#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1soh h PHE 14 N 0.00 0.00 0.00 -1.42 0.04 -2.06 -3.14 116.94 110.36 1soh h PHE 14 Ca 0.00 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.59 1soh h PHE 14 Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 1soh h PHE 14 CO 0.00 0.39 -1.00 1.37 -0.60 0.00 0.00 178.31 178.47 1soh h LEU 15 N 0.00 0.00 -0.79 1.54 -0.00 -2.05 -3.31 115.31 110.70 1soh h LEU 15 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.77 1soh h LEU 15 Cb 1.15 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.80 1soh h LEU 15 CO 0.05 0.75 -0.26 0.74 -0.00 0.00 0.00 178.44 179.72 1soh h THR 16 N 0.00 1.27 0.23 0.15 2.02 -1.97 -0.65 112.91 113.96 1soh h THR 16 Ca -0.07 -1.34 -0.01 0.00 0.77 0.00 0.00 66.41 65.75 1soh h THR 16 Cb 1.64 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1soh h THR 16 CO 0.09 0.44 -0.11 0.06 0.37 0.00 0.00 175.52 176.36 1soh h GLN 17 N 0.54 -0.29 -0.46 6.66 3.07 -1.64 -2.61 115.11 120.38 1soh h GLN 17 Ca 0.07 0.02 -0.02 0.00 0.09 0.00 0.00 58.65 58.81 1soh h GLN 17 Cb 0.73 0.07 -0.02 0.00 0.08 0.00 0.00 27.48 28.33 1soh h GLN 17 CO 0.06 -0.09 0.20 0.28 0.09 0.00 0.00 178.83 179.36 1soh h VAL 18 N -0.44 1.17 -0.26 1.86 2.07 -1.63 0.04 116.25 119.06 1soh h VAL 18 Ca -0.03 -0.50 0.07 0.00 0.82 0.00 0.00 66.70 67.06 1soh h VAL 18 Cb 0.34 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1soh h VAL 18 CO 0.05 0.20 0.28 0.11 0.02 0.00 0.00 177.57 178.23 1soh h LYS 19 N 0.65 0.00 0.00 1.57 1.79 -0.75 1.27 116.57 121.10 1soh h LYS 19 Ca 0.16 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.60 1soh h LYS 19 Cb 0.10 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1soh h LYS 19 CO -0.02 0.00 -0.17 0.93 -1.08 0.00 0.00 179.45 179.11 1soh h GLU 20 N 0.00 0.00 0.00 3.15 4.39 -0.66 -2.76 114.58 118.70 1soh h GLU 20 Ca 0.12 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.54 1soh h GLU 20 Cb 0.68 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.29 1soh h GLU 20 CO -0.00 0.17 -1.88 0.43 -1.16 0.00 0.00 179.01 176.56 1soh n SER 21 N -3.17 1.94 0.31 1.42 7.64 0.31 -3.03 113.62 119.05 1soh n SER 21 Ca 0.03 0.35 0.19 0.00 1.01 0.00 0.00 58.87 60.45 1soh n SER 21 Cb 0.55 -0.80 1.02 0.00 -1.01 0.00 0.00 64.21 63.97 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 0.97 0.30 115.31 120.26 1soh h LEU 22 Ca -0.42 0.00 -0.09 0.00 0.11 0.00 0.00 57.88 57.48 1soh h LEU 22 Cb 1.35 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.56 1soh h LEU 22 CO -0.25 0.00 -1.71 -0.24 -4.11 0.00 0.00 178.44 172.13 1soh n SER 23 N -3.18 0.37 -0.01 0.17 2.88 -1.04 -3.21 113.62 109.60 1soh n SER 23 Ca -0.02 0.15 0.14 0.00 -1.33 0.00 0.00 58.87 57.81 1soh n SER 23 Cb 0.21 1.13 0.65 0.00 -0.75 0.00 0.00 64.21 65.46 1soh n SER 23 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1soh n SER 24 N -2.55 0.04 -0.07 -3.46 2.88 0.98 -2.79 113.62 108.66 1soh n SER 24 Ca -0.08 0.20 0.02 0.00 -1.33 0.00 0.00 58.87 57.68 1soh n SER 24 Cb 0.70 -0.38 -0.01 0.00 -0.75 0.00 0.00 64.21 63.78 1soh n SER 24 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1soh n TYR 25 N -1.40 0.00 0.00 0.66 4.19 -0.69 -4.30 117.16 115.61 1soh n TYR 25 Ca 0.10 0.00 -0.03 0.00 3.31 0.00 0.00 57.90 61.28 1soh n TYR 25 Cb 0.30 0.00 -0.11 0.00 0.49 0.00 0.00 39.34 40.02 1soh n TYR 25 CO 0.00 0.00 0.00 1.87 0.91 0.00 0.00 176.86 179.64 1soh n TRP 26 N -0.58 0.87 0.13 2.98 -0.00 -1.17 -3.03 117.44 116.63 1soh n TRP 26 Ca 0.01 0.30 0.05 0.00 -0.00 0.00 0.00 57.50 57.87 1soh n TRP 26 Cb 0.08 -1.09 0.03 0.00 -0.00 0.00 0.00 31.31 30.33 1soh n TRP 26 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 1soh h GLU 27 N 0.00 0.00 0.23 5.87 4.81 -1.75 -3.31 114.58 120.42 1soh h GLU 27 Ca -0.23 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.67 1soh h GLU 27 Cb 1.75 0.00 0.03 0.00 0.63 0.00 0.00 28.75 31.16 1soh h GLU 27 CO 0.05 0.26 -1.50 1.03 -0.73 0.00 0.00 179.01 178.13 1soh h SER 28 N 0.00 0.75 -0.50 1.04 0.87 -1.75 -3.19 113.55 110.76 1soh h SER 28 Ca -0.04 -0.93 0.14 0.00 -1.23 0.00 0.00 61.79 59.74 1soh h SER 28 Cb 1.29 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.98 1soh h SER 28 CO 0.04 1.71 0.43 0.00 -0.53 0.00 0.00 176.83 178.48 1soh h ALA 29 N 0.13 2.32 0.00 6.23 0.00 -1.64 1.00 119.26 127.29 1soh h ALA 29 Ca -0.27 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 1soh h ALA 29 Cb 2.10 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.90 1soh h ALA 29 CO 0.23 -0.69 -0.76 0.87 0.00 0.00 0.00 179.25 178.90 1soh h LYS 30 N 0.00 0.00 -0.98 0.00 1.79 -1.64 1.25 116.57 116.99 1soh h LYS 30 Ca 0.24 0.00 0.15 0.00 -2.18 0.00 0.00 60.65 58.86 1soh h LYS 30 Cb 1.10 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.66 1soh h LYS 30 CO -0.00 0.76 0.61 1.15 -1.08 0.00 0.00 179.45 180.89 1soh h THR 31 N 0.00 0.82 0.00 -0.16 2.02 0.11 -3.40 112.91 112.30 1soh h THR 31 Ca -0.01 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 1soh h THR 31 Cb 1.53 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1soh h THR 31 CO 0.10 0.15 -0.03 0.00 0.37 0.00 0.00 175.52 176.11 1soh n ALA 32 N -2.37 -1.31 -0.00 6.16 0.00 -1.19 -5.01 120.51 116.80 1soh n ALA 32 Ca 0.20 -0.09 -0.00 0.00 0.00 0.00 0.00 53.44 53.55 1soh n ALA 32 Cb 0.47 -0.43 -0.00 0.00 0.00 0.00 0.00 19.45 19.48 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 -0.10 1.99 0.62 0.00 0.00 0.35 -4.45 120.51 118.92 1soh n ALA 33 Ca -0.02 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.53 1soh n ALA 33 Cb 0.45 0.42 0.45 0.00 0.00 0.00 0.00 19.45 20.77 1soh n ALA 33 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1soh n GLN 34 N -2.37 0.21 -0.08 0.00 6.02 0.32 -1.95 117.38 119.53 1soh n GLN 34 Ca -0.01 0.24 -0.15 0.00 -0.01 0.00 0.00 57.00 57.07 1soh n GLN 34 Cb 0.51 -1.77 -0.10 0.00 1.02 0.00 0.00 30.24 29.90 1soh n GLN 34 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 177.06 175.08 1soh h ASN 35 N 0.00 0.00 -0.50 1.08 -0.73 -1.82 -3.31 115.58 110.30 1soh h ASN 35 Ca 0.00 -0.57 -0.13 0.00 1.87 0.00 0.00 56.30 57.47 1soh h ASN 35 Cb 0.61 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.19 1soh h ASN 35 CO 0.00 1.13 -0.19 0.17 -0.37 0.00 0.00 177.43 178.18 1soh h LEU 36 N -1.00 1.03 -0.41 0.34 8.10 -1.78 -2.74 115.31 118.85 1soh h LEU 36 Ca -0.15 -0.38 0.00 0.00 0.11 0.00 0.00 57.88 57.45 1soh h LEU 36 Cb 0.98 -0.28 0.00 0.00 -0.44 0.00 0.00 40.66 40.91 1soh h LEU 36 CO -0.09 1.18 0.00 0.00 -4.11 0.00 0.00 178.44 175.42 1soh n TYR 37 N -4.13 0.33 0.07 0.17 4.11 -0.82 -1.48 117.16 115.42 1soh n TYR 37 Ca 0.00 0.14 0.09 0.00 -0.00 0.00 0.00 57.90 58.14 1soh n TYR 37 Cb 0.44 -0.73 -0.04 0.00 -0.00 0.00 0.00 39.34 39.01 1soh n TYR 37 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1soh n GLU 38 N -1.82 0.62 -0.90 -3.48 -0.58 -1.04 -3.26 120.64 110.18 1soh n GLU 38 Ca 0.02 0.10 0.05 0.00 -0.42 0.00 0.00 57.16 56.91 1soh n GLU 38 Cb 0.13 -1.78 0.15 0.00 -0.57 0.00 0.00 31.44 29.36 1soh n GLU 38 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1soh n LYS 39 N -2.66 1.11 0.00 3.49 2.85 -0.72 -4.75 118.16 117.48 1soh n LYS 39 Ca -0.03 -2.91 0.00 0.00 -1.05 0.00 0.00 58.31 54.32 1soh n LYS 39 Cb 0.61 -1.12 0.00 0.00 -0.65 0.00 0.00 35.03 33.87 1soh n LYS 39 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1soh n THR 40 N -0.61 0.00 -2.32 0.58 -2.24 -0.55 -4.99 114.28 104.15 1soh n THR 40 Ca 0.15 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 1soh n THR 40 Cb 0.84 -0.70 -0.01 0.00 -2.10 0.00 0.00 70.33 68.36 1soh n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1soh n TYR 41 N -1.45 0.00 -3.92 4.78 4.19 -1.26 -5.04 117.16 114.46 1soh n TYR 41 Ca 0.00 -0.50 -0.35 0.00 3.31 0.00 0.00 57.90 60.36 1soh n TYR 41 Cb 0.00 0.09 0.01 0.00 0.49 0.00 0.00 39.34 39.93 1soh n TYR 41 CO 0.00 0.00 0.00 1.47 0.91 0.00 0.00 176.86 179.24 1soh n LEU 42 N 0.32 -0.89 -1.22 2.98 -0.00 -1.20 -4.81 117.00 112.17 1soh n LEU 42 Ca -0.06 -1.10 -0.04 0.00 -0.00 0.00 0.00 56.01 54.81 1soh n LEU 42 Cb 0.99 -1.51 0.09 0.00 -0.00 0.00 0.00 43.42 42.98 1soh n LEU 42 CO -0.08 0.60 0.63 -0.81 -0.00 0.00 0.00 177.39 177.74 1soh n PRO 43 N -3.75 1.77 0.02 1.47 -0.05 -1.24 -3.92 135.00 129.31 1soh n PRO 43 Ca -0.21 -1.01 0.12 0.00 -0.05 0.00 0.00 63.50 62.35 1soh n PRO 43 Cb 0.60 -1.54 0.16 0.00 -0.05 0.00 0.00 33.50 32.67 1soh n PRO 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1soh n ALA 44 N 0.06 3.38 0.07 0.55 0.00 -1.26 -3.86 120.51 119.45 1soh n ALA 44 Ca 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 53.44 53.25 1soh n ALA 44 Cb 0.75 -1.09 0.29 0.00 0.00 0.00 0.00 19.45 19.40 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 0.00 1.24 -0.00 0.00 3.04 -1.94 0.93 116.25 119.52 1soh h VAL 45 Ca 0.00 -1.12 0.00 0.00 -1.01 0.00 0.00 66.70 64.57 1soh h VAL 45 Cb 0.62 1.36 0.00 0.00 -2.01 0.00 0.00 31.29 31.26 1soh h VAL 45 CO 0.00 0.35 -0.01 -0.67 -1.01 0.00 0.00 177.57 176.23 1soh n ASP 46 N -4.16 0.01 -1.10 3.17 2.03 -1.25 -0.78 116.55 114.45 1soh n ASP 46 Ca -0.01 0.35 0.04 0.00 0.52 0.00 0.00 54.79 55.70 1soh n ASP 46 Cb 0.36 -0.45 0.06 0.00 -0.72 0.00 0.00 41.12 40.37 1soh n ASP 46 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1soh n GLU 47 N -1.45 0.37 0.10 -0.67 1.02 -0.44 -4.51 120.64 115.06 1soh n GLU 47 Ca 0.09 -2.13 0.00 0.00 -0.02 0.00 0.00 57.16 55.10 1soh n GLU 47 Cb 0.32 -0.46 0.00 0.00 -0.02 0.00 0.00 31.44 31.28 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 0.02 0.00 0.32 3.49 4.81 0.31 -4.69 118.16 122.42 1soh n LYS 48 Ca 0.08 0.00 0.20 0.00 -0.87 0.00 0.00 58.31 57.73 1soh n LYS 48 Cb 0.97 0.00 1.02 0.00 0.02 0.00 0.00 35.03 37.04 1soh n LYS 48 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1soh h LEU 49 N 0.00 0.00 -1.78 3.14 3.38 -1.42 -1.62 115.31 117.01 1soh h LEU 49 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1soh h LEU 49 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1soh h LEU 49 CO 0.00 0.01 -0.22 -1.14 0.09 0.00 0.00 178.44 177.17 1soh n ARG 50 N -3.13 0.34 0.00 1.13 0.00 0.04 -4.79 116.66 110.25 1soh n ARG 50 Ca -0.02 -0.98 0.00 0.00 -0.00 0.00 0.00 57.85 56.85 1soh n ARG 50 Cb 0.15 -0.63 0.00 0.00 0.00 0.00 0.00 32.46 31.99 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 -0.17 0.26 -0.06 6.15 -0.08 -1.10 -4.72 116.55 116.83 1soh n ASP 51 Ca 0.01 -0.63 0.02 0.00 -1.51 0.00 0.00 54.79 52.69 1soh n ASP 51 Cb 0.58 0.25 0.12 0.00 2.34 0.00 0.00 41.12 44.42 1soh n ASP 51 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1soh n LEU 52 N -0.25 0.17 -0.08 -2.67 4.77 -0.63 -3.84 117.00 114.47 1soh n LEU 52 Ca 0.00 -0.08 -0.07 0.00 -0.03 0.00 0.00 56.01 55.83 1soh n LEU 52 Cb 0.06 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1soh n LEU 52 CO 0.00 0.04 -0.49 -1.22 -1.33 0.00 0.00 177.39 174.39 1soh n TYR 53 N -0.46 0.39 -4.17 -1.77 4.01 -1.26 -4.98 117.16 108.92 1soh n TYR 53 Ca 0.04 0.17 -0.31 0.00 -0.16 0.00 0.00 57.90 57.64 1soh n TYR 53 Cb 0.04 -0.58 -0.05 0.00 -0.31 0.00 0.00 39.34 38.44 1soh n TYR 53 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1soh n SER 54 N -4.37 -0.86 0.00 7.72 7.64 -1.25 -4.30 113.62 118.20 1soh n SER 54 Ca -0.10 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.68 1soh n SER 54 Cb 0.38 -2.48 0.00 0.00 -1.01 0.00 0.00 64.21 61.09 1soh n SER 54 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1soh n LYS 55 N -4.42 0.00 -0.29 1.43 2.85 -1.26 -4.80 118.16 111.67 1soh n LYS 55 Ca -0.18 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.07 1soh n LYS 55 Cb 0.62 0.00 0.12 0.00 -0.65 0.00 0.00 35.03 35.12 1soh n LYS 55 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1soh h SER 56 N 0.00 0.79 0.00 -5.58 0.87 -1.98 -3.33 113.55 104.32 1soh h SER 56 Ca 0.00 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 1soh h SER 56 Cb 0.00 -0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 61.75 1soh h SER 56 CO 0.00 0.52 -0.42 0.41 -0.53 0.00 0.00 176.83 176.81 1soh n THR 57 N -4.64 0.00 -0.01 2.23 -1.04 -1.26 -4.89 114.28 104.67 1soh n THR 57 Ca 0.11 -0.13 -0.13 0.00 -2.04 0.00 0.00 64.05 61.86 1soh n THR 57 Cb 0.15 0.43 -0.10 0.00 -1.82 0.00 0.00 70.33 68.99 1soh n THR 57 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1soh h ALA 58 N 0.13 -0.04 0.00 2.41 0.00 -1.85 0.91 119.26 120.81 1soh h ALA 58 Ca -0.06 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 1soh h ALA 58 Cb 1.36 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1soh h ALA 58 CO -0.01 -0.24 -0.26 0.00 0.00 0.00 0.00 179.25 178.74 1soh h ALA 59 N 0.32 1.34 0.00 0.00 0.00 -1.91 0.47 119.26 119.47 1soh h ALA 59 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1soh h ALA 59 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1soh h ALA 59 CO 0.01 0.33 -0.39 0.52 0.00 0.00 0.00 179.25 179.72 1soh h MET 60 N 0.00 0.00 -1.14 0.00 2.86 -1.89 -3.37 114.93 111.39 1soh h MET 60 Ca -0.00 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.26 1soh h MET 60 Cb 0.54 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 31.88 1soh h MET 60 CO 0.03 0.00 -0.96 0.45 1.06 0.00 0.00 176.91 177.49 1soh n SER 61 N -2.36 0.07 0.12 1.22 2.88 0.31 -4.91 113.62 110.96 1soh n SER 61 Ca 0.04 -3.01 0.12 0.00 -1.33 0.00 0.00 58.87 54.69 1soh n SER 61 Cb 0.46 0.08 0.17 0.00 -0.75 0.00 0.00 64.21 64.17 1soh n SER 61 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1soh h THR 62 N 2.00 0.00 -0.76 2.46 1.35 -0.28 -3.31 112.91 114.38 1soh h THR 62 Ca -0.03 -0.76 0.22 0.00 -0.55 0.00 0.00 66.41 65.29 1soh h THR 62 Cb 1.08 1.52 -0.03 0.00 -1.73 0.00 0.00 68.15 68.99 1soh h THR 62 CO 0.37 0.00 0.80 1.88 -0.25 0.00 0.00 175.52 178.31 1soh h TYR 63 N 0.00 0.00 -0.94 4.73 0.05 -1.91 0.46 116.97 119.36 1soh h TYR 63 Ca 0.00 0.00 0.27 0.00 0.05 0.00 0.00 58.73 59.05 1soh h TYR 63 Cb 0.88 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.58 1soh h TYR 63 CO 0.00 0.00 0.77 1.15 -1.05 0.00 0.00 178.16 179.03 1soh h THR 64 N 0.00 0.37 0.00 -2.88 2.02 -1.95 1.58 112.91 112.05 1soh h THR 64 Ca 0.36 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.46 1soh h THR 64 Cb 1.95 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 1soh h THR 64 CO -0.00 0.00 -0.36 1.23 0.37 0.00 0.00 175.52 176.75 1soh h GLY 65 N 0.00 0.00 0.00 2.16 0.00 -0.39 -3.18 103.07 101.66 1soh h GLY 65 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1soh h GLY 65 CO -0.00 0.00 -1.39 1.39 0.00 0.00 0.00 176.54 176.53 1soh n ILE 66 N -3.50 0.00 -0.58 2.60 5.41 0.46 -4.31 119.36 119.44 1soh n ILE 66 Ca -0.00 -0.29 0.46 0.00 1.00 0.00 0.00 62.75 63.92 1soh n ILE 66 Cb 0.51 0.42 0.76 0.00 -0.71 0.00 0.00 39.64 40.62 1soh n ILE 66 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 1soh h PHE 67 N 0.00 0.18 0.00 1.39 3.57 0.96 1.18 116.94 124.22 1soh h PHE 67 Ca 0.00 0.01 -0.28 0.00 3.53 0.00 0.00 57.97 61.22 1soh h PHE 67 Cb 0.60 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 1soh h PHE 67 CO 0.00 -0.08 -2.25 2.41 -2.23 0.00 0.00 178.31 176.16 1soh n THR 68 N -4.22 1.07 -0.07 4.41 -1.04 -1.26 -4.15 114.28 109.01 1soh n THR 68 Ca 0.40 -0.75 -0.11 0.00 -2.04 0.00 0.00 64.05 61.55 1soh n THR 68 Cb 1.74 -0.39 0.03 0.00 -1.82 0.00 0.00 70.33 69.89 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 0.83 0.32 8.00 1.82 0.64 0.28 116.42 128.31 1soh h ASP 69 Ca -0.42 -0.38 -0.06 0.00 -0.39 0.00 0.00 57.03 55.78 1soh h ASP 69 Cb 1.95 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 41.72 1soh h ASP 69 CO 0.02 1.13 -0.28 1.56 -1.61 0.00 0.00 179.24 180.06 1soh h GLN 70 N 0.63 0.00 0.15 0.28 4.20 0.73 -2.22 115.11 118.88 1soh h GLN 70 Ca 0.05 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.42 1soh h GLN 70 Cb 0.97 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.75 1soh h GLN 70 CO 0.09 0.28 -1.76 0.28 -0.67 0.00 0.00 178.83 177.05 1soh h VAL 71 N 0.00 0.85 -0.06 -0.54 2.07 -1.66 -3.31 116.25 113.60 1soh h VAL 71 Ca -0.00 -2.42 0.02 0.00 0.82 0.00 0.00 66.70 65.11 1soh h VAL 71 Cb 0.51 2.66 -0.00 0.00 -1.52 0.00 0.00 31.29 32.94 1soh h VAL 71 CO 0.04 0.83 0.05 0.25 0.02 0.00 0.00 177.57 178.75 1soh h LEU 72 N -0.01 0.00 -0.37 2.57 7.12 -0.33 0.21 115.31 124.50 1soh h LEU 72 Ca -0.36 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.60 1soh h LEU 72 Cb 2.00 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 42.12 1soh h LEU 72 CO 0.12 0.00 -0.24 0.77 -0.13 0.00 0.00 178.44 178.96 1soh h SER 73 N 0.00 0.00 -0.22 1.25 4.64 -1.53 -3.17 113.55 114.52 1soh h SER 73 Ca 0.03 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.39 1soh h SER 73 Cb 0.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1soh h SER 73 CO -0.00 0.24 0.16 0.58 -0.87 0.00 0.00 176.83 176.93 1soh h VAL 74 N 0.00 0.95 -0.18 0.95 2.07 -0.95 0.11 116.25 119.20 1soh h VAL 74 Ca -0.00 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.53 1soh h VAL 74 Cb 1.05 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1soh h VAL 74 CO 0.03 0.02 0.26 0.25 0.02 0.00 0.00 177.57 178.15 1soh h LEU 75 N 0.11 0.00 -6.18 2.57 6.46 -1.63 -3.37 115.31 113.28 1soh h LEU 75 Ca 0.10 0.00 0.20 0.00 -0.12 0.00 0.00 57.88 58.06 1soh h LEU 75 Cb 0.26 0.00 -0.22 0.00 -0.73 0.00 0.00 40.66 39.97 1soh h LEU 75 CO -0.01 0.00 0.15 -0.75 -0.62 0.00 0.00 178.44 177.20 1soh s LYS 76 N -4.48 0.25 0.00 1.25 2.36 0.02 -4.95 119.74 114.19 1soh s LYS 76 Ca -0.04 0.53 0.00 0.00 -2.55 0.00 0.00 55.97 53.91 1soh s LYS 76 Cb 0.14 0.31 0.00 0.00 -1.05 0.00 0.00 37.83 37.22 1soh s LYS 76 CO 0.48 -0.20 0.00 0.41 1.55 0.00 0.00 175.35 177.59 1soh n GLY 77 N 5.25 0.84 2.69 5.54 0.00 -1.22 -4.64 105.19 113.65 1soh n GLY 77 Ca -0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.85 -2.66 0.00 1.61 4.07 -1.19 -4.95 120.64 116.67 1soh n GLU 78 Ca 0.00 0.24 0.15 0.00 -0.06 0.00 0.00 57.16 57.49 1soh n GLU 78 Cb 0.00 -4.79 0.78 0.00 -0.06 0.00 0.00 31.44 27.37 1soh n GLU 78 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46