#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 3.04 -2.07 -2.97 116.94 113.53 1soh h PHE 14 Ca 0.00 0.00 -0.13 0.00 3.98 0.00 0.00 57.97 61.82 1soh h PHE 14 Cb 0.00 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1soh h PHE 14 CO 0.00 0.38 -0.61 1.37 -2.02 0.00 0.00 178.31 177.43 1soh h LEU 15 N 0.00 0.00 -1.28 0.59 8.10 -2.05 -3.19 115.31 117.48 1soh h LEU 15 Ca -0.00 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.99 1soh h LEU 15 Cb 1.00 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 41.19 1soh h LEU 15 CO 0.05 0.61 0.42 0.74 -4.11 0.00 0.00 178.44 176.15 1soh h THR 16 N 0.00 1.18 0.28 0.15 2.02 -1.94 0.21 112.91 114.81 1soh h THR 16 Ca -0.01 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1soh h THR 16 Cb 1.27 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1soh h THR 16 CO 0.08 0.19 -0.14 0.06 0.37 0.00 0.00 175.52 176.08 1soh h GLN 17 N 0.92 -0.37 -0.40 6.66 3.07 -1.65 -2.61 115.11 120.74 1soh h GLN 17 Ca 0.24 0.03 -0.02 0.00 0.09 0.00 0.00 58.65 58.99 1soh h GLN 17 Cb -0.06 0.08 -0.02 0.00 0.08 0.00 0.00 27.48 27.56 1soh h GLN 17 CO -0.05 -0.15 0.14 0.28 0.09 0.00 0.00 178.83 179.14 1soh h VAL 18 N -0.52 1.16 -0.28 1.86 2.07 -1.58 -0.06 116.25 118.91 1soh h VAL 18 Ca -0.04 -0.51 0.08 0.00 0.82 0.00 0.00 66.70 67.05 1soh h VAL 18 Cb 0.39 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1soh h VAL 18 CO 0.06 0.20 0.30 0.50 0.02 0.00 0.00 177.57 178.65 1soh h LYS 19 N 0.56 0.00 0.00 1.57 3.64 -0.23 1.23 116.57 123.34 1soh h LYS 19 Ca 0.14 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.42 1soh h LYS 19 Cb 0.14 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1soh h LYS 19 CO -0.01 0.00 -0.44 0.93 -2.27 0.00 0.00 179.45 177.66 1soh h GLU 20 N 0.00 0.00 0.00 1.90 5.08 -0.68 -2.71 114.58 118.17 1soh h GLU 20 Ca 0.13 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.27 1soh h GLU 20 Cb 0.73 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 1soh h GLU 20 CO -0.00 0.44 -1.45 0.43 -1.00 0.00 0.00 179.01 177.43 1soh n SER 21 N -3.29 1.89 0.33 1.42 7.64 0.30 -2.83 113.62 119.09 1soh n SER 21 Ca 0.01 0.43 0.20 0.00 1.01 0.00 0.00 58.87 60.52 1soh n SER 21 Cb 0.66 -0.87 1.09 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 -1.00 0.00 0.00 -3.43 8.10 0.91 0.30 115.31 120.19 1soh h LEU 22 Ca -0.33 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.64 1soh h LEU 22 Cb 1.19 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.41 1soh h LEU 22 CO -0.20 0.00 -1.53 -0.24 -4.11 0.00 0.00 178.44 172.36 1soh n SER 23 N -3.10 0.42 0.09 0.17 2.88 -1.02 -3.74 113.62 109.32 1soh n SER 23 Ca -0.02 0.16 0.10 0.00 -1.33 0.00 0.00 58.87 57.77 1soh n SER 23 Cb 0.17 1.21 0.42 0.00 -0.75 0.00 0.00 64.21 65.25 1soh n SER 23 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1soh n SER 24 N -2.48 0.43 -0.14 -3.46 3.41 0.10 -1.64 113.62 109.84 1soh n SER 24 Ca -0.03 0.62 0.04 0.00 -0.26 0.00 0.00 58.87 59.24 1soh n SER 24 Cb 0.58 -0.71 -0.01 0.00 -0.26 0.00 0.00 64.21 63.81 1soh n SER 24 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1soh n TYR 25 N -1.99 0.00 0.04 7.33 4.01 -1.19 -4.31 117.16 121.04 1soh n TYR 25 Ca 0.02 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.79 1soh n TYR 25 Cb 0.17 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.12 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 -0.49 0.80 0.14 -0.72 -0.00 -0.65 -3.41 117.44 113.10 1soh n TRP 26 Ca 0.03 0.26 0.05 0.00 -0.00 0.00 0.00 57.50 57.83 1soh n TRP 26 Cb 0.15 -0.98 0.04 0.00 -0.00 0.00 0.00 31.31 30.52 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 0.02 5.87 4.81 -1.54 -3.31 114.58 120.43 1soh h GLU 27 Ca -0.13 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.02 1soh h GLU 27 Cb 1.42 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.81 1soh h GLU 27 CO 0.03 0.32 -0.30 1.03 -0.73 0.00 0.00 179.01 179.35 1soh h SER 28 N 0.00 0.23 -0.82 1.04 0.87 -1.75 -2.50 113.55 110.61 1soh h SER 28 Ca -0.03 -0.85 0.24 0.00 -1.23 0.00 0.00 61.79 59.92 1soh h SER 28 Cb 1.30 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 63.15 1soh h SER 28 CO 0.04 1.05 0.69 0.00 -0.53 0.00 0.00 176.83 178.09 1soh h ALA 29 N 0.18 2.68 0.00 6.23 0.00 -1.66 0.86 119.26 127.56 1soh h ALA 29 Ca -0.04 -0.03 -0.27 0.00 0.00 0.00 0.00 54.91 54.57 1soh h ALA 29 Cb 1.12 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 1soh h ALA 29 CO 0.06 -1.12 -1.48 0.87 0.00 0.00 0.00 179.25 177.59 1soh h LYS 30 N 0.00 0.01 0.00 0.00 1.57 -1.63 -3.04 116.57 113.48 1soh h LYS 30 Ca 0.39 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 59.07 1soh h LYS 30 Cb 1.77 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 34.08 1soh h LYS 30 CO -0.00 0.68 -0.38 1.79 -0.57 0.00 0.00 179.45 180.97 1soh h THR 31 N 0.00 1.15 -0.39 -0.16 1.35 0.11 -2.71 112.91 112.26 1soh h THR 31 Ca -0.20 -1.36 -0.07 0.00 -0.55 0.00 0.00 66.41 64.23 1soh h THR 31 Cb 1.93 1.76 -0.04 0.00 -1.73 0.00 0.00 68.15 70.07 1soh h THR 31 CO 0.10 0.37 0.04 0.00 -0.25 0.00 0.00 175.52 175.78 1soh n ALA 32 N -2.41 3.58 -0.11 6.62 0.00 -0.24 -4.51 120.51 123.44 1soh n ALA 32 Ca -0.01 -2.43 -0.18 0.00 0.00 0.00 0.00 53.44 50.82 1soh n ALA 32 Cb 0.44 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 18.98 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 -0.46 1.00 0.33 0.00 0.00 -1.02 -4.04 120.51 116.32 1soh n ALA 33 Ca 0.28 -0.93 0.21 0.00 0.00 0.00 0.00 53.44 53.00 1soh n ALA 33 Cb 1.04 0.07 1.15 0.00 0.00 0.00 0.00 19.45 21.70 1soh n ALA 33 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1soh h GLN 34 N -1.00 0.00 0.43 0.00 7.50 -1.81 0.34 115.11 120.58 1soh h GLN 34 Ca -0.29 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.84 1soh h GLN 34 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.78 1soh h GLN 34 CO -0.18 0.00 -0.21 -0.97 -1.50 0.00 0.00 178.83 175.98 1soh h ASN 35 N 0.00 -0.49 -0.02 1.46 -1.24 -1.79 -3.06 115.58 110.44 1soh h ASN 35 Ca -0.00 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 56.87 1soh h ASN 35 Cb 0.03 0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.20 1soh h ASN 35 CO 0.00 -0.06 -0.45 -0.07 -1.29 0.00 0.00 177.43 175.56 1soh h LEU 36 N -1.15 0.61 -2.56 0.34 3.38 -1.63 -2.81 115.31 111.49 1soh h LEU 36 Ca -0.06 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.63 1soh h LEU 36 Cb 0.46 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1soh h LEU 36 CO 0.10 0.97 0.12 1.88 0.09 0.00 0.00 178.44 181.60 1soh h TYR 37 N 0.45 0.00 -0.14 1.13 -1.99 -0.44 -0.02 116.97 115.97 1soh h TYR 37 Ca 0.03 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.66 1soh h TYR 37 Cb 0.97 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.68 1soh h TYR 37 CO 0.04 0.00 -0.34 0.93 -0.00 0.00 0.00 178.16 178.79 1soh h GLU 38 N 0.00 0.29 -0.61 4.88 5.08 -1.38 -2.44 114.58 120.40 1soh h GLU 38 Ca 0.02 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1soh h GLU 38 Cb 0.26 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1soh h GLU 38 CO -0.00 0.60 0.00 1.17 -1.00 0.00 0.00 179.01 179.78 1soh n LYS 39 N -4.08 2.94 -3.91 2.33 4.81 -0.03 -4.91 118.16 115.32 1soh n LYS 39 Ca -0.01 -2.00 -0.30 0.00 -0.87 0.00 0.00 58.31 55.13 1soh n LYS 39 Cb 0.43 -1.72 0.02 0.00 0.02 0.00 0.00 35.03 33.79 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 0.71 -2.23 -3.00 3.15 -1.04 -0.92 -1.22 114.28 109.73 1soh n THR 40 Ca 0.18 -0.06 -0.13 0.00 -2.04 0.00 0.00 64.05 62.00 1soh n THR 40 Cb 0.67 -2.89 -0.02 0.00 -1.82 0.00 0.00 70.33 66.27 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 -4.64 -1.74 -0.29 -1.42 9.36 -1.19 -4.60 117.16 112.64 1soh n TYR 41 Ca 0.01 0.20 0.04 0.00 3.32 0.00 0.00 57.90 61.47 1soh n TYR 41 Cb 0.54 -1.66 0.13 0.00 -0.63 0.00 0.00 39.34 37.72 1soh n TYR 41 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 1soh h LEU 42 N -0.30 -0.68 -1.62 2.98 5.85 -1.46 1.14 115.31 121.21 1soh h LEU 42 Ca -0.21 0.24 0.47 0.00 0.84 0.00 0.00 57.88 59.22 1soh h LEU 42 Cb 1.14 0.49 -0.06 0.00 0.37 0.00 0.00 40.66 42.59 1soh h LEU 42 CO 0.29 -0.27 1.31 -2.65 -0.34 0.00 0.00 178.44 176.78 1soh n PRO 43 N -5.51 0.00 -0.70 5.25 -0.02 -1.26 -2.80 135.00 129.97 1soh n PRO 43 Ca 0.13 1.02 -0.03 0.00 -2.02 0.00 0.00 63.50 62.60 1soh n PRO 43 Cb 0.46 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.50 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 -2.67 2.35 0.06 3.55 0.00 -0.32 -4.95 120.51 118.53 1soh n ALA 44 Ca 0.36 -0.32 -0.15 0.00 0.00 0.00 0.00 53.44 53.33 1soh n ALA 44 Cb 1.79 -0.18 -0.06 0.00 0.00 0.00 0.00 19.45 21.00 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 4.15 1.38 0.00 0.00 3.04 0.14 0.10 116.25 125.06 1soh h VAL 45 Ca -0.27 -2.44 0.00 0.00 -1.01 0.00 0.00 66.70 62.98 1soh h VAL 45 Cb 1.07 2.44 0.00 0.00 -2.01 0.00 0.00 31.29 32.79 1soh h VAL 45 CO -0.14 0.73 0.00 0.44 -1.01 0.00 0.00 177.57 177.60 1soh h ASP 46 N 0.25 0.00 -0.06 3.17 5.19 -1.80 0.31 116.42 123.48 1soh h ASP 46 Ca -0.09 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1soh h ASP 46 Cb 1.62 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.13 1soh h ASP 46 CO 0.17 0.00 0.00 -0.62 -3.12 0.00 0.00 179.24 175.67 1soh n GLU 47 N -2.93 2.04 0.08 3.56 -0.58 -1.14 -4.11 120.64 117.56 1soh n GLU 47 Ca 0.01 -2.31 0.00 0.00 -0.42 0.00 0.00 57.16 54.45 1soh n GLU 47 Cb 0.33 -1.41 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 1soh n GLU 47 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1soh n LYS 48 N -0.95 0.00 -0.99 3.49 4.81 0.35 -4.24 118.16 120.63 1soh n LYS 48 Ca 0.12 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.39 1soh n LYS 48 Cb 0.56 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.62 1soh n LYS 48 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1soh n LEU 49 N -2.87 6.36 0.00 3.14 4.32 0.10 -2.34 117.00 125.72 1soh n LEU 49 Ca 0.00 -3.39 0.00 0.00 -0.02 0.00 0.00 56.01 52.60 1soh n LEU 49 Cb 0.00 -1.11 0.00 0.00 -1.62 0.00 0.00 43.42 40.69 1soh n LEU 49 CO 0.00 1.33 0.00 0.54 -1.22 0.00 0.00 177.39 178.04 1soh n ARG 50 N 0.60 0.00 -0.04 3.23 1.74 -0.86 -4.75 116.66 116.58 1soh n ARG 50 Ca 0.32 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.36 1soh n ARG 50 Cb 0.58 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.97 1soh n ARG 50 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1soh n ASP 51 N 0.00 3.35 -1.04 0.55 -0.08 -1.25 -3.96 116.55 114.13 1soh n ASP 51 Ca 0.00 -0.02 0.05 0.00 -1.51 0.00 0.00 54.79 53.31 1soh n ASP 51 Cb 0.00 0.32 0.21 0.00 2.34 0.00 0.00 41.12 43.99 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 -2.46 2.98 0.00 -2.67 0.00 -0.99 -4.18 117.00 109.68 1soh n LEU 52 Ca -0.13 -1.50 0.00 0.00 0.00 0.00 0.00 56.01 54.38 1soh n LEU 52 Cb 0.69 -0.45 0.00 0.00 0.00 0.00 0.00 43.42 43.66 1soh n LEU 52 CO 0.12 0.50 -0.22 0.00 0.00 0.00 0.00 177.39 177.79 1soh n TYR 53 N 0.51 0.00 -3.61 1.96 9.36 -1.22 -4.97 117.16 119.18 1soh n TYR 53 Ca 0.15 0.00 -0.21 0.00 3.32 0.00 0.00 57.90 61.16 1soh n TYR 53 Cb 0.58 0.17 0.06 0.00 -0.63 0.00 0.00 39.34 39.52 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 -2.40 -2.26 -1.55 2.98 7.64 -1.25 -0.88 113.62 115.90 1soh n SER 54 Ca 0.00 -0.72 -0.16 0.00 1.01 0.00 0.00 58.87 59.00 1soh n SER 54 Cb 0.22 -4.51 -0.06 0.00 -1.01 0.00 0.00 64.21 58.85 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 -4.32 -1.41 -0.13 1.43 4.81 -1.26 -4.82 118.16 112.45 1soh n LYS 55 Ca -0.24 0.92 -0.04 0.00 -0.87 0.00 0.00 58.31 58.08 1soh n LYS 55 Cb 0.65 -5.24 0.04 0.00 0.02 0.00 0.00 35.03 30.50 1soh n LYS 55 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1soh h SER 56 N 0.00 -0.08 0.00 3.14 0.87 -1.42 -3.34 113.55 112.72 1soh h SER 56 Ca -0.33 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.30 1soh h SER 56 Cb 1.05 0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 63.11 1soh h SER 56 CO 0.47 -0.01 -0.40 0.41 -0.53 0.00 0.00 176.83 176.77 1soh n THR 57 N -5.15 0.00 -0.02 2.23 -1.04 -1.26 -4.86 114.28 104.17 1soh n THR 57 Ca 0.04 -0.09 -0.16 0.00 -2.04 0.00 0.00 64.05 61.80 1soh n THR 57 Cb 0.22 0.41 -0.12 0.00 -1.82 0.00 0.00 70.33 69.02 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 0.09 0.03 0.00 2.41 0.00 -1.93 -2.48 119.26 117.38 1soh h ALA 58 Ca -0.04 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.32 1soh h ALA 58 Cb 1.34 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1soh h ALA 58 CO -0.00 0.15 -0.20 0.00 0.00 0.00 0.00 179.25 179.19 1soh h ALA 59 N 0.24 1.01 0.00 0.00 0.00 -1.91 -2.26 119.26 116.34 1soh h ALA 59 Ca -0.04 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.53 1soh h ALA 59 Cb 1.11 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1soh h ALA 59 CO 0.07 0.26 -0.72 0.52 0.00 0.00 0.00 179.25 179.37 1soh h MET 60 N 0.00 0.00 0.00 0.00 2.86 -1.88 -3.38 114.93 112.54 1soh h MET 60 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1soh h MET 60 Cb 0.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.40 1soh h MET 60 CO 0.03 0.72 0.00 -1.13 1.06 0.00 0.00 176.91 177.59 1soh n SER 61 N -3.43 0.00 0.00 1.22 3.41 -0.93 -4.90 113.62 108.99 1soh n SER 61 Ca 0.00 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 1soh n SER 61 Cb 0.77 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 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 -1.84 0.00 -0.48 6.66 -1.04 -0.88 -4.77 114.28 111.93 1soh n THR 62 Ca 0.00 0.00 0.43 0.00 -2.04 0.00 0.00 64.05 62.44 1soh n THR 62 Cb 0.00 -0.87 0.73 0.00 -1.82 0.00 0.00 70.33 68.37 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 -0.61 -1.42 -1.99 -1.90 1.23 116.97 112.28 1soh h TYR 63 Ca 0.00 0.00 0.18 0.00 2.00 0.00 0.00 58.73 60.91 1soh h TYR 63 Cb 0.76 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.46 1soh h TYR 63 CO 0.48 0.00 0.58 1.15 -0.00 0.00 0.00 178.16 180.37 1soh h THR 64 N 0.00 0.37 -0.01 -2.88 2.02 -1.97 1.19 112.91 111.63 1soh h THR 64 Ca 0.73 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.91 1soh h THR 64 Cb 3.14 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 70.10 1soh h THR 64 CO -0.01 0.00 -0.31 0.61 0.37 0.00 0.00 175.52 176.19 1soh n GLY 65 N -1.57 -0.07 0.00 2.16 0.00 0.42 -4.45 105.19 101.68 1soh n GLY 65 Ca 0.12 -0.43 0.04 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.15 0.00 -0.53 -0.61 5.41 0.15 -4.36 119.36 119.28 1soh n ILE 66 Ca 0.06 -0.28 0.44 0.00 1.00 0.00 0.00 62.75 63.97 1soh n ILE 66 Cb 0.31 0.84 0.77 0.00 -0.71 0.00 0.00 39.64 40.86 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 0.08 0.00 1.39 3.04 0.93 0.99 116.94 123.36 1soh h PHE 67 Ca 0.00 0.00 -0.08 0.00 3.98 0.00 0.00 57.97 61.88 1soh h PHE 67 Cb 0.24 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 1soh h PHE 67 CO 0.00 -0.02 -1.69 2.41 -2.02 0.00 0.00 178.31 176.99 1soh n THR 68 N -4.13 0.28 0.04 4.41 -1.04 -1.26 -4.30 114.28 108.28 1soh n THR 68 Ca 0.37 -0.38 -0.13 0.00 -2.04 0.00 0.00 64.05 61.87 1soh n THR 68 Cb 1.65 -0.10 -0.01 0.00 -1.82 0.00 0.00 70.33 70.05 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 0.62 0.29 8.00 1.82 -0.29 0.56 116.42 127.44 1soh h ASP 69 Ca -0.11 -0.43 -0.10 0.00 -0.39 0.00 0.00 57.03 56.00 1soh h ASP 69 Cb 0.99 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.81 1soh h ASP 69 CO 0.01 1.20 -0.41 -0.61 -1.61 0.00 0.00 179.24 177.82 1soh h GLN 70 N 0.34 0.15 0.07 0.28 4.15 0.49 -2.72 115.11 117.88 1soh h GLN 70 Ca -0.05 -0.07 -0.34 0.00 0.77 0.00 0.00 58.65 58.96 1soh h GLN 70 Cb 1.40 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.05 1soh h GLN 70 CO 0.14 0.54 -1.92 0.28 -1.93 0.00 0.00 178.83 175.95 1soh n VAL 71 N -4.03 1.71 0.23 2.39 0.31 -1.18 -3.87 118.33 113.88 1soh n VAL 71 Ca -0.02 -0.71 0.10 0.00 -0.01 0.00 0.00 64.34 63.71 1soh n VAL 71 Cb 0.46 -1.45 0.67 0.00 -0.91 0.00 0.00 33.84 32.61 1soh n VAL 71 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1soh h LEU 72 N 0.04 0.00 -0.22 7.52 5.85 0.16 -0.30 115.31 128.36 1soh h LEU 72 Ca -0.38 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.23 1soh h LEU 72 Cb 2.03 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 43.04 1soh h LEU 72 CO 0.08 0.00 -0.53 0.28 -0.34 0.00 0.00 178.44 177.93 1soh h SER 73 N 0.00 0.00 -0.31 1.25 0.02 -1.62 -3.20 113.55 109.68 1soh h SER 73 Ca 0.03 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1soh h SER 73 Cb 0.12 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1soh h SER 73 CO -0.00 0.53 0.22 0.58 -1.14 0.00 0.00 176.83 177.02 1soh h VAL 74 N 0.00 0.92 -0.11 2.27 2.07 -1.04 0.76 116.25 121.12 1soh h VAL 74 Ca -0.01 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.49 1soh h VAL 74 Cb 1.32 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1soh h VAL 74 CO 0.07 0.03 0.18 0.25 0.02 0.00 0.00 177.57 178.11 1soh h LEU 75 N 0.15 0.00 -6.09 2.57 7.12 -1.59 -3.38 115.31 114.09 1soh h LEU 75 Ca 0.14 0.00 0.25 0.00 0.13 0.00 0.00 57.88 58.40 1soh h LEU 75 Cb 0.37 0.00 -0.23 0.00 -0.53 0.00 0.00 40.66 40.27 1soh h LEU 75 CO -0.02 0.00 0.28 -0.75 -0.13 0.00 0.00 178.44 177.82 1soh s LYS 76 N -4.44 0.13 0.00 1.25 2.20 0.25 -4.96 119.74 114.17 1soh s LYS 76 Ca -0.04 0.27 0.00 0.00 -0.36 0.00 0.00 55.97 55.84 1soh s LYS 76 Cb 0.14 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.61 1soh s LYS 76 CO 0.47 -0.10 0.00 0.41 -0.36 0.00 0.00 175.35 175.77 1soh n GLY 77 N 5.18 0.93 2.70 5.54 0.00 -1.19 -4.66 105.19 113.69 1soh n GLY 77 Ca -0.08 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 -0.68 -2.66 0.00 1.61 4.07 -1.14 -4.95 120.64 116.89 1soh n GLU 78 Ca 0.00 0.23 0.13 0.00 -0.06 0.00 0.00 57.16 57.45 1soh n GLU 78 Cb 0.00 -4.78 0.22 0.00 -0.06 0.00 0.00 31.44 26.82 1soh n GLU 78 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46