#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2v h LYS 34 N 0.00 0.00 0.02 5.31 1.63 -2.07 -3.22 116.57 118.23 1h2v h LYS 34 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1h2v h LYS 34 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1h2v h LYS 34 CO 0.00 0.67 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.59 1h2v h LEU 35 N 0.00 -0.02 -1.95 5.20 3.38 -2.01 -3.28 115.31 116.64 1h2v h LEU 35 Ca -0.01 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.22 1h2v h LEU 35 Cb 1.30 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1h2v h LEU 35 CO 0.09 0.78 0.34 -0.07 0.09 0.00 0.00 178.44 179.66 1h2v h LEU 36 N -0.86 0.00 -0.15 1.67 3.38 -1.90 -0.43 115.31 117.02 1h2v h LEU 36 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h2v h LEU 36 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1h2v h LEU 36 CO 0.00 0.00 -0.25 0.29 0.09 0.00 0.00 178.44 178.57 1h2v n LYS 37 N -2.86 0.35 -0.00 1.13 5.02 -1.22 -3.90 118.16 116.68 1h2v n LYS 37 Ca -0.02 -0.15 0.02 0.00 -2.02 0.00 0.00 58.31 56.14 1h2v n LYS 37 Cb 0.38 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.87 1h2v n LYS 37 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1h2v n LYS 38 N -1.19 3.10 -1.68 1.97 4.01 -0.20 -5.06 118.16 119.11 1h2v n LYS 38 Ca 0.10 -0.02 -0.36 0.00 -0.51 0.00 0.00 58.31 57.52 1h2v n LYS 38 Cb 0.32 -0.88 0.07 0.00 -0.51 0.00 0.00 35.03 34.03 1h2v n LYS 38 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1h2v s SER 39 N -1.90 4.52 -0.09 4.39 0.15 -1.03 -4.90 113.70 114.83 1h2v s SER 39 Ca 0.00 2.55 0.13 0.00 0.70 0.00 0.00 55.95 59.33 1h2v s SER 39 Cb 0.03 -2.61 0.20 0.00 -1.71 0.00 0.00 66.02 61.93 1h2v s SER 39 CO 0.18 -2.06 1.09 0.00 1.20 0.00 0.00 173.24 173.65 1h2v s THR 41 N -2.16 2.68 0.01 0.00 2.01 -1.26 -0.85 115.64 116.07 1h2v s THR 41 Ca 0.22 -0.83 0.07 0.00 0.31 0.00 0.00 61.69 61.47 1h2v s THR 41 Cb 0.19 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 1h2v s THR 41 CO 0.02 0.56 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.53 1h2v s LEU 42 N -0.08 2.36 -0.21 4.42 1.43 0.40 -1.58 118.68 125.43 1h2v s LEU 42 Ca -0.04 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.50 1h2v s LEU 42 Cb -0.14 -1.41 -0.05 0.00 0.03 0.00 0.00 46.19 44.62 1h2v s LEU 42 CO 0.04 0.29 0.17 -0.47 0.23 0.00 0.00 176.35 176.61 1h2v s TYR 43 N -0.79 3.39 -0.15 0.29 5.04 -0.26 -0.90 117.35 123.97 1h2v s TYR 43 Ca 0.12 0.35 -0.00 0.00 -2.44 0.00 0.00 57.07 55.10 1h2v s TYR 43 Cb -0.10 -2.23 -0.01 0.00 0.35 0.00 0.00 41.96 39.97 1h2v s TYR 43 CO 0.02 0.21 -0.13 0.08 -1.34 0.00 0.00 175.55 174.39 1h2v s VAL 44 N 0.59 2.89 0.40 3.14 1.01 0.15 -1.57 120.40 127.01 1h2v s VAL 44 Ca 0.09 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.43 1h2v s VAL 44 Cb -0.12 -2.23 -0.07 0.00 0.00 0.00 0.00 36.38 33.96 1h2v s VAL 44 CO 0.01 0.51 0.02 -0.83 0.00 0.00 0.00 175.10 174.81 1h2v s GLY 45 N 0.69 2.49 -0.93 4.51 0.00 0.44 -1.67 107.32 112.85 1h2v s GLY 45 Ca -0.06 -2.04 0.00 0.00 0.00 0.00 0.00 44.72 42.62 1h2v s GLY 45 CO 0.02 -2.05 0.00 -2.01 0.00 0.00 0.00 173.10 169.06 1h2v n ASN 46 N -0.96 -3.98 -4.77 1.64 5.15 -1.07 -2.09 115.26 109.19 1h2v n ASN 46 Ca -0.06 0.20 -0.37 0.00 -0.60 0.00 0.00 54.58 53.75 1h2v n ASN 46 Cb 0.67 -2.37 -0.00 0.00 -0.53 0.00 0.00 39.78 37.55 1h2v n ASN 46 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1h2v s LEU 47 N -2.09 3.97 0.71 1.20 1.43 -0.84 -4.78 118.68 118.28 1h2v s LEU 47 Ca 0.00 2.34 -0.12 0.00 -1.03 0.00 0.00 54.13 55.32 1h2v s LEU 47 Cb 0.00 -4.28 0.02 0.00 0.03 0.00 0.00 46.19 41.96 1h2v s LEU 47 CO 0.00 -1.02 1.08 -0.94 0.23 0.00 0.00 176.35 175.70 1h2v s SER 48 N -1.36 5.00 0.38 2.29 1.04 -1.26 -4.32 113.70 115.48 1h2v s SER 48 Ca 0.65 1.79 0.28 0.00 0.48 0.00 0.00 55.95 59.16 1h2v s SER 48 Cb -0.29 -2.52 1.14 0.00 0.10 0.00 0.00 66.02 64.45 1h2v s SER 48 CO 0.35 -1.70 1.83 -0.26 0.98 0.00 0.00 173.24 174.44 1h2v h PHE 49 N -0.64 0.00 -0.02 5.02 0.05 -1.94 -2.65 116.94 116.76 1h2v h PHE 49 Ca -0.44 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.35 1h2v h PHE 49 Cb 1.23 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.18 1h2v h PHE 49 CO 0.59 0.00 -0.08 0.66 -0.18 0.00 0.00 178.31 179.29 1h2v n TYR 50 N -2.60 0.00 -2.40 -0.55 0.53 -1.26 -4.73 117.16 106.14 1h2v n TYR 50 Ca 0.02 0.00 -0.41 0.00 -1.02 0.00 0.00 57.90 56.48 1h2v n TYR 50 Cb 0.27 -0.02 -0.04 0.00 -1.03 0.00 0.00 39.34 38.52 1h2v n TYR 50 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 1h2v s THR 51 N -2.12 3.62 0.35 -0.72 2.01 -1.00 -5.04 115.64 112.74 1h2v s THR 51 Ca 0.31 1.38 0.08 0.00 0.31 0.00 0.00 61.69 63.77 1h2v s THR 51 Cb 0.20 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 1h2v s THR 51 CO 0.38 0.23 0.17 0.42 -0.69 0.00 0.00 174.62 175.12 1h2v s THR 52 N -0.14 3.01 0.43 -0.82 -4.23 -1.26 -4.98 115.64 107.65 1h2v s THR 52 Ca 0.52 -1.65 0.10 0.00 -1.18 0.00 0.00 61.69 59.48 1h2v s THR 52 Cb -0.32 -3.00 0.29 0.00 1.34 0.00 0.00 72.50 70.81 1h2v s THR 52 CO 0.37 -0.16 2.04 -0.08 -0.54 0.00 0.00 174.62 176.24 1h2v h GLU 53 N 1.49 0.44 -0.37 3.99 4.81 -1.99 -2.24 114.58 120.71 1h2v h GLU 53 Ca -0.44 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 58.66 1h2v h GLU 53 Cb 1.25 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1h2v h GLU 53 CO 0.63 0.29 -0.21 0.93 -0.73 0.00 0.00 179.01 179.93 1h2v h GLU 54 N 0.45 0.79 -0.67 1.92 3.07 -1.99 -1.57 114.58 116.58 1h2v h GLU 54 Ca 0.19 -0.36 -0.07 0.00 -0.50 0.00 0.00 59.36 58.62 1h2v h GLU 54 Cb 0.17 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.04 1h2v h GLU 54 CO -0.05 0.98 0.14 1.96 -1.40 0.00 0.00 179.01 180.65 1h2v h GLN 55 N 0.58 1.09 -0.45 2.33 4.20 -1.85 -1.54 115.11 119.47 1h2v h GLN 55 Ca 0.08 -0.27 -0.05 0.00 0.06 0.00 0.00 58.65 58.46 1h2v h GLN 55 Cb 0.76 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 1h2v h GLN 55 CO 0.06 0.98 0.06 0.82 -0.67 0.00 0.00 178.83 180.08 1h2v h ILE 56 N 1.01 1.22 -0.01 2.54 2.04 -1.31 -1.01 117.51 121.99 1h2v h ILE 56 Ca 0.21 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.24 1h2v h ILE 56 Cb 0.40 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1h2v h ILE 56 CO 0.01 0.30 0.00 1.88 0.00 0.00 0.00 178.15 180.33 1h2v h TYR 57 N 0.67 0.01 -0.01 1.37 0.05 -0.88 -0.75 116.97 117.43 1h2v h TYR 57 Ca 0.15 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.95 1h2v h TYR 57 Cb 0.33 -0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.03 1h2v h TYR 57 CO 0.02 0.16 -0.14 1.49 -1.05 0.00 0.00 178.16 178.64 1h2v h GLU 58 N -0.15 -0.22 0.48 4.88 4.57 -0.92 -0.45 114.58 122.77 1h2v h GLU 58 Ca 0.00 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 1h2v h GLU 58 Cb 0.16 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1h2v h GLU 58 CO -0.00 -0.15 -0.23 1.25 -1.18 0.00 0.00 179.01 178.70 1h2v h LEU 59 N -0.23 -0.55 -1.54 1.64 5.85 -1.15 -3.24 115.31 116.10 1h2v h LEU 59 Ca 0.05 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1h2v h LEU 59 Cb 0.29 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 1h2v h LEU 59 CO -0.14 -0.24 -0.01 -0.26 -0.34 0.00 0.00 178.44 177.45 1h2v h PHE 60 N -0.86 0.00 0.00 1.25 -1.00 -1.15 -2.41 116.94 112.77 1h2v h PHE 60 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 1h2v h PHE 60 Cb 0.58 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.14 1h2v h PHE 60 CO -0.00 0.01 0.00 0.77 -1.61 0.00 0.00 178.31 177.48 1h2v h SER 61 N 0.00 0.00 0.59 2.17 0.02 -1.10 -2.60 113.55 112.63 1h2v h SER 61 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1h2v h SER 61 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1h2v h SER 61 CO 0.00 0.00 0.00 0.11 -1.14 0.00 0.00 176.83 175.80 1h2v h LYS 62 N 0.00 0.00 -0.01 3.45 1.57 -1.53 -2.45 116.57 117.61 1h2v h LYS 62 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h2v h LYS 62 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1h2v h LYS 62 CO 0.00 0.00 -0.45 -1.13 -0.57 0.00 0.00 179.45 177.30 1h2v n SER 63 N -2.53 1.33 0.00 0.86 3.41 -0.98 -5.08 113.62 110.63 1h2v n SER 63 Ca 0.01 -1.16 0.00 0.00 -0.26 0.00 0.00 58.87 57.45 1h2v n SER 63 Cb 0.19 0.63 0.00 0.00 -0.26 0.00 0.00 64.21 64.78 1h2v n SER 63 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h2v n GLY 64 N 1.20 -1.37 3.67 5.00 0.00 -0.92 -4.52 105.19 108.26 1h2v n GLY 64 Ca 0.05 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 1h2v n GLY 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h2v s ASP 65 N -0.09 6.85 -0.13 1.61 -0.00 -1.26 -4.28 116.67 119.37 1h2v s ASP 65 Ca 0.00 1.99 -0.20 0.00 -0.00 0.00 0.00 52.55 54.33 1h2v s ASP 65 Cb 0.00 -2.55 -0.03 0.00 -0.00 0.00 0.00 42.92 40.34 1h2v s ASP 65 CO 0.00 -0.77 0.59 -0.63 -0.00 0.00 0.00 175.17 174.36 1h2v s ILE 66 N 3.09 5.09 -0.07 0.77 1.01 -1.26 -2.79 121.20 127.05 1h2v s ILE 66 Ca 0.63 1.16 -0.19 0.00 0.00 0.00 0.00 60.65 62.25 1h2v s ILE 66 Cb -0.28 -3.92 -0.30 0.00 0.01 0.00 0.00 42.46 37.97 1h2v s ILE 66 CO 0.23 0.23 0.76 0.50 0.00 0.00 0.00 174.94 176.66 1h2v h LYS 67 N 7.00 0.29 -1.78 2.79 3.64 -0.70 -3.47 116.57 124.34 1h2v h LYS 67 Ca -0.38 -0.50 0.01 0.00 -1.27 0.00 0.00 60.65 58.51 1h2v h LYS 67 Cb 1.17 0.19 -0.21 0.00 -0.41 0.00 0.00 32.23 32.97 1h2v h LYS 67 CO 0.76 1.24 0.37 0.21 -2.27 0.00 0.00 179.45 179.76 1h2v s LYS 68 N -2.46 0.82 -0.03 1.90 2.20 -1.11 -5.03 119.74 116.03 1h2v s LYS 68 Ca -0.16 0.21 0.03 0.00 -0.36 0.00 0.00 55.97 55.70 1h2v s LYS 68 Cb 0.03 0.39 -0.00 0.00 -1.51 0.00 0.00 37.83 36.73 1h2v s LYS 68 CO 0.81 -0.25 -0.13 0.42 -0.36 0.00 0.00 175.35 175.84 1h2v s ILE 69 N -1.12 1.10 -0.21 5.43 1.01 -1.26 -1.45 121.20 124.70 1h2v s ILE 69 Ca -0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1h2v s ILE 69 Cb -0.00 -0.96 0.06 0.00 0.01 0.00 0.00 42.46 41.56 1h2v s ILE 69 CO 0.06 0.33 -0.02 -0.63 0.00 0.00 0.00 174.94 174.67 1h2v s ILE 70 N 0.10 1.15 0.43 2.92 1.01 -0.87 -4.98 121.20 120.95 1h2v s ILE 70 Ca -0.03 -0.93 -0.22 0.00 0.00 0.00 0.00 60.65 59.47 1h2v s ILE 70 Cb -0.10 -1.48 -0.09 0.00 0.01 0.00 0.00 42.46 40.80 1h2v s ILE 70 CO 0.01 -0.11 1.01 -0.04 0.00 0.00 0.00 174.94 175.82 1h2v s MET 71 N 1.58 4.10 -0.10 2.79 -1.94 -1.26 -1.28 119.30 123.18 1h2v s MET 71 Ca -0.03 1.35 -0.21 0.00 -1.71 0.00 0.00 55.69 55.09 1h2v s MET 71 Cb -0.18 -2.33 -0.04 0.00 2.01 0.00 0.00 34.83 34.29 1h2v s MET 71 CO -0.07 -0.17 0.61 0.20 -0.01 0.00 0.00 175.02 175.57 1h2v s GLY 72 N -1.85 2.46 0.35 -0.03 0.00 -0.37 -4.87 107.32 103.00 1h2v s GLY 72 Ca 0.61 -0.04 0.09 0.00 0.00 0.00 0.00 44.72 45.38 1h2v s GLY 72 CO 0.21 1.04 -0.01 1.08 0.00 0.00 0.00 173.10 175.43 1h2v s LEU 73 N 0.89 2.91 0.10 0.66 1.43 0.24 -1.71 118.68 123.21 1h2v s LEU 73 Ca 0.32 -1.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 1h2v s LEU 73 Cb -0.16 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.78 1h2v s LEU 73 CO 0.14 -0.26 1.10 -0.62 0.23 0.00 0.00 176.35 176.94 1h2v s ASP 74 N -3.70 7.25 0.65 2.29 3.68 0.24 -4.18 116.67 122.91 1h2v s ASP 74 Ca 0.34 1.96 0.35 0.00 2.13 0.00 0.00 52.55 57.34 1h2v s ASP 74 Cb 0.02 -2.59 1.94 0.00 -1.45 0.00 0.00 42.92 40.84 1h2v s ASP 74 CO 0.19 -0.29 2.13 0.50 0.13 0.00 0.00 175.17 177.83 1h2v h LYS 75 N 5.98 0.00 0.00 4.34 3.64 -1.94 -0.74 116.57 127.84 1h2v h LYS 75 Ca -0.43 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1h2v h LYS 75 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1h2v h LYS 75 CO 0.76 0.00 -0.36 -1.33 -2.27 0.00 0.00 179.45 176.24 1h2v n MET 76 N -3.18 0.19 0.21 1.90 2.81 -1.26 -4.72 117.12 113.07 1h2v n MET 76 Ca -0.01 0.08 0.15 0.00 -1.81 0.00 0.00 57.70 56.10 1h2v n MET 76 Cb 0.25 -0.78 0.52 0.00 -0.71 0.00 0.00 33.22 32.50 1h2v n MET 76 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1h2v h LYS 77 N -0.36 0.00 -2.74 0.03 1.57 -1.99 -3.46 116.57 109.62 1h2v h LYS 77 Ca 0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 1h2v h LYS 77 Cb 0.36 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.71 1h2v h LYS 77 CO 0.00 0.00 -0.35 1.63 -0.57 0.00 0.00 179.45 180.16 1h2v n LYS 78 N -2.77 -2.75 -4.73 3.15 4.76 -0.28 -4.93 118.16 110.59 1h2v n LYS 78 Ca 0.02 0.53 -0.33 0.00 -2.87 0.00 0.00 58.31 55.66 1h2v n LYS 78 Cb 0.34 -4.61 -0.12 0.00 -1.84 0.00 0.00 35.03 28.79 1h2v n LYS 78 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1h2v s THR 79 N -2.89 3.43 0.09 -0.18 -4.23 -1.26 -4.62 115.64 105.99 1h2v s THR 79 Ca 0.17 -0.58 -0.35 0.00 -1.18 0.00 0.00 61.69 59.75 1h2v s THR 79 Cb -0.07 -2.38 -0.18 0.00 1.34 0.00 0.00 72.50 71.20 1h2v s THR 79 CO 0.21 0.59 0.86 0.00 -0.54 0.00 0.00 174.62 175.74 1h2v n ALA 80 N 2.33 -3.08 -0.44 3.99 0.00 -1.26 0.83 120.51 122.89 1h2v n ALA 80 Ca -0.18 0.52 0.05 0.00 0.00 0.00 0.00 53.44 53.84 1h2v n ALA 80 Cb 0.53 -1.73 0.13 0.00 0.00 0.00 0.00 19.45 18.38 1h2v n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h2v n GLY 82 N -0.33 1.34 3.75 0.00 0.00 -1.26 -4.98 105.19 103.71 1h2v n GLY 82 Ca 0.11 -0.26 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 1h2v n GLY 82 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1h2v s PHE 83 N -2.00 -0.22 0.21 1.61 -0.12 -1.26 -1.98 117.98 114.23 1h2v s PHE 83 Ca 0.00 -0.14 -0.22 0.00 -0.05 0.00 0.00 56.93 56.52 1h2v s PHE 83 Cb 0.00 0.66 0.06 0.00 -0.63 0.00 0.00 43.02 43.11 1h2v s PHE 83 CO 0.00 -1.00 0.92 0.00 -0.05 0.00 0.00 175.22 175.09 1h2v s PHE 85 N -2.98 2.47 -0.14 0.00 0.40 -0.40 -0.67 117.98 116.66 1h2v s PHE 85 Ca 0.15 -0.33 -0.00 0.00 -0.60 0.00 0.00 56.93 56.14 1h2v s PHE 85 Cb -0.03 -1.54 0.03 0.00 0.51 0.00 0.00 43.02 41.99 1h2v s PHE 85 CO 0.05 0.06 -0.08 0.08 0.70 0.00 0.00 175.22 176.03 1h2v s VAL 86 N -0.68 1.15 -0.16 -0.44 1.01 -0.08 -2.05 120.40 119.15 1h2v s VAL 86 Ca 0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 1h2v s VAL 86 Cb -0.10 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 1h2v s VAL 86 CO -0.00 0.31 -0.08 -0.70 0.00 0.00 0.00 175.10 174.63 1h2v s GLU 87 N 1.64 3.49 0.25 2.72 2.12 -0.53 -0.45 118.70 127.95 1h2v s GLU 87 Ca 0.04 -0.61 0.06 0.00 0.36 0.00 0.00 54.97 54.82 1h2v s GLU 87 Cb -0.13 -2.81 -0.03 0.00 0.26 0.00 0.00 34.13 31.41 1h2v s GLU 87 CO -0.08 0.14 0.25 0.71 -0.54 0.00 0.00 175.26 175.74 1h2v s TYR 88 N 0.58 3.20 0.19 5.30 2.02 -0.03 0.00 117.35 128.61 1h2v s TYR 88 Ca -0.05 -0.09 0.03 0.00 -0.37 0.00 0.00 57.07 56.59 1h2v s TYR 88 Cb -0.15 -1.46 0.08 0.00 -0.40 0.00 0.00 41.96 40.03 1h2v s TYR 88 CO 0.03 0.49 1.44 1.88 -1.57 0.00 0.00 175.55 177.81 1h2v h TYR 89 N 1.39 0.28 -3.83 2.71 0.05 -1.83 -3.44 116.97 112.31 1h2v h TYR 89 Ca -0.49 -0.14 -0.54 0.00 0.05 0.00 0.00 58.73 57.61 1h2v h TYR 89 Cb 1.24 -0.04 -0.21 0.00 1.01 0.00 0.00 36.73 38.73 1h2v h TYR 89 CO 0.52 0.90 -0.81 -1.54 -1.05 0.00 0.00 178.16 176.18 1h2v s SER 90 N -6.91 2.47 0.19 3.88 1.04 -1.26 -5.05 113.70 108.06 1h2v s SER 90 Ca -0.03 -0.71 -0.12 0.00 0.48 0.00 0.00 55.95 55.56 1h2v s SER 90 Cb 0.11 -0.13 0.12 0.00 0.10 0.00 0.00 66.02 66.21 1h2v s SER 90 CO 0.82 0.03 1.84 -0.09 0.98 0.00 0.00 173.24 176.81 1h2v h ARG 91 N 3.96 0.73 -0.91 4.02 9.65 -1.88 -2.81 114.38 127.14 1h2v h ARG 91 Ca -0.45 -0.04 0.14 0.00 -1.10 0.00 0.00 59.98 58.53 1h2v h ARG 91 Cb 1.19 -0.17 -0.07 0.00 -1.39 0.00 0.00 29.97 29.53 1h2v h ARG 91 CO 0.42 0.49 0.58 0.00 2.80 0.00 0.00 179.97 184.26 1h2v h ALA 92 N 1.24 1.77 -0.19 2.80 0.00 -1.96 -1.00 119.26 121.92 1h2v h ALA 92 Ca 0.23 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.98 1h2v h ALA 92 Cb -0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1h2v h ALA 92 CO -0.08 -0.02 -0.60 -0.44 0.00 0.00 0.00 179.25 178.11 1h2v h ASP 93 N 0.75 0.73 -0.18 0.00 3.32 -1.73 -2.24 116.42 117.06 1h2v h ASP 93 Ca 0.46 -0.41 -0.12 0.00 0.02 0.00 0.00 57.03 56.98 1h2v h ASP 93 Cb 0.68 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 1h2v h ASP 93 CO -0.22 1.16 -0.28 0.00 -1.72 0.00 0.00 179.24 178.19 1h2v h ALA 94 N 0.84 0.92 -0.57 3.45 0.00 -1.23 -2.30 119.26 120.37 1h2v h ALA 94 Ca -0.00 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 1h2v h ALA 94 Cb 1.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1h2v h ALA 94 CO 0.12 0.62 0.05 0.93 0.00 0.00 0.00 179.25 180.96 1h2v h GLU 95 N 0.57 0.98 0.00 0.00 5.08 -1.12 -1.23 114.58 118.87 1h2v h GLU 95 Ca 0.07 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.10 1h2v h GLU 95 Cb 0.76 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1h2v h GLU 95 CO 0.06 0.96 -0.23 -0.91 -1.00 0.00 0.00 179.01 177.88 1h2v h ASN 96 N 0.87 0.00 -0.24 1.42 2.35 -1.27 0.94 115.58 119.65 1h2v h ASN 96 Ca 0.17 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.80 1h2v h ASN 96 Cb 0.48 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1h2v h ASN 96 CO 0.02 0.23 -0.30 0.00 -1.65 0.00 0.00 177.43 175.73 1h2v h ALA 97 N 1.77 0.36 -0.28 -0.83 0.00 -0.89 0.24 119.26 119.63 1h2v h ALA 97 Ca -0.00 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 1h2v h ALA 97 Cb 0.46 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1h2v h ALA 97 CO 0.03 0.38 -0.03 0.52 0.00 0.00 0.00 179.25 180.15 1h2v h MET 98 N 0.34 0.43 0.01 0.00 2.86 -0.39 0.14 114.93 118.31 1h2v h MET 98 Ca 0.03 -0.09 -0.14 0.00 -2.06 0.00 0.00 59.70 57.44 1h2v h MET 98 Cb 0.87 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 32.48 1h2v h MET 98 CO 0.07 0.48 -0.55 0.00 1.06 0.00 0.00 176.91 177.98 1h2v h ARG 99 N 0.41 0.36 0.00 1.72 3.08 -0.62 -3.37 114.38 115.96 1h2v h ARG 99 Ca 0.09 -0.40 -0.03 0.00 0.07 0.00 0.00 59.98 59.71 1h2v h ARG 99 Cb 0.32 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1h2v h ARG 99 CO 0.01 1.08 -1.45 0.66 -1.07 0.00 0.00 179.97 179.20 1h2v n TYR 100 N -4.26 0.00 -0.02 3.04 4.01 0.05 -4.72 117.16 115.26 1h2v n TYR 100 Ca -0.10 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.42 1h2v n TYR 100 Cb 0.65 -0.25 -0.13 0.00 -0.31 0.00 0.00 39.34 39.30 1h2v n TYR 100 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1h2v h ILE 101 N 0.00 0.74 -2.42 -0.72 1.08 -0.89 -3.44 117.51 111.86 1h2v h ILE 101 Ca -0.05 -2.30 -0.61 0.00 -0.39 0.00 0.00 64.86 61.51 1h2v h ILE 101 Cb 0.64 2.45 0.09 0.00 -3.07 0.00 0.00 36.82 36.93 1h2v h ILE 101 CO 0.00 0.72 0.33 -3.20 -0.69 0.00 0.00 178.15 175.31 1h2v n ASN 102 N -3.78 1.80 -0.00 1.72 5.15 -0.70 -1.73 115.26 117.71 1h2v n ASN 102 Ca -0.31 1.16 -0.00 0.00 -0.60 0.00 0.00 54.58 54.83 1h2v n ASN 102 Cb 0.94 -1.32 -0.00 0.00 -0.53 0.00 0.00 39.78 38.87 1h2v n ASN 102 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h2v n GLY 103 N 1.68 0.47 3.83 8.20 0.00 -0.38 -4.95 105.19 114.03 1h2v n GLY 103 Ca 0.11 -0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1h2v n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h2v s THR 104 N -1.93 1.64 0.16 2.61 -4.23 -0.71 -4.81 115.64 108.37 1h2v s THR 104 Ca 0.00 -1.69 -0.03 0.00 -1.18 0.00 0.00 61.69 58.78 1h2v s THR 104 Cb 0.00 -2.33 -0.05 0.00 1.34 0.00 0.00 72.50 71.46 1h2v s THR 104 CO 0.00 0.00 0.38 -0.13 -0.54 0.00 0.00 174.62 174.33 1h2v s ARG 105 N -4.08 3.58 -0.16 3.99 0.52 -1.26 -1.59 118.95 119.96 1h2v s ARG 105 Ca 0.27 -0.17 -0.06 0.00 -0.52 0.00 0.00 55.73 55.25 1h2v s ARG 105 Cb 0.00 -2.84 0.07 0.00 0.52 0.00 0.00 34.95 32.70 1h2v s ARG 105 CO 0.16 0.44 0.33 -1.17 0.02 0.00 0.00 175.30 175.08 1h2v s LEU 106 N -2.87 -0.35 -1.47 2.53 2.96 -0.68 -4.82 118.68 113.98 1h2v s LEU 106 Ca 0.40 0.76 -0.11 0.00 -0.22 0.00 0.00 54.13 54.96 1h2v s LEU 106 Cb -0.12 1.00 0.05 0.00 0.50 0.00 0.00 46.19 47.63 1h2v s LEU 106 CO 0.26 -0.23 0.98 -0.67 -1.32 0.00 0.00 176.35 175.37 1h2v n ASP 107 N 5.17 -5.38 -1.64 3.68 -0.08 -1.26 -1.53 116.55 115.50 1h2v n ASP 107 Ca -0.10 -0.63 -0.20 0.00 -1.51 0.00 0.00 54.79 52.34 1h2v n ASP 107 Cb 0.50 -4.28 -0.08 0.00 2.34 0.00 0.00 41.12 39.60 1h2v n ASP 107 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1h2v n ASP 108 N -2.82 -5.51 -4.35 1.67 2.03 -1.26 -4.93 116.55 101.39 1h2v n ASP 108 Ca 0.01 0.46 -0.32 0.00 0.52 0.00 0.00 54.79 55.47 1h2v n ASP 108 Cb 0.55 -4.78 -0.15 0.00 -0.72 0.00 0.00 41.12 36.01 1h2v n ASP 108 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1h2v s ARG 109 N -3.86 2.38 -0.16 -0.67 0.52 -0.58 -5.04 118.95 111.53 1h2v s ARG 109 Ca 0.00 -0.85 -0.29 0.00 -0.52 0.00 0.00 55.73 54.06 1h2v s ARG 109 Cb 0.00 -2.18 -0.01 0.00 0.52 0.00 0.00 34.95 33.27 1h2v s ARG 109 CO 0.00 0.52 1.24 0.42 0.02 0.00 0.00 175.30 177.50 1h2v s ILE 110 N -0.49 4.31 0.30 1.52 -1.09 -1.26 -1.69 121.20 122.80 1h2v s ILE 110 Ca 0.06 1.59 0.03 0.00 -2.23 0.00 0.00 60.65 60.10 1h2v s ILE 110 Cb -0.11 -4.02 -0.03 0.00 -1.58 0.00 0.00 42.46 36.72 1h2v s ILE 110 CO 0.01 -0.13 0.46 0.27 -1.23 0.00 0.00 174.94 174.32 1h2v s ILE 111 N 3.38 4.97 -0.02 2.92 -4.36 -0.62 -4.84 121.20 122.63 1h2v s ILE 111 Ca 0.54 -0.78 0.04 0.00 -0.26 0.00 0.00 60.65 60.19 1h2v s ILE 111 Cb -0.21 -3.78 -0.01 0.00 1.25 0.00 0.00 42.46 39.71 1h2v s ILE 111 CO 0.14 -0.38 -0.14 -0.13 0.24 0.00 0.00 174.94 174.67 1h2v s ARG 112 N -4.16 1.29 0.06 0.37 0.52 -0.89 -1.25 118.95 114.89 1h2v s ARG 112 Ca 0.38 -0.50 0.09 0.00 -0.52 0.00 0.00 55.73 55.19 1h2v s ARG 112 Cb -0.09 -1.20 -0.03 0.00 0.52 0.00 0.00 34.95 34.15 1h2v s ARG 112 CO 0.32 0.25 -0.26 0.95 0.02 0.00 0.00 175.30 176.58 1h2v s THR 113 N -0.12 2.14 -0.02 0.02 -4.23 -1.26 -0.42 115.64 111.75 1h2v s THR 113 Ca 0.01 -1.44 -0.06 0.00 -1.18 0.00 0.00 61.69 59.02 1h2v s THR 113 Cb -0.08 -1.84 0.01 0.00 1.34 0.00 0.00 72.50 71.93 1h2v s THR 113 CO 0.00 0.32 0.14 -1.81 -0.54 0.00 0.00 174.62 172.73 1h2v s ASP 114 N -1.37 -0.05 0.64 3.99 1.11 -0.61 -4.97 116.67 115.41 1h2v s ASP 114 Ca 0.12 0.02 -0.18 0.00 0.18 0.00 0.00 52.55 52.69 1h2v s ASP 114 Cb -0.10 0.25 -0.02 0.00 1.07 0.00 0.00 42.92 44.13 1h2v s ASP 114 CO 0.03 -0.22 1.27 0.26 1.18 0.00 0.00 175.17 177.69 1h2v s TRP 115 N -0.72 2.15 -0.01 4.23 0.52 -1.26 -1.10 118.94 122.75 1h2v s TRP 115 Ca -0.08 1.49 0.00 0.00 0.02 0.00 0.00 56.10 57.53 1h2v s TRP 115 Cb -0.05 -3.65 0.01 0.00 -1.15 0.00 0.00 33.47 28.63 1h2v s TRP 115 CO 0.01 -2.77 -0.01 0.34 0.02 0.00 0.00 176.95 174.54 1h2v s ASP 116 N -1.44 0.18 0.49 2.95 -1.08 -0.61 -4.68 116.67 112.47 1h2v s ASP 116 Ca 0.81 -0.02 0.21 0.00 -0.52 0.00 0.00 52.55 53.04 1h2v s ASP 116 Cb -0.36 -0.05 1.26 0.00 -1.46 0.00 0.00 42.92 42.32 1h2v s ASP 116 CO 0.38 -0.01 1.97 0.00 0.52 0.00 0.00 175.17 178.03 1h2v h ALA 117 N 6.37 2.35 0.00 3.66 0.00 -1.92 -3.40 119.26 126.32 1h2v h ALA 117 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1h2v h ALA 117 Cb 1.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1h2v h ALA 117 CO 0.50 -0.52 0.00 0.41 0.00 0.00 0.00 179.25 179.64 1h2v n GLY 118 N -1.60 4.52 3.77 0.00 0.00 -1.26 -4.93 105.19 105.69 1h2v n GLY 118 Ca 0.11 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.59 1h2v n GLY 118 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1h2v s PHE 119 N -2.00 2.89 -0.02 1.61 2.19 -1.26 -5.05 117.98 116.35 1h2v s PHE 119 Ca 0.00 1.54 0.02 0.00 0.33 0.00 0.00 56.93 58.82 1h2v s PHE 119 Cb 0.00 -3.36 -0.00 0.00 -1.31 0.00 0.00 43.02 38.35 1h2v s PHE 119 CO 0.00 -1.45 -0.07 0.15 1.83 0.00 0.00 175.22 175.67 1h2v s LYS 120 N -2.70 0.72 0.14 10.12 1.02 -1.26 -5.09 119.74 122.68 1h2v s LYS 120 Ca 0.63 -0.26 -0.34 0.00 0.02 0.00 0.00 55.97 56.02 1h2v s LYS 120 Cb -0.28 -0.69 -0.16 0.00 -0.52 0.00 0.00 37.83 36.18 1h2v s LYS 120 CO 0.34 0.12 1.27 -1.91 -0.92 0.00 0.00 175.35 174.26 1h2v n GLU 121 N 3.13 1.26 0.00 1.68 4.07 -1.26 -1.25 120.64 128.28 1h2v n GLU 121 Ca -0.16 0.45 0.00 0.00 -0.06 0.00 0.00 57.16 57.39 1h2v n GLU 121 Cb 0.56 -2.04 0.00 0.00 -0.06 0.00 0.00 31.44 29.90 1h2v n GLU 121 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1h2v n GLY 122 N 2.31 2.71 0.00 8.31 0.00 -1.26 -4.90 105.19 112.36 1h2v n GLY 122 Ca 0.16 -0.34 0.08 0.00 0.00 0.00 0.00 46.02 45.93 1h2v n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h2v n ARG 123 N 0.00 0.48 0.00 1.61 1.74 -0.38 -2.89 116.66 117.21 1h2v n ARG 123 Ca 0.00 0.02 0.16 0.00 -0.77 0.00 0.00 57.85 57.25 1h2v n ARG 123 Cb 0.00 -1.50 0.91 0.00 -1.02 0.00 0.00 32.46 30.85 1h2v n ARG 123 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h2v n GLN 124 N -1.03 0.99 0.00 5.56 0.00 -1.26 -4.99 117.38 116.64 1h2v n GLN 124 Ca 0.12 -0.05 0.07 0.00 0.00 0.00 0.00 57.00 57.14 1h2v n GLN 124 Cb 0.06 -1.50 0.06 0.00 0.00 0.00 0.00 30.24 28.87 1h2v n GLN 124 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72