0.00 0.00 5.66 -1.26 -1.45 114.28 120.78 1oyi n THR 32 Ca 0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.09 1oyi n THR 32 Cb 0.35 -1.78 0.00 0.00 -1.55 0.00 0.00 70.33 67.35 1oyi n THR 32 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1oyi n ALA 33 N -3.00 -0.13 -0.34 1.79 0.00 -1.25 -3.05 120.51 114.53 1oyi n ALA 33 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1oyi n ALA 33 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1oyi n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oyi n ALA 34 N -1.22 -0.43 -0.74 0.00 0.00 -1.26 0.08 120.51 116.95 1oyi n ALA 34 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 53.44 54.18 1oyi n ALA 34 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1oyi n ALA 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1oyi n GLN 35 N -5.08 0.00 -0.25 0.00 1.13 -1.25 0.49 117.38 112.41 1oyi n GLN 35 Ca 0.03 0.18 -0.03 0.00 -1.94 0.00 0.00 57.00 55.25 1oyi n GLN 35 Cb 0.24 -0.55 0.03 0.00 0.11 0.00 0.00 30.24 30.07 1oyi n GLN 35 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1oyi h LEU 36 N 0.00 -1.13 -1.25 1.08 4.07 -1.34 1.56 115.31 118.30 1oyi h LEU 36 Ca 0.00 0.24 0.26 0.00 0.08 0.00 0.00 57.88 58.46 1oyi h LEU 36 Cb 0.00 0.59 -0.04 0.00 1.08 0.00 0.00 40.66 42.30 1oyi h LEU 36 CO 0.00 -0.29 1.06 0.74 -1.08 0.00 0.00 178.44 178.86 1oyi h THR 37 N -0.10 0.07 0.09 0.22 2.02 0.13 1.22 112.91 116.57 1oyi h THR 37 Ca 0.28 0.00 -0.36 0.00 0.77 0.00 0.00 66.41 67.10 1oyi h THR 37 Cb 0.56 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 1oyi h THR 37 CO -0.76 0.00 -2.00 0.54 0.37 0.00 0.00 175.52 173.67 1oyi n ARG 38 N -3.33 0.72 -0.14 6.66 5.12 0.52 0.01 116.66 126.22 1oyi n ARG 38 Ca 0.20 0.28 0.27 0.00 -1.93 0.00 0.00 57.85 56.67 1oyi n ARG 38 Cb 1.34 -1.68 0.72 0.00 -1.16 0.00 0.00 32.46 31.67 1oyi n ARG 38 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1oyi h GLN 39 N -0.09 0.00 0.00 5.56 7.50 0.30 -3.37 115.11 125.01 1oyi h GLN 39 Ca -0.45 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.70 1oyi h GLN 39 Cb 1.92 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.45 1oyi h GLN 39 CO 0.02 0.00 0.00 1.47 -1.50 0.00 0.00 178.83 178.82 1oyi n LEU 40 N -4.25 0.00 -0.70 1.46 -0.00 -0.50 -5.05 117.00 107.97 1oyi n LEU 40 Ca 0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 56.01 56.14 1oyi n LEU 40 Cb 0.89 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 44.28 1oyi n LEU 40 CO 0.38 0.00 0.26 0.59 -0.00 0.00 0.00 177.39 178.62 1oyi n ASN 41 N 0.00 -0.46 -1.53 1.45 5.03 -1.21 -5.00 115.26 113.54 1oyi n ASN 41 Ca 0.00 -1.32 -0.03 0.00 0.87 0.00 0.00 54.58 54.10 1oyi n ASN 41 Cb 0.00 0.14 0.02 0.00 -1.02 0.00 0.00 39.78 38.91 1oyi n ASN 41 CO 0.00 0.00 0.00 0.80 -1.83 0.00 0.00 177.26 176.23 1oyi n MET 42 N 0.00 -1.10 -3.11 3.52 0.00 0.10 -5.00 117.12 111.53 1oyi n MET 42 Ca -0.13 0.16 -0.36 0.00 0.00 0.00 0.00 57.70 57.38 1oyi n MET 42 Cb 0.54 -2.99 -0.03 0.00 0.00 0.00 0.00 33.22 30.75 1oyi n MET 42 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1oyi n GLU 43 N -1.64 3.78 -0.61 2.12 1.02 -1.26 -4.85 120.64 119.20 1oyi n GLU 43 Ca -0.05 -4.64 0.48 0.00 -0.02 0.00 0.00 57.16 52.94 1oyi n GLU 43 Cb 0.53 -2.39 0.76 0.00 -0.02 0.00 0.00 31.44 30.31 1oyi n GLU 43 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1oyi h LYS 44 N 4.66 0.00 -0.07 3.49 3.64 -1.95 1.91 116.57 128.25 1oyi h LYS 44 Ca 0.23 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1oyi h LYS 44 Cb 0.59 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1oyi h LYS 44 CO 1.10 0.00 0.03 0.00 -2.27 0.00 0.00 179.45 178.31 1oyi h ARG 45 N 0.00 0.10 0.16 1.90 3.08 -1.98 0.61 114.38 118.25 1oyi h ARG 45 Ca 0.85 -0.02 -0.29 0.00 0.07 0.00 0.00 59.98 60.58 1oyi h ARG 45 Cb 3.57 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 33.62 1oyi h ARG 45 CO -0.01 0.24 -1.34 1.05 -1.07 0.00 0.00 179.97 178.84 1oyi h GLU 46 N -0.06 0.33 0.00 0.04 4.11 0.22 -1.55 114.58 117.68 1oyi h GLU 46 Ca 0.02 -0.57 -0.04 0.00 0.07 0.00 0.00 59.36 58.84 1oyi h GLU 46 Cb 0.18 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1oyi h GLU 46 CO -0.00 1.26 -0.21 -0.24 0.07 0.00 0.00 179.01 179.89 1oyi h VAL 47 N 0.09 0.68 0.05 -1.06 3.04 0.29 0.39 116.25 119.74 1oyi h VAL 47 Ca -0.18 -0.89 -0.16 0.00 -1.01 0.00 0.00 66.70 64.46 1oyi h VAL 47 Cb 2.03 1.56 -0.01 0.00 -2.01 0.00 0.00 31.29 32.86 1oyi h VAL 47 CO 0.22 0.20 -0.81 -1.13 -1.01 0.00 0.00 177.57 175.04 1oyi h ASN 48 N 0.00 0.18 0.12 3.17 -1.24 0.23 -0.99 115.58 117.05 1oyi h ASN 48 Ca -0.00 -0.84 -0.05 0.00 0.71 0.00 0.00 56.30 56.13 1oyi h ASN 48 Cb 0.55 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.53 1oyi h ASN 48 CO 0.03 1.35 -0.17 0.07 -1.29 0.00 0.00 177.43 177.41 1oyi h LYS 49 N -0.71 0.11 0.02 6.67 2.10 -1.11 0.48 116.57 124.13 1oyi h LYS 49 Ca -0.19 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.44 1oyi h LYS 49 Cb 1.38 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1oyi h LYS 49 CO -0.01 0.29 -0.01 0.00 -2.00 0.00 0.00 179.45 177.71 1oyi h ALA 50 N 1.72 -0.03 -0.45 0.07 0.00 -0.32 -1.52 119.26 118.74 1oyi h ALA 50 Ca 0.02 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.61 1oyi h ALA 50 Cb 0.37 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1oyi h ALA 50 CO 0.02 -0.07 0.30 -0.07 0.00 0.00 0.00 179.25 179.43 1oyi h LEU 51 N -0.92 0.40 0.40 0.00 3.38 -0.98 0.12 115.31 117.70 1oyi h LEU 51 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1oyi h LEU 51 Cb 0.73 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1oyi h LEU 51 CO 0.01 0.27 -0.19 0.22 0.09 0.00 0.00 178.44 178.84 1oyi h TYR 52 N 0.46 -0.49 -0.89 1.13 3.20 -0.09 0.49 116.97 120.78 1oyi h TYR 52 Ca 0.19 -0.01 0.20 0.00 3.14 0.00 0.00 58.73 62.24 1oyi h TYR 52 Cb 0.17 0.16 -0.11 0.00 1.54 0.00 0.00 36.73 38.49 1oyi h TYR 52 CO -0.00 -0.31 0.43 0.22 -1.64 0.00 0.00 178.16 176.86 1oyi h ASP 53 N -0.91 0.43 -0.57 -2.11 3.58 -1.09 0.68 116.42 116.44 1oyi h ASP 53 Ca -0.05 0.13 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 1oyi h ASP 53 Cb 0.41 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.51 1oyi h ASP 53 CO 0.09 0.09 0.08 -0.07 -2.88 0.00 0.00 179.24 176.55 1oyi h LEU 54 N 0.50 0.95 -0.67 2.28 3.38 -0.80 0.46 115.31 121.41 1oyi h LEU 54 Ca 0.53 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 1oyi h LEU 54 Cb 0.93 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1oyi h LEU 54 CO -0.46 0.96 0.39 -0.61 0.09 0.00 0.00 178.44 178.81 1oyi h GLN 55 N 0.93 0.92 0.00 1.13 5.75 0.26 0.20 115.11 124.29 1oyi h GLN 55 Ca 0.18 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.59 1oyi h GLN 55 Cb 0.43 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.79 1oyi h GLN 55 CO 0.01 0.67 -0.04 0.00 -2.65 0.00 0.00 178.83 176.82 1oyi h ARG 56 N 0.91 0.00 0.04 1.69 2.47 -0.44 -3.16 114.38 115.89 1oyi h ARG 56 Ca 0.24 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.73 1oyi h ARG 56 Cb -0.00 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.30 1oyi h ARG 56 CO -0.04 0.00 -1.10 0.77 0.56 0.00 0.00 179.97 180.15 1oyi h SER 57 N 0.00 0.13 0.00 7.04 0.02 0.94 -3.47 113.55 118.20 1oyi h SER 57 Ca 0.00 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1oyi h SER 57 Cb 0.88 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.38 1oyi h SER 57 CO 0.00 1.11 0.00 0.00 -1.14 0.00 0.00 176.83 176.80 1oyi n ALA 58 N -2.42 0.00 0.24 3.77 0.00 0.60 -4.92 120.51 117.78 1oyi n ALA 58 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.54 1oyi n ALA 58 Cb 0.97 -0.27 0.34 0.00 0.00 0.00 0.00 19.45 20.49 1oyi n ALA 58 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1oyi h MET 59 N 0.52 0.00 -4.80 0.00 2.86 -1.80 -3.46 114.93 108.25 1oyi h MET 59 Ca 0.00 0.00 -0.43 0.00 -2.06 0.00 0.00 59.70 57.21 1oyi h MET 59 Cb 0.00 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 31.53 1oyi h MET 59 CO 0.00 0.02 -0.48 0.14 1.06 0.00 0.00 176.91 177.66 1oyi s VAL 60 N -3.36 0.00 0.34 -2.22 -7.23 -1.26 -4.82 120.40 101.85 1oyi s VAL 60 Ca 0.05 -1.96 0.07 0.00 -1.81 0.00 0.00 61.98 58.32 1oyi s VAL 60 Cb 0.06 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 1oyi s VAL 60 CO 0.63 0.00 0.26 -1.22 -0.31 0.00 0.00 175.10 174.46 1oyi n TYR 61 N -0.58 -0.63 -4.42 2.82 4.02 0.28 -4.76 117.16 113.89 1oyi n TYR 61 Ca 0.06 -2.75 -0.27 0.00 -0.01 0.00 0.00 57.90 54.94 1oyi n TYR 61 Cb 0.63 0.24 -0.11 0.00 -0.02 0.00 0.00 39.34 40.07 1oyi n TYR 61 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1oyi s SER 62 N -3.34 3.50 0.32 7.72 0.15 -1.26 -0.66 113.70 120.14 1oyi s SER 62 Ca 0.36 -0.86 0.24 0.00 0.70 0.00 0.00 55.95 56.39 1oyi s SER 62 Cb 0.02 -0.29 0.50 0.00 -1.71 0.00 0.00 66.02 64.54 1oyi s SER 62 CO 0.26 0.11 1.63 -1.28 1.20 0.00 0.00 173.24 175.16 1oyi h SER 63 N 3.10 0.00 -2.59 5.45 0.87 -1.58 -3.44 113.55 115.36 1oyi h SER 63 Ca -0.46 -0.01 -0.41 0.00 -1.23 0.00 0.00 61.79 59.68 1oyi h SER 63 Cb 1.21 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.12 1oyi h SER 63 CO 0.49 0.01 -0.50 0.47 -0.53 0.00 0.00 176.83 176.77 1oyi n ASP 64 N -2.71 -5.77 -3.99 6.23 8.00 -1.26 -4.94 116.55 112.10 1oyi n ASP 64 Ca 0.04 0.10 -0.10 0.00 0.71 0.00 0.00 54.79 55.55 1oyi n ASP 64 Cb 0.49 -4.87 -0.07 0.00 -0.02 0.00 0.00 41.12 36.65 1oyi n ASP 64 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1oyi s ASP 65 N -2.20 0.00 -0.14 -2.24 2.15 -1.26 -5.13 116.67 107.84 1oyi s ASP 65 Ca 0.00 -0.94 -0.06 0.00 0.43 0.00 0.00 52.55 51.98 1oyi s ASP 65 Cb 0.00 0.48 -0.04 0.00 -0.30 0.00 0.00 42.92 43.06 1oyi s ASP 65 CO 0.00 -0.97 0.09 -0.51 -0.17 0.00 0.00 175.17 173.61 1oyi s ILE 66 N -4.00 5.04 0.90 4.11 2.07 -1.26 -2.83 121.20 125.22 1oyi s ILE 66 Ca 0.21 0.04 -0.12 0.00 -1.41 0.00 0.00 60.65 59.37 1oyi s ILE 66 Cb 0.02 -3.21 0.13 0.00 0.13 0.00 0.00 42.46 39.53 1oyi s ILE 66 CO 0.04 0.55 1.13 -2.16 -1.91 0.00 0.00 174.94 172.59 1oyi s PRO 67 N -0.44 1.24 -0.24 3.50 0.04 -1.26 -5.08 135.00 132.77 1oyi s PRO 67 Ca 0.10 0.33 -0.29 0.00 0.04 0.00 0.00 61.00 61.18 1oyi s PRO 67 Cb -0.12 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 1oyi s PRO 67 CO 0.02 -2.14 1.31 -1.25 0.04 0.00 0.00 177.00 174.99 1oyi s PRO 68 N -5.27 4.04 -0.07 0.56 0.04 -1.13 -4.93 135.00 128.24 1oyi s PRO 68 Ca 0.63 1.46 0.02 0.00 0.04 0.00 0.00 61.00 63.15 1oyi s PRO 68 Cb -0.15 -3.85 0.01 0.00 0.04 0.00 0.00 34.50 30.56 1oyi s PRO 68 CO 0.53 -0.96 -0.13 1.03 0.04 0.00 0.00 177.00 177.52 1oyi s ARG 69 N 3.93 1.77 -0.20 4.56 0.52 -1.26 -3.89 118.95 124.38 1oyi s ARG 69 Ca 0.57 -0.43 -0.26 0.00 -0.52 0.00 0.00 55.73 55.09 1oyi s ARG 69 Cb -0.19 -1.47 -0.01 0.00 0.52 0.00 0.00 34.95 33.80 1oyi s ARG 69 CO 0.20 0.01 0.89 -1.58 0.02 0.00 0.00 175.30 174.85 1oyi s TRP 70 N 0.73 3.37 0.49 -0.53 0.52 -0.53 -1.35 118.94 121.65 1oyi s TRP 70 Ca -0.13 1.30 0.04 0.00 0.02 0.00 0.00 56.10 57.32 1oyi s TRP 70 Cb -0.16 -3.10 -0.01 0.00 -1.15 0.00 0.00 33.47 29.05 1oyi s TRP 70 CO 0.03 -0.35 0.16 -0.06 0.02 0.00 0.00 176.95 176.75 1oyi s PHE 71 N 2.60 2.01 -0.41 -1.98 0.40 0.17 0.20 117.98 120.97 1oyi s PHE 71 Ca 0.39 -0.82 -0.15 0.00 -0.60 0.00 0.00 56.93 55.75 1oyi s PHE 71 Cb -0.16 -1.79 0.02 0.00 0.51 0.00 0.00 43.02 41.60 1oyi s PHE 71 CO 0.10 0.03 0.30 0.00 0.70 0.00 0.00 175.22 176.35 1oyi s MET 72 N -3.99 2.96 0.00 0.44 0.23 -1.26 0.10 119.30 117.78 1oyi s MET 72 Ca 0.24 -1.02 0.00 0.00 -1.03 0.00 0.00 55.69 53.87 1oyi s MET 72 Cb 0.02 -3.97 0.00 0.00 -1.53 0.00 0.00 34.83 29.35 1oyi s MET 72 CO 0.14 -0.75 0.00 2.41 -2.03 0.00 0.00 175.02 174.79 1oyi n THR 73 N 5.15 -1.64 -0.64 3.16 -1.04 -1.26 -4.94 114.28 113.07 1oyi n THR 73 Ca -0.11 0.39 0.00 0.00 -2.04 0.00 0.00 64.05 62.29 1oyi n THR 73 Cb 0.47 -2.54 0.00 0.00 -1.82 0.00 0.00 70.33 66.44 1oyi n THR 73 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50