#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 -5.15 -2.06 -2.83 116.94 105.47 1soh h PHE 14 Ca 0.00 0.00 -0.23 0.00 -0.20 0.00 0.00 57.97 57.54 1soh h PHE 14 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 36.13 1soh h PHE 14 CO 0.00 0.38 -1.41 1.37 -2.00 0.00 0.00 178.31 176.65 1soh h LEU 15 N 0.00 0.00 -0.45 2.10 -0.00 -2.05 -3.32 115.31 111.59 1soh h LEU 15 Ca -0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 57.70 1soh h LEU 15 Cb 1.17 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.83 1soh h LEU 15 CO 0.05 0.85 -0.72 0.74 -0.00 0.00 0.00 178.44 179.36 1soh h THR 16 N 0.00 1.40 0.16 0.15 2.02 -1.98 -2.27 112.91 112.39 1soh h THR 16 Ca -0.18 -2.18 -0.01 0.00 0.77 0.00 0.00 66.41 64.81 1soh h THR 16 Cb 1.81 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 70.36 1soh h THR 16 CO 0.08 0.65 -0.08 0.06 0.37 0.00 0.00 175.52 176.60 1soh h GLN 17 N 0.22 -0.21 -0.48 6.66 3.07 -1.62 -2.41 115.11 120.34 1soh h GLN 17 Ca -0.03 0.01 -0.03 0.00 0.09 0.00 0.00 58.65 58.70 1soh h GLN 17 Cb 1.29 0.05 -0.02 0.00 0.08 0.00 0.00 27.48 28.87 1soh h GLN 17 CO 0.12 -0.08 0.19 0.28 0.09 0.00 0.00 178.83 179.43 1soh h VAL 18 N -0.28 1.18 -0.29 1.86 2.07 -1.65 -0.15 116.25 118.98 1soh h VAL 18 Ca -0.02 -0.57 0.09 0.00 0.82 0.00 0.00 66.70 67.01 1soh h VAL 18 Cb 0.22 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1soh h VAL 18 CO 0.04 0.22 0.32 0.50 0.02 0.00 0.00 177.57 178.66 1soh h LYS 19 N 0.69 0.00 0.00 1.57 1.63 -0.92 1.42 116.57 120.96 1soh h LYS 19 Ca 0.17 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.85 1soh h LYS 19 Cb 0.14 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 1soh h LYS 19 CO -0.02 0.00 -0.59 0.93 -3.45 0.00 0.00 179.45 176.33 1soh h GLU 20 N 0.00 0.00 0.00 1.90 4.39 -0.67 -3.01 114.58 117.19 1soh h GLU 20 Ca 0.14 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.61 1soh h GLU 20 Cb 0.77 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.38 1soh h GLU 20 CO -0.00 0.55 -1.35 0.43 -1.16 0.00 0.00 179.01 177.48 1soh n SER 21 N -3.23 1.87 0.25 1.42 7.64 0.29 -2.39 113.62 119.47 1soh n SER 21 Ca 0.01 0.43 0.16 0.00 1.01 0.00 0.00 58.87 60.49 1soh n SER 21 Cb 0.76 -0.93 0.87 0.00 -1.01 0.00 0.00 64.21 63.90 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 0.13 0.16 115.31 119.27 1soh h LEU 22 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.64 1soh h LEU 22 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.47 1soh h LEU 22 CO -0.21 0.00 -0.92 -1.20 -4.11 0.00 0.00 178.44 172.00 1soh n SER 23 N -2.65 0.84 0.04 0.17 7.64 -1.14 -4.37 113.62 114.16 1soh n SER 23 Ca -0.02 -0.71 0.08 0.00 1.01 0.00 0.00 58.87 59.23 1soh n SER 23 Cb 0.10 1.14 0.33 0.00 -1.01 0.00 0.00 64.21 64.77 1soh n SER 23 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1soh n SER 24 N -1.50 0.21 -0.09 6.43 3.41 0.56 -1.42 113.62 121.22 1soh n SER 24 Ca 0.02 0.56 0.05 0.00 -0.26 0.00 0.00 58.87 59.24 1soh n SER 24 Cb 0.28 -0.60 -0.04 0.00 -0.26 0.00 0.00 64.21 63.59 1soh n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1soh n TYR 25 N -1.74 0.00 -0.03 7.33 0.18 -1.24 -3.88 117.16 117.78 1soh n TYR 25 Ca 0.02 0.00 -0.04 0.00 1.88 0.00 0.00 57.90 59.76 1soh n TYR 25 Cb 0.16 0.00 -0.13 0.00 -0.38 0.00 0.00 39.34 38.98 1soh n TYR 25 CO 0.00 0.00 0.00 1.87 -2.08 0.00 0.00 176.86 176.65 1soh n TRP 26 N -0.86 0.54 0.09 -3.48 -0.00 -0.69 -3.03 117.44 110.01 1soh n TRP 26 Ca 0.03 0.19 0.06 0.00 -0.00 0.00 0.00 57.50 57.77 1soh n TRP 26 Cb 0.18 -1.01 -0.02 0.00 -0.00 0.00 0.00 31.31 30.46 1soh n TRP 26 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 1soh h GLU 27 N 0.00 0.00 0.19 5.87 5.08 -1.45 -3.34 114.58 120.92 1soh h GLU 27 Ca -0.30 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 57.79 1soh h GLU 27 Cb 1.84 0.00 0.03 0.00 0.50 0.00 0.00 28.75 31.12 1soh h GLU 27 CO 0.04 0.18 -1.19 1.03 -1.00 0.00 0.00 179.01 178.07 1soh h SER 28 N 0.00 0.62 -0.81 1.42 0.87 -1.71 -2.87 113.55 111.08 1soh h SER 28 Ca -0.07 -0.93 0.23 0.00 -1.23 0.00 0.00 61.79 59.80 1soh h SER 28 Cb 1.29 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 63.01 1soh h SER 28 CO 0.03 1.57 0.62 0.00 -0.53 0.00 0.00 176.83 178.52 1soh h ALA 29 N 0.10 2.72 0.00 6.23 0.00 -1.67 0.71 119.26 127.35 1soh h ALA 29 Ca -0.22 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1soh h ALA 29 Cb 1.89 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.71 1soh h ALA 29 CO 0.20 -1.04 -1.32 0.87 0.00 0.00 0.00 179.25 177.95 1soh h LYS 30 N 0.00 0.00 0.01 0.00 1.79 -1.68 -2.90 116.57 113.80 1soh h LYS 30 Ca 0.38 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.65 1soh h LYS 30 Cb 1.62 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.25 1soh h LYS 30 CO -0.00 0.39 -0.94 1.79 -1.08 0.00 0.00 179.45 179.61 1soh h THR 31 N 0.00 1.60 -0.64 -0.16 1.35 0.45 -3.21 112.91 112.31 1soh h THR 31 Ca -0.16 -2.99 0.00 0.00 -0.55 0.00 0.00 66.41 62.71 1soh h THR 31 Cb 1.65 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 70.72 1soh h THR 31 CO 0.06 0.86 0.00 0.00 -0.25 0.00 0.00 175.52 176.19 1soh n ALA 32 N -2.41 2.38 -0.10 6.62 0.00 0.10 -4.41 120.51 122.69 1soh n ALA 32 Ca -0.02 -1.22 -0.20 0.00 0.00 0.00 0.00 53.44 52.00 1soh n ALA 32 Cb 0.87 -0.89 -0.10 0.00 0.00 0.00 0.00 19.45 19.32 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 1.58 0.76 0.31 0.00 0.00 -1.09 -3.33 120.51 118.73 1soh n ALA 33 Ca 0.23 -0.50 0.19 0.00 0.00 0.00 0.00 53.44 53.36 1soh n ALA 33 Cb 0.61 -0.49 1.05 0.00 0.00 0.00 0.00 19.45 20.62 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 0.05 0.00 5.75 -1.77 0.18 115.11 118.32 1soh h GLN 34 Ca -0.32 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.17 1soh h GLN 34 Cb 1.23 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.78 1soh h GLN 34 CO -0.20 0.00 -0.02 -0.97 -2.65 0.00 0.00 178.83 174.99 1soh h ASN 35 N 0.00 -0.06 -0.21 -0.69 -0.73 -1.77 -3.27 115.58 108.86 1soh h ASN 35 Ca 0.01 0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.23 1soh h ASN 35 Cb 0.10 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 38.70 1soh h ASN 35 CO -0.00 0.25 0.15 0.17 -0.37 0.00 0.00 177.43 177.62 1soh h LEU 36 N -0.64 0.06 -0.99 0.34 8.10 -1.52 0.93 115.31 121.59 1soh h LEU 36 Ca -0.01 -0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.98 1soh h LEU 36 Cb 0.05 -0.01 0.00 0.00 -0.44 0.00 0.00 40.66 40.26 1soh h LEU 36 CO 0.01 0.04 0.00 0.00 -4.11 0.00 0.00 178.44 174.38 1soh n TYR 37 N -4.49 0.80 0.09 0.17 9.36 0.62 -1.89 117.16 121.83 1soh n TYR 37 Ca 0.02 0.35 -0.06 0.00 3.32 0.00 0.00 57.90 61.53 1soh n TYR 37 Cb 0.24 -1.06 0.02 0.00 -0.63 0.00 0.00 39.34 37.90 1soh n TYR 37 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1soh h GLU 38 N 0.00 0.07 -0.69 2.98 5.08 -0.85 -3.08 114.58 118.10 1soh h GLU 38 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1soh h GLU 38 Cb 0.23 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1soh h GLU 38 CO 0.00 0.85 0.00 1.17 -1.00 0.00 0.00 179.01 180.03 1soh n LYS 39 N -3.62 3.73 -1.39 2.33 0.00 -0.79 -4.87 118.16 113.54 1soh n LYS 39 Ca -0.02 -2.26 -0.13 0.00 0.00 0.00 0.00 58.31 55.90 1soh n LYS 39 Cb 0.78 -2.02 -0.06 0.00 0.00 0.00 0.00 35.03 33.74 1soh n LYS 39 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1soh n THR 40 N 0.49 0.00 -3.02 3.15 -1.04 -1.16 -3.10 114.28 109.60 1soh n THR 40 Ca 0.20 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 62.09 1soh n THR 40 Cb 0.91 -1.49 -0.02 0.00 -1.82 0.00 0.00 70.33 67.91 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 -2.51 -1.75 -2.59 -1.42 9.36 -0.84 -4.81 117.16 112.61 1soh n TYR 41 Ca -0.13 0.19 -0.25 0.00 3.32 0.00 0.00 57.90 61.03 1soh n TYR 41 Cb 0.49 -1.50 -0.00 0.00 -0.63 0.00 0.00 39.34 37.70 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 -2.97 4.20 -4.58 2.98 4.77 -1.18 -4.91 117.00 115.31 1soh n LEU 42 Ca 0.01 -5.11 -0.37 0.00 -0.03 0.00 0.00 56.01 50.52 1soh n LEU 42 Cb 0.50 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1soh n LEU 42 CO 0.27 2.18 1.77 -2.16 -1.33 0.00 0.00 177.39 178.12 1soh s PRO 43 N -3.45 3.38 -1.22 3.23 0.04 -1.26 -4.00 135.00 131.72 1soh s PRO 43 Ca 0.45 -1.64 0.00 0.00 0.04 0.00 0.00 61.00 59.86 1soh s PRO 43 Cb 0.39 -5.41 0.00 0.00 0.04 0.00 0.00 34.50 29.51 1soh s PRO 43 CO -0.15 -2.94 0.00 0.00 0.04 0.00 0.00 177.00 173.94 1soh n ALA 44 N 10.81 -0.18 0.06 8.56 0.00 -1.26 -4.84 120.51 133.66 1soh n ALA 44 Ca 0.47 0.19 0.07 0.00 0.00 0.00 0.00 53.44 54.17 1soh n ALA 44 Cb 0.46 -1.58 0.51 0.00 0.00 0.00 0.00 19.45 18.84 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 1.03 0.00 0.00 3.04 -1.91 1.00 116.25 119.40 1soh h VAL 45 Ca -0.24 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 1soh h VAL 45 Cb 1.00 0.65 0.00 0.00 -2.01 0.00 0.00 31.29 30.93 1soh h VAL 45 CO 0.34 0.06 0.00 0.44 -1.01 0.00 0.00 177.57 177.41 1soh h ASP 46 N 0.35 0.00 -0.10 3.17 3.32 -1.88 -2.26 116.42 119.02 1soh h ASP 46 Ca 0.13 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.04 1soh h ASP 46 Cb 0.10 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.41 1soh h ASP 46 CO -0.03 0.00 -0.82 1.21 -1.72 0.00 0.00 179.24 177.88 1soh n GLU 47 N -2.96 1.09 0.12 3.56 2.13 0.58 -4.62 120.64 120.53 1soh n GLU 47 Ca 0.02 -2.84 0.00 0.00 0.66 0.00 0.00 57.16 55.01 1soh n GLU 47 Cb 0.39 -0.98 0.00 0.00 0.27 0.00 0.00 31.44 31.13 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 -0.34 0.00 -0.82 5.31 4.81 0.32 -4.78 118.16 122.66 1soh n LYS 48 Ca 0.14 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.46 1soh n LYS 48 Cb 0.92 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.99 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 -2.99 6.12 0.00 3.14 7.99 -0.86 -2.50 117.00 127.90 1soh n LEU 49 Ca 0.00 -3.08 0.00 0.00 -0.01 0.00 0.00 56.01 52.92 1soh n LEU 49 Cb 0.00 -1.10 0.00 0.00 -0.11 0.00 0.00 43.42 42.21 1soh n LEU 49 CO 0.00 1.21 0.00 0.54 -1.51 0.00 0.00 177.39 177.63 1soh n ARG 50 N 0.77 0.00 -0.02 3.23 1.74 -1.15 -4.83 116.66 116.39 1soh n ARG 50 Ca 0.23 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.26 1soh n ARG 50 Cb 0.56 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.88 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 -0.24 0.62 -1.07 0.55 2.03 -1.23 -3.93 116.55 113.28 1soh n ASP 51 Ca 0.00 0.29 0.05 0.00 0.52 0.00 0.00 54.79 55.65 1soh n ASP 51 Cb 0.00 0.37 0.21 0.00 -0.72 0.00 0.00 41.12 40.98 1soh n ASP 51 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1soh n LEU 52 N -2.88 3.07 -0.05 -2.67 4.77 -1.04 -3.98 117.00 114.21 1soh n LEU 52 Ca -0.17 -1.55 -0.08 0.00 -0.03 0.00 0.00 56.01 54.18 1soh n LEU 52 Cb 0.97 -0.47 -0.04 0.00 -2.33 0.00 0.00 43.42 41.55 1soh n LEU 52 CO 0.44 0.50 -0.83 0.00 -1.33 0.00 0.00 177.39 176.17 1soh n TYR 53 N 0.51 0.00 -3.32 -1.77 9.36 -1.26 -5.03 117.16 115.65 1soh n TYR 53 Ca 0.15 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 61.21 1soh n TYR 53 Cb 0.60 -0.38 0.08 0.00 -0.63 0.00 0.00 39.34 39.01 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 -2.94 -5.01 -1.64 2.98 7.64 -1.25 -1.79 113.62 111.61 1soh n SER 54 Ca -0.18 -0.68 -0.21 0.00 1.01 0.00 0.00 58.87 58.81 1soh n SER 54 Cb 0.68 -5.17 -0.09 0.00 -1.01 0.00 0.00 64.21 58.63 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 -3.56 -1.46 -0.30 1.43 4.81 -1.26 -4.84 118.16 112.98 1soh n LYS 55 Ca -0.15 1.22 0.11 0.00 -0.87 0.00 0.00 58.31 58.62 1soh n LYS 55 Cb 0.64 -5.62 0.28 0.00 0.02 0.00 0.00 35.03 30.34 1soh n LYS 55 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1soh h SER 56 N 0.00 0.44 0.00 3.14 0.02 -1.75 -3.23 113.55 112.17 1soh h SER 56 Ca -0.43 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.64 1soh h SER 56 Cb 1.36 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.96 1soh h SER 56 CO 0.62 0.10 -0.39 0.41 -1.14 0.00 0.00 176.83 176.43 1soh n THR 57 N -4.96 0.00 0.07 -2.27 -1.04 -1.26 -4.84 114.28 99.98 1soh n THR 57 Ca 0.20 -0.02 -0.22 0.00 -2.04 0.00 0.00 64.05 61.97 1soh n THR 57 Cb 0.56 0.39 -0.15 0.00 -1.82 0.00 0.00 70.33 69.32 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 0.02 -0.07 0.00 2.41 0.00 -1.93 -2.89 119.26 116.80 1soh h ALA 58 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.09 1soh h ALA 58 Cb 1.32 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1soh h ALA 58 CO 0.00 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1soh h ALA 59 N 0.09 1.00 0.00 0.00 0.00 -1.90 -3.00 119.26 115.44 1soh h ALA 59 Ca -0.20 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 1soh h ALA 59 Cb 1.83 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 1soh h ALA 59 CO 0.18 0.00 -0.92 1.98 0.00 0.00 0.00 179.25 180.49 1soh h MET 60 N 0.00 0.00 -0.99 0.00 4.05 -1.85 -3.28 114.93 112.86 1soh h MET 60 Ca 0.00 0.00 -0.48 0.00 -0.28 0.00 0.00 59.70 58.94 1soh h MET 60 Cb 0.70 0.00 -0.29 0.00 -0.80 0.00 0.00 31.60 31.21 1soh h MET 60 CO 0.00 0.58 0.61 0.43 0.23 0.00 0.00 176.91 178.76 1soh n SER 61 N -3.17 3.78 -0.00 1.39 7.64 -1.09 -4.15 113.62 118.02 1soh n SER 61 Ca -0.03 -3.52 0.10 0.00 1.01 0.00 0.00 58.87 56.43 1soh n SER 61 Cb 0.83 -0.82 -0.13 0.00 -1.01 0.00 0.00 64.21 63.08 1soh n SER 61 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1soh n THR 62 N -1.03 0.00 -0.21 0.44 -1.04 -1.23 -4.38 114.28 106.84 1soh n THR 62 Ca 0.57 -0.25 0.31 0.00 -2.04 0.00 0.00 64.05 62.63 1soh n THR 62 Cb 1.62 0.53 0.66 0.00 -1.82 0.00 0.00 70.33 71.32 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 -0.87 -1.42 -1.99 -1.81 0.41 116.97 111.29 1soh h TYR 63 Ca 0.00 0.00 0.25 0.00 2.00 0.00 0.00 58.73 60.98 1soh h TYR 63 Cb 0.68 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 1soh h TYR 63 CO 0.00 0.00 0.79 1.15 -0.00 0.00 0.00 178.16 180.10 1soh h THR 64 N 0.00 0.30 0.00 -2.88 2.02 -1.92 1.31 112.91 111.74 1soh h THR 64 Ca 0.47 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.65 1soh h THR 64 Cb 2.28 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1soh h THR 64 CO -0.00 0.00 -1.46 0.61 0.37 0.00 0.00 175.52 175.03 1soh n GLY 65 N -1.66 -1.01 0.00 2.16 0.00 0.15 -4.30 105.19 100.54 1soh n GLY 65 Ca 0.18 -0.55 0.10 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 -1.88 0.00 -0.58 -0.61 2.08 0.29 -4.28 119.36 114.38 1soh n ILE 66 Ca 0.00 -0.23 0.47 0.00 0.56 0.00 0.00 62.75 63.55 1soh n ILE 66 Cb 0.45 0.57 0.77 0.00 -0.75 0.00 0.00 39.64 40.68 1soh n ILE 66 CO 0.00 0.00 0.00 0.15 0.56 0.00 0.00 176.55 177.26 1soh h PHE 67 N 0.00 0.12 0.00 1.39 3.57 0.11 1.12 116.94 123.24 1soh h PHE 67 Ca 0.00 0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.35 1soh h PHE 67 Cb 0.68 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 1soh h PHE 67 CO 0.00 -0.05 -1.95 2.41 -2.23 0.00 0.00 178.31 176.49 1soh n THR 68 N -4.15 0.60 0.03 4.41 -1.04 -1.26 -4.21 114.28 108.66 1soh n THR 68 Ca 0.40 -0.55 -0.12 0.00 -2.04 0.00 0.00 64.05 61.74 1soh n THR 68 Cb 1.76 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 70.00 1soh n THR 68 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1soh h ASP 69 N 0.00 0.60 0.25 8.00 3.32 0.23 -1.01 116.42 127.81 1soh h ASP 69 Ca -0.24 -0.40 -0.09 0.00 0.02 0.00 0.00 57.03 56.33 1soh h ASP 69 Cb 1.44 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 1soh h ASP 69 CO 0.01 1.15 -0.35 0.06 -1.72 0.00 0.00 179.24 178.39 1soh h GLN 70 N 0.34 0.16 0.19 3.56 -0.00 0.67 -1.63 115.11 118.41 1soh h GLN 70 Ca -0.04 -0.06 -0.28 0.00 -0.00 0.00 0.00 58.65 58.27 1soh h GLN 70 Cb 1.33 -0.01 0.03 0.00 -0.00 0.00 0.00 27.48 28.84 1soh h GLN 70 CO 0.13 0.49 -1.20 0.28 -0.00 0.00 0.00 178.83 178.54 1soh h VAL 71 N 0.14 1.36 -0.01 1.86 2.07 -1.70 -2.95 116.25 117.02 1soh h VAL 71 Ca 0.02 -2.59 -0.04 0.00 0.82 0.00 0.00 66.70 64.90 1soh h VAL 71 Cb 0.69 3.04 -0.01 0.00 -1.52 0.00 0.00 31.29 33.49 1soh h VAL 71 CO 0.05 0.76 -0.21 -0.07 0.02 0.00 0.00 177.57 178.13 1soh h LEU 72 N -0.01 0.01 0.00 2.57 3.38 -1.07 -1.85 115.31 118.33 1soh h LEU 72 Ca -0.21 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1soh h LEU 72 Cb 1.94 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.68 1soh h LEU 72 CO 0.23 0.22 -0.16 0.28 0.09 0.00 0.00 178.44 179.10 1soh h SER 73 N 0.01 0.00 -0.17 -0.43 0.02 -1.35 -3.24 113.55 108.39 1soh h SER 73 Ca 0.00 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1soh h SER 73 Cb 0.37 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1soh h SER 73 CO 0.03 0.16 0.12 0.58 -1.14 0.00 0.00 176.83 176.58 1soh h VAL 74 N 0.00 0.95 -0.47 2.27 2.07 -1.14 0.37 116.25 120.30 1soh h VAL 74 Ca -0.00 -0.02 -0.13 0.00 0.82 0.00 0.00 66.70 67.36 1soh h VAL 74 Cb 1.12 0.88 -0.08 0.00 -1.52 0.00 0.00 31.29 31.69 1soh h VAL 74 CO 0.02 0.01 0.17 -0.11 0.02 0.00 0.00 177.57 177.68 1soh n LEU 75 N -4.50 4.52 0.00 2.57 7.94 -1.22 -0.37 117.00 125.94 1soh n LEU 75 Ca 0.01 -2.34 0.00 0.00 -1.11 0.00 0.00 56.01 52.57 1soh n LEU 75 Cb 0.21 -0.66 0.00 0.00 0.53 0.00 0.00 43.42 43.50 1soh n LEU 75 CO 0.35 0.63 0.00 0.29 -1.11 0.00 0.00 177.39 177.55 1soh n LYS 76 N 0.02 0.00 0.00 1.96 5.02 0.10 -4.94 118.16 120.32 1soh n LYS 76 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1soh n LYS 76 Cb 1.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.01 1soh n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1soh n GLY 77 N 0.00 1.34 2.71 0.72 0.00 -0.97 -4.57 105.19 104.42 1soh n GLY 77 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.86 1.40 0.00 1.61 -0.58 0.42 -4.91 120.64 117.72 1soh n GLU 78 Ca 0.00 -1.84 0.12 0.00 -0.42 0.00 0.00 57.16 55.02 1soh n GLU 78 Cb 0.00 -0.11 0.10 0.00 -0.57 0.00 0.00 31.44 30.86 1soh n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74