#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 0.28 -0.34 1.61 0.00 -1.26 -4.95 120.64 115.98 1of9 n GLU 2 Ca 0.00 -0.93 0.16 0.00 0.00 0.00 0.00 57.16 56.38 1of9 n GLU 2 Cb 0.00 -0.49 0.30 0.00 0.00 0.00 0.00 31.44 31.25 1of9 n GLU 2 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1of9 n ILE 3 N 1.45 -0.41 -2.17 3.84 2.08 -1.26 -3.65 119.36 119.24 1of9 n ILE 3 Ca 0.03 2.13 -0.03 0.00 0.56 0.00 0.00 62.75 65.44 1of9 n ILE 3 Cb 0.69 -3.14 0.01 0.00 -0.75 0.00 0.00 39.64 36.46 1of9 n ILE 3 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1of9 n LEU 4 N -5.44 -0.83 0.00 1.39 4.32 -1.26 -4.97 117.00 110.21 1of9 n LEU 4 Ca 0.24 -1.87 0.00 0.00 -0.02 0.00 0.00 56.01 54.36 1of9 n LEU 4 Cb 0.78 0.16 0.00 0.00 -1.62 0.00 0.00 43.42 42.74 1of9 n LEU 4 CO -0.07 1.32 0.21 0.00 -1.22 0.00 0.00 177.39 177.64 1of9 h ASN 6 N 0.00 0.00 0.00 0.00 -0.73 -1.84 -2.42 115.58 110.60 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 0.18 -0.37 0.00 0.00 177.43 177.24 1of9 n LEU 7 N -2.88 0.53 0.00 0.34 4.32 -1.20 -0.83 117.00 117.29 1of9 n LEU 7 Ca -0.02 0.20 0.00 0.00 -0.02 0.00 0.00 56.01 56.17 1of9 n LEU 7 Cb 0.26 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.06 1of9 n LEU 7 CO 0.15 0.00 0.39 0.00 -1.22 0.00 0.00 177.39 176.71 1of9 h THR 9 N 0.00 0.04 -0.00 0.00 1.03 -1.63 1.93 112.91 114.27 1of9 h THR 9 Ca 0.00 0.00 -0.18 0.00 -0.01 0.00 0.00 66.41 66.22 1of9 h THR 9 Cb 0.00 0.10 0.01 0.00 -1.07 0.00 0.00 68.15 67.19 1of9 h THR 9 CO 0.00 0.00 -0.68 1.23 -0.01 0.00 0.00 175.52 176.06 1of9 h GLY 10 N 0.00 0.52 2.00 2.99 0.00 0.35 -2.66 103.07 106.27 1of9 h GLY 10 Ca 0.33 -0.91 -0.05 0.00 0.00 0.00 0.00 47.33 46.70 1of9 h GLY 10 CO -0.00 0.81 -0.22 0.17 0.00 0.00 0.00 176.54 177.29 1of9 h LEU 11 N -0.00 0.00 0.49 3.11 8.10 0.63 -2.78 115.31 124.85 1of9 h LEU 11 Ca -0.08 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.88 1of9 h LEU 11 Cb 1.38 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.61 1of9 h LEU 11 CO 0.13 0.22 -0.24 0.40 -4.11 0.00 0.00 178.44 174.85 1of9 h ILE 12 N 0.00 0.35 -0.93 0.15 1.08 -0.15 0.18 117.51 118.18 1of9 h ILE 12 Ca -0.00 -0.46 0.03 0.00 -0.39 0.00 0.00 64.86 64.04 1of9 h ILE 12 Cb 1.15 0.50 -0.05 0.00 -3.07 0.00 0.00 36.82 35.34 1of9 h ILE 12 CO 0.03 0.06 0.61 0.78 -0.69 0.00 0.00 178.15 178.93 1of9 h ASN 13 N -0.99 1.02 0.57 1.72 4.21 -1.55 0.30 115.58 120.85 1of9 h ASN 13 Ca -0.07 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.43 1of9 h ASN 13 Cb 0.60 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.56 1of9 h ASN 13 CO 0.11 0.70 0.00 1.07 -1.29 0.00 0.00 177.43 178.02 1of9 n THR 14 N -4.49 0.60 0.06 2.81 5.66 -1.05 -1.93 114.28 115.95 1of9 n THR 14 Ca 0.12 0.15 0.08 0.00 -3.05 0.00 0.00 64.05 61.35 1of9 n THR 14 Cb 0.08 -0.82 -0.05 0.00 -1.55 0.00 0.00 70.33 67.99 1of9 n THR 14 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1of9 n LEU 15 N -1.44 0.71 0.33 1.09 4.32 0.95 -3.35 117.00 119.61 1of9 n LEU 15 Ca 0.06 0.29 0.22 0.00 -0.02 0.00 0.00 56.01 56.56 1of9 n LEU 15 Cb 0.20 0.00 1.16 0.00 -1.62 0.00 0.00 43.42 43.17 1of9 n LEU 15 CO 0.17 -0.05 1.17 -0.33 -1.22 0.00 0.00 177.39 177.13 1of9 h GLU 16 N 0.00 0.00 -0.01 3.23 5.08 -0.62 0.10 114.58 122.37 1of9 h GLU 16 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1of9 h GLU 16 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1of9 h GLU 16 CO 0.01 0.00 -0.07 -1.71 -1.00 0.00 0.00 179.01 176.25 1of9 n ASN 17 N -3.13 1.42 0.00 1.42 5.15 -1.25 -4.53 115.26 114.33 1of9 n ASN 17 Ca -0.03 -1.21 0.00 0.00 -0.60 0.00 0.00 54.58 52.75 1of9 n ASN 17 Cb 0.09 0.19 0.00 0.00 -0.53 0.00 0.00 39.78 39.54 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 0.14 0.00 -0.12 1.20 7.94 0.35 -4.49 117.00 122.01 1of9 n LEU 18 Ca 0.04 0.08 -0.24 0.00 -1.11 0.00 0.00 56.01 54.78 1of9 n LEU 18 Cb 0.18 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.02 1of9 n LEU 18 CO 0.07 0.00 -1.30 0.18 -1.11 0.00 0.00 177.39 175.23 1of9 n LEU 19 N -0.14 2.38 -2.44 -1.96 7.99 -1.26 -5.00 117.00 116.57 1of9 n LEU 19 Ca 0.00 0.16 0.00 0.00 -0.01 0.00 0.00 56.01 56.16 1of9 n LEU 19 Cb 0.00 -0.89 0.00 0.00 -0.11 0.00 0.00 43.42 42.42 1of9 n LEU 19 CO 0.00 0.71 -0.28 1.07 -1.51 0.00 0.00 177.39 177.38 1of9 n THR 20 N -3.84 -1.30 -0.08 -5.08 5.66 -1.26 -1.96 114.28 106.43 1of9 n THR 20 Ca -0.48 0.28 0.00 0.00 -3.05 0.00 0.00 64.05 60.80 1of9 n THR 20 Cb 0.92 -2.13 0.00 0.00 -1.55 0.00 0.00 70.33 67.57 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 1.35 0.00 -0.02 1.09 5.66 -1.26 -4.82 114.28 116.27 1of9 n THR 21 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 1of9 n THR 21 Cb 0.28 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 68.92 1of9 n THR 21 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1of9 n LYS 22 N -2.00 0.72 0.00 1.09 4.76 -0.83 -5.02 118.16 116.89 1of9 n LYS 22 Ca 0.00 0.31 0.00 0.00 -2.87 0.00 0.00 58.31 55.75 1of9 n LYS 22 Cb 0.00 -1.70 0.00 0.00 -1.84 0.00 0.00 35.03 31.49 1of9 n LYS 22 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1of9 n GLY 23 N 1.91 1.69 0.00 0.72 0.00 -1.26 -4.98 105.19 103.26 1of9 n GLY 23 Ca -0.33 0.27 0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 1.51 0.02 4.61 0.00 -1.26 -1.67 120.51 123.72 1of9 n ALA 24 Ca 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 53.44 53.26 1of9 n ALA 24 Cb 0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 19.45 18.24 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 0.74 0.59 0.00 5.19 -2.00 -2.78 116.42 118.16 1of9 h ASP 25 Ca 0.00 -0.51 0.00 0.00 -0.62 0.00 0.00 57.03 55.90 1of9 h ASP 25 Cb 0.18 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.47 1of9 h ASP 25 CO 0.00 1.29 0.00 0.50 -3.12 0.00 0.00 179.24 177.91 1of9 h LYS 26 N 0.41 0.00 0.31 3.56 1.63 -1.70 -2.71 116.57 118.06 1of9 h LYS 26 Ca -0.06 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1of9 h LYS 26 Cb 1.42 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 33.05 1of9 h LYS 26 CO 0.15 0.00 -0.17 -0.24 -3.45 0.00 0.00 179.45 175.74 1of9 h VAL 27 N 0.00 0.65 -0.27 2.00 3.04 -1.55 -0.39 116.25 119.73 1of9 h VAL 27 Ca 0.00 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.77 1of9 h VAL 27 Cb 0.29 0.65 -0.01 0.00 -2.01 0.00 0.00 31.29 30.21 1of9 h VAL 27 CO 0.00 0.00 0.36 0.50 -1.01 0.00 0.00 177.57 177.42 1of9 h LYS 28 N -0.45 0.00 -0.35 4.17 3.11 -1.58 0.74 116.57 122.21 1of9 h LYS 28 Ca -0.04 0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.70 1of9 h LYS 28 Cb 0.36 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.58 1of9 h LYS 28 CO 0.05 0.00 -0.20 0.22 -2.81 0.00 0.00 179.45 176.71 1of9 h ASP 29 N 0.00 0.67 0.68 4.20 3.58 -1.12 -1.99 116.42 122.44 1of9 h ASP 29 Ca 0.13 -0.23 -0.26 0.00 0.42 0.00 0.00 57.03 57.09 1of9 h ASP 29 Cb 0.84 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 41.67 1of9 h ASP 29 CO -0.00 0.87 -1.42 0.22 -2.88 0.00 0.00 179.24 176.04 1of9 h TYR 30 N 0.60 0.05 0.00 0.28 5.03 0.62 -3.25 116.97 120.29 1of9 h TYR 30 Ca 0.09 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.37 1of9 h TYR 30 Cb 0.67 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.95 1of9 h TYR 30 CO 0.03 1.05 0.00 0.82 -1.32 0.00 0.00 178.16 178.74 1of9 h ILE 31 N 0.01 0.00 0.06 1.81 2.04 -0.57 -2.70 117.51 118.16 1of9 h ILE 31 Ca -0.17 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1of9 h ILE 31 Cb 1.92 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1of9 h ILE 31 CO 0.11 0.00 -0.03 0.28 0.00 0.00 0.00 178.15 178.51 1of9 h SER 32 N 0.00 -0.07 -0.85 1.72 0.02 -1.40 0.50 113.55 113.48 1of9 h SER 32 Ca 0.00 -0.47 -0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1of9 h SER 32 Cb 0.34 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.86 1of9 h SER 32 CO 0.00 0.46 0.52 -1.28 -1.14 0.00 0.00 176.83 175.39 1of9 h SER 33 N -0.62 1.02 -0.17 3.07 0.87 -1.64 0.68 113.55 116.76 1of9 h SER 33 Ca -0.01 -0.06 -0.06 0.00 -1.23 0.00 0.00 61.79 60.43 1of9 h SER 33 Cb 0.53 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.23 1of9 h SER 33 CO 0.01 0.78 -0.14 -0.07 -0.53 0.00 0.00 176.83 176.89 1of9 h LEU 34 N 1.17 0.41 -0.61 2.23 -0.00 -1.50 -3.06 115.31 113.96 1of9 h LEU 34 Ca 0.31 -0.46 0.01 0.00 -0.00 0.00 0.00 57.88 57.74 1of9 h LEU 34 Cb -0.05 -0.12 -0.03 0.00 -0.00 0.00 0.00 40.66 40.46 1of9 h LEU 34 CO -0.06 0.79 0.40 0.00 -0.00 0.00 0.00 178.44 179.57 1of9 h ASN 36 N 0.80 0.00 -1.26 0.00 -1.24 0.47 0.38 115.58 114.73 1of9 h ASN 36 Ca 0.23 0.00 -0.61 0.00 0.71 0.00 0.00 56.30 56.63 1of9 h ASN 36 Cb -0.06 0.00 -0.18 0.00 0.73 0.00 0.00 38.32 38.81 1of9 h ASN 36 CO -0.07 0.00 1.00 1.17 -1.29 0.00 0.00 177.43 178.25 1of9 n LYS 37 N -3.65 3.16 0.00 6.67 4.81 -0.05 -4.60 118.16 124.50 1of9 n LYS 37 Ca 0.28 -2.89 0.00 0.00 -0.87 0.00 0.00 58.31 54.83 1of9 n LYS 37 Cb 1.52 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 34.27 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 0.87 0.00 -4.24 3.14 0.00 0.14 -4.98 120.51 115.43 1of9 n ALA 38 Ca 0.53 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.61 1of9 n ALA 38 Cb 0.42 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.79 1of9 n ALA 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1of9 n SER 39 N 0.00 -0.83 0.00 0.00 2.88 -1.26 -4.73 113.62 109.68 1of9 n SER 39 Ca 0.00 -1.15 0.00 0.00 -1.33 0.00 0.00 58.87 56.39 1of9 n SER 39 Cb 0.00 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.00 1of9 n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1of9 n GLY 40 N -1.49 4.13 0.18 0.46 0.00 -1.26 -4.87 105.19 102.35 1of9 n GLY 40 Ca -0.03 -0.39 0.04 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 0.00 1.61 3.04 -2.00 -2.30 116.94 117.29 1of9 h PHE 41 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1of9 h PHE 41 Cb 0.00 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.51 1of9 h PHE 41 CO 0.00 0.40 -0.64 -0.89 -2.02 0.00 0.00 178.31 175.17 1of9 n ILE 42 N -3.78 0.13 -0.34 1.41 -0.00 -1.26 -4.32 119.36 111.19 1of9 n ILE 42 Ca -0.01 -0.12 -0.09 0.00 -0.00 0.00 0.00 62.75 62.53 1of9 n ILE 42 Cb 0.47 0.15 -0.08 0.00 -0.00 0.00 0.00 39.64 40.18 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 -1.65 -0.52 0.23 -1.39 0.00 -0.87 0.35 120.51 116.67 1of9 n ALA 43 Ca 0.04 0.69 0.09 0.00 0.00 0.00 0.00 53.44 54.26 1of9 n ALA 43 Cb 0.38 -0.11 0.57 0.00 0.00 0.00 0.00 19.45 20.29 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 0.81 -0.37 0.00 1.03 -1.76 -1.71 112.91 110.91 1of9 h THR 44 Ca 0.13 -0.81 -0.09 0.00 -0.01 0.00 0.00 66.41 65.63 1of9 h THR 44 Cb 0.33 1.48 -0.01 0.00 -1.07 0.00 0.00 68.15 68.88 1of9 h THR 44 CO -0.76 0.20 -0.12 -0.07 -0.01 0.00 0.00 175.52 174.76 1of9 h LEU 45 N 0.00 0.75 0.49 0.00 3.38 0.59 -1.59 115.31 118.93 1of9 h LEU 45 Ca -0.00 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1of9 h LEU 45 Cb 0.47 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1of9 h LEU 45 CO 0.03 0.96 -0.24 0.00 0.09 0.00 0.00 178.44 179.27 1of9 h THR 47 N -0.91 0.12 0.30 0.00 2.02 -1.33 0.11 112.91 113.23 1of9 h THR 47 Ca -0.07 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1of9 h THR 47 Cb 0.60 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1of9 h THR 47 CO 0.11 0.00 -0.15 0.50 0.37 0.00 0.00 175.52 176.36 1of9 h LYS 48 N 0.00 -0.39 -0.96 6.66 3.11 -0.65 0.15 116.57 124.48 1of9 h LYS 48 Ca 0.09 0.03 0.14 0.00 -2.81 0.00 0.00 60.65 58.09 1of9 h LYS 48 Cb 1.05 0.09 -0.08 0.00 -1.00 0.00 0.00 32.23 32.29 1of9 h LYS 48 CO -0.00 -0.10 0.61 0.28 -2.81 0.00 0.00 179.45 177.43 1of9 h VAL 49 N -0.68 0.87 0.22 2.00 2.07 -0.67 0.37 116.25 120.42 1of9 h VAL 49 Ca -0.04 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1of9 h VAL 49 Cb 0.47 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1of9 h VAL 49 CO 0.07 0.16 -0.11 -0.07 0.02 0.00 0.00 177.57 177.64 1of9 h LEU 50 N 0.86 -0.25 -1.21 2.57 3.38 -1.24 1.72 115.31 121.14 1of9 h LEU 50 Ca 0.49 -0.15 0.11 0.00 0.09 0.00 0.00 57.88 58.41 1of9 h LEU 50 Cb 0.61 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 1of9 h LEU 50 CO -0.25 0.02 0.58 0.44 0.09 0.00 0.00 178.44 179.31 1of9 h ASP 51 N -0.52 0.77 0.05 -0.43 5.19 0.54 -2.52 116.42 119.50 1of9 h ASP 51 Ca -0.03 0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1of9 h ASP 51 Cb 0.39 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.77 1of9 h ASP 51 CO 0.05 0.43 -0.03 0.15 -3.12 0.00 0.00 179.24 176.73 1of9 h PHE 52 N 0.84 -0.07 0.00 4.55 3.57 0.00 -3.50 116.94 122.33 1of9 h PHE 52 Ca 0.43 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.93 1of9 h PHE 52 Cb 0.50 0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.26 1of9 h PHE 52 CO -0.00 0.55 0.00 0.41 -2.23 0.00 0.00 178.31 177.04 1of9 n GLY 53 N 1.02 2.52 0.38 2.40 0.00 0.58 -4.75 105.19 107.34 1of9 n GLY 53 Ca -0.08 -0.76 0.26 0.00 0.00 0.00 0.00 46.02 45.43 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 0.34 -1.00 -0.61 5.03 -1.79 1.66 117.51 121.13 1of9 h ILE 54 Ca 0.00 -0.11 0.05 0.00 -0.12 0.00 0.00 64.86 64.68 1of9 h ILE 54 Cb 0.00 -0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 33.72 1of9 h ILE 54 CO 0.00 0.06 0.65 0.44 -0.68 0.00 0.00 178.15 178.62 1of9 h ASP 55 N 0.31 1.07 0.80 1.72 5.19 -1.90 -2.00 116.42 121.60 1of9 h ASP 55 Ca 0.71 -0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 57.08 1of9 h ASP 55 Cb 1.79 -0.23 0.01 0.00 0.18 0.00 0.00 39.33 41.07 1of9 h ASP 55 CO -0.48 0.71 -0.38 0.11 -3.12 0.00 0.00 179.24 176.08 1of9 h LYS 56 N 1.23 -1.03 -1.12 3.56 6.56 0.21 -0.64 116.57 125.34 1of9 h LYS 56 Ca 0.42 0.07 0.43 0.00 -1.06 0.00 0.00 60.65 60.51 1of9 h LYS 56 Cb 0.08 0.23 -0.16 0.00 -0.57 0.00 0.00 32.23 31.81 1of9 h LYS 56 CO -0.15 -0.68 0.66 -0.07 -2.06 0.00 0.00 179.45 177.15 1of9 h LEU 57 N -1.24 0.29 0.52 2.94 4.07 -1.03 0.56 115.31 121.43 1of9 h LEU 57 Ca -0.11 0.22 -0.03 0.00 0.08 0.00 0.00 57.88 58.05 1of9 h LEU 57 Cb 0.83 0.22 0.01 0.00 1.08 0.00 0.00 40.66 42.80 1of9 h LEU 57 CO 0.18 -0.36 -0.25 0.40 -1.08 0.00 0.00 178.44 177.33 1of9 h ILE 58 N 0.03 0.00 -0.91 1.22 2.04 -0.99 -2.66 117.51 116.23 1of9 h ILE 58 Ca 0.85 -0.37 0.25 0.00 1.00 0.00 0.00 64.86 66.60 1of9 h ILE 58 Cb 2.40 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 38.34 1of9 h ILE 58 CO -0.66 0.00 0.35 1.56 0.00 0.00 0.00 178.15 179.41 1of9 h GLN 59 N -1.06 0.27 -0.24 2.37 4.20 0.13 0.41 115.11 121.19 1of9 h GLN 59 Ca -0.07 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.68 1of9 h GLN 59 Cb 0.54 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.20 1of9 h GLN 59 CO 0.12 0.18 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.28 1of9 h LEU 60 N 0.28 -0.36 -0.60 1.46 3.38 -0.09 0.19 115.31 119.57 1of9 h LEU 60 Ca 0.60 0.09 0.11 0.00 0.09 0.00 0.00 57.88 58.77 1of9 h LEU 60 Cb 1.24 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 42.10 1of9 h LEU 60 CO -0.62 -0.14 0.11 -0.29 0.09 0.00 0.00 178.44 177.59 1of9 h ILE 61 N -0.07 0.62 -0.73 1.22 2.10 0.16 0.47 117.51 121.27 1of9 h ILE 61 Ca 0.12 -0.08 -0.01 0.00 1.08 0.00 0.00 64.86 65.97 1of9 h ILE 61 Cb 0.26 0.36 -0.04 0.00 -1.09 0.00 0.00 36.82 36.32 1of9 h ILE 61 CO -0.28 0.04 0.41 -0.33 -1.08 0.00 0.00 178.15 176.91 1of9 h GLU 62 N 0.23 1.00 0.66 2.19 4.39 -0.42 -3.04 114.58 119.60 1of9 h GLU 62 Ca 0.31 -0.10 -0.03 0.00 0.34 0.00 0.00 59.36 59.88 1of9 h GLU 62 Cb 0.48 -0.20 0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1of9 h GLU 62 CO -0.42 0.73 -0.32 0.22 -1.16 0.00 0.00 179.01 178.06 1of9 h ASP 63 N 1.01 -0.75 0.00 1.42 1.82 0.24 -3.47 116.42 116.69 1of9 h ASP 63 Ca 0.26 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.93 1of9 h ASP 63 Cb 0.01 0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.21 1of9 h ASP 63 CO -0.04 -0.41 0.00 0.29 -1.61 0.00 0.00 179.24 177.46 1of9 n LYS 64 N -5.09 0.00 -3.95 0.28 5.02 0.13 -5.09 118.16 109.46 1of9 n LYS 64 Ca -0.11 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.87 1of9 n LYS 64 Cb 0.35 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 35.21 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 2.10 0.96 -0.18 1.01 -0.29 -4.96 120.40 119.05 1of9 s VAL 65 Ca 0.00 -2.44 -0.13 0.00 0.00 0.00 0.00 61.98 59.41 1of9 s VAL 65 Cb 0.00 -2.53 0.14 0.00 0.00 0.00 0.00 36.38 33.99 1of9 s VAL 65 CO 0.00 -0.67 0.22 0.47 0.00 0.00 0.00 175.10 175.12 1of9 n ASP 66 N 4.04 -2.90 -0.15 3.32 8.00 -1.26 -3.40 116.55 124.20 1of9 n ASP 66 Ca 0.04 -0.33 -0.11 0.00 0.71 0.00 0.00 54.79 55.09 1of9 n ASP 66 Cb 0.39 -0.74 -0.01 0.00 -0.02 0.00 0.00 41.12 40.75 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 -2.55 0.63 -0.02 2.24 0.00 -1.95 0.73 119.26 118.34 1of9 h ALA 67 Ca -0.24 -0.35 -0.21 0.00 0.00 0.00 0.00 54.91 54.11 1of9 h ALA 67 Cb 0.74 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.38 1of9 h ALA 67 CO 0.15 0.55 -0.80 -0.91 0.00 0.00 0.00 179.25 178.24 1of9 h ASN 68 N 0.73 0.74 -0.98 0.00 2.35 -1.89 0.45 115.58 116.98 1of9 h ASN 68 Ca 0.11 -0.73 0.04 0.00 -0.55 0.00 0.00 56.30 55.17 1of9 h ASN 68 Cb 0.70 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.79 1of9 h ASN 68 CO 0.05 1.37 0.64 0.00 -1.65 0.00 0.00 177.43 177.85 1of9 h ALA 69 N 0.38 1.38 0.00 -0.83 0.00 -1.85 0.57 119.26 118.92 1of9 h ALA 69 Ca -0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1of9 h ALA 69 Cb 1.48 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1of9 h ALA 69 CO 0.16 0.51 -0.00 0.97 0.00 0.00 0.00 179.25 180.89 1of9 h ILE 70 N 1.22 1.54 0.00 0.00 -0.00 -0.83 -2.79 117.51 116.64 1of9 h ILE 70 Ca 0.40 -1.61 0.00 0.00 -0.00 0.00 0.00 64.86 63.65 1of9 h ILE 70 Cb 0.04 2.64 0.00 0.00 -0.00 0.00 0.00 36.82 39.50 1of9 h ILE 70 CO -0.13 0.42 0.01 0.00 -0.00 0.00 0.00 178.15 178.44 1of9 h ALA 72 N 1.98 0.05 0.00 0.00 0.00 0.38 1.90 119.26 123.57 1of9 h ALA 72 Ca 0.00 -0.59 0.01 0.00 0.00 0.00 0.00 54.91 54.33 1of9 h ALA 72 Cb 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1of9 h ALA 72 CO 0.00 0.35 -0.16 -0.22 0.00 0.00 0.00 179.25 179.23 1of9 h LYS 73 N -0.14 -0.19 0.00 0.00 3.64 -0.64 0.55 116.57 119.79 1of9 h LYS 73 Ca -0.08 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1of9 h LYS 73 Cb 1.36 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.22 1of9 h LYS 73 CO 0.12 -0.13 0.00 0.44 -2.27 0.00 0.00 179.45 177.62 1of9 n ILE 74 N -3.36 0.33 -0.98 2.00 -0.00 -1.18 -4.74 119.36 111.43 1of9 n ILE 74 Ca -0.02 0.08 0.00 0.00 -0.00 0.00 0.00 62.75 62.81 1of9 n ILE 74 Cb 0.11 -0.96 0.00 0.00 -0.00 0.00 0.00 39.64 38.79 1of9 n ILE 74 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.55 178.12 1of9 n HIS 75 N -1.11 0.00 0.21 4.28 -0.00 0.19 -4.80 115.22 113.99 1of9 n HIS 75 Ca 0.05 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.88 1of9 n HIS 75 Cb 0.04 -1.11 0.57 0.00 -0.00 0.00 0.00 29.99 29.49 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 1.00 1.16 -0.03 1.57 0.00 0.53 -4.88 120.51 119.86 1of9 n ALA 76 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1of9 n ALA 76 Cb 0.26 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1of9 n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50