#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vwl h GLU 14 N 0.00 0.39 -0.05 0.00 -0.00 -1.91 -3.10 114.58 109.90 1vwl h GLU 14 Ca 0.00 -0.04 0.04 0.00 -0.00 0.00 0.00 59.36 59.36 1vwl h GLU 14 Cb 0.00 -0.08 -0.06 0.00 -0.00 0.00 0.00 28.75 28.61 1vwl h GLU 14 CO 0.00 0.31 -0.37 0.00 -0.00 0.00 0.00 179.01 178.95 1vwl h ALA 15 N 1.05 -0.53 -1.03 1.06 0.00 -1.93 -0.63 119.26 117.25 1vwl h ALA 15 Ca 0.10 -0.01 0.28 0.00 0.00 0.00 0.00 54.91 55.28 1vwl h ALA 15 Cb 0.03 0.67 -0.12 0.00 0.00 0.00 0.00 17.79 18.37 1vwl h ALA 15 CO -0.02 -0.88 0.63 0.78 0.00 0.00 0.00 179.25 179.76 1vwl h GLY 16 N -0.49 1.72 1.20 0.00 0.00 -2.00 -1.32 103.07 102.18 1vwl h GLY 16 Ca 0.07 -0.26 -0.31 0.00 0.00 0.00 0.00 47.33 46.83 1vwl h GLY 16 CO -0.33 -0.28 -1.56 -2.22 0.00 0.00 0.00 176.54 172.16 1vwl h ILE 17 N 0.45 1.13 -3.63 2.60 2.04 -1.33 -3.46 117.51 115.31 1vwl h ILE 17 Ca 0.66 -2.75 -0.56 0.00 1.00 0.00 0.00 64.86 63.21 1vwl h ILE 17 Cb 1.48 2.78 0.12 0.00 -0.74 0.00 0.00 36.82 40.47 1vwl h ILE 17 CO -0.45 0.82 0.53 0.41 0.00 0.00 0.00 178.15 179.46 1vwl n THR 18 N -3.49 2.64 0.00 -0.27 -1.04 -0.30 -4.80 114.28 107.02 1vwl n THR 18 Ca -0.17 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.34 1vwl n THR 18 Cb 1.05 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.95 1vwl n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1vwl n GLY 19 N 0.77 0.80 3.53 3.41 0.00 -0.66 -4.69 105.19 108.36 1vwl n GLY 19 Ca 0.06 -2.02 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 1vwl n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vwl s THR 20 N -1.76 3.52 0.11 2.61 2.01 0.42 -1.38 115.64 121.18 1vwl s THR 20 Ca 0.00 -0.53 0.03 0.00 0.31 0.00 0.00 61.69 61.49 1vwl s THR 20 Cb 0.00 -2.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.02 1vwl s THR 20 CO 0.00 0.58 -0.08 0.26 -0.69 0.00 0.00 174.62 174.68 1vwl s TRP 21 N -0.54 1.01 0.06 4.92 0.52 0.39 -1.00 118.94 124.31 1vwl s TRP 21 Ca 0.08 -0.80 0.01 0.00 0.02 0.00 0.00 56.10 55.40 1vwl s TRP 21 Cb -0.12 -0.56 -0.04 0.00 -1.15 0.00 0.00 33.47 31.61 1vwl s TRP 21 CO 0.02 -0.05 -0.05 0.71 0.02 0.00 0.00 176.95 177.59 1vwl s TYR 22 N -3.20 0.66 0.50 -1.98 2.02 -0.48 -1.54 117.35 113.34 1vwl s TYR 22 Ca 0.11 -0.84 0.01 0.00 -0.37 0.00 0.00 57.07 55.97 1vwl s TYR 22 Cb 0.02 -0.42 0.01 0.00 -0.40 0.00 0.00 41.96 41.17 1vwl s TYR 22 CO -0.02 -0.21 0.04 0.27 -1.57 0.00 0.00 175.55 174.06 1vwl n ASN 23 N 0.47 3.29 0.00 2.29 0.23 -1.05 -0.43 115.26 120.06 1vwl n ASN 23 Ca -0.16 -3.12 0.03 0.00 -0.53 0.00 0.00 54.58 50.80 1vwl n ASN 23 Cb 0.59 0.30 0.12 0.00 -2.08 0.00 0.00 39.78 38.71 1vwl n ASN 23 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1vwl n GLN 24 N -1.28 0.00 0.02 -3.83 0.00 -1.21 -2.01 117.38 109.06 1vwl n GLN 24 Ca -0.18 0.40 0.11 0.00 0.00 0.00 0.00 57.00 57.32 1vwl n GLN 24 Cb 0.62 -1.50 -0.01 0.00 0.00 0.00 0.00 30.24 29.35 1vwl n GLN 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1vwl n LEU 25 N -1.49 0.61 0.00 2.61 4.77 -1.26 -4.95 117.00 117.29 1vwl n LEU 25 Ca 0.01 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1vwl n LEU 25 Cb 0.07 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1vwl n LEU 25 CO 0.05 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 1vwl n GLY 26 N 1.38 1.01 3.86 -0.72 0.00 -0.85 -4.78 105.19 105.09 1vwl n GLY 26 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 1vwl n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vwl s SER 27 N -2.00 6.57 -0.11 1.61 0.01 -1.26 -3.70 113.70 114.82 1vwl s SER 27 Ca 0.00 1.29 -0.02 0.00 1.31 0.00 0.00 55.95 58.53 1vwl s SER 27 Cb 0.00 -2.39 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 1vwl s SER 27 CO 0.00 -0.45 -0.03 -0.89 0.41 0.00 0.00 173.24 172.28 1vwl s THR 28 N -2.44 4.04 -0.11 1.44 2.01 -0.87 -2.52 115.64 117.20 1vwl s THR 28 Ca 0.54 -0.33 -0.00 0.00 0.31 0.00 0.00 61.69 62.21 1vwl s THR 28 Cb -0.10 -2.72 0.02 0.00 0.01 0.00 0.00 72.50 69.71 1vwl s THR 28 CO 0.31 0.56 -0.08 0.12 -0.69 0.00 0.00 174.62 174.83 1vwl s PHE 29 N -0.38 1.51 -0.20 4.92 5.36 -0.59 0.01 117.98 128.62 1vwl s PHE 29 Ca 0.07 -0.74 0.01 0.00 -0.96 0.00 0.00 56.93 55.30 1vwl s PHE 29 Cb -0.12 -1.24 0.03 0.00 -0.34 0.00 0.00 43.02 41.35 1vwl s PHE 29 CO 0.02 -0.50 -0.17 0.42 -1.46 0.00 0.00 175.22 173.54 1vwl s ILE 30 N 1.60 2.01 0.11 3.12 1.01 -0.45 -0.46 121.20 128.14 1vwl s ILE 30 Ca 0.03 -1.08 0.04 0.00 0.00 0.00 0.00 60.65 59.65 1vwl s ILE 30 Cb -0.13 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1vwl s ILE 30 CO -0.07 0.37 -0.11 0.54 0.00 0.00 0.00 174.94 175.66 1vwl s VAL 31 N 1.27 1.08 -0.06 2.92 0.11 -0.48 -1.38 120.40 123.86 1vwl s VAL 31 Ca 0.01 -1.67 0.02 0.00 -2.93 0.00 0.00 61.98 57.40 1vwl s VAL 31 Cb -0.15 -1.43 0.02 0.00 -1.53 0.00 0.00 36.38 33.29 1vwl s VAL 31 CO -0.11 -0.52 -0.09 -0.89 -3.33 0.00 0.00 175.10 170.17 1vwl s THR 32 N -2.36 0.90 -0.19 5.04 2.01 -0.19 -1.66 115.64 119.20 1vwl s THR 32 Ca 0.07 -0.33 -0.08 0.00 0.31 0.00 0.00 61.69 61.65 1vwl s THR 32 Cb -0.03 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.58 1vwl s THR 32 CO 0.01 0.30 0.08 0.00 -0.69 0.00 0.00 174.62 174.32 1vwl s ALA 33 N 0.80 3.46 0.31 7.40 0.00 -1.26 -2.40 121.76 130.06 1vwl s ALA 33 Ca -0.13 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.12 1vwl s ALA 33 Cb -0.15 -1.98 -0.03 0.00 0.00 0.00 0.00 23.12 20.96 1vwl s ALA 33 CO 0.02 0.15 0.46 0.20 0.00 0.00 0.00 175.76 176.59 1vwl s GLY 34 N 0.42 1.33 0.60 0.00 0.00 0.27 -4.83 107.32 105.12 1vwl s GLY 34 Ca 0.04 -1.14 0.31 0.00 0.00 0.00 0.00 44.72 43.93 1vwl s GLY 34 CO -0.00 -1.10 2.24 0.00 0.00 0.00 0.00 173.10 174.24 1vwl h ALA 35 N 0.93 1.53 -0.09 3.20 0.00 -1.99 -2.42 119.26 120.43 1vwl h ALA 35 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1vwl h ALA 35 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1vwl h ALA 35 CO 0.60 -0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.40 1vwl n ASP 36 N -3.78 0.62 0.00 0.00 5.75 -1.26 -4.87 116.55 113.01 1vwl n ASP 36 Ca -0.02 -1.74 0.00 0.00 -0.01 0.00 0.00 54.79 53.02 1vwl n ASP 36 Cb 0.12 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 1vwl n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vwl n GLY 37 N 0.81 0.71 3.86 6.12 0.00 -0.91 -4.97 105.19 110.83 1vwl n GLY 37 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1vwl n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vwl s ALA 38 N -2.38 3.37 -0.07 4.61 0.00 -1.25 -1.21 121.76 124.84 1vwl s ALA 38 Ca 0.00 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.86 1vwl s ALA 38 Cb 0.00 -2.68 0.02 0.00 0.00 0.00 0.00 23.12 20.45 1vwl s ALA 38 CO 0.00 0.21 -0.10 -1.17 0.00 0.00 0.00 175.76 174.70 1vwl s LEU 39 N -3.33 1.54 0.04 0.00 2.96 -0.76 -0.56 118.68 118.56 1vwl s LEU 39 Ca 0.52 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 54.14 1vwl s LEU 39 Cb -0.10 -0.77 -0.03 0.00 0.50 0.00 0.00 46.19 45.79 1vwl s LEU 39 CO 0.24 0.00 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.36 1vwl s THR 40 N 0.82 0.17 -3.75 3.68 2.01 -1.01 -1.36 115.64 116.20 1vwl s THR 40 Ca -0.12 -1.36 0.00 0.00 0.31 0.00 0.00 61.69 60.52 1vwl s THR 40 Cb -0.15 -0.93 0.00 0.00 0.01 0.00 0.00 72.50 71.43 1vwl s THR 40 CO 0.02 -0.75 0.00 0.61 -0.69 0.00 0.00 174.62 173.81 1vwl n GLY 41 N 0.80 -0.67 3.10 4.40 0.00 -1.08 -1.02 105.19 110.73 1vwl n GLY 41 Ca -0.19 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 44.66 1vwl n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vwl s THR 42 N -3.00 0.77 0.04 2.61 -4.23 -0.48 -1.80 115.64 109.55 1vwl s THR 42 Ca 0.00 -1.10 0.09 0.00 -1.18 0.00 0.00 61.69 59.50 1vwl s THR 42 Cb 0.00 -0.78 -0.03 0.00 1.34 0.00 0.00 72.50 73.03 1vwl s THR 42 CO 0.00 -0.27 -0.26 -0.47 -0.54 0.00 0.00 174.62 173.08 1vwl s TYR 43 N -1.23 2.35 0.05 3.99 6.14 -0.27 -1.34 117.35 127.02 1vwl s TYR 43 Ca -0.06 -0.40 0.04 0.00 0.64 0.00 0.00 57.07 57.29 1vwl s TYR 43 Cb -0.09 -1.41 -0.02 0.00 0.42 0.00 0.00 41.96 40.86 1vwl s TYR 43 CO 0.01 0.12 -0.12 -1.21 0.64 0.00 0.00 175.55 174.99 1vwl s GLU 44 N -1.21 0.78 0.87 4.97 2.02 0.10 -1.07 118.70 125.17 1vwl s GLU 44 Ca 0.12 -0.77 -0.12 0.00 0.02 0.00 0.00 54.97 54.22 1vwl s GLU 44 Cb -0.10 -0.74 0.11 0.00 0.10 0.00 0.00 34.13 33.50 1vwl s GLU 44 CO 0.02 0.17 1.11 0.45 0.02 0.00 0.00 175.26 177.03 1vwl s SER 45 N -1.33 3.83 -0.31 -0.19 0.15 -1.05 -2.06 113.70 112.75 1vwl s SER 45 Ca -0.02 1.24 -0.28 0.00 0.70 0.00 0.00 55.95 57.60 1vwl s SER 45 Cb -0.08 -1.92 -0.04 0.00 -1.71 0.00 0.00 66.02 62.27 1vwl s SER 45 CO 0.01 -2.38 2.07 0.00 1.20 0.00 0.00 173.24 174.14 1vwl s ALA 46 N -3.12 2.63 0.00 5.45 0.00 -1.26 -4.47 121.76 121.00 1vwl s ALA 46 Ca 0.63 0.44 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1vwl s ALA 46 Cb -0.16 -4.09 0.00 0.00 0.00 0.00 0.00 23.12 18.87 1vwl s ALA 46 CO 0.55 -2.97 0.00 0.28 0.00 0.00 0.00 175.76 173.62 1vwl n VAL 47 N 7.64 0.00 -1.07 0.00 0.31 -1.24 -4.95 118.33 119.01 1vwl n VAL 47 Ca 0.28 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1vwl n VAL 47 Cb 0.47 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.40 1vwl n VAL 47 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1vwl n GLY 48 N 0.00 1.00 7.00 2.92 0.00 -1.26 -5.00 105.19 109.84 1vwl n GLY 48 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1vwl n GLY 48 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vwl n ASN 49 N 0.65 -4.71 0.02 1.61 3.02 -1.26 -4.52 115.26 110.07 1vwl n ASN 49 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.34 1vwl n ASN 49 Cb 0.22 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.25 1vwl n ASN 49 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vwl h ALA 50 N -0.96 0.16 0.00 5.41 0.00 -2.01 -3.39 119.26 118.47 1vwl h ALA 50 Ca 0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 54.91 53.81 1vwl h ALA 50 Cb 0.00 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1vwl h ALA 50 CO 0.00 0.81 -0.04 -0.85 0.00 0.00 0.00 179.25 179.18 1vwl n GLU 51 N -3.91 0.91 -0.67 0.00 0.00 -1.26 -3.48 120.64 112.22 1vwl n GLU 51 Ca -0.24 -0.18 0.06 0.00 0.00 0.00 0.00 57.16 56.80 1vwl n GLU 51 Cb 0.91 -1.31 0.17 0.00 0.00 0.00 0.00 31.44 31.21 1vwl n GLU 51 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1vwl n SER 52 N 1.88 1.64 -4.78 -1.84 7.64 -1.26 -4.87 113.62 112.02 1vwl n SER 52 Ca 0.08 -3.54 -0.36 0.00 1.01 0.00 0.00 58.87 56.06 1vwl n SER 52 Cb 0.44 -0.48 -0.07 0.00 -1.01 0.00 0.00 64.21 63.08 1vwl n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1vwl s ARG 53 N -2.71 3.89 0.06 1.43 0.52 -1.23 -2.53 118.95 118.39 1vwl s ARG 53 Ca 0.36 -0.19 0.06 0.00 -0.52 0.00 0.00 55.73 55.44 1vwl s ARG 53 Cb 0.36 -3.32 -0.03 0.00 0.52 0.00 0.00 34.95 32.48 1vwl s ARG 53 CO -0.07 0.48 -0.18 0.71 0.02 0.00 0.00 175.30 176.26 1vwl s TYR 54 N -0.17 1.52 0.36 -0.53 1.51 -0.23 -4.86 117.35 114.96 1vwl s TYR 54 Ca 0.10 -0.39 -0.25 0.00 -1.01 0.00 0.00 57.07 55.52 1vwl s TYR 54 Cb -0.11 -0.88 -0.09 0.00 -0.11 0.00 0.00 41.96 40.76 1vwl s TYR 54 CO 0.00 0.10 1.01 0.08 -1.11 0.00 0.00 175.55 175.64 1vwl s VAL 55 N -0.99 3.89 0.06 0.71 1.01 -1.26 -1.12 120.40 122.71 1vwl s VAL 55 Ca 0.04 1.51 0.03 0.00 0.00 0.00 0.00 61.98 63.56 1vwl s VAL 55 Cb -0.09 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 1vwl s VAL 55 CO 0.02 0.07 -0.10 -1.48 0.00 0.00 0.00 175.10 173.62 1vwl s LEU 56 N -2.36 2.31 -0.05 3.92 0.05 -0.74 -4.40 118.68 117.40 1vwl s LEU 56 Ca 0.54 -0.65 -0.08 0.00 0.05 0.00 0.00 54.13 53.99 1vwl s LEU 56 Cb -0.21 -0.27 0.01 0.00 -2.05 0.00 0.00 46.19 43.67 1vwl s LEU 56 CO 0.27 -0.20 0.20 0.28 -0.55 0.00 0.00 176.35 176.34 1vwl s THR 57 N -1.73 0.03 0.00 5.48 -1.32 -1.11 -2.62 115.64 114.38 1vwl s THR 57 Ca -0.03 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 1vwl s THR 57 Cb -0.07 -0.37 0.00 0.00 -1.51 0.00 0.00 72.50 70.55 1vwl s THR 57 CO 0.00 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.89 1vwl n GLY 58 N 2.35 2.09 3.21 6.08 0.00 -0.46 -1.70 105.19 116.77 1vwl n GLY 58 Ca -0.16 -0.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.82 1vwl n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vwl s ARG 59 N -1.16 0.70 0.16 1.61 1.81 -0.50 -1.83 118.95 119.74 1vwl s ARG 59 Ca 0.00 -0.45 -0.03 0.00 -1.72 0.00 0.00 55.73 53.53 1vwl s ARG 59 Cb 0.00 0.30 -0.03 0.00 -0.45 0.00 0.00 34.95 34.77 1vwl s ARG 59 CO 0.00 -0.21 0.14 1.52 -0.68 0.00 0.00 175.30 176.07 1vwl s TYR 60 N -2.10 0.84 -0.44 -0.53 1.13 -0.35 -1.43 117.35 114.47 1vwl s TYR 60 Ca -0.08 -1.17 -0.27 0.00 -1.41 0.00 0.00 57.07 54.14 1vwl s TYR 60 Cb -0.03 -0.40 0.03 0.00 -1.10 0.00 0.00 41.96 40.46 1vwl s TYR 60 CO -0.01 -0.61 1.02 0.34 -2.51 0.00 0.00 175.55 173.78 1vwl s ASP 61 N -3.06 6.61 0.00 -0.18 3.68 -0.58 -4.65 116.67 118.49 1vwl s ASP 61 Ca 0.27 0.40 0.31 0.00 2.13 0.00 0.00 52.55 55.66 1vwl s ASP 61 Cb 0.06 -2.50 1.73 0.00 -1.45 0.00 0.00 42.92 40.76 1vwl s ASP 61 CO 0.05 -1.08 2.13 -1.54 0.13 0.00 0.00 175.17 174.85 1vwl n SER 62 N 7.33 0.27 -3.20 -0.34 3.41 -1.26 -3.93 113.62 115.91 1vwl n SER 62 Ca 0.09 -1.04 -0.23 0.00 -0.26 0.00 0.00 58.87 57.43 1vwl n SER 62 Cb 0.48 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.37 1vwl n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vwl n ALA 63 N -0.81 2.64 -0.39 7.33 0.00 -1.26 -4.92 120.51 123.10 1vwl n ALA 63 Ca 0.22 -3.65 -0.18 0.00 0.00 0.00 0.00 53.44 49.84 1vwl n ALA 63 Cb 0.16 -0.85 0.28 0.00 0.00 0.00 0.00 19.45 19.04 1vwl n ALA 63 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1vwl n PRO 64 N 0.88 -4.55 -2.37 0.00 -0.04 -1.25 -5.00 135.00 122.68 1vwl n PRO 64 Ca 0.24 -1.47 -0.32 0.00 -0.04 0.00 0.00 63.50 61.92 1vwl n PRO 64 Cb 0.55 -1.80 -0.02 0.00 -0.04 0.00 0.00 33.50 32.18 1vwl n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vwl s ALA 65 N -2.26 3.12 -1.14 0.55 0.00 -1.26 -4.96 121.76 115.81 1vwl s ALA 65 Ca 0.66 0.06 -0.05 0.00 0.00 0.00 0.00 51.96 52.63 1vwl s ALA 65 Cb -0.11 -3.04 0.14 0.00 0.00 0.00 0.00 23.12 20.11 1vwl s ALA 65 CO 0.54 -0.29 2.37 0.25 0.00 0.00 0.00 175.76 178.63 1vwl n THR 66 N -1.78 5.03 -3.89 0.00 -2.24 -1.26 -4.72 114.28 105.42 1vwl n THR 66 Ca 0.06 -4.33 -0.09 0.00 -2.27 0.00 0.00 64.05 57.41 1vwl n THR 66 Cb 0.54 -1.92 -0.02 0.00 -2.10 0.00 0.00 70.33 66.83 1vwl n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1vwl n ASP 67 N 1.32 -0.84 -2.80 3.42 5.68 -1.26 -5.01 116.55 117.06 1vwl n ASP 67 Ca 0.58 -2.20 -0.29 0.00 -0.50 0.00 0.00 54.79 52.38 1vwl n ASP 67 Cb 0.29 1.58 -0.07 0.00 -1.14 0.00 0.00 41.12 41.78 1vwl n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vwl n GLY 68 N -0.37 4.05 3.81 6.12 0.00 -1.26 -4.86 105.19 112.69 1vwl n GLY 68 Ca 0.01 -1.57 -0.28 0.00 0.00 0.00 0.00 46.02 44.17 1vwl n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vwl s SER 69 N 1.49 5.68 0.79 1.61 0.01 -1.26 -5.10 113.70 116.92 1vwl s SER 69 Ca 0.64 -0.02 -0.11 0.00 1.31 0.00 0.00 55.95 57.78 1vwl s SER 69 Cb 0.26 -1.55 0.08 0.00 0.21 0.00 0.00 66.02 65.01 1vwl s SER 69 CO -0.07 0.12 1.15 -0.83 0.41 0.00 0.00 173.24 174.02 1vwl s GLY 70 N -2.78 1.60 -0.26 3.44 0.00 -1.26 -4.86 107.32 103.19 1vwl s GLY 70 Ca 0.31 -0.68 -0.09 0.00 0.00 0.00 0.00 44.72 44.26 1vwl s GLY 70 CO 0.24 -0.20 0.14 -1.59 0.00 0.00 0.00 173.10 171.68 1vwl s THR 71 N -3.53 4.88 0.39 0.90 2.01 -0.05 -4.77 115.64 115.47 1vwl s THR 71 Ca 0.62 0.02 -0.24 0.00 0.31 0.00 0.00 61.69 62.40 1vwl s THR 71 Cb -0.11 -3.30 -0.09 0.00 0.01 0.00 0.00 72.50 69.00 1vwl s THR 71 CO 0.48 0.30 1.03 0.00 -0.69 0.00 0.00 174.62 175.74 1vwl s ALA 72 N 1.64 3.11 0.26 7.40 0.00 -1.26 -0.90 121.76 132.01 1vwl s ALA 72 Ca 0.07 0.65 -0.21 0.00 0.00 0.00 0.00 51.96 52.47 1vwl s ALA 72 Cb -0.15 -3.25 0.04 0.00 0.00 0.00 0.00 23.12 19.76 1vwl s ALA 72 CO 0.07 -0.12 0.82 -0.48 0.00 0.00 0.00 175.76 176.05 1vwl s LEU 73 N -2.56 -0.17 -0.06 0.00 2.34 -0.83 -1.52 118.68 115.87 1vwl s LEU 73 Ca 0.57 -0.66 -0.30 0.00 0.06 0.00 0.00 54.13 53.79 1vwl s LEU 73 Cb -0.21 2.56 0.11 0.00 -0.56 0.00 0.00 46.19 48.10 1vwl s LEU 73 CO 0.26 -1.27 0.96 -0.83 -1.06 0.00 0.00 176.35 174.41 1vwl s GLY 74 N -2.99 -0.41 0.22 -3.48 0.00 -0.51 -1.88 107.32 98.27 1vwl s GLY 74 Ca 0.13 1.24 -0.19 0.00 0.00 0.00 0.00 44.72 45.90 1vwl s GLY 74 CO 0.07 0.45 0.58 0.66 0.00 0.00 0.00 173.10 174.85 1vwl s TRP 75 N -2.77 -0.14 0.05 1.90 -2.14 -0.76 -1.41 118.94 113.67 1vwl s TRP 75 Ca 0.05 -0.23 0.04 0.00 2.66 0.00 0.00 56.10 58.63 1vwl s TRP 75 Cb -0.01 0.48 -0.02 0.00 -3.10 0.00 0.00 33.47 30.82 1vwl s TRP 75 CO -0.07 -1.01 -0.12 0.99 -2.66 0.00 0.00 176.95 174.08 1vwl s THR 76 N -3.89 0.94 -0.04 0.66 2.01 -0.69 -0.79 115.64 113.84 1vwl s THR 76 Ca 0.10 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 61.06 1vwl s THR 76 Cb -0.02 -0.89 0.03 0.00 0.01 0.00 0.00 72.50 71.62 1vwl s THR 76 CO 0.00 -0.14 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.09 1vwl s VAL 77 N -1.03 0.30 -0.22 3.82 1.01 -0.49 -2.74 120.40 121.06 1vwl s VAL 77 Ca -0.02 0.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.92 1vwl s VAL 77 Cb -0.08 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 1vwl s VAL 77 CO 0.01 0.18 0.04 0.00 0.00 0.00 0.00 175.10 175.33 1vwl s ALA 78 N 1.06 3.14 -1.40 5.51 0.00 -1.26 -0.54 121.76 128.27 1vwl s ALA 78 Ca -0.09 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.76 1vwl s ALA 78 Cb -0.14 -1.94 -0.09 0.00 0.00 0.00 0.00 23.12 20.96 1vwl s ALA 78 CO -0.01 -0.27 2.79 0.91 0.00 0.00 0.00 175.76 179.17 1vwl n TRP 79 N 4.48 2.08 -3.98 0.00 7.02 -0.42 -4.76 117.44 121.85 1vwl n TRP 79 Ca -0.17 -2.77 -0.16 0.00 -1.02 0.00 0.00 57.50 53.39 1vwl n TRP 79 Cb 0.52 -2.27 -0.15 0.00 -2.42 0.00 0.00 31.31 26.99 1vwl n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1vwl s LYS 80 N 2.41 0.31 0.00 -0.99 2.20 -1.26 -0.56 119.74 121.85 1vwl s LYS 80 Ca 0.63 -0.00 0.00 0.00 -0.36 0.00 0.00 55.97 56.23 1vwl s LYS 80 Cb 0.17 -0.41 0.00 0.00 -1.51 0.00 0.00 37.83 36.07 1vwl s LYS 80 CO -0.05 -0.06 0.00 0.27 -0.36 0.00 0.00 175.35 175.15 1vwl n ASN 81 N 3.71 0.00 0.00 1.43 0.23 -0.09 -4.77 115.26 115.77 1vwl n ASN 81 Ca -0.22 -0.58 0.10 0.00 -0.53 0.00 0.00 54.58 53.35 1vwl n ASN 81 Cb 0.53 0.00 0.44 0.00 -2.08 0.00 0.00 39.78 38.67 1vwl n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1vwl n ASN 82 N -1.23 0.00 -0.07 0.53 5.03 -1.26 -3.83 115.26 114.44 1vwl n ASN 82 Ca 0.00 0.44 -0.09 0.00 0.87 0.00 0.00 54.58 55.80 1vwl n ASN 82 Cb 0.00 -0.47 -0.07 0.00 -1.02 0.00 0.00 39.78 38.21 1vwl n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1vwl n TYR 83 N -1.47 0.00 -4.11 3.10 4.01 -1.26 -5.06 117.16 112.36 1vwl n TYR 83 Ca 0.05 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.71 1vwl n TYR 83 Cb 0.23 -0.55 -0.10 0.00 -0.31 0.00 0.00 39.34 38.61 1vwl n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1vwl s ARG 84 N -2.28 0.68 -0.21 -0.72 1.81 -1.25 -5.12 118.95 111.86 1vwl s ARG 84 Ca -0.16 -1.26 -0.04 0.00 -1.72 0.00 0.00 55.73 52.55 1vwl s ARG 84 Cb 0.05 0.10 0.09 0.00 -0.45 0.00 0.00 34.95 34.73 1vwl s ARG 84 CO 0.36 -0.09 0.18 1.21 -0.68 0.00 0.00 175.30 176.28 1vwl s ASN 85 N -2.96 1.81 0.00 0.23 3.84 -1.26 -0.92 114.94 115.69 1vwl s ASN 85 Ca 0.09 -0.44 0.22 0.00 0.21 0.00 0.00 52.86 52.94 1vwl s ASN 85 Cb 0.07 0.17 0.54 0.00 -0.55 0.00 0.00 41.25 41.48 1vwl s ASN 85 CO -0.08 -0.34 1.45 0.00 -2.79 0.00 0.00 177.10 175.33 1vwl n ALA 86 N 5.30 2.45 -3.79 1.71 0.00 0.27 -4.97 120.51 121.49 1vwl n ALA 86 Ca -0.06 -0.82 -0.33 0.00 0.00 0.00 0.00 53.44 52.23 1vwl n ALA 86 Cb 0.49 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 19.01 1vwl n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1vwl n HIS 87 N 1.04 -1.78 -3.55 0.00 8.25 -1.26 -4.85 115.22 113.07 1vwl n HIS 87 Ca 0.18 0.44 -0.09 0.00 -0.26 0.00 0.00 57.72 57.98 1vwl n HIS 87 Cb 0.49 -3.38 -0.02 0.00 1.12 0.00 0.00 29.99 28.20 1vwl n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1vwl s SER 88 N -3.63 -0.43 -0.02 0.41 1.04 -1.26 -0.84 113.70 108.96 1vwl s SER 88 Ca 0.40 -0.15 -0.10 0.00 0.48 0.00 0.00 55.95 56.58 1vwl s SER 88 Cb -0.16 0.56 0.01 0.00 0.10 0.00 0.00 66.02 66.54 1vwl s SER 88 CO 0.88 -0.95 0.22 0.00 0.98 0.00 0.00 173.24 174.37 1vwl s ALA 89 N -3.59 -0.54 0.02 5.32 0.00 -0.18 -1.30 121.76 121.49 1vwl s ALA 89 Ca 0.05 0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.27 1vwl s ALA 89 Cb -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.07 1vwl s ALA 89 CO -0.07 -0.21 -0.18 0.99 0.00 0.00 0.00 175.76 176.29 1vwl s THR 90 N -1.05 1.46 -0.02 0.00 2.01 0.30 -0.75 115.64 117.59 1vwl s THR 90 Ca -0.11 -1.01 0.05 0.00 0.31 0.00 0.00 61.69 60.93 1vwl s THR 90 Cb -0.06 -1.26 -0.01 0.00 0.01 0.00 0.00 72.50 71.18 1vwl s THR 90 CO 0.02 0.23 -0.17 0.42 -0.69 0.00 0.00 174.62 174.43 1vwl s THR 91 N -0.68 1.34 -0.10 -0.82 -4.23 -0.57 -1.40 115.64 109.19 1vwl s THR 91 Ca 0.06 -0.71 0.02 0.00 -1.18 0.00 0.00 61.69 59.88 1vwl s THR 91 Cb -0.08 -1.12 -0.01 0.00 1.34 0.00 0.00 72.50 72.63 1vwl s THR 91 CO 0.01 0.38 -0.17 0.26 -0.54 0.00 0.00 174.62 174.56 1vwl s TRP 92 N -0.32 2.69 -0.10 3.99 0.51 0.03 -1.70 118.94 124.04 1vwl s TRP 92 Ca 0.05 -0.64 0.02 0.00 -2.12 0.00 0.00 56.10 53.41 1vwl s TRP 92 Cb -0.07 -1.74 0.01 0.00 -0.81 0.00 0.00 33.47 30.86 1vwl s TRP 92 CO -0.00 -0.18 -0.17 0.45 -0.51 0.00 0.00 176.95 176.54 1vwl s SER 93 N 0.07 2.46 0.00 2.95 0.15 -0.44 -1.82 113.70 117.07 1vwl s SER 93 Ca -0.07 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1vwl s SER 93 Cb -0.15 -1.12 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 1vwl s SER 93 CO 0.05 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.16 1vwl n GLY 94 N 3.91 2.01 3.05 9.45 0.00 -0.79 -1.65 105.19 121.17 1vwl n GLY 94 Ca -0.20 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 1vwl n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vwl s GLN 95 N 1.09 0.62 -0.18 1.61 -0.21 -0.49 -1.97 119.66 120.13 1vwl s GLN 95 Ca 0.00 -0.58 -0.08 0.00 0.02 0.00 0.00 55.36 54.71 1vwl s GLN 95 Cb 0.00 -0.52 -0.04 0.00 1.00 0.00 0.00 33.01 33.44 1vwl s GLN 95 CO 0.00 0.12 0.11 -0.47 -2.12 0.00 0.00 175.29 172.93 1vwl s TYR 96 N -0.84 3.39 -0.21 0.91 5.04 -0.08 -0.80 117.35 124.76 1vwl s TYR 96 Ca -0.03 0.29 0.01 0.00 -2.44 0.00 0.00 57.07 54.89 1vwl s TYR 96 Cb -0.07 -2.08 0.05 0.00 0.35 0.00 0.00 41.96 40.21 1vwl s TYR 96 CO 0.00 0.34 -0.08 0.08 -1.34 0.00 0.00 175.55 174.55 1vwl s VAL 97 N 0.06 1.59 0.77 3.14 1.01 0.20 -0.87 120.40 126.31 1vwl s VAL 97 Ca 0.08 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 1vwl s VAL 97 Cb -0.12 -1.74 0.14 0.00 0.00 0.00 0.00 36.38 34.67 1vwl s VAL 97 CO -0.00 0.08 1.06 -0.83 0.00 0.00 0.00 175.10 175.41 1vwl s GLY 98 N 1.40 1.76 0.00 4.51 0.00 -1.26 -0.94 107.32 112.79 1vwl s GLY 98 Ca -0.03 -1.59 0.00 0.00 0.00 0.00 0.00 44.72 43.10 1vwl s GLY 98 CO -0.07 -0.99 0.00 0.61 0.00 0.00 0.00 173.10 172.65 1vwl n GLY 99 N -3.03 0.74 0.18 0.20 0.00 -1.26 -4.76 105.19 97.26 1vwl n GLY 99 Ca 0.15 -1.79 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 1vwl n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vwl h ALA 100 N 0.00 0.95 -3.18 4.61 0.00 -2.06 -3.31 119.26 116.27 1vwl h ALA 100 Ca 0.00 -0.49 -0.68 0.00 0.00 0.00 0.00 54.91 53.74 1vwl h ALA 100 Cb 0.00 -0.09 -0.37 0.00 0.00 0.00 0.00 17.79 17.33 1vwl h ALA 100 CO 0.00 0.67 -0.41 -1.21 0.00 0.00 0.00 179.25 178.30 1vwl s GLU 101 N -3.93 2.52 0.31 0.00 2.02 -1.26 -5.07 118.70 113.29 1vwl s GLU 101 Ca -0.04 -2.72 -0.27 0.00 0.02 0.00 0.00 54.97 51.96 1vwl s GLU 101 Cb 0.12 -3.64 -0.10 0.00 0.10 0.00 0.00 34.13 30.62 1vwl s GLU 101 CO 0.79 -1.18 0.94 0.00 0.02 0.00 0.00 175.26 175.83 1vwl s ALA 102 N -0.41 3.24 0.04 5.21 0.00 -1.25 -4.86 121.76 123.73 1vwl s ALA 102 Ca 0.19 0.53 -0.02 0.00 0.00 0.00 0.00 51.96 52.66 1vwl s ALA 102 Cb -0.19 -3.18 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1vwl s ALA 102 CO -0.05 0.18 0.00 1.03 0.00 0.00 0.00 175.76 176.93 1vwl s ARG 103 N -1.90 0.51 -0.17 0.00 1.81 -0.11 -3.33 118.95 115.74 1vwl s ARG 103 Ca 0.48 -0.90 0.01 0.00 -1.72 0.00 0.00 55.73 53.60 1vwl s ARG 103 Cb -0.20 0.18 0.03 0.00 -0.45 0.00 0.00 34.95 34.51 1vwl s ARG 103 CO 0.25 -0.10 -0.15 0.42 -0.68 0.00 0.00 175.30 175.04 1vwl s ILE 104 N -2.79 1.78 -0.24 1.52 1.01 -0.90 -0.63 121.20 120.96 1vwl s ILE 104 Ca -0.04 -0.85 -0.08 0.00 0.00 0.00 0.00 60.65 59.68 1vwl s ILE 104 Cb -0.00 -1.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 1vwl s ILE 104 CO -0.06 0.41 0.10 0.20 0.00 0.00 0.00 174.94 175.60 1vwl s ASN 105 N 1.39 5.55 0.27 3.58 0.01 0.02 -1.13 114.94 124.63 1vwl s ASN 105 Ca 0.03 -0.06 0.02 0.00 -0.71 0.00 0.00 52.86 52.14 1vwl s ASN 105 Cb -0.14 -1.99 -0.05 0.00 0.41 0.00 0.00 41.25 39.47 1vwl s ASN 105 CO -0.11 0.03 0.08 0.42 -1.51 0.00 0.00 177.10 176.01 1vwl s THR 106 N 1.27 0.75 0.01 1.60 -4.23 -0.17 -1.40 115.64 113.47 1vwl s THR 106 Ca 0.06 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.61 1vwl s THR 106 Cb -0.14 -2.65 -0.02 0.00 1.34 0.00 0.00 72.50 71.03 1vwl s THR 106 CO 0.05 -0.03 -0.14 -1.10 -0.54 0.00 0.00 174.62 172.86 1vwl s GLN 107 N -3.99 1.04 0.08 3.99 -1.52 -0.66 -2.16 119.66 116.45 1vwl s GLN 107 Ca 0.37 -0.61 0.01 0.00 -1.95 0.00 0.00 55.36 53.17 1vwl s GLN 107 Cb 0.08 -1.03 -0.04 0.00 -0.22 0.00 0.00 33.01 31.80 1vwl s GLN 107 CO 0.14 0.27 -0.05 1.67 -0.25 0.00 0.00 175.29 177.06 1vwl s TRP 108 N -0.56 0.76 -0.09 0.91 1.48 -0.04 -1.32 118.94 120.09 1vwl s TRP 108 Ca 0.04 -0.95 0.02 0.00 -1.06 0.00 0.00 56.10 54.14 1vwl s TRP 108 Cb -0.06 -0.47 0.02 0.00 -1.16 0.00 0.00 33.47 31.79 1vwl s TRP 108 CO 0.00 -0.22 -0.13 -0.51 -4.06 0.00 0.00 176.95 172.03 1vwl s LEU 109 N -2.96 1.60 -0.22 -4.66 1.43 -0.69 -2.16 118.68 111.02 1vwl s LEU 109 Ca 0.10 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1vwl s LEU 109 Cb 0.06 -0.94 0.02 0.00 0.03 0.00 0.00 46.19 45.36 1vwl s LEU 109 CO -0.06 0.00 -0.11 -0.22 0.23 0.00 0.00 176.35 176.19 1vwl s LEU 110 N 0.97 2.84 -0.13 1.79 0.20 -0.10 -1.51 118.68 122.75 1vwl s LEU 110 Ca -0.08 -0.81 -0.00 0.00 0.69 0.00 0.00 54.13 53.93 1vwl s LEU 110 Cb -0.15 -1.60 -0.02 0.00 -0.43 0.00 0.00 46.19 44.00 1vwl s LEU 110 CO -0.00 -0.08 -0.12 -0.89 -0.29 0.00 0.00 176.35 174.97 1vwl s THR 111 N 1.30 3.17 0.11 3.68 2.01 0.07 -0.98 115.64 125.01 1vwl s THR 111 Ca 0.01 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 61.43 1vwl s THR 111 Cb -0.16 -2.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 1vwl s THR 111 CO -0.07 0.53 0.11 -0.44 -0.69 0.00 0.00 174.62 174.05 1vwl s SER 112 N 0.25 5.56 0.04 3.53 0.01 -0.60 -1.01 113.70 121.48 1vwl s SER 112 Ca -0.08 -0.04 -0.30 0.00 1.31 0.00 0.00 55.95 56.83 1vwl s SER 112 Cb -0.15 -1.49 -0.05 0.00 0.21 0.00 0.00 66.02 64.54 1vwl s SER 112 CO 0.05 0.13 1.13 -0.83 0.41 0.00 0.00 173.24 174.13 1vwl s GLY 113 N -2.66 2.56 0.41 3.44 0.00 -0.02 -4.88 107.32 106.17 1vwl s GLY 113 Ca 0.30 0.75 0.05 0.00 0.00 0.00 0.00 44.72 45.82 1vwl s GLY 113 CO 0.23 1.93 0.17 -0.51 0.00 0.00 0.00 173.10 174.92 1vwl s THR 114 N 1.05 0.43 0.50 0.90 -4.23 -1.26 -5.02 115.64 108.00 1vwl s THR 114 Ca 0.57 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1vwl s THR 114 Cb -0.27 -2.33 0.01 0.00 1.34 0.00 0.00 72.50 71.25 1vwl s THR 114 CO 0.29 0.00 0.73 0.42 -0.54 0.00 0.00 174.62 175.51 1vwl s THR 115 N -3.23 3.52 0.28 3.99 -4.23 -1.26 -4.90 115.64 109.81 1vwl s THR 115 Ca 0.26 -0.51 0.02 0.00 -1.18 0.00 0.00 61.69 60.27 1vwl s THR 115 Cb 0.02 -3.32 0.27 0.00 1.34 0.00 0.00 72.50 70.81 1vwl s THR 115 CO 0.17 -0.23 1.72 -0.08 -0.54 0.00 0.00 174.62 175.66 1vwl h GLU 116 N 0.23 0.47 0.00 3.99 4.81 -2.01 -1.40 114.58 120.68 1vwl h GLU 116 Ca -0.45 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.72 1vwl h GLU 116 Cb 1.27 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1vwl h GLU 116 CO 0.56 0.31 -0.14 0.00 -0.73 0.00 0.00 179.01 179.01 1vwl h ALA 117 N 1.65 1.09 -0.36 2.92 0.00 -2.06 -3.05 119.26 119.44 1vwl h ALA 117 Ca 0.52 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1vwl h ALA 117 Cb 0.89 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1vwl h ALA 117 CO -0.46 0.18 0.00 0.09 0.00 0.00 0.00 179.25 179.06 1vwl n ASN 118 N -3.39 2.96 0.05 0.00 3.02 -0.59 -4.51 115.26 112.80 1vwl n ASN 118 Ca -0.01 -1.96 0.15 0.00 -0.03 0.00 0.00 54.58 52.74 1vwl n ASN 118 Cb 0.33 -0.24 0.64 0.00 -0.61 0.00 0.00 39.78 39.90 1vwl n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vwl h ALA 119 N 2.31 2.27 -0.05 5.41 0.00 -1.29 -1.39 119.26 126.52 1vwl h ALA 119 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1vwl h ALA 119 Cb 0.74 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1vwl h ALA 119 CO 0.00 -0.38 0.04 0.11 0.00 0.00 0.00 179.25 179.01 1vwl h TRP 120 N 0.09 0.00 -0.83 0.00 5.08 -1.81 -2.63 115.95 115.84 1vwl h TRP 120 Ca 0.19 0.00 -0.57 0.00 1.08 0.00 0.00 58.89 59.59 1vwl h TRP 120 Cb 0.66 0.00 -0.41 0.00 -3.00 0.00 0.00 29.16 26.41 1vwl h TRP 120 CO -0.00 0.00 -0.57 0.36 -1.28 0.00 0.00 178.44 176.95 1vwl n LYS 121 N -4.33 3.48 0.10 0.12 2.85 -0.53 -4.72 118.16 115.13 1vwl n LYS 121 Ca -0.02 -4.06 0.12 0.00 -1.05 0.00 0.00 58.31 53.30 1vwl n LYS 121 Cb 0.13 -2.28 0.13 0.00 -0.65 0.00 0.00 35.03 32.37 1vwl n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1vwl h SER 122 N 2.18 0.00 -3.27 -5.58 4.64 -1.46 -3.47 113.55 106.60 1vwl h SER 122 Ca 0.40 -0.10 -0.67 0.00 -0.47 0.00 0.00 61.79 60.95 1vwl h SER 122 Cb 1.40 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.15 1vwl h SER 122 CO 0.89 0.05 -0.87 -0.89 -0.87 0.00 0.00 176.83 175.13 1vwl s THR 123 N -3.23 2.02 0.02 2.95 2.01 -1.26 -1.56 115.64 116.59 1vwl s THR 123 Ca 0.05 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.07 1vwl s THR 123 Cb 0.11 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 1vwl s THR 123 CO 0.73 0.55 0.10 -0.76 -0.69 0.00 0.00 174.62 174.54 1vwl s LEU 124 N 0.62 3.95 0.05 4.42 1.43 -0.16 -4.93 118.68 124.06 1vwl s LEU 124 Ca -0.12 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.18 1vwl s LEU 124 Cb -0.17 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.63 1vwl s LEU 124 CO 0.03 0.24 -0.18 0.54 0.23 0.00 0.00 176.35 177.21 1vwl s VAL 125 N -1.27 1.43 0.13 -1.59 0.11 -1.26 -0.92 120.40 117.02 1vwl s VAL 125 Ca 0.26 -1.18 -0.06 0.00 -2.93 0.00 0.00 61.98 58.07 1vwl s VAL 125 Cb -0.12 -1.28 0.02 0.00 -1.53 0.00 0.00 36.38 33.48 1vwl s VAL 125 CO 0.17 0.07 0.32 0.61 -3.33 0.00 0.00 175.10 172.93 1vwl n GLY 126 N 1.72 1.48 3.05 6.54 0.00 -0.92 -4.99 105.19 112.08 1vwl n GLY 126 Ca -0.18 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 1vwl n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1vwl s HIS 127 N -6.02 -0.06 0.04 1.61 -3.43 -1.26 -0.86 115.29 105.31 1vwl s HIS 127 Ca 0.07 0.14 0.02 0.00 -0.80 0.00 0.00 55.06 54.49 1vwl s HIS 127 Cb -0.02 0.00 -0.02 0.00 -1.43 0.00 0.00 32.58 31.11 1vwl s HIS 127 CO 0.04 -0.16 -0.08 -0.51 -2.00 0.00 0.00 174.74 172.03 1vwl s ASP 128 N -0.53 0.88 -0.05 7.38 1.01 -0.92 -4.98 116.67 119.46 1vwl s ASP 128 Ca -0.06 -0.54 0.05 0.00 0.71 0.00 0.00 52.55 52.70 1vwl s ASP 128 Cb -0.04 0.03 -0.00 0.00 1.01 0.00 0.00 42.92 43.92 1vwl s ASP 128 CO 0.01 -0.19 -0.19 -0.89 0.21 0.00 0.00 175.17 174.11 1vwl s THR 129 N -1.34 1.58 -0.04 -1.27 2.01 -1.26 -1.00 115.64 114.32 1vwl s THR 129 Ca -0.09 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.13 1vwl s THR 129 Cb -0.10 -1.36 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 1vwl s THR 129 CO 0.00 0.45 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.93 1vwl s PHE 130 N 0.04 2.83 -0.05 4.92 0.40 -0.28 -3.33 117.98 122.50 1vwl s PHE 130 Ca -0.05 -0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.27 1vwl s PHE 130 Cb -0.12 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 41.74 1vwl s PHE 130 CO 0.03 0.29 -0.21 0.99 0.70 0.00 0.00 175.22 177.02 1vwl s THR 131 N -0.83 2.47 0.07 0.64 2.01 0.42 -2.12 115.64 118.31 1vwl s THR 131 Ca 0.13 -0.94 -0.26 0.00 0.31 0.00 0.00 61.69 60.94 1vwl s THR 131 Cb -0.11 -1.92 -0.06 0.00 0.01 0.00 0.00 72.50 70.42 1vwl s THR 131 CO 0.03 0.58 0.81 -0.75 -0.69 0.00 0.00 174.62 174.59 1vwl s LYS 132 N -0.47 4.55 -0.01 4.92 2.20 -1.21 -1.38 119.74 128.35 1vwl s LYS 132 Ca 0.06 1.16 0.00 0.00 -0.36 0.00 0.00 55.97 56.83 1vwl s LYS 132 Cb -0.12 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.84 1vwl s LYS 132 CO 0.01 0.31 0.00 1.33 -0.36 0.00 0.00 175.35 176.64 1vwl n VAL 133 N 2.65 0.04 -3.99 4.02 0.24 -0.17 -4.94 118.33 116.18 1vwl n VAL 133 Ca -0.02 -0.03 -0.09 0.00 -2.04 0.00 0.00 64.34 62.17 1vwl n VAL 133 Cb 0.50 -0.90 -0.10 0.00 -1.47 0.00 0.00 33.84 31.86 1vwl n VAL 133 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1vwl s LYS 134 N -2.02 0.47 0.00 7.34 1.02 -1.13 -4.97 119.74 120.45 1vwl s LYS 134 Ca -0.00 -0.80 0.28 0.00 0.02 0.00 0.00 55.97 55.46 1vwl s LYS 134 Cb 0.00 0.17 1.09 0.00 -0.52 0.00 0.00 37.83 38.57 1vwl s LYS 134 CO 0.02 -0.09 1.77 -0.35 -0.92 0.00 0.00 175.35 175.78