#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 3.57 -2.07 -3.10 116.94 113.93 1soh h PHE 14 Ca 0.00 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.29 1soh h PHE 14 Cb 0.00 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1soh h PHE 14 CO 0.00 0.31 -1.07 1.37 -2.23 0.00 0.00 178.31 176.68 1soh h LEU 15 N 0.00 0.00 -0.93 0.59 8.10 -2.06 -3.29 115.31 117.73 1soh h LEU 15 Ca -0.00 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 57.89 1soh h LEU 15 Cb 1.03 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.23 1soh h LEU 15 CO 0.04 0.93 -0.25 0.74 -4.11 0.00 0.00 178.44 175.79 1soh h THR 16 N 0.00 1.27 0.12 0.15 2.02 -1.97 -1.86 112.91 112.64 1soh h THR 16 Ca -0.06 -1.27 -0.01 0.00 0.77 0.00 0.00 66.41 65.84 1soh h THR 16 Cb 1.76 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 1soh h THR 16 CO 0.11 0.41 -0.06 0.06 0.37 0.00 0.00 175.52 176.41 1soh h GLN 17 N 0.43 -0.16 -0.55 6.66 3.07 -1.62 -2.43 115.11 120.51 1soh h GLN 17 Ca 0.06 0.01 -0.01 0.00 0.09 0.00 0.00 58.65 58.80 1soh h GLN 17 Cb 0.67 0.04 -0.03 0.00 0.08 0.00 0.00 27.48 28.24 1soh h GLN 17 CO 0.05 -0.04 0.30 0.28 0.09 0.00 0.00 178.83 179.52 1soh h VAL 18 N -0.25 1.17 -0.14 1.86 2.07 -1.63 0.42 116.25 119.75 1soh h VAL 18 Ca -0.02 -0.41 0.04 0.00 0.82 0.00 0.00 66.70 67.13 1soh h VAL 18 Cb 0.20 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1soh h VAL 18 CO 0.03 0.18 0.15 0.11 0.02 0.00 0.00 177.57 178.06 1soh h LYS 19 N 0.76 0.00 -0.01 1.57 1.57 -0.88 1.37 116.57 120.95 1soh h LYS 19 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1soh h LYS 19 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1soh h LYS 19 CO -0.03 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.24 1soh n GLU 20 N -3.85 1.29 0.02 3.15 4.71 0.13 -3.18 120.64 122.92 1soh n GLU 20 Ca 0.00 -0.42 0.00 0.00 -0.01 0.00 0.00 57.16 56.73 1soh n GLU 20 Cb 0.26 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 1soh n GLU 20 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1soh n SER 21 N -0.48 0.39 0.29 1.62 2.88 0.31 -3.85 113.62 114.78 1soh n SER 21 Ca 0.22 0.07 0.18 0.00 -1.33 0.00 0.00 58.87 58.00 1soh n SER 21 Cb 0.21 -0.11 0.92 0.00 -0.75 0.00 0.00 64.21 64.49 1soh n SER 21 CO 0.00 0.00 0.00 0.17 -1.23 0.00 0.00 175.04 173.98 1soh h LEU 22 N 0.00 0.00 0.00 2.46 8.10 0.12 0.70 115.31 126.68 1soh h LEU 22 Ca 0.00 0.00 -0.09 0.00 0.11 0.00 0.00 57.88 57.90 1soh h LEU 22 Cb 0.56 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.76 1soh h LEU 22 CO 0.00 0.00 -1.84 -1.20 -4.11 0.00 0.00 178.44 171.29 1soh n SER 23 N -3.20 1.25 -0.40 0.17 7.64 -1.19 -3.87 113.62 114.02 1soh n SER 23 Ca -0.01 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.01 1soh n SER 23 Cb 0.30 1.47 0.43 0.00 -1.01 0.00 0.00 64.21 65.40 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 -2.23 1.37 -0.00 6.43 7.64 0.35 -3.23 113.62 123.95 1soh n SER 24 Ca -0.10 -1.25 0.03 0.00 1.01 0.00 0.00 58.87 58.56 1soh n SER 24 Cb 0.61 0.07 -0.04 0.00 -1.01 0.00 0.00 64.21 63.84 1soh n SER 24 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1soh n TYR 25 N -0.14 0.00 -0.04 1.43 4.19 0.22 -3.87 117.16 118.95 1soh n TYR 25 Ca 0.16 0.00 -0.14 0.00 3.31 0.00 0.00 57.90 61.23 1soh n TYR 25 Cb 0.37 -0.01 -0.14 0.00 0.49 0.00 0.00 39.34 40.05 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 -1.18 0.82 0.12 2.98 -0.00 -1.24 -2.61 117.44 116.33 1soh n TRP 26 Ca 0.01 0.24 0.06 0.00 -0.00 0.00 0.00 57.50 57.81 1soh n TRP 26 Cb 0.10 -1.13 0.02 0.00 -0.00 0.00 0.00 31.31 30.30 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 0.02 0.00 0.20 5.87 3.07 -1.79 -3.33 114.58 118.63 1soh h GLU 27 Ca -0.40 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.16 1soh h GLU 27 Cb 2.05 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 29.98 1soh h GLU 27 CO 0.06 0.20 -1.40 1.03 -1.40 0.00 0.00 179.01 177.49 1soh h SER 28 N 0.00 0.66 -0.89 1.42 0.87 -1.71 -2.91 113.55 110.99 1soh h SER 28 Ca -0.04 -0.92 0.26 0.00 -1.23 0.00 0.00 61.79 59.85 1soh h SER 28 Cb 1.25 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.96 1soh h SER 28 CO 0.03 1.66 0.68 0.00 -0.53 0.00 0.00 176.83 178.66 1soh h ALA 29 N 0.10 2.80 0.05 6.23 0.00 -1.61 0.55 119.26 127.39 1soh h ALA 29 Ca -0.26 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 54.32 1soh h ALA 29 Cb 2.00 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.82 1soh h ALA 29 CO 0.20 -1.14 -1.60 0.87 0.00 0.00 0.00 179.25 177.59 1soh h LYS 30 N 0.00 0.11 0.00 0.00 1.79 -1.66 -2.60 116.57 114.21 1soh h LYS 30 Ca 0.42 -0.18 -0.09 0.00 -2.18 0.00 0.00 60.65 58.62 1soh h LYS 30 Cb 1.77 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 32.48 1soh h LYS 30 CO -0.00 0.84 -0.41 1.79 -1.08 0.00 0.00 179.45 180.58 1soh h THR 31 N 0.03 0.93 -0.22 -0.16 1.35 0.04 -3.08 112.91 111.80 1soh h THR 31 Ca -0.25 -1.65 -0.04 0.00 -0.55 0.00 0.00 66.41 63.91 1soh h THR 31 Cb 1.98 2.00 -0.03 0.00 -1.73 0.00 0.00 68.15 70.38 1soh h THR 31 CO 0.11 0.40 -0.03 0.00 -0.25 0.00 0.00 175.52 175.75 1soh n ALA 32 N -2.30 3.17 -0.11 6.62 0.00 0.14 -4.60 120.51 123.44 1soh n ALA 32 Ca -0.00 -2.59 -0.17 0.00 0.00 0.00 0.00 53.44 50.68 1soh n ALA 32 Cb 0.54 -0.65 -0.06 0.00 0.00 0.00 0.00 19.45 19.29 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 -0.85 0.96 0.33 0.00 0.00 -0.98 -3.99 120.51 115.98 1soh n ALA 33 Ca 0.23 -0.87 0.22 0.00 0.00 0.00 0.00 53.44 53.02 1soh n ALA 33 Cb 0.87 0.04 1.19 0.00 0.00 0.00 0.00 19.45 21.55 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 0.38 0.00 4.20 -1.83 0.44 115.11 117.30 1soh h GLN 34 Ca -0.28 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.42 1soh h GLN 34 Cb 1.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1soh h GLN 34 CO -0.17 0.00 -0.18 -0.97 -0.67 0.00 0.00 178.83 176.84 1soh h ASN 35 N 0.00 -0.43 -0.43 1.46 -1.24 -1.81 -2.86 115.58 110.27 1soh h ASN 35 Ca -0.00 0.01 -0.04 0.00 0.71 0.00 0.00 56.30 56.99 1soh h ASN 35 Cb 0.03 0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 1soh h ASN 35 CO 0.00 -0.01 0.12 -0.07 -1.29 0.00 0.00 177.43 176.18 1soh h LEU 36 N -1.09 0.63 -2.43 0.34 3.38 -1.63 -2.22 115.31 112.29 1soh h LEU 36 Ca -0.05 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.72 1soh h LEU 36 Cb 0.39 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1soh h LEU 36 CO 0.08 0.68 0.17 1.88 0.09 0.00 0.00 178.44 181.35 1soh h TYR 37 N 0.55 0.00 0.00 1.13 -1.99 -1.04 -0.49 116.97 115.14 1soh h TYR 37 Ca 0.14 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.87 1soh h TYR 37 Cb 0.28 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.01 1soh h TYR 37 CO 0.01 0.00 -0.00 1.49 -0.00 0.00 0.00 178.16 179.66 1soh h GLU 38 N 0.00 -0.00 -1.00 4.88 4.57 -1.15 0.26 114.58 122.13 1soh h GLU 38 Ca 0.03 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 57.70 1soh h GLU 38 Cb 0.37 0.00 -0.29 0.00 -0.16 0.00 0.00 28.75 28.67 1soh h GLU 38 CO -0.00 0.68 0.64 1.63 -1.18 0.00 0.00 179.01 180.78 1soh n LYS 39 N -4.76 2.22 0.00 1.92 5.02 -0.68 -3.96 118.16 117.92 1soh n LYS 39 Ca -0.09 -2.87 0.00 0.00 -2.02 0.00 0.00 58.31 53.33 1soh n LYS 39 Cb 0.34 -2.12 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 1soh n LYS 39 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1soh n THR 40 N -1.04 0.00 -1.13 -0.18 -1.04 -0.28 -4.90 114.28 105.72 1soh n THR 40 Ca 0.57 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 62.33 1soh n THR 40 Cb 1.53 -0.13 0.15 0.00 -1.82 0.00 0.00 70.33 70.06 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 -2.00 2.92 -3.66 -1.42 4.19 0.91 -4.81 117.16 113.28 1soh n TYR 41 Ca 0.00 -2.02 -0.38 0.00 3.31 0.00 0.00 57.90 58.81 1soh n TYR 41 Cb 0.00 -1.02 -0.09 0.00 0.49 0.00 0.00 39.34 38.73 1soh n TYR 41 CO 0.00 0.00 0.00 -1.17 0.91 0.00 0.00 176.86 176.60 1soh s LEU 42 N -3.20 5.46 -0.17 2.98 2.96 -1.23 -4.88 118.68 120.61 1soh s LEU 42 Ca 0.55 -2.72 0.00 0.00 -0.22 0.00 0.00 54.13 51.74 1soh s LEU 42 Cb 0.46 -1.91 0.18 0.00 0.50 0.00 0.00 46.19 45.42 1soh s LEU 42 CO 0.08 -0.43 1.58 -0.81 -1.32 0.00 0.00 176.35 175.45 1soh n PRO 43 N 3.71 1.44 0.00 0.98 -0.04 -1.26 -3.58 135.00 136.24 1soh n PRO 43 Ca 0.07 -0.96 0.00 0.00 -0.04 0.00 0.00 63.50 62.57 1soh n PRO 43 Cb 0.39 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 0.31 1.26 0.23 0.55 0.00 -1.26 -4.77 120.51 116.83 1soh n ALA 44 Ca 0.19 -0.52 0.06 0.00 0.00 0.00 0.00 53.44 53.17 1soh n ALA 44 Cb 0.73 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.73 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 1.37 1.09 0.00 0.00 3.04 -1.94 0.40 116.25 120.20 1soh h VAL 45 Ca 0.00 -0.45 -0.05 0.00 -1.01 0.00 0.00 66.70 65.19 1soh h VAL 45 Cb 0.62 1.24 -0.01 0.00 -2.01 0.00 0.00 31.29 31.14 1soh h VAL 45 CO 0.00 0.13 -0.23 -0.78 -1.01 0.00 0.00 177.57 175.68 1soh h ASP 46 N 0.00 0.00 0.00 3.17 3.58 -1.89 0.30 116.42 121.59 1soh h ASP 46 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1soh h ASP 46 Cb 0.23 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.25 1soh h ASP 46 CO 0.02 0.23 -0.49 -0.62 -2.88 0.00 0.00 179.24 175.49 1soh n GLU 47 N -3.24 1.42 0.15 0.28 1.02 -0.32 -4.83 120.64 115.12 1soh n GLU 47 Ca 0.02 -3.11 0.00 0.00 -0.02 0.00 0.00 57.16 54.05 1soh n GLU 47 Cb 0.53 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 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 -1.01 0.00 -2.91 3.49 4.81 0.13 -4.82 118.16 117.84 1soh n LYS 48 Ca 0.17 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.46 1soh n LYS 48 Cb 0.72 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.77 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 -3.14 -1.13 -1.38 3.14 7.94 0.09 0.12 117.00 122.65 1soh n LEU 49 Ca 0.00 -0.05 -0.13 0.00 -1.11 0.00 0.00 56.01 54.72 1soh n LEU 49 Cb 0.00 -1.94 -0.01 0.00 0.53 0.00 0.00 43.42 42.00 1soh n LEU 49 CO 0.00 0.02 -0.16 0.54 -1.11 0.00 0.00 177.39 176.69 1soh n ARG 50 N -3.19 -0.99 -0.01 1.96 1.74 -1.26 -4.88 116.66 110.03 1soh n ARG 50 Ca -0.06 0.66 -0.00 0.00 -0.77 0.00 0.00 57.85 57.68 1soh n ARG 50 Cb 0.56 -4.84 -0.02 0.00 -1.02 0.00 0.00 32.46 27.13 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 -0.37 4.24 -0.93 0.55 -0.08 0.32 -4.58 116.55 115.71 1soh n ASP 51 Ca -0.15 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.18 1soh n ASP 51 Cb 0.59 0.80 0.18 0.00 2.34 0.00 0.00 41.12 45.02 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 -1.92 2.62 -0.08 -2.67 7.94 -1.19 -3.92 117.00 117.78 1soh n LEU 52 Ca -0.03 -1.32 -0.14 0.00 -1.11 0.00 0.00 56.01 53.41 1soh n LEU 52 Cb 0.40 -0.42 -0.07 0.00 0.53 0.00 0.00 43.42 43.86 1soh n LEU 52 CO 0.07 0.45 -1.04 0.00 -1.11 0.00 0.00 177.39 175.76 1soh n TYR 53 N 0.41 0.00 -3.57 1.96 9.36 -1.26 -5.01 117.16 119.04 1soh n TYR 53 Ca 0.13 0.00 -0.20 0.00 3.32 0.00 0.00 57.90 61.15 1soh n TYR 53 Cb 0.51 -0.60 0.06 0.00 -0.63 0.00 0.00 39.34 38.68 1soh n TYR 53 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1soh n SER 54 N -3.30 -1.82 -1.35 2.98 2.88 -1.25 -0.86 113.62 110.91 1soh n SER 54 Ca -0.30 -0.74 -0.18 0.00 -1.33 0.00 0.00 58.87 56.33 1soh n SER 54 Cb 0.77 -4.52 -0.08 0.00 -0.75 0.00 0.00 64.21 59.63 1soh n SER 54 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1soh n LYS 55 N -4.17 -1.53 -0.18 -1.46 5.02 -1.26 -4.84 118.16 109.74 1soh n LYS 55 Ca -0.28 1.12 -0.01 0.00 -2.02 0.00 0.00 58.31 57.11 1soh n LYS 55 Cb 0.67 -5.51 0.08 0.00 -0.02 0.00 0.00 35.03 30.25 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 0.06 0.00 4.39 0.02 -1.39 -3.34 113.55 113.29 1soh h SER 56 Ca -0.36 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.66 1soh h SER 56 Cb 1.30 0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.90 1soh h SER 56 CO 0.53 0.05 -0.40 0.41 -1.14 0.00 0.00 176.83 176.28 1soh n THR 57 N -5.08 0.00 0.10 -2.27 -1.04 -1.26 -4.88 114.28 99.84 1soh n THR 57 Ca 0.07 -0.10 -0.22 0.00 -2.04 0.00 0.00 64.05 61.75 1soh n THR 57 Cb 0.26 0.40 -0.14 0.00 -1.82 0.00 0.00 70.33 69.04 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 0.10 -0.06 0.00 2.41 0.00 -1.94 -2.98 119.26 116.79 1soh h ALA 58 Ca -0.05 -0.77 -0.03 0.00 0.00 0.00 0.00 54.91 54.06 1soh h ALA 58 Cb 1.33 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1soh h ALA 58 CO -0.01 0.62 -0.12 0.00 0.00 0.00 0.00 179.25 179.74 1soh h ALA 59 N 0.22 0.99 0.00 0.00 0.00 -1.90 -2.85 119.26 115.71 1soh h ALA 59 Ca -0.20 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1soh h ALA 59 Cb 1.91 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 1soh h ALA 59 CO 0.23 0.15 -0.45 0.52 0.00 0.00 0.00 179.25 179.70 1soh h MET 60 N 0.00 0.00 -0.77 0.00 2.86 -1.88 -3.24 114.93 111.90 1soh h MET 60 Ca -0.00 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.16 1soh h MET 60 Cb 0.75 0.00 -0.27 0.00 0.06 0.00 0.00 31.60 32.14 1soh h MET 60 CO 0.02 0.45 0.25 0.43 1.06 0.00 0.00 176.91 179.11 1soh n SER 61 N -3.24 4.80 -0.00 1.22 7.64 -1.08 -4.39 113.62 118.56 1soh n SER 61 Ca 0.02 -3.75 0.08 0.00 1.01 0.00 0.00 58.87 56.23 1soh n SER 61 Cb 0.69 -0.74 -0.11 0.00 -1.01 0.00 0.00 64.21 63.05 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 -1.00 0.00 -0.24 0.44 -1.04 -1.20 -4.43 114.28 106.81 1soh n THR 62 Ca 0.50 -0.22 0.32 0.00 -2.04 0.00 0.00 64.05 62.61 1soh n THR 62 Cb 1.05 0.64 0.67 0.00 -1.82 0.00 0.00 70.33 70.87 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 -0.92 -1.42 -1.99 -1.81 0.47 116.97 111.31 1soh h TYR 63 Ca 0.00 0.00 0.27 0.00 2.00 0.00 0.00 58.73 61.00 1soh h TYR 63 Cb 0.55 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.25 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 0.32 0.00 -2.88 2.02 -1.94 1.09 112.91 111.52 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 2.36 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 1soh h THR 64 CO -0.01 0.00 -0.58 0.61 0.37 0.00 0.00 175.52 175.92 1soh n GLY 65 N -1.67 -0.14 0.00 2.16 0.00 0.17 -4.46 105.19 101.25 1soh n GLY 65 Ca 0.19 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.29 0.00 -0.55 -0.61 5.41 0.17 -4.29 119.36 118.19 1soh n ILE 66 Ca 0.02 -0.13 0.45 0.00 1.00 0.00 0.00 62.75 64.09 1soh n ILE 66 Cb 0.19 0.79 0.77 0.00 -0.71 0.00 0.00 39.64 40.68 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 0.11 0.00 1.39 3.57 0.72 1.04 116.94 123.77 1soh h PHE 67 Ca 0.00 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.35 1soh h PHE 67 Cb 0.55 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1soh h PHE 67 CO 0.00 -0.04 -1.94 2.41 -2.23 0.00 0.00 178.31 176.52 1soh n THR 68 N -4.16 0.59 0.00 4.41 -1.04 -1.26 -4.26 114.28 108.56 1soh n THR 68 Ca 0.38 -0.54 -0.12 0.00 -2.04 0.00 0.00 64.05 61.73 1soh n THR 68 Cb 1.68 -0.27 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 0.68 0.25 8.00 3.58 0.02 0.12 116.42 129.07 1soh h ASP 69 Ca -0.23 -0.40 -0.07 0.00 0.42 0.00 0.00 57.03 56.75 1soh h ASP 69 Cb 1.43 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 1soh h ASP 69 CO 0.01 1.14 -0.29 0.06 -2.88 0.00 0.00 179.24 177.29 1soh h GLN 70 N 0.43 0.07 0.15 0.28 3.07 0.55 -1.80 115.11 117.86 1soh h GLN 70 Ca -0.01 -0.02 -0.26 0.00 0.09 0.00 0.00 58.65 58.45 1soh h GLN 70 Cb 1.21 -0.01 0.01 0.00 0.08 0.00 0.00 27.48 28.78 1soh h GLN 70 CO 0.12 0.36 -1.25 0.28 0.09 0.00 0.00 178.83 178.43 1soh h VAL 71 N 0.07 1.21 0.00 1.86 2.07 -1.71 -3.24 116.25 116.51 1soh h VAL 71 Ca 0.01 -2.49 -0.00 0.00 0.82 0.00 0.00 66.70 65.04 1soh h VAL 71 Cb 0.55 2.92 -0.00 0.00 -1.52 0.00 0.00 31.29 33.24 1soh h VAL 71 CO 0.04 0.73 -0.02 0.25 0.02 0.00 0.00 177.57 178.59 1soh h LEU 72 N -0.25 0.00 -0.27 2.57 6.46 -0.87 -0.29 115.31 122.67 1soh h LEU 72 Ca -0.25 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.45 1soh h LEU 72 Cb 1.79 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.72 1soh h LEU 72 CO 0.12 0.02 -0.28 0.77 -0.62 0.00 0.00 178.44 178.46 1soh h SER 73 N 0.00 0.00 -0.23 1.25 4.64 -1.42 -3.19 113.55 114.61 1soh h SER 73 Ca -0.00 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.37 1soh h SER 73 Cb 0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1soh h SER 73 CO 0.00 0.28 0.16 0.58 -0.87 0.00 0.00 176.83 176.98 1soh h VAL 74 N 0.00 0.94 -0.17 0.95 2.07 -1.06 0.27 116.25 119.25 1soh h VAL 74 Ca -0.00 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.53 1soh h VAL 74 Cb 1.11 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 1soh h VAL 74 CO 0.04 0.02 0.25 -0.07 0.02 0.00 0.00 177.57 177.82 1soh h LEU 75 N 0.10 0.00 -6.06 2.57 4.07 -1.64 -3.39 115.31 110.96 1soh h LEU 75 Ca 0.10 0.00 0.26 0.00 0.08 0.00 0.00 57.88 58.33 1soh h LEU 75 Cb 0.28 0.00 -0.24 0.00 1.08 0.00 0.00 40.66 41.78 1soh h LEU 75 CO -0.01 0.00 0.39 -0.54 -1.08 0.00 0.00 178.44 177.20 1soh s LYS 76 N -4.48 0.07 0.00 1.13 -0.14 0.07 -4.97 119.74 111.41 1soh s LYS 76 Ca -0.04 0.15 0.00 0.00 -1.36 0.00 0.00 55.97 54.71 1soh s LYS 76 Cb 0.14 0.09 0.00 0.00 -1.68 0.00 0.00 37.83 36.37 1soh s LYS 76 CO 0.48 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 175.44 1soh n GLY 77 N 5.01 0.99 2.70 -3.33 0.00 -1.20 -4.68 105.19 104.69 1soh n GLY 77 Ca -0.08 0.00 -0.08 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 -0.65 -2.67 0.00 1.61 2.13 -1.12 -4.96 120.64 114.99 1soh n GLU 78 Ca 0.00 0.22 0.14 0.00 0.66 0.00 0.00 57.16 58.18 1soh n GLU 78 Cb 0.00 -4.77 0.52 0.00 0.27 0.00 0.00 31.44 27.46 1soh n GLU 78 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11