#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1soh n PHE 14 N 0.00 0.00 0.05 4.78 -1.74 -1.26 -4.08 117.46 115.21 1soh n PHE 14 Ca 0.00 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 56.85 1soh n PHE 14 Cb 0.00 -0.65 -0.09 0.00 1.52 0.00 0.00 39.48 40.26 1soh n PHE 14 CO 0.00 0.00 0.00 1.37 -0.56 0.00 0.00 176.76 177.57 1soh h LEU 15 N 0.00 0.00 -0.47 5.98 8.10 -2.06 -3.30 115.31 123.56 1soh h LEU 15 Ca -0.37 0.00 -0.15 0.00 0.11 0.00 0.00 57.88 57.47 1soh h LEU 15 Cb 1.62 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.82 1soh h LEU 15 CO -0.04 0.82 -0.70 0.74 -4.11 0.00 0.00 178.44 175.14 1soh h THR 16 N 0.00 1.41 0.14 0.15 2.02 -1.99 -2.75 112.91 111.89 1soh h THR 16 Ca -0.11 -2.48 -0.01 0.00 0.77 0.00 0.00 66.41 64.58 1soh h THR 16 Cb 1.72 2.37 0.00 0.00 -1.74 0.00 0.00 68.15 70.51 1soh h THR 16 CO 0.09 0.69 -0.07 0.06 0.37 0.00 0.00 175.52 176.66 1soh h GLN 17 N 0.00 -0.18 -0.55 6.66 3.07 -1.71 -2.63 115.11 119.77 1soh h GLN 17 Ca -0.01 0.01 -0.02 0.00 0.09 0.00 0.00 58.65 58.73 1soh h GLN 17 Cb 1.32 0.04 -0.03 0.00 0.08 0.00 0.00 27.48 28.89 1soh h GLN 17 CO 0.09 0.00 0.27 0.28 0.09 0.00 0.00 178.83 179.57 1soh h VAL 18 N -0.34 1.18 -0.23 1.86 2.07 -1.64 0.06 116.25 119.21 1soh h VAL 18 Ca -0.02 -0.50 0.07 0.00 0.82 0.00 0.00 66.70 67.07 1soh h VAL 18 Cb 0.27 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1soh h VAL 18 CO 0.03 0.21 0.25 0.11 0.02 0.00 0.00 177.57 178.19 1soh h LYS 19 N 0.77 0.00 0.00 1.57 1.57 -1.16 1.35 116.57 120.67 1soh h LYS 19 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1soh h LYS 19 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1soh h LYS 19 CO -0.03 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 179.78 1soh h GLU 20 N 0.00 0.00 0.00 3.15 5.08 -0.66 -2.87 114.58 119.29 1soh h GLU 20 Ca 0.11 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.22 1soh h GLU 20 Cb 0.62 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 1soh h GLU 20 CO -0.00 0.00 -1.78 0.43 -1.00 0.00 0.00 179.01 176.66 1soh n SER 21 N -2.86 1.71 0.33 1.42 7.64 0.30 -3.14 113.62 119.01 1soh n SER 21 Ca 0.04 0.29 0.20 0.00 1.01 0.00 0.00 58.87 60.42 1soh n SER 21 Cb 0.49 -0.68 1.08 0.00 -1.01 0.00 0.00 64.21 64.08 1soh n SER 21 CO 0.00 0.00 0.00 0.17 -3.01 0.00 0.00 175.04 172.20 1soh h LEU 22 N -0.84 0.00 0.00 -3.43 8.10 0.11 0.23 115.31 119.48 1soh h LEU 22 Ca -0.38 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.58 1soh h LEU 22 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.49 1soh h LEU 22 CO -0.23 0.00 -1.94 -0.24 -4.11 0.00 0.00 178.44 171.92 1soh n SER 23 N -3.13 0.08 -0.21 0.17 2.88 -1.08 -3.59 113.62 108.73 1soh n SER 23 Ca -0.02 0.03 0.14 0.00 -1.33 0.00 0.00 58.87 57.69 1soh n SER 23 Cb 0.17 1.78 0.55 0.00 -0.75 0.00 0.00 64.21 65.96 1soh n SER 23 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1soh n SER 24 N -2.33 0.79 -0.04 -3.46 7.64 0.66 -3.12 113.62 113.76 1soh n SER 24 Ca -0.06 -0.88 0.02 0.00 1.01 0.00 0.00 58.87 58.96 1soh n SER 24 Cb 0.61 0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.81 1soh n SER 24 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1soh n TYR 25 N -0.65 0.00 -0.05 1.43 4.01 -0.40 -4.12 117.16 117.37 1soh n TYR 25 Ca 0.15 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.78 1soh n TYR 25 Cb 0.30 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.18 1soh n TYR 25 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 1soh n TRP 26 N -0.72 0.68 0.13 -0.72 -0.00 -1.23 -2.87 117.44 112.71 1soh n TRP 26 Ca 0.01 0.22 0.09 0.00 -0.00 0.00 0.00 57.50 57.83 1soh n TRP 26 Cb 0.06 -1.12 0.04 0.00 -0.00 0.00 0.00 31.31 30.30 1soh n TRP 26 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 177.69 178.74 1soh h GLU 27 N 0.01 0.00 0.17 5.87 4.11 -1.79 -3.32 114.58 119.63 1soh h GLU 27 Ca -0.40 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 58.75 1soh h GLU 27 Cb 2.08 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.34 1soh h GLU 27 CO 0.06 0.10 -1.35 1.03 0.07 0.00 0.00 179.01 178.91 1soh h SER 28 N 0.00 0.57 -0.46 3.06 0.87 -1.72 -2.80 113.55 113.07 1soh h SER 28 Ca -0.02 -0.91 0.13 0.00 -1.23 0.00 0.00 61.79 59.76 1soh h SER 28 Cb 1.12 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 1soh h SER 28 CO 0.01 1.62 0.46 0.00 -0.53 0.00 0.00 176.83 178.39 1soh h ALA 29 N 0.07 2.22 0.00 6.23 0.00 -1.64 0.43 119.26 126.56 1soh h ALA 29 Ca -0.26 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.38 1soh h ALA 29 Cb 1.91 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.69 1soh h ALA 29 CO 0.16 -0.70 -1.65 1.63 0.00 0.00 0.00 179.25 178.69 1soh n LYS 30 N -3.82 0.63 0.16 0.00 5.02 -1.23 -2.50 118.16 116.42 1soh n LYS 30 Ca 0.08 0.25 0.03 0.00 -2.02 0.00 0.00 58.31 56.66 1soh n LYS 30 Cb 0.65 -1.78 0.17 0.00 -0.02 0.00 0.00 35.03 34.04 1soh n LYS 30 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1soh h THR 31 N 0.00 0.93 -0.10 -0.18 1.03 -0.05 -3.22 112.91 111.33 1soh h THR 31 Ca -0.26 -1.97 -0.02 0.00 -0.01 0.00 0.00 66.41 64.15 1soh h THR 31 Cb 1.88 2.21 -0.01 0.00 -1.07 0.00 0.00 68.15 71.16 1soh h THR 31 CO 0.07 0.47 -0.09 0.00 -0.01 0.00 0.00 175.52 175.95 1soh n ALA 32 N -2.27 2.88 -0.09 0.00 0.00 0.68 -4.70 120.51 117.02 1soh n ALA 32 Ca 0.01 -2.72 -0.10 0.00 0.00 0.00 0.00 53.44 50.62 1soh n ALA 32 Cb 0.64 -0.49 -0.04 0.00 0.00 0.00 0.00 19.45 19.56 1soh n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1soh n ALA 33 N -1.14 0.67 0.30 0.00 0.00 -1.04 -3.52 120.51 115.78 1soh n ALA 33 Ca 0.20 -0.59 0.19 0.00 0.00 0.00 0.00 53.44 53.23 1soh n ALA 33 Cb 0.75 -0.05 1.00 0.00 0.00 0.00 0.00 19.45 21.15 1soh n ALA 33 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1soh h GLN 34 N -1.00 0.00 0.11 0.00 4.15 -1.85 0.18 115.11 116.70 1soh h GLN 34 Ca -0.11 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 1soh h GLN 34 Cb 0.84 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.53 1soh h GLN 34 CO -0.06 0.00 -0.05 -0.97 -1.93 0.00 0.00 178.83 175.81 1soh h ASN 35 N 0.00 -0.13 -0.54 -0.69 -0.73 -1.84 -3.12 115.58 108.54 1soh h ASN 35 Ca 0.02 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.20 1soh h ASN 35 Cb 0.28 0.03 -0.03 0.00 0.27 0.00 0.00 38.32 38.88 1soh h ASN 35 CO -0.00 0.27 0.35 0.17 -0.37 0.00 0.00 177.43 177.84 1soh h LEU 36 N -0.87 0.63 -0.38 0.34 8.10 -1.53 -0.22 115.31 121.39 1soh h LEU 36 Ca -0.02 -0.02 0.00 0.00 0.11 0.00 0.00 57.88 57.95 1soh h LEU 36 Cb 0.12 -0.16 0.00 0.00 -0.44 0.00 0.00 40.66 40.18 1soh h LEU 36 CO 0.03 0.47 0.00 0.00 -4.11 0.00 0.00 178.44 174.83 1soh n TYR 37 N -4.44 0.39 0.81 0.17 4.19 0.60 -0.42 117.16 118.46 1soh n TYR 37 Ca 0.05 0.16 0.11 0.00 3.31 0.00 0.00 57.90 61.52 1soh n TYR 37 Cb 0.06 -0.76 0.10 0.00 0.49 0.00 0.00 39.34 39.23 1soh n TYR 37 CO 0.00 0.00 0.00 -1.91 0.91 0.00 0.00 176.86 175.86 1soh n GLU 38 N -1.86 1.97 -1.00 2.98 2.13 -0.11 -4.20 120.64 120.55 1soh n GLU 38 Ca 0.02 -1.80 -0.01 0.00 0.66 0.00 0.00 57.16 56.04 1soh n GLU 38 Cb 0.18 -1.41 -0.02 0.00 0.27 0.00 0.00 31.44 30.46 1soh n GLU 38 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1soh n LYS 39 N 1.20 0.00 0.09 5.31 4.81 -0.73 -4.36 118.16 124.47 1soh n LYS 39 Ca 0.13 -1.17 0.00 0.00 -0.87 0.00 0.00 58.31 56.40 1soh n LYS 39 Cb 0.53 0.07 0.00 0.00 0.02 0.00 0.00 35.03 35.65 1soh n LYS 39 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1soh n THR 40 N 0.17 0.52 -1.54 3.15 -1.04 0.44 -4.88 114.28 111.09 1soh n THR 40 Ca -0.07 0.17 -0.02 0.00 -2.04 0.00 0.00 64.05 62.10 1soh n THR 40 Cb 0.82 -1.02 0.19 0.00 -1.82 0.00 0.00 70.33 68.50 1soh n THR 40 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1soh n TYR 41 N -3.40 0.75 0.00 -1.42 9.36 -1.26 -4.84 117.16 116.34 1soh n TYR 41 Ca 0.00 -1.62 0.00 0.00 3.32 0.00 0.00 57.90 59.60 1soh n TYR 41 Cb 0.03 -0.40 0.00 0.00 -0.63 0.00 0.00 39.34 38.34 1soh n TYR 41 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1soh n LEU 42 N -1.11 0.00 -1.62 2.98 4.77 -1.26 -5.03 117.00 115.73 1soh n LEU 42 Ca 0.28 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.17 1soh n LEU 42 Cb 0.89 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.02 1soh n LEU 42 CO 0.11 0.00 1.00 -0.81 -1.33 0.00 0.00 177.39 176.36 1soh n PRO 43 N 0.00 1.48 -0.36 3.23 -0.04 -1.26 -3.62 135.00 134.43 1soh n PRO 43 Ca 0.00 -1.00 0.00 0.00 -0.04 0.00 0.00 63.50 62.46 1soh n PRO 43 Cb 0.00 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 1soh n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1soh n ALA 44 N 0.47 1.72 0.08 0.55 0.00 -1.26 -4.86 120.51 117.21 1soh n ALA 44 Ca 0.19 -0.60 -0.12 0.00 0.00 0.00 0.00 53.44 52.92 1soh n ALA 44 Cb 0.67 -0.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.81 1soh n ALA 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1soh h VAL 45 N 5.43 1.48 0.00 0.00 2.07 -1.80 0.79 116.25 124.22 1soh h VAL 45 Ca 0.00 -2.71 -0.02 0.00 0.82 0.00 0.00 66.70 64.79 1soh h VAL 45 Cb 1.20 2.59 -0.00 0.00 -1.52 0.00 0.00 31.29 33.55 1soh h VAL 45 CO 0.00 0.79 -0.10 0.44 0.02 0.00 0.00 177.57 178.73 1soh h ASP 46 N 0.13 0.00 -0.20 0.57 3.32 -1.87 1.57 116.42 119.95 1soh h ASP 46 Ca -0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1soh h ASP 46 Cb 1.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.21 1soh h ASP 46 CO 0.16 0.10 0.00 -0.62 -1.72 0.00 0.00 179.24 177.16 1soh n GLU 47 N -3.32 1.93 0.00 3.56 1.02 -1.13 -4.31 120.64 118.39 1soh n GLU 47 Ca -0.01 -1.66 0.00 0.00 -0.02 0.00 0.00 57.16 55.48 1soh n GLU 47 Cb 0.30 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 1soh n GLU 47 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1soh n LYS 48 N 0.48 0.00 0.00 3.49 4.81 0.26 -4.23 118.16 122.97 1soh n LYS 48 Ca 0.09 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 57.67 1soh n LYS 48 Cb 0.35 -0.37 0.79 0.00 0.02 0.00 0.00 35.03 35.82 1soh n LYS 48 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1soh n LEU 49 N -2.52 0.00 -0.00 3.14 0.00 0.53 -0.20 117.00 117.95 1soh n LEU 49 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 56.01 56.15 1soh n LEU 49 Cb 0.23 -0.11 -0.05 0.00 0.00 0.00 0.00 43.42 43.49 1soh n LEU 49 CO 0.00 -0.01 -0.49 0.54 0.00 0.00 0.00 177.39 177.43 1soh n ARG 50 N -1.11 0.92 0.00 1.96 1.74 -1.14 -4.38 116.66 114.64 1soh n ARG 50 Ca 0.18 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 1soh n ARG 50 Cb 0.14 -1.11 0.00 0.00 -1.02 0.00 0.00 32.46 30.48 1soh n ARG 50 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1soh n ASP 51 N -1.65 0.63 -0.63 0.55 9.92 -1.18 -4.53 116.55 119.66 1soh n ASP 51 Ca -0.01 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.28 1soh n ASP 51 Cb 0.17 0.00 0.11 0.00 -0.64 0.00 0.00 41.12 40.75 1soh n ASP 51 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1soh n LEU 52 N -1.81 1.72 0.00 0.64 0.00 0.72 -4.07 117.00 114.20 1soh n LEU 52 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 56.01 55.14 1soh n LEU 52 Cb 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 43.42 43.19 1soh n LEU 52 CO 0.00 0.33 -0.07 0.00 0.00 0.00 0.00 177.39 177.64 1soh n TYR 53 N 0.17 0.00 -3.95 1.96 9.36 0.37 -4.85 117.16 120.21 1soh n TYR 53 Ca 0.08 0.00 -0.31 0.00 3.32 0.00 0.00 57.90 60.99 1soh n TYR 53 Cb 0.34 0.20 0.02 0.00 -0.63 0.00 0.00 39.34 39.27 1soh n TYR 53 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1soh n SER 54 N -2.09 -4.35 -1.57 2.98 7.64 -1.26 0.01 113.62 114.98 1soh n SER 54 Ca 0.00 -0.82 -0.13 0.00 1.01 0.00 0.00 58.87 58.93 1soh n SER 54 Cb 0.07 -3.72 -0.05 0.00 -1.01 0.00 0.00 64.21 59.50 1soh n SER 54 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1soh n LYS 55 N -4.62 -1.44 0.22 1.43 5.02 -1.26 -4.82 118.16 112.68 1soh n LYS 55 Ca 0.02 0.77 -0.15 0.00 -2.02 0.00 0.00 58.31 56.93 1soh n LYS 55 Cb 0.53 -5.08 -0.07 0.00 -0.02 0.00 0.00 35.03 30.39 1soh n LYS 55 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1soh h SER 56 N 0.00 -0.82 0.00 4.39 0.02 -0.82 -3.35 113.55 112.97 1soh h SER 56 Ca -0.28 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1soh h SER 56 Cb 0.94 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1soh h SER 56 CO 0.40 -0.45 -0.23 1.07 -1.14 0.00 0.00 176.83 176.49 1soh n THR 57 N -5.43 0.65 -0.03 -2.27 5.66 -1.26 -4.69 114.28 106.91 1soh n THR 57 Ca -0.10 -0.77 -0.14 0.00 -3.05 0.00 0.00 64.05 60.00 1soh n THR 57 Cb 0.33 0.36 -0.10 0.00 -1.55 0.00 0.00 70.33 69.37 1soh n THR 57 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1soh h ALA 58 N 0.00 0.06 0.00 1.79 0.00 -1.90 0.19 119.26 119.41 1soh h ALA 58 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1soh h ALA 58 Cb 1.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1soh h ALA 58 CO 0.00 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.27 1soh h ALA 59 N 0.36 1.00 0.00 0.00 0.00 -1.87 -3.11 119.26 115.64 1soh h ALA 59 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1soh h ALA 59 Cb 0.84 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1soh h ALA 59 CO 0.03 0.00 -1.13 -0.12 0.00 0.00 0.00 179.25 178.04 1soh n MET 60 N -2.71 0.61 -0.46 0.00 1.56 -1.19 -3.85 117.12 111.08 1soh n MET 60 Ca 0.04 0.14 0.05 0.00 -0.27 0.00 0.00 57.70 57.67 1soh n MET 60 Cb 0.45 -1.82 0.24 0.00 2.15 0.00 0.00 33.22 34.24 1soh n MET 60 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 1soh n SER 61 N -2.72 3.49 0.03 6.12 3.41 0.67 -3.81 113.62 120.82 1soh n SER 61 Ca -0.03 -2.40 0.11 0.00 -0.26 0.00 0.00 58.87 56.29 1soh n SER 61 Cb 0.62 -0.52 -0.01 0.00 -0.26 0.00 0.00 64.21 64.04 1soh n SER 61 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1soh n THR 62 N 0.52 0.20 -0.18 6.66 -1.04 -1.24 -4.16 114.28 115.04 1soh n THR 62 Ca 0.17 -0.31 0.30 0.00 -2.04 0.00 0.00 64.05 62.16 1soh n THR 62 Cb 0.70 0.14 0.68 0.00 -1.82 0.00 0.00 70.33 70.02 1soh n THR 62 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1soh h TYR 63 N 0.00 0.00 -0.75 -1.42 -1.99 -1.82 0.50 116.97 111.49 1soh h TYR 63 Ca 0.00 0.00 0.22 0.00 2.00 0.00 0.00 58.73 60.95 1soh h TYR 63 Cb 0.79 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.49 1soh h TYR 63 CO 0.00 0.00 0.70 1.15 -0.00 0.00 0.00 178.16 180.01 1soh h THR 64 N 0.00 0.33 -0.00 -2.88 2.02 -1.89 0.99 112.91 111.47 1soh h THR 64 Ca 0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.63 1soh h THR 64 Cb 2.14 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1soh h THR 64 CO -0.00 0.00 -0.28 0.61 0.37 0.00 0.00 175.52 176.22 1soh n GLY 65 N -1.61 -0.05 0.00 2.16 0.00 0.17 -4.51 105.19 101.35 1soh n GLY 65 Ca 0.15 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.98 1soh n GLY 65 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1soh n ILE 66 N -0.60 0.00 -0.50 -0.61 5.41 0.12 -4.33 119.36 118.85 1soh n ILE 66 Ca 0.03 -0.19 0.43 0.00 1.00 0.00 0.00 62.75 64.02 1soh n ILE 66 Cb 0.18 0.84 0.76 0.00 -0.71 0.00 0.00 39.64 40.72 1soh n ILE 66 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1soh h PHE 67 N 0.00 0.09 0.00 1.39 0.04 0.53 0.99 116.94 119.98 1soh h PHE 67 Ca 0.00 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.60 1soh h PHE 67 Cb 0.41 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.51 1soh h PHE 67 CO 0.00 -0.02 -1.99 2.41 -0.60 0.00 0.00 178.31 178.11 1soh n THR 68 N -4.15 0.66 -0.04 -1.55 -1.04 -1.26 -4.26 114.28 102.63 1soh n THR 68 Ca 0.35 -0.57 -0.12 0.00 -2.04 0.00 0.00 64.05 61.67 1soh n THR 68 Cb 1.59 -0.29 0.01 0.00 -1.82 0.00 0.00 70.33 69.82 1soh n THR 68 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1soh h ASP 69 N 0.00 0.79 0.10 8.00 3.58 -0.07 0.18 116.42 129.00 1soh h ASP 69 Ca -0.26 -0.42 -0.05 0.00 0.42 0.00 0.00 57.03 56.72 1soh h ASP 69 Cb 1.51 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 42.32 1soh h ASP 69 CO 0.01 1.17 -0.18 1.56 -2.88 0.00 0.00 179.24 178.93 1soh h GLN 70 N 0.56 0.16 0.11 0.28 4.20 0.47 -1.79 115.11 119.09 1soh h GLN 70 Ca 0.02 -0.04 -0.25 0.00 0.06 0.00 0.00 58.65 58.44 1soh h GLN 70 Cb 1.10 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.86 1soh h GLN 70 CO 0.11 0.34 -1.26 0.28 -0.67 0.00 0.00 178.83 177.62 1soh h VAL 71 N 0.15 1.13 -0.07 -0.54 2.07 -1.70 -3.30 116.25 113.99 1soh h VAL 71 Ca 0.03 -2.42 0.02 0.00 0.82 0.00 0.00 66.70 65.15 1soh h VAL 71 Cb 0.41 2.80 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1soh h VAL 71 CO 0.03 0.69 0.08 -0.07 0.02 0.00 0.00 177.57 178.31 1soh h LEU 72 N -0.36 0.00 -0.30 2.57 3.38 -0.54 0.62 115.31 120.68 1soh h LEU 72 Ca -0.27 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.62 1soh h LEU 72 Cb 1.71 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.44 1soh h LEU 72 CO 0.06 0.00 -0.40 0.28 0.09 0.00 0.00 178.44 178.47 1soh h SER 73 N 0.00 0.00 -0.22 -0.43 0.02 -1.43 -3.18 113.55 108.32 1soh h SER 73 Ca 0.03 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1soh h SER 73 Cb 0.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1soh h SER 73 CO -0.00 0.40 0.15 0.58 -1.14 0.00 0.00 176.83 176.83 1soh h VAL 74 N 0.00 0.94 -0.13 2.27 2.07 -0.94 0.36 116.25 120.83 1soh h VAL 74 Ca -0.00 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.52 1soh h VAL 74 Cb 1.19 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1soh h VAL 74 CO 0.05 0.02 0.20 0.25 0.02 0.00 0.00 177.57 178.11 1soh h LEU 75 N 0.10 0.00 -6.18 2.57 6.46 -1.64 -3.25 115.31 113.37 1soh h LEU 75 Ca 0.10 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 1soh h LEU 75 Cb 0.27 0.00 -0.23 0.00 -0.73 0.00 0.00 40.66 39.97 1soh h LEU 75 CO -0.01 0.00 -0.32 -0.54 -0.62 0.00 0.00 178.44 176.95 1soh s LYS 76 N -4.45 0.51 0.00 1.25 3.01 0.12 -4.89 119.74 115.29 1soh s LYS 76 Ca -0.04 0.90 0.00 0.00 -1.01 0.00 0.00 55.97 55.82 1soh s LYS 76 Cb 0.14 0.29 0.00 0.00 -1.01 0.00 0.00 37.83 37.24 1soh s LYS 76 CO 0.47 -0.60 0.00 0.41 0.51 0.00 0.00 175.35 176.14 1soh n GLY 77 N 5.41 0.75 2.71 -3.33 0.00 -1.24 -4.63 105.19 104.86 1soh n GLY 77 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1soh n GLY 77 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1soh n GLU 78 N -1.01 -2.66 -0.11 1.61 2.13 -1.23 -4.96 120.64 114.42 1soh n GLU 78 Ca 0.00 0.23 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1soh n GLU 78 Cb 0.00 -4.78 0.00 0.00 0.27 0.00 0.00 31.44 26.93 1soh n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81