#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vs7 n LYS 13 N 0.00 0.09 -1.69 5.56 4.01 -1.24 -5.07 118.16 119.82 1vs7 n LYS 13 Ca 0.00 -0.50 0.00 0.00 -0.51 0.00 0.00 58.31 57.30 1vs7 n LYS 13 Cb 0.00 -0.52 0.00 0.00 -0.51 0.00 0.00 35.03 34.00 1vs7 n LYS 13 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1vs7 n GLN 14 N -0.02 -4.84 0.00 1.97 3.00 0.77 -5.02 117.38 113.25 1vs7 n GLN 14 Ca 0.00 3.58 0.00 0.00 -0.01 0.00 0.00 57.00 60.57 1vs7 n GLN 14 Cb 0.47 -4.01 0.00 0.00 0.00 0.00 0.00 30.24 26.70 1vs7 n GLN 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1vs7 n VAL 15 N -0.61 0.00 -3.31 5.09 0.31 -1.25 -4.90 118.33 113.66 1vs7 n VAL 15 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.16 1vs7 n VAL 15 Cb 0.00 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.00 1vs7 n VAL 15 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1vs7 n SER 16 N -2.00 -5.93 0.00 4.52 2.88 -1.18 -4.82 113.62 107.09 1vs7 n SER 16 Ca 0.00 -0.72 0.00 0.00 -1.33 0.00 0.00 58.87 56.82 1vs7 n SER 16 Cb 0.00 -5.05 0.00 0.00 -0.75 0.00 0.00 64.21 58.41 1vs7 n SER 16 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1vs7 n ASP 17 N -3.17 0.00 -4.66 -3.46 5.68 -1.23 -4.48 116.55 105.22 1vs7 n ASP 17 Ca -0.10 -0.17 -0.31 0.00 -0.50 0.00 0.00 54.79 53.71 1vs7 n ASP 17 Cb 0.62 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.78 1vs7 n ASP 17 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1vs7 s GLY 18 N 0.00 1.68 0.53 6.12 0.00 -1.26 -3.87 107.32 110.53 1vs7 s GLY 18 Ca 0.00 0.57 0.07 0.00 0.00 0.00 0.00 44.72 45.37 1vs7 s GLY 18 CO 0.00 1.01 0.72 -1.34 0.00 0.00 0.00 173.10 173.49 1vs7 s VAL 19 N -2.64 2.52 -0.49 1.40 -7.23 0.60 -3.26 120.40 111.31 1vs7 s VAL 19 Ca 0.67 -0.93 0.04 0.00 -1.81 0.00 0.00 61.98 59.94 1vs7 s VAL 19 Cb -0.23 -2.58 0.13 0.00 0.56 0.00 0.00 36.38 34.25 1vs7 s VAL 19 CO 0.58 0.00 0.23 0.00 -0.31 0.00 0.00 175.10 175.60 1vs7 s ALA 20 N -2.60 3.15 -0.47 1.32 0.00 -0.76 -2.65 121.76 119.75 1vs7 s ALA 20 Ca 0.59 -3.11 -0.29 0.00 0.00 0.00 0.00 51.96 49.15 1vs7 s ALA 20 Cb -0.08 -2.11 0.03 0.00 0.00 0.00 0.00 23.12 20.96 1vs7 s ALA 20 CO 0.37 -1.98 1.15 -1.01 0.00 0.00 0.00 175.76 174.30 1vs7 s HIS 21 N -0.07 2.80 -0.42 0.00 3.76 -0.32 -0.29 115.29 120.75 1vs7 s HIS 21 Ca 0.16 0.72 -0.05 0.00 -0.15 0.00 0.00 55.06 55.74 1vs7 s HIS 21 Cb -0.25 -4.41 0.11 0.00 1.11 0.00 0.00 32.58 29.13 1vs7 s HIS 21 CO -0.01 -1.31 0.24 0.42 -0.85 0.00 0.00 174.74 173.23 1vs7 s ILE 22 N 4.50 3.63 -0.87 0.60 1.01 -1.24 -1.17 121.20 127.65 1vs7 s ILE 22 Ca 0.49 -1.89 -0.15 0.00 0.00 0.00 0.00 60.65 59.10 1vs7 s ILE 22 Cb -0.08 -3.41 0.20 0.00 0.01 0.00 0.00 42.46 39.18 1vs7 s ILE 22 CO 0.31 -0.67 0.88 -2.28 0.00 0.00 0.00 174.94 173.19 1vs7 s HIS 23 N 1.24 3.63 -0.24 3.97 5.65 -0.22 -1.65 115.29 127.67 1vs7 s HIS 23 Ca 0.06 -1.89 -0.05 0.00 0.25 0.00 0.00 55.06 53.44 1vs7 s HIS 23 Cb -0.24 -3.94 -0.01 0.00 -1.18 0.00 0.00 32.58 27.21 1vs7 s HIS 23 CO -0.02 -1.12 0.00 0.00 -0.65 0.00 0.00 174.74 172.95 1vs7 s ALA 24 N 0.73 2.93 0.42 1.58 0.00 -1.06 -0.74 121.76 125.61 1vs7 s ALA 24 Ca 0.23 -1.24 0.07 0.00 0.00 0.00 0.00 51.96 51.02 1vs7 s ALA 24 Cb -0.09 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 1vs7 s ALA 24 CO -0.09 -0.57 0.23 -1.54 0.00 0.00 0.00 175.76 173.80 1vs7 s SER 25 N 1.50 4.56 0.24 0.00 1.04 0.79 -3.51 113.70 118.33 1vs7 s SER 25 Ca 0.05 -1.02 0.09 0.00 0.48 0.00 0.00 55.95 55.54 1vs7 s SER 25 Cb -0.15 -0.44 0.49 0.00 0.10 0.00 0.00 66.02 66.02 1vs7 s SER 25 CO -0.01 -0.60 1.13 0.49 0.98 0.00 0.00 173.24 175.24 1vs7 n PHE 26 N -1.33 0.31 0.04 5.02 3.72 -1.26 -3.48 117.46 120.48 1vs7 n PHE 26 Ca -0.00 0.16 -0.00 0.00 -0.05 0.00 0.00 57.45 57.56 1vs7 n PHE 26 Cb 0.64 -0.53 -0.00 0.00 -0.94 0.00 0.00 39.48 38.65 1vs7 n PHE 26 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1vs7 n ASN 27 N -1.84 0.92 -4.85 4.37 3.02 -1.26 -4.87 115.26 110.75 1vs7 n ASN 27 Ca -0.01 0.12 -0.24 0.00 -0.03 0.00 0.00 54.58 54.42 1vs7 n ASN 27 Cb 0.32 -0.28 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 1vs7 n ASN 27 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1vs7 s ASN 28 N -5.80 4.75 -0.16 6.41 3.04 -1.23 -3.14 114.94 118.81 1vs7 s ASN 28 Ca -0.00 -1.00 -0.05 0.00 0.04 0.00 0.00 52.86 51.84 1vs7 s ASN 28 Cb 0.00 -0.20 0.08 0.00 -1.54 0.00 0.00 41.25 39.59 1vs7 s ASN 28 CO 0.01 -0.79 0.32 -0.89 -3.04 0.00 0.00 177.10 172.71 1vs7 s THR 29 N -2.61 -0.50 -0.06 -5.21 2.01 -1.26 -0.15 115.64 107.86 1vs7 s THR 29 Ca 0.42 0.21 0.04 0.00 0.31 0.00 0.00 61.69 62.66 1vs7 s THR 29 Cb -0.01 -0.54 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 1vs7 s THR 29 CO 0.24 0.08 -0.16 0.27 -0.69 0.00 0.00 174.62 174.36 1vs7 s ILE 30 N 2.48 2.87 -0.18 1.82 -5.25 0.08 -0.61 121.20 122.42 1vs7 s ILE 30 Ca 0.01 -0.78 0.01 0.00 -0.99 0.00 0.00 60.65 58.90 1vs7 s ILE 30 Cb -0.12 -2.12 0.01 0.00 2.95 0.00 0.00 42.46 43.18 1vs7 s ILE 30 CO -0.10 0.58 -0.18 -0.69 -1.79 0.00 0.00 174.94 172.75 1vs7 s VAL 31 N -0.48 2.23 -0.09 8.37 1.01 0.39 -1.05 120.40 130.78 1vs7 s VAL 31 Ca 0.06 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.17 1vs7 s VAL 31 Cb -0.12 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.34 1vs7 s VAL 31 CO 0.02 0.53 -0.14 -0.89 0.00 0.00 0.00 175.10 174.61 1vs7 s THR 32 N 1.20 1.36 -0.27 3.92 2.01 -0.32 -0.57 115.64 122.97 1vs7 s THR 32 Ca 0.03 -0.58 -0.14 0.00 0.31 0.00 0.00 61.69 61.30 1vs7 s THR 32 Cb -0.14 -1.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 1vs7 s THR 32 CO -0.09 0.41 0.34 -0.63 -0.69 0.00 0.00 174.62 173.96 1vs7 s ILE 33 N 0.84 5.20 -0.01 1.82 -1.09 -0.23 -1.17 121.20 126.55 1vs7 s ILE 33 Ca -0.10 0.51 0.05 0.00 -2.23 0.00 0.00 60.65 58.87 1vs7 s ILE 33 Cb -0.15 -3.67 -0.01 0.00 -1.58 0.00 0.00 42.46 37.04 1vs7 s ILE 33 CO 0.01 0.17 -0.18 0.28 -1.23 0.00 0.00 174.94 174.00 1vs7 s THR 34 N 2.02 1.39 1.24 2.92 -1.32 -1.09 0.14 115.64 120.95 1vs7 s THR 34 Ca 0.14 -0.75 -0.15 0.00 -1.21 0.00 0.00 61.69 59.72 1vs7 s THR 34 Cb -0.16 -1.16 0.32 0.00 -1.51 0.00 0.00 72.50 69.99 1vs7 s THR 34 CO 0.10 0.39 1.00 1.51 -2.21 0.00 0.00 174.62 175.41 1vs7 s ASP 35 N -0.39 0.33 0.58 8.08 3.84 -1.20 0.22 116.67 128.14 1vs7 s ASP 35 Ca 0.06 1.36 0.30 0.00 -0.00 0.00 0.00 52.55 54.28 1vs7 s ASP 35 Cb -0.07 -2.09 1.40 0.00 -1.38 0.00 0.00 42.92 40.78 1vs7 s ASP 35 CO -0.01 -4.58 1.79 0.03 -0.00 0.00 0.00 175.17 172.40 1vs7 h ARG 36 N -2.88 0.00 0.01 2.11 3.08 -1.89 -1.03 114.38 113.77 1vs7 h ARG 36 Ca -0.59 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.46 1vs7 h ARG 36 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1vs7 h ARG 36 CO 0.46 0.00 -0.00 0.37 -1.07 0.00 0.00 179.97 179.73 1vs7 h GLN 37 N 0.00 -0.01 0.00 0.04 5.75 -1.93 -3.49 115.11 115.47 1vs7 h GLN 37 Ca 0.32 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.82 1vs7 h GLN 37 Cb 1.66 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.21 1vs7 h GLN 37 CO -0.00 0.68 0.00 0.41 -2.65 0.00 0.00 178.83 177.27 1vs7 n GLY 38 N 0.83 1.26 3.48 2.39 0.00 -0.39 -5.13 105.19 107.64 1vs7 n GLY 38 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 1vs7 n GLY 38 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vs7 s ASN 39 N -1.26 5.53 -0.22 1.61 0.01 -1.26 -4.90 114.94 114.45 1vs7 s ASN 39 Ca 0.00 -0.30 -0.40 0.00 -0.71 0.00 0.00 52.86 51.45 1vs7 s ASN 39 Cb 0.00 -2.01 -0.16 0.00 0.41 0.00 0.00 41.25 39.50 1vs7 s ASN 39 CO 0.00 -0.11 1.69 0.00 -1.51 0.00 0.00 177.10 177.17 1vs7 n ALA 40 N 4.98 -0.29 -0.06 0.60 0.00 -1.26 -3.21 120.51 121.27 1vs7 n ALA 40 Ca -0.15 0.40 -0.02 0.00 0.00 0.00 0.00 53.44 53.68 1vs7 n ALA 40 Cb 0.51 -2.21 -0.14 0.00 0.00 0.00 0.00 19.45 17.60 1vs7 n ALA 40 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vs7 n LEU 41 N 4.99 0.00 0.00 0.00 4.77 0.12 -4.98 117.00 121.90 1vs7 n LEU 41 Ca 0.25 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1vs7 n LEU 41 Cb 0.14 0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1vs7 n LEU 41 CO 0.78 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.73 1vs7 n GLY 42 N 1.72 1.39 3.53 -0.72 0.00 -1.16 -4.92 105.19 105.02 1vs7 n GLY 42 Ca -0.20 0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1vs7 n GLY 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1vs7 s TRP 43 N -0.32 2.26 -0.25 1.61 1.48 -1.26 -1.06 118.94 121.40 1vs7 s TRP 43 Ca 0.00 -0.72 -0.26 0.00 -1.06 0.00 0.00 56.10 54.05 1vs7 s TRP 43 Cb 0.00 -1.48 0.13 0.00 -1.16 0.00 0.00 33.47 30.96 1vs7 s TRP 43 CO 0.00 0.33 1.05 0.00 -4.06 0.00 0.00 176.95 174.27 1vs7 s ALA 44 N -2.90 -1.98 0.03 2.67 0.00 0.26 -4.82 121.76 115.03 1vs7 s ALA 44 Ca 0.34 1.79 0.02 0.00 0.00 0.00 0.00 51.96 54.11 1vs7 s ALA 44 Cb 0.07 -1.27 -0.02 0.00 0.00 0.00 0.00 23.12 21.90 1vs7 s ALA 44 CO 0.16 -0.25 -0.07 -0.08 0.00 0.00 0.00 175.76 175.52 1vs7 s THR 45 N -0.13 0.51 0.16 0.00 -1.32 -1.26 0.15 115.64 113.74 1vs7 s THR 45 Ca 0.02 -0.92 -0.23 0.00 -1.21 0.00 0.00 61.69 59.35 1vs7 s THR 45 Cb -0.04 -0.56 0.04 0.00 -1.51 0.00 0.00 72.50 70.43 1vs7 s THR 45 CO -0.05 -0.29 1.61 0.00 -2.21 0.00 0.00 174.62 173.68 1vs7 h ALA 46 N 4.78 -0.19 -0.94 11.08 0.00 -1.14 0.34 119.26 133.19 1vs7 h ALA 46 Ca -0.34 0.08 0.20 0.00 0.00 0.00 0.00 54.91 54.85 1vs7 h ALA 46 Cb 1.20 0.62 -0.08 0.00 0.00 0.00 0.00 17.79 19.54 1vs7 h ALA 46 CO 0.42 -0.72 0.61 0.78 0.00 0.00 0.00 179.25 180.35 1vs7 h GLY 47 N -0.27 1.07 1.94 0.00 0.00 -1.86 0.16 103.07 104.10 1vs7 h GLY 47 Ca 0.15 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 47.11 1vs7 h GLY 47 CO -0.46 -0.02 -0.65 -1.33 0.00 0.00 0.00 176.54 174.08 1vs7 h GLY 48 N 0.48 0.07 -0.74 4.60 0.00 -1.36 -3.05 103.07 103.07 1vs7 h GLY 48 Ca 0.50 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.74 1vs7 h GLY 48 CO -0.22 0.08 0.00 1.44 0.00 0.00 0.00 176.54 177.84 1vs7 n SER 49 N -3.78 0.32 -2.64 0.19 7.64 0.57 -4.79 113.62 111.13 1vs7 n SER 49 Ca -0.01 -0.87 -0.01 0.00 1.01 0.00 0.00 58.87 58.98 1vs7 n SER 49 Cb 0.64 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1vs7 n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vs7 n GLY 50 N 0.19 -1.03 0.25 0.23 0.00 -1.15 -4.99 105.19 98.69 1vs7 n GLY 50 Ca 0.00 0.42 0.03 0.00 0.00 0.00 0.00 46.02 46.47 1vs7 n GLY 50 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vs7 n PHE 51 N -1.35 0.00 0.00 1.61 3.01 -1.24 -5.06 117.46 114.43 1vs7 n PHE 51 Ca 0.02 -0.37 0.00 0.00 1.01 0.00 0.00 57.45 58.10 1vs7 n PHE 51 Cb 0.47 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.86 1vs7 n PHE 51 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1vs7 n ARG 52 N -0.52 0.00 0.05 -1.08 3.00 -1.26 -2.72 116.66 114.13 1vs7 n ARG 52 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 1vs7 n ARG 52 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.08 1vs7 n ARG 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1vs7 n GLY 53 N 0.00 -0.54 0.04 5.14 0.00 -1.26 -4.84 105.19 103.72 1vs7 n GLY 53 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 1vs7 n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1vs7 h SER 54 N 0.00 -0.09 0.09 1.61 0.02 -2.00 -2.43 113.55 110.75 1vs7 h SER 54 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1vs7 h SER 54 Cb 0.00 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1vs7 h SER 54 CO 0.00 -0.06 0.00 0.54 -1.14 0.00 0.00 176.83 176.17 1vs7 n ARG 55 N -2.31 0.12 -0.03 3.45 5.12 -1.26 -2.73 116.66 119.02 1vs7 n ARG 55 Ca -0.01 0.17 -0.13 0.00 -1.93 0.00 0.00 57.85 55.95 1vs7 n ARG 55 Cb 0.04 -1.50 -0.08 0.00 -1.16 0.00 0.00 32.46 29.75 1vs7 n ARG 55 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 1vs7 h LYS 56 N 0.00 0.15 -1.74 5.56 3.64 -1.23 -3.18 116.57 119.78 1vs7 h LYS 56 Ca 0.00 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 1vs7 h LYS 56 Cb 0.05 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 1vs7 h LYS 56 CO 0.00 0.53 0.12 -1.13 -2.27 0.00 0.00 179.45 176.70 1vs7 n SER 57 N -4.77 5.31 -4.76 4.20 3.41 -1.11 -4.68 113.62 111.23 1vs7 n SER 57 Ca -0.07 -2.55 -0.32 0.00 -0.26 0.00 0.00 58.87 55.68 1vs7 n SER 57 Cb 0.26 -1.03 -0.07 0.00 -0.26 0.00 0.00 64.21 63.11 1vs7 n SER 57 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1vs7 s THR 58 N -0.64 4.50 0.61 6.66 -4.23 -1.20 -4.76 115.64 116.58 1vs7 s THR 58 Ca 0.09 -0.64 0.39 0.00 -1.18 0.00 0.00 61.69 60.35 1vs7 s THR 58 Cb 0.07 -3.10 0.41 0.00 1.34 0.00 0.00 72.50 71.22 1vs7 s THR 58 CO 0.00 0.23 2.31 1.55 -0.54 0.00 0.00 174.62 178.18 1vs7 h PRO 59 N 3.72 0.00 0.10 3.99 0.13 -1.89 -2.60 132.00 135.46 1vs7 h PRO 59 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1vs7 h PRO 59 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1vs7 h PRO 59 CO 0.63 0.01 -0.05 0.35 -0.23 0.00 0.00 178.00 178.71 1vs7 h PHE 60 N 0.00 -0.13 -0.40 1.56 3.04 -1.94 -3.19 116.94 115.88 1vs7 h PHE 60 Ca -0.00 -0.00 0.06 0.00 3.98 0.00 0.00 57.97 62.01 1vs7 h PHE 60 Cb 0.04 0.04 -0.09 0.00 2.56 0.00 0.00 35.95 38.50 1vs7 h PHE 60 CO 0.00 0.36 -0.48 0.00 -2.02 0.00 0.00 178.31 176.17 1vs7 h ALA 61 N 0.04 -0.57 -0.89 2.41 0.00 -1.70 -0.12 119.26 118.43 1vs7 h ALA 61 Ca -0.01 0.04 0.20 0.00 0.00 0.00 0.00 54.91 55.13 1vs7 h ALA 61 Cb 0.54 0.98 -0.11 0.00 0.00 0.00 0.00 17.79 19.20 1vs7 h ALA 61 CO 0.02 -0.94 0.43 0.00 0.00 0.00 0.00 179.25 178.77 1vs7 h ALA 62 N 0.24 1.42 -0.23 0.00 0.00 -1.67 0.14 119.26 119.16 1vs7 h ALA 62 Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1vs7 h ALA 62 Cb 0.59 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1vs7 h ALA 62 CO -0.58 -0.25 0.15 0.37 0.00 0.00 0.00 179.25 178.94 1vs7 h GLN 63 N 0.49 0.30 0.00 0.00 4.15 -1.04 0.36 115.11 119.38 1vs7 h GLN 63 Ca 0.54 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.94 1vs7 h GLN 63 Cb 0.94 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.57 1vs7 h GLN 63 CO -0.47 0.20 0.00 1.33 -1.93 0.00 0.00 178.83 177.96 1vs7 n VAL 64 N -4.93 0.84 -0.06 2.39 0.24 -0.04 -2.84 118.33 113.93 1vs7 n VAL 64 Ca -0.03 0.20 -0.05 0.00 -2.04 0.00 0.00 64.34 62.42 1vs7 n VAL 64 Cb 0.03 -1.03 -0.03 0.00 -1.47 0.00 0.00 33.84 31.34 1vs7 n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vs7 h ALA 65 N 2.42 0.02 -0.95 2.33 0.00 0.53 -3.18 119.26 120.42 1vs7 h ALA 65 Ca 0.00 -0.36 0.25 0.00 0.00 0.00 0.00 54.91 54.80 1vs7 h ALA 65 Cb 0.35 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1vs7 h ALA 65 CO 0.00 0.27 0.65 0.00 0.00 0.00 0.00 179.25 180.17 1vs7 h ALA 66 N -0.87 2.49 -0.19 0.00 0.00 -0.98 0.14 119.26 119.84 1vs7 h ALA 66 Ca -0.03 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1vs7 h ALA 66 Cb 0.41 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1vs7 h ALA 66 CO -0.02 -0.79 -0.63 1.05 0.00 0.00 0.00 179.25 178.85 1vs7 h GLU 67 N 0.24 0.69 0.00 0.00 4.11 -1.67 -2.93 114.58 115.02 1vs7 h GLU 67 Ca 0.49 -0.48 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1vs7 h GLU 67 Cb 1.50 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.83 1vs7 h GLU 67 CO -0.14 1.10 0.17 0.54 0.07 0.00 0.00 179.01 180.75 1vs7 n ARG 68 N -3.95 0.12 0.04 1.06 1.74 0.49 -2.31 116.66 113.84 1vs7 n ARG 68 Ca -0.05 0.61 -0.02 0.00 -0.77 0.00 0.00 57.85 57.62 1vs7 n ARG 68 Cb 0.66 -2.04 -0.01 0.00 -1.02 0.00 0.00 32.46 30.05 1vs7 n ARG 68 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vs7 h ALA 70 N -1.93 1.15 0.00 0.00 0.00 -1.64 1.77 119.26 118.60 1vs7 h ALA 70 Ca -0.01 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1vs7 h ALA 70 Cb 0.08 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1vs7 h ALA 70 CO 0.02 -0.50 0.00 -3.47 0.00 0.00 0.00 179.25 175.30 1vs7 n ASP 71 N -5.33 0.00 0.00 0.00 -0.08 -1.19 0.59 116.55 110.54 1vs7 n ASP 71 Ca 0.20 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.48 1vs7 n ASP 71 Cb 0.67 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.13 1vs7 n ASP 71 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vs7 n ALA 72 N -0.85 0.00 0.00 -1.67 0.00 0.39 -4.92 120.51 113.46 1vs7 n ALA 72 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vs7 n ALA 72 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1vs7 n ALA 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1vs7 n VAL 73 N 0.00 0.00 -0.18 0.00 0.24 0.50 -4.78 118.33 114.11 1vs7 n VAL 73 Ca 0.00 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.41 1vs7 n VAL 73 Cb 0.25 -0.09 0.43 0.00 -1.47 0.00 0.00 33.84 32.96 1vs7 n VAL 73 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1vs7 h LYS 74 N 0.00 0.56 -0.13 7.34 3.64 0.02 0.11 116.57 128.11 1vs7 h LYS 74 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1vs7 h LYS 74 Cb 0.18 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1vs7 h LYS 74 CO 0.00 0.37 0.00 -0.85 -2.27 0.00 0.00 179.45 176.70 1vs7 n GLU 75 N -4.50 0.40 -0.09 1.90 0.00 -1.26 -2.83 120.64 114.27 1vs7 n GLU 75 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 57.16 57.11 1vs7 n GLU 75 Cb 0.39 -1.07 -0.11 0.00 0.00 0.00 0.00 31.44 30.65 1vs7 n GLU 75 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 1vs7 h TYR 76 N 0.20 0.00 0.00 -1.84 3.20 -1.33 0.49 116.97 117.69 1vs7 h TYR 76 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1vs7 h TYR 76 Cb 0.07 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.34 1vs7 h TYR 76 CO 0.00 1.20 0.00 0.41 -1.64 0.00 0.00 178.16 178.13 1vs7 n GLY 77 N 1.51 -0.93 3.79 1.82 0.00 -1.13 -0.16 105.19 110.09 1vs7 n GLY 77 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1vs7 n GLY 77 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vs7 s ILE 78 N 0.00 3.68 0.00 -0.61 -0.00 -1.26 -3.11 121.20 119.90 1vs7 s ILE 78 Ca 0.00 0.55 0.00 0.00 -0.00 0.00 0.00 60.65 61.20 1vs7 s ILE 78 Cb 0.00 -3.16 0.00 0.00 -0.00 0.00 0.00 42.46 39.30 1vs7 s ILE 78 CO 0.00 -0.71 0.00 0.29 -0.00 0.00 0.00 174.94 174.52 1vs7 n LYS 79 N -3.32 0.26 -4.04 0.37 4.76 -1.26 -4.74 118.16 110.18 1vs7 n LYS 79 Ca 0.08 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.21 1vs7 n LYS 79 Cb 0.53 -0.07 -0.15 0.00 -1.84 0.00 0.00 35.03 33.50 1vs7 n LYS 79 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1vs7 s ASN 80 N -0.69 4.49 0.33 4.39 4.22 -1.26 0.47 114.94 126.89 1vs7 s ASN 80 Ca 0.00 -1.61 0.07 0.00 -2.14 0.00 0.00 52.86 49.18 1vs7 s ASN 80 Cb 0.00 -1.53 -0.02 0.00 1.28 0.00 0.00 41.25 40.98 1vs7 s ASN 80 CO 0.00 -0.25 0.38 -0.76 -2.04 0.00 0.00 177.10 174.42 1vs7 s LEU 81 N 1.07 3.78 -0.41 3.54 1.02 -0.73 -3.48 118.68 123.48 1vs7 s LEU 81 Ca -0.03 -0.34 0.02 0.00 0.02 0.00 0.00 54.13 53.80 1vs7 s LEU 81 Cb -0.20 -2.47 0.15 0.00 0.02 0.00 0.00 46.19 43.69 1vs7 s LEU 81 CO -0.06 -0.39 0.26 -1.61 0.02 0.00 0.00 176.35 174.57 1vs7 s GLU 82 N -4.08 0.97 0.39 1.70 8.01 -1.20 -2.33 118.70 122.16 1vs7 s GLU 82 Ca 0.43 -1.82 -0.25 0.00 0.01 0.00 0.00 54.97 53.34 1vs7 s GLU 82 Cb -0.08 -1.78 -0.12 0.00 -4.31 0.00 0.00 34.13 27.85 1vs7 s GLU 82 CO 0.29 -1.23 0.93 0.28 0.01 0.00 0.00 175.26 175.53 1vs7 n VAL 83 N 3.53 2.26 -3.07 2.63 0.31 0.15 -1.83 118.33 122.30 1vs7 n VAL 83 Ca 0.15 -0.50 -0.20 0.00 -0.01 0.00 0.00 64.34 63.78 1vs7 n VAL 83 Cb 0.38 -1.01 -0.04 0.00 -0.91 0.00 0.00 33.84 32.26 1vs7 n VAL 83 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 1vs7 n MET 84 N 0.32 0.73 -1.17 5.55 1.56 0.60 -3.51 117.12 121.21 1vs7 n MET 84 Ca 0.10 -2.82 -0.35 0.00 -0.27 0.00 0.00 57.70 54.35 1vs7 n MET 84 Cb 0.38 -1.28 0.09 0.00 2.15 0.00 0.00 33.22 34.55 1vs7 n MET 84 CO 0.00 0.00 0.00 1.33 -0.73 0.00 0.00 175.97 176.57 1vs7 n VAL 85 N 1.46 1.60 -3.31 1.12 0.24 -1.21 -3.61 118.33 114.63 1vs7 n VAL 85 Ca 0.18 -0.33 0.03 0.00 -2.04 0.00 0.00 64.34 62.17 1vs7 n VAL 85 Cb 0.56 -0.81 -0.02 0.00 -1.47 0.00 0.00 33.84 32.09 1vs7 n VAL 85 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1vs7 s LYS 86 N -3.14 0.47 0.00 7.34 2.20 -0.66 -0.38 119.74 125.56 1vs7 s LYS 86 Ca 0.66 0.96 0.00 0.00 -0.36 0.00 0.00 55.97 57.23 1vs7 s LYS 86 Cb -0.32 0.56 0.00 0.00 -1.51 0.00 0.00 37.83 36.56 1vs7 s LYS 86 CO 0.58 -0.37 0.00 0.41 -0.36 0.00 0.00 175.35 175.61 1vs7 n GLY 87 N 5.38 3.11 0.00 5.54 0.00 -1.26 -2.58 105.19 115.38 1vs7 n GLY 87 Ca -0.06 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1vs7 n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vs7 n PRO 88 N 0.01 3.92 -1.33 1.61 -0.04 -1.23 -4.74 135.00 133.19 1vs7 n PRO 88 Ca 0.00 0.00 0.17 0.00 -0.04 0.00 0.00 63.50 63.63 1vs7 n PRO 88 Cb 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 1vs7 n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vs7 n GLY 89 N 5.00 -2.04 0.00 0.55 0.00 -1.26 -4.37 105.19 103.07 1vs7 n GLY 89 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1vs7 n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vs7 n PRO 90 N -3.98 -0.37 -1.89 1.61 -0.04 -1.26 -4.05 135.00 125.02 1vs7 n PRO 90 Ca -0.01 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.35 1vs7 n PRO 90 Cb 0.66 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.10 1vs7 n PRO 90 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vs7 n GLY 91 N 2.72 0.17 0.02 0.55 0.00 -1.26 -4.72 105.19 102.67 1vs7 n GLY 91 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1vs7 n GLY 91 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vs7 n ARG 92 N -2.21 0.69 -0.06 1.61 0.63 -1.26 -4.41 116.66 111.66 1vs7 n ARG 92 Ca -0.10 -0.13 -0.09 0.00 -0.92 0.00 0.00 57.85 56.60 1vs7 n ARG 92 Cb 0.46 -1.43 -0.03 0.00 0.45 0.00 0.00 32.46 31.91 1vs7 n ARG 92 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1vs7 n GLU 93 N -2.22 0.38 -0.29 -0.14 1.02 -1.26 -4.62 120.64 113.51 1vs7 n GLU 93 Ca -0.08 0.15 0.18 0.00 -0.02 0.00 0.00 57.16 57.39 1vs7 n GLU 93 Cb 0.58 -1.15 0.46 0.00 -0.02 0.00 0.00 31.44 31.31 1vs7 n GLU 93 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1vs7 h SER 94 N -0.69 0.51 -0.27 1.62 0.87 -1.85 0.42 113.55 114.16 1vs7 h SER 94 Ca -0.09 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 60.61 1vs7 h SER 94 Cb 0.82 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 1vs7 h SER 94 CO -0.05 0.18 0.26 0.00 -0.53 0.00 0.00 176.83 176.69 1vs7 h THR 95 N 0.50 0.55 0.21 2.23 1.03 -1.81 0.44 112.91 116.05 1vs7 h THR 95 Ca 0.52 0.00 -0.31 0.00 -0.01 0.00 0.00 66.41 66.60 1vs7 h THR 95 Cb 1.16 0.80 0.03 0.00 -1.07 0.00 0.00 68.15 69.07 1vs7 h THR 95 CO -0.24 0.00 -1.45 0.40 -0.01 0.00 0.00 175.52 174.21 1vs7 h ILE 96 N 0.00 1.20 0.42 0.00 2.04 -0.42 -3.29 117.51 117.46 1vs7 h ILE 96 Ca 0.13 -2.60 -0.01 0.00 1.00 0.00 0.00 64.86 63.38 1vs7 h ILE 96 Cb 0.64 2.97 -0.03 0.00 -0.74 0.00 0.00 36.82 39.66 1vs7 h ILE 96 CO -0.00 0.80 -0.45 0.03 0.00 0.00 0.00 178.15 178.53 1vs7 h ARG 97 N 0.02 -0.86 -0.81 2.37 2.47 -0.62 -2.76 114.38 114.19 1vs7 h ARG 97 Ca -0.27 0.06 0.17 0.00 -1.26 0.00 0.00 59.98 58.68 1vs7 h ARG 97 Cb 2.04 0.20 -0.11 0.00 -1.65 0.00 0.00 29.97 30.45 1vs7 h ARG 97 CO 0.21 -0.57 0.32 0.00 0.56 0.00 0.00 179.97 180.49 1vs7 h ALA 98 N -0.61 1.18 -0.47 0.04 0.00 -1.47 0.13 119.26 118.06 1vs7 h ALA 98 Ca -0.04 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1vs7 h ALA 98 Cb 0.79 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 1vs7 h ALA 98 CO -0.08 -0.26 0.04 1.25 0.00 0.00 0.00 179.25 180.20 1vs7 h LEU 99 N 0.42 -0.11 -0.13 0.00 5.85 -1.56 -2.09 115.31 117.68 1vs7 h LEU 99 Ca 0.47 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 59.24 1vs7 h LEU 99 Cb 0.78 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.97 1vs7 h LEU 99 CO -0.46 -0.02 -0.09 -1.13 -0.34 0.00 0.00 178.44 176.40 1vs7 h ASN 100 N 0.16 0.30 0.00 1.25 -1.24 -0.99 -2.97 115.58 112.08 1vs7 h ASN 100 Ca 0.23 -0.44 0.00 0.00 0.71 0.00 0.00 56.30 56.80 1vs7 h ASN 100 Cb 0.33 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.30 1vs7 h ASN 100 CO -0.35 0.68 0.00 0.00 -1.29 0.00 0.00 177.43 176.47 1vs7 n ALA 101 N -2.38 1.35 0.58 1.57 0.00 0.30 -0.28 120.51 121.64 1vs7 n ALA 101 Ca -0.06 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.46 1vs7 n ALA 101 Cb 0.31 -0.92 -0.11 0.00 0.00 0.00 0.00 19.45 18.73 1vs7 n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vs7 n ALA 102 N -0.99 3.82 0.00 0.00 0.00 -0.86 -4.97 120.51 117.50 1vs7 n ALA 102 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1vs7 n ALA 102 Cb 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1vs7 n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vs7 n GLY 103 N 1.43 1.48 3.58 0.00 0.00 0.61 -5.09 105.19 107.20 1vs7 n GLY 103 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1vs7 n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vs7 s PHE 104 N -2.00 3.13 -0.69 1.61 0.08 -1.22 -4.87 117.98 114.03 1vs7 s PHE 104 Ca 0.00 0.45 -0.26 0.00 0.12 0.00 0.00 56.93 57.24 1vs7 s PHE 104 Cb 0.00 -3.27 -0.03 0.00 -0.57 0.00 0.00 43.02 39.15 1vs7 s PHE 104 CO 0.00 -0.68 1.89 1.03 -0.10 0.00 0.00 175.22 177.35 1vs7 s ARG 105 N 2.91 2.60 0.06 0.44 0.52 0.18 -4.52 118.95 121.14 1vs7 s ARG 105 Ca 0.28 0.37 -0.28 0.00 -0.52 0.00 0.00 55.73 55.58 1vs7 s ARG 105 Cb -0.14 -4.57 -0.05 0.00 0.52 0.00 0.00 34.95 30.71 1vs7 s ARG 105 CO 0.16 -2.91 0.89 -1.50 0.02 0.00 0.00 175.30 171.96 1vs7 s ILE 106 N 9.37 4.66 -0.27 1.52 2.07 -1.25 -1.76 121.20 135.53 1vs7 s ILE 106 Ca 0.68 1.90 0.22 0.00 -1.41 0.00 0.00 60.65 62.04 1vs7 s ILE 106 Cb -0.11 -4.24 0.50 0.00 0.13 0.00 0.00 42.46 38.73 1vs7 s ILE 106 CO 0.15 0.30 1.17 0.35 -1.91 0.00 0.00 174.94 175.00 1vs7 n THR 107 N 3.02 1.10 0.00 4.00 -2.24 -0.98 -4.98 114.28 114.18 1vs7 n THR 107 Ca 0.01 -2.65 0.00 0.00 -2.27 0.00 0.00 64.05 59.14 1vs7 n THR 107 Cb 0.50 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 70.00 1vs7 n THR 107 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1vs7 n ASN 108 N -0.71 0.00 -2.46 3.42 5.15 -1.26 -4.94 115.26 114.46 1vs7 n ASN 108 Ca 0.04 0.00 -0.17 0.00 -0.60 0.00 0.00 54.58 53.85 1vs7 n ASN 108 Cb 0.81 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 40.09 1vs7 n ASN 108 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1vs7 n ILE 109 N 0.00 1.90 -2.98 -1.44 -0.00 -1.24 0.29 119.36 115.89 1vs7 n ILE 109 Ca 0.00 -3.90 -0.38 0.00 -0.00 0.00 0.00 62.75 58.47 1vs7 n ILE 109 Cb 0.00 -0.27 -0.06 0.00 -0.00 0.00 0.00 39.64 39.31 1vs7 n ILE 109 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 1vs7 s THR 110 N -4.39 4.40 -0.03 1.39 -4.23 -1.23 -4.85 115.64 106.70 1vs7 s THR 110 Ca 0.40 1.60 -0.23 0.00 -1.18 0.00 0.00 61.69 62.28 1vs7 s THR 110 Cb 0.40 -4.04 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 1vs7 s THR 110 CO -0.04 0.37 0.70 -0.62 -0.54 0.00 0.00 174.62 174.48 1vs7 s ASP 111 N -1.38 7.03 -0.19 3.99 2.15 -1.26 -3.28 116.67 123.73 1vs7 s ASP 111 Ca 0.40 1.24 0.16 0.00 0.43 0.00 0.00 52.55 54.78 1vs7 s ASP 111 Cb -0.20 -2.42 0.47 0.00 -0.30 0.00 0.00 42.92 40.47 1vs7 s ASP 111 CO 0.24 -0.05 1.37 1.33 -0.17 0.00 0.00 175.17 177.89 1vs7 n VAL 112 N 3.39 2.25 -1.62 1.11 0.24 0.49 -4.97 118.33 119.22 1vs7 n VAL 112 Ca -0.02 -2.15 -0.43 0.00 -2.04 0.00 0.00 64.34 59.70 1vs7 n VAL 112 Cb 0.51 -0.26 -0.03 0.00 -1.47 0.00 0.00 33.84 32.59 1vs7 n VAL 112 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1vs7 s THR 113 N -2.93 3.01 0.21 3.34 2.01 -1.25 -4.89 115.64 115.14 1vs7 s THR 113 Ca 0.40 0.01 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 1vs7 s THR 113 Cb 0.34 -3.02 -0.09 0.00 0.01 0.00 0.00 72.50 69.74 1vs7 s THR 113 CO 0.06 -0.01 1.40 -2.16 -0.69 0.00 0.00 174.62 173.21 1vs7 s PRO 114 N 6.20 4.31 -0.09 4.92 0.04 -1.26 -4.98 135.00 144.14 1vs7 s PRO 114 Ca 0.99 2.19 0.01 0.00 0.04 0.00 0.00 61.00 64.23 1vs7 s PRO 114 Cb -0.34 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.07 1vs7 s PRO 114 CO 0.36 -0.38 -0.09 0.96 0.04 0.00 0.00 177.00 177.88 1vs7 s ILE 115 N 0.26 1.06 0.20 0.56 -5.25 -1.26 -5.08 121.20 111.68 1vs7 s ILE 115 Ca 0.60 -0.36 -0.30 0.00 -0.99 0.00 0.00 60.65 59.60 1vs7 s ILE 115 Cb -0.40 -1.03 -0.08 0.00 2.95 0.00 0.00 42.46 43.90 1vs7 s ILE 115 CO 0.39 0.36 1.04 -2.16 -1.79 0.00 0.00 174.94 172.78 1vs7 s PRO 116 N 1.26 4.68 -0.28 0.37 0.04 -1.26 -4.93 135.00 134.87 1vs7 s PRO 116 Ca -0.03 1.64 -0.02 0.00 0.04 0.00 0.00 61.00 62.62 1vs7 s PRO 116 Cb -0.14 -3.28 0.10 0.00 0.04 0.00 0.00 34.50 31.23 1vs7 s PRO 116 CO -0.03 0.23 2.36 0.72 0.04 0.00 0.00 177.00 180.32 1vs7 n HIS 117 N 1.99 1.21 -2.02 0.56 8.25 -1.26 -4.77 115.22 119.18 1vs7 n HIS 117 Ca 0.01 -1.80 -0.00 0.00 -0.26 0.00 0.00 57.72 55.67 1vs7 n HIS 117 Cb 0.47 -1.07 0.00 0.00 1.12 0.00 0.00 29.99 30.51 1vs7 n HIS 117 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1vs7 n ASN 118 N 0.83 -4.60 0.00 0.41 5.03 -1.26 -5.08 115.26 110.60 1vs7 n ASN 118 Ca 0.32 0.60 0.00 0.00 0.87 0.00 0.00 54.58 56.38 1vs7 n ASN 118 Cb 0.59 -2.87 0.00 0.00 -1.02 0.00 0.00 39.78 36.48 1vs7 n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1vs7 n GLY 119 N 0.27 -0.07 3.86 7.41 0.00 -1.26 -5.10 105.19 110.30 1vs7 n GLY 119 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1vs7 n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vs7 s ARG 121 N -2.84 3.61 0.62 0.00 3.52 -1.26 -5.03 118.95 117.57 1vs7 s ARG 121 Ca 0.50 0.28 -0.19 0.00 -0.13 0.00 0.00 55.73 56.19 1vs7 s ARG 121 Cb -0.11 -3.90 -0.02 0.00 -1.56 0.00 0.00 34.95 29.36 1vs7 s ARG 121 CO 0.19 -1.18 1.28 -1.25 -0.81 0.00 0.00 175.30 173.54 1vs7 s PRO 122 N 3.76 2.74 0.48 5.12 0.04 -1.26 -4.96 135.00 140.92 1vs7 s PRO 122 Ca 0.38 2.04 -0.22 0.00 0.04 0.00 0.00 61.00 63.24 1vs7 s PRO 122 Cb -0.10 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 1vs7 s PRO 122 CO 0.25 -1.44 1.14 -1.25 0.04 0.00 0.00 177.00 175.74 1vs7 s PRO 123 N -3.29 3.65 0.06 0.56 0.04 -1.26 -4.95 135.00 129.80 1vs7 s PRO 123 Ca 0.80 1.70 -0.24 0.00 0.04 0.00 0.00 61.00 63.30 1vs7 s PRO 123 Cb -0.36 -2.27 -0.17 0.00 0.04 0.00 0.00 34.50 31.74 1vs7 s PRO 123 CO 0.39 -0.62 1.60 0.87 0.04 0.00 0.00 177.00 179.28 1vs7 h LYS 124 N 1.78 -0.00 0.00 4.56 1.57 -2.07 -3.46 116.57 118.95 1vs7 h LYS 124 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1vs7 h LYS 124 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1vs7 h LYS 124 CO 0.59 0.14 0.00 1.17 -0.57 0.00 0.00 179.45 180.78 1vs7 n LYS 125 N -5.02 0.00 -1.97 3.15 3.00 -1.26 -4.77 118.16 111.29 1vs7 n LYS 125 Ca -0.07 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.83 1vs7 n LYS 125 Cb 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.11 1vs7 n LYS 125 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1vs7 s ARG 126 N 0.00 4.24 0.00 1.64 0.52 -1.26 -4.98 118.95 119.10 1vs7 s ARG 126 Ca 0.00 2.39 0.00 0.00 -0.52 0.00 0.00 55.73 57.60 1vs7 s ARG 126 Cb 0.00 -3.02 0.00 0.00 0.52 0.00 0.00 34.95 32.45 1vs7 s ARG 126 CO 0.00 -0.35 0.00 -2.13 0.02 0.00 0.00 175.30 172.84 1vs7 n ARG 127 N 0.64 0.00 0.00 3.54 0.63 -1.26 -5.24 116.66 114.96 1vs7 n ARG 127 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1vs7 n ARG 127 Cb 0.41 -0.09 0.00 0.00 0.45 0.00 0.00 32.46 33.22 1vs7 n ARG 127 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45