#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oco n GLN 12 N 0.00 0.29 -3.48 2.98 6.02 -1.26 -5.11 117.38 116.83 1oco n GLN 12 Ca 0.00 0.12 -0.10 0.00 -0.01 0.00 0.00 57.00 57.01 1oco n GLN 12 Cb 0.00 -1.01 -0.02 0.00 1.02 0.00 0.00 30.24 30.23 1oco n GLN 12 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1oco s THR 13 N -2.40 0.00 -0.06 5.09 -1.32 -1.26 -5.13 115.64 110.56 1oco s THR 13 Ca -0.17 0.00 -0.38 0.00 -1.21 0.00 0.00 61.69 59.93 1oco s THR 13 Cb 0.04 -1.00 -0.16 0.00 -1.51 0.00 0.00 72.50 69.88 1oco s THR 13 CO 0.24 0.00 1.54 0.00 -2.21 0.00 0.00 174.62 174.19 1oco n ALA 14 N -0.20 -0.44 -1.66 11.08 0.00 -1.26 -4.97 120.51 123.07 1oco n ALA 14 Ca -0.11 0.45 -0.29 0.00 0.00 0.00 0.00 53.44 53.48 1oco n ALA 14 Cb 0.62 -2.17 0.15 0.00 0.00 0.00 0.00 19.45 18.05 1oco n ALA 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1oco s PRO 15 N 1.91 0.92 0.40 0.00 0.04 -1.26 -5.00 135.00 132.02 1oco s PRO 15 Ca 0.90 0.04 -0.27 0.00 0.04 0.00 0.00 61.00 61.72 1oco s PRO 15 Cb -0.97 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 31.64 1oco s PRO 15 CO 0.54 -2.30 1.40 0.12 0.04 0.00 0.00 177.00 176.80 1oco s PHE 16 N -3.46 2.65 -0.33 0.56 5.36 -1.26 -4.99 117.98 116.52 1oco s PHE 16 Ca 0.67 1.29 0.01 0.00 -0.96 0.00 0.00 56.93 57.93 1oco s PHE 16 Cb -0.11 -3.86 0.10 0.00 -0.34 0.00 0.00 43.02 38.81 1oco s PHE 16 CO 0.53 -2.62 0.10 0.34 -1.46 0.00 0.00 175.22 172.10 1oco s ASP 17 N -0.45 4.20 0.57 6.13 -1.08 -1.26 -5.01 116.67 119.77 1oco s ASP 17 Ca 0.56 -1.86 0.38 0.00 -0.52 0.00 0.00 52.55 51.11 1oco s ASP 17 Cb -0.43 -1.08 1.45 0.00 -1.46 0.00 0.00 42.92 41.40 1oco s ASP 17 CO 0.56 -0.39 1.61 0.77 0.52 0.00 0.00 175.17 178.24 1oco h SER 18 N 7.85 0.00 0.00 -0.34 4.64 -1.99 0.54 113.55 124.25 1oco h SER 18 Ca -0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1oco h SER 18 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1oco h SER 18 CO 0.49 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.34 1oco n ARG 19 N -3.79 0.90 -2.95 4.77 1.85 -1.26 -3.57 116.66 112.60 1oco n ARG 19 Ca 0.29 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.99 1oco n ARG 19 Cb 1.52 -1.38 -0.01 0.00 -1.05 0.00 0.00 32.46 31.55 1oco n ARG 19 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1oco n PHE 20 N -0.88 -2.07 1.57 2.89 3.72 0.19 -5.01 117.46 117.88 1oco n PHE 20 Ca 0.16 -2.53 0.14 0.00 -0.05 0.00 0.00 57.45 55.17 1oco n PHE 20 Cb 0.07 0.73 0.59 0.00 -0.94 0.00 0.00 39.48 39.94 1oco n PHE 20 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1oco n PRO 21 N 1.65 1.46 -3.88 -1.08 -0.04 -1.23 -4.66 135.00 127.20 1oco n PRO 21 Ca 0.15 -0.74 -0.22 0.00 -0.04 0.00 0.00 63.50 62.65 1oco n PRO 21 Cb 0.58 -1.48 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 1oco n PRO 21 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1oco s ASN 22 N -2.05 4.85 0.43 3.54 0.01 -1.26 -5.01 114.94 115.45 1oco s ASN 22 Ca 0.39 -0.78 0.27 0.00 -0.71 0.00 0.00 52.86 52.02 1oco s ASN 22 Cb 0.21 -0.67 1.35 0.00 0.41 0.00 0.00 41.25 42.55 1oco s ASN 22 CO 0.36 -0.47 1.66 -0.61 -1.51 0.00 0.00 177.10 176.52 1oco h GLN 23 N 1.30 0.15 -6.21 -0.60 4.15 -2.06 -3.35 115.11 108.49 1oco h GLN 23 Ca -0.43 -0.01 -0.58 0.00 0.77 0.00 0.00 58.65 58.40 1oco h GLN 23 Cb 1.26 -0.03 -0.08 0.00 0.21 0.00 0.00 27.48 28.83 1oco h GLN 23 CO 0.62 0.10 0.69 1.21 -1.93 0.00 0.00 178.83 179.52 1oco s ASN 24 N -4.68 6.72 0.00 -0.69 3.04 -1.26 -4.88 114.94 113.19 1oco s ASN 24 Ca -0.08 0.64 0.13 0.00 0.04 0.00 0.00 52.86 53.59 1oco s ASN 24 Cb 0.29 -2.49 0.18 0.00 -1.54 0.00 0.00 41.25 37.68 1oco s ASN 24 CO 0.81 -0.92 1.02 0.00 -3.04 0.00 0.00 177.10 174.98 1oco n GLN 25 N 6.94 1.40 -0.34 0.43 1.13 -1.26 -4.68 117.38 121.01 1oco n GLN 25 Ca 0.09 -1.52 0.26 0.00 -1.94 0.00 0.00 57.00 53.88 1oco n GLN 25 Cb 0.48 -1.26 0.50 0.00 0.11 0.00 0.00 30.24 30.07 1oco n GLN 25 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1oco h THR 26 N 2.43 0.25 -0.27 5.09 2.02 -1.95 0.29 112.91 120.77 1oco h THR 26 Ca 0.00 -0.09 -0.18 0.00 0.77 0.00 0.00 66.41 66.91 1oco h THR 26 Cb 0.60 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1oco h THR 26 CO 0.00 0.05 -0.55 0.03 0.37 0.00 0.00 175.52 175.42 1oco h ARG 27 N 0.26 0.83 -0.84 6.66 2.47 -1.99 -2.51 114.38 119.27 1oco h ARG 27 Ca 0.75 -0.53 0.11 0.00 -1.26 0.00 0.00 59.98 59.06 1oco h ARG 27 Cb 1.81 0.06 -0.08 0.00 -1.65 0.00 0.00 29.97 30.12 1oco h ARG 27 CO -0.61 1.16 0.47 -0.97 0.56 0.00 0.00 179.97 180.58 1oco h ASN 28 N 0.64 0.64 0.71 7.04 -0.73 -0.76 0.88 115.58 124.00 1oco h ASN 28 Ca 0.01 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 58.21 1oco h ASN 28 Cb 1.15 -0.06 0.01 0.00 0.27 0.00 0.00 38.32 39.69 1oco h ASN 28 CO 0.12 0.34 -0.34 0.00 -0.37 0.00 0.00 177.43 177.18 1oco h TRP 30 N -1.09 -0.44 -0.10 0.00 2.91 -0.83 -2.00 115.95 114.41 1oco h TRP 30 Ca -0.10 0.05 0.03 0.00 1.13 0.00 0.00 58.89 60.00 1oco h TRP 30 Cb 0.73 0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 29.64 1oco h TRP 30 CO 0.03 -0.28 -0.06 0.37 -1.03 0.00 0.00 178.44 177.47 1oco h GLN 31 N -0.05 -0.06 0.00 2.65 5.75 0.67 -2.39 115.11 121.67 1oco h GLN 31 Ca 0.26 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.72 1oco h GLN 31 Cb 0.45 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.01 1oco h GLN 31 CO -0.59 -0.04 -0.23 -0.91 -2.65 0.00 0.00 178.83 174.41 1oco h ASN 32 N -0.07 0.00 0.08 -0.69 2.35 -1.30 0.15 115.58 116.09 1oco h ASN 32 Ca 0.06 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.64 1oco h ASN 32 Cb 0.15 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1oco h ASN 32 CO -0.14 0.23 -0.59 0.22 -1.65 0.00 0.00 177.43 175.50 1oco h TYR 33 N 0.00 0.66 0.25 1.19 5.03 -1.10 -1.83 116.97 121.18 1oco h TYR 33 Ca -0.00 -0.25 -0.01 0.00 2.58 0.00 0.00 58.73 61.05 1oco h TYR 33 Cb 0.46 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 38.62 1oco h TYR 33 CO 0.00 0.98 -0.12 -0.07 -1.32 0.00 0.00 178.16 177.64 1oco h LEU 34 N 0.39 -0.28 -0.91 2.82 3.38 -0.99 -2.91 115.31 116.81 1oco h LEU 34 Ca -0.00 -0.21 0.26 0.00 0.09 0.00 0.00 57.88 58.01 1oco h LEU 34 Cb 1.14 0.07 -0.15 0.00 0.09 0.00 0.00 40.66 41.81 1oco h LEU 34 CO 0.11 0.22 0.23 0.44 0.09 0.00 0.00 178.44 179.54 1oco h ASP 35 N -0.96 -0.04 0.55 -0.43 3.32 -0.76 -0.27 116.42 117.83 1oco h ASP 35 Ca -0.03 0.22 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1oco h ASP 35 Cb 0.47 0.30 0.01 0.00 0.22 0.00 0.00 39.33 40.33 1oco h ASP 35 CO 0.06 -0.21 -0.26 0.15 -1.72 0.00 0.00 179.24 177.25 1oco h PHE 36 N 0.16 -0.68 -0.37 4.55 3.57 -1.38 -1.96 116.94 120.84 1oco h PHE 36 Ca 0.59 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 62.18 1oco h PHE 36 Cb 1.23 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 40.18 1oco h PHE 36 CO -0.28 -0.42 0.31 0.45 -2.23 0.00 0.00 178.31 176.14 1oco h HIS 37 N -0.86 0.00 -0.05 0.41 3.86 -1.21 0.22 115.15 117.51 1oco h HIS 37 Ca -0.08 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.88 1oco h HIS 37 Cb 0.56 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.05 1oco h HIS 37 CO 0.06 0.00 -0.95 0.00 0.86 0.00 0.00 177.93 177.90 1oco h ARG 38 N 0.00 0.74 0.07 2.45 3.08 -1.04 -1.37 114.38 118.31 1oco h ARG 38 Ca 0.17 -0.72 -0.00 0.00 0.07 0.00 0.00 59.98 59.50 1oco h ARG 38 Cb 0.80 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1oco h ARG 38 CO -0.00 1.31 -0.03 0.00 -1.07 0.00 0.00 179.97 180.17 1oco h GLU 40 N -0.38 -0.29 -0.86 0.00 4.81 -0.70 -1.48 114.58 115.68 1oco h GLU 40 Ca -0.01 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.35 1oco h GLU 40 Cb 0.33 0.07 -0.08 0.00 0.63 0.00 0.00 28.75 29.70 1oco h GLU 40 CO 0.02 -0.20 0.50 -0.22 -0.73 0.00 0.00 179.01 178.38 1oco h LYS 41 N -0.30 0.78 0.08 1.92 3.64 -1.10 -1.87 116.57 119.71 1oco h LYS 41 Ca 0.13 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1oco h LYS 41 Cb 0.52 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1oco h LYS 41 CO -0.43 0.52 -0.05 0.00 -2.27 0.00 0.00 179.45 177.22 1oco h ALA 42 N 1.49 -0.97 -0.61 5.00 0.00 -0.40 -0.59 119.26 123.18 1oco h ALA 42 Ca 0.43 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.49 1oco h ALA 42 Cb 0.43 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1oco h ALA 42 CO -0.27 -0.96 0.88 0.52 0.00 0.00 0.00 179.25 179.42 1oco h MET 43 N -0.12 0.00 0.00 0.00 2.86 -1.08 0.80 114.93 117.39 1oco h MET 43 Ca -0.01 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1oco h MET 43 Cb 0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.76 1oco h MET 43 CO 0.01 0.00 -0.00 1.15 1.06 0.00 0.00 176.91 179.13 1oco h THR 44 N 0.00 1.50 -0.21 2.22 2.02 -1.02 0.08 112.91 117.51 1oco h THR 44 Ca 0.29 -2.12 -0.21 0.00 0.77 0.00 0.00 66.41 65.13 1oco h THR 44 Cb 2.04 2.83 -0.08 0.00 -1.74 0.00 0.00 68.15 71.21 1oco h THR 44 CO -0.00 0.51 -0.14 0.00 0.37 0.00 0.00 175.52 176.26 1oco n ALA 45 N -2.64 5.86 0.00 6.16 0.00 0.27 -2.05 120.51 128.12 1oco n ALA 45 Ca -0.08 -1.67 0.00 0.00 0.00 0.00 0.00 53.44 51.68 1oco n ALA 45 Cb 0.40 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.87 1oco n ALA 45 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1oco n LYS 46 N 1.90 0.00 0.00 0.00 4.81 -0.99 -4.93 118.16 118.95 1oco n LYS 46 Ca 0.35 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1oco n LYS 46 Cb 0.76 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.81 1oco n LYS 46 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1oco n GLY 47 N -0.02 1.27 3.82 3.14 0.00 0.02 -4.73 105.19 108.69 1oco n GLY 47 Ca 0.00 0.44 -0.24 0.00 0.00 0.00 0.00 46.02 46.22 1oco n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oco n GLY 48 N 0.00 -0.35 2.36 -0.02 0.00 -1.26 0.72 105.19 106.65 1oco n GLY 48 Ca 0.00 0.18 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1oco n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oco n ASP 49 N -2.98 -4.71 -4.06 1.61 8.00 -1.26 -2.01 116.55 111.14 1oco n ASP 49 Ca -0.28 0.21 -0.34 0.00 0.71 0.00 0.00 54.79 55.10 1oco n ASP 49 Cb 0.67 -4.06 -0.04 0.00 -0.02 0.00 0.00 41.12 37.67 1oco n ASP 49 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1oco n VAL 50 N -3.08 -0.51 -1.52 2.53 0.24 0.22 -4.93 118.33 111.28 1oco n VAL 50 Ca -0.19 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.78 1oco n VAL 50 Cb 0.61 -1.07 0.08 0.00 -1.47 0.00 0.00 33.84 31.99 1oco n VAL 50 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1oco s SER 51 N -3.06 4.45 -0.00 -1.34 1.04 -0.85 -5.04 113.70 108.90 1oco s SER 51 Ca 0.66 2.25 0.02 0.00 0.48 0.00 0.00 55.95 59.37 1oco s SER 51 Cb -0.37 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.16 1oco s SER 51 CO 0.81 -2.09 -0.08 0.68 0.98 0.00 0.00 173.24 173.55 1oco s VAL 52 N -2.09 0.61 -1.41 5.02 -7.23 -1.26 -4.85 120.40 109.20 1oco s VAL 52 Ca 0.72 -0.37 -0.14 0.00 -1.81 0.00 0.00 61.98 60.38 1oco s VAL 52 Cb -0.27 -0.52 0.06 0.00 0.56 0.00 0.00 36.38 36.21 1oco s VAL 52 CO 0.44 0.14 2.09 0.00 -0.31 0.00 0.00 175.10 177.47 1oco h GLU 54 N 6.25 0.66 -0.82 0.00 4.57 -1.98 -3.35 114.58 119.92 1oco h GLU 54 Ca 0.53 -0.52 0.20 0.00 -1.18 0.00 0.00 59.36 58.39 1oco h GLU 54 Cb 0.68 0.10 -0.13 0.00 -0.16 0.00 0.00 28.75 29.24 1oco h GLU 54 CO 1.78 1.14 0.18 2.35 -1.18 0.00 0.00 179.01 183.27 1oco h TRP 55 N 0.46 0.25 -0.73 0.92 2.91 -2.00 0.20 115.95 117.97 1oco h TRP 55 Ca -0.03 0.05 -0.03 0.00 1.13 0.00 0.00 58.89 60.01 1oco h TRP 55 Cb 1.33 0.02 -0.03 0.00 -0.51 0.00 0.00 29.16 29.96 1oco h TRP 55 CO 0.07 -0.18 0.35 1.88 -1.03 0.00 0.00 178.44 179.53 1oco h TYR 56 N 0.21 1.06 -0.01 2.65 0.05 -1.89 -1.71 116.97 117.32 1oco h TYR 56 Ca 0.48 -0.05 -0.11 0.00 0.05 0.00 0.00 58.73 59.10 1oco h TYR 56 Cb 0.91 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 38.31 1oco h TYR 56 CO -0.30 0.78 -0.53 -0.09 -1.05 0.00 0.00 178.16 176.98 1oco h ARG 57 N 1.03 0.03 0.27 4.88 2.43 -0.88 -0.41 114.38 121.72 1oco h ARG 57 Ca 0.25 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1oco h ARG 57 Cb 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1oco h ARG 57 CO -0.03 0.55 -0.13 0.00 -1.51 0.00 0.00 179.97 178.85 1oco h ARG 58 N 0.02 -0.35 0.55 0.20 2.47 -0.57 -2.53 114.38 114.17 1oco h ARG 58 Ca -0.00 0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.71 1oco h ARG 58 Cb 0.94 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.34 1oco h ARG 58 CO 0.07 -0.06 -0.28 0.28 0.56 0.00 0.00 179.97 180.54 1oco h VAL 59 N -0.64 0.43 -0.04 2.04 2.07 -1.19 -1.64 116.25 117.27 1oco h VAL 59 Ca -0.04 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1oco h VAL 59 Cb 0.45 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1oco h VAL 59 CO 0.06 0.00 0.04 0.10 0.02 0.00 0.00 177.57 177.79 1oco h TYR 60 N -0.76 0.00 -0.18 1.57 -0.00 -1.19 -0.86 116.97 115.55 1oco h TYR 60 Ca -0.07 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.53 1oco h TYR 60 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.31 1oco h TYR 60 CO -0.05 0.00 -0.44 0.87 -0.00 0.00 0.00 178.16 178.54 1oco h LYS 61 N 0.00 0.43 0.03 0.10 1.79 -0.94 -1.06 116.57 116.92 1oco h LYS 61 Ca 0.02 -0.23 -0.00 0.00 -2.18 0.00 0.00 60.65 58.26 1oco h LYS 61 Cb 0.11 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1oco h LYS 61 CO -0.00 0.79 -0.02 0.77 -1.08 0.00 0.00 179.45 179.92 1oco h SER 62 N 0.35 -0.04 0.36 0.86 0.02 -0.26 -3.39 113.55 111.46 1oco h SER 62 Ca 0.03 -0.54 -0.32 0.00 -0.84 0.00 0.00 61.79 60.12 1oco h SER 62 Cb 0.92 0.01 0.02 0.00 0.14 0.00 0.00 62.40 63.49 1oco h SER 62 CO 0.08 0.53 -1.48 -0.07 -1.14 0.00 0.00 176.83 174.76 1oco h LEU 63 N -0.62 0.67 -9.58 5.07 3.38 -1.43 -3.47 115.31 109.32 1oco h LEU 63 Ca -0.00 -0.77 -0.52 0.00 0.09 0.00 0.00 57.88 56.68 1oco h LEU 63 Cb 0.57 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1oco h LEU 63 CO 0.01 1.61 0.43 0.00 0.09 0.00 0.00 178.44 180.58 1oco s PRO 65 N 0.09 3.89 0.20 0.00 0.04 -1.26 -4.87 135.00 133.09 1oco s PRO 65 Ca 0.50 1.94 -0.21 0.00 0.04 0.00 0.00 61.00 63.27 1oco s PRO 65 Cb -0.26 -2.61 0.14 0.00 0.04 0.00 0.00 34.50 31.81 1oco s PRO 65 CO 0.32 -0.49 1.57 0.82 0.04 0.00 0.00 177.00 179.25 1oco h ILE 66 N 2.19 0.08 -0.28 0.56 2.04 -1.94 0.15 117.51 120.32 1oco h ILE 66 Ca -0.49 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.45 1oco h ILE 66 Cb 1.25 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1oco h ILE 66 CO 0.62 0.00 0.23 0.77 0.00 0.00 0.00 178.15 179.76 1oco h SER 67 N -0.10 0.00 0.31 1.72 4.64 -1.98 0.38 113.55 118.52 1oco h SER 67 Ca 0.26 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.57 1oco h SER 67 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1oco h SER 67 CO -0.82 0.00 -0.15 -0.50 -0.87 0.00 0.00 176.83 174.49 1oco h TRP 68 N 0.00 -0.39 -0.72 4.77 4.06 -1.34 -1.78 115.95 120.55 1oco h TRP 68 Ca 0.13 -0.01 0.14 0.00 2.06 0.00 0.00 58.89 61.21 1oco h TRP 68 Cb 0.59 0.13 -0.09 0.00 -1.00 0.00 0.00 29.16 28.78 1oco h TRP 68 CO 0.00 -0.05 0.25 0.28 -3.56 0.00 0.00 178.44 175.36 1oco h VAL 69 N -0.92 0.65 0.72 1.49 2.07 -0.84 0.14 116.25 119.57 1oco h VAL 69 Ca -0.04 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 1oco h VAL 69 Cb 0.52 0.22 0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1oco h VAL 69 CO 0.07 0.07 -0.35 0.28 0.02 0.00 0.00 177.57 177.66 1oco h SER 70 N 0.39 -0.82 -0.75 0.57 0.02 -0.27 -0.78 113.55 111.90 1oco h SER 70 Ca 0.39 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.47 1oco h SER 70 Cb 0.59 0.21 -0.05 0.00 0.14 0.00 0.00 62.40 63.29 1oco h SER 70 CO -0.41 -0.50 0.49 0.71 -1.14 0.00 0.00 176.83 175.99 1oco h THR 71 N -1.13 0.86 0.26 -2.27 1.35 -0.98 -0.11 112.91 110.89 1oco h THR 71 Ca -0.10 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.57 1oco h THR 71 Cb 0.77 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1oco h THR 71 CO 0.16 0.10 -0.13 -0.50 -0.25 0.00 0.00 175.52 174.90 1oco h TRP 72 N 0.53 -0.33 -0.49 4.73 6.55 -0.52 -0.98 115.95 125.45 1oco h TRP 72 Ca 0.36 -0.01 0.09 0.00 0.95 0.00 0.00 58.89 60.28 1oco h TRP 72 Cb 0.65 0.11 -0.07 0.00 -0.86 0.00 0.00 29.16 28.99 1oco h TRP 72 CO -0.00 -0.03 0.04 -0.44 -1.05 0.00 0.00 178.44 176.96 1oco h ASP 73 N -0.62 -0.12 -0.27 -3.49 3.32 -0.24 0.10 116.42 115.10 1oco h ASP 73 Ca -0.04 0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.18 1oco h ASP 73 Cb 0.44 0.17 -0.07 0.00 0.22 0.00 0.00 39.33 40.09 1oco h ASP 73 CO 0.06 -0.03 -0.20 0.44 -1.72 0.00 0.00 179.24 177.79 1oco h ASP 74 N 0.16 -0.64 -0.66 6.45 5.19 -1.00 0.40 116.42 126.33 1oco h ASP 74 Ca 0.24 0.13 0.09 0.00 -0.62 0.00 0.00 57.03 56.87 1oco h ASP 74 Cb 0.35 0.32 -0.07 0.00 0.18 0.00 0.00 39.33 40.12 1oco h ASP 74 CO -0.37 -0.23 0.31 0.03 -3.12 0.00 0.00 179.24 175.86 1oco h ARG 75 N -0.18 0.53 -0.66 3.56 -0.00 -0.08 -0.37 114.38 117.18 1oco h ARG 75 Ca 0.15 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.98 59.59 1oco h ARG 75 Cb 0.40 -0.12 -0.03 0.00 0.00 0.00 0.00 29.97 30.22 1oco h ARG 75 CO -0.38 0.35 0.38 0.00 0.00 0.00 0.00 179.97 180.31 1oco h ARG 76 N 0.54 0.90 0.57 0.04 3.08 0.27 0.35 114.38 120.13 1oco h ARG 76 Ca 0.32 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.26 1oco h ARG 76 Cb 0.33 -0.19 0.01 0.00 0.08 0.00 0.00 29.97 30.20 1oco h ARG 76 CO -0.26 0.65 -0.27 0.00 -1.07 0.00 0.00 179.97 179.01 1oco h ALA 77 N 1.50 -0.76 0.00 0.04 0.00 0.52 -2.54 119.26 118.01 1oco h ALA 77 Ca 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1oco h ALA 77 Cb -0.00 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1oco h ALA 77 CO -0.04 -0.85 0.00 -0.85 0.00 0.00 0.00 179.25 177.51 1oco n GLU 78 N -5.36 0.48 -2.65 0.00 0.28 -0.30 -4.87 120.64 108.22 1oco n GLU 78 Ca -0.12 0.05 -0.10 0.00 -0.16 0.00 0.00 57.16 56.83 1oco n GLU 78 Cb 0.34 -1.50 0.02 0.00 1.43 0.00 0.00 31.44 31.72 1oco n GLU 78 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1oco n GLY 79 N 0.39 0.21 0.29 -1.84 0.00 0.88 -4.94 105.19 100.18 1oco n GLY 79 Ca 0.13 -0.38 0.07 0.00 0.00 0.00 0.00 46.02 45.84 1oco n GLY 79 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oco n THR 80 N -3.73 1.48 -2.48 2.61 -2.24 0.71 -5.00 114.28 105.64 1oco n THR 80 Ca -0.04 -1.91 -0.43 0.00 -2.27 0.00 0.00 64.05 59.40 1oco n THR 80 Cb 0.55 -0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.71 1oco n THR 80 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1oco s PHE 81 N -2.24 2.79 -1.05 4.78 5.36 -1.16 -4.88 117.98 121.58 1oco s PHE 81 Ca 0.27 0.92 0.09 0.00 -0.96 0.00 0.00 56.93 57.25 1oco s PHE 81 Cb 0.24 -3.92 0.39 0.00 -0.34 0.00 0.00 43.02 39.39 1oco s PHE 81 CO 0.00 -1.48 1.27 -0.35 -1.46 0.00 0.00 175.22 173.20 1oco n PRO 82 N 7.29 0.01 -2.98 10.12 -0.04 -1.26 -4.76 135.00 143.38 1oco n PRO 82 Ca 0.14 0.33 -0.27 0.00 -0.04 0.00 0.00 63.50 63.66 1oco n PRO 82 Cb 0.47 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.42 1oco n PRO 82 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1oco s GLY 83 N -2.95 1.54 -0.30 0.55 0.00 -1.26 -5.06 107.32 99.84 1oco s GLY 83 Ca 0.05 -0.61 -0.12 0.00 0.00 0.00 0.00 44.72 44.04 1oco s GLY 83 CO 0.16 -0.48 0.23 0.54 0.00 0.00 0.00 173.10 173.55 1oco s LYS 84 N -4.37 3.83 0.00 2.90 3.01 -1.26 -5.15 119.74 118.71 1oco s LYS 84 Ca 0.45 -0.36 0.04 0.00 -1.01 0.00 0.00 55.97 55.08 1oco s LYS 84 Cb -0.10 -3.70 0.03 0.00 -1.01 0.00 0.00 37.83 33.05 1oco s LYS 84 CO 0.39 -0.27 0.62 -0.89 0.51 0.00 0.00 175.35 175.71