#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vwj n GLU 14 N 0.00 0.00 -0.92 0.00 4.71 -1.26 0.14 120.64 123.31 1vwj n GLU 14 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.16 56.98 1vwj n GLU 14 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 31.44 30.46 1vwj n GLU 14 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1vwj n ALA 15 N -0.37 5.17 0.91 0.62 0.00 -1.26 -3.45 120.51 122.14 1vwj n ALA 15 Ca 0.00 -1.68 0.11 0.00 0.00 0.00 0.00 53.44 51.87 1vwj n ALA 15 Cb 0.00 -1.42 0.13 0.00 0.00 0.00 0.00 19.45 18.16 1vwj n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vwj n GLY 16 N 0.45 -1.20 0.15 0.00 0.00 0.12 -3.35 105.19 101.37 1vwj n GLY 16 Ca 0.30 -0.41 -0.01 0.00 0.00 0.00 0.00 46.02 45.91 1vwj n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1vwj h ILE 17 N 0.00 1.39 -3.83 -0.61 2.04 -1.70 -3.43 117.51 111.36 1vwj h ILE 17 Ca 0.00 -1.88 -0.53 0.00 1.00 0.00 0.00 64.86 63.45 1vwj h ILE 17 Cb 0.55 2.01 0.09 0.00 -0.74 0.00 0.00 36.82 38.72 1vwj h ILE 17 CO 0.00 0.54 0.74 -0.89 0.00 0.00 0.00 178.15 178.54 1vwj s THR 18 N -3.78 2.31 -4.42 -0.27 2.01 -1.21 -4.76 115.64 105.51 1vwj s THR 18 Ca -0.02 0.30 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1vwj s THR 18 Cb 0.13 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.45 1vwj s THR 18 CO 0.76 0.07 0.00 0.61 -0.69 0.00 0.00 174.62 175.36 1vwj n GLY 19 N 0.83 0.92 3.47 4.40 0.00 -0.58 -5.00 105.19 109.23 1vwj n GLY 19 Ca 0.02 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 1vwj n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vwj s THR 20 N -2.11 3.91 0.18 2.61 2.01 -1.26 -1.67 115.64 119.31 1vwj s THR 20 Ca 0.00 -0.34 0.11 0.00 0.31 0.00 0.00 61.69 61.77 1vwj s THR 20 Cb 0.00 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 1vwj s THR 20 CO 0.00 0.47 -0.24 0.26 -0.69 0.00 0.00 174.62 174.42 1vwj s TRP 21 N 0.64 2.25 0.08 4.92 0.52 0.67 -4.51 118.94 123.51 1vwj s TRP 21 Ca -0.02 -0.37 0.06 0.00 0.02 0.00 0.00 56.10 55.79 1vwj s TRP 21 Cb -0.14 -1.13 -0.03 0.00 -1.15 0.00 0.00 33.47 31.02 1vwj s TRP 21 CO 0.02 0.46 -0.15 0.71 0.02 0.00 0.00 176.95 178.02 1vwj s TYR 22 N -1.62 1.30 0.52 -1.98 2.02 0.97 -1.14 117.35 117.42 1vwj s TYR 22 Ca 0.19 -0.47 0.03 0.00 -0.37 0.00 0.00 57.07 56.45 1vwj s TYR 22 Cb -0.08 -0.72 0.00 0.00 -0.40 0.00 0.00 41.96 40.76 1vwj s TYR 22 CO 0.09 0.09 0.13 0.54 -1.57 0.00 0.00 175.55 174.83 1vwj s ASN 23 N -1.88 4.29 0.42 2.29 2.20 -1.05 -1.11 114.94 120.10 1vwj s ASN 23 Ca 0.01 -1.50 0.29 0.00 -0.94 0.00 0.00 52.86 50.72 1vwj s ASN 23 Cb -0.09 0.45 1.40 0.00 -2.00 0.00 0.00 41.25 41.00 1vwj s ASN 23 CO 0.03 -0.92 1.89 0.06 -2.94 0.00 0.00 177.10 175.22 1vwj h GLN 24 N 1.17 0.00 0.00 3.55 -0.00 -1.92 -2.88 115.11 115.03 1vwj h GLN 24 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.23 1vwj h GLN 24 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.79 1vwj h GLN 24 CO 0.69 0.00 -0.54 -0.07 -0.00 0.00 0.00 178.83 178.91 1vwj h LEU 25 N 0.00 0.00 0.00 0.06 3.38 -1.95 -3.47 115.31 113.33 1vwj h LEU 25 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1vwj h LEU 25 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1vwj h LEU 25 CO 0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.15 1vwj n GLY 26 N 1.18 0.96 3.75 0.83 0.00 -1.09 -5.00 105.19 105.82 1vwj n GLY 26 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1vwj n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vwj s SER 27 N -1.69 5.24 0.08 1.61 0.01 -1.26 -4.81 113.70 112.87 1vwj s SER 27 Ca 0.00 2.47 0.08 0.00 1.31 0.00 0.00 55.95 59.81 1vwj s SER 27 Cb 0.00 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 1vwj s SER 27 CO 0.00 -1.57 -0.17 -0.89 0.41 0.00 0.00 173.24 171.02 1vwj s THR 28 N -1.51 2.86 -0.05 1.44 2.01 -0.54 -2.55 115.64 117.29 1vwj s THR 28 Ca 0.76 -1.33 0.01 0.00 0.31 0.00 0.00 61.69 61.43 1vwj s THR 28 Cb -0.33 -2.26 0.02 0.00 0.01 0.00 0.00 72.50 69.95 1vwj s THR 28 CO 0.36 0.22 -0.05 0.12 -0.69 0.00 0.00 174.62 174.59 1vwj s PHE 29 N -1.04 0.84 -0.19 4.92 5.36 -0.29 -1.36 117.98 126.21 1vwj s PHE 29 Ca 0.16 -0.26 0.01 0.00 -0.96 0.00 0.00 56.93 55.89 1vwj s PHE 29 Cb -0.11 -0.75 0.03 0.00 -0.34 0.00 0.00 43.02 41.85 1vwj s PHE 29 CO 0.08 -0.24 -0.16 0.42 -1.46 0.00 0.00 175.22 173.86 1vwj s ILE 30 N 1.11 1.90 0.10 3.12 1.01 -0.56 -0.23 121.20 127.64 1vwj s ILE 30 Ca -0.08 -0.99 0.03 0.00 0.00 0.00 0.00 60.65 59.62 1vwj s ILE 30 Cb -0.14 -1.81 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 1vwj s ILE 30 CO -0.01 0.38 -0.09 0.68 0.00 0.00 0.00 174.94 175.89 1vwj s VAL 31 N 1.32 0.89 -0.11 2.92 -7.23 -0.67 -1.66 120.40 115.86 1vwj s VAL 31 Ca 0.02 -1.70 0.03 0.00 -1.81 0.00 0.00 61.98 58.51 1vwj s VAL 31 Cb -0.15 -1.42 0.01 0.00 0.56 0.00 0.00 36.38 35.38 1vwj s VAL 31 CO -0.11 -0.62 -0.20 0.42 -0.31 0.00 0.00 175.10 174.28 1vwj s THR 32 N -2.68 1.81 -0.19 5.32 -4.23 -0.06 -1.53 115.64 114.08 1vwj s THR 32 Ca 0.07 -0.84 -0.07 0.00 -1.18 0.00 0.00 61.69 59.67 1vwj s THR 32 Cb -0.01 -1.60 -0.04 0.00 1.34 0.00 0.00 72.50 72.19 1vwj s THR 32 CO -0.01 0.50 0.05 0.00 -0.54 0.00 0.00 174.62 174.62 1vwj s ALA 33 N 0.73 3.32 0.47 3.99 0.00 -1.26 -1.95 121.76 127.07 1vwj s ALA 33 Ca -0.11 -0.80 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 1vwj s ALA 33 Cb -0.16 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.03 1vwj s ALA 33 CO 0.01 0.11 0.79 0.20 0.00 0.00 0.00 175.76 176.87 1vwj s GLY 34 N 0.51 1.56 0.55 0.00 0.00 0.43 -4.93 107.32 105.44 1vwj s GLY 34 Ca 0.02 -0.46 0.30 0.00 0.00 0.00 0.00 44.72 44.59 1vwj s GLY 34 CO 0.01 -0.29 2.12 0.00 0.00 0.00 0.00 173.10 174.94 1vwj h ALA 35 N 0.36 1.25 -0.52 3.20 0.00 -1.99 -3.06 119.26 118.50 1vwj h ALA 35 Ca -0.47 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1vwj h ALA 35 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1vwj h ALA 35 CO 0.62 0.10 0.00 -0.25 0.00 0.00 0.00 179.25 179.72 1vwj n ASP 36 N -3.55 3.94 0.00 0.00 8.00 -1.26 -4.86 116.55 118.82 1vwj n ASP 36 Ca -0.02 -2.36 0.00 0.00 0.71 0.00 0.00 54.79 53.12 1vwj n ASP 36 Cb 0.21 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.79 1vwj n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vwj n GLY 37 N 0.97 0.65 3.85 0.44 0.00 -1.16 -4.89 105.19 105.05 1vwj n GLY 37 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 1vwj n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vwj s ALA 38 N -2.00 3.31 -0.11 4.61 0.00 -1.26 -1.00 121.76 125.31 1vwj s ALA 38 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.02 1vwj s ALA 38 Cb 0.00 -2.79 0.02 0.00 0.00 0.00 0.00 23.12 20.35 1vwj s ALA 38 CO 0.00 0.32 -0.11 -1.17 0.00 0.00 0.00 175.76 174.81 1vwj s LEU 39 N -2.98 1.42 0.04 0.00 2.96 -0.68 -0.43 118.68 119.02 1vwj s LEU 39 Ca 0.54 -0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.12 1vwj s LEU 39 Cb -0.10 -0.93 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 1vwj s LEU 39 CO 0.17 -0.06 -0.07 0.42 -1.32 0.00 0.00 176.35 175.49 1vwj s THR 40 N 1.40 0.47 -3.25 3.68 -4.23 -0.82 -0.65 115.64 112.23 1vwj s THR 40 Ca 0.00 -1.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1vwj s THR 40 Cb -0.13 -0.67 0.00 0.00 1.34 0.00 0.00 72.50 73.03 1vwj s THR 40 CO -0.06 -0.47 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 1vwj n GLY 41 N 1.31 -0.82 3.14 3.99 0.00 -1.10 -0.88 105.19 110.83 1vwj n GLY 41 Ca -0.22 -0.99 -0.22 0.00 0.00 0.00 0.00 46.02 44.60 1vwj n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vwj s THR 42 N -3.00 1.18 -0.13 2.61 2.01 -0.66 -1.69 115.64 115.96 1vwj s THR 42 Ca 0.00 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.19 1vwj s THR 42 Cb 0.00 -1.02 -0.00 0.00 0.01 0.00 0.00 72.50 71.49 1vwj s THR 42 CO 0.00 0.18 -0.19 -0.47 -0.69 0.00 0.00 174.62 173.46 1vwj s TYR 43 N -0.59 2.70 -0.01 4.92 6.14 0.36 -1.49 117.35 129.39 1vwj s TYR 43 Ca 0.04 -1.02 0.06 0.00 0.64 0.00 0.00 57.07 56.79 1vwj s TYR 43 Cb -0.07 -1.82 -0.02 0.00 0.42 0.00 0.00 41.96 40.48 1vwj s TYR 43 CO 0.00 -0.43 -0.20 -1.83 0.64 0.00 0.00 175.55 173.72 1vwj s GLU 44 N 0.59 1.62 0.26 4.97 -1.05 -0.47 -0.94 118.70 123.68 1vwj s GLU 44 Ca -0.11 -0.76 -0.00 0.00 -0.15 0.00 0.00 54.97 53.95 1vwj s GLU 44 Cb -0.16 -1.59 0.05 0.00 -0.44 0.00 0.00 34.13 31.99 1vwj s GLU 44 CO 0.03 0.43 0.36 0.45 0.95 0.00 0.00 175.26 177.49 1vwj n SER 45 N 2.47 0.45 -1.41 0.83 2.88 -0.32 -1.47 113.62 117.05 1vwj n SER 45 Ca -0.15 -1.39 -0.14 0.00 -1.33 0.00 0.00 58.87 55.85 1vwj n SER 45 Cb 0.53 -0.24 -0.00 0.00 -0.75 0.00 0.00 64.21 63.75 1vwj n SER 45 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vwj n ALA 46 N -2.99 -1.79 0.00 -1.46 0.00 -1.26 -2.08 120.51 110.93 1vwj n ALA 46 Ca -0.06 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1vwj n ALA 46 Cb 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1vwj n ALA 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vwj n VAL 47 N -0.22 0.00 0.00 0.00 0.31 -1.26 -3.75 118.33 113.41 1vwj n VAL 47 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1vwj n VAL 47 Cb 0.11 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 1vwj n VAL 47 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1vwj n GLY 48 N -1.37 2.31 7.00 2.92 0.00 -0.88 -4.97 105.19 110.20 1vwj n GLY 48 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1vwj n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vwj n ASN 49 N 3.41 -2.83 0.03 1.61 2.85 -1.25 -4.60 115.26 114.49 1vwj n ASN 49 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1vwj n ASN 49 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1vwj n ASN 49 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1vwj n ALA 50 N 1.36 3.00 -3.19 5.20 0.00 -1.26 -4.84 120.51 120.78 1vwj n ALA 50 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1vwj n ALA 50 Cb 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.54 1vwj n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1vwj n GLU 51 N -3.03 3.52 -0.09 0.00 4.07 -1.26 -3.94 120.64 119.91 1vwj n GLU 51 Ca 0.00 -4.64 0.03 0.00 -0.06 0.00 0.00 57.16 52.49 1vwj n GLU 51 Cb 0.00 -2.37 0.07 0.00 -0.06 0.00 0.00 31.44 29.08 1vwj n GLU 51 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1vwj n SER 52 N 0.95 2.43 -4.86 4.31 3.41 -1.26 -4.85 113.62 113.75 1vwj n SER 52 Ca 0.29 -2.12 -0.37 0.00 -0.26 0.00 0.00 58.87 56.41 1vwj n SER 52 Cb 0.37 -0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 64.13 1vwj n SER 52 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1vwj s ARG 53 N -1.20 3.61 0.06 4.33 0.52 -1.25 -1.17 118.95 123.84 1vwj s ARG 53 Ca 0.12 0.02 0.03 0.00 -0.52 0.00 0.00 55.73 55.38 1vwj s ARG 53 Cb 0.08 -3.21 -0.03 0.00 0.52 0.00 0.00 34.95 32.31 1vwj s ARG 53 CO 0.06 0.73 -0.09 0.71 0.02 0.00 0.00 175.30 176.73 1vwj s TYR 54 N -0.97 0.87 0.30 -0.53 1.51 -0.12 -4.85 117.35 113.56 1vwj s TYR 54 Ca 0.17 -0.58 -0.19 0.00 -1.01 0.00 0.00 57.07 55.47 1vwj s TYR 54 Cb -0.13 -0.50 -0.09 0.00 -0.11 0.00 0.00 41.96 41.13 1vwj s TYR 54 CO 0.06 -0.05 0.78 0.08 -1.11 0.00 0.00 175.55 175.31 1vwj s VAL 55 N -1.85 4.55 0.06 0.71 1.01 -1.26 -0.49 120.40 123.13 1vwj s VAL 55 Ca -0.03 1.24 0.04 0.00 0.00 0.00 0.00 61.98 63.24 1vwj s VAL 55 Cb -0.07 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1vwj s VAL 55 CO 0.00 -0.02 -0.12 -1.48 0.00 0.00 0.00 175.10 173.49 1vwj s LEU 56 N -2.52 2.27 -0.02 3.92 0.05 -0.68 -4.38 118.68 117.32 1vwj s LEU 56 Ca 0.50 -0.59 -0.10 0.00 0.05 0.00 0.00 54.13 53.99 1vwj s LEU 56 Cb -0.13 -0.39 0.01 0.00 -2.05 0.00 0.00 46.19 43.63 1vwj s LEU 56 CO 0.19 -0.12 0.22 0.28 -0.55 0.00 0.00 176.35 176.36 1vwj s THR 57 N -1.30 0.06 0.00 5.48 -1.32 -1.09 -2.70 115.64 114.77 1vwj s THR 57 Ca -0.05 -0.47 0.00 0.00 -1.21 0.00 0.00 61.69 59.96 1vwj s THR 57 Cb -0.10 -0.47 0.00 0.00 -1.51 0.00 0.00 72.50 70.42 1vwj s THR 57 CO 0.02 -0.26 0.00 0.61 -2.21 0.00 0.00 174.62 172.78 1vwj n GLY 58 N 1.71 1.87 3.20 6.08 0.00 0.17 -1.24 105.19 116.98 1vwj n GLY 58 Ca -0.20 -0.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.85 1vwj n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vwj s ARG 59 N -0.85 0.71 0.13 1.61 1.81 -1.00 -1.69 118.95 119.68 1vwj s ARG 59 Ca 0.00 -0.55 -0.06 0.00 -1.72 0.00 0.00 55.73 53.40 1vwj s ARG 59 Cb 0.00 0.30 -0.02 0.00 -0.45 0.00 0.00 34.95 34.78 1vwj s ARG 59 CO 0.00 -0.21 0.18 1.52 -0.68 0.00 0.00 175.30 176.11 1vwj s TYR 60 N -2.39 0.51 -0.46 -0.53 1.13 -0.17 -2.19 117.35 113.25 1vwj s TYR 60 Ca -0.06 -0.90 -0.29 0.00 -1.41 0.00 0.00 57.07 54.41 1vwj s TYR 60 Cb -0.02 -0.21 0.03 0.00 -1.10 0.00 0.00 41.96 40.66 1vwj s TYR 60 CO -0.03 -0.61 1.13 0.34 -2.51 0.00 0.00 175.55 173.88 1vwj s ASP 61 N -2.97 6.67 0.00 -0.18 3.68 -0.53 -4.48 116.67 118.85 1vwj s ASP 61 Ca 0.17 0.54 0.30 0.00 2.13 0.00 0.00 52.55 55.69 1vwj s ASP 61 Cb 0.05 -2.55 1.72 0.00 -1.45 0.00 0.00 42.92 40.69 1vwj s ASP 61 CO -0.02 -1.21 2.12 -1.54 0.13 0.00 0.00 175.17 174.65 1vwj n SER 62 N 7.72 0.19 -3.19 -0.34 3.41 -1.26 -3.73 113.62 116.42 1vwj n SER 62 Ca 0.12 -1.11 -0.23 0.00 -0.26 0.00 0.00 58.87 57.40 1vwj n SER 62 Cb 0.49 -0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 1vwj n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vwj n ALA 63 N -0.83 2.36 -0.83 7.33 0.00 -1.26 -5.02 120.51 122.25 1vwj n ALA 63 Ca 0.22 -3.42 -0.29 0.00 0.00 0.00 0.00 53.44 49.95 1vwj n ALA 63 Cb 0.14 -0.84 0.20 0.00 0.00 0.00 0.00 19.45 18.94 1vwj n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1vwj s PRO 64 N -1.50 0.16 0.61 0.00 0.04 -1.24 -4.98 135.00 128.09 1vwj s PRO 64 Ca 0.36 0.92 -0.17 0.00 0.04 0.00 0.00 61.00 62.15 1vwj s PRO 64 Cb 0.21 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 33.05 1vwj s PRO 64 CO -0.10 -3.02 1.13 0.00 0.04 0.00 0.00 177.00 175.06 1vwj s ALA 65 N -2.68 2.55 -0.42 8.56 0.00 -1.26 -4.90 121.76 123.60 1vwj s ALA 65 Ca 0.66 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 53.34 1vwj s ALA 65 Cb -0.22 -3.36 0.19 0.00 0.00 0.00 0.00 23.12 19.74 1vwj s ALA 65 CO 0.60 -1.09 2.28 0.25 0.00 0.00 0.00 175.76 177.80 1vwj n THR 66 N -1.88 3.09 -4.55 0.00 -2.24 -1.26 -4.66 114.28 102.77 1vwj n THR 66 Ca 0.11 -2.33 -0.26 0.00 -2.27 0.00 0.00 64.05 59.30 1vwj n THR 66 Cb 0.51 -1.40 -0.07 0.00 -2.10 0.00 0.00 70.33 67.28 1vwj n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1vwj n ASP 67 N 0.35 1.98 -3.43 3.42 5.75 -1.26 -5.00 116.55 118.36 1vwj n ASP 67 Ca 0.41 -3.04 -0.39 0.00 -0.01 0.00 0.00 54.79 51.75 1vwj n ASP 67 Cb 0.57 0.73 -0.02 0.00 -1.03 0.00 0.00 41.12 41.37 1vwj n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vwj n GLY 68 N -0.61 4.22 3.65 6.12 0.00 -1.26 -4.87 105.19 112.44 1vwj n GLY 68 Ca -0.11 -1.49 -0.24 0.00 0.00 0.00 0.00 46.02 44.18 1vwj n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vwj s SER 69 N 2.58 4.27 0.67 1.61 0.01 -1.26 -5.13 113.70 116.45 1vwj s SER 69 Ca 0.62 -0.96 -0.01 0.00 1.31 0.00 0.00 55.95 56.90 1vwj s SER 69 Cb 0.16 -0.56 0.09 0.00 0.21 0.00 0.00 66.02 65.92 1vwj s SER 69 CO -0.06 -0.26 0.93 -0.83 0.41 0.00 0.00 173.24 173.43 1vwj s GLY 70 N -3.75 1.77 -0.32 3.44 0.00 -1.26 -4.93 107.32 102.27 1vwj s GLY 70 Ca 0.35 -1.48 -0.12 0.00 0.00 0.00 0.00 44.72 43.47 1vwj s GLY 70 CO 0.20 -1.02 0.22 -1.59 0.00 0.00 0.00 173.10 170.91 1vwj s THR 71 N -3.05 5.20 0.31 0.90 2.01 0.17 -4.80 115.64 116.38 1vwj s THR 71 Ca 0.63 -0.15 -0.29 0.00 0.31 0.00 0.00 61.69 62.19 1vwj s THR 71 Cb -0.08 -3.62 -0.10 0.00 0.01 0.00 0.00 72.50 68.71 1vwj s THR 71 CO 0.43 0.06 1.18 0.00 -0.69 0.00 0.00 174.62 175.60 1vwj s ALA 72 N 1.72 3.42 0.36 7.40 0.00 -1.26 -0.81 121.76 132.59 1vwj s ALA 72 Ca 0.06 1.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.90 1vwj s ALA 72 Cb -0.17 -3.39 0.05 0.00 0.00 0.00 0.00 23.12 19.61 1vwj s ALA 72 CO 0.10 -0.36 0.76 -0.48 0.00 0.00 0.00 175.76 175.78 1vwj s LEU 73 N -1.66 0.00 -0.08 0.00 0.05 -0.73 -1.46 118.68 114.81 1vwj s LEU 73 Ca 0.47 -1.06 -0.32 0.00 0.05 0.00 0.00 54.13 53.27 1vwj s LEU 73 Cb -0.35 2.76 0.12 0.00 -2.05 0.00 0.00 46.19 46.68 1vwj s LEU 73 CO 0.45 -1.61 1.18 -0.83 -0.55 0.00 0.00 176.35 174.99 1vwj s GLY 74 N -3.05 -0.35 0.22 -3.48 0.00 -0.93 -1.63 107.32 98.09 1vwj s GLY 74 Ca 0.15 1.08 -0.23 0.00 0.00 0.00 0.00 44.72 45.73 1vwj s GLY 74 CO 0.11 0.32 0.75 0.66 0.00 0.00 0.00 173.10 174.94 1vwj s TRP 75 N -2.57 -0.26 0.10 1.90 -2.14 -0.53 -2.36 118.94 113.08 1vwj s TRP 75 Ca 0.11 -0.10 0.06 0.00 2.66 0.00 0.00 56.10 58.82 1vwj s TRP 75 Cb 0.01 0.66 -0.03 0.00 -3.10 0.00 0.00 33.47 31.00 1vwj s TRP 75 CO -0.04 -1.04 -0.14 0.99 -2.66 0.00 0.00 176.95 174.05 1vwj s THR 76 N -3.72 1.24 -0.06 0.66 2.01 -0.37 -0.92 115.64 114.47 1vwj s THR 76 Ca 0.09 -1.53 -0.02 0.00 0.31 0.00 0.00 61.69 60.53 1vwj s THR 76 Cb -0.04 -1.33 0.04 0.00 0.01 0.00 0.00 72.50 71.18 1vwj s THR 76 CO 0.01 -0.33 0.12 -0.69 -0.69 0.00 0.00 174.62 173.04 1vwj s VAL 77 N -1.75 -0.12 -0.22 3.82 1.01 -0.19 -2.67 120.40 120.28 1vwj s VAL 77 Ca 0.04 0.28 -0.10 0.00 0.00 0.00 0.00 61.98 62.20 1vwj s VAL 77 Cb -0.07 -0.21 -0.05 0.00 0.00 0.00 0.00 36.38 36.05 1vwj s VAL 77 CO 0.03 0.11 0.13 0.00 0.00 0.00 0.00 175.10 175.37 1vwj s ALA 78 N 1.63 3.55 -0.64 5.51 0.00 -1.26 -0.69 121.76 129.86 1vwj s ALA 78 Ca -0.03 -0.84 -0.07 0.00 0.00 0.00 0.00 51.96 51.01 1vwj s ALA 78 Cb -0.12 -2.19 -0.19 0.00 0.00 0.00 0.00 23.12 20.62 1vwj s ALA 78 CO -0.05 -0.07 3.25 0.91 0.00 0.00 0.00 175.76 179.80 1vwj n TRP 79 N 4.03 0.95 -4.15 0.00 7.02 -0.39 -4.76 117.44 120.15 1vwj n TRP 79 Ca -0.16 -2.08 -0.15 0.00 -1.02 0.00 0.00 57.50 54.09 1vwj n TRP 79 Cb 0.52 -1.91 -0.14 0.00 -2.42 0.00 0.00 31.31 27.36 1vwj n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1vwj s LYS 80 N 1.57 0.43 0.00 -0.99 2.20 -1.26 -0.75 119.74 120.94 1vwj s LYS 80 Ca 0.66 -0.24 0.00 0.00 -0.36 0.00 0.00 55.97 56.03 1vwj s LYS 80 Cb 0.25 -0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.18 1vwj s LYS 80 CO -0.02 0.10 0.00 0.27 -0.36 0.00 0.00 175.35 175.34 1vwj n ASN 81 N 2.82 0.00 -0.05 1.43 0.23 0.33 -4.77 115.26 115.25 1vwj n ASN 81 Ca -0.14 -0.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.96 1vwj n ASN 81 Cb 0.58 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.28 1vwj n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1vwj n ASN 82 N -1.85 0.10 0.00 0.53 3.02 -1.26 -3.59 115.26 112.20 1vwj n ASN 82 Ca 0.00 -1.94 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1vwj n ASN 82 Cb 0.00 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1vwj n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1vwj n TYR 83 N -0.45 0.00 -4.06 3.10 4.02 -1.26 -5.09 117.16 113.42 1vwj n TYR 83 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 1vwj n TYR 83 Cb 0.02 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.24 1vwj n TYR 83 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1vwj s ARG 84 N -1.50 0.53 -0.24 -0.72 0.52 -1.24 -5.13 118.95 111.18 1vwj s ARG 84 Ca 0.00 -0.96 -0.03 0.00 -0.52 0.00 0.00 55.73 54.23 1vwj s ARG 84 Cb 0.00 0.03 0.11 0.00 0.52 0.00 0.00 34.95 35.61 1vwj s ARG 84 CO 0.00 -0.05 0.25 1.21 0.02 0.00 0.00 175.30 176.73 1vwj s ASN 85 N -2.22 1.49 -0.12 0.23 3.84 -1.26 -0.51 114.94 116.39 1vwj s ASN 85 Ca -0.03 -0.40 0.18 0.00 0.21 0.00 0.00 52.86 52.82 1vwj s ASN 85 Cb -0.01 0.44 0.73 0.00 -0.55 0.00 0.00 41.25 41.86 1vwj s ASN 85 CO -0.04 -0.35 1.64 0.00 -2.79 0.00 0.00 177.10 175.56 1vwj n ALA 86 N 5.32 3.16 -4.05 1.71 0.00 0.07 -4.96 120.51 121.75 1vwj n ALA 86 Ca -0.04 -1.60 -0.31 0.00 0.00 0.00 0.00 53.44 51.49 1vwj n ALA 86 Cb 0.48 -1.04 -0.05 0.00 0.00 0.00 0.00 19.45 18.84 1vwj n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1vwj n HIS 87 N 1.11 -1.11 -3.96 0.00 8.25 -1.26 -4.89 115.22 113.37 1vwj n HIS 87 Ca 0.26 0.36 -0.09 0.00 -0.26 0.00 0.00 57.72 58.00 1vwj n HIS 87 Cb 0.91 -2.38 -0.04 0.00 1.12 0.00 0.00 29.99 29.60 1vwj n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1vwj s SER 88 N -4.04 -0.07 -0.08 0.41 1.04 -1.26 -1.05 113.70 108.64 1vwj s SER 88 Ca 0.14 -0.89 -0.18 0.00 0.48 0.00 0.00 55.95 55.50 1vwj s SER 88 Cb -0.08 0.65 0.04 0.00 0.10 0.00 0.00 66.02 66.73 1vwj s SER 88 CO 0.85 -1.24 0.43 0.00 0.98 0.00 0.00 173.24 174.26 1vwj s ALA 89 N -3.84 -1.08 -0.01 5.32 0.00 -0.64 -1.26 121.76 120.26 1vwj s ALA 89 Ca 0.19 0.85 0.07 0.00 0.00 0.00 0.00 51.96 53.07 1vwj s ALA 89 Cb -0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1vwj s ALA 89 CO 0.09 -0.26 -0.21 0.99 0.00 0.00 0.00 175.76 176.37 1vwj s THR 90 N -0.71 1.67 -0.06 0.00 2.01 0.13 -1.26 115.64 117.42 1vwj s THR 90 Ca -0.08 -0.96 0.04 0.00 0.31 0.00 0.00 61.69 61.00 1vwj s THR 90 Cb -0.04 -1.40 0.00 0.00 0.01 0.00 0.00 72.50 71.08 1vwj s THR 90 CO 0.04 0.42 -0.17 0.42 -0.69 0.00 0.00 174.62 174.64 1vwj s THR 91 N -0.55 1.47 -0.09 -0.82 -4.23 -0.57 -1.02 115.64 109.83 1vwj s THR 91 Ca 0.08 -0.71 0.01 0.00 -1.18 0.00 0.00 61.69 59.90 1vwj s THR 91 Cb -0.08 -1.28 -0.02 0.00 1.34 0.00 0.00 72.50 72.46 1vwj s THR 91 CO -0.00 0.42 -0.12 0.26 -0.54 0.00 0.00 174.62 174.64 1vwj s TRP 92 N 0.27 2.80 -0.07 3.99 0.51 -0.10 -1.67 118.94 124.67 1vwj s TRP 92 Ca -0.10 -0.32 0.03 0.00 -2.12 0.00 0.00 56.10 53.59 1vwj s TRP 92 Cb -0.14 -1.74 0.01 0.00 -0.81 0.00 0.00 33.47 30.78 1vwj s TRP 92 CO 0.04 0.04 -0.16 0.45 -0.51 0.00 0.00 176.95 176.81 1vwj s SER 93 N -0.26 2.13 0.00 2.95 0.15 -0.52 -1.45 113.70 116.70 1vwj s SER 93 Ca 0.02 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1vwj s SER 93 Cb -0.13 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.29 1vwj s SER 93 CO 0.03 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.17 1vwj n GLY 94 N 3.59 1.18 3.15 9.45 0.00 -0.65 -2.20 105.19 119.71 1vwj n GLY 94 Ca -0.21 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.26 1vwj n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1vwj s GLN 95 N 1.52 0.59 -0.12 1.61 -2.07 -0.66 -1.77 119.66 118.77 1vwj s GLN 95 Ca 0.00 -0.48 -0.08 0.00 -1.82 0.00 0.00 55.36 52.98 1vwj s GLN 95 Cb 0.00 0.25 -0.04 0.00 -1.09 0.00 0.00 33.01 32.12 1vwj s GLN 95 CO 0.00 -0.15 0.17 -0.47 -1.32 0.00 0.00 175.29 173.51 1vwj s TYR 96 N -1.87 3.59 -0.08 9.60 5.04 0.01 -1.19 117.35 132.45 1vwj s TYR 96 Ca -0.11 0.56 0.00 0.00 -2.44 0.00 0.00 57.07 55.08 1vwj s TYR 96 Cb -0.05 -2.00 0.02 0.00 0.35 0.00 0.00 41.96 40.28 1vwj s TYR 96 CO -0.00 0.68 -0.07 0.08 -1.34 0.00 0.00 175.55 174.90 1vwj s VAL 97 N -0.87 0.82 0.27 3.14 1.01 -0.47 -0.65 120.40 123.65 1vwj s VAL 97 Ca 0.15 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1vwj s VAL 97 Cb -0.12 -0.84 0.04 0.00 0.00 0.00 0.00 36.38 35.46 1vwj s VAL 97 CO 0.04 0.31 0.32 0.61 0.00 0.00 0.00 175.10 176.39 1vwj n GLY 98 N 4.47 2.20 0.00 4.51 0.00 -1.26 -1.21 105.19 113.90 1vwj n GLY 98 Ca -0.17 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.66 1vwj n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vwj n GLY 99 N 1.78 0.69 0.24 -0.02 0.00 -1.26 -4.66 105.19 101.96 1vwj n GLY 99 Ca 0.05 -2.09 -0.01 0.00 0.00 0.00 0.00 46.02 43.98 1vwj n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vwj h ALA 100 N 0.00 0.80 -2.52 4.61 0.00 -2.07 -3.16 119.26 116.93 1vwj h ALA 100 Ca 0.00 0.05 -0.68 0.00 0.00 0.00 0.00 54.91 54.28 1vwj h ALA 100 Cb 0.00 -0.02 -0.37 0.00 0.00 0.00 0.00 17.79 17.40 1vwj h ALA 100 CO 0.00 -0.11 -0.14 -0.85 0.00 0.00 0.00 179.25 178.15 1vwj n GLU 101 N -4.91 2.84 -1.90 0.00 0.28 -1.26 -5.08 120.64 110.61 1vwj n GLU 101 Ca 0.08 -4.56 -0.39 0.00 -0.16 0.00 0.00 57.16 52.13 1vwj n GLU 101 Cb 0.22 -2.37 0.02 0.00 1.43 0.00 0.00 31.44 30.74 1vwj n GLU 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1vwj s ALA 102 N -1.97 3.12 0.11 -1.84 0.00 -1.20 -4.88 121.76 115.10 1vwj s ALA 102 Ca 0.32 1.33 -0.11 0.00 0.00 0.00 0.00 51.96 53.49 1vwj s ALA 102 Cb 0.02 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.61 1vwj s ALA 102 CO -0.06 -1.10 0.28 1.03 0.00 0.00 0.00 175.76 175.91 1vwj s ARG 103 N -2.53 0.97 -0.18 0.00 3.00 -0.35 -4.38 118.95 115.48 1vwj s ARG 103 Ca 0.63 -0.89 -0.00 0.00 0.00 0.00 0.00 55.73 55.46 1vwj s ARG 103 Cb -0.40 0.40 0.04 0.00 0.00 0.00 0.00 34.95 34.99 1vwj s ARG 103 CO 0.51 -0.35 -0.06 0.42 0.00 0.00 0.00 175.30 175.81 1vwj s ILE 104 N -3.85 1.27 -0.24 1.52 1.01 -0.75 -1.37 121.20 118.79 1vwj s ILE 104 Ca 0.06 -0.76 -0.10 0.00 0.00 0.00 0.00 60.65 59.85 1vwj s ILE 104 Cb 0.03 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 1vwj s ILE 104 CO -0.10 0.12 0.13 0.20 0.00 0.00 0.00 174.94 175.30 1vwj s ASN 105 N 1.56 5.84 0.18 3.58 0.02 -0.34 -1.22 114.94 124.56 1vwj s ASN 105 Ca -0.00 0.02 0.02 0.00 -1.02 0.00 0.00 52.86 51.88 1vwj s ASN 105 Cb -0.16 -2.05 -0.05 0.00 0.02 0.00 0.00 41.25 39.01 1vwj s ASN 105 CO -0.08 0.04 0.01 0.42 0.02 0.00 0.00 177.10 177.52 1vwj s THR 106 N 1.19 0.62 0.06 1.60 -4.23 0.25 -1.65 115.64 113.48 1vwj s THR 106 Ca 0.06 -1.98 0.06 0.00 -1.18 0.00 0.00 61.69 58.66 1vwj s THR 106 Cb -0.14 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 1vwj s THR 106 CO 0.05 -0.43 -0.17 -1.10 -0.54 0.00 0.00 174.62 172.43 1vwj s GLN 107 N -3.94 1.04 0.07 3.99 -0.21 -0.94 -1.01 119.66 118.67 1vwj s GLN 107 Ca 0.25 -0.90 0.00 0.00 0.02 0.00 0.00 55.36 54.73 1vwj s GLN 107 Cb 0.06 -1.12 -0.04 0.00 1.00 0.00 0.00 33.01 32.92 1vwj s GLN 107 CO 0.05 0.27 -0.05 1.67 -2.12 0.00 0.00 175.29 175.11 1vwj s TRP 108 N -0.97 0.66 -0.11 0.91 1.48 0.26 -1.44 118.94 119.73 1vwj s TRP 108 Ca 0.03 -0.97 0.01 0.00 -1.06 0.00 0.00 56.10 54.10 1vwj s TRP 108 Cb -0.09 -0.43 0.02 0.00 -1.16 0.00 0.00 33.47 31.81 1vwj s TRP 108 CO 0.02 -0.27 -0.11 -0.51 -4.06 0.00 0.00 176.95 172.01 1vwj s LEU 109 N -2.87 1.46 -0.28 -4.66 1.43 -0.67 -1.99 118.68 111.10 1vwj s LEU 109 Ca 0.08 -0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 52.80 1vwj s LEU 109 Cb 0.06 -0.95 0.04 0.00 0.03 0.00 0.00 46.19 45.37 1vwj s LEU 109 CO -0.07 -0.05 -0.01 -0.22 0.23 0.00 0.00 176.35 176.22 1vwj s LEU 110 N 1.34 3.68 -0.09 1.79 0.20 -0.44 -1.51 118.68 123.64 1vwj s LEU 110 Ca -0.01 -1.12 -0.00 0.00 0.69 0.00 0.00 54.13 53.69 1vwj s LEU 110 Cb -0.14 -1.71 -0.03 0.00 -0.43 0.00 0.00 46.19 43.89 1vwj s LEU 110 CO -0.05 -0.22 -0.05 -0.89 -0.29 0.00 0.00 176.35 174.85 1vwj s THR 111 N 1.29 3.85 0.14 3.68 2.01 -0.39 -0.88 115.64 125.34 1vwj s THR 111 Ca -0.03 -0.41 0.06 0.00 0.31 0.00 0.00 61.69 61.61 1vwj s THR 111 Cb -0.19 -2.60 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 1vwj s THR 111 CO -0.02 0.58 0.03 -0.44 -0.69 0.00 0.00 174.62 174.08 1vwj s SER 112 N -0.64 5.04 -0.18 3.53 0.01 -0.26 -1.62 113.70 119.58 1vwj s SER 112 Ca 0.10 -0.25 -0.28 0.00 1.31 0.00 0.00 55.95 56.84 1vwj s SER 112 Cb -0.12 -1.18 -0.00 0.00 0.21 0.00 0.00 66.02 64.93 1vwj s SER 112 CO 0.02 0.12 0.95 -0.83 0.41 0.00 0.00 173.24 173.91 1vwj s GLY 113 N -2.70 1.98 0.45 3.44 0.00 -0.21 -4.89 107.32 105.38 1vwj s GLY 113 Ca 0.27 0.15 0.03 0.00 0.00 0.00 0.00 44.72 45.18 1vwj s GLY 113 CO 0.19 1.93 0.11 -0.51 0.00 0.00 0.00 173.10 174.83 1vwj s THR 114 N 2.57 0.63 0.34 0.90 -4.23 -1.26 -5.00 115.64 109.59 1vwj s THR 114 Ca 0.42 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.96 1vwj s THR 114 Cb -0.16 -2.23 -0.02 0.00 1.34 0.00 0.00 72.50 71.43 1vwj s THR 114 CO 0.11 0.00 0.51 0.42 -0.54 0.00 0.00 174.62 175.12 1vwj s THR 115 N -3.11 4.62 0.15 3.99 -4.23 -1.26 -4.90 115.64 110.89 1vwj s THR 115 Ca 0.17 -0.73 -0.30 0.00 -1.18 0.00 0.00 61.69 59.65 1vwj s THR 115 Cb 0.01 -3.66 -0.08 0.00 1.34 0.00 0.00 72.50 70.12 1vwj s THR 115 CO 0.12 -0.35 1.52 -0.33 -0.54 0.00 0.00 174.62 175.04 1vwj h GLU 116 N 0.80 -0.08 -0.98 3.99 4.39 -2.01 0.29 114.58 120.97 1vwj h GLU 116 Ca -0.48 0.01 0.29 0.00 0.34 0.00 0.00 59.36 59.51 1vwj h GLU 116 Cb 1.24 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.87 1vwj h GLU 116 CO 0.58 -0.06 0.92 0.00 -1.16 0.00 0.00 179.01 179.29 1vwj h ALA 117 N 0.33 2.84 -0.12 3.43 0.00 -2.06 0.29 119.26 123.97 1vwj h ALA 117 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1vwj h ALA 117 Cb 0.44 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1vwj h ALA 117 CO -0.83 -1.42 0.00 0.09 0.00 0.00 0.00 179.25 177.08 1vwj n ASN 118 N -3.68 2.40 -0.34 0.00 3.02 0.01 -4.59 115.26 112.09 1vwj n ASN 118 Ca 0.21 -1.68 0.06 0.00 -0.03 0.00 0.00 54.58 53.14 1vwj n ASN 118 Cb 1.24 -0.07 0.25 0.00 -0.61 0.00 0.00 39.78 40.58 1vwj n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vwj h ALA 119 N 2.69 1.54 -0.29 5.41 0.00 0.40 -2.21 119.26 126.80 1vwj h ALA 119 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1vwj h ALA 119 Cb 0.63 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1vwj h ALA 119 CO 0.00 0.27 0.22 0.11 0.00 0.00 0.00 179.25 179.85 1vwj h TRP 120 N 1.00 0.00 -1.10 0.00 5.08 -1.81 -2.50 115.95 116.62 1vwj h TRP 120 Ca 0.45 0.00 -0.58 0.00 1.08 0.00 0.00 58.89 59.84 1vwj h TRP 120 Cb 0.38 0.00 -0.41 0.00 -3.00 0.00 0.00 29.16 26.13 1vwj h TRP 120 CO -0.00 0.00 -0.56 0.36 -1.28 0.00 0.00 178.44 176.95 1vwj n LYS 121 N -4.34 3.44 0.14 0.12 0.00 -0.83 -4.72 118.16 111.96 1vwj n LYS 121 Ca 0.04 -4.19 0.08 0.00 -0.00 0.00 0.00 58.31 54.24 1vwj n LYS 121 Cb 0.38 -2.27 0.04 0.00 -0.00 0.00 0.00 35.03 33.19 1vwj n LYS 121 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1vwj h SER 122 N 2.35 0.00 -3.29 -5.58 4.64 -1.45 -3.47 113.55 106.75 1vwj h SER 122 Ca 0.37 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 61.03 1vwj h SER 122 Cb 1.19 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.98 1vwj h SER 122 CO 0.89 0.19 -0.80 -0.89 -0.87 0.00 0.00 176.83 175.35 1vwj s THR 123 N -3.17 2.69 0.16 2.95 2.01 -1.26 -1.10 115.64 117.93 1vwj s THR 123 Ca 0.02 -0.77 0.04 0.00 0.31 0.00 0.00 61.69 61.30 1vwj s THR 123 Cb 0.08 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 1vwj s THR 123 CO 0.75 0.52 0.18 -0.76 -0.69 0.00 0.00 174.62 174.62 1vwj s LEU 124 N 0.73 3.96 0.03 4.42 1.43 -0.06 -4.93 118.68 124.27 1vwj s LEU 124 Ca -0.07 -0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.02 1vwj s LEU 124 Cb -0.16 -2.56 -0.02 0.00 0.03 0.00 0.00 46.19 43.49 1vwj s LEU 124 CO 0.01 0.06 -0.08 0.54 0.23 0.00 0.00 176.35 177.11 1vwj s VAL 125 N -1.76 0.61 0.05 -1.59 0.11 -1.26 -1.33 120.40 115.24 1vwj s VAL 125 Ca 0.32 -0.83 -0.02 0.00 -2.93 0.00 0.00 61.98 58.51 1vwj s VAL 125 Cb -0.10 -0.61 0.01 0.00 -1.53 0.00 0.00 36.38 34.14 1vwj s VAL 125 CO 0.25 -0.17 0.13 0.61 -3.33 0.00 0.00 175.10 172.58 1vwj n GLY 126 N 1.95 1.69 3.00 6.54 0.00 -0.84 -4.97 105.19 112.55 1vwj n GLY 126 Ca -0.19 -1.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 1vwj n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1vwj s HIS 127 N -7.36 0.03 0.02 1.61 -3.43 -1.26 -0.58 115.29 104.32 1vwj s HIS 127 Ca 0.03 -0.05 0.01 0.00 -0.80 0.00 0.00 55.06 54.24 1vwj s HIS 127 Cb -0.01 -0.04 -0.01 0.00 -1.43 0.00 0.00 32.58 31.09 1vwj s HIS 127 CO 0.02 -0.14 -0.04 -0.51 -2.00 0.00 0.00 174.74 172.06 1vwj s ASP 128 N -0.69 0.46 -0.11 7.38 1.01 -0.18 -4.95 116.67 119.59 1vwj s ASP 128 Ca -0.08 -0.32 0.03 0.00 0.71 0.00 0.00 52.55 52.90 1vwj s ASP 128 Cb -0.05 0.02 0.01 0.00 1.01 0.00 0.00 42.92 43.91 1vwj s ASP 128 CO 0.00 -0.13 -0.22 -0.89 0.21 0.00 0.00 175.17 174.15 1vwj s THR 129 N -0.83 1.94 0.01 -1.27 2.01 -1.26 -0.59 115.64 115.65 1vwj s THR 129 Ca -0.07 -0.93 0.05 0.00 0.31 0.00 0.00 61.69 61.05 1vwj s THR 129 Cb -0.06 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 1vwj s THR 129 CO -0.00 0.53 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.98 1vwj s PHE 130 N 0.57 2.74 0.29 4.92 0.08 -0.36 -3.78 117.98 122.44 1vwj s PHE 130 Ca -0.14 -0.13 0.04 0.00 0.12 0.00 0.00 56.93 56.81 1vwj s PHE 130 Cb -0.17 -1.56 -0.04 0.00 -0.57 0.00 0.00 43.02 40.69 1vwj s PHE 130 CO 0.04 0.30 0.19 0.95 -0.10 0.00 0.00 175.22 176.61 1vwj s THR 131 N -0.94 0.16 -1.54 0.64 -4.23 -0.26 -1.81 115.64 107.66 1vwj s THR 131 Ca 0.15 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.85 1vwj s THR 131 Cb -0.11 -2.50 0.62 0.00 1.34 0.00 0.00 72.50 71.86 1vwj s THR 131 CO 0.06 0.00 1.52 0.29 -0.54 0.00 0.00 174.62 175.95 1vwj n LYS 132 N -0.54 3.06 0.00 3.99 5.02 -1.26 -0.02 118.16 128.41 1vwj n LYS 132 Ca 0.03 -2.49 0.03 0.00 -2.02 0.00 0.00 58.31 53.86 1vwj n LYS 132 Cb 0.64 -1.70 0.03 0.00 -0.02 0.00 0.00 35.03 33.98 1vwj n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16