#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 0.71 -0.16 1.61 4.71 -1.26 -4.96 120.64 121.29 1of9 n GLU 2 Ca 0.00 -3.35 -0.04 0.00 -0.01 0.00 0.00 57.16 53.76 1of9 n GLU 2 Cb 0.00 -1.47 -0.04 0.00 -1.01 0.00 0.00 31.44 28.93 1of9 n GLU 2 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1of9 h ILE 3 N 2.99 0.00 -0.03 -3.67 2.04 -2.00 -3.24 117.51 113.61 1of9 h ILE 3 Ca 0.14 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.86 1of9 h ILE 3 Cb 0.87 0.00 -0.31 0.00 -0.74 0.00 0.00 36.82 36.64 1of9 h ILE 3 CO 0.47 0.00 -0.92 0.18 0.00 0.00 0.00 178.15 177.87 1of9 n LEU 4 N -3.87 1.44 0.16 1.44 4.32 -1.17 -4.84 117.00 114.48 1of9 n LEU 4 Ca 0.01 -2.48 -0.07 0.00 -0.02 0.00 0.00 56.01 53.45 1of9 n LEU 4 Cb 0.10 -0.10 -0.03 0.00 -1.62 0.00 0.00 43.42 41.77 1of9 n LEU 4 CO -0.06 0.73 0.26 0.00 -1.22 0.00 0.00 177.39 177.11 1of9 h ASN 6 N -0.78 0.00 0.17 0.00 2.35 -1.81 -0.32 115.58 115.20 1of9 h ASN 6 Ca -0.05 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1of9 h ASN 6 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1of9 h ASN 6 CO 0.08 0.01 -0.08 -0.07 -1.65 0.00 0.00 177.43 175.72 1of9 h LEU 7 N 0.00 -0.19 0.00 1.61 -0.00 -1.86 -1.06 115.31 113.81 1of9 h LEU 7 Ca -0.00 -0.33 0.00 0.00 -0.00 0.00 0.00 57.88 57.55 1of9 h LEU 7 Cb 0.08 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.79 1of9 h LEU 7 CO 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 178.44 178.72 1of9 h THR 9 N 0.00 0.00 0.23 0.00 1.35 -1.27 2.83 112.91 116.05 1of9 h THR 9 Ca 0.00 0.00 -0.32 0.00 -0.55 0.00 0.00 66.41 65.54 1of9 h THR 9 Cb 0.00 0.00 0.04 0.00 -1.73 0.00 0.00 68.15 66.46 1of9 h THR 9 CO 0.00 0.00 -1.41 1.23 -0.25 0.00 0.00 175.52 175.09 1of9 h GLY 10 N 0.00 0.62 1.71 5.82 0.00 -1.10 -3.00 103.07 107.11 1of9 h GLY 10 Ca 0.56 -1.54 -0.20 0.00 0.00 0.00 0.00 47.33 46.15 1of9 h GLY 10 CO -0.01 1.35 -0.89 0.17 0.00 0.00 0.00 176.54 177.16 1of9 h LEU 11 N 0.13 0.34 0.62 3.11 8.10 0.77 -2.77 115.31 125.61 1of9 h LEU 11 Ca -0.24 -0.27 -0.02 0.00 0.11 0.00 0.00 57.88 57.45 1of9 h LEU 11 Cb 2.10 -0.10 -0.01 0.00 -0.44 0.00 0.00 40.66 42.21 1of9 h LEU 11 CO 0.26 1.07 -0.42 0.40 -4.11 0.00 0.00 178.44 175.65 1of9 h ILE 12 N 0.15 0.16 -0.90 0.15 1.08 0.05 0.42 117.51 118.61 1of9 h ILE 12 Ca -0.05 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.54 1of9 h ILE 12 Cb 1.52 0.16 -0.08 0.00 -3.07 0.00 0.00 36.82 35.34 1of9 h ILE 12 CO 0.14 0.00 0.52 0.78 -0.69 0.00 0.00 178.15 178.91 1of9 h ASN 13 N -0.99 0.73 0.13 1.72 2.35 -1.59 1.01 115.58 118.94 1of9 h ASN 13 Ca -0.08 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1of9 h ASN 13 Cb 0.82 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.11 1of9 h ASN 13 CO 0.05 0.38 0.00 1.07 -1.65 0.00 0.00 177.43 177.28 1of9 n THR 14 N -4.73 0.07 -0.07 2.81 5.66 -0.86 -2.46 114.28 114.69 1of9 n THR 14 Ca 0.17 0.02 -0.10 0.00 -3.05 0.00 0.00 64.05 61.08 1of9 n THR 14 Cb 0.35 -0.62 -0.15 0.00 -1.55 0.00 0.00 70.33 68.36 1of9 n THR 14 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1of9 n LEU 15 N -1.08 0.55 0.33 1.09 7.94 0.34 -3.45 117.00 122.72 1of9 n LEU 15 Ca 0.17 0.15 0.21 0.00 -1.11 0.00 0.00 56.01 55.43 1of9 n LEU 15 Cb 0.12 0.26 1.12 0.00 0.53 0.00 0.00 43.42 45.45 1of9 n LEU 15 CO 0.16 0.49 1.16 -0.33 -1.11 0.00 0.00 177.39 177.76 1of9 h GLU 16 N 0.00 0.00 -0.01 1.96 5.08 -0.89 0.46 114.58 121.18 1of9 h GLU 16 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1of9 h GLU 16 Cb 2.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.39 1of9 h GLU 16 CO 0.04 0.00 -0.05 -1.71 -1.00 0.00 0.00 179.01 176.29 1of9 n ASN 17 N -3.01 1.76 0.00 1.42 5.15 -1.26 -4.52 115.26 114.80 1of9 n ASN 17 Ca -0.03 -1.38 0.00 0.00 -0.60 0.00 0.00 54.58 52.57 1of9 n ASN 17 Cb 0.13 0.11 0.00 0.00 -0.53 0.00 0.00 39.78 39.49 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 0.41 0.00 -0.14 1.20 7.94 0.16 -4.61 117.00 121.97 1of9 n LEU 18 Ca 0.06 0.02 -0.27 0.00 -1.11 0.00 0.00 56.01 54.71 1of9 n LEU 18 Cb 0.26 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.11 1of9 n LEU 18 CO 0.08 0.00 -1.42 0.18 -1.11 0.00 0.00 177.39 175.12 1of9 n LEU 19 N -0.03 2.21 -1.42 -1.96 7.99 -1.26 -4.92 117.00 117.61 1of9 n LEU 19 Ca 0.00 0.21 -0.03 0.00 -0.01 0.00 0.00 56.01 56.19 1of9 n LEU 19 Cb 0.00 -0.83 -0.01 0.00 -0.11 0.00 0.00 43.42 42.47 1of9 n LEU 19 CO 0.00 0.67 -0.03 1.07 -1.51 0.00 0.00 177.39 177.59 1of9 n THR 20 N -3.98 -0.03 0.00 -5.08 5.66 -1.26 -1.84 114.28 107.74 1of9 n THR 20 Ca -0.52 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.48 1of9 n THR 20 Cb 0.91 -0.29 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 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 -1.55 0.00 0.16 1.09 5.66 -1.26 -4.95 114.28 113.43 1of9 n THR 21 Ca -0.03 0.00 0.18 0.00 -3.05 0.00 0.00 64.05 61.16 1of9 n THR 21 Cb 0.19 0.00 0.79 0.00 -1.55 0.00 0.00 70.33 69.77 1of9 n THR 21 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 1of9 h LYS 22 N 0.00 0.00 0.00 1.09 3.64 -1.72 -3.44 116.57 116.14 1of9 h LYS 22 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1of9 h LYS 22 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1of9 h LYS 22 CO 0.00 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 177.59 1of9 n GLY 23 N -1.44 3.35 0.00 5.01 0.00 -1.26 -4.91 105.19 105.94 1of9 n GLY 23 Ca 0.04 -0.32 0.05 0.00 0.00 0.00 0.00 46.02 45.79 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 1.53 0.10 4.61 0.00 -1.26 -1.41 120.51 124.07 1of9 n ALA 24 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.26 1of9 n ALA 24 Cb 0.00 -1.17 -0.12 0.00 0.00 0.00 0.00 19.45 18.16 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 0.39 0.77 0.00 5.19 -1.99 -3.08 116.42 117.70 1of9 h ASP 25 Ca 0.00 -0.39 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1of9 h ASP 25 Cb 0.16 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1of9 h ASP 25 CO 0.00 1.28 0.00 0.50 -3.12 0.00 0.00 179.24 177.90 1of9 h LYS 26 N 0.09 0.00 0.25 3.56 1.63 -1.59 -2.82 116.57 117.69 1of9 h LYS 26 Ca -0.11 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.68 1of9 h LYS 26 Cb 1.87 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.50 1of9 h LYS 26 CO 0.19 0.00 -0.12 -0.24 -3.45 0.00 0.00 179.45 175.83 1of9 h VAL 27 N 0.00 0.79 0.00 2.00 3.04 -1.57 -0.80 116.25 119.71 1of9 h VAL 27 Ca 0.00 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 1of9 h VAL 27 Cb 0.39 0.91 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 1of9 h VAL 27 CO 0.00 0.05 0.01 2.29 -1.01 0.00 0.00 177.57 178.90 1of9 n LYS 28 N -5.19 0.14 0.08 4.17 2.85 -1.07 -0.09 118.16 119.05 1of9 n LYS 28 Ca -0.09 0.64 -0.11 0.00 -1.05 0.00 0.00 58.31 57.69 1of9 n LYS 28 Cb 0.19 -1.97 -0.05 0.00 -0.65 0.00 0.00 35.03 32.55 1of9 n LYS 28 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1of9 h ASP 29 N 0.00 0.37 0.71 -5.58 1.82 -1.16 -2.77 116.42 109.82 1of9 h ASP 29 Ca 0.00 -0.32 -0.26 0.00 -0.39 0.00 0.00 57.03 56.06 1of9 h ASP 29 Cb 0.02 -0.12 -0.04 0.00 0.68 0.00 0.00 39.33 39.87 1of9 h ASP 29 CO 0.00 1.14 -1.39 0.22 -1.61 0.00 0.00 179.24 177.61 1of9 h TYR 30 N 0.14 0.02 0.21 0.28 5.03 -0.13 -3.34 116.97 119.18 1of9 h TYR 30 Ca -0.07 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.21 1of9 h TYR 30 Cb 1.62 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.90 1of9 h TYR 30 CO 0.04 1.02 -0.10 0.82 -1.32 0.00 0.00 178.16 178.62 1of9 h ILE 31 N 0.00 0.00 -1.09 1.81 2.04 -1.16 -2.80 117.51 116.32 1of9 h ILE 31 Ca -0.16 -0.05 0.38 0.00 1.00 0.00 0.00 64.86 66.03 1of9 h ILE 31 Cb 1.91 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.88 1of9 h ILE 31 CO 0.11 0.00 0.71 -1.20 0.00 0.00 0.00 178.15 177.76 1of9 n SER 32 N -2.89 0.16 0.49 1.72 7.64 -1.05 0.13 113.62 119.82 1of9 n SER 32 Ca -0.04 1.07 -0.19 0.00 1.01 0.00 0.00 58.87 60.72 1of9 n SER 32 Cb 0.11 -0.52 -0.09 0.00 -1.01 0.00 0.00 64.21 62.69 1of9 n SER 32 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1of9 h SER 33 N 0.00 -1.10 -0.49 6.43 0.87 -1.62 1.25 113.55 118.90 1of9 h SER 33 Ca 0.69 0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 61.17 1of9 h SER 33 Cb 2.24 0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 64.47 1of9 h SER 33 CO -0.35 -0.76 -0.16 -0.07 -0.53 0.00 0.00 176.83 174.95 1of9 h LEU 34 N -1.25 1.00 -2.00 2.23 4.07 0.13 -1.93 115.31 117.56 1of9 h LEU 34 Ca -0.13 -0.35 -0.02 0.00 0.08 0.00 0.00 57.88 57.46 1of9 h LEU 34 Cb 0.97 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 42.43 1of9 h LEU 34 CO 0.20 1.14 -0.10 0.00 -1.08 0.00 0.00 178.44 178.60 1of9 n ASN 36 N -3.86 5.97 -2.68 0.00 5.15 0.43 -3.46 115.26 116.82 1of9 n ASN 36 Ca -0.02 -2.42 -0.03 0.00 -0.60 0.00 0.00 54.58 51.51 1of9 n ASN 36 Cb 0.20 -1.33 0.13 0.00 -0.53 0.00 0.00 39.78 38.24 1of9 n ASN 36 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1of9 n LYS 37 N 3.08 1.36 0.00 1.20 4.81 -1.16 -4.97 118.16 122.47 1of9 n LYS 37 Ca 0.52 -1.37 0.00 0.00 -0.87 0.00 0.00 58.31 56.59 1of9 n LYS 37 Cb 0.55 0.30 0.00 0.00 0.02 0.00 0.00 35.03 35.90 1of9 n LYS 37 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1of9 n ALA 38 N -1.39 0.12 -3.31 3.14 0.00 -1.22 -5.01 120.51 112.83 1of9 n ALA 38 Ca -0.15 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.13 1of9 n ALA 38 Cb 0.87 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.40 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 -4.32 0.00 0.00 7.64 -1.26 -4.77 113.62 110.92 1of9 n SER 39 Ca 0.00 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.23 1of9 n SER 39 Cb 0.00 -5.08 0.00 0.00 -1.01 0.00 0.00 64.21 58.12 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 -1.18 -1.86 0.16 0.23 0.00 -1.26 -4.85 105.19 96.43 1of9 n GLY 40 Ca -0.18 0.74 -0.19 0.00 0.00 0.00 0.00 46.02 46.39 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 0.83 0.00 1.61 3.04 -2.00 -3.22 116.94 117.20 1of9 h PHE 41 Ca 0.00 -0.47 0.00 0.00 3.98 0.00 0.00 57.97 61.48 1of9 h PHE 41 Cb 0.00 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.42 1of9 h PHE 41 CO 0.00 1.31 -0.51 -0.89 -2.02 0.00 0.00 178.31 176.20 1of9 n ILE 42 N -4.01 0.16 -0.34 1.41 2.08 -1.26 -4.26 119.36 113.14 1of9 n ILE 42 Ca -0.11 -0.12 -0.08 0.00 0.56 0.00 0.00 62.75 63.00 1of9 n ILE 42 Cb 0.81 0.01 -0.06 0.00 -0.75 0.00 0.00 39.64 39.65 1of9 n ILE 42 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1of9 n ALA 43 N -1.65 -0.46 0.23 -1.39 0.00 -1.22 0.35 120.51 116.39 1of9 n ALA 43 Ca 0.05 0.72 0.10 0.00 0.00 0.00 0.00 53.44 54.31 1of9 n ALA 43 Cb 0.38 -0.16 0.56 0.00 0.00 0.00 0.00 19.45 20.23 1of9 n ALA 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1of9 h THR 44 N 0.00 0.69 -0.36 0.00 1.03 -1.77 -2.02 112.91 110.48 1of9 h THR 44 Ca 0.16 -0.92 -0.14 0.00 -0.01 0.00 0.00 66.41 65.51 1of9 h THR 44 Cb 0.37 1.58 -0.01 0.00 -1.07 0.00 0.00 68.15 69.01 1of9 h THR 44 CO -0.79 0.21 -0.32 -0.07 -0.01 0.00 0.00 175.52 174.54 1of9 h LEU 45 N 0.00 0.84 0.52 0.00 3.38 0.60 0.70 115.31 121.35 1of9 h LEU 45 Ca -0.00 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 1of9 h LEU 45 Cb 0.56 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.08 1of9 h LEU 45 CO 0.03 1.09 -0.25 0.00 0.09 0.00 0.00 178.44 179.40 1of9 h THR 47 N -1.14 0.00 0.48 0.00 2.02 -1.41 -1.74 112.91 111.12 1of9 h THR 47 Ca -0.07 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1of9 h THR 47 Cb 0.58 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1of9 h THR 47 CO 0.12 0.00 -0.23 0.11 0.37 0.00 0.00 175.52 175.89 1of9 h LYS 48 N 0.00 -0.62 -0.63 6.66 1.79 -0.58 0.18 116.57 123.37 1of9 h LYS 48 Ca 0.00 0.04 0.11 0.00 -2.18 0.00 0.00 60.65 58.62 1of9 h LYS 48 Cb 0.19 0.14 -0.08 0.00 -1.58 0.00 0.00 32.23 30.90 1of9 h LYS 48 CO 0.00 -0.31 0.21 0.28 -1.08 0.00 0.00 179.45 178.55 1of9 h VAL 49 N -0.96 0.71 0.09 0.50 2.07 -1.19 0.52 116.25 117.99 1of9 h VAL 49 Ca -0.07 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1of9 h VAL 49 Cb 0.59 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1of9 h VAL 49 CO 0.11 0.07 -0.09 -0.07 0.02 0.00 0.00 177.57 177.61 1of9 h LEU 50 N 0.36 -0.23 -1.74 2.57 3.38 -1.46 2.19 115.31 120.38 1of9 h LEU 50 Ca 0.33 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.38 1of9 h LEU 50 Cb 0.45 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1of9 h LEU 50 CO -0.35 -0.14 0.29 -0.78 0.09 0.00 0.00 178.44 177.55 1of9 h ASP 51 N -0.20 0.28 0.02 -0.43 3.58 0.69 -2.67 116.42 117.69 1of9 h ASP 51 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1of9 h ASP 51 Cb 0.19 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.18 1of9 h ASP 51 CO -0.02 0.18 -0.01 0.15 -2.88 0.00 0.00 179.24 176.66 1of9 h PHE 52 N 0.32 -0.02 0.00 0.28 3.57 0.13 -3.50 116.94 117.71 1of9 h PHE 52 Ca 0.19 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1of9 h PHE 52 Cb 0.35 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.10 1of9 h PHE 52 CO -0.00 0.64 0.00 0.41 -2.23 0.00 0.00 178.31 177.13 1of9 n GLY 53 N 1.52 2.53 0.39 2.40 0.00 0.73 -4.71 105.19 108.04 1of9 n GLY 53 Ca -0.07 -0.76 0.25 0.00 0.00 0.00 0.00 46.02 45.44 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 0.40 -0.48 -0.61 5.03 -1.82 1.72 117.51 121.75 1of9 h ILE 54 Ca 0.00 -0.12 -0.07 0.00 -0.12 0.00 0.00 64.86 64.55 1of9 h ILE 54 Cb 0.00 0.01 -0.02 0.00 -3.03 0.00 0.00 36.82 33.78 1of9 h ILE 54 CO 0.00 0.06 0.01 0.44 -0.68 0.00 0.00 178.15 177.98 1of9 h ASP 55 N 0.36 0.75 0.45 1.72 3.32 -1.92 -2.67 116.42 118.43 1of9 h ASP 55 Ca 0.68 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.53 1of9 h ASP 55 Cb 1.69 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 41.05 1of9 h ASP 55 CO -0.43 0.81 -0.22 0.11 -1.72 0.00 0.00 179.24 177.80 1of9 h LYS 56 N 0.73 -0.59 -0.85 3.56 1.79 0.23 -0.32 116.57 121.13 1of9 h LYS 56 Ca 0.14 0.04 0.22 0.00 -2.18 0.00 0.00 60.65 58.87 1of9 h LYS 56 Cb 0.44 0.13 -0.14 0.00 -1.58 0.00 0.00 32.23 31.08 1of9 h LYS 56 CO 0.02 -0.37 0.16 -0.07 -1.08 0.00 0.00 179.45 178.12 1of9 h LEU 57 N -0.65 -0.11 -1.23 2.94 4.07 -1.08 1.72 115.31 120.97 1of9 h LEU 57 Ca -0.06 0.20 -0.05 0.00 0.08 0.00 0.00 57.88 58.04 1of9 h LEU 57 Cb 0.49 0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.51 1of9 h LEU 57 CO 0.10 -0.16 -0.04 0.40 -1.08 0.00 0.00 178.44 177.65 1of9 h ILE 58 N 0.18 1.20 0.35 1.22 1.08 -1.11 -2.78 117.51 117.64 1of9 h ILE 58 Ca 0.51 -0.82 -0.02 0.00 -0.39 0.00 0.00 64.86 64.14 1of9 h ILE 58 Cb 1.00 1.02 0.00 0.00 -3.07 0.00 0.00 36.82 35.77 1of9 h ILE 58 CO -0.66 0.27 -0.17 -0.61 -0.69 0.00 0.00 178.15 176.29 1of9 h GLN 59 N 0.45 -0.46 -0.97 2.37 4.15 0.42 -0.89 115.11 120.19 1of9 h GLN 59 Ca 0.09 0.03 0.28 0.00 0.77 0.00 0.00 58.65 59.83 1of9 h GLN 59 Cb 0.36 0.10 -0.14 0.00 0.21 0.00 0.00 27.48 28.01 1of9 h GLN 59 CO 0.02 -0.18 0.48 -0.07 -1.93 0.00 0.00 178.83 177.15 1of9 h LEU 60 N -0.70 0.39 -0.64 -2.39 3.38 -0.45 1.52 115.31 116.42 1of9 h LEU 60 Ca -0.05 0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.98 1of9 h LEU 60 Cb 0.49 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1of9 h LEU 60 CO 0.08 -0.10 -0.31 0.40 0.09 0.00 0.00 178.44 178.60 1of9 h ILE 61 N 0.33 1.28 -0.48 1.22 5.03 -1.24 0.15 117.51 123.80 1of9 h ILE 61 Ca 0.67 -1.45 0.07 0.00 -0.12 0.00 0.00 64.86 64.03 1of9 h ILE 61 Cb 1.44 1.35 -0.06 0.00 -3.03 0.00 0.00 36.82 36.52 1of9 h ILE 61 CO -0.60 0.47 0.14 -0.33 -0.68 0.00 0.00 178.15 177.15 1of9 h GLU 62 N 0.62 0.28 0.32 2.37 4.39 0.35 -3.10 114.58 119.82 1of9 h GLU 62 Ca 0.07 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 1of9 h GLU 62 Cb 0.83 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1of9 h GLU 62 CO 0.07 0.19 -0.15 0.38 -1.16 0.00 0.00 179.01 178.33 1of9 h ASP 63 N 0.29 -0.37 0.00 1.42 2.03 -1.06 -3.48 116.42 115.26 1of9 h ASP 63 Ca 0.24 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 1of9 h ASP 63 Cb 0.28 0.09 0.00 0.00 -0.83 0.00 0.00 39.33 38.87 1of9 h ASP 63 CO -0.27 -0.09 0.00 2.29 -1.03 0.00 0.00 179.24 180.14 1of9 n LYS 64 N -4.13 0.00 -3.82 4.15 2.85 -0.30 -5.12 118.16 111.78 1of9 n LYS 64 Ca -0.05 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 56.91 1of9 n LYS 64 Cb 0.17 0.00 -0.16 0.00 -0.65 0.00 0.00 35.03 34.39 1of9 n LYS 64 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1of9 s VAL 65 N 0.00 1.08 0.93 0.58 1.01 0.38 -4.94 120.40 119.45 1of9 s VAL 65 Ca 0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 61.98 60.71 1of9 s VAL 65 Cb 0.00 -1.59 0.13 0.00 0.00 0.00 0.00 36.38 34.92 1of9 s VAL 65 CO 0.00 -0.34 0.18 0.47 0.00 0.00 0.00 175.10 175.41 1of9 n ASP 66 N 4.81 -2.83 0.11 3.32 9.92 -1.26 -4.00 116.55 126.61 1of9 n ASP 66 Ca -0.07 -0.30 -0.02 0.00 -0.53 0.00 0.00 54.79 53.86 1of9 n ASP 66 Cb 0.44 -0.72 0.02 0.00 -0.64 0.00 0.00 41.12 40.23 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 -2.49 0.62 0.21 2.24 0.00 -1.95 -1.78 119.26 116.11 1of9 h ALA 67 Ca -0.22 -0.68 -0.32 0.00 0.00 0.00 0.00 54.91 53.69 1of9 h ALA 67 Cb 0.70 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.39 1of9 h ALA 67 CO 0.14 0.94 -1.50 -0.91 0.00 0.00 0.00 179.25 177.92 1of9 h ASN 68 N 0.00 0.68 -0.40 0.00 4.21 -1.89 -1.74 115.58 116.44 1of9 h ASN 68 Ca -0.01 -0.92 -0.05 0.00 1.21 0.00 0.00 56.30 56.53 1of9 h ASN 68 Cb 1.45 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 38.40 1of9 h ASN 68 CO 0.10 1.70 0.09 0.00 -1.29 0.00 0.00 177.43 178.02 1of9 h ALA 69 N 0.11 1.27 -0.06 -0.83 0.00 -1.88 0.55 119.26 118.42 1of9 h ALA 69 Ca -0.28 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1of9 h ALA 69 Cb 2.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1of9 h ALA 69 CO 0.21 0.50 -0.34 0.97 0.00 0.00 0.00 179.25 180.59 1of9 h ILE 70 N 0.70 1.43 -0.64 0.00 -0.00 -1.40 -2.97 117.51 114.64 1of9 h ILE 70 Ca 0.15 -1.77 0.00 0.00 -0.00 0.00 0.00 64.86 63.24 1of9 h ILE 70 Cb 0.30 2.39 -0.03 0.00 -0.00 0.00 0.00 36.82 39.48 1of9 h ILE 70 CO 0.00 0.51 0.41 0.00 -0.00 0.00 0.00 178.15 179.07 1of9 h ALA 72 N 1.22 0.57 -0.27 0.00 0.00 0.10 0.36 119.26 121.24 1of9 h ALA 72 Ca 0.23 0.21 0.03 0.00 0.00 0.00 0.00 54.91 55.38 1of9 h ALA 72 Cb -0.08 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1of9 h ALA 72 CO -0.05 -0.41 -0.23 -0.22 0.00 0.00 0.00 179.25 178.34 1of9 h LYS 73 N 0.08 -0.08 -0.99 0.00 3.11 -1.20 1.44 116.57 118.94 1of9 h LYS 73 Ca 0.32 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 58.17 1of9 h LYS 73 Cb 0.53 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.78 1of9 h LYS 73 CO -0.57 -0.06 0.00 0.44 -2.81 0.00 0.00 179.45 176.46 1of9 n ILE 74 N -3.84 0.01 -3.79 2.00 -0.00 -0.68 -4.84 119.36 108.23 1of9 n ILE 74 Ca -0.00 -0.01 -0.23 0.00 -0.00 0.00 0.00 62.75 62.50 1of9 n ILE 74 Cb 0.12 -0.49 -0.05 0.00 -0.00 0.00 0.00 39.64 39.22 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 -0.00 -0.87 -1.03 4.28 8.25 0.49 -4.74 115.22 121.61 1of9 n HIS 75 Ca 0.00 0.33 -0.23 0.00 -0.26 0.00 0.00 57.72 57.56 1of9 n HIS 75 Cb 0.25 -1.89 0.15 0.00 1.12 0.00 0.00 29.99 29.62 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 -3.51 5.39 0.40 -1.41 0.00 0.41 -4.91 120.51 116.89 1of9 n ALA 76 Ca -0.19 -2.66 0.03 0.00 0.00 0.00 0.00 53.44 50.62 1of9 n ALA 76 Cb 0.45 -1.44 0.19 0.00 0.00 0.00 0.00 19.45 18.65 1of9 n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50