#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 0.00 -0.21 1.61 0.28 -1.26 -4.98 120.64 116.08 1of9 n GLU 2 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.92 1of9 n GLU 2 Cb 0.00 0.00 0.02 0.00 1.43 0.00 0.00 31.44 32.89 1of9 n GLU 2 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1of9 h ILE 3 N 0.00 1.25 0.00 3.84 2.04 -1.96 -3.40 117.51 119.28 1of9 h ILE 3 Ca 0.00 -0.88 -0.09 0.00 1.00 0.00 0.00 64.86 64.89 1of9 h ILE 3 Cb 0.00 0.70 -0.08 0.00 -0.74 0.00 0.00 36.82 36.70 1of9 h ILE 3 CO 0.00 0.33 -0.16 0.00 0.00 0.00 0.00 178.15 178.32 1of9 n LEU 4 N -4.38 -0.75 0.00 1.44 -0.00 -1.26 -5.00 117.00 107.06 1of9 n LEU 4 Ca 0.03 -1.85 0.00 0.00 -0.00 0.00 0.00 56.01 54.19 1of9 n LEU 4 Cb 0.23 0.29 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1of9 n LEU 4 CO 0.41 1.29 0.45 0.00 -0.00 0.00 0.00 177.39 179.54 1of9 h ASN 6 N 0.00 0.00 0.00 0.00 -0.73 -1.94 0.92 115.58 113.82 1of9 h ASN 6 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1of9 h ASN 6 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.59 1of9 h ASN 6 CO 0.00 0.00 0.00 -0.11 -0.37 0.00 0.00 177.43 176.95 1of9 n LEU 7 N -3.26 0.29 0.16 0.34 -0.00 -0.17 -0.27 117.00 114.09 1of9 n LEU 7 Ca 0.09 0.59 -0.16 0.00 -0.00 0.00 0.00 56.01 56.53 1of9 n LEU 7 Cb 0.88 -0.16 -0.09 0.00 -0.00 0.00 0.00 43.42 44.06 1of9 n LEU 7 CO 0.20 -0.16 0.56 0.00 -0.00 0.00 0.00 177.39 177.99 1of9 h THR 9 N -0.76 0.06 0.11 0.00 2.02 -0.97 1.26 112.91 114.63 1of9 h THR 9 Ca -0.00 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.90 1of9 h THR 9 Cb 0.74 0.43 0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1of9 h THR 9 CO -0.21 0.00 -1.20 1.23 0.37 0.00 0.00 175.52 175.71 1of9 h GLY 10 N 0.00 0.44 1.10 2.16 0.00 0.30 -3.08 103.07 103.98 1of9 h GLY 10 Ca 0.07 -0.99 -0.34 0.00 0.00 0.00 0.00 47.33 46.06 1of9 h GLY 10 CO -0.00 0.87 -1.62 0.17 0.00 0.00 0.00 176.54 175.97 1of9 h LEU 11 N 0.15 0.73 -0.32 3.11 8.10 0.21 -3.28 115.31 124.00 1of9 h LEU 11 Ca -0.14 -0.91 0.07 0.00 0.11 0.00 0.00 57.88 57.00 1of9 h LEU 11 Cb 1.89 -0.24 -0.08 0.00 -0.44 0.00 0.00 40.66 41.79 1of9 h LEU 11 CO 0.21 1.74 -0.29 0.40 -4.11 0.00 0.00 178.44 176.39 1of9 h ILE 12 N 0.13 0.29 -0.89 0.15 5.03 -0.28 0.56 117.51 122.51 1of9 h ILE 12 Ca -0.30 0.00 0.20 0.00 -0.12 0.00 0.00 64.86 64.64 1of9 h ILE 12 Cb 2.14 0.29 -0.06 0.00 -3.03 0.00 0.00 36.82 36.15 1of9 h ILE 12 CO 0.23 0.00 0.59 0.78 -0.68 0.00 0.00 178.15 179.06 1of9 h ASN 13 N -0.26 0.41 0.88 1.72 2.35 -1.66 1.08 115.58 120.09 1of9 h ASN 13 Ca 0.16 0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.89 1of9 h ASN 13 Cb 0.51 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 1of9 h ASN 13 CO -0.47 0.17 -0.25 0.74 -1.65 0.00 0.00 177.43 175.97 1of9 h THR 14 N 0.41 0.62 0.00 2.81 2.02 -0.04 -2.38 112.91 116.35 1of9 h THR 14 Ca 0.46 -1.16 -0.07 0.00 0.77 0.00 0.00 66.41 66.40 1of9 h THR 14 Cb 1.13 1.77 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 1of9 h THR 14 CO -0.17 0.24 -0.34 -0.07 0.37 0.00 0.00 175.52 175.55 1of9 h LEU 15 N 0.00 0.00 -0.58 2.58 3.38 0.34 2.34 115.31 123.37 1of9 h LEU 15 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1of9 h LEU 15 Cb 0.75 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1of9 h LEU 15 CO 0.03 0.34 -0.19 -0.33 0.09 0.00 0.00 178.44 178.39 1of9 h GLU 16 N 0.00 0.00 -0.00 1.13 5.08 -1.02 -3.12 114.58 116.64 1of9 h GLU 16 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 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 0.04 0.19 -0.09 -1.71 -1.00 0.00 0.00 179.01 176.44 1of9 n ASN 17 N -3.21 0.94 0.00 1.42 2.85 -0.87 -4.62 115.26 111.77 1of9 n ASN 17 Ca 0.02 -0.97 0.00 0.00 -0.11 0.00 0.00 54.58 53.52 1of9 n ASN 17 Cb 0.51 0.40 0.00 0.00 1.24 0.00 0.00 39.78 41.93 1of9 n ASN 17 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 1of9 n LEU 18 N -0.27 0.00 -0.13 1.20 7.94 0.78 -4.71 117.00 121.82 1of9 n LEU 18 Ca 0.02 0.00 -0.25 0.00 -1.11 0.00 0.00 56.01 54.67 1of9 n LEU 18 Cb 0.11 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 43.96 1of9 n LEU 18 CO 0.06 0.00 -1.15 0.18 -1.11 0.00 0.00 177.39 175.36 1of9 n LEU 19 N 0.00 1.93 -3.13 -1.96 7.99 -1.26 -4.93 117.00 115.64 1of9 n LEU 19 Ca 0.00 0.37 -0.23 0.00 -0.01 0.00 0.00 56.01 56.14 1of9 n LEU 19 Cb 0.00 -0.84 -0.04 0.00 -0.11 0.00 0.00 43.42 42.43 1of9 n LEU 19 CO 0.00 0.39 -0.09 1.07 -1.51 0.00 0.00 177.39 177.25 1of9 n THR 20 N -4.32 0.00 0.00 -5.08 5.66 -1.26 -4.46 114.28 104.82 1of9 n THR 20 Ca -0.44 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 1of9 n THR 20 Cb 0.79 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 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 -2.45 0.00 0.00 1.09 5.66 -1.26 -5.04 114.28 112.28 1of9 n THR 21 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1of9 n THR 21 Cb 0.26 -0.59 0.00 0.00 -1.55 0.00 0.00 70.33 68.45 1of9 n THR 21 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1of9 n LYS 22 N -2.40 0.00 -0.55 1.09 3.00 -1.26 -4.99 118.16 113.06 1of9 n LYS 22 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.25 1of9 n LYS 22 Cb 0.13 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.08 1of9 n LYS 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1of9 n GLY 23 N 0.00 2.12 0.37 3.14 0.00 -1.26 -4.37 105.19 105.20 1of9 n GLY 23 Ca 0.00 -0.57 0.02 0.00 0.00 0.00 0.00 46.02 45.47 1of9 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1of9 h ALA 24 N 3.63 1.38 -0.05 4.61 0.00 -1.95 0.19 119.26 127.07 1of9 h ALA 24 Ca 0.09 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1of9 h ALA 24 Cb 0.87 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1of9 h ALA 24 CO 0.25 0.49 0.03 -0.44 0.00 0.00 0.00 179.25 179.59 1of9 h ASP 25 N 1.22 0.00 0.81 0.00 3.32 -2.02 0.44 116.42 120.19 1of9 h ASP 25 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 1of9 h ASP 25 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1of9 h ASP 25 CO -0.15 0.00 0.00 0.50 -1.72 0.00 0.00 179.24 177.87 1of9 h LYS 26 N 0.00 0.00 0.20 3.56 1.63 -0.98 -2.75 116.57 118.24 1of9 h LYS 26 Ca 0.02 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 1of9 h LYS 26 Cb 0.09 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 1of9 h LYS 26 CO -0.00 0.00 -0.10 -0.24 -3.45 0.00 0.00 179.45 175.66 1of9 h VAL 27 N 0.00 0.88 0.00 2.00 3.04 0.03 -2.52 116.25 119.68 1of9 h VAL 27 Ca 0.00 -0.77 -0.01 0.00 -1.01 0.00 0.00 66.70 64.91 1of9 h VAL 27 Cb 0.41 1.31 -0.00 0.00 -2.01 0.00 0.00 31.29 31.00 1of9 h VAL 27 CO 0.00 0.16 -0.03 0.50 -1.01 0.00 0.00 177.57 177.19 1of9 h LYS 28 N -0.68 0.00 -0.24 4.17 3.11 -1.52 0.18 116.57 121.58 1of9 h LYS 28 Ca -0.03 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.73 1of9 h LYS 28 Cb 0.48 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.70 1of9 h LYS 28 CO 0.05 0.03 -0.21 0.22 -2.81 0.00 0.00 179.45 176.73 1of9 h ASP 29 N 0.00 0.43 0.64 4.20 3.58 -1.23 -2.21 116.42 121.84 1of9 h ASP 29 Ca -0.00 -0.13 -0.27 0.00 0.42 0.00 0.00 57.03 57.05 1of9 h ASP 29 Cb 0.07 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 40.97 1of9 h ASP 29 CO 0.00 0.66 -1.49 0.22 -2.88 0.00 0.00 179.24 175.75 1of9 h TYR 30 N 0.40 0.02 0.00 0.28 5.03 -0.47 -3.28 116.97 118.95 1of9 h TYR 30 Ca 0.06 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.35 1of9 h TYR 30 Cb 0.59 -0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.87 1of9 h TYR 30 CO 0.02 1.03 -0.03 0.82 -1.32 0.00 0.00 178.16 178.68 1of9 h ILE 31 N 0.00 0.12 -0.02 1.81 2.04 -0.53 -1.66 117.51 119.28 1of9 h ILE 31 Ca -0.20 -0.35 -0.20 0.00 1.00 0.00 0.00 64.86 65.11 1of9 h ILE 31 Cb 1.94 1.30 0.01 0.00 -0.74 0.00 0.00 36.82 39.34 1of9 h ILE 31 CO 0.10 0.03 -0.76 0.28 0.00 0.00 0.00 178.15 177.79 1of9 h SER 32 N 0.00 0.70 0.46 1.72 0.02 -1.46 0.27 113.55 115.25 1of9 h SER 32 Ca -0.00 -0.73 -0.08 0.00 -0.84 0.00 0.00 61.79 60.13 1of9 h SER 32 Cb 0.30 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1of9 h SER 32 CO 0.00 1.34 -0.39 -1.28 -1.14 0.00 0.00 176.83 175.37 1of9 h SER 33 N 0.13 0.00 0.00 3.07 0.87 -1.49 1.56 113.55 117.69 1of9 h SER 33 Ca -0.09 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.45 1of9 h SER 33 Cb 1.44 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.40 1of9 h SER 33 CO 0.15 0.39 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.64 1of9 h LEU 34 N 0.00 0.00 -1.32 2.23 -0.00 -1.30 -3.29 115.31 111.63 1of9 h LEU 34 Ca -0.00 -0.87 -0.03 0.00 -0.00 0.00 0.00 57.88 56.98 1of9 h LEU 34 Cb 0.72 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.38 1of9 h LEU 34 CO 0.05 1.01 -0.14 0.00 -0.00 0.00 0.00 178.44 179.36 1of9 n ASN 36 N -3.31 0.02 -2.55 0.00 2.85 0.53 0.99 115.26 113.79 1of9 n ASN 36 Ca 0.00 1.00 -0.27 0.00 -0.11 0.00 0.00 54.58 55.20 1of9 n ASN 36 Cb 0.37 -0.50 -0.06 0.00 1.24 0.00 0.00 39.78 40.83 1of9 n ASN 36 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1of9 n LYS 37 N -3.93 2.60 0.00 1.20 0.00 -1.13 -4.62 118.16 112.28 1of9 n LYS 37 Ca 0.43 -2.33 0.00 0.00 0.00 0.00 0.00 58.31 56.41 1of9 n LYS 37 Cb 1.91 -2.19 0.00 0.00 0.00 0.00 0.00 35.03 34.75 1of9 n LYS 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1of9 n ALA 38 N 1.15 0.00 -4.21 3.14 0.00 0.28 -4.95 120.51 115.92 1of9 n ALA 38 Ca 0.50 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.62 1of9 n ALA 38 Cb 0.55 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.92 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 0.08 0.00 0.00 7.64 -1.26 -4.71 113.62 115.37 1of9 n SER 39 Ca 0.00 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.71 1of9 n SER 39 Cb 0.00 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 61.74 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 -2.01 2.72 0.13 0.23 0.00 -1.26 -4.87 105.19 100.13 1of9 n GLY 40 Ca -0.17 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 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 0.44 0.00 1.61 3.04 -1.99 -3.11 116.94 116.94 1of9 h PHE 41 Ca 0.00 -0.26 0.00 0.00 3.98 0.00 0.00 57.97 61.69 1of9 h PHE 41 Cb 0.00 -0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.47 1of9 h PHE 41 CO 0.00 1.09 -0.48 -0.89 -2.02 0.00 0.00 178.31 176.01 1of9 n ILE 42 N -3.67 0.05 -0.32 1.41 -0.00 -1.26 -4.30 119.36 111.27 1of9 n ILE 42 Ca -0.05 -0.04 -0.08 0.00 -0.00 0.00 0.00 62.75 62.57 1of9 n ILE 42 Cb 0.85 0.13 -0.08 0.00 -0.00 0.00 0.00 39.64 40.55 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 -1.55 -0.49 0.24 -1.39 0.00 -1.17 0.32 120.51 116.47 1of9 n ALA 43 Ca 0.05 0.65 0.09 0.00 0.00 0.00 0.00 53.44 54.24 1of9 n ALA 43 Cb 0.35 -0.07 0.60 0.00 0.00 0.00 0.00 19.45 20.33 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 0.79 -0.52 0.00 1.03 -1.79 -2.00 112.91 110.42 1of9 h THR 44 Ca 0.12 -0.74 -0.11 0.00 -0.01 0.00 0.00 66.41 65.68 1of9 h THR 44 Cb 0.31 1.44 -0.02 0.00 -1.07 0.00 0.00 68.15 68.82 1of9 h THR 44 CO -0.72 0.18 -0.09 -0.07 -0.01 0.00 0.00 175.52 174.82 1of9 h LEU 45 N 0.00 0.98 -0.03 0.00 3.38 0.50 -1.96 115.31 118.18 1of9 h LEU 45 Ca -0.00 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1of9 h LEU 45 Cb 0.43 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1of9 h LEU 45 CO 0.02 1.10 0.00 0.00 0.09 0.00 0.00 178.44 179.65 1of9 h THR 47 N -0.23 0.59 0.68 0.00 2.02 -1.26 -0.60 112.91 114.11 1of9 h THR 47 Ca 0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1of9 h THR 47 Cb 0.31 0.61 0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1of9 h THR 47 CO 0.00 0.00 -0.33 0.11 0.37 0.00 0.00 175.52 175.67 1of9 h LYS 48 N 0.00 -0.88 -1.03 6.66 1.79 -0.83 0.14 116.57 122.43 1of9 h LYS 48 Ca 0.36 0.06 0.28 0.00 -2.18 0.00 0.00 60.65 59.16 1of9 h LYS 48 Cb 1.46 0.20 -0.12 0.00 -1.58 0.00 0.00 32.23 32.18 1of9 h LYS 48 CO -0.00 -0.58 0.62 0.28 -1.08 0.00 0.00 179.45 178.69 1of9 h VAL 49 N -0.95 0.46 0.68 0.50 2.07 -1.04 0.47 116.25 118.45 1of9 h VAL 49 Ca -0.09 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1of9 h VAL 49 Cb 0.71 -0.04 0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1of9 h VAL 49 CO 0.15 0.09 -0.33 -0.07 0.02 0.00 0.00 177.57 177.43 1of9 h LEU 50 N 0.47 -0.78 -1.39 2.57 3.38 -1.12 1.38 115.31 119.82 1of9 h LEU 50 Ca 0.66 0.01 0.27 0.00 0.09 0.00 0.00 57.88 58.92 1of9 h LEU 50 Cb 1.44 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 42.30 1of9 h LEU 50 CO -0.47 -0.40 0.68 -0.78 0.09 0.00 0.00 178.44 177.56 1of9 h ASP 51 N -1.20 0.42 0.12 -0.43 3.58 0.12 -1.77 116.42 117.25 1of9 h ASP 51 Ca -0.09 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1of9 h ASP 51 Cb 0.72 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.79 1of9 h ASP 51 CO 0.15 0.07 -0.06 0.15 -2.88 0.00 0.00 179.24 176.68 1of9 h PHE 52 N 0.36 -0.15 0.00 0.28 3.57 0.07 -3.50 116.94 117.58 1of9 h PHE 52 Ca 0.60 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.10 1of9 h PHE 52 Cb 1.57 0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.36 1of9 h PHE 52 CO -0.00 0.08 0.00 0.41 -2.23 0.00 0.00 178.31 176.57 1of9 n GLY 53 N 1.27 2.53 0.37 2.40 0.00 0.47 -4.73 105.19 107.51 1of9 n GLY 53 Ca -0.04 -0.63 0.23 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.25 -0.61 5.03 -1.79 1.78 117.51 122.10 1of9 h ILE 54 Ca 0.00 -0.14 -0.10 0.00 -0.12 0.00 0.00 64.86 64.50 1of9 h ILE 54 Cb 0.00 -0.02 -0.01 0.00 -3.03 0.00 0.00 36.82 33.76 1of9 h ILE 54 CO 0.00 0.07 -0.27 0.44 -0.68 0.00 0.00 178.15 177.71 1of9 h ASP 55 N 0.41 0.49 0.36 1.72 5.19 -1.92 -2.55 116.42 120.11 1of9 h ASP 55 Ca 0.67 -0.17 -0.01 0.00 -0.62 0.00 0.00 57.03 56.90 1of9 h ASP 55 Cb 1.57 -0.13 -0.00 0.00 0.18 0.00 0.00 39.33 40.95 1of9 h ASP 55 CO -0.45 0.75 -0.22 0.11 -3.12 0.00 0.00 179.24 176.31 1of9 h LYS 56 N 0.42 -0.53 -0.82 3.56 1.79 0.24 0.50 116.57 121.74 1of9 h LYS 56 Ca 0.06 0.04 0.14 0.00 -2.18 0.00 0.00 60.65 58.71 1of9 h LYS 56 Cb 0.70 0.12 -0.09 0.00 -1.58 0.00 0.00 32.23 31.37 1of9 h LYS 56 CO 0.05 -0.35 0.41 -0.07 -1.08 0.00 0.00 179.45 178.41 1of9 h LEU 57 N -0.55 0.48 -0.78 2.94 3.38 -1.16 0.22 115.31 119.85 1of9 h LEU 57 Ca -0.04 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1of9 h LEU 57 Cb 0.45 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 1of9 h LEU 57 CO 0.04 0.21 0.51 0.40 0.09 0.00 0.00 178.44 179.69 1of9 h ILE 58 N 0.59 1.16 -0.03 1.22 2.04 -0.97 0.75 117.51 122.27 1of9 h ILE 58 Ca 0.44 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.97 1of9 h ILE 58 Cb 0.62 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1of9 h ILE 58 CO -0.36 0.18 0.07 -0.61 0.00 0.00 0.00 178.15 177.44 1of9 h GLN 59 N 1.01 0.00 0.21 2.37 4.15 0.17 -2.38 115.11 120.64 1of9 h GLN 59 Ca 0.30 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.71 1of9 h GLN 59 Cb -0.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.63 1of9 h GLN 59 CO -0.08 0.00 -0.10 -0.07 -1.93 0.00 0.00 178.83 176.64 1of9 h LEU 60 N 0.00 -0.24 -1.46 -2.39 3.38 -0.22 -3.22 115.31 111.16 1of9 h LEU 60 Ca 0.02 -0.04 0.47 0.00 0.09 0.00 0.00 57.88 58.42 1of9 h LEU 60 Cb 0.16 0.06 -0.11 0.00 0.09 0.00 0.00 40.66 40.86 1of9 h LEU 60 CO -0.00 0.24 0.98 0.00 0.09 0.00 0.00 178.44 179.75 1of9 n ILE 61 N -4.96 -0.16 -0.04 1.22 3.06 -0.91 0.19 119.36 117.75 1of9 n ILE 61 Ca -0.04 1.60 -0.08 0.00 -2.50 0.00 0.00 62.75 61.72 1of9 n ILE 61 Cb 0.14 -2.63 -0.02 0.00 0.54 0.00 0.00 39.64 37.67 1of9 n ILE 61 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 1of9 h GLU 62 N 0.00 -0.13 0.50 9.51 4.39 -1.52 -3.09 114.58 124.25 1of9 h GLU 62 Ca 0.84 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 60.52 1of9 h GLU 62 Cb 2.92 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 31.60 1of9 h GLU 62 CO -0.31 -0.08 -0.24 0.38 -1.16 0.00 0.00 179.01 177.60 1of9 h ASP 63 N -0.13 -0.57 0.00 1.42 2.03 0.20 -3.47 116.42 115.89 1of9 h ASP 63 Ca 0.12 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 1of9 h ASP 63 Cb 0.31 0.15 0.00 0.00 -0.83 0.00 0.00 39.33 38.96 1of9 h ASP 63 CO -0.29 -0.20 0.00 0.29 -1.03 0.00 0.00 179.24 178.01 1of9 n LYS 64 N -4.99 0.00 -3.47 4.15 5.02 -0.71 -5.13 118.16 113.04 1of9 n LYS 64 Ca -0.08 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.93 1of9 n LYS 64 Cb 0.27 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.15 1of9 n LYS 64 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1of9 s VAL 65 N 0.00 0.01 0.95 -0.18 1.01 -1.25 -4.91 120.40 116.03 1of9 s VAL 65 Ca 0.00 -1.34 -0.13 0.00 0.00 0.00 0.00 61.98 60.52 1of9 s VAL 65 Cb 0.00 -1.03 0.14 0.00 0.00 0.00 0.00 36.38 35.49 1of9 s VAL 65 CO 0.00 -0.86 0.21 0.47 0.00 0.00 0.00 175.10 174.91 1of9 n ASP 66 N 4.43 -2.87 -0.16 3.32 8.00 -1.26 -4.22 116.55 123.78 1of9 n ASP 66 Ca 0.07 -0.32 -0.08 0.00 0.71 0.00 0.00 54.79 55.16 1of9 n ASP 66 Cb 0.39 -0.73 0.01 0.00 -0.02 0.00 0.00 41.12 40.77 1of9 n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1of9 h ALA 67 N -2.53 0.60 0.88 2.24 0.00 -1.95 -1.16 119.26 117.34 1of9 h ALA 67 Ca -0.23 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1of9 h ALA 67 Cb 0.72 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1of9 h ALA 67 CO 0.15 0.19 -0.43 -0.97 0.00 0.00 0.00 179.25 178.18 1of9 h ASN 68 N 0.61 -1.03 -1.16 0.00 -1.24 -1.88 0.55 115.58 111.43 1of9 h ASN 68 Ca 0.16 0.04 0.33 0.00 0.71 0.00 0.00 56.30 57.53 1of9 h ASN 68 Cb 0.15 0.27 -0.07 0.00 0.73 0.00 0.00 38.32 39.41 1of9 h ASN 68 CO -0.02 -0.73 0.80 0.00 -1.29 0.00 0.00 177.43 176.20 1of9 h ALA 69 N -1.08 2.83 0.05 1.57 0.00 -1.84 1.82 119.26 122.62 1of9 h ALA 69 Ca -0.12 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.56 1of9 h ALA 69 Cb 0.92 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1of9 h ALA 69 CO 0.19 -1.21 -1.06 0.82 0.00 0.00 0.00 179.25 178.00 1of9 h ILE 70 N 0.13 1.53 -0.34 0.00 1.08 -0.27 -2.91 117.51 116.73 1of9 h ILE 70 Ca 0.59 -2.93 0.00 0.00 -0.39 0.00 0.00 64.86 62.13 1of9 h ILE 70 Cb 2.06 2.73 0.00 0.00 -3.07 0.00 0.00 36.82 38.54 1of9 h ILE 70 CO -0.12 0.85 0.00 0.00 -0.69 0.00 0.00 178.15 178.19 1of9 n ALA 72 N 0.47 1.76 0.25 0.00 0.00 0.20 -2.64 120.51 120.56 1of9 n ALA 72 Ca 0.14 -0.74 -0.17 0.00 0.00 0.00 0.00 53.44 52.66 1of9 n ALA 72 Cb 0.53 0.23 -0.09 0.00 0.00 0.00 0.00 19.45 20.12 1of9 n ALA 72 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1of9 h LYS 73 N -0.53 -0.85 0.00 0.00 3.11 -1.62 0.27 116.57 116.95 1of9 h LYS 73 Ca -0.46 0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.44 1of9 h LYS 73 Cb 1.45 0.19 0.00 0.00 -1.00 0.00 0.00 32.23 32.88 1of9 h LYS 73 CO -0.24 -0.57 0.00 -0.89 -2.81 0.00 0.00 179.45 174.94 1of9 n ILE 74 N -5.52 1.75 -1.47 2.00 2.08 -1.25 -4.77 119.36 112.17 1of9 n ILE 74 Ca -0.11 0.44 -0.15 0.00 0.56 0.00 0.00 62.75 63.49 1of9 n ILE 74 Cb 0.42 -1.39 -0.06 0.00 -0.75 0.00 0.00 39.64 37.87 1of9 n ILE 74 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 1of9 n HIS 75 N -1.48 -0.03 0.00 1.39 -0.00 0.97 -4.86 115.22 111.20 1of9 n HIS 75 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1of9 n HIS 75 Cb 0.03 -2.65 0.00 0.00 -0.00 0.00 0.00 29.99 27.37 1of9 n HIS 75 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1of9 n ALA 76 N 1.13 0.00 0.00 1.57 0.00 -1.08 -4.96 120.51 117.17 1of9 n ALA 76 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1of9 n ALA 76 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1of9 n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50