#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ro7 s LYS 3 N 0.00 3.13 -0.01 1.64 3.01 -1.21 -4.53 119.74 121.77 1ro7 s LYS 3 Ca 0.00 0.21 0.01 0.00 -1.01 0.00 0.00 55.97 55.17 1ro7 s LYS 3 Cb 0.00 -2.23 0.01 0.00 -1.01 0.00 0.00 37.83 34.60 1ro7 s LYS 3 CO 0.00 -0.63 -0.02 0.54 0.51 0.00 0.00 175.35 175.75 1ro7 s VAL 4 N -3.02 0.21 -0.24 3.17 0.11 -1.01 -0.42 120.40 119.21 1ro7 s VAL 4 Ca 0.53 -0.03 -0.09 0.00 -2.93 0.00 0.00 61.98 59.46 1ro7 s VAL 4 Cb -0.11 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.47 1ro7 s VAL 4 CO 0.47 0.10 0.11 -0.63 -3.33 0.00 0.00 175.10 171.82 1ro7 s ILE 5 N 0.42 4.78 -0.24 7.04 1.01 0.54 -1.00 121.20 133.75 1ro7 s ILE 5 Ca -0.04 -0.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.52 1ro7 s ILE 5 Cb -0.07 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 1ro7 s ILE 5 CO -0.01 0.34 0.05 -0.63 0.00 0.00 0.00 174.94 174.70 1ro7 s ILE 6 N 1.32 4.21 -0.14 2.92 1.01 0.76 -1.20 121.20 130.08 1ro7 s ILE 6 Ca 0.06 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.52 1ro7 s ILE 6 Cb -0.15 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1ro7 s ILE 6 CO 0.05 0.36 -0.19 0.00 0.00 0.00 0.00 174.94 175.16 1ro7 s ALA 7 N 1.51 2.36 0.64 9.38 0.00 -0.80 -1.68 121.76 133.18 1ro7 s ALA 7 Ca 0.06 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 1ro7 s ALA 7 Cb -0.15 -1.08 0.07 0.00 0.00 0.00 0.00 23.12 21.96 1ro7 s ALA 7 CO 0.03 0.02 0.48 0.41 0.00 0.00 0.00 175.76 176.70 1ro7 n GLY 8 N 3.97 0.28 0.93 0.00 0.00 0.30 -4.04 105.19 106.63 1ro7 n GLY 8 Ca -0.19 -1.92 0.01 0.00 0.00 0.00 0.00 46.02 43.91 1ro7 n GLY 8 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ro7 n ASN 9 N -3.05 2.70 -4.56 1.61 3.02 -1.10 -4.30 115.26 109.58 1ro7 n ASN 9 Ca 0.07 -3.55 -0.29 0.00 -0.03 0.00 0.00 54.58 50.79 1ro7 n ASN 9 Cb 0.26 -0.58 0.20 0.00 -0.61 0.00 0.00 39.78 39.05 1ro7 n ASN 9 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ro7 s GLY 10 N -2.51 1.55 0.58 7.41 0.00 0.44 -1.44 107.32 113.36 1ro7 s GLY 10 Ca 0.42 -0.41 0.28 0.00 0.00 0.00 0.00 44.72 45.01 1ro7 s GLY 10 CO 0.01 0.26 2.19 -0.56 0.00 0.00 0.00 173.10 175.00 1ro7 h PRO 11 N -2.14 0.00 0.00 2.90 0.13 -1.78 -1.81 132.00 129.30 1ro7 h PRO 11 Ca -0.55 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 1ro7 h PRO 11 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1ro7 h PRO 11 CO 0.55 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.98 1ro7 h SER 12 N 0.00 0.00 -0.51 1.44 4.64 -1.90 -1.94 113.55 115.27 1ro7 h SER 12 Ca 0.04 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1ro7 h SER 12 Cb 0.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 1ro7 h SER 12 CO -0.00 0.00 0.35 0.25 -0.87 0.00 0.00 176.83 176.56 1ro7 h LEU 13 N 0.00 0.25 -1.08 5.97 5.85 -1.64 0.33 115.31 124.98 1ro7 h LEU 13 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1ro7 h LEU 13 Cb 0.13 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1ro7 h LEU 13 CO 0.00 0.15 0.00 0.29 -0.34 0.00 0.00 178.44 178.54 1ro7 n LYS 14 N -4.46 1.73 -1.79 1.25 5.02 -0.73 -4.13 118.16 115.05 1ro7 n LYS 14 Ca 0.08 -1.08 -0.15 0.00 -2.02 0.00 0.00 58.31 55.14 1ro7 n LYS 14 Cb 0.39 -1.45 0.06 0.00 -0.02 0.00 0.00 35.03 34.01 1ro7 n LYS 14 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ro7 n GLU 15 N 0.30 2.96 -2.55 1.97 1.02 0.11 -5.05 120.64 119.40 1ro7 n GLU 15 Ca 0.18 -3.89 -0.41 0.00 -0.02 0.00 0.00 57.16 53.02 1ro7 n GLU 15 Cb 0.36 -2.03 -0.04 0.00 -0.02 0.00 0.00 31.44 29.70 1ro7 n GLU 15 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ro7 s ILE 16 N -4.14 3.91 -0.60 -3.67 1.01 -1.20 -4.54 121.20 111.96 1ro7 s ILE 16 Ca 0.46 1.68 -0.21 0.00 0.00 0.00 0.00 60.65 62.58 1ro7 s ILE 16 Cb 0.39 -4.07 0.07 0.00 0.01 0.00 0.00 42.46 38.87 1ro7 s ILE 16 CO 0.01 0.30 0.84 -0.62 0.00 0.00 0.00 174.94 175.47 1ro7 s ASP 17 N -0.24 6.21 0.03 3.58 -1.08 -0.84 -4.90 116.67 119.43 1ro7 s ASP 17 Ca 0.48 -1.00 0.14 0.00 -0.52 0.00 0.00 52.55 51.65 1ro7 s ASP 17 Cb -0.29 -2.37 0.60 0.00 -1.46 0.00 0.00 42.92 39.40 1ro7 s ASP 17 CO 0.35 -1.25 1.44 -1.22 0.52 0.00 0.00 175.17 175.02 1ro7 n TYR 18 N 7.09 0.10 0.32 -5.34 4.02 -1.26 -1.85 117.16 120.24 1ro7 n TYR 18 Ca -0.05 0.04 0.16 0.00 -0.01 0.00 0.00 57.90 58.04 1ro7 n TYR 18 Cb 0.45 -0.57 0.63 0.00 -0.02 0.00 0.00 39.34 39.83 1ro7 n TYR 18 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 1ro7 h SER 19 N 0.00 0.00 -0.57 7.72 0.02 -1.91 -1.83 113.55 116.98 1ro7 h SER 19 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ro7 h SER 19 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1ro7 h SER 19 CO 0.00 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.23 1ro7 n ARG 20 N -2.80 2.62 -2.11 3.45 1.74 -0.77 -0.47 116.66 118.31 1ro7 n ARG 20 Ca 0.01 -2.48 -0.42 0.00 -0.77 0.00 0.00 57.85 54.19 1ro7 n ARG 20 Cb 0.28 -1.55 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1ro7 n ARG 20 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1ro7 s LEU 21 N -1.23 4.33 0.93 0.55 2.96 -0.69 -4.69 118.68 120.84 1ro7 s LEU 21 Ca 0.44 2.23 -0.12 0.00 -0.22 0.00 0.00 54.13 56.47 1ro7 s LEU 21 Cb 0.24 -3.56 0.15 0.00 0.50 0.00 0.00 46.19 43.52 1ro7 s LEU 21 CO 0.33 -0.79 1.09 -2.16 -1.32 0.00 0.00 176.35 173.49 1ro7 s PRO 22 N 2.66 0.99 -0.01 0.98 0.04 -1.26 -4.73 135.00 133.67 1ro7 s PRO 22 Ca 0.68 0.90 -0.15 0.00 0.04 0.00 0.00 61.00 62.46 1ro7 s PRO 22 Cb -0.34 -1.77 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 1ro7 s PRO 22 CO 0.28 -2.45 0.41 -0.80 0.04 0.00 0.00 177.00 174.48 1ro7 s ASN 23 N -3.24 6.80 -0.20 6.66 0.01 -1.26 -4.72 114.94 118.99 1ro7 s ASN 23 Ca 0.64 0.96 -0.06 0.00 -0.71 0.00 0.00 52.86 53.69 1ro7 s ASN 23 Cb -0.19 -2.25 0.02 0.00 0.41 0.00 0.00 41.25 39.24 1ro7 s ASN 23 CO 0.58 0.31 0.11 -0.67 -1.51 0.00 0.00 177.10 175.92 1ro7 n ASP 24 N 1.91 -4.44 -3.92 -1.22 2.03 -1.26 -4.80 116.55 104.85 1ro7 n ASP 24 Ca -0.14 1.27 -0.09 0.00 0.52 0.00 0.00 54.79 56.35 1ro7 n ASP 24 Cb 0.52 -4.64 -0.07 0.00 -0.72 0.00 0.00 41.12 36.21 1ro7 n ASP 24 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1ro7 s PHE 25 N -1.00 0.29 0.25 -0.67 -0.71 -1.26 -3.31 117.98 111.57 1ro7 s PHE 25 Ca -0.13 -0.69 0.08 0.00 -1.04 0.00 0.00 56.93 55.15 1ro7 s PHE 25 Cb 0.01 -0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 1ro7 s PHE 25 CO 0.65 -0.63 0.09 -0.51 -1.34 0.00 0.00 175.22 173.49 1ro7 s ASP 26 N -2.92 5.04 -0.08 1.98 1.01 0.45 -4.95 116.67 117.20 1ro7 s ASP 26 Ca 0.11 -0.43 0.04 0.00 0.71 0.00 0.00 52.55 52.99 1ro7 s ASP 26 Cb 0.04 -1.13 0.00 0.00 1.01 0.00 0.00 42.92 42.84 1ro7 s ASP 26 CO -0.05 -0.00 -0.21 -0.69 0.21 0.00 0.00 175.17 174.43 1ro7 s VAL 27 N -2.16 1.77 -0.18 -1.27 1.01 -1.26 -0.34 120.40 117.97 1ro7 s VAL 27 Ca 0.32 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 1ro7 s VAL 27 Cb -0.07 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1ro7 s VAL 27 CO 0.22 0.50 -0.05 -0.36 0.00 0.00 0.00 175.10 175.41 1ro7 s PHE 28 N 0.32 2.96 0.28 5.22 0.40 -0.34 0.33 117.98 127.15 1ro7 s PHE 28 Ca -0.14 -0.62 0.09 0.00 -0.60 0.00 0.00 56.93 55.65 1ro7 s PHE 28 Cb -0.16 -2.02 -0.06 0.00 0.51 0.00 0.00 43.02 41.30 1ro7 s PHE 28 CO 0.06 -0.29 -0.12 1.03 0.70 0.00 0.00 175.22 176.60 1ro7 s ARG 29 N 0.89 1.60 0.05 0.44 1.81 -0.61 -1.90 118.95 121.23 1ro7 s ARG 29 Ca -0.01 -1.78 -0.05 0.00 -1.72 0.00 0.00 55.73 52.18 1ro7 s ARG 29 Cb -0.15 -1.41 -0.02 0.00 -0.45 0.00 0.00 34.95 32.92 1ro7 s ARG 29 CO 0.01 0.16 0.07 0.00 -0.68 0.00 0.00 175.30 174.86 1ro7 n ASN 31 N 0.36 0.00 -1.64 0.00 3.02 0.53 -1.95 115.26 115.58 1ro7 n ASN 31 Ca -0.16 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.35 1ro7 n ASN 31 Cb 0.60 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.74 1ro7 n ASN 31 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ro7 n GLN 32 N 14.00 1.27 -0.17 3.52 3.00 -1.26 -4.52 117.38 133.22 1ro7 n GLN 32 Ca 0.00 -0.33 0.06 0.00 -0.01 0.00 0.00 57.00 56.72 1ro7 n GLN 32 Cb 0.00 -1.25 0.35 0.00 0.00 0.00 0.00 30.24 29.34 1ro7 n GLN 32 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1ro7 h PHE 33 N 1.44 0.76 0.00 1.08 -5.15 -1.80 -1.86 116.94 111.42 1ro7 h PHE 33 Ca 0.06 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.85 1ro7 h PHE 33 Cb 1.09 -0.25 0.00 0.00 0.22 0.00 0.00 35.95 37.01 1ro7 h PHE 33 CO 0.59 0.41 0.00 2.48 -2.00 0.00 0.00 178.31 179.79 1ro7 n TYR 34 N -4.47 0.03 0.36 6.09 4.11 -1.26 -1.86 117.16 120.16 1ro7 n TYR 34 Ca 0.10 0.02 0.14 0.00 -0.00 0.00 0.00 57.90 58.15 1ro7 n TYR 34 Cb 0.20 -0.52 0.55 0.00 -0.00 0.00 0.00 39.34 39.57 1ro7 n TYR 34 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.86 177.60 1ro7 h PHE 35 N 0.00 0.00 -2.82 -3.48 0.05 -1.56 -3.43 116.94 105.70 1ro7 h PHE 35 Ca 0.00 0.00 -0.59 0.00 3.82 0.00 0.00 57.97 61.20 1ro7 h PHE 35 Cb 0.13 0.00 0.10 0.00 2.00 0.00 0.00 35.95 38.18 1ro7 h PHE 35 CO 0.00 0.00 0.38 -0.85 -0.18 0.00 0.00 178.31 177.66 1ro7 n GLU 36 N -2.49 1.78 0.05 1.51 0.28 -0.78 -4.82 120.64 116.16 1ro7 n GLU 36 Ca 0.02 0.63 0.13 0.00 -0.16 0.00 0.00 57.16 57.77 1ro7 n GLU 36 Cb 0.25 -2.14 0.48 0.00 1.43 0.00 0.00 31.44 31.46 1ro7 n GLU 36 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1ro7 n ASP 37 N 1.25 0.42 -4.03 -1.84 5.75 -1.26 -4.84 116.55 112.00 1ro7 n ASP 37 Ca 0.08 0.48 -0.09 0.00 -0.01 0.00 0.00 54.79 55.25 1ro7 n ASP 37 Cb 0.33 -0.56 -0.09 0.00 -1.03 0.00 0.00 41.12 39.77 1ro7 n ASP 37 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1ro7 s LYS 38 N -3.05 0.87 -1.33 0.11 1.02 -1.26 -3.54 119.74 112.55 1ro7 s LYS 38 Ca 0.12 -1.22 -0.12 0.00 0.02 0.00 0.00 55.97 54.77 1ro7 s LYS 38 Cb 0.16 0.28 0.12 0.00 -0.52 0.00 0.00 37.83 37.87 1ro7 s LYS 38 CO 0.58 -0.26 1.92 0.66 -0.92 0.00 0.00 175.35 177.33 1ro7 n TYR 39 N -0.06 3.57 0.13 3.18 4.02 -0.07 -4.78 117.16 123.15 1ro7 n TYR 39 Ca -0.10 -2.93 0.19 0.00 -0.01 0.00 0.00 57.90 55.05 1ro7 n TYR 39 Cb 0.63 -2.25 0.76 0.00 -0.02 0.00 0.00 39.34 38.46 1ro7 n TYR 39 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 176.86 177.73 1ro7 h TYR 40 N 6.19 0.00 0.00 -0.72 0.05 -1.92 -2.31 116.97 118.26 1ro7 h TYR 40 Ca 0.45 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.21 1ro7 h TYR 40 Cb 0.69 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.38 1ro7 h TYR 40 CO 1.32 0.00 -0.42 1.28 -1.05 0.00 0.00 178.16 179.29 1ro7 n LEU 41 N -3.63 0.96 0.00 3.88 4.77 -1.26 -4.99 117.00 116.72 1ro7 n LEU 41 Ca 0.06 -1.89 0.00 0.00 -0.03 0.00 0.00 56.01 54.14 1ro7 n LEU 41 Cb 0.56 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1ro7 n LEU 41 CO 0.26 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1ro7 n GLY 42 N -0.42 -0.96 0.11 -0.72 0.00 -0.87 -4.69 105.19 97.64 1ro7 n GLY 42 Ca 0.06 -1.65 0.12 0.00 0.00 0.00 0.00 46.02 44.55 1ro7 n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ro7 h LYS 43 N 0.00 0.00 -5.39 1.61 1.57 -1.88 -3.46 116.57 109.02 1ro7 h LYS 43 Ca 0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 1ro7 h LYS 43 Cb 0.00 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.18 1ro7 h LYS 43 CO 0.00 0.00 0.05 0.21 -0.57 0.00 0.00 179.45 179.14 1ro7 s LYS 44 N -3.26 3.89 -0.05 3.15 2.47 -1.26 -1.54 119.74 123.14 1ro7 s LYS 44 Ca 0.03 0.20 0.01 0.00 -1.56 0.00 0.00 55.97 54.65 1ro7 s LYS 44 Cb 0.10 -3.72 -0.03 0.00 -1.46 0.00 0.00 37.83 32.72 1ro7 s LYS 44 CO 0.74 -0.52 -0.05 0.00 0.16 0.00 0.00 175.35 175.68 1ro7 h LYS 46 N 5.01 0.53 -2.87 0.00 1.63 -0.42 -2.66 116.57 117.79 1ro7 h LYS 46 Ca -0.49 -0.89 -0.11 0.00 -0.85 0.00 0.00 60.65 58.31 1ro7 h LYS 46 Cb 1.18 0.33 -0.20 0.00 -0.60 0.00 0.00 32.23 32.93 1ro7 h LYS 46 CO 0.53 1.43 -0.21 0.00 -3.45 0.00 0.00 179.45 177.75 1ro7 s ALA 47 N -2.62 -0.94 -0.02 5.00 0.00 -1.08 -0.87 121.76 121.22 1ro7 s ALA 47 Ca -0.09 0.53 0.05 0.00 0.00 0.00 0.00 51.96 52.46 1ro7 s ALA 47 Cb 0.04 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 1ro7 s ALA 47 CO 0.94 -0.27 -0.18 0.14 0.00 0.00 0.00 175.76 176.39 1ro7 s VAL 48 N -1.19 1.46 -0.08 0.00 -7.23 -0.93 -1.57 120.40 110.86 1ro7 s VAL 48 Ca -0.12 -0.77 0.03 0.00 -1.81 0.00 0.00 61.98 59.31 1ro7 s VAL 48 Cb -0.04 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.66 1ro7 s VAL 48 CO 0.05 0.42 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.72 1ro7 s PHE 49 N -0.31 2.65 -0.00 2.82 0.40 0.26 -4.43 117.98 119.37 1ro7 s PHE 49 Ca 0.04 -0.54 0.04 0.00 -0.60 0.00 0.00 56.93 55.87 1ro7 s PHE 49 Cb -0.08 -1.69 -0.01 0.00 0.51 0.00 0.00 43.02 41.74 1ro7 s PHE 49 CO 0.00 -0.10 -0.12 0.71 0.70 0.00 0.00 175.22 176.41 1ro7 s TYR 50 N -0.14 1.07 0.52 0.36 4.12 -1.26 -0.35 117.35 121.66 1ro7 s TYR 50 Ca -0.02 -0.22 -0.20 0.00 0.02 0.00 0.00 57.07 56.65 1ro7 s TYR 50 Cb -0.14 -0.68 -0.07 0.00 -1.52 0.00 0.00 41.96 39.56 1ro7 s TYR 50 CO 0.04 -0.01 1.09 -0.80 0.02 0.00 0.00 175.55 175.89 1ro7 s ASN 51 N -0.40 5.97 0.35 2.29 0.01 -1.26 -1.10 114.94 120.80 1ro7 s ASN 51 Ca 0.04 2.07 0.06 0.00 -0.71 0.00 0.00 52.86 54.32 1ro7 s ASN 51 Cb -0.05 -2.57 0.73 0.00 0.41 0.00 0.00 41.25 39.77 1ro7 s ASN 51 CO -0.00 -1.04 1.91 -0.65 -1.51 0.00 0.00 177.10 175.81 1ro7 h PRO 52 N 1.33 0.76 -0.69 -0.60 0.11 -1.93 -1.48 132.00 129.51 1ro7 h PRO 52 Ca -0.50 -0.05 0.15 0.00 0.11 0.00 0.00 66.00 65.72 1ro7 h PRO 52 Cb 1.24 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 1ro7 h PRO 52 CO 0.58 0.50 0.47 0.66 -0.21 0.00 0.00 178.00 180.00 1ro7 h SER 53 N 0.78 0.27 0.00 -2.05 4.64 -1.92 -2.83 113.55 112.45 1ro7 h SER 53 Ca 0.39 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1ro7 h SER 53 Cb 0.45 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1ro7 h SER 53 CO -0.16 0.14 -0.12 0.18 -0.87 0.00 0.00 176.83 176.00 1ro7 n LEU 54 N -4.44 1.58 -0.27 5.97 4.77 -0.98 -4.80 117.00 118.83 1ro7 n LEU 54 Ca 0.13 -2.23 -0.01 0.00 -0.03 0.00 0.00 56.01 53.87 1ro7 n LEU 54 Cb 0.56 -0.24 0.11 0.00 -2.33 0.00 0.00 43.42 41.52 1ro7 n LEU 54 CO 0.34 0.52 1.14 0.15 -1.33 0.00 0.00 177.39 178.22 1ro7 h PHE 55 N 0.00 0.84 -0.37 -1.77 3.57 -1.02 -0.47 116.94 117.72 1ro7 h PHE 55 Ca 0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1ro7 h PHE 55 Cb 1.02 -0.27 -0.08 0.00 2.79 0.00 0.00 35.95 39.42 1ro7 h PHE 55 CO 0.02 0.43 -0.17 0.35 -2.23 0.00 0.00 178.31 176.71 1ro7 h PHE 56 N 0.84 -0.42 -0.04 0.41 -0.00 -1.87 0.77 116.94 116.62 1ro7 h PHE 56 Ca 0.33 0.04 -0.21 0.00 -0.00 0.00 0.00 57.97 58.13 1ro7 h PHE 56 Cb 0.14 0.24 -0.00 0.00 -0.00 0.00 0.00 35.95 36.34 1ro7 h PHE 56 CO -0.05 -0.25 -0.84 0.93 -0.00 0.00 0.00 178.31 178.10 1ro7 h GLU 57 N -0.11 0.43 -0.34 1.11 3.07 -1.78 -3.03 114.58 113.94 1ro7 h GLU 57 Ca 0.18 -0.41 -0.10 0.00 -0.50 0.00 0.00 59.36 58.53 1ro7 h GLU 57 Cb 0.39 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 1ro7 h GLU 57 CO -0.44 1.06 -0.22 1.96 -1.40 0.00 0.00 179.01 179.97 1ro7 h GLN 58 N 0.27 0.66 -0.16 2.33 1.08 -0.74 -0.40 115.11 118.15 1ro7 h GLN 58 Ca -0.06 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 56.88 1ro7 h GLN 58 Cb 1.45 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.84 1ro7 h GLN 58 CO 0.15 0.83 0.04 -0.92 -0.95 0.00 0.00 178.83 177.97 1ro7 h TYR 59 N 0.58 0.26 -0.16 2.96 3.20 -0.90 0.25 116.97 123.17 1ro7 h TYR 59 Ca 0.08 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.97 1ro7 h TYR 59 Cb 0.69 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.84 1ro7 h TYR 59 CO 0.03 0.39 -0.14 -0.92 -1.64 0.00 0.00 178.16 175.87 1ro7 h TYR 60 N 0.06 -0.36 -0.56 -3.82 -0.00 -1.38 -1.96 116.97 108.95 1ro7 h TYR 60 Ca 0.05 0.02 -0.00 0.00 -0.00 0.00 0.00 58.73 58.80 1ro7 h TYR 60 Cb 0.26 0.19 -0.03 0.00 -0.00 0.00 0.00 36.73 37.14 1ro7 h TYR 60 CO 0.01 -0.21 0.33 1.15 -0.00 0.00 0.00 178.16 179.44 1ro7 h THR 61 N -0.16 1.17 -0.67 1.81 2.02 -0.87 -2.80 112.91 113.41 1ro7 h THR 61 Ca 0.10 -0.39 0.07 0.00 0.77 0.00 0.00 66.41 66.96 1ro7 h THR 61 Cb 0.31 0.42 -0.06 0.00 -1.74 0.00 0.00 68.15 67.08 1ro7 h THR 61 CO -0.26 0.18 0.36 0.25 0.37 0.00 0.00 175.52 176.42 1ro7 h LEU 62 N 0.75 0.52 -1.41 2.58 5.85 -0.03 -0.28 115.31 123.30 1ro7 h LEU 62 Ca 0.20 0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.00 1ro7 h LEU 62 Cb -0.00 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 1ro7 h LEU 62 CO -0.04 0.33 0.43 0.11 -0.34 0.00 0.00 178.44 178.93 1ro7 h LYS 63 N 0.66 0.74 -0.23 1.25 1.79 -1.11 0.38 116.57 120.04 1ro7 h LYS 63 Ca 0.31 -0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 58.61 1ro7 h LYS 63 Cb 0.23 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1ro7 h LYS 63 CO -0.20 0.49 -0.36 0.45 -1.08 0.00 0.00 179.45 178.74 1ro7 h HIS 64 N 0.76 0.81 -0.96 -1.35 3.86 -1.02 -1.35 115.15 115.90 1ro7 h HIS 64 Ca 0.27 -0.28 0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1ro7 h HIS 64 Cb 0.11 -0.16 -0.06 0.00 1.06 0.00 0.00 27.41 28.36 1ro7 h HIS 64 CO -0.00 1.03 0.61 -0.07 0.86 0.00 0.00 177.93 180.36 1ro7 h LEU 65 N 0.36 0.98 -0.13 2.43 3.38 -0.07 0.13 115.31 122.41 1ro7 h LEU 65 Ca 0.02 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1ro7 h LEU 65 Cb 0.95 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1ro7 h LEU 65 CO 0.08 0.63 -0.08 0.40 0.09 0.00 0.00 178.44 179.57 1ro7 h ILE 66 N 1.12 1.33 -0.93 1.22 2.04 -0.87 0.98 117.51 122.40 1ro7 h ILE 66 Ca 0.41 -1.14 0.01 0.00 1.00 0.00 0.00 64.86 65.15 1ro7 h ILE 66 Cb 0.15 1.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 1ro7 h ILE 66 CO -0.17 0.33 0.62 -0.61 0.00 0.00 0.00 178.15 178.32 1ro7 h GLN 67 N -0.08 1.21 0.00 2.37 5.75 -0.77 0.19 115.11 123.78 1ro7 h GLN 67 Ca 0.03 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1ro7 h GLN 67 Cb 0.55 -0.27 0.00 0.00 1.07 0.00 0.00 27.48 28.83 1ro7 h GLN 67 CO 0.02 0.80 0.00 0.09 -2.65 0.00 0.00 178.83 177.09 1ro7 n ASN 68 N -4.40 0.00 -1.73 -0.69 4.13 0.43 -4.88 115.26 108.11 1ro7 n ASN 68 Ca 0.11 0.07 -0.16 0.00 1.68 0.00 0.00 54.58 56.28 1ro7 n ASN 68 Cb 0.03 -0.32 -0.02 0.00 -1.54 0.00 0.00 39.78 37.93 1ro7 n ASN 68 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ro7 n GLN 69 N -1.32 -1.25 0.08 3.52 6.02 0.05 -4.90 117.38 119.58 1ro7 n GLN 69 Ca 0.09 0.81 -0.15 0.00 -0.01 0.00 0.00 57.00 57.74 1ro7 n GLN 69 Cb 0.19 -5.16 -0.14 0.00 1.02 0.00 0.00 30.24 26.15 1ro7 n GLN 69 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1ro7 h GLU 70 N 0.00 0.21 -3.66 -1.09 5.08 -1.03 -3.48 114.58 110.61 1ro7 h GLU 70 Ca -0.37 -0.36 -0.07 0.00 -1.00 0.00 0.00 59.36 57.57 1ro7 h GLU 70 Cb 1.25 0.13 -0.10 0.00 0.50 0.00 0.00 28.75 30.53 1ro7 h GLU 70 CO 0.45 1.11 -0.15 0.71 -1.00 0.00 0.00 179.01 180.13 1ro7 s TYR 71 N -2.65 0.29 -0.02 4.33 1.51 -1.19 -4.79 117.35 114.83 1ro7 s TYR 71 Ca -0.05 -0.64 -0.06 0.00 -1.01 0.00 0.00 57.07 55.31 1ro7 s TYR 71 Cb 0.07 0.15 0.00 0.00 -0.11 0.00 0.00 41.96 42.08 1ro7 s TYR 71 CO 0.86 -0.90 0.13 -1.83 -1.11 0.00 0.00 175.55 172.70 1ro7 s GLU 72 N -3.98 0.36 -0.04 -0.62 -1.05 -0.59 -4.07 118.70 108.72 1ro7 s GLU 72 Ca 0.19 -0.19 -0.08 0.00 -0.15 0.00 0.00 54.97 54.74 1ro7 s GLU 72 Cb 0.00 0.15 0.01 0.00 -0.44 0.00 0.00 34.13 33.86 1ro7 s GLU 72 CO 0.04 -0.08 0.19 -0.08 0.95 0.00 0.00 175.26 176.28 1ro7 s THR 73 N -0.85 0.04 -0.08 1.83 -1.32 -1.26 -0.18 115.64 113.83 1ro7 s THR 73 Ca -0.09 -0.34 -0.16 0.00 -1.21 0.00 0.00 61.69 59.89 1ro7 s THR 73 Cb -0.05 -0.38 -0.29 0.00 -1.51 0.00 0.00 72.50 70.27 1ro7 s THR 73 CO 0.01 -0.19 0.64 -0.08 -2.21 0.00 0.00 174.62 172.79 1ro7 h GLU 74 N 4.97 0.29 -6.81 7.08 4.81 -1.31 -3.47 114.58 120.13 1ro7 h GLU 74 Ca -0.28 -0.50 -0.68 0.00 -0.13 0.00 0.00 59.36 57.77 1ro7 h GLU 74 Cb 1.19 0.19 -0.20 0.00 0.63 0.00 0.00 28.75 30.56 1ro7 h GLU 74 CO 0.39 1.24 -0.83 -0.51 -0.73 0.00 0.00 179.01 178.57 1ro7 s LEU 75 N -7.55 2.52 0.27 1.64 1.43 -0.05 -5.01 118.68 111.93 1ro7 s LEU 75 Ca -0.18 -0.65 0.08 0.00 -1.03 0.00 0.00 54.13 52.35 1ro7 s LEU 75 Cb 0.04 -1.39 -0.06 0.00 0.03 0.00 0.00 46.19 44.82 1ro7 s LEU 75 CO 0.80 0.18 -0.09 -0.63 0.23 0.00 0.00 176.35 176.83 1ro7 s ILE 76 N -1.10 1.81 -0.26 -0.59 1.01 -1.26 -2.19 121.20 118.61 1ro7 s ILE 76 Ca 0.16 -2.18 -0.10 0.00 0.00 0.00 0.00 60.65 58.53 1ro7 s ILE 76 Cb -0.10 -2.37 0.11 0.00 0.01 0.00 0.00 42.46 40.11 1ro7 s ILE 76 CO 0.08 -0.36 0.58 0.00 0.00 0.00 0.00 174.94 175.24 1ro7 n SER 79 N 5.20 4.13 -4.88 0.00 7.64 -0.26 0.20 113.62 125.65 1ro7 n SER 79 Ca -0.13 -2.84 -0.21 0.00 1.01 0.00 0.00 58.87 56.70 1ro7 n SER 79 Cb 0.51 -1.66 -0.03 0.00 -1.01 0.00 0.00 64.21 62.02 1ro7 n SER 79 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ro7 s ASN 80 N 4.24 5.58 0.00 6.43 4.22 -1.26 -4.43 114.94 129.73 1ro7 s ASN 80 Ca 0.54 -0.31 0.00 0.00 -2.14 0.00 0.00 52.86 50.95 1ro7 s ASN 80 Cb 0.08 -1.24 0.00 0.00 1.28 0.00 0.00 41.25 41.37 1ro7 s ASN 80 CO 0.04 -0.24 0.27 -1.22 -2.04 0.00 0.00 177.10 173.90 1ro7 n TYR 81 N -1.37 0.00 -3.38 1.54 4.01 -1.26 -3.66 117.16 113.04 1ro7 n TYR 81 Ca -0.04 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.53 1ro7 n TYR 81 Cb 0.59 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.70 1ro7 n TYR 81 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1ro7 n ASN 82 N -0.07 -2.22 -3.86 7.72 4.13 -1.26 -5.02 115.26 114.69 1ro7 n ASN 82 Ca 0.00 -0.61 -0.24 0.00 1.68 0.00 0.00 54.58 55.41 1ro7 n ASN 82 Cb 0.09 -5.01 -0.17 0.00 -1.54 0.00 0.00 39.78 33.15 1ro7 n ASN 82 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1ro7 s GLN 83 N -5.28 1.11 0.51 3.52 -1.52 -1.26 -5.04 119.66 111.70 1ro7 s GLN 83 Ca 0.02 -0.11 0.20 0.00 -1.95 0.00 0.00 55.36 53.52 1ro7 s GLN 83 Cb -0.00 -1.25 1.30 0.00 -0.22 0.00 0.00 33.01 32.84 1ro7 s GLN 83 CO 0.71 -0.24 2.05 0.00 -0.25 0.00 0.00 175.29 177.56 1ro7 h ALA 84 N 8.02 2.26 -0.01 6.09 0.00 -1.96 -0.85 119.26 132.82 1ro7 h ALA 84 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1ro7 h ALA 84 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1ro7 h ALA 84 CO 0.37 -0.35 -0.16 -2.39 0.00 0.00 0.00 179.25 176.71 1ro7 n HIS 85 N -4.45 0.00 -0.06 0.00 1.44 -1.26 -4.00 115.22 106.90 1ro7 n HIS 85 Ca 0.05 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.72 1ro7 n HIS 85 Cb 0.39 -0.15 -0.11 0.00 0.12 0.00 0.00 29.99 30.24 1ro7 n HIS 85 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1ro7 n LEU 86 N -0.78 0.00 -3.76 2.39 4.77 -0.38 -5.06 117.00 114.17 1ro7 n LEU 86 Ca 0.14 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 1ro7 n LEU 86 Cb 0.31 0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 41.63 1ro7 n LEU 86 CO 0.24 0.29 0.15 -1.83 -1.33 0.00 0.00 177.39 174.90 1ro7 s GLU 87 N -2.46 1.19 0.04 3.23 1.03 -0.84 -4.87 118.70 116.02 1ro7 s GLU 87 Ca -0.07 -0.89 -0.31 0.00 0.03 0.00 0.00 54.97 53.74 1ro7 s GLU 87 Cb 0.05 0.46 -0.07 0.00 -0.80 0.00 0.00 34.13 33.78 1ro7 s GLU 87 CO 0.58 -0.47 1.42 1.21 -1.33 0.00 0.00 175.26 176.67 1ro7 s ASN 88 N -2.87 6.82 0.08 0.83 3.84 -1.26 -4.50 114.94 117.88 1ro7 s ASN 88 Ca 0.09 2.22 -0.21 0.00 0.21 0.00 0.00 52.86 55.17 1ro7 s ASN 88 Cb 0.01 -2.57 -0.10 0.00 -0.55 0.00 0.00 41.25 38.04 1ro7 s ASN 88 CO -0.06 -0.71 1.61 -0.33 -2.79 0.00 0.00 177.10 174.82 1ro7 h GLU 89 N 7.58 0.26 -0.14 0.43 5.08 -1.92 -2.73 114.58 123.14 1ro7 h GLU 89 Ca -0.40 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 57.87 1ro7 h GLU 89 Cb 1.19 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1ro7 h GLU 89 CO 0.89 0.35 -0.12 -0.97 -1.00 0.00 0.00 179.01 178.16 1ro7 h ASN 90 N 0.11 0.20 -0.34 1.42 -0.73 -1.92 -0.84 115.58 113.48 1ro7 h ASN 90 Ca 0.06 -0.04 0.02 0.00 1.87 0.00 0.00 56.30 58.21 1ro7 h ASN 90 Cb 0.20 -0.05 -0.03 0.00 0.27 0.00 0.00 38.32 38.71 1ro7 h ASN 90 CO -0.00 0.35 0.18 0.15 -0.37 0.00 0.00 177.43 177.74 1ro7 h PHE 91 N 0.21 0.34 -0.30 0.67 3.57 -1.74 -0.92 116.94 118.77 1ro7 h PHE 91 Ca 0.04 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 1ro7 h PHE 91 Cb 0.35 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1ro7 h PHE 91 CO 0.00 0.19 -0.16 0.28 -2.23 0.00 0.00 178.31 176.39 1ro7 h VAL 92 N 0.37 1.30 -0.59 1.41 2.07 -1.14 -1.00 116.25 118.67 1ro7 h VAL 92 Ca 0.14 -1.28 0.06 0.00 0.82 0.00 0.00 66.70 66.44 1ro7 h VAL 92 Cb 0.03 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1ro7 h VAL 92 CO -0.08 0.41 0.30 0.50 0.02 0.00 0.00 177.57 178.71 1ro7 h LYS 93 N 0.38 0.55 -0.34 1.57 3.64 -0.87 -2.88 116.57 118.61 1ro7 h LYS 93 Ca 0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ro7 h LYS 93 Cb 0.69 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1ro7 h LYS 93 CO 0.05 0.36 0.00 0.25 -2.27 0.00 0.00 179.45 177.84 1ro7 n THR 94 N -4.86 0.44 -0.30 1.00 -2.24 -0.38 -4.70 114.28 103.25 1ro7 n THR 94 Ca 0.07 -0.68 -0.08 0.00 -2.27 0.00 0.00 64.05 61.10 1ro7 n THR 94 Cb 0.18 0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 69.28 1ro7 n THR 94 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1ro7 h PHE 95 N 4.16 -1.41 0.00 4.78 3.57 -0.95 -0.87 116.94 126.22 1ro7 h PHE 95 Ca 0.00 0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1ro7 h PHE 95 Cb 0.91 0.73 0.00 0.00 2.79 0.00 0.00 35.95 40.38 1ro7 h PHE 95 CO 0.22 -0.41 0.00 1.88 -2.23 0.00 0.00 178.31 177.77 1ro7 h TYR 96 N -0.13 0.00 0.00 0.41 -1.99 -1.83 0.08 116.97 113.52 1ro7 h TYR 96 Ca 0.21 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.94 1ro7 h TYR 96 Cb 0.54 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 1ro7 h TYR 96 CO -0.83 0.00 -1.12 -0.25 -0.00 0.00 0.00 178.16 175.96 1ro7 n ASP 97 N -2.59 0.74 -0.04 3.88 8.00 -0.36 -2.94 116.55 123.24 1ro7 n ASP 97 Ca -0.01 0.28 -0.04 0.00 0.71 0.00 0.00 54.79 55.73 1ro7 n ASP 97 Cb 0.13 0.63 -0.14 0.00 -0.02 0.00 0.00 41.12 41.72 1ro7 n ASP 97 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1ro7 n TYR 98 N -2.61 0.42 -3.33 1.24 4.02 -0.82 -4.63 117.16 111.47 1ro7 n TYR 98 Ca -0.00 0.15 -0.25 0.00 -0.01 0.00 0.00 57.90 57.78 1ro7 n TYR 98 Cb 0.55 -0.98 -0.08 0.00 -0.02 0.00 0.00 39.34 38.81 1ro7 n TYR 98 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1ro7 n PHE 99 N -2.76 0.96 0.02 -0.72 3.01 -0.05 -4.98 117.46 112.93 1ro7 n PHE 99 Ca -0.20 -3.75 0.22 0.00 1.01 0.00 0.00 57.45 54.73 1ro7 n PHE 99 Cb 0.97 -0.35 0.73 0.00 -0.01 0.00 0.00 39.48 40.82 1ro7 n PHE 99 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1ro7 h PRO 100 N 4.34 0.00 -0.67 -1.08 0.11 -1.76 -1.85 132.00 131.09 1ro7 h PRO 100 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1ro7 h PRO 100 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1ro7 h PRO 100 CO 0.57 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 1ro7 n ASP 101 N -3.98 4.23 -4.85 -2.05 5.75 -1.26 -4.97 116.55 109.42 1ro7 n ASP 101 Ca 0.10 -2.19 -0.26 0.00 -0.01 0.00 0.00 54.79 52.42 1ro7 n ASP 101 Cb 0.68 -0.51 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 1ro7 n ASP 101 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ro7 s ALA 102 N -1.37 4.16 0.04 2.12 0.00 -0.70 -4.51 121.76 121.52 1ro7 s ALA 102 Ca 0.48 -1.41 0.03 0.00 0.00 0.00 0.00 51.96 51.06 1ro7 s ALA 102 Cb 0.28 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 1ro7 s ALA 102 CO 0.29 -0.31 -0.09 -1.01 0.00 0.00 0.00 175.76 174.63 1ro7 s HIS 103 N -2.71 0.80 -0.21 0.00 3.76 0.71 -4.96 115.29 112.67 1ro7 s HIS 103 Ca 0.34 -0.45 -0.25 0.00 -0.15 0.00 0.00 55.06 54.55 1ro7 s HIS 103 Cb -0.00 -0.47 -0.01 0.00 1.11 0.00 0.00 32.58 33.21 1ro7 s HIS 103 CO 0.20 -0.04 0.82 -1.17 -0.85 0.00 0.00 174.74 173.70 1ro7 s LEU 104 N -1.49 4.12 0.51 0.89 2.96 -1.26 -1.10 118.68 123.31 1ro7 s LEU 104 Ca -0.07 1.08 0.20 0.00 -0.22 0.00 0.00 54.13 55.12 1ro7 s LEU 104 Cb -0.09 -3.19 1.34 0.00 0.50 0.00 0.00 46.19 44.74 1ro7 s LEU 104 CO 0.01 -0.46 2.12 1.23 -1.32 0.00 0.00 176.35 177.93 1ro7 h GLY 105 N 8.81 0.00 2.00 7.98 0.00 -0.55 -1.90 103.07 119.41 1ro7 h GLY 105 Ca -0.26 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1ro7 h GLY 105 CO 0.86 0.00 -0.07 -1.82 0.00 0.00 0.00 176.54 175.51 1ro7 h TYR 106 N 0.00 0.00 -0.33 5.60 -0.00 -1.74 0.15 116.97 120.65 1ro7 h TYR 106 Ca -0.00 0.00 0.10 0.00 -0.00 0.00 0.00 58.73 58.82 1ro7 h TYR 106 Cb 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.85 1ro7 h TYR 106 CO 0.00 0.07 0.26 -0.44 -0.00 0.00 0.00 178.16 178.04 1ro7 h ASP 107 N 0.00 0.00 0.00 -2.11 3.45 -1.69 -0.37 116.42 115.70 1ro7 h ASP 107 Ca -0.00 0.00 -0.36 0.00 0.43 0.00 0.00 57.03 57.10 1ro7 h ASP 107 Cb 0.16 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.87 1ro7 h ASP 107 CO 0.01 0.00 -2.30 0.49 -1.57 0.00 0.00 179.24 175.87 1ro7 n PHE 108 N -4.26 0.00 -0.31 4.55 3.01 -0.38 -4.45 117.46 115.61 1ro7 n PHE 108 Ca 0.05 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.58 1ro7 n PHE 108 Cb 0.43 -0.86 0.23 0.00 -0.01 0.00 0.00 39.48 39.26 1ro7 n PHE 108 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 1ro7 h PHE 109 N -0.25 0.89 0.00 1.38 3.04 -0.87 0.10 116.94 121.22 1ro7 h PHE 109 Ca -0.53 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.45 1ro7 h PHE 109 Cb 1.71 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 39.96 1ro7 h PHE 109 CO -0.00 0.26 0.00 0.36 -2.02 0.00 0.00 178.31 176.91 1ro7 n LYS 110 N -4.79 0.11 0.28 1.11 2.85 -0.16 -2.00 118.16 115.57 1ro7 n LYS 110 Ca 0.18 0.37 0.17 0.00 -1.05 0.00 0.00 58.31 57.98 1ro7 n LYS 110 Cb 0.41 -1.72 0.74 0.00 -0.65 0.00 0.00 35.03 33.81 1ro7 n LYS 110 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1ro7 h GLN 111 N 0.00 0.00 -3.87 -1.58 4.20 -1.18 -3.29 115.11 109.39 1ro7 h GLN 111 Ca 0.00 0.00 -0.78 0.00 0.06 0.00 0.00 58.65 57.93 1ro7 h GLN 111 Cb 0.30 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 27.82 1ro7 h GLN 111 CO 0.00 0.02 0.68 -0.51 -0.67 0.00 0.00 178.83 178.35 1ro7 s LEU 112 N -6.25 6.02 0.17 1.46 1.43 -0.84 -4.90 118.68 115.77 1ro7 s LEU 112 Ca 0.00 -3.45 -0.16 0.00 -1.03 0.00 0.00 54.13 49.49 1ro7 s LEU 112 Cb 0.10 -2.26 0.13 0.00 0.03 0.00 0.00 46.19 44.18 1ro7 s LEU 112 CO 0.53 -0.40 1.67 0.50 0.23 0.00 0.00 176.35 178.89 1ro7 h LYS 113 N 6.78 0.04 -0.98 1.70 3.64 -1.82 -0.09 116.57 125.83 1ro7 h LYS 113 Ca 0.21 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1ro7 h LYS 113 Cb 0.87 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.63 1ro7 h LYS 113 CO 1.07 0.03 0.65 -0.44 -2.27 0.00 0.00 179.45 178.49 1ro7 h ASP 114 N 0.04 1.10 0.27 4.20 5.19 -1.93 -1.22 116.42 124.07 1ro7 h ASP 114 Ca 0.21 -0.02 -0.26 0.00 -0.62 0.00 0.00 57.03 56.34 1ro7 h ASP 114 Cb 0.32 -0.27 0.01 0.00 0.18 0.00 0.00 39.33 39.58 1ro7 h ASP 114 CO -0.41 0.78 -1.08 0.15 -3.12 0.00 0.00 179.24 175.56 1ro7 h PHE 115 N 1.29 0.78 -0.57 4.55 3.57 -1.82 -1.50 116.94 123.24 1ro7 h PHE 115 Ca 0.38 -0.46 0.03 0.00 3.53 0.00 0.00 57.97 61.45 1ro7 h PHE 115 Cb -0.08 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 1ro7 h PHE 115 CO -0.00 1.30 0.33 -0.97 -2.23 0.00 0.00 178.31 176.74 1ro7 h ASN 116 N 0.25 0.52 -0.64 0.41 -1.24 -0.78 0.42 115.58 114.52 1ro7 h ASN 116 Ca -0.12 0.01 -0.04 0.00 0.71 0.00 0.00 56.30 56.86 1ro7 h ASN 116 Cb 1.74 -0.10 -0.03 0.00 0.73 0.00 0.00 38.32 40.66 1ro7 h ASN 116 CO 0.20 0.36 0.24 0.00 -1.29 0.00 0.00 177.43 176.94 1ro7 h ALA 117 N 1.26 0.83 0.04 1.57 0.00 -1.19 -0.25 119.26 121.53 1ro7 h ALA 117 Ca 0.24 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ro7 h ALA 117 Cb 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ro7 h ALA 117 CO -0.12 0.47 -0.02 -0.92 0.00 0.00 0.00 179.25 178.66 1ro7 h TYR 118 N 0.91 -0.05 0.14 0.00 5.03 -0.27 -1.44 116.97 121.27 1ro7 h TYR 118 Ca 0.21 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.51 1ro7 h TYR 118 Cb 0.23 0.02 -0.00 0.00 1.55 0.00 0.00 36.73 38.53 1ro7 h TYR 118 CO 0.01 0.02 -0.07 0.35 -1.32 0.00 0.00 178.16 177.15 1ro7 h PHE 119 N -0.12 -0.19 -0.57 -3.82 3.57 0.02 -2.83 116.94 113.00 1ro7 h PHE 119 Ca -0.01 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.51 1ro7 h PHE 119 Cb 0.10 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 1ro7 h PHE 119 CO -0.06 -0.12 0.36 0.87 -2.23 0.00 0.00 178.31 177.13 1ro7 h LYS 120 N -0.20 0.69 -0.29 1.11 1.79 -1.01 -1.29 116.57 117.38 1ro7 h LYS 120 Ca -0.02 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1ro7 h LYS 120 Cb 0.16 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1ro7 h LYS 120 CO 0.02 0.46 0.19 0.35 -1.08 0.00 0.00 179.45 179.39 1ro7 h PHE 121 N 0.71 0.35 -0.05 -1.35 3.04 -1.21 0.50 116.94 118.93 1ro7 h PHE 121 Ca 0.22 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 62.06 1ro7 h PHE 121 Cb -0.01 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.37 1ro7 h PHE 121 CO -0.05 0.22 -0.53 0.45 -2.02 0.00 0.00 178.31 176.38 1ro7 h HIS 122 N 0.38 0.19 0.01 0.41 3.86 -1.34 -1.74 115.15 116.92 1ro7 h HIS 122 Ca 0.11 -0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 1ro7 h HIS 122 Cb -0.04 -0.04 0.01 0.00 1.06 0.00 0.00 27.41 28.40 1ro7 h HIS 122 CO -0.06 0.65 -0.26 1.49 0.86 0.00 0.00 177.93 180.62 1ro7 h GLU 123 N 0.12 0.15 0.20 2.45 4.22 -1.00 -0.14 114.58 120.57 1ro7 h GLU 123 Ca 0.00 -0.18 -0.01 0.00 0.08 0.00 0.00 59.36 59.25 1ro7 h GLU 123 Cb 0.98 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1ro7 h GLU 123 CO 0.08 0.96 -0.10 0.82 -2.18 0.00 0.00 179.01 178.59 1ro7 h ILE 124 N -0.59 0.87 0.00 2.32 2.04 -0.94 -1.96 117.51 119.25 1ro7 h ILE 124 Ca -0.04 -0.38 -0.16 0.00 1.00 0.00 0.00 64.86 65.28 1ro7 h ILE 124 Cb 1.06 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 1ro7 h ILE 124 CO 0.05 0.09 -1.38 1.88 0.00 0.00 0.00 178.15 178.78 1ro7 h TYR 125 N -0.46 0.00 0.00 1.37 -1.99 -1.47 -3.40 116.97 111.03 1ro7 h TYR 125 Ca -0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.70 1ro7 h TYR 125 Cb 0.35 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.08 1ro7 h TYR 125 CO -0.01 0.56 0.00 1.19 -0.00 0.00 0.00 178.16 179.90 1ro7 n PHE 126 N -2.89 0.00 -2.06 4.88 3.01 -0.49 -5.00 117.46 114.92 1ro7 n PHE 126 Ca -0.09 -0.15 -0.21 0.00 1.01 0.00 0.00 57.45 58.01 1ro7 n PHE 126 Cb 0.83 -0.02 -0.04 0.00 -0.01 0.00 0.00 39.48 40.24 1ro7 n PHE 126 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1ro7 n ASN 127 N -0.15 -5.73 -4.65 4.37 5.15 -0.40 -4.92 115.26 108.92 1ro7 n ASN 127 Ca 0.00 0.21 -0.39 0.00 -0.60 0.00 0.00 54.58 53.80 1ro7 n ASN 127 Cb 0.08 -4.87 -0.08 0.00 -0.53 0.00 0.00 39.78 34.38 1ro7 n ASN 127 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1ro7 s GLN 128 N -4.49 4.13 -0.05 1.20 -0.21 -0.20 -3.31 119.66 116.72 1ro7 s GLN 128 Ca 0.00 0.18 0.05 0.00 0.02 0.00 0.00 55.36 55.62 1ro7 s GLN 128 Cb 0.00 -3.57 -0.01 0.00 1.00 0.00 0.00 33.01 30.43 1ro7 s GLN 128 CO 0.00 -0.13 -0.21 0.50 -2.12 0.00 0.00 175.29 173.33 1ro7 s ARG 129 N 1.59 2.23 0.57 2.91 3.52 -1.26 -2.65 118.95 125.85 1ro7 s ARG 129 Ca 0.18 -0.77 -0.14 0.00 -0.13 0.00 0.00 55.73 54.88 1ro7 s ARG 129 Cb -0.15 -1.89 -0.06 0.00 -1.56 0.00 0.00 34.95 31.29 1ro7 s ARG 129 CO 0.08 0.31 1.01 0.96 -0.81 0.00 0.00 175.30 176.85 1ro7 s ILE 130 N -0.05 4.59 0.63 4.11 -4.36 -1.26 -2.36 121.20 122.50 1ro7 s ILE 130 Ca -0.04 1.03 -0.05 0.00 -0.26 0.00 0.00 60.65 61.33 1ro7 s ILE 130 Cb -0.13 -3.78 0.04 0.00 1.25 0.00 0.00 42.46 39.84 1ro7 s ILE 130 CO 0.03 -0.92 0.93 0.42 0.24 0.00 0.00 174.94 175.64 1ro7 s THR 131 N -2.90 2.90 0.49 8.37 -4.23 -1.26 -4.90 115.64 114.11 1ro7 s THR 131 Ca 0.57 -0.23 0.19 0.00 -1.18 0.00 0.00 61.69 61.03 1ro7 s THR 131 Cb -0.11 -3.19 0.35 0.00 1.34 0.00 0.00 72.50 70.89 1ro7 s THR 131 CO 0.43 -0.18 2.01 0.28 -0.54 0.00 0.00 174.62 176.62 1ro7 h SER 132 N -0.31 0.17 -0.94 3.99 0.02 -1.98 -0.74 113.55 113.75 1ro7 h SER 132 Ca -0.45 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.55 1ro7 h SER 132 Cb 1.29 -0.03 -0.06 0.00 0.14 0.00 0.00 62.40 63.74 1ro7 h SER 132 CO 0.59 0.10 0.61 1.23 -1.14 0.00 0.00 176.83 178.22 1ro7 h GLY 133 N 0.18 1.38 1.52 -3.77 0.00 -1.93 -2.38 103.07 98.08 1ro7 h GLY 133 Ca 0.23 -0.46 -0.25 0.00 0.00 0.00 0.00 47.33 46.84 1ro7 h GLY 133 CO -0.04 0.38 -1.08 -2.08 0.00 0.00 0.00 176.54 173.73 1ro7 h VAL 134 N 1.17 1.41 0.00 4.60 2.07 -1.53 -2.88 116.25 121.09 1ro7 h VAL 134 Ca 0.38 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 65.28 1ro7 h VAL 134 Cb 0.03 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1ro7 h VAL 134 CO -0.13 0.78 0.00 0.00 0.02 0.00 0.00 177.57 178.24 1ro7 n TYR 135 N -3.69 0.00 0.00 1.57 4.19 -0.80 -1.77 117.16 116.66 1ro7 n TYR 135 Ca -0.08 -0.02 0.00 0.00 3.31 0.00 0.00 57.90 61.11 1ro7 n TYR 135 Cb 0.91 -0.10 0.00 0.00 0.49 0.00 0.00 39.34 40.64 1ro7 n TYR 135 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1ro7 h ALA 138 N 0.00 0.27 -0.52 0.00 0.00 -1.66 -0.47 119.26 116.89 1ro7 h ALA 138 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1ro7 h ALA 138 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ro7 h ALA 138 CO 0.00 -0.35 0.14 0.28 0.00 0.00 0.00 179.25 179.32 1ro7 h VAL 139 N 0.18 1.22 -0.36 0.00 2.07 -1.61 -0.02 116.25 117.72 1ro7 h VAL 139 Ca 0.11 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 1ro7 h VAL 139 Cb 0.09 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1ro7 h VAL 139 CO -0.13 0.28 0.13 0.00 0.02 0.00 0.00 177.57 177.88 1ro7 h ALA 140 N 1.39 0.47 -0.69 1.67 0.00 -1.69 -0.45 119.26 119.96 1ro7 h ALA 140 Ca 0.17 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ro7 h ALA 140 Cb 0.26 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1ro7 h ALA 140 CO -0.00 0.09 0.39 0.82 0.00 0.00 0.00 179.25 180.54 1ro7 h ILE 141 N 0.44 1.21 -0.17 0.00 2.04 -0.67 -1.70 117.51 118.66 1ro7 h ILE 141 Ca 0.12 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 1ro7 h ILE 141 Cb 0.21 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1ro7 h ILE 141 CO -0.01 0.23 -0.07 0.00 0.00 0.00 0.00 178.15 178.30 1ro7 h ALA 142 N 1.20 1.57 0.00 1.87 0.00 -0.69 -1.50 119.26 121.72 1ro7 h ALA 142 Ca 0.25 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ro7 h ALA 142 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ro7 h ALA 142 CO -0.04 0.31 0.00 1.28 0.00 0.00 0.00 179.25 180.80 1ro7 n LEU 143 N -4.32 0.00 0.00 0.00 4.77 -0.21 -4.91 117.00 112.33 1ro7 n LEU 143 Ca -0.01 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1ro7 n LEU 143 Cb 0.23 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1ro7 n LEU 143 CO 0.37 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1ro7 n GLY 144 N 1.23 0.66 3.77 -0.72 0.00 -0.56 -5.07 105.19 104.48 1ro7 n GLY 144 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1ro7 n GLY 144 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ro7 s TYR 145 N -2.00 2.82 -0.06 1.61 2.02 -0.75 -4.94 117.35 116.04 1ro7 s TYR 145 Ca 0.00 1.15 0.10 0.00 -0.37 0.00 0.00 57.07 57.95 1ro7 s TYR 145 Cb 0.00 -3.90 -0.15 0.00 -0.40 0.00 0.00 41.96 37.52 1ro7 s TYR 145 CO 0.00 -2.71 0.13 1.63 -1.57 0.00 0.00 175.55 173.03 1ro7 n LYS 146 N 1.17 1.43 -4.03 -0.62 4.76 -1.26 -4.46 118.16 115.15 1ro7 n LYS 146 Ca 0.03 -0.05 -0.31 0.00 -2.87 0.00 0.00 58.31 55.11 1ro7 n LYS 146 Cb 0.40 -1.26 -0.15 0.00 -1.84 0.00 0.00 35.03 32.17 1ro7 n LYS 146 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1ro7 s GLU 147 N -2.48 2.08 -0.20 1.97 2.02 -1.26 -0.82 118.70 120.01 1ro7 s GLU 147 Ca -0.05 -1.16 -0.04 0.00 0.02 0.00 0.00 54.97 53.74 1ro7 s GLU 147 Cb 0.05 -2.73 -0.02 0.00 0.10 0.00 0.00 34.13 31.53 1ro7 s GLU 147 CO 0.44 -0.54 -0.03 0.42 0.02 0.00 0.00 175.26 175.56 1ro7 s ILE 148 N 1.23 3.61 -0.24 -1.63 1.01 0.51 -2.39 121.20 123.29 1ro7 s ILE 148 Ca -0.06 -0.43 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 1ro7 s ILE 148 Cb -0.19 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 1ro7 s ILE 148 CO -0.06 0.44 0.09 -0.31 0.00 0.00 0.00 174.94 175.09 1ro7 s TYR 149 N 1.14 3.13 -0.04 3.97 2.02 -0.17 -0.61 117.35 126.79 1ro7 s TYR 149 Ca 0.02 -0.24 -0.04 0.00 -0.37 0.00 0.00 57.07 56.44 1ro7 s TYR 149 Cb -0.15 -2.23 -0.04 0.00 -0.40 0.00 0.00 41.96 39.15 1ro7 s TYR 149 CO 0.00 -0.23 0.16 -0.51 -1.57 0.00 0.00 175.55 173.41 1ro7 s LEU 150 N 1.39 4.33 0.13 -1.29 1.43 0.84 -0.17 118.68 125.34 1ro7 s LEU 150 Ca 0.06 0.36 -0.20 0.00 -1.03 0.00 0.00 54.13 53.32 1ro7 s LEU 150 Cb -0.15 -2.45 0.05 0.00 0.03 0.00 0.00 46.19 43.68 1ro7 s LEU 150 CO 0.04 0.30 0.50 -0.94 0.23 0.00 0.00 176.35 176.48 1ro7 s SER 151 N -1.69 -0.40 -0.81 2.29 1.04 -0.68 -1.25 113.70 112.21 1ro7 s SER 151 Ca 0.24 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.52 1ro7 s SER 151 Cb -0.12 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1ro7 s SER 151 CO 0.15 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 174.08 1ro7 n GLY 152 N -0.25 0.89 3.19 7.32 0.00 -1.26 -0.54 105.19 114.54 1ro7 n GLY 152 Ca -0.17 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 1ro7 n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ro7 s ILE 153 N -2.03 3.50 -0.01 -0.61 1.01 -1.26 -0.42 121.20 121.39 1ro7 s ILE 153 Ca 0.00 -1.62 0.01 0.00 0.00 0.00 0.00 60.65 59.04 1ro7 s ILE 153 Cb 0.00 -3.19 0.02 0.00 0.01 0.00 0.00 42.46 39.29 1ro7 s ILE 153 CO 0.00 -0.44 0.97 0.47 0.00 0.00 0.00 174.94 175.93 1ro7 n ASP 154 N 4.71 1.85 -1.36 3.58 9.92 -1.26 -4.50 116.55 129.48 1ro7 n ASP 154 Ca -0.08 -1.98 -0.14 0.00 -0.53 0.00 0.00 54.79 52.06 1ro7 n ASP 154 Cb 0.43 -0.02 -0.06 0.00 -0.64 0.00 0.00 41.12 40.82 1ro7 n ASP 154 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1ro7 n PHE 155 N -0.51 -0.29 -1.63 1.24 3.72 -1.26 -4.88 117.46 113.86 1ro7 n PHE 155 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 1ro7 n PHE 155 Cb 0.29 -2.69 0.00 0.00 -0.94 0.00 0.00 39.48 36.14 1ro7 n PHE 155 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1ro7 n TYR 156 N -1.95 -4.33 -0.02 1.38 4.02 -1.26 -4.57 117.16 110.43 1ro7 n TYR 156 Ca -0.14 2.34 0.00 0.00 -0.01 0.00 0.00 57.90 60.09 1ro7 n TYR 156 Cb 0.48 -3.56 -0.00 0.00 -0.02 0.00 0.00 39.34 36.23 1ro7 n TYR 156 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1ro7 n SER 161 N -2.12 -0.12 -4.05 7.72 3.41 -1.26 -5.07 113.62 112.12 1ro7 n SER 161 Ca 0.00 0.02 -0.14 0.00 -0.26 0.00 0.00 58.87 58.49 1ro7 n SER 161 Cb 0.34 -0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.12 1ro7 n SER 161 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1ro7 s TYR 162 N -2.90 1.34 -1.21 7.33 2.02 -1.26 -4.45 117.35 118.22 1ro7 s TYR 162 Ca 0.00 -1.40 0.01 0.00 -0.37 0.00 0.00 57.07 55.30 1ro7 s TYR 162 Cb 0.00 -0.65 0.04 0.00 -0.40 0.00 0.00 41.96 40.95 1ro7 s TYR 162 CO 0.00 -0.63 0.67 0.00 -1.57 0.00 0.00 175.55 174.02 1ro7 n ALA 163 N -0.38 2.55 -3.74 3.71 0.00 -0.52 -4.22 120.51 117.90 1ro7 n ALA 163 Ca 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 53.44 53.36 1ro7 n ALA 163 Cb 0.65 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.09 1ro7 n ALA 163 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1ro7 s PHE 164 N -1.29 -0.09 -0.43 0.00 -0.71 -1.26 -4.68 117.98 109.52 1ro7 s PHE 164 Ca 0.03 -0.19 -0.27 0.00 -1.04 0.00 0.00 56.93 55.46 1ro7 s PHE 164 Cb 0.02 0.63 0.02 0.00 -1.21 0.00 0.00 43.02 42.48 1ro7 s PHE 164 CO 0.01 -0.74 0.98 0.34 -1.34 0.00 0.00 175.22 174.48 1ro7 s ASP 165 N -3.00 6.61 0.00 1.98 3.68 -1.26 -4.87 116.67 119.81 1ro7 s ASP 165 Ca 0.14 0.39 0.27 0.00 2.13 0.00 0.00 52.55 55.48 1ro7 s ASP 165 Cb -0.00 -2.48 0.87 0.00 -1.45 0.00 0.00 42.92 39.85 1ro7 s ASP 165 CO 0.02 -1.03 1.64 1.07 0.13 0.00 0.00 175.17 176.99 1ro7 n THR 166 N 6.36 0.00 -1.52 1.71 5.66 -1.26 -4.65 114.28 120.59 1ro7 n THR 166 Ca 0.08 -0.28 -0.41 0.00 -3.05 0.00 0.00 64.05 60.39 1ro7 n THR 166 Cb 0.48 0.66 -0.02 0.00 -1.55 0.00 0.00 70.33 69.91 1ro7 n THR 166 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1ro7 n LYS 167 N 0.27 2.55 -4.03 1.09 3.00 -1.26 -4.82 118.16 114.96 1ro7 n LYS 167 Ca 0.17 -2.34 -0.32 0.00 -0.00 0.00 0.00 58.31 55.82 1ro7 n LYS 167 Cb 0.39 -3.13 -0.06 0.00 0.00 0.00 0.00 35.03 32.23 1ro7 n LYS 167 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1ro7 s GLN 168 N 3.58 3.14 0.05 1.64 1.11 -1.26 -5.00 119.66 122.92 1ro7 s GLN 168 Ca 0.51 -0.50 -0.16 0.00 0.01 0.00 0.00 55.36 55.23 1ro7 s GLN 168 Cb 0.14 -2.89 -0.06 0.00 -1.01 0.00 0.00 33.01 29.19 1ro7 s GLN 168 CO -0.03 0.63 1.25 0.87 0.01 0.00 0.00 175.29 178.02 1ro7 h LYS 169 N 3.74 -0.26 -0.71 2.91 1.79 -1.96 0.26 116.57 122.33 1ro7 h LYS 169 Ca -0.48 0.02 0.08 0.00 -2.18 0.00 0.00 60.65 58.08 1ro7 h LYS 169 Cb 1.18 0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 31.82 1ro7 h LYS 169 CO 0.66 -0.18 0.39 -0.91 -1.08 0.00 0.00 179.45 178.33 1ro7 h ASN 170 N -0.27 0.55 -0.69 0.86 2.35 -1.97 -0.34 115.58 116.08 1ro7 h ASN 170 Ca 0.01 0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.73 1ro7 h ASN 170 Cb 0.31 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 1ro7 h ASN 170 CO -0.20 0.34 0.14 0.25 -1.65 0.00 0.00 177.43 176.31 1ro7 h LEU 171 N 0.69 1.07 -0.99 1.61 5.85 -1.76 -2.08 115.31 119.70 1ro7 h LEU 171 Ca 0.33 -0.24 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1ro7 h LEU 171 Cb 0.27 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1ro7 h LEU 171 CO -0.22 1.04 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.82 1ro7 h LEU 172 N 1.06 0.67 -1.13 2.25 3.38 0.25 0.19 115.31 121.98 1ro7 h LEU 172 Ca 0.21 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1ro7 h LEU 172 Cb 0.41 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ro7 h LEU 172 CO 0.01 0.76 -0.31 0.11 0.09 0.00 0.00 178.44 179.10 1ro7 h LYS 173 N 0.65 0.22 0.18 1.13 1.57 -0.69 -2.65 116.57 116.98 1ro7 h LYS 173 Ca 0.13 -0.08 -0.31 0.00 -1.87 0.00 0.00 60.65 58.51 1ro7 h LYS 173 Cb 0.45 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.76 1ro7 h LYS 173 CO 0.02 0.51 -1.52 -0.07 -0.57 0.00 0.00 179.45 177.82 1ro7 h LEU 174 N 0.20 0.59 -6.43 2.94 3.38 -0.80 -3.43 115.31 111.76 1ro7 h LEU 174 Ca 0.03 -0.92 -0.59 0.00 0.09 0.00 0.00 57.88 56.49 1ro7 h LEU 174 Cb 0.65 -0.19 -0.38 0.00 0.09 0.00 0.00 40.66 40.82 1ro7 h LEU 174 CO 0.05 1.69 -0.94 0.00 0.09 0.00 0.00 178.44 179.33 1ro7 s ALA 175 N -2.54 1.63 0.30 1.53 0.00 0.61 -5.11 121.76 118.18 1ro7 s ALA 175 Ca -0.15 -2.58 0.28 0.00 0.00 0.00 0.00 51.96 49.51 1ro7 s ALA 175 Cb 0.04 -1.65 1.55 0.00 0.00 0.00 0.00 23.12 23.06 1ro7 s ALA 175 CO 0.85 -1.98 1.85 -1.35 0.00 0.00 0.00 175.76 175.12 1ro7 h PRO 176 N 5.62 0.00 0.00 0.00 0.11 -1.69 -3.42 132.00 132.63 1ro7 h PRO 176 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 1ro7 h PRO 176 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1ro7 h PRO 176 CO 0.40 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.60 1ro7 n GLY 187 N -1.21 0.21 7.00 -0.55 0.00 -1.21 -5.08 105.19 104.35 1ro7 n GLY 187 Ca -0.02 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1ro7 n GLY 187 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ro7 n HIS 188 N 0.24 0.00 -1.00 1.61 -0.00 -1.00 -4.82 115.22 110.25 1ro7 n HIS 188 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 1ro7 n HIS 188 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 29.97 1ro7 n HIS 188 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1ro7 n SER 189 N 10.73 -5.42 -0.15 0.41 3.41 -1.26 -3.90 113.62 117.44 1ro7 n SER 189 Ca 0.00 1.14 -0.11 0.00 -0.26 0.00 0.00 58.87 59.64 1ro7 n SER 189 Cb 0.00 -3.11 -0.01 0.00 -0.26 0.00 0.00 64.21 60.83 1ro7 n SER 189 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1ro7 h LYS 190 N -0.29 0.89 -0.38 4.33 3.64 -1.94 -3.16 116.57 119.66 1ro7 h LYS 190 Ca -0.05 -0.36 0.02 0.00 -1.27 0.00 0.00 60.65 58.99 1ro7 h LYS 190 Cb 0.74 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.50 1ro7 h LYS 190 CO 0.02 1.01 0.21 -0.97 -2.27 0.00 0.00 179.45 177.45 1ro7 h ASN 191 N 0.72 0.34 -0.20 4.20 -0.73 -1.99 -0.84 115.58 117.09 1ro7 h ASN 191 Ca 0.11 0.01 0.03 0.00 1.87 0.00 0.00 56.30 58.32 1ro7 h ASN 191 Cb 0.70 -0.06 -0.03 0.00 0.27 0.00 0.00 38.32 39.20 1ro7 h ASN 191 CO 0.05 0.24 -0.01 0.74 -0.37 0.00 0.00 177.43 178.09 1ro7 h THR 192 N 0.43 0.85 -0.50 -3.57 2.02 -1.67 0.24 112.91 110.71 1ro7 h THR 192 Ca 0.15 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.29 1ro7 h THR 192 Cb 0.02 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1ro7 h THR 192 CO -0.08 0.01 0.22 0.44 0.37 0.00 0.00 175.52 176.48 1ro7 h ASP 193 N 0.05 0.68 -0.32 4.18 5.19 -1.48 -0.51 116.42 124.22 1ro7 h ASP 193 Ca 0.09 -0.16 -0.03 0.00 -0.62 0.00 0.00 57.03 56.31 1ro7 h ASP 193 Cb 0.12 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 1ro7 h ASP 193 CO -0.16 0.65 0.07 0.40 -3.12 0.00 0.00 179.24 177.08 1ro7 h ILE 194 N 0.67 1.22 -0.65 0.35 1.08 -0.86 -0.36 117.51 118.97 1ro7 h ILE 194 Ca 0.17 -0.76 -0.05 0.00 -0.39 0.00 0.00 64.86 63.84 1ro7 h ILE 194 Cb 0.17 1.11 -0.03 0.00 -3.07 0.00 0.00 36.82 35.01 1ro7 h ILE 194 CO -0.02 0.25 0.22 0.11 -0.69 0.00 0.00 178.15 178.03 1ro7 h LYS 195 N 0.35 0.98 -0.58 2.37 1.79 -0.44 -1.32 116.57 119.72 1ro7 h LYS 195 Ca 0.10 -0.18 -0.09 0.00 -2.18 0.00 0.00 60.65 58.29 1ro7 h LYS 195 Cb 0.31 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.78 1ro7 h LYS 195 CO 0.00 0.83 -0.00 0.00 -1.08 0.00 0.00 179.45 179.20 1ro7 h ALA 196 N 1.29 0.78 -0.56 3.86 0.00 -0.81 -1.54 119.26 122.27 1ro7 h ALA 196 Ca 0.22 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1ro7 h ALA 196 Cb 0.24 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ro7 h ALA 196 CO -0.01 0.62 -0.03 -0.07 0.00 0.00 0.00 179.25 179.76 1ro7 h LEU 197 N 0.92 1.00 -0.58 0.00 3.38 -0.71 -1.40 115.31 117.91 1ro7 h LEU 197 Ca 0.16 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 1ro7 h LEU 197 Cb 0.55 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1ro7 h LEU 197 CO 0.03 1.08 0.22 -0.33 0.09 0.00 0.00 178.44 179.53 1ro7 h GLU 198 N 0.90 0.88 -0.47 1.13 5.08 -1.12 -0.90 114.58 120.08 1ro7 h GLU 198 Ca 0.16 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ro7 h GLU 198 Cb 0.58 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1ro7 h GLU 198 CO 0.03 0.76 0.30 0.35 -1.00 0.00 0.00 179.01 179.46 1ro7 h PHE 199 N 0.81 0.61 -0.20 4.33 3.04 -1.09 -0.52 116.94 123.92 1ro7 h PHE 199 Ca 0.19 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.15 1ro7 h PHE 199 Cb 0.22 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.52 1ro7 h PHE 199 CO 0.01 0.40 0.11 -0.07 -2.02 0.00 0.00 178.31 176.74 1ro7 h LEU 200 N 0.64 0.24 -0.39 0.59 3.38 -0.92 0.40 115.31 119.26 1ro7 h LEU 200 Ca 0.17 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1ro7 h LEU 200 Cb -0.05 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1ro7 h LEU 200 CO -0.04 0.25 0.22 -0.08 0.09 0.00 0.00 178.44 178.88 1ro7 h GLU 201 N 0.22 0.53 0.06 1.13 4.81 -0.92 -1.76 114.58 118.65 1ro7 h GLU 201 Ca 0.07 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1ro7 h GLU 201 Cb 0.06 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.33 1ro7 h GLU 201 CO -0.01 0.42 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.44 1ro7 h LYS 202 N 0.50 -0.08 -0.61 1.92 3.64 -1.02 -2.22 116.57 118.69 1ro7 h LYS 202 Ca 0.14 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1ro7 h LYS 202 Cb 0.04 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1ro7 h LYS 202 CO -0.02 0.30 0.28 1.15 -2.27 0.00 0.00 179.45 178.88 1ro7 h THR 203 N -0.48 1.22 -0.62 1.00 2.02 -0.91 -3.21 112.91 111.92 1ro7 h THR 203 Ca -0.01 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.53 1ro7 h THR 203 Cb 0.42 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1ro7 h THR 203 CO 0.01 0.26 0.00 -1.22 0.37 0.00 0.00 175.52 174.94 1ro7 n TYR 204 N -4.50 0.93 -4.02 3.16 4.01 -0.67 -4.99 117.16 111.09 1ro7 n TYR 204 Ca 0.04 -0.52 -0.33 0.00 -0.16 0.00 0.00 57.90 56.93 1ro7 n TYR 204 Cb 0.14 -0.05 -0.02 0.00 -0.31 0.00 0.00 39.34 39.10 1ro7 n TYR 204 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1ro7 n LYS 205 N 1.27 -1.63 -4.12 -0.72 5.02 -0.85 -4.98 118.16 112.15 1ro7 n LYS 205 Ca 0.22 0.26 -0.28 0.00 -2.02 0.00 0.00 58.31 56.49 1ro7 n LYS 205 Cb 0.62 -3.76 -0.03 0.00 -0.02 0.00 0.00 35.03 31.84 1ro7 n LYS 205 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1ro7 s ILE 206 N -3.87 1.60 -0.12 -0.18 -5.25 -1.15 -5.07 121.20 107.16 1ro7 s ILE 206 Ca 0.21 -1.64 0.03 0.00 -0.99 0.00 0.00 60.65 58.26 1ro7 s ILE 206 Cb -0.10 -2.24 0.01 0.00 2.95 0.00 0.00 42.46 43.09 1ro7 s ILE 206 CO 0.93 0.00 -0.21 -0.75 -1.79 0.00 0.00 174.94 173.12 1ro7 s LYS 207 N -4.14 2.81 -0.07 0.37 2.47 0.00 -4.83 119.74 116.35 1ro7 s LYS 207 Ca 0.28 -0.78 -0.03 0.00 -1.56 0.00 0.00 55.97 53.87 1ro7 s LYS 207 Cb -0.01 -2.25 -0.04 0.00 -1.46 0.00 0.00 37.83 34.08 1ro7 s LYS 207 CO 0.17 0.02 0.07 -0.51 0.16 0.00 0.00 175.35 175.26 1ro7 s LEU 208 N 0.74 3.96 0.04 5.43 1.43 -1.26 -0.37 118.68 128.66 1ro7 s LEU 208 Ca -0.10 0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 1ro7 s LEU 208 Cb -0.16 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 43.98 1ro7 s LEU 208 CO 0.01 0.35 -0.08 -0.31 0.23 0.00 0.00 176.35 176.55 1ro7 s TYR 209 N -1.03 0.70 -0.19 0.29 2.02 0.22 -4.42 117.35 114.93 1ro7 s TYR 209 Ca 0.17 -0.47 -0.05 0.00 -0.37 0.00 0.00 57.07 56.34 1ro7 s TYR 209 Cb -0.12 -0.42 -0.03 0.00 -0.40 0.00 0.00 41.96 41.00 1ro7 s TYR 209 CO 0.07 -0.07 0.01 0.00 -1.57 0.00 0.00 175.55 173.98 1ro7 n LEU 211 N 4.00 1.56 -3.99 0.00 4.77 -0.38 -0.39 117.00 122.57 1ro7 n LEU 211 Ca -0.17 -0.53 -0.32 0.00 -0.03 0.00 0.00 56.01 54.96 1ro7 n LEU 211 Cb 0.52 -0.06 -0.13 0.00 -2.33 0.00 0.00 43.42 41.43 1ro7 n LEU 211 CO 0.32 0.29 -0.11 0.00 -1.33 0.00 0.00 177.39 176.56 1ro7 h PRO 213 N 6.64 0.00 -0.24 0.00 0.13 -1.84 -1.81 132.00 134.88 1ro7 h PRO 213 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1ro7 h PRO 213 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1ro7 h PRO 213 CO 0.70 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.56 1ro7 n ASN 214 N -3.32 3.02 -4.86 1.44 3.02 -1.26 -4.81 115.26 108.49 1ro7 n ASN 214 Ca -0.01 -1.94 -0.32 0.00 -0.03 0.00 0.00 54.58 52.28 1ro7 n ASN 214 Cb 0.25 -0.14 -0.05 0.00 -0.61 0.00 0.00 39.78 39.23 1ro7 n ASN 214 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ro7 s SER 215 N -1.68 6.68 0.58 6.41 0.15 -0.68 -4.93 113.70 120.23 1ro7 s SER 215 Ca 0.35 1.21 0.39 0.00 0.70 0.00 0.00 55.95 58.59 1ro7 s SER 215 Cb 0.21 -2.35 2.04 0.00 -1.71 0.00 0.00 66.02 64.22 1ro7 s SER 215 CO 0.31 -0.26 2.18 0.25 1.20 0.00 0.00 173.24 176.92 1ro7 h LEU 216 N 1.96 0.00 -1.53 3.45 5.85 -1.87 -0.33 115.31 122.84 1ro7 h LEU 216 Ca -0.48 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.19 1ro7 h LEU 216 Cb 1.18 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 1ro7 h LEU 216 CO 0.65 0.00 -0.24 0.25 -0.34 0.00 0.00 178.44 178.76 1ro7 h LEU 217 N 0.00 0.00 -0.51 2.25 5.85 -1.88 -2.34 115.31 118.67 1ro7 h LEU 217 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ro7 h LEU 217 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1ro7 h LEU 217 CO 0.00 0.24 0.00 0.00 -0.34 0.00 0.00 178.44 178.34 1ro7 n ALA 218 N -2.39 1.39 0.55 1.25 0.00 -0.13 -1.43 120.51 119.76 1ro7 n ALA 218 Ca -0.02 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1ro7 n ALA 218 Cb 0.33 -1.25 0.32 0.00 0.00 0.00 0.00 19.45 18.85 1ro7 n ALA 218 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1ro7 h ASN 219 N 0.00 0.00 0.00 0.00 2.35 -1.59 -3.38 115.58 112.96 1ro7 h ASN 219 Ca 0.00 -0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.63 1ro7 h ASN 219 Cb 0.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 1ro7 h ASN 219 CO 0.00 0.02 -1.28 0.49 -1.65 0.00 0.00 177.43 175.01 1ro7 n PHE 220 N -2.35 0.00 -4.50 1.19 3.72 -0.51 -5.03 117.46 109.98 1ro7 n PHE 220 Ca 0.05 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.11 1ro7 n PHE 220 Cb 0.45 -0.20 -0.11 0.00 -0.94 0.00 0.00 39.48 38.68 1ro7 n PHE 220 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1ro7 s ILE 221 N -2.10 3.91 0.39 4.37 1.09 -0.66 -5.08 121.20 123.12 1ro7 s ILE 221 Ca -0.04 -0.38 -0.25 0.00 -1.10 0.00 0.00 60.65 58.87 1ro7 s ILE 221 Cb 0.01 -2.65 -0.11 0.00 -1.06 0.00 0.00 42.46 38.66 1ro7 s ILE 221 CO 0.14 0.57 1.02 1.21 -0.10 0.00 0.00 174.94 177.78 1ro7 n GLU 222 N 2.62 1.40 -2.48 2.79 2.13 -1.26 -4.45 120.64 121.39 1ro7 n GLU 222 Ca -0.18 0.50 -0.40 0.00 0.66 0.00 0.00 57.16 57.74 1ro7 n GLU 222 Cb 0.53 -2.02 -0.04 0.00 0.27 0.00 0.00 31.44 30.18 1ro7 n GLU 222 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1ro7 s LEU 223 N -0.34 4.50 0.23 4.31 2.96 -1.26 0.27 118.68 129.34 1ro7 s LEU 223 Ca 0.62 2.25 -0.31 0.00 -0.22 0.00 0.00 54.13 56.47 1ro7 s LEU 223 Cb -0.58 -3.69 -0.11 0.00 0.50 0.00 0.00 46.19 42.31 1ro7 s LEU 223 CO 0.58 -0.19 1.62 0.00 -1.32 0.00 0.00 176.35 177.04 1ro7 s ALA 224 N -1.22 3.81 0.45 5.97 0.00 0.48 -4.66 121.76 126.60 1ro7 s ALA 224 Ca 0.46 1.50 -0.24 0.00 0.00 0.00 0.00 51.96 53.69 1ro7 s ALA 224 Cb -0.31 -3.65 -0.10 0.00 0.00 0.00 0.00 23.12 19.06 1ro7 s ALA 224 CO 0.40 -0.89 1.05 -0.35 0.00 0.00 0.00 175.76 175.97 1ro7 n PRO 225 N 3.29 1.40 -2.56 0.00 -0.04 -1.26 -4.81 135.00 131.01 1ro7 n PRO 225 Ca 0.12 0.50 -0.43 0.00 -0.04 0.00 0.00 63.50 63.66 1ro7 n PRO 225 Cb 0.37 -2.12 -0.02 0.00 -0.04 0.00 0.00 33.50 31.69 1ro7 n PRO 225 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1ro7 s ASN 226 N -0.77 7.09 0.00 3.54 3.84 -1.26 -4.43 114.94 122.95 1ro7 s ASN 226 Ca 0.64 1.61 0.06 0.00 0.21 0.00 0.00 52.86 55.38 1ro7 s ASN 226 Cb -0.53 -2.55 0.17 0.00 -0.55 0.00 0.00 41.25 37.79 1ro7 s ASN 226 CO 0.56 -0.60 1.13 0.18 -2.79 0.00 0.00 177.10 175.57 1ro7 n LEU 227 N 5.71 2.48 -2.18 3.21 4.77 0.38 -4.94 117.00 126.43 1ro7 n LEU 227 Ca 0.11 -1.96 -0.21 0.00 -0.03 0.00 0.00 56.01 53.92 1ro7 n LEU 227 Cb 0.47 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 1ro7 n LEU 227 CO 0.54 0.62 -0.25 0.59 -1.33 0.00 0.00 177.39 177.56 1ro7 n ASN 228 N 0.07 -5.76 -4.72 -1.43 5.03 -0.77 -4.94 115.26 102.75 1ro7 n ASN 228 Ca 0.06 0.13 -0.30 0.00 0.87 0.00 0.00 54.58 55.35 1ro7 n ASN 228 Cb 0.34 -4.87 0.14 0.00 -1.02 0.00 0.00 39.78 34.37 1ro7 n ASN 228 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1ro7 s SER 229 N -2.25 3.42 0.04 6.41 0.01 -0.70 -4.96 113.70 115.68 1ro7 s SER 229 Ca 0.00 1.40 0.01 0.00 1.31 0.00 0.00 55.95 58.66 1ro7 s SER 229 Cb 0.00 -2.08 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 1ro7 s SER 229 CO 0.00 -2.66 -0.05 0.20 0.41 0.00 0.00 173.24 171.14 1ro7 s ASN 230 N -3.50 0.59 -0.16 2.44 -0.87 -1.26 -3.71 114.94 108.48 1ro7 s ASN 230 Ca 0.63 -0.69 -0.10 0.00 -1.57 0.00 0.00 52.86 51.13 1ro7 s ASN 230 Cb -0.18 0.10 0.05 0.00 -0.02 0.00 0.00 41.25 41.21 1ro7 s ASN 230 CO 0.57 -0.36 0.40 0.12 -2.57 0.00 0.00 177.10 175.25 1ro7 s PHE 231 N -2.26 -0.54 -0.31 2.20 5.36 -1.26 -5.02 117.98 116.15 1ro7 s PHE 231 Ca -0.06 1.19 -0.21 0.00 -0.96 0.00 0.00 56.93 56.89 1ro7 s PHE 231 Cb -0.04 0.22 -0.00 0.00 -0.34 0.00 0.00 43.02 42.85 1ro7 s PHE 231 CO -0.03 -0.30 0.68 0.42 -1.46 0.00 0.00 175.22 174.53 1ro7 s ILE 232 N 1.04 4.88 -0.58 3.12 1.01 -1.26 -5.00 121.20 124.41 1ro7 s ILE 232 Ca -0.07 0.91 -0.22 0.00 0.00 0.00 0.00 60.65 61.28 1ro7 s ILE 232 Cb -0.07 -4.06 0.06 0.00 0.01 0.00 0.00 42.46 38.40 1ro7 s ILE 232 CO -0.09 -0.21 0.86 -0.63 0.00 0.00 0.00 174.94 174.88 1ro7 s ILE 233 N 2.74 4.50 0.34 2.92 1.09 -1.26 -4.90 121.20 126.63 1ro7 s ILE 233 Ca 0.27 -0.20 -0.27 0.00 -1.10 0.00 0.00 60.65 59.35 1ro7 s ILE 233 Cb -0.15 -4.53 -0.09 0.00 -1.06 0.00 0.00 42.46 36.63 1ro7 s ILE 233 CO 0.13 -1.16 1.10 -1.10 -0.10 0.00 0.00 174.94 173.80 1ro7 s GLN 234 N 3.60 4.38 0.78 2.79 -0.21 -1.26 -4.83 119.66 124.92 1ro7 s GLN 234 Ca 0.23 1.73 -0.12 0.00 0.02 0.00 0.00 55.36 57.22 1ro7 s GLN 234 Cb -0.16 -2.90 0.06 0.00 1.00 0.00 0.00 33.01 31.01 1ro7 s GLN 234 CO 0.14 0.00 1.12 -1.21 -2.12 0.00 0.00 175.29 173.21 1ro7 s GLU 235 N -1.92 2.22 -0.03 2.91 2.02 -1.26 -0.89 118.70 121.74 1ro7 s GLU 235 Ca 0.51 0.42 0.03 0.00 0.02 0.00 0.00 54.97 55.95 1ro7 s GLU 235 Cb -0.29 -1.95 -0.00 0.00 0.10 0.00 0.00 34.13 31.99 1ro7 s GLU 235 CO 0.37 -1.48 -0.13 0.15 0.02 0.00 0.00 175.26 174.19 1ro7 s LYS 236 N -5.33 1.33 -0.01 1.61 1.02 -1.23 -4.71 119.74 112.41 1ro7 s LYS 236 Ca 0.60 -0.45 0.00 0.00 0.02 0.00 0.00 55.97 56.15 1ro7 s LYS 236 Cb -0.13 -1.20 0.01 0.00 -0.52 0.00 0.00 37.83 36.00 1ro7 s LYS 236 CO 0.52 0.18 -0.00 -0.80 -0.92 0.00 0.00 175.35 174.33 1ro7 s ASN 237 N 0.09 0.24 -1.40 2.83 0.01 -1.26 -4.84 114.94 110.60 1ro7 s ASN 237 Ca -0.03 -0.01 -0.05 0.00 -0.71 0.00 0.00 52.86 52.06 1ro7 s ASN 237 Cb -0.10 -0.10 0.03 0.00 0.41 0.00 0.00 41.25 41.50 1ro7 s ASN 237 CO 0.01 -0.05 0.77 0.59 -1.51 0.00 0.00 177.10 176.91 1ro7 n ASN 238 N 3.64 -2.36 -5.00 -1.22 3.02 -1.26 -4.95 115.26 107.14 1ro7 n ASN 238 Ca -0.21 -0.83 -0.18 0.00 -0.03 0.00 0.00 54.58 53.33 1ro7 n ASN 238 Cb 0.54 -3.86 0.01 0.00 -0.61 0.00 0.00 39.78 35.87 1ro7 n ASN 238 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1ro7 s TYR 239 N -3.57 2.89 -0.45 3.10 1.13 -1.26 -5.03 117.35 114.16 1ro7 s TYR 239 Ca 0.24 -0.27 -0.29 0.00 -1.41 0.00 0.00 57.07 55.35 1ro7 s TYR 239 Cb -0.12 -2.39 0.01 0.00 -1.10 0.00 0.00 41.96 38.36 1ro7 s TYR 239 CO 0.83 -0.44 1.41 0.99 -2.51 0.00 0.00 175.55 175.83 1ro7 s THR 240 N -2.41 3.88 -0.16 -3.49 2.01 -1.26 -4.83 115.64 109.38 1ro7 s THR 240 Ca 0.54 0.87 0.15 0.00 0.31 0.00 0.00 61.69 63.55 1ro7 s THR 240 Cb -0.10 -4.26 0.35 0.00 0.01 0.00 0.00 72.50 68.49 1ro7 s THR 240 CO 0.34 -0.85 1.18 2.29 -0.69 0.00 0.00 174.62 176.88 1ro7 n LYS 241 N 8.21 1.36 -3.69 4.92 0.00 -1.26 -4.50 118.16 123.20 1ro7 n LYS 241 Ca 0.16 -2.87 -0.15 0.00 -0.00 0.00 0.00 58.31 55.45 1ro7 n LYS 241 Cb 0.48 -1.50 -0.08 0.00 -0.00 0.00 0.00 35.03 33.94 1ro7 n LYS 241 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1ro7 s ASP 242 N -2.98 -0.33 0.53 -5.58 3.68 -1.26 -4.85 116.67 105.88 1ro7 s ASP 242 Ca 0.34 0.30 -0.19 0.00 2.13 0.00 0.00 52.55 55.13 1ro7 s ASP 242 Cb 0.32 0.41 -0.06 0.00 -1.45 0.00 0.00 42.92 42.13 1ro7 s ASP 242 CO -0.02 -0.47 1.09 -0.51 0.13 0.00 0.00 175.17 175.38 1ro7 s ILE 243 N -1.20 3.42 0.12 4.11 2.07 -1.26 -5.03 121.20 123.44 1ro7 s ILE 243 Ca -0.12 0.86 -0.03 0.00 -1.41 0.00 0.00 60.65 59.95 1ro7 s ILE 243 Cb -0.04 -3.34 -0.05 0.00 0.13 0.00 0.00 42.46 39.16 1ro7 s ILE 243 CO 0.06 -0.22 0.33 -0.76 -1.91 0.00 0.00 174.94 172.44 1ro7 s LEU 244 N -3.78 4.29 -0.25 8.50 1.43 -1.26 -4.61 118.68 123.00 1ro7 s LEU 244 Ca 0.70 0.48 -0.06 0.00 -1.03 0.00 0.00 54.13 54.23 1ro7 s LEU 244 Cb -0.21 -3.20 -0.01 0.00 0.03 0.00 0.00 46.19 42.81 1ro7 s LEU 244 CO 0.26 0.08 0.03 -0.63 0.23 0.00 0.00 176.35 176.31 1ro7 s ILE 245 N -1.63 3.77 1.01 -0.59 -1.09 -1.26 -4.74 121.20 116.68 1ro7 s ILE 245 Ca 0.39 -0.51 -0.12 0.00 -2.23 0.00 0.00 60.65 58.18 1ro7 s ILE 245 Cb -0.12 -2.82 0.19 0.00 -1.58 0.00 0.00 42.46 38.13 1ro7 s ILE 245 CO 0.26 0.27 1.08 -2.16 -1.23 0.00 0.00 174.94 173.16 1ro7 s PRO 246 N 1.51 0.34 1.01 2.79 0.04 -1.26 -5.00 135.00 134.43 1ro7 s PRO 246 Ca 0.04 0.88 -0.12 0.00 0.04 0.00 0.00 61.00 61.85 1ro7 s PRO 246 Cb -0.16 -1.70 0.19 0.00 0.04 0.00 0.00 34.50 32.88 1ro7 s PRO 246 CO 0.00 -2.89 1.08 -1.54 0.04 0.00 0.00 177.00 173.69 1ro7 s SER 247 N -3.01 2.37 0.29 6.66 1.04 -1.26 -4.82 113.70 114.97 1ro7 s SER 247 Ca 0.66 1.63 0.00 0.00 0.48 0.00 0.00 55.95 58.72 1ro7 s SER 247 Cb -0.21 -2.28 0.44 0.00 0.10 0.00 0.00 66.02 64.07 1ro7 s SER 247 CO 0.60 -3.35 1.82 0.77 0.98 0.00 0.00 173.24 174.05 1ro7 h SER 248 N -2.04 0.67 0.10 7.02 4.64 -2.00 -1.85 113.55 120.10 1ro7 h SER 248 Ca -0.53 -0.14 -0.08 0.00 -0.47 0.00 0.00 61.79 60.57 1ro7 h SER 248 Cb 1.30 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1ro7 h SER 248 CO 0.50 0.72 -0.28 -0.33 -0.87 0.00 0.00 176.83 176.57 1ro7 h GLU 249 N 0.68 0.29 -0.12 4.77 5.08 -2.00 -2.01 114.58 121.27 1ro7 h GLU 249 Ca 0.14 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1ro7 h GLU 249 Cb 0.36 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1ro7 h GLU 249 CO 0.01 0.55 -0.02 0.00 -1.00 0.00 0.00 179.01 178.55 1ro7 h ALA 250 N 1.46 0.17 -0.01 3.43 0.00 -1.70 -2.51 119.26 120.09 1ro7 h ALA 250 Ca 0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1ro7 h ALA 250 Cb 0.63 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1ro7 h ALA 250 CO 0.05 -0.10 -0.18 1.88 0.00 0.00 0.00 179.25 180.89 1ro7 h TYR 251 N -0.07 0.01 -0.31 0.00 -1.99 -1.25 -2.11 116.97 111.25 1ro7 h TYR 251 Ca 0.03 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.73 1ro7 h TYR 251 Cb 0.42 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.13 1ro7 h TYR 251 CO 0.05 0.19 0.06 0.78 -0.00 0.00 0.00 178.16 179.24 1ro7 h GLY 252 N 0.56 0.55 1.97 3.88 0.00 -1.16 0.53 103.07 109.39 1ro7 h GLY 252 Ca 0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.90 1ro7 h GLY 252 CO 0.02 0.34 -0.29 0.50 0.00 0.00 0.00 176.54 177.11 1ro7 h LYS 253 N 0.34 0.04 -0.03 4.80 1.57 -1.00 -2.81 116.57 119.48 1ro7 h LYS 253 Ca 0.10 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1ro7 h LYS 253 Cb 0.33 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1ro7 h LYS 253 CO 0.00 0.33 -0.11 0.34 -0.57 0.00 0.00 179.45 179.45 1ro7 n PHE 254 N -4.18 0.00 -0.34 -1.35 -0.00 -0.84 -4.61 117.46 106.15 1ro7 n PHE 254 Ca -0.02 0.00 0.23 0.00 -0.00 0.00 0.00 57.45 57.66 1ro7 n PHE 254 Cb 0.35 -0.00 0.46 0.00 -0.00 0.00 0.00 39.48 40.29 1ro7 n PHE 254 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1ro7 h SER 255 N 4.18 0.54 0.58 -2.13 4.64 0.33 0.95 113.55 122.64 1ro7 h SER 255 Ca 0.00 0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 1ro7 h SER 255 Cb 0.94 0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1ro7 h SER 255 CO 0.00 -0.09 -0.03 0.07 -0.87 0.00 0.00 176.83 175.92 1ro7 h LYS 256 N 0.37 0.00 -0.03 4.77 -0.00 -1.82 -3.51 116.57 116.36 1ro7 h LYS 256 Ca 0.72 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 61.37 1ro7 h LYS 256 Cb 1.61 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.84 1ro7 h LYS 256 CO -0.57 0.03 0.00 0.09 -0.00 0.00 0.00 179.45 179.00