#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1of9 n GLU 2 N 0.00 0.37 0.03 1.61 1.02 -1.26 -5.00 120.64 117.41 1of9 n GLU 2 Ca 0.00 -1.04 -0.12 0.00 -0.02 0.00 0.00 57.16 55.98 1of9 n GLU 2 Cb 0.00 -0.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.85 1of9 n GLU 2 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1of9 h ILE 3 N 1.47 0.00 -0.24 -3.67 2.04 -1.95 -3.38 117.51 111.78 1of9 h ILE 3 Ca -0.24 0.00 -0.23 0.00 1.00 0.00 0.00 64.86 65.40 1of9 h ILE 3 Cb 1.17 0.00 -0.24 0.00 -0.74 0.00 0.00 36.82 37.01 1of9 h ILE 3 CO 0.00 0.00 -0.61 -0.11 0.00 0.00 0.00 178.15 177.43 1of9 n LEU 4 N -4.70 -0.48 -0.01 1.44 7.94 -1.25 -4.92 117.00 115.02 1of9 n LEU 4 Ca -0.05 -3.30 -0.01 0.00 -1.11 0.00 0.00 56.01 51.54 1of9 n LEU 4 Cb 0.29 0.21 -0.00 0.00 0.53 0.00 0.00 43.42 44.45 1of9 n LEU 4 CO 0.09 1.59 -0.04 0.00 -1.11 0.00 0.00 177.39 177.91 1of9 h ASN 6 N -0.13 0.00 -0.01 0.00 -1.24 -1.92 0.53 115.58 112.82 1of9 h ASN 6 Ca 0.00 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.00 1of9 h ASN 6 Cb 0.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.11 1of9 h ASN 6 CO 0.00 0.00 -0.02 0.25 -1.29 0.00 0.00 177.43 176.37 1of9 h LEU 7 N 0.00 0.03 0.00 0.34 7.12 -1.90 -1.60 115.31 119.29 1of9 h LEU 7 Ca 0.10 -0.65 0.00 0.00 0.13 0.00 0.00 57.88 57.46 1of9 h LEU 7 Cb 0.48 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.60 1of9 h LEU 7 CO -0.00 0.67 0.00 0.00 -0.13 0.00 0.00 178.44 178.98 1of9 n THR 9 N -0.36 0.00 -0.04 0.00 -1.04 0.03 0.33 114.28 113.19 1of9 n THR 9 Ca 0.00 1.36 -0.16 0.00 -2.04 0.00 0.00 64.05 63.20 1of9 n THR 9 Cb 0.00 -2.29 -0.06 0.00 -1.82 0.00 0.00 70.33 66.15 1of9 n THR 9 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1of9 h GLY 10 N 0.00 0.85 1.64 3.41 0.00 -1.22 -3.02 103.07 104.73 1of9 h GLY 10 Ca 0.79 -1.11 -0.23 0.00 0.00 0.00 0.00 47.33 46.78 1of9 h GLY 10 CO -0.01 0.99 -1.01 0.17 0.00 0.00 0.00 176.54 176.68 1of9 h LEU 11 N 0.50 0.42 -0.35 3.11 8.10 0.82 -3.19 115.31 124.71 1of9 h LEU 11 Ca -0.02 -0.37 0.08 0.00 0.11 0.00 0.00 57.88 57.68 1of9 h LEU 11 Cb 1.26 -0.13 -0.08 0.00 -0.44 0.00 0.00 40.66 41.26 1of9 h LEU 11 CO 0.13 1.20 -0.24 0.40 -4.11 0.00 0.00 178.44 175.83 1of9 h ILE 12 N 0.15 0.37 -0.46 0.15 1.08 -0.36 0.53 117.51 118.97 1of9 h ILE 12 Ca -0.08 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.44 1of9 h ILE 12 Cb 1.67 0.37 -0.03 0.00 -3.07 0.00 0.00 36.82 35.77 1of9 h ILE 12 CO 0.17 0.00 0.31 0.78 -0.69 0.00 0.00 178.15 178.72 1of9 h ASN 13 N -0.19 0.36 0.72 1.72 4.21 -1.58 0.26 115.58 121.08 1of9 h ASN 13 Ca 0.17 -0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.63 1of9 h ASN 13 Cb 0.46 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.57 1of9 h ASN 13 CO -0.46 0.24 -0.26 0.74 -1.29 0.00 0.00 177.43 176.40 1of9 h THR 14 N 0.41 0.71 -0.09 2.81 2.02 -0.09 -2.39 112.91 116.29 1of9 h THR 14 Ca 0.20 -1.11 -0.11 0.00 0.77 0.00 0.00 66.41 66.16 1of9 h THR 14 Cb 0.27 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1of9 h THR 14 CO -0.05 0.25 -0.42 -0.07 0.37 0.00 0.00 175.52 175.60 1of9 h LEU 15 N 0.00 0.22 -1.05 2.58 3.38 0.25 2.16 115.31 122.84 1of9 h LEU 15 Ca -0.00 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1of9 h LEU 15 Cb 0.69 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1of9 h LEU 15 CO 0.03 0.61 -0.20 -0.33 0.09 0.00 0.00 178.44 178.65 1of9 h GLU 16 N 0.17 0.00 -0.01 1.13 5.08 -1.21 -2.84 114.58 116.91 1of9 h GLU 16 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1of9 h GLU 16 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1of9 h GLU 16 CO 0.06 0.20 -0.24 -1.71 -1.00 0.00 0.00 179.01 176.32 1of9 n ASN 17 N -3.33 1.16 0.00 1.42 5.15 -0.84 -4.44 115.26 114.38 1of9 n ASN 17 Ca 0.00 -1.08 0.00 0.00 -0.60 0.00 0.00 54.58 52.90 1of9 n ASN 17 Cb 0.43 0.52 0.00 0.00 -0.53 0.00 0.00 39.78 40.20 1of9 n ASN 17 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1of9 n LEU 18 N -0.34 0.00 -0.13 1.20 7.94 0.72 -4.70 117.00 121.69 1of9 n LEU 18 Ca 0.04 0.05 -0.27 0.00 -1.11 0.00 0.00 56.01 54.73 1of9 n LEU 18 Cb 0.21 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.06 1of9 n LEU 18 CO 0.14 0.00 -1.36 0.18 -1.11 0.00 0.00 177.39 175.24 1of9 n LEU 19 N -0.06 2.18 -1.65 -1.96 7.99 -1.26 -4.92 117.00 117.33 1of9 n LEU 19 Ca 0.00 0.24 -0.01 0.00 -0.01 0.00 0.00 56.01 56.23 1of9 n LEU 19 Cb 0.00 -0.86 -0.00 0.00 -0.11 0.00 0.00 43.42 42.45 1of9 n LEU 19 CO 0.00 0.64 -0.01 1.07 -1.51 0.00 0.00 177.39 177.58 1of9 n THR 20 N -4.04 -0.02 0.00 -5.08 5.66 -1.26 -1.74 114.28 107.80 1of9 n THR 20 Ca -0.51 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.49 1of9 n THR 20 Cb 0.90 -0.14 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 1of9 n THR 20 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1of9 n THR 21 N -1.71 0.00 -0.03 1.09 5.66 -1.26 -4.95 114.28 113.07 1of9 n THR 21 Ca -0.01 0.00 0.22 0.00 -3.05 0.00 0.00 64.05 61.21 1of9 n THR 21 Cb 0.24 0.00 0.70 0.00 -1.55 0.00 0.00 70.33 69.72 1of9 n THR 21 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1of9 h LYS 22 N 0.00 0.00 0.00 1.09 6.56 -1.69 -3.44 116.57 119.09 1of9 h LYS 22 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1of9 h LYS 22 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1of9 h LYS 22 CO 0.00 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.80 1of9 n GLY 23 N -1.65 3.03 0.16 3.86 0.00 -1.26 -4.92 105.19 104.41 1of9 n GLY 23 Ca 0.11 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.07 1of9 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1of9 n ALA 24 N 0.00 1.13 0.04 4.61 0.00 -1.26 -0.59 120.51 124.44 1of9 n ALA 24 Ca 0.00 0.18 -0.12 0.00 0.00 0.00 0.00 53.44 53.50 1of9 n ALA 24 Cb 0.00 -1.32 -0.00 0.00 0.00 0.00 0.00 19.45 18.13 1of9 n ALA 24 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1of9 h ASP 25 N 0.00 0.59 0.69 0.00 3.32 -1.99 -2.69 116.42 116.34 1of9 h ASP 25 Ca 0.00 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1of9 h ASP 25 Cb 0.05 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.43 1of9 h ASP 25 CO 0.00 1.16 0.00 0.50 -1.72 0.00 0.00 179.24 179.18 1of9 h LYS 26 N 0.33 0.00 0.21 3.56 1.63 -1.20 -2.82 116.57 118.28 1of9 h LYS 26 Ca -0.04 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 1of9 h LYS 26 Cb 1.36 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.99 1of9 h LYS 26 CO 0.14 0.00 -0.10 -0.24 -3.45 0.00 0.00 179.45 175.80 1of9 h VAL 27 N 0.00 0.87 0.00 2.00 3.04 -1.45 -1.91 116.25 118.80 1of9 h VAL 27 Ca 0.00 -0.50 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 1of9 h VAL 27 Cb 0.34 1.16 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 1of9 h VAL 27 CO 0.00 0.11 0.11 0.07 -1.01 0.00 0.00 177.57 176.85 1of9 h LYS 28 N -0.53 0.00 -0.10 4.17 2.10 -1.57 0.42 116.57 121.05 1of9 h LYS 28 Ca -0.03 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.43 1of9 h LYS 28 Cb 0.40 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.73 1of9 h LYS 28 CO 0.05 0.00 -0.73 0.22 -2.00 0.00 0.00 179.45 176.99 1of9 h ASP 29 N 0.00 0.59 0.72 7.07 3.58 -1.36 -1.95 116.42 125.08 1of9 h ASP 29 Ca 0.00 -0.38 -0.24 0.00 0.42 0.00 0.00 57.03 56.82 1of9 h ASP 29 Cb 0.21 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.05 1of9 h ASP 29 CO 0.00 1.13 -1.40 0.22 -2.88 0.00 0.00 179.24 176.32 1of9 h TYR 30 N 0.35 0.00 -0.16 0.28 5.03 -0.02 -3.04 116.97 119.41 1of9 h TYR 30 Ca -0.03 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.17 1of9 h TYR 30 Cb 1.31 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.58 1of9 h TYR 30 CO 0.05 0.93 -0.38 0.82 -1.32 0.00 0.00 178.16 178.27 1of9 h ILE 31 N 0.00 1.30 -0.08 1.81 2.04 -0.61 0.14 117.51 122.10 1of9 h ILE 31 Ca -0.17 -1.47 -0.20 0.00 1.00 0.00 0.00 64.86 64.02 1of9 h ILE 31 Cb 1.86 1.59 0.01 0.00 -0.74 0.00 0.00 36.82 39.55 1of9 h ILE 31 CO 0.09 0.45 -0.72 0.28 0.00 0.00 0.00 178.15 178.25 1of9 h SER 32 N 0.29 0.78 -0.06 1.72 0.02 -1.44 0.40 113.55 115.26 1of9 h SER 32 Ca 0.03 -0.67 -0.08 0.00 -0.84 0.00 0.00 61.79 60.23 1of9 h SER 32 Cb 0.80 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1of9 h SER 32 CO 0.06 1.34 -0.18 -1.28 -1.14 0.00 0.00 176.83 175.63 1of9 h SER 33 N 0.29 0.42 0.01 3.07 0.87 -1.40 1.53 113.55 118.34 1of9 h SER 33 Ca -0.07 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.36 1of9 h SER 33 Cb 1.37 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 1of9 h SER 33 CO 0.15 0.62 -0.07 -0.07 -0.53 0.00 0.00 176.83 176.93 1of9 h LEU 34 N 0.39 0.04 -1.57 2.23 4.07 -0.94 -3.25 115.31 116.29 1of9 h LEU 34 Ca 0.07 -0.95 -0.04 0.00 0.08 0.00 0.00 57.88 57.03 1of9 h LEU 34 Cb 0.55 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.27 1of9 h LEU 34 CO 0.04 0.99 -0.21 0.00 -1.08 0.00 0.00 178.44 178.17 1of9 h ASN 36 N 0.00 0.00 -0.37 0.00 -0.73 0.22 0.21 115.58 114.90 1of9 h ASN 36 Ca -0.00 0.00 -0.29 0.00 1.87 0.00 0.00 56.30 57.88 1of9 h ASN 36 Cb 0.50 0.00 -0.10 0.00 0.27 0.00 0.00 38.32 38.98 1of9 h ASN 36 CO 0.03 0.00 -0.08 0.29 -0.37 0.00 0.00 177.43 177.30 1of9 n LYS 37 N -3.68 2.07 0.00 6.67 5.02 -0.92 -4.45 118.16 122.87 1of9 n LYS 37 Ca 0.27 -1.41 0.00 0.00 -2.02 0.00 0.00 58.31 55.15 1of9 n LYS 37 Cb 1.47 -1.98 0.00 0.00 -0.02 0.00 0.00 35.03 34.50 1of9 n LYS 37 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1of9 n ALA 38 N 1.82 0.18 -4.25 7.82 0.00 0.72 -4.94 120.51 121.87 1of9 n ALA 38 Ca 0.42 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.48 1of9 n ALA 38 Cb 0.76 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.14 1of9 n ALA 38 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1of9 n SER 39 N 0.00 -1.43 0.00 0.00 7.64 -1.26 -4.70 113.62 113.87 1of9 n SER 39 Ca 0.00 -1.13 0.00 0.00 1.01 0.00 0.00 58.87 58.75 1of9 n SER 39 Cb 0.00 -1.45 0.00 0.00 -1.01 0.00 0.00 64.21 61.75 1of9 n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1of9 n GLY 40 N -1.13 3.88 0.24 0.23 0.00 -1.26 -4.87 105.19 102.27 1of9 n GLY 40 Ca 0.07 -0.27 0.04 0.00 0.00 0.00 0.00 46.02 45.87 1of9 n GLY 40 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1of9 h PHE 41 N 0.00 0.11 0.00 1.61 3.04 -1.99 -0.45 116.94 119.26 1of9 h PHE 41 Ca 0.00 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1of9 h PHE 41 Cb 0.00 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 38.48 1of9 h PHE 41 CO 0.00 0.24 -0.47 -0.89 -2.02 0.00 0.00 178.31 175.17 1of9 n ILE 42 N -4.33 0.09 -0.34 1.41 -0.00 -1.26 -4.27 119.36 110.65 1of9 n ILE 42 Ca -0.02 -0.07 -0.09 0.00 -0.00 0.00 0.00 62.75 62.58 1of9 n ILE 42 Cb 0.23 0.07 -0.08 0.00 -0.00 0.00 0.00 39.64 39.86 1of9 n ILE 42 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1of9 n ALA 43 N -1.58 -0.51 0.23 -1.39 0.00 -0.18 0.35 120.51 117.43 1of9 n ALA 43 Ca 0.05 0.70 0.08 0.00 0.00 0.00 0.00 53.44 54.27 1of9 n ALA 43 Cb 0.36 -0.12 0.55 0.00 0.00 0.00 0.00 19.45 20.24 1of9 n ALA 43 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1of9 h THR 44 N 0.00 0.85 -0.55 0.00 1.35 -1.74 -1.96 112.91 110.85 1of9 h THR 44 Ca 0.14 -0.86 -0.11 0.00 -0.55 0.00 0.00 66.41 65.02 1of9 h THR 44 Cb 0.34 1.51 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 1of9 h THR 44 CO -0.77 0.22 -0.10 -0.07 -0.25 0.00 0.00 175.52 174.55 1of9 h LEU 45 N 0.00 1.04 0.04 3.87 3.38 0.57 -1.62 115.31 122.59 1of9 h LEU 45 Ca -0.00 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 1of9 h LEU 45 Cb 0.49 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1of9 h LEU 45 CO 0.03 1.14 -0.02 0.00 0.09 0.00 0.00 178.44 179.68 1of9 h THR 47 N -0.41 0.49 0.86 0.00 2.02 -1.26 -1.27 112.91 113.33 1of9 h THR 47 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 1of9 h THR 47 Cb 0.37 0.67 0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1of9 h THR 47 CO 0.01 0.00 -0.41 0.11 0.37 0.00 0.00 175.52 175.60 1of9 h LYS 48 N 0.00 -1.11 -1.03 6.66 1.79 -0.84 -0.33 116.57 121.70 1of9 h LYS 48 Ca 0.23 0.08 0.35 0.00 -2.18 0.00 0.00 60.65 59.12 1of9 h LYS 48 Cb 1.11 0.25 -0.15 0.00 -1.58 0.00 0.00 32.23 31.86 1of9 h LYS 48 CO -0.00 -0.73 0.60 0.28 -1.08 0.00 0.00 179.45 178.51 1of9 h VAL 49 N -1.27 0.24 -0.35 0.50 2.07 -1.14 1.50 116.25 117.81 1of9 h VAL 49 Ca -0.12 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1of9 h VAL 49 Cb 0.89 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1of9 h VAL 49 CO 0.19 0.05 0.01 -0.07 0.02 0.00 0.00 177.57 177.77 1of9 h LEU 50 N 0.25 0.60 -1.14 2.57 3.38 -1.26 1.06 115.31 120.78 1of9 h LEU 50 Ca 0.76 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 58.40 1of9 h LEU 50 Cb 1.85 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.41 1of9 h LEU 50 CO -0.60 0.75 0.27 0.44 0.09 0.00 0.00 178.44 179.39 1of9 h ASP 51 N 0.42 0.79 0.02 -0.43 5.19 0.36 -3.02 116.42 119.76 1of9 h ASP 51 Ca 0.10 -0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1of9 h ASP 51 Cb 0.44 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.75 1of9 h ASP 51 CO 0.02 0.69 -0.01 0.15 -3.12 0.00 0.00 179.24 176.97 1of9 h PHE 52 N 0.87 -0.03 0.00 4.55 3.57 0.31 -3.50 116.94 122.71 1of9 h PHE 52 Ca 0.21 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1of9 h PHE 52 Cb 0.13 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1of9 h PHE 52 CO 0.01 0.70 0.00 0.41 -2.23 0.00 0.00 178.31 177.20 1of9 n GLY 53 N 1.03 2.33 0.37 2.40 0.00 0.36 -4.70 105.19 107.00 1of9 n GLY 53 Ca -0.09 -0.83 0.23 0.00 0.00 0.00 0.00 46.02 45.33 1of9 n GLY 53 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1of9 h ILE 54 N 0.00 0.42 -0.48 -0.61 5.03 -1.82 1.73 117.51 121.77 1of9 h ILE 54 Ca 0.00 -0.14 -0.03 0.00 -0.12 0.00 0.00 64.86 64.57 1of9 h ILE 54 Cb 0.00 -0.02 -0.02 0.00 -3.03 0.00 0.00 36.82 33.75 1of9 h ILE 54 CO 0.00 0.07 0.17 0.44 -0.68 0.00 0.00 178.15 178.15 1of9 h ASP 55 N 0.40 0.64 0.81 1.72 5.19 -1.92 -2.74 116.42 120.53 1of9 h ASP 55 Ca 0.68 -0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.97 1of9 h ASP 55 Cb 1.59 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 40.94 1of9 h ASP 55 CO -0.46 0.60 -0.39 0.11 -3.12 0.00 0.00 179.24 175.98 1of9 h LYS 56 N 0.69 -1.05 -0.99 3.56 1.57 0.23 0.22 116.57 120.81 1of9 h LYS 56 Ca 0.16 0.07 0.37 0.00 -1.87 0.00 0.00 60.65 59.38 1of9 h LYS 56 Cb 0.18 0.24 -0.17 0.00 0.08 0.00 0.00 32.23 32.56 1of9 h LYS 56 CO -0.01 -0.69 0.46 -0.07 -0.57 0.00 0.00 179.45 178.57 1of9 h LEU 57 N -1.18 0.24 0.10 2.94 3.38 -1.15 0.82 115.31 120.46 1of9 h LEU 57 Ca -0.11 0.24 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1of9 h LEU 57 Cb 0.85 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1of9 h LEU 57 CO 0.18 -0.34 -0.05 0.40 0.09 0.00 0.00 178.44 178.72 1of9 h ILE 58 N 0.09 1.13 -0.97 1.22 1.08 -1.16 -2.69 117.51 116.21 1of9 h ILE 58 Ca 0.77 -1.04 0.27 0.00 -0.39 0.00 0.00 64.86 64.46 1of9 h ILE 58 Cb 1.91 1.77 -0.14 0.00 -3.07 0.00 0.00 36.82 37.30 1of9 h ILE 58 CO -0.75 0.25 0.51 -0.61 -0.69 0.00 0.00 178.15 176.85 1of9 h GLN 59 N -0.63 0.40 0.91 2.37 4.15 0.38 0.26 115.11 122.96 1of9 h GLN 59 Ca -0.01 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.34 1of9 h GLN 59 Cb 0.51 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.11 1of9 h GLN 59 CO 0.02 0.27 -0.44 -0.07 -1.93 0.00 0.00 178.83 176.68 1of9 h LEU 60 N 0.41 -1.04 -0.81 -2.39 3.38 -0.54 -1.82 115.31 112.50 1of9 h LEU 60 Ca 0.65 0.03 0.19 0.00 0.09 0.00 0.00 57.88 58.84 1of9 h LEU 60 Cb 1.34 0.27 -0.12 0.00 0.09 0.00 0.00 40.66 42.24 1of9 h LEU 60 CO -0.55 -0.71 0.23 -0.29 0.09 0.00 0.00 178.44 177.21 1of9 h ILE 61 N -1.30 0.46 -0.95 1.22 2.10 -0.70 0.78 117.51 119.12 1of9 h ILE 61 Ca -0.13 -0.10 0.13 0.00 1.08 0.00 0.00 64.86 65.85 1of9 h ILE 61 Cb 0.94 0.15 -0.08 0.00 -1.09 0.00 0.00 36.82 36.74 1of9 h ILE 61 CO 0.21 0.05 0.60 -0.33 -1.08 0.00 0.00 178.15 177.60 1of9 h GLU 62 N 0.29 0.83 0.19 2.19 4.39 -0.30 -2.90 114.58 119.26 1of9 h GLU 62 Ca 0.48 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 60.12 1of9 h GLU 62 Cb 0.87 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1of9 h GLU 62 CO -0.55 0.55 -0.09 0.22 -1.16 0.00 0.00 179.01 177.97 1of9 h ASP 63 N 0.85 -0.21 0.00 1.42 3.58 0.13 -3.48 116.42 118.70 1of9 h ASP 63 Ca 0.48 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.93 1of9 h ASP 63 Cb 0.60 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.71 1of9 h ASP 63 CO -0.24 0.07 0.00 1.17 -2.88 0.00 0.00 179.24 177.36 1of9 n LYS 64 N -3.90 0.00 -4.03 0.28 4.81 0.73 -5.11 118.16 110.94 1of9 n LYS 64 Ca -0.03 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.10 1of9 n LYS 64 Cb 0.10 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 34.99 1of9 n LYS 64 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1of9 s VAL 65 N 0.00 1.79 0.98 3.15 1.01 -1.13 -4.96 120.40 121.25 1of9 s VAL 65 Ca 0.00 -1.08 -0.13 0.00 0.00 0.00 0.00 61.98 60.77 1of9 s VAL 65 Cb 0.00 -1.82 0.15 0.00 0.00 0.00 0.00 36.38 34.71 1of9 s VAL 65 CO 0.00 0.21 0.25 0.47 0.00 0.00 0.00 175.10 176.03 1of9 n ASP 66 N 4.64 -2.93 0.08 3.32 9.92 -1.26 -4.28 116.55 126.04 1of9 n ASP 66 Ca -0.16 -0.35 -0.17 0.00 -0.53 0.00 0.00 54.79 53.59 1of9 n ASP 66 Cb 0.47 -0.75 -0.14 0.00 -0.64 0.00 0.00 41.12 40.05 1of9 n ASP 66 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1of9 h ALA 67 N -2.59 0.19 0.02 2.24 0.00 -1.97 -2.91 119.26 114.25 1of9 h ALA 67 Ca -0.24 -1.02 -0.00 0.00 0.00 0.00 0.00 54.91 53.65 1of9 h ALA 67 Cb 0.75 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1of9 h ALA 67 CO 0.15 1.06 -0.01 -0.97 0.00 0.00 0.00 179.25 179.48 1of9 h ASN 68 N 0.07 -0.03 -0.72 0.00 -0.73 -1.90 -1.29 115.58 110.98 1of9 h ASN 68 Ca -0.20 -0.65 0.14 0.00 1.87 0.00 0.00 56.30 57.45 1of9 h ASN 68 Cb 2.01 0.01 -0.09 0.00 0.27 0.00 0.00 38.32 40.51 1of9 h ASN 68 CO 0.18 0.66 0.26 0.00 -0.37 0.00 0.00 177.43 178.16 1of9 h ALA 69 N 0.18 0.98 -0.32 1.57 0.00 -1.92 0.84 119.26 120.59 1of9 h ALA 69 Ca -0.00 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1of9 h ALA 69 Cb 0.67 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1of9 h ALA 69 CO 0.01 -0.23 -0.17 0.82 0.00 0.00 0.00 179.25 179.68 1of9 h ILE 70 N 0.40 1.25 -0.08 0.00 1.08 -1.54 -0.22 117.51 118.40 1of9 h ILE 70 Ca 0.39 -1.15 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 1of9 h ILE 70 Cb 0.59 1.19 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 1of9 h ILE 70 CO -0.40 0.38 0.00 0.00 -0.69 0.00 0.00 178.15 177.43 1of9 n ALA 72 N -0.30 0.86 0.35 0.00 0.00 0.25 -0.95 120.51 120.72 1of9 n ALA 72 Ca 0.12 -0.57 -0.18 0.00 0.00 0.00 0.00 53.44 52.81 1of9 n ALA 72 Cb 0.15 -0.62 -0.09 0.00 0.00 0.00 0.00 19.45 18.89 1of9 n ALA 72 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1of9 h LYS 73 N -0.30 -0.99 -0.07 0.00 2.10 -1.52 -0.40 116.57 115.39 1of9 h LYS 73 Ca -0.41 0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1of9 h LYS 73 Cb 1.79 0.22 0.00 0.00 -0.90 0.00 0.00 32.23 33.34 1of9 h LYS 73 CO -0.02 -0.66 0.00 0.44 -2.00 0.00 0.00 179.45 177.21 1of9 n ILE 74 N -5.56 0.02 -3.61 0.07 -0.00 -1.25 -4.86 119.36 104.17 1of9 n ILE 74 Ca -0.13 -0.02 -0.19 0.00 -0.00 0.00 0.00 62.75 62.41 1of9 n ILE 74 Cb 0.45 -0.02 -0.06 0.00 -0.00 0.00 0.00 39.64 40.01 1of9 n ILE 74 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.55 177.96 1of9 n HIS 75 N -0.43 -0.77 1.39 4.28 8.25 -0.16 -4.69 115.22 123.08 1of9 n HIS 75 Ca 0.00 0.37 0.06 0.00 -0.26 0.00 0.00 57.72 57.89 1of9 n HIS 75 Cb 0.03 -1.70 0.21 0.00 1.12 0.00 0.00 29.99 29.64 1of9 n HIS 75 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1of9 n ALA 76 N -3.19 2.49 0.31 -1.41 0.00 -0.13 -4.99 120.51 113.60 1of9 n ALA 76 Ca -0.20 -0.37 0.02 0.00 0.00 0.00 0.00 53.44 52.89 1of9 n ALA 76 Cb 0.42 -1.04 0.15 0.00 0.00 0.00 0.00 19.45 18.98 1of9 n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50