#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 0.08 4.78 7.35 -1.26 -4.53 117.46 123.89 1soh n PHE 14 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 1soh n PHE 14 Cb 0.00 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 39.70 1soh n PHE 14 CO 0.00 0.00 0.00 1.37 -0.76 0.00 0.00 176.76 177.37 1soh h LEU 15 N 0.00 0.26 -0.94 -2.13 -0.00 -2.06 -3.25 115.31 107.19 1soh h LEU 15 Ca 0.00 -0.29 -0.09 0.00 -0.00 0.00 0.00 57.88 57.51 1soh h LEU 15 Cb 0.00 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 40.56 1soh h LEU 15 CO 0.00 1.23 -0.41 0.74 -0.00 0.00 0.00 178.44 179.99 1soh h THR 16 N 0.04 1.00 0.16 0.15 2.02 -1.99 -2.77 112.91 111.51 1soh h THR 16 Ca -0.10 -1.59 -0.01 0.00 0.77 0.00 0.00 66.41 65.47 1soh h THR 16 Cb 1.91 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 70.26 1soh h THR 16 CO 0.17 0.40 -0.08 0.06 0.37 0.00 0.00 175.52 176.45 1soh h GLN 17 N 0.00 -0.20 -0.51 6.66 3.07 -1.92 -2.56 115.11 119.65 1soh h GLN 17 Ca -0.00 0.01 -0.02 0.00 0.09 0.00 0.00 58.65 58.73 1soh h GLN 17 Cb 0.91 0.05 -0.03 0.00 0.08 0.00 0.00 27.48 28.49 1soh h GLN 17 CO 0.05 -0.03 0.24 0.28 0.09 0.00 0.00 178.83 179.46 1soh h VAL 18 N -0.34 1.17 -0.22 1.86 2.07 -1.63 0.20 116.25 119.37 1soh h VAL 18 Ca -0.02 -0.49 0.07 0.00 0.82 0.00 0.00 66.70 67.07 1soh h VAL 18 Cb 0.26 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1soh h VAL 18 CO 0.04 0.20 0.25 0.11 0.02 0.00 0.00 177.57 178.18 1soh h LYS 19 N 0.71 0.00 0.00 1.57 1.57 -1.17 1.33 116.57 120.58 1soh h LYS 19 Ca 0.18 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1soh h LYS 19 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1soh h LYS 19 CO -0.02 0.00 -0.05 0.93 -0.57 0.00 0.00 179.45 179.74 1soh h GLU 20 N 0.00 0.00 0.00 3.15 4.39 -0.61 -2.80 114.58 118.72 1soh h GLU 20 Ca 0.11 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.52 1soh h GLU 20 Cb 0.60 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 1soh h GLU 20 CO -0.00 0.05 -1.92 0.43 -1.16 0.00 0.00 179.01 176.41 1soh n SER 21 N -3.11 1.95 0.32 1.42 7.64 0.30 -2.80 113.62 119.33 1soh n SER 21 Ca 0.03 0.34 0.21 0.00 1.01 0.00 0.00 58.87 60.47 1soh n SER 21 Cb 0.53 -0.80 1.11 0.00 -1.01 0.00 0.00 64.21 64.04 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 -1.00 0.00 0.00 -3.43 8.10 0.11 0.97 115.31 120.06 1soh h LEU 22 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.56 1soh h LEU 22 Cb 1.37 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.59 1soh h LEU 22 CO -0.26 0.00 -1.20 -1.20 -4.11 0.00 0.00 178.44 171.67 1soh n SER 23 N -2.97 0.93 0.03 0.17 7.64 -1.05 -4.31 113.62 114.05 1soh n SER 23 Ca -0.03 -0.51 0.09 0.00 1.01 0.00 0.00 58.87 59.44 1soh n SER 23 Cb 0.11 1.33 0.40 0.00 -1.01 0.00 0.00 64.21 65.04 1soh n SER 23 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1soh n SER 24 N -1.68 0.18 -0.00 6.43 7.64 0.33 -1.40 113.62 125.11 1soh n SER 24 Ca 0.00 0.54 0.09 0.00 1.01 0.00 0.00 58.87 60.51 1soh n SER 24 Cb 0.33 -0.58 -0.12 0.00 -1.01 0.00 0.00 64.21 62.84 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 -1.69 0.00 -0.02 1.43 4.02 -1.19 -3.46 117.16 116.24 1soh n TYR 25 Ca 0.04 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.85 1soh n TYR 25 Cb 0.23 -0.19 -0.14 0.00 -0.02 0.00 0.00 39.34 39.22 1soh n TYR 25 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 1soh n TRP 26 N -1.75 0.90 0.15 -0.72 -0.00 -0.90 -2.99 117.44 112.12 1soh n TRP 26 Ca 0.00 0.32 0.09 0.00 -0.00 0.00 0.00 57.50 57.92 1soh n TRP 26 Cb 0.37 -1.16 0.06 0.00 -0.00 0.00 0.00 31.31 30.59 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 0.00 0.00 0.14 5.87 4.11 -1.42 -3.32 114.58 119.96 1soh h GLU 27 Ca -0.30 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 58.94 1soh h GLU 27 Cb 1.99 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.26 1soh h GLU 27 CO 0.07 0.09 -0.84 1.03 0.07 0.00 0.00 179.01 179.44 1soh h SER 28 N 0.00 0.47 -0.90 3.06 0.87 -1.67 -2.34 113.55 113.04 1soh h SER 28 Ca -0.02 -0.95 0.26 0.00 -1.23 0.00 0.00 61.79 59.85 1soh h SER 28 Cb 1.10 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.87 1soh h SER 28 CO 0.01 1.40 0.64 0.00 -0.53 0.00 0.00 176.83 178.36 1soh h ALA 29 N 0.08 2.81 0.00 6.23 0.00 -1.64 0.69 119.26 127.42 1soh h ALA 29 Ca -0.15 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.50 1soh h ALA 29 Cb 1.65 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.46 1soh h ALA 29 CO 0.15 -1.07 -1.47 -0.22 0.00 0.00 0.00 179.25 176.64 1soh h LYS 30 N 0.03 0.00 -0.01 0.00 3.64 -1.66 -2.59 116.57 115.98 1soh h LYS 30 Ca 0.43 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.68 1soh h LYS 30 Cb 1.69 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.49 1soh h LYS 30 CO -0.02 0.50 -0.63 1.15 -2.27 0.00 0.00 179.45 178.18 1soh h THR 31 N 0.00 1.45 -0.22 1.00 2.02 0.73 -3.13 112.91 114.75 1soh h THR 31 Ca -0.20 -2.15 -0.02 0.00 0.77 0.00 0.00 66.41 64.81 1soh h THR 31 Cb 1.83 2.15 -0.01 0.00 -1.74 0.00 0.00 68.15 70.38 1soh h THR 31 CO 0.08 0.62 -0.01 0.00 0.37 0.00 0.00 175.52 176.58 1soh n ALA 32 N -2.43 2.99 -0.09 6.16 0.00 0.11 -4.65 120.51 122.60 1soh n ALA 32 Ca -0.01 -2.44 -0.15 0.00 0.00 0.00 0.00 53.44 50.84 1soh n ALA 32 Cb 0.63 -0.66 -0.07 0.00 0.00 0.00 0.00 19.45 19.35 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 -0.72 0.69 0.21 0.00 0.00 -0.98 -3.42 120.51 116.29 1soh n ALA 33 Ca 0.21 -0.53 0.18 0.00 0.00 0.00 0.00 53.44 53.30 1soh n ALA 33 Cb 0.86 -0.23 0.83 0.00 0.00 0.00 0.00 19.45 20.92 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 0.12 0.00 4.15 -1.83 0.17 115.11 116.72 1soh h GLN 34 Ca -0.22 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.20 1soh h GLN 34 Cb 0.99 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.68 1soh h GLN 34 CO -0.13 0.00 -0.06 -0.97 -1.93 0.00 0.00 178.83 175.74 1soh h ASN 35 N 0.00 -0.13 -0.65 -0.69 -1.24 -1.84 -3.29 115.58 107.74 1soh h ASN 35 Ca 0.10 0.00 0.09 0.00 0.71 0.00 0.00 56.30 57.20 1soh h ASN 35 Cb 0.68 0.03 -0.04 0.00 0.73 0.00 0.00 38.32 39.72 1soh h ASN 35 CO -0.00 0.22 0.43 0.17 -1.29 0.00 0.00 177.43 176.96 1soh h LEU 36 N -0.79 0.47 -2.71 0.34 8.10 -1.48 0.94 115.31 120.18 1soh h LEU 36 Ca -0.02 0.01 0.00 0.00 0.11 0.00 0.00 57.88 57.98 1soh h LEU 36 Cb 0.12 -0.09 0.00 0.00 -0.44 0.00 0.00 40.66 40.25 1soh h LEU 36 CO 0.03 0.29 0.00 0.22 -4.11 0.00 0.00 178.44 174.86 1soh h TYR 37 N 0.52 0.00 -0.08 0.17 5.03 -0.80 -0.70 116.97 121.12 1soh h TYR 37 Ca 0.29 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.49 1soh h TYR 37 Cb 0.46 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.73 1soh h TYR 37 CO -0.00 0.00 -0.46 1.49 -1.32 0.00 0.00 178.16 177.86 1soh h GLU 38 N 0.00 0.19 -0.64 1.82 4.22 -0.87 -2.62 114.58 116.68 1soh h GLU 38 Ca 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 59.36 59.34 1soh h GLU 38 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1soh h GLU 38 CO 0.00 0.62 0.00 1.63 -2.18 0.00 0.00 179.01 179.08 1soh n LYS 39 N -3.98 3.16 -4.27 1.92 4.01 -0.27 -4.92 118.16 113.81 1soh n LYS 39 Ca -0.02 -2.04 -0.36 0.00 -0.51 0.00 0.00 58.31 55.39 1soh n LYS 39 Cb 0.51 -1.81 -0.05 0.00 -0.51 0.00 0.00 35.03 33.18 1soh n LYS 39 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1soh n THR 40 N 0.62 -1.11 -1.26 -0.18 5.66 -0.99 -4.82 114.28 112.20 1soh n THR 40 Ca 0.18 -0.14 -0.12 0.00 -3.05 0.00 0.00 64.05 60.92 1soh n THR 40 Cb 0.74 -1.49 0.21 0.00 -1.55 0.00 0.00 70.33 68.24 1soh n THR 40 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1soh n TYR 41 N -4.34 2.17 -0.06 1.09 4.19 -1.23 -4.52 117.16 114.46 1soh n TYR 41 Ca -0.02 -1.59 -0.13 0.00 3.31 0.00 0.00 57.90 59.47 1soh n TYR 41 Cb 0.54 -0.71 -0.04 0.00 0.49 0.00 0.00 39.34 39.61 1soh n TYR 41 CO 0.00 0.00 0.00 -0.11 0.91 0.00 0.00 176.86 177.66 1soh n LEU 42 N -0.93 1.23 0.00 2.98 0.00 -1.26 -4.00 117.00 115.01 1soh n LEU 42 Ca 0.45 0.20 0.03 0.00 0.00 0.00 0.00 56.01 56.70 1soh n LEU 42 Cb 1.36 -0.48 0.15 0.00 0.00 0.00 0.00 43.42 44.45 1soh n LEU 42 CO 0.41 0.06 0.59 -2.65 0.00 0.00 0.00 177.39 175.80 1soh n PRO 43 N -3.79 0.02 0.00 1.96 -0.02 -1.26 -2.08 135.00 129.82 1soh n PRO 43 Ca -0.23 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1soh n PRO 43 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 1soh n PRO 43 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1soh n ALA 44 N -1.46 1.97 0.21 3.55 0.00 -1.26 -4.67 120.51 118.85 1soh n ALA 44 Ca 0.02 -0.64 0.08 0.00 0.00 0.00 0.00 53.44 52.90 1soh n ALA 44 Cb 0.07 0.00 0.47 0.00 0.00 0.00 0.00 19.45 20.00 1soh n ALA 44 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1soh h VAL 45 N 0.31 0.81 0.00 0.00 3.04 -1.55 0.95 116.25 119.81 1soh h VAL 45 Ca 0.00 -1.13 0.00 0.00 -1.01 0.00 0.00 66.70 64.56 1soh h VAL 45 Cb 0.30 1.69 0.00 0.00 -2.01 0.00 0.00 31.29 31.27 1soh h VAL 45 CO 0.00 0.27 -0.13 -0.78 -1.01 0.00 0.00 177.57 175.92 1soh h ASP 46 N 0.00 0.00 -0.01 3.17 3.58 -1.83 -2.95 116.42 118.37 1soh h ASP 46 Ca -0.00 -0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.31 1soh h ASP 46 Cb 0.67 0.00 -0.28 0.00 1.72 0.00 0.00 39.33 41.43 1soh h ASP 46 CO 0.04 0.00 -0.89 1.21 -2.88 0.00 0.00 179.24 176.72 1soh n GLU 47 N -2.96 0.49 0.16 0.28 2.13 -0.87 -4.53 120.64 115.34 1soh n GLU 47 Ca 0.04 -2.40 0.00 0.00 0.66 0.00 0.00 57.16 55.46 1soh n GLU 47 Cb 0.52 -0.49 0.00 0.00 0.27 0.00 0.00 31.44 31.74 1soh n GLU 47 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1soh n LYS 48 N 0.03 0.00 -0.81 5.31 4.81 0.32 -4.49 118.16 123.33 1soh n LYS 48 Ca 0.10 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.42 1soh n LYS 48 Cb 1.02 0.00 0.01 0.00 0.02 0.00 0.00 35.03 36.07 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 -3.20 6.03 0.00 3.14 7.94 -0.84 -1.89 117.00 128.17 1soh n LEU 49 Ca 0.00 -3.05 0.00 0.00 -1.11 0.00 0.00 56.01 51.85 1soh n LEU 49 Cb 0.00 -1.12 0.00 0.00 0.53 0.00 0.00 43.42 42.83 1soh n LEU 49 CO 0.00 1.22 0.00 -1.14 -1.11 0.00 0.00 177.39 176.36 1soh n ARG 50 N 0.90 0.00 -0.05 1.96 3.00 -1.12 -4.80 116.66 116.54 1soh n ARG 50 Ca 0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 57.85 58.02 1soh n ARG 50 Cb 0.57 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.95 1soh n ARG 50 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1soh n ASP 51 N -0.01 2.55 -1.07 6.15 -0.08 -1.24 -4.10 116.55 118.74 1soh n ASP 51 Ca 0.00 -0.01 0.05 0.00 -1.51 0.00 0.00 54.79 53.32 1soh n ASP 51 Cb 0.00 0.66 0.21 0.00 2.34 0.00 0.00 41.12 44.33 1soh n ASP 51 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1soh n LEU 52 N -2.42 3.07 0.00 -2.67 0.00 -0.79 -4.14 117.00 110.04 1soh n LEU 52 Ca -0.17 -1.55 0.00 0.00 0.00 0.00 0.00 56.01 54.29 1soh n LEU 52 Cb 0.82 -0.48 0.00 0.00 0.00 0.00 0.00 43.42 43.76 1soh n LEU 52 CO 0.21 0.49 -0.44 0.00 0.00 0.00 0.00 177.39 177.65 1soh n TYR 53 N 0.46 0.00 -3.54 1.96 4.19 -1.24 -4.97 117.16 114.01 1soh n TYR 53 Ca 0.15 0.00 -0.22 0.00 3.31 0.00 0.00 57.90 61.13 1soh n TYR 53 Cb 0.61 0.06 -0.04 0.00 0.49 0.00 0.00 39.34 40.47 1soh n TYR 53 CO 0.00 0.00 0.00 0.43 0.91 0.00 0.00 176.86 178.20 1soh n SER 54 N -2.93 -1.66 0.00 2.98 7.64 -1.26 -4.16 113.62 114.23 1soh n SER 54 Ca 0.00 -0.41 0.00 0.00 1.01 0.00 0.00 58.87 59.47 1soh n SER 54 Cb 0.44 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 1soh n SER 54 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1soh n LYS 55 N -3.35 0.00 -0.10 1.43 4.81 -1.26 -4.73 118.16 114.95 1soh n LYS 55 Ca 0.05 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.44 1soh n LYS 55 Cb 0.48 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.54 1soh n LYS 55 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1soh h SER 56 N 0.00 -0.59 0.00 3.14 4.64 -1.95 -3.17 113.55 115.62 1soh h SER 56 Ca 0.00 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1soh h SER 56 Cb 0.00 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1soh h SER 56 CO 0.00 -0.21 -0.15 1.07 -0.87 0.00 0.00 176.83 176.67 1soh n THR 57 N -5.35 0.93 -0.08 2.95 5.66 -1.26 -4.76 114.28 112.37 1soh n THR 57 Ca 0.02 -1.09 -0.13 0.00 -3.05 0.00 0.00 64.05 59.79 1soh n THR 57 Cb 0.27 0.26 -0.05 0.00 -1.55 0.00 0.00 70.33 69.25 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 0.34 0.00 1.79 0.00 -1.84 -2.21 119.26 117.34 1soh h ALA 58 Ca 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 1soh h ALA 58 Cb 1.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1soh h ALA 58 CO 0.00 0.34 -0.25 0.00 0.00 0.00 0.00 179.25 179.34 1soh h ALA 59 N 0.66 1.07 0.00 0.00 0.00 -1.86 -1.26 119.26 117.87 1soh h ALA 59 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1soh h ALA 59 Cb 0.83 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1soh h ALA 59 CO 0.06 0.31 0.00 1.98 0.00 0.00 0.00 179.25 181.60 1soh h MET 60 N 0.00 0.00 -1.32 0.00 4.05 -1.82 -3.35 114.93 112.50 1soh h MET 60 Ca -0.00 0.00 -0.40 0.00 -0.28 0.00 0.00 59.70 59.02 1soh h MET 60 Cb 0.71 0.00 -0.40 0.00 -0.80 0.00 0.00 31.60 31.11 1soh h MET 60 CO 0.03 0.00 -1.20 0.45 0.23 0.00 0.00 176.91 176.43 1soh n SER 61 N -3.04 1.28 -0.01 1.39 2.88 -0.85 -4.85 113.62 110.42 1soh n SER 61 Ca 0.04 -2.81 0.10 0.00 -1.33 0.00 0.00 58.87 54.87 1soh n SER 61 Cb 0.51 -0.56 -0.14 0.00 -0.75 0.00 0.00 64.21 63.27 1soh n SER 61 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1soh n THR 62 N 0.04 0.00 -0.24 2.46 -1.04 -0.51 -4.36 114.28 110.63 1soh n THR 62 Ca 0.14 -0.28 0.32 0.00 -2.04 0.00 0.00 64.05 62.20 1soh n THR 62 Cb 0.77 0.45 0.69 0.00 -1.82 0.00 0.00 70.33 70.42 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 -0.81 -1.42 -1.99 -1.88 0.55 116.97 111.43 1soh h TYR 63 Ca 0.00 0.00 0.23 0.00 2.00 0.00 0.00 58.73 60.96 1soh h TYR 63 Cb 0.74 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.44 1soh h TYR 63 CO 0.00 0.00 0.71 1.15 -0.00 0.00 0.00 178.16 180.02 1soh h THR 64 N 0.00 0.35 -0.00 -2.88 2.02 -1.98 0.93 112.91 111.35 1soh h THR 64 Ca 0.50 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.68 1soh h THR 64 Cb 2.30 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1soh h THR 64 CO -0.01 0.00 -0.44 0.61 0.37 0.00 0.00 175.52 176.05 1soh n GLY 65 N -1.64 -0.04 0.00 2.16 0.00 0.19 -4.48 105.19 101.39 1soh n GLY 65 Ca 0.17 -0.31 0.10 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 -1.01 0.00 -0.58 -0.61 5.41 0.13 -4.29 119.36 118.41 1soh n ILE 66 Ca 0.03 -0.23 0.46 0.00 1.00 0.00 0.00 62.75 64.01 1soh n ILE 66 Cb 0.18 0.56 0.76 0.00 -0.71 0.00 0.00 39.64 40.44 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 0.17 0.00 1.39 -1.00 0.40 1.09 116.94 118.99 1soh h PHE 67 Ca 0.00 0.01 -0.22 0.00 2.81 0.00 0.00 57.97 60.57 1soh h PHE 67 Cb 0.69 -0.04 -0.04 0.00 3.61 0.00 0.00 35.95 40.16 1soh h PHE 67 CO 0.00 -0.07 -2.11 2.41 -1.61 0.00 0.00 178.31 176.93 1soh n THR 68 N -4.22 0.82 -0.04 -1.55 -1.04 -1.26 -4.22 114.28 102.78 1soh n THR 68 Ca 0.40 -0.65 -0.11 0.00 -2.04 0.00 0.00 64.05 61.64 1soh n THR 68 Cb 1.74 -0.33 0.02 0.00 -1.82 0.00 0.00 70.33 69.94 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 0.77 0.27 8.00 3.58 0.46 -0.17 116.42 129.33 1soh h ASP 69 Ca -0.33 -0.40 -0.05 0.00 0.42 0.00 0.00 57.03 56.67 1soh h ASP 69 Cb 1.70 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 42.52 1soh h ASP 69 CO 0.02 1.14 -0.26 -0.61 -2.88 0.00 0.00 179.24 176.65 1soh h GLN 70 N 0.55 0.00 0.12 0.28 5.75 0.56 -1.63 115.11 120.75 1soh h GLN 70 Ca 0.02 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 58.30 1soh h GLN 70 Cb 1.07 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.63 1soh h GLN 70 CO 0.10 0.26 -1.04 0.28 -2.65 0.00 0.00 178.83 175.79 1soh h VAL 71 N 0.00 1.32 0.00 2.39 2.07 -1.68 -3.19 116.25 117.15 1soh h VAL 71 Ca -0.00 -2.47 -0.01 0.00 0.82 0.00 0.00 66.70 65.04 1soh h VAL 71 Cb 0.46 2.99 -0.00 0.00 -1.52 0.00 0.00 31.29 33.23 1soh h VAL 71 CO 0.03 0.70 -0.03 -0.07 0.02 0.00 0.00 177.57 178.23 1soh h LEU 72 N -0.38 0.00 -0.27 2.57 4.07 -0.89 -0.57 115.31 119.84 1soh h LEU 72 Ca -0.21 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.67 1soh h LEU 72 Cb 1.66 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.39 1soh h LEU 72 CO 0.10 0.03 -0.41 0.77 -1.08 0.00 0.00 178.44 177.85 1soh h SER 73 N 0.00 0.00 -0.15 -0.43 4.64 -1.39 -3.18 113.55 113.04 1soh h SER 73 Ca -0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1soh h SER 73 Cb 0.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 1soh h SER 73 CO 0.00 0.41 0.11 0.58 -0.87 0.00 0.00 176.83 177.07 1soh h VAL 74 N 0.00 0.87 -0.59 0.95 2.07 -1.08 0.61 116.25 119.07 1soh h VAL 74 Ca -0.00 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.34 1soh h VAL 74 Cb 1.21 0.92 -0.10 0.00 -1.52 0.00 0.00 31.29 31.80 1soh h VAL 74 CO 0.05 0.00 0.22 0.18 0.02 0.00 0.00 177.57 178.04 1soh n LEU 75 N -4.40 5.25 0.00 2.57 4.77 -1.20 -0.66 117.00 123.33 1soh n LEU 75 Ca 0.01 -2.72 0.00 0.00 -0.03 0.00 0.00 56.01 53.26 1soh n LEU 75 Cb 0.24 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 1soh n LEU 75 CO 0.34 0.71 0.00 2.29 -1.33 0.00 0.00 177.39 179.40 1soh n LYS 76 N -0.06 0.00 0.00 3.23 2.85 0.12 -4.93 118.16 119.37 1soh n LYS 76 Ca 0.33 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.59 1soh n LYS 76 Cb 1.18 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.56 1soh n LYS 76 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1soh n GLY 77 N 0.00 1.34 2.47 2.58 0.00 -0.84 -4.51 105.19 106.23 1soh n GLY 77 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1soh n GLY 77 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1soh n GLU 78 N -0.68 1.24 0.00 1.61 -0.58 0.17 -4.89 120.64 117.51 1soh n GLU 78 Ca 0.00 -1.69 0.11 0.00 -0.42 0.00 0.00 57.16 55.16 1soh n GLU 78 Cb 0.00 0.00 0.09 0.00 -0.57 0.00 0.00 31.44 30.96 1soh n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74