#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2km2 n GLY 3 N -0.87 -1.72 3.85 0.00 0.00 -1.22 -3.09 105.19 102.14 2km2 n GLY 3 Ca 0.45 -1.53 -0.37 0.00 0.00 0.00 0.00 46.02 44.57 2km2 n GLY 3 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2km2 s LEU 4 N -4.61 4.42 -0.14 0.99 1.02 -1.24 -4.85 118.68 114.26 2km2 s LEU 4 Ca 0.00 0.91 -0.03 0.00 0.02 0.00 0.00 54.13 55.02 2km2 s LEU 4 Cb 0.00 -2.77 -0.03 0.00 0.02 0.00 0.00 46.19 43.41 2km2 s LEU 4 CO 0.00 0.25 -0.03 -0.69 0.02 0.00 0.00 176.35 175.91 2km2 s VAL 5 N -1.22 3.98 0.33 -1.59 1.01 -1.26 -3.47 120.40 118.19 2km2 s VAL 5 Ca 0.28 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.96 2km2 s VAL 5 Cb -0.16 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2km2 s VAL 5 CO 0.15 0.51 0.09 0.00 0.00 0.00 0.00 175.10 175.86 2km2 s ALA 6 N 0.17 2.37 0.22 5.51 0.00 -0.68 -5.03 121.76 124.32 2km2 s ALA 6 Ca -0.01 -1.76 -0.16 0.00 0.00 0.00 0.00 51.96 50.03 2km2 s ALA 6 Cb -0.14 0.80 0.02 0.00 0.00 0.00 0.00 23.12 23.80 2km2 s ALA 6 CO 0.03 -0.36 0.54 -1.54 0.00 0.00 0.00 175.76 174.42 2km2 s SER 7 N -3.48 -0.20 -1.13 0.00 1.04 -1.26 -3.32 113.70 105.35 2km2 s SER 7 Ca 0.33 -0.65 -0.07 0.00 0.48 0.00 0.00 55.95 56.04 2km2 s SER 7 Cb 0.07 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.80 2km2 s SER 7 CO 0.15 -1.13 0.99 -3.20 0.98 0.00 0.00 173.24 171.03 2km2 n ASN 8 N -0.37 -5.65 -1.69 7.02 2.85 -0.95 -4.90 115.26 111.58 2km2 n ASN 8 Ca -0.06 -0.45 0.09 0.00 -0.11 0.00 0.00 54.58 54.05 2km2 n ASN 8 Cb 0.62 -4.26 0.37 0.00 1.24 0.00 0.00 39.78 37.75 2km2 n ASN 8 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2km2 n LEU 9 N -4.24 5.03 0.00 1.20 4.77 -1.12 -4.98 117.00 117.66 2km2 n LEU 9 Ca 0.01 -2.54 0.00 0.00 -0.03 0.00 0.00 56.01 53.44 2km2 n LEU 9 Cb 0.55 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2km2 n LEU 9 CO 0.54 0.76 0.00 -3.20 -1.33 0.00 0.00 177.39 174.16 2km2 n ASN 10 N 1.01 0.00 -4.79 -1.43 2.85 0.80 -4.59 115.26 109.12 2km2 n ASN 10 Ca 0.26 0.00 -0.36 0.00 -0.11 0.00 0.00 54.58 54.38 2km2 n ASN 10 Cb 0.98 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.92 2km2 n ASN 10 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2km2 s LEU 11 N 0.00 4.24 0.43 1.20 0.20 0.13 -4.71 118.68 120.17 2km2 s LEU 11 Ca 0.00 0.32 0.07 0.00 0.69 0.00 0.00 54.13 55.21 2km2 s LEU 11 Cb 0.00 -2.06 -0.03 0.00 -0.43 0.00 0.00 46.19 43.67 2km2 s LEU 11 CO 0.00 0.29 0.26 -0.54 -0.29 0.00 0.00 176.35 176.07 2km2 s LYS 12 N -0.29 2.32 0.45 1.98 1.02 -1.26 -1.17 119.74 122.79 2km2 s LYS 12 Ca 0.11 -1.79 -0.24 0.00 0.02 0.00 0.00 55.97 54.07 2km2 s LYS 12 Cb -0.12 -2.10 -0.07 0.00 -0.52 0.00 0.00 37.83 35.02 2km2 s LYS 12 CO 0.01 -0.20 1.26 -1.25 -0.92 0.00 0.00 175.35 174.25 2km2 s PRO 13 N -4.01 3.74 0.00 -1.68 0.04 -1.26 -3.10 135.00 128.73 2km2 s PRO 13 Ca 0.41 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.49 2km2 s PRO 13 Cb 0.01 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 32.01 2km2 s PRO 13 CO 0.23 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.04 2km2 n GLY 14 N 0.61 2.84 3.87 0.56 0.00 -1.22 -4.99 105.19 106.87 2km2 n GLY 14 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 2km2 n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2km2 s GLU 15 N -0.41 3.83 0.24 1.61 2.02 -1.18 -5.06 118.70 119.75 2km2 s GLU 15 Ca 0.00 0.33 0.07 0.00 0.02 0.00 0.00 54.97 55.39 2km2 s GLU 15 Cb 0.00 -2.61 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2km2 s GLU 15 CO 0.00 0.29 0.18 0.00 0.02 0.00 0.00 175.26 175.74 2km2 s LEU 17 N -3.74 0.89 -0.09 0.00 1.98 -0.55 -3.20 118.68 113.98 2km2 s LEU 17 Ca 0.32 -0.11 0.03 0.00 -2.89 0.00 0.00 54.13 51.48 2km2 s LEU 17 Cb -0.08 -0.47 -0.01 0.00 0.66 0.00 0.00 46.19 46.29 2km2 s LEU 17 CO 0.24 -0.14 -0.19 -0.60 -1.89 0.00 0.00 176.35 173.77 2km2 s ARG 18 N 1.58 2.98 -0.26 1.98 3.52 0.14 -0.47 118.95 128.43 2km2 s ARG 18 Ca -0.01 -0.79 0.02 0.00 -0.13 0.00 0.00 55.73 54.83 2km2 s ARG 18 Cb -0.13 -2.40 0.06 0.00 -1.56 0.00 0.00 34.95 30.93 2km2 s ARG 18 CO -0.04 0.30 -0.07 0.08 -0.81 0.00 0.00 175.30 174.76 2km2 s VAL 19 N 0.07 1.94 -0.20 7.11 1.01 -0.17 -1.58 120.40 128.58 2km2 s VAL 19 Ca -0.08 -1.55 -0.04 0.00 0.00 0.00 0.00 61.98 60.30 2km2 s VAL 19 Cb -0.15 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2km2 s VAL 19 CO 0.05 -0.11 -0.02 -0.60 0.00 0.00 0.00 175.10 174.42 2km2 s ARG 20 N 1.19 3.52 0.00 2.72 3.52 -0.89 -1.90 118.95 127.10 2km2 s ARG 20 Ca -0.06 -0.57 0.00 0.00 -0.13 0.00 0.00 55.73 54.97 2km2 s ARG 20 Cb -0.19 -3.03 0.00 0.00 -1.56 0.00 0.00 34.95 30.16 2km2 s ARG 20 CO -0.06 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 174.78 2km2 n GLY 21 N 4.42 4.27 3.10 8.12 0.00 -1.21 -2.66 105.19 121.23 2km2 n GLY 21 Ca -0.17 -1.22 -0.25 0.00 0.00 0.00 0.00 46.02 44.38 2km2 n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2km2 s GLU 22 N 0.61 1.65 -0.19 1.61 2.12 0.21 -3.56 118.70 121.15 2km2 s GLU 22 Ca 0.00 -0.54 -0.09 0.00 0.36 0.00 0.00 54.97 54.71 2km2 s GLU 22 Cb 0.00 -1.43 -0.05 0.00 0.26 0.00 0.00 34.13 32.92 2km2 s GLU 22 CO 0.00 0.19 0.10 0.08 -0.54 0.00 0.00 175.26 175.09 2km2 s VAL 23 N 0.14 5.09 0.98 3.70 1.01 -1.21 0.02 120.40 130.13 2km2 s VAL 23 Ca -0.05 0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.88 2km2 s VAL 23 Cb -0.12 -3.31 0.09 0.00 0.00 0.00 0.00 36.38 33.04 2km2 s VAL 23 CO 0.02 0.44 0.55 0.00 0.00 0.00 0.00 175.10 176.12 2km2 n ALA 24 N 3.60 -2.44 0.30 5.51 0.00 -1.03 -2.53 120.51 123.90 2km2 n ALA 24 Ca -0.16 -0.73 0.19 0.00 0.00 0.00 0.00 53.44 52.74 2km2 n ALA 24 Cb 0.52 -1.86 0.87 0.00 0.00 0.00 0.00 19.45 18.98 2km2 n ALA 24 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2km2 h PRO 25 N -1.78 0.00 -1.20 0.00 0.13 -1.90 0.49 132.00 127.73 2km2 h PRO 25 Ca -0.46 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.04 2km2 h PRO 25 Cb 1.29 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 32.06 2km2 h PRO 25 CO 0.37 0.01 -0.07 -0.25 -0.23 0.00 0.00 178.00 177.83 2km2 n ASP 26 N -3.11 6.00 -4.56 1.44 8.00 -1.26 -4.09 116.55 118.97 2km2 n ASP 26 Ca -0.01 -3.77 -0.30 0.00 0.71 0.00 0.00 54.79 51.43 2km2 n ASP 26 Cb 0.22 -0.65 -0.05 0.00 -0.02 0.00 0.00 41.12 40.63 2km2 n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2km2 s ALA 27 N -3.72 1.85 -0.07 2.24 0.00 -1.08 -4.65 121.76 116.33 2km2 s ALA 27 Ca 0.54 -1.52 0.22 0.00 0.00 0.00 0.00 51.96 51.20 2km2 s ALA 27 Cb 0.44 -4.52 -0.29 0.00 0.00 0.00 0.00 23.12 18.74 2km2 s ALA 27 CO -0.10 -4.56 0.52 1.63 0.00 0.00 0.00 175.76 173.24 2km2 n LYS 28 N 8.90 0.66 -3.75 0.00 5.02 -1.26 -4.79 118.16 122.93 2km2 n LYS 28 Ca 0.37 -0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 56.39 2km2 n LYS 28 Cb 0.48 -1.56 -0.10 0.00 -0.02 0.00 0.00 35.03 33.83 2km2 n LYS 28 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2km2 s SER 29 N -4.72 -0.32 -0.11 4.39 0.15 -1.26 -3.66 113.70 108.17 2km2 s SER 29 Ca -0.07 0.52 -0.08 0.00 0.70 0.00 0.00 55.95 57.01 2km2 s SER 29 Cb 0.13 0.60 0.04 0.00 -1.71 0.00 0.00 66.02 65.07 2km2 s SER 29 CO 0.89 -0.24 0.28 0.12 1.20 0.00 0.00 173.24 175.49 2km2 s PHE 30 N -0.34 -0.35 -0.06 3.44 5.36 -1.23 -0.34 117.98 124.45 2km2 s PHE 30 Ca -0.05 0.83 0.03 0.00 -0.96 0.00 0.00 56.93 56.78 2km2 s PHE 30 Cb -0.03 0.10 0.01 0.00 -0.34 0.00 0.00 43.02 42.76 2km2 s PHE 30 CO 0.02 -0.21 -0.14 0.08 -1.46 0.00 0.00 175.22 173.51 2km2 s VAL 31 N 0.73 1.27 0.00 3.12 1.01 0.42 -3.54 120.40 123.41 2km2 s VAL 31 Ca -0.05 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.37 2km2 s VAL 31 Cb -0.06 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 2km2 s VAL 31 CO -0.05 0.38 -0.02 -0.22 0.00 0.00 0.00 175.10 175.19 2km2 s LEU 32 N 0.52 2.05 -0.14 3.92 2.96 -0.65 0.10 118.68 127.43 2km2 s LEU 32 Ca -0.13 -0.12 -0.19 0.00 -0.22 0.00 0.00 54.13 53.47 2km2 s LEU 32 Cb -0.15 -0.08 0.05 0.00 0.50 0.00 0.00 46.19 46.51 2km2 s LEU 32 CO 0.04 -0.03 0.50 0.54 -1.32 0.00 0.00 176.35 176.08 2km2 s ASN 33 N -0.31 -0.49 -0.09 3.68 4.22 -0.11 -1.29 114.94 120.55 2km2 s ASN 33 Ca -0.02 0.83 -0.02 0.00 -2.14 0.00 0.00 52.86 51.51 2km2 s ASN 33 Cb -0.02 0.85 0.03 0.00 1.28 0.00 0.00 41.25 43.39 2km2 s ASN 33 CO -0.00 -0.28 0.02 -1.48 -2.04 0.00 0.00 177.10 173.31 2km2 s LEU 34 N -0.20 0.59 0.00 3.54 0.05 -1.17 -1.06 118.68 120.42 2km2 s LEU 34 Ca -0.04 -0.17 0.00 0.00 0.05 0.00 0.00 54.13 53.97 2km2 s LEU 34 Cb -0.03 -0.41 0.00 0.00 -2.05 0.00 0.00 46.19 43.69 2km2 s LEU 34 CO 0.03 -0.22 0.00 0.61 -0.55 0.00 0.00 176.35 176.22 2km2 n GLY 35 N 5.16 5.19 0.00 -3.48 0.00 0.47 -2.75 105.19 109.78 2km2 n GLY 35 Ca -0.07 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2km2 n GLY 35 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2km2 n LYS 36 N 0.00 0.71 0.00 1.61 2.85 -0.86 0.34 118.16 122.81 2km2 n LYS 36 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2km2 n LYS 36 Cb 0.00 -0.81 0.00 0.00 -0.65 0.00 0.00 35.03 33.57 2km2 n LYS 36 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2km2 n ASP 37 N -1.92 0.00 0.07 -5.58 8.00 -1.26 -3.85 116.55 112.01 2km2 n ASP 37 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2km2 n ASP 37 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 2km2 n ASP 37 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2km2 n SER 38 N -0.72 -0.97 -0.40 -2.24 2.88 -1.26 -4.87 113.62 106.05 2km2 n SER 38 Ca 0.00 0.28 0.12 0.00 -1.33 0.00 0.00 58.87 57.94 2km2 n SER 38 Cb 0.00 1.11 0.26 0.00 -0.75 0.00 0.00 64.21 64.83 2km2 n SER 38 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2km2 n ASN 39 N -2.86 1.52 -3.83 -3.46 3.02 -1.26 -4.55 115.26 103.84 2km2 n ASN 39 Ca 0.00 -1.22 -0.42 0.00 -0.03 0.00 0.00 54.58 52.90 2km2 n ASN 39 Cb 0.00 0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 2km2 n ASN 39 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2km2 n ASN 40 N -0.24 5.65 -4.60 6.41 3.02 -1.26 -2.59 115.26 121.65 2km2 n ASN 40 Ca 0.12 -3.17 -0.34 0.00 -0.03 0.00 0.00 54.58 51.16 2km2 n ASN 40 Cb 0.40 -1.43 -0.10 0.00 -0.61 0.00 0.00 39.78 38.04 2km2 n ASN 40 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2km2 s LEU 41 N -0.83 3.56 -0.01 3.41 1.43 -0.20 -2.03 118.68 124.00 2km2 s LEU 41 Ca 0.40 0.03 -0.03 0.00 -1.03 0.00 0.00 54.13 53.50 2km2 s LEU 41 Cb 0.10 -1.86 -0.28 0.00 0.03 0.00 0.00 46.19 44.19 2km2 s LEU 41 CO 0.01 0.24 0.80 0.00 0.23 0.00 0.00 176.35 177.62 2km2 s LEU 43 N -6.96 1.54 -0.11 0.00 1.43 -1.25 -4.36 118.68 108.97 2km2 s LEU 43 Ca -0.10 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 2km2 s LEU 43 Cb 0.07 -0.75 0.02 0.00 0.03 0.00 0.00 46.19 45.56 2km2 s LEU 43 CO 0.85 0.00 -0.13 -2.28 0.23 0.00 0.00 176.35 175.02 2km2 s HIS 44 N 0.79 1.86 -0.13 0.29 2.46 0.16 -3.07 115.29 117.65 2km2 s HIS 44 Ca -0.12 -0.90 -0.02 0.00 0.47 0.00 0.00 55.06 54.49 2km2 s HIS 44 Cb -0.15 -1.38 -0.02 0.00 -0.13 0.00 0.00 32.58 30.89 2km2 s HIS 44 CO 0.02 -0.50 -0.07 -0.06 -2.47 0.00 0.00 174.74 171.66 2km2 s PHE 45 N 1.17 2.95 -0.46 3.88 0.08 -0.41 -2.66 117.98 122.53 2km2 s PHE 45 Ca -0.03 -0.35 0.06 0.00 0.12 0.00 0.00 56.93 56.73 2km2 s PHE 45 Cb -0.14 -1.88 0.19 0.00 -0.57 0.00 0.00 43.02 40.62 2km2 s PHE 45 CO -0.04 -0.03 0.55 -1.71 -0.10 0.00 0.00 175.22 173.90 2km2 n ASN 46 N 3.31 -1.76 -4.77 1.36 4.05 -0.88 -1.64 115.26 114.95 2km2 n ASN 46 Ca -0.18 -2.69 -0.38 0.00 0.45 0.00 0.00 54.58 51.78 2km2 n ASN 46 Cb 0.53 0.52 -0.01 0.00 1.23 0.00 0.00 39.78 42.04 2km2 n ASN 46 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2km2 s PRO 47 N 0.29 3.95 -0.38 1.20 0.04 -1.23 -2.40 135.00 136.47 2km2 s PRO 47 Ca 0.32 1.85 0.02 0.00 0.04 0.00 0.00 61.00 63.23 2km2 s PRO 47 Cb 0.06 -2.60 0.15 0.00 0.04 0.00 0.00 34.50 32.15 2km2 s PRO 47 CO -0.14 -0.41 0.33 1.03 0.04 0.00 0.00 177.00 177.85 2km2 s ARG 48 N -2.42 0.66 0.13 4.56 0.52 0.29 -3.51 118.95 119.19 2km2 s ARG 48 Ca 0.59 -1.23 -0.18 0.00 -0.52 0.00 0.00 55.73 54.40 2km2 s ARG 48 Cb -0.31 -1.00 -0.03 0.00 0.52 0.00 0.00 34.95 34.13 2km2 s ARG 48 CO 0.38 -1.24 1.72 0.35 0.02 0.00 0.00 175.30 176.54 2km2 h PHE 49 N 6.74 0.45 -3.05 -0.53 3.04 -1.74 -2.58 116.94 119.26 2km2 h PHE 49 Ca 0.09 -0.01 -0.57 0.00 3.98 0.00 0.00 57.97 61.45 2km2 h PHE 49 Cb 1.01 -0.14 -0.40 0.00 2.56 0.00 0.00 35.95 38.97 2km2 h PHE 49 CO 0.35 0.37 -0.76 1.21 -2.02 0.00 0.00 178.31 177.45 2km2 s ASN 50 N -5.63 3.88 0.01 0.41 2.47 -1.26 -2.15 114.94 112.67 2km2 s ASN 50 Ca -0.13 -1.64 -0.00 0.00 0.42 0.00 0.00 52.86 51.51 2km2 s ASN 50 Cb 0.09 -0.75 -0.00 0.00 -1.45 0.00 0.00 41.25 39.14 2km2 s ASN 50 CO 0.72 -0.41 -0.00 0.00 -3.72 0.00 0.00 177.10 173.69 2km2 n ALA 51 N 4.83 2.82 0.32 1.71 0.00 -1.26 -4.90 120.51 124.03 2km2 n ALA 51 Ca -0.02 -0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.48 2km2 n ALA 51 Cb 0.41 0.02 -0.11 0.00 0.00 0.00 0.00 19.45 19.78 2km2 n ALA 51 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2km2 n HIS 52 N -2.60 0.00 0.00 0.00 8.25 -1.26 -4.93 115.22 114.69 2km2 n HIS 52 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2km2 n HIS 52 Cb 0.00 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 30.90 2km2 n HIS 52 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2km2 n GLY 53 N 1.49 0.01 3.77 -1.41 0.00 -1.26 -5.15 105.19 102.63 2km2 n GLY 53 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2km2 n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2km2 n ASP 54 N 0.00 -0.82 0.00 1.61 8.00 -1.26 -5.02 116.55 119.07 2km2 n ASP 54 Ca 0.00 -1.36 0.00 0.00 0.71 0.00 0.00 54.79 54.14 2km2 n ASP 54 Cb 0.00 -1.03 0.00 0.00 -0.02 0.00 0.00 41.12 40.07 2km2 n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2km2 n ALA 55 N -4.30 1.10 -2.73 2.24 0.00 -0.91 -4.21 120.51 111.69 2km2 n ALA 55 Ca -0.21 -0.07 -0.06 0.00 0.00 0.00 0.00 53.44 53.10 2km2 n ALA 55 Cb 0.59 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.09 2km2 n ALA 55 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2km2 n ASN 56 N -0.39 -2.71 -4.12 0.00 0.23 -1.05 -4.55 115.26 102.67 2km2 n ASN 56 Ca 0.00 -2.86 -0.28 0.00 -0.53 0.00 0.00 54.58 50.91 2km2 n ASN 56 Cb 0.03 1.59 -0.17 0.00 -2.08 0.00 0.00 39.78 39.15 2km2 n ASN 56 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2km2 s THR 57 N 0.67 1.57 -0.09 5.53 2.01 -0.97 -4.75 115.64 119.60 2km2 s THR 57 Ca 0.30 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.60 2km2 s THR 57 Cb 0.17 -1.38 0.00 0.00 0.01 0.00 0.00 72.50 71.30 2km2 s THR 57 CO -0.17 0.45 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.36 2km2 s ILE 58 N 0.47 1.87 -0.13 1.82 1.01 -1.15 0.10 121.20 125.20 2km2 s ILE 58 Ca -0.16 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.58 2km2 s ILE 58 Cb -0.16 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.67 2km2 s ILE 58 CO 0.06 0.52 -0.13 -0.69 0.00 0.00 0.00 174.94 174.69 2km2 s VAL 59 N 0.34 3.01 -0.10 2.92 1.01 -1.01 -1.80 120.40 124.77 2km2 s VAL 59 Ca -0.16 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2km2 s VAL 59 Cb -0.17 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 33.97 2km2 s VAL 59 CO 0.07 0.53 -0.09 0.00 0.00 0.00 0.00 175.10 175.61 2km2 s ASN 61 N 1.48 1.14 0.12 0.00 4.22 -1.09 -2.03 114.94 118.78 2km2 s ASN 61 Ca 0.01 -1.59 0.06 0.00 -2.14 0.00 0.00 52.86 49.20 2km2 s ASN 61 Cb -0.13 0.46 -0.04 0.00 1.28 0.00 0.00 41.25 42.82 2km2 s ASN 61 CO -0.06 -0.95 -0.13 -0.44 -2.04 0.00 0.00 177.10 173.48 2km2 s SER 62 N -3.30 1.93 0.04 3.54 0.01 -1.26 -0.66 113.70 113.99 2km2 s SER 62 Ca 0.39 -0.83 0.02 0.00 1.31 0.00 0.00 55.95 56.85 2km2 s SER 62 Cb 0.05 -0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.20 2km2 s SER 62 CO 0.20 -0.17 -0.08 -0.75 0.41 0.00 0.00 173.24 172.85 2km2 s LYS 63 N -2.76 0.55 -0.31 12.44 2.20 0.30 -3.41 119.74 128.75 2km2 s LYS 63 Ca 0.09 -0.74 0.00 0.00 -0.36 0.00 0.00 55.97 54.97 2km2 s LYS 63 Cb -0.04 -0.35 0.10 0.00 -1.51 0.00 0.00 37.83 36.02 2km2 s LYS 63 CO 0.03 0.07 0.08 0.34 -0.36 0.00 0.00 175.35 175.51 2km2 s ASP 64 N -1.49 4.17 -1.58 1.43 -1.08 -1.23 -1.03 116.67 115.86 2km2 s ASP 64 Ca -0.08 -1.73 0.00 0.00 -0.52 0.00 0.00 52.55 50.22 2km2 s ASP 64 Cb -0.09 -1.04 0.00 0.00 -1.46 0.00 0.00 42.92 40.33 2km2 s ASP 64 CO 0.01 -0.40 0.00 0.61 0.52 0.00 0.00 175.17 175.90 2km2 n GLY 65 N 4.71 1.33 2.14 2.66 0.00 -1.07 -1.96 105.19 113.01 2km2 n GLY 65 Ca -0.01 -0.29 -0.06 0.00 0.00 0.00 0.00 46.02 45.66 2km2 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2km2 n GLY 66 N -1.09 0.51 0.15 -0.02 0.00 -1.17 -4.92 105.19 98.65 2km2 n GLY 66 Ca -0.16 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.13 2km2 n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2km2 n ALA 67 N 0.02 0.69 -1.01 4.61 0.00 -0.83 -5.04 120.51 118.95 2km2 n ALA 67 Ca -0.06 -0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.11 2km2 n ALA 67 Cb 0.35 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.02 2km2 n ALA 67 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2km2 n TRP 68 N -2.01 -3.76 0.00 0.00 7.02 -1.26 -4.92 117.44 112.51 2km2 n TRP 68 Ca 0.00 -0.85 0.00 0.00 -1.02 0.00 0.00 57.50 55.63 2km2 n TRP 68 Cb 0.00 -0.99 0.00 0.00 -2.42 0.00 0.00 31.31 27.90 2km2 n TRP 68 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2km2 n GLY 69 N -3.86 0.00 3.55 6.99 0.00 -1.22 -4.40 105.19 106.25 2km2 n GLY 69 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 2km2 n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2km2 s THR 70 N 0.00 3.09 -0.18 2.61 2.01 -1.26 -4.79 115.64 117.12 2km2 s THR 70 Ca 0.00 0.05 -0.25 0.00 0.31 0.00 0.00 61.69 61.81 2km2 s THR 70 Cb 0.00 -3.23 -0.01 0.00 0.01 0.00 0.00 72.50 69.27 2km2 s THR 70 CO 0.00 -0.22 0.81 -1.61 -0.69 0.00 0.00 174.62 172.91 2km2 s GLU 71 N 7.92 4.27 0.00 4.92 2.02 -1.26 -4.20 118.70 132.37 2km2 s GLU 71 Ca 0.91 0.96 0.00 0.00 0.02 0.00 0.00 54.97 56.86 2km2 s GLU 71 Cb -0.16 -3.58 0.00 0.00 0.10 0.00 0.00 34.13 30.48 2km2 s GLU 71 CO 0.25 -0.34 0.00 1.04 0.02 0.00 0.00 175.26 176.23 2km2 n GLN 72 N 5.31 1.37 -3.68 1.61 6.02 -0.86 -4.95 117.38 122.21 2km2 n GLN 72 Ca 0.04 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.89 2km2 n GLN 72 Cb 0.49 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.61 2km2 n GLN 72 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2km2 s ARG 73 N -1.27 0.14 -0.13 -1.09 3.52 -1.26 -3.62 118.95 115.24 2km2 s ARG 73 Ca 0.00 0.67 -0.03 0.00 -0.13 0.00 0.00 55.73 56.24 2km2 s ARG 73 Cb 0.00 -0.09 -0.03 0.00 -1.56 0.00 0.00 34.95 33.27 2km2 s ARG 73 CO 0.00 -0.26 -0.03 -2.00 -0.81 0.00 0.00 175.30 172.20 2km2 s GLU 74 N 2.14 3.47 -0.82 5.12 2.12 -0.75 -5.02 118.70 124.96 2km2 s GLU 74 Ca -0.01 -0.50 0.02 0.00 0.36 0.00 0.00 54.97 54.84 2km2 s GLU 74 Cb -0.12 -2.87 0.33 0.00 0.26 0.00 0.00 34.13 31.73 2km2 s GLU 74 CO -0.08 0.37 1.40 0.00 -0.54 0.00 0.00 175.26 176.41 2km2 n ALA 75 N 3.16 5.39 -2.76 6.30 0.00 -1.26 -2.93 120.51 128.41 2km2 n ALA 75 Ca -0.18 -4.66 -0.13 0.00 0.00 0.00 0.00 53.44 48.47 2km2 n ALA 75 Cb 0.53 -1.49 -0.11 0.00 0.00 0.00 0.00 19.45 18.37 2km2 n ALA 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2km2 s VAL 76 N -4.36 0.64 -0.42 0.00 0.11 -1.26 -5.08 120.40 110.04 2km2 s VAL 76 Ca 0.44 -1.22 0.07 0.00 -2.93 0.00 0.00 61.98 58.34 2km2 s VAL 76 Cb 0.23 -0.80 0.23 0.00 -1.53 0.00 0.00 36.38 34.51 2km2 s VAL 76 CO -0.13 -0.42 0.57 2.22 -3.33 0.00 0.00 175.10 174.01 2km2 n PHE 77 N 1.25 -1.15 0.29 1.54 -1.74 -1.26 -4.90 117.46 111.49 2km2 n PHE 77 Ca -0.21 -3.10 0.10 0.00 -0.56 0.00 0.00 57.45 53.68 2km2 n PHE 77 Cb 0.55 0.17 0.46 0.00 1.52 0.00 0.00 39.48 42.18 2km2 n PHE 77 CO 0.00 0.00 0.00 -0.35 -0.56 0.00 0.00 176.76 175.85 2km2 n PRO 78 N 1.74 0.14 -4.44 3.97 -0.04 -1.26 -4.70 135.00 130.40 2km2 n PRO 78 Ca 0.20 0.49 -0.26 0.00 -0.04 0.00 0.00 63.50 63.89 2km2 n PRO 78 Cb 0.54 -1.83 -0.10 0.00 -0.04 0.00 0.00 33.50 32.07 2km2 n PRO 78 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2km2 s PHE 79 N -3.34 2.51 0.17 0.54 -0.12 -1.26 -4.82 117.98 111.67 2km2 s PHE 79 Ca 0.02 -0.55 -0.02 0.00 -0.05 0.00 0.00 56.93 56.33 2km2 s PHE 79 Cb 0.07 -1.62 -0.04 0.00 -0.63 0.00 0.00 43.02 40.80 2km2 s PHE 79 CO 0.27 0.45 0.12 -0.65 -0.05 0.00 0.00 175.22 175.37 2km2 s GLN 80 N -3.72 1.11 0.55 1.99 1.11 -1.26 -5.13 119.66 114.31 2km2 s GLN 80 Ca 0.35 -1.52 -0.20 0.00 0.01 0.00 0.00 55.36 54.00 2km2 s GLN 80 Cb 0.04 0.27 -0.05 0.00 -1.01 0.00 0.00 33.01 32.27 2km2 s GLN 80 CO 0.19 -0.35 1.22 -1.25 0.01 0.00 0.00 175.29 175.10 2km2 s PRO 81 N -4.10 3.18 -1.17 2.91 0.04 -1.26 -3.27 135.00 131.33 2km2 s PRO 81 Ca 0.32 1.87 -0.06 0.00 0.04 0.00 0.00 61.00 63.17 2km2 s PRO 81 Cb 0.07 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2km2 s PRO 81 CO 0.07 -1.05 1.01 0.41 0.04 0.00 0.00 177.00 177.49 2km2 n GLY 82 N 0.51 -0.35 3.17 0.56 0.00 0.17 -4.80 105.19 104.46 2km2 n GLY 82 Ca 0.12 0.12 -0.13 0.00 0.00 0.00 0.00 46.02 46.13 2km2 n GLY 82 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2km2 s SER 83 N -3.51 -0.32 0.26 1.61 0.15 -1.20 -4.89 113.70 105.79 2km2 s SER 83 Ca 0.40 0.62 -0.30 0.00 0.70 0.00 0.00 55.95 57.37 2km2 s SER 83 Cb -0.17 0.59 -0.09 0.00 -1.71 0.00 0.00 66.02 64.64 2km2 s SER 83 CO 0.65 -0.12 0.99 0.68 1.20 0.00 0.00 173.24 176.64 2km2 s VAL 84 N 0.44 3.87 0.03 4.45 -7.23 -1.26 -3.34 120.40 117.36 2km2 s VAL 84 Ca -0.02 1.87 -0.13 0.00 -1.81 0.00 0.00 61.98 61.89 2km2 s VAL 84 Cb -0.04 -4.19 0.02 0.00 0.56 0.00 0.00 36.38 32.73 2km2 s VAL 84 CO -0.02 0.44 0.28 0.00 -0.31 0.00 0.00 175.10 175.48 2km2 s ALA 85 N -1.19 -0.63 0.15 1.32 0.00 -1.23 -4.99 121.76 115.19 2km2 s ALA 85 Ca 0.43 0.01 0.10 0.00 0.00 0.00 0.00 51.96 52.50 2km2 s ALA 85 Cb -0.28 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 2km2 s ALA 85 CO 0.35 -0.36 -0.22 -1.83 0.00 0.00 0.00 175.76 173.69 2km2 s GLU 86 N -2.23 1.34 -0.01 0.00 -1.05 -1.26 -3.35 118.70 112.14 2km2 s GLU 86 Ca -0.07 -1.38 0.04 0.00 -0.15 0.00 0.00 54.97 53.41 2km2 s GLU 86 Cb -0.02 -1.62 -0.01 0.00 -0.44 0.00 0.00 34.13 32.04 2km2 s GLU 86 CO -0.01 0.36 -0.14 0.08 0.95 0.00 0.00 175.26 176.49 2km2 s VAL 87 N -1.53 1.13 -0.25 1.83 1.01 -0.80 -3.09 120.40 118.70 2km2 s VAL 87 Ca 0.15 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.50 2km2 s VAL 87 Cb -0.08 -0.95 0.02 0.00 0.00 0.00 0.00 36.38 35.37 2km2 s VAL 87 CO 0.07 0.32 -0.05 0.00 0.00 0.00 0.00 175.10 175.44 2km2 s ILE 89 N 1.36 1.93 -0.05 0.00 1.01 0.38 -0.44 121.20 125.39 2km2 s ILE 89 Ca 0.01 -0.93 0.05 0.00 0.00 0.00 0.00 60.65 59.78 2km2 s ILE 89 Cb -0.16 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 2km2 s ILE 89 CO -0.04 0.53 -0.21 -0.89 0.00 0.00 0.00 174.94 174.33 2km2 s THR 90 N 0.57 1.74 -0.28 2.92 2.01 0.02 -1.48 115.64 121.14 2km2 s THR 90 Ca -0.14 -0.88 -0.09 0.00 0.31 0.00 0.00 61.69 60.89 2km2 s THR 90 Cb -0.17 -1.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.84 2km2 s THR 90 CO 0.04 0.49 0.12 0.12 -0.69 0.00 0.00 174.62 174.70 2km2 s PHE 91 N -0.02 3.14 -0.01 4.92 5.36 -1.26 -1.43 117.98 128.68 2km2 s PHE 91 Ca -0.05 -0.42 0.04 0.00 -0.96 0.00 0.00 56.93 55.54 2km2 s PHE 91 Cb -0.13 -2.30 -0.03 0.00 -0.34 0.00 0.00 43.02 40.22 2km2 s PHE 91 CO 0.03 -0.37 -0.10 -0.51 -1.46 0.00 0.00 175.22 172.81 2km2 s ASP 92 N 1.63 4.35 0.57 6.13 1.01 -0.40 -3.43 116.67 126.53 2km2 s ASP 92 Ca 0.06 -0.20 0.26 0.00 0.71 0.00 0.00 52.55 53.38 2km2 s ASP 92 Cb -0.16 -0.95 1.67 0.00 1.01 0.00 0.00 42.92 44.49 2km2 s ASP 92 CO 0.06 0.30 2.21 -0.61 0.21 0.00 0.00 175.17 177.33 2km2 h GLN 93 N 4.75 0.00 0.00 8.23 5.75 -1.94 -1.99 115.11 129.91 2km2 h GLN 93 Ca -0.48 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 57.95 2km2 h GLN 93 Cb 1.16 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.70 2km2 h GLN 93 CO 0.52 0.00 -1.07 0.00 -2.65 0.00 0.00 178.83 175.63 2km2 h ALA 94 N 1.97 0.60 -1.43 3.38 0.00 -1.96 -3.46 119.26 118.36 2km2 h ALA 94 Ca 0.01 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.62 2km2 h ALA 94 Cb 0.07 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2km2 h ALA 94 CO -0.00 0.38 0.13 0.27 0.00 0.00 0.00 179.25 180.03 2km2 n ASN 95 N -2.82 -0.21 -4.21 0.00 0.23 -0.75 -3.66 115.26 103.84 2km2 n ASN 95 Ca -0.03 -1.07 -0.29 0.00 -0.53 0.00 0.00 54.58 52.66 2km2 n ASN 95 Cb 0.67 0.34 -0.16 0.00 -2.08 0.00 0.00 39.78 38.54 2km2 n ASN 95 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2km2 s LEU 96 N 0.00 2.00 -0.21 -4.53 1.43 0.33 -1.28 118.68 116.42 2km2 s LEU 96 Ca 0.04 -0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 52.65 2km2 s LEU 96 Cb -0.00 -1.21 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2km2 s LEU 96 CO 0.00 0.20 -0.00 -0.89 0.23 0.00 0.00 176.35 175.89 2km2 s THR 97 N -0.06 3.82 -0.09 5.49 2.01 -0.52 -2.01 115.64 124.28 2km2 s THR 97 Ca -0.04 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.63 2km2 s THR 97 Cb -0.13 -2.74 0.01 0.00 0.01 0.00 0.00 72.50 69.65 2km2 s THR 97 CO 0.03 0.41 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.52 2km2 s VAL 98 N 1.22 1.56 0.08 3.82 1.01 0.12 -0.80 120.40 127.41 2km2 s VAL 98 Ca 0.03 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.39 2km2 s VAL 98 Cb -0.15 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 2km2 s VAL 98 CO 0.01 0.45 -0.24 -0.54 0.00 0.00 0.00 175.10 174.78 2km2 s LYS 99 N 0.70 1.40 0.36 2.72 1.02 0.42 -0.09 119.74 126.27 2km2 s LYS 99 Ca -0.13 -1.15 0.08 0.00 0.02 0.00 0.00 55.97 54.79 2km2 s LYS 99 Cb -0.16 -1.67 -0.03 0.00 -0.52 0.00 0.00 37.83 35.45 2km2 s LYS 99 CO 0.03 0.41 0.30 -0.51 -0.92 0.00 0.00 175.35 174.66 2km2 s LEU 100 N -1.64 3.48 0.56 3.17 1.43 0.01 -2.43 118.68 123.26 2km2 s LEU 100 Ca 0.10 -0.62 0.30 0.00 -1.03 0.00 0.00 54.13 52.88 2km2 s LEU 100 Cb -0.10 -2.09 1.64 0.00 0.03 0.00 0.00 46.19 45.67 2km2 s LEU 100 CO 0.04 -0.44 2.15 1.55 0.23 0.00 0.00 176.35 179.87 2km2 h PRO 101 N 1.23 0.00 0.00 1.29 0.13 -1.87 -1.41 132.00 131.36 2km2 h PRO 101 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2km2 h PRO 101 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2km2 h PRO 101 CO 0.59 0.07 0.00 -3.47 -0.23 0.00 0.00 178.00 174.96 2km2 n ASP 102 N -3.63 0.04 0.00 1.44 2.03 -1.26 -4.87 116.55 110.30 2km2 n ASP 102 Ca -0.02 0.51 0.00 0.00 0.52 0.00 0.00 54.79 55.79 2km2 n ASP 102 Cb 0.18 -0.52 0.00 0.00 -0.72 0.00 0.00 41.12 40.07 2km2 n ASP 102 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2km2 n GLY 103 N 0.97 0.38 3.74 0.27 0.00 -0.53 -5.07 105.19 104.95 2km2 n GLY 103 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2km2 n GLY 103 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2km2 s TYR 104 N -2.00 3.44 0.01 1.61 5.04 -1.26 -4.77 117.35 119.43 2km2 s TYR 104 Ca 0.00 1.45 0.07 0.00 -2.44 0.00 0.00 57.07 56.15 2km2 s TYR 104 Cb 0.00 -3.41 -0.02 0.00 0.35 0.00 0.00 41.96 38.88 2km2 s TYR 104 CO 0.00 -1.13 -0.20 -2.00 -1.34 0.00 0.00 175.55 170.88 2km2 s GLU 105 N -0.33 1.48 0.03 4.97 2.12 -1.26 -0.81 118.70 124.91 2km2 s GLU 105 Ca 0.52 -0.82 0.03 0.00 0.36 0.00 0.00 54.97 55.06 2km2 s GLU 105 Cb -0.32 -1.51 -0.02 0.00 0.26 0.00 0.00 34.13 32.54 2km2 s GLU 105 CO 0.37 0.40 -0.10 0.12 -0.54 0.00 0.00 175.26 175.51 2km2 s PHE 106 N -0.63 0.84 0.07 5.30 5.36 0.87 -4.96 117.98 124.83 2km2 s PHE 106 Ca 0.07 -0.35 0.09 0.00 -0.96 0.00 0.00 56.93 55.78 2km2 s PHE 106 Cb -0.08 -0.51 -0.03 0.00 -0.34 0.00 0.00 43.02 42.06 2km2 s PHE 106 CO 0.01 -0.02 -0.24 0.15 -1.46 0.00 0.00 175.22 173.65 2km2 s LYS 107 N -1.09 1.53 0.12 10.12 1.02 -1.26 -0.71 119.74 129.48 2km2 s LYS 107 Ca -0.03 -1.12 0.10 0.00 0.02 0.00 0.00 55.97 54.93 2km2 s LYS 107 Cb -0.07 -1.77 -0.04 0.00 -0.52 0.00 0.00 37.83 35.43 2km2 s LYS 107 CO 0.01 0.44 -0.20 -0.06 -0.92 0.00 0.00 175.35 174.62 2km2 s PHE 108 N -0.90 2.48 0.54 3.18 0.08 -0.85 -4.92 117.98 117.58 2km2 s PHE 108 Ca 0.11 -0.29 -0.20 0.00 0.12 0.00 0.00 56.93 56.67 2km2 s PHE 108 Cb -0.10 -1.32 -0.06 0.00 -0.57 0.00 0.00 43.02 40.98 2km2 s PHE 108 CO 0.03 0.38 1.12 -1.25 -0.10 0.00 0.00 175.22 175.41 2km2 s PRO 109 N -2.16 3.40 -0.87 0.24 0.04 -1.26 -0.51 135.00 133.88 2km2 s PRO 109 Ca 0.17 1.60 -0.10 0.00 0.04 0.00 0.00 61.00 62.72 2km2 s PRO 109 Cb -0.10 -2.03 -0.08 0.00 0.04 0.00 0.00 34.50 32.33 2km2 s PRO 109 CO 0.09 -0.81 2.05 -1.71 0.04 0.00 0.00 177.00 176.66 2km2 n ASN 110 N -1.24 4.23 -0.23 6.66 4.05 -1.24 -4.60 115.26 122.89 2km2 n ASN 110 Ca 0.11 -2.42 -0.08 0.00 0.45 0.00 0.00 54.58 52.65 2km2 n ASN 110 Cb 0.51 -1.10 0.04 0.00 1.23 0.00 0.00 39.78 40.46 2km2 n ASN 110 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 177.26 174.24 2km2 h ARG 111 N 6.74 1.11 -5.53 1.20 3.08 -1.93 -3.42 114.38 115.64 2km2 h ARG 111 Ca 0.47 -0.31 -0.59 0.00 0.07 0.00 0.00 59.98 59.62 2km2 h ARG 111 Cb 0.29 -0.12 -0.10 0.00 0.08 0.00 0.00 29.97 30.12 2km2 h ARG 111 CO 1.58 1.03 -0.31 -0.51 -1.07 0.00 0.00 179.97 180.69 2km2 s LEU 112 N -9.43 4.25 0.00 3.04 2.01 -1.26 -4.96 118.68 112.33 2km2 s LEU 112 Ca -0.12 0.54 0.15 0.00 0.01 0.00 0.00 54.13 54.71 2km2 s LEU 112 Cb 0.14 -2.40 0.53 0.00 0.01 0.00 0.00 46.19 44.46 2km2 s LEU 112 CO 0.85 0.10 1.39 0.59 1.01 0.00 0.00 176.35 180.29 2km2 n ASN 113 N 3.53 1.48 -4.69 2.29 5.03 -1.26 -4.90 115.26 116.73 2km2 n ASN 113 Ca -0.12 -1.83 -0.44 0.00 0.87 0.00 0.00 54.58 53.06 2km2 n ASN 113 Cb 0.52 -0.14 -0.04 0.00 -1.02 0.00 0.00 39.78 39.10 2km2 n ASN 113 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2km2 n LEU 114 N 0.25 3.63 -0.29 3.41 0.00 -1.26 -4.86 117.00 117.87 2km2 n LEU 114 Ca 0.13 1.05 0.07 0.00 0.00 0.00 0.00 56.01 57.26 2km2 n LEU 114 Cb 0.27 -1.50 -0.02 0.00 0.00 0.00 0.00 43.42 42.17 2km2 n LEU 114 CO 0.10 -0.01 0.21 -1.84 0.00 0.00 0.00 177.39 175.84 2km2 n GLU 115 N 4.17 1.80 -3.95 1.96 0.28 -1.26 -4.95 120.64 118.69 2km2 n GLU 115 Ca 0.17 -0.65 -0.16 0.00 -0.16 0.00 0.00 57.16 56.36 2km2 n GLU 115 Cb 0.33 -1.24 -0.16 0.00 1.43 0.00 0.00 31.44 31.80 2km2 n GLU 115 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2km2 s ALA 116 N -1.93 0.29 -0.15 -1.84 0.00 -1.25 -3.99 121.76 112.88 2km2 s ALA 116 Ca 0.12 0.10 -0.02 0.00 0.00 0.00 0.00 51.96 52.16 2km2 s ALA 116 Cb 0.12 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 2km2 s ALA 116 CO 0.42 -0.04 -0.07 0.42 0.00 0.00 0.00 175.76 176.49 2km2 s ILE 117 N 0.75 3.51 0.00 0.00 1.01 -0.31 -4.77 121.20 121.39 2km2 s ILE 117 Ca -0.07 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.09 2km2 s ILE 117 Cb -0.11 -2.52 0.00 0.00 0.01 0.00 0.00 42.46 39.84 2km2 s ILE 117 CO -0.01 0.50 0.00 0.59 0.00 0.00 0.00 174.94 176.01 2km2 n ASN 118 N 3.66 3.33 -4.68 3.58 3.02 0.12 0.23 115.26 124.53 2km2 n ASN 118 Ca -0.18 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 53.99 2km2 n ASN 118 Cb 0.52 0.41 -0.07 0.00 -0.61 0.00 0.00 39.78 40.04 2km2 n ASN 118 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2km2 s TYR 119 N -1.59 3.41 -0.02 3.10 5.04 0.15 -2.24 117.35 125.21 2km2 s TYR 119 Ca 0.00 0.75 -0.01 0.00 -2.44 0.00 0.00 57.07 55.37 2km2 s TYR 119 Cb 0.00 -2.59 0.02 0.00 0.35 0.00 0.00 41.96 39.74 2km2 s TYR 119 CO 0.00 0.00 0.05 1.41 -1.34 0.00 0.00 175.55 175.67 2km2 s MET 120 N 1.26 0.02 -0.09 4.97 -2.45 -1.21 0.18 119.30 121.97 2km2 s MET 120 Ca 0.23 0.15 -0.28 0.00 -1.25 0.00 0.00 55.69 54.53 2km2 s MET 120 Cb -0.15 -0.11 0.07 0.00 1.25 0.00 0.00 34.83 35.88 2km2 s MET 120 CO 0.09 -0.09 0.66 0.00 1.05 0.00 0.00 175.02 176.73 2km2 s ALA 121 N 0.59 -1.69 0.05 4.11 0.00 -0.22 -1.69 121.76 122.92 2km2 s ALA 121 Ca -0.05 1.38 -0.10 0.00 0.00 0.00 0.00 51.96 53.19 2km2 s ALA 121 Cb -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.83 2km2 s ALA 121 CO -0.02 -0.35 0.21 0.00 0.00 0.00 0.00 175.76 175.60 2km2 s ALA 122 N -0.88 -0.38 0.15 0.00 0.00 -1.23 -0.93 121.76 118.49 2km2 s ALA 122 Ca -0.09 -0.33 -0.18 0.00 0.00 0.00 0.00 51.96 51.36 2km2 s ALA 122 Cb -0.01 0.34 0.04 0.00 0.00 0.00 0.00 23.12 23.49 2km2 s ALA 122 CO 0.08 -0.41 0.48 0.16 0.00 0.00 0.00 175.76 176.06 2km2 s ASP 123 N -2.29 -0.33 0.00 0.00 -4.77 0.28 -3.38 116.67 106.18 2km2 s ASP 123 Ca -0.02 -0.25 0.00 0.00 -3.30 0.00 0.00 52.55 48.97 2km2 s ASP 123 Cb 0.01 0.53 0.00 0.00 -1.09 0.00 0.00 42.92 42.36 2km2 s ASP 123 CO -0.06 -0.92 0.00 0.61 0.70 0.00 0.00 175.17 175.51 2km2 n GLY 124 N -0.29 0.70 0.85 2.12 0.00 -1.26 0.16 105.19 107.47 2km2 n GLY 124 Ca -0.15 -1.68 0.06 0.00 0.00 0.00 0.00 46.02 44.25 2km2 n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2km2 n ASP 125 N 0.00 2.47 -4.73 1.61 8.00 0.54 -4.65 116.55 119.78 2km2 n ASP 125 Ca 0.00 -2.07 -0.29 0.00 0.71 0.00 0.00 54.79 53.13 2km2 n ASP 125 Cb 0.00 -0.33 -0.07 0.00 -0.02 0.00 0.00 41.12 40.70 2km2 n ASP 125 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2km2 s PHE 126 N -1.51 3.06 -0.14 1.24 5.36 -1.26 -2.47 117.98 122.26 2km2 s PHE 126 Ca 0.29 -0.00 0.02 0.00 -0.96 0.00 0.00 56.93 56.28 2km2 s PHE 126 Cb 0.16 -1.54 0.01 0.00 -0.34 0.00 0.00 43.02 41.31 2km2 s PHE 126 CO 0.18 0.50 -0.21 0.21 -1.46 0.00 0.00 175.22 174.44 2km2 s LYS 127 N -2.53 2.90 -0.21 10.12 2.20 0.10 -4.68 119.74 127.64 2km2 s LYS 127 Ca 0.28 -0.81 -0.09 0.00 -0.36 0.00 0.00 55.97 54.99 2km2 s LYS 127 Cb -0.11 -2.36 -0.04 0.00 -1.51 0.00 0.00 37.83 33.81 2km2 s LYS 127 CO 0.20 -0.03 0.10 -1.50 -0.36 0.00 0.00 175.35 173.76 2km2 s ILE 128 N 0.87 4.96 -0.14 5.43 2.07 -1.26 0.68 121.20 133.81 2km2 s ILE 128 Ca -0.06 0.04 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 2km2 s ILE 128 Cb -0.15 -3.28 -0.00 0.00 0.13 0.00 0.00 42.46 39.16 2km2 s ILE 128 CO -0.02 0.40 0.32 2.29 -1.91 0.00 0.00 174.94 176.01 2km2 n LYS 129 N 4.00 2.74 -3.68 3.50 2.85 -1.22 -4.91 118.16 121.44 2km2 n LYS 129 Ca -0.16 -0.31 -0.10 0.00 -1.05 0.00 0.00 58.31 56.69 2km2 n LYS 129 Cb 0.52 -0.81 -0.09 0.00 -0.65 0.00 0.00 35.03 34.00 2km2 n LYS 129 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2km2 s VAL 131 N 1.24 1.14 -0.02 0.00 1.01 -1.26 -2.10 120.40 120.41 2km2 s VAL 131 Ca -0.08 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 2km2 s VAL 131 Cb -0.07 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.32 2km2 s VAL 131 CO -0.12 0.34 0.08 0.00 0.00 0.00 0.00 175.10 175.40 2km2 s ALA 132 N 0.20 -0.18 0.00 5.51 0.00 -0.62 -5.01 121.76 121.66 2km2 s ALA 132 Ca -0.05 0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.97 2km2 s ALA 132 Cb -0.11 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.95 2km2 s ALA 132 CO 0.02 -0.08 0.03 1.19 0.00 0.00 0.00 175.76 176.91 2km2 n PHE 133 N 2.59 0.00 1.17 0.00 3.01 -1.26 0.28 117.46 123.25 2km2 n PHE 133 Ca -0.16 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.43 2km2 n PHE 133 Cb 0.58 0.00 0.25 0.00 -0.01 0.00 0.00 39.48 40.30 2km2 n PHE 133 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30