#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2km2 s GLY 3 N 2.76 0.45 0.68 0.00 0.00 -1.24 -2.00 107.32 107.97 2km2 s GLY 3 Ca 0.11 3.68 -0.15 0.00 0.00 0.00 0.00 44.72 48.36 2km2 s GLY 3 CO -0.26 2.85 1.14 -2.27 0.00 0.00 0.00 173.10 174.55 2km2 s LEU 4 N 1.28 3.37 -0.05 0.66 0.20 -1.20 -4.40 118.68 118.54 2km2 s LEU 4 Ca -0.07 2.11 0.05 0.00 0.69 0.00 0.00 54.13 56.91 2km2 s LEU 4 Cb -0.02 -4.56 -0.02 0.00 -0.43 0.00 0.00 46.19 41.16 2km2 s LEU 4 CO -0.12 -1.81 -0.22 -0.69 -0.29 0.00 0.00 176.35 173.22 2km2 s VAL 5 N -2.23 2.37 0.34 1.68 1.01 -1.26 -3.12 120.40 119.18 2km2 s VAL 5 Ca 0.69 -0.96 0.10 0.00 0.00 0.00 0.00 61.98 61.80 2km2 s VAL 5 Cb -0.23 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.21 2km2 s VAL 5 CO 0.42 0.57 -0.10 0.00 0.00 0.00 0.00 175.10 176.00 2km2 s ALA 6 N -0.34 2.96 0.20 5.51 0.00 0.65 -5.01 121.76 125.73 2km2 s ALA 6 Ca 0.02 -2.06 -0.15 0.00 0.00 0.00 0.00 51.96 49.78 2km2 s ALA 6 Cb -0.12 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 22.90 2km2 s ALA 6 CO 0.02 0.10 0.47 -1.54 0.00 0.00 0.00 175.76 174.81 2km2 s SER 7 N -3.61 -0.15 -1.37 0.00 1.04 -1.26 -2.99 113.70 105.36 2km2 s SER 7 Ca 0.32 -0.68 -0.07 0.00 0.48 0.00 0.00 55.95 56.00 2km2 s SER 7 Cb 0.01 0.56 0.01 0.00 0.10 0.00 0.00 66.02 66.70 2km2 s SER 7 CO 0.17 -1.05 0.98 -3.20 0.98 0.00 0.00 173.24 171.11 2km2 n ASN 8 N -0.33 -6.16 -0.31 7.02 5.15 -1.10 -4.88 115.26 114.65 2km2 n ASN 8 Ca -0.07 -0.45 0.13 0.00 -0.60 0.00 0.00 54.58 53.60 2km2 n ASN 8 Cb 0.62 -4.84 0.44 0.00 -0.53 0.00 0.00 39.78 35.47 2km2 n ASN 8 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2km2 n LEU 9 N -4.55 1.13 -0.39 1.20 4.77 -1.25 -4.98 117.00 112.93 2km2 n LEU 9 Ca -0.03 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 2km2 n LEU 9 Cb 0.58 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2km2 n LEU 9 CO 0.57 0.20 0.00 0.59 -1.33 0.00 0.00 177.39 177.43 2km2 n ASN 10 N -0.41 0.00 -4.72 -1.43 4.13 0.29 -4.81 115.26 108.32 2km2 n ASN 10 Ca 0.15 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 56.06 2km2 n ASN 10 Cb 0.34 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.50 2km2 n ASN 10 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2km2 s LEU 11 N -0.12 4.18 0.37 3.41 0.20 -0.41 -4.73 118.68 121.58 2km2 s LEU 11 Ca 0.00 0.22 0.05 0.00 0.69 0.00 0.00 54.13 55.08 2km2 s LEU 11 Cb 0.00 -2.08 -0.01 0.00 -0.43 0.00 0.00 46.19 43.67 2km2 s LEU 11 CO 0.00 0.17 0.53 -0.54 -0.29 0.00 0.00 176.35 176.22 2km2 s LYS 12 N 0.39 3.11 0.51 1.98 1.02 -1.26 -0.84 119.74 124.64 2km2 s LYS 12 Ca 0.08 -0.85 -0.22 0.00 0.02 0.00 0.00 55.97 55.00 2km2 s LYS 12 Cb -0.11 -2.74 -0.06 0.00 -0.52 0.00 0.00 37.83 34.39 2km2 s LYS 12 CO -0.02 -0.03 1.21 -1.25 -0.92 0.00 0.00 175.35 174.35 2km2 s PRO 13 N -4.28 3.45 0.00 -1.68 0.04 -1.25 -3.32 135.00 127.96 2km2 s PRO 13 Ca 0.46 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2km2 s PRO 13 Cb -0.10 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.18 2km2 s PRO 13 CO 0.33 -0.83 0.00 0.41 0.04 0.00 0.00 177.00 176.95 2km2 n GLY 14 N 0.49 0.79 3.49 0.56 0.00 -1.25 -4.98 105.19 104.29 2km2 n GLY 14 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.63 2.04 -0.10 1.61 2.02 -1.21 -5.10 118.70 117.32 2km2 s GLU 15 Ca 0.00 -1.02 -0.03 0.00 0.02 0.00 0.00 54.97 53.95 2km2 s GLU 15 Cb 0.00 -2.21 -0.03 0.00 0.10 0.00 0.00 34.13 31.99 2km2 s GLU 15 CO 0.00 0.53 0.01 0.00 0.02 0.00 0.00 175.26 175.82 2km2 s LEU 17 N -0.64 2.32 -0.12 0.00 2.96 -0.42 0.54 118.68 123.33 2km2 s LEU 17 Ca 0.10 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.57 2km2 s LEU 17 Cb -0.12 -1.48 -0.00 0.00 0.50 0.00 0.00 46.19 45.09 2km2 s LEU 17 CO 0.02 0.16 -0.22 -0.60 -1.32 0.00 0.00 176.35 174.40 2km2 s ARG 18 N 0.34 3.10 -0.13 1.98 3.52 -0.96 -1.04 118.95 125.75 2km2 s ARG 18 Ca -0.16 -0.84 0.02 0.00 -0.13 0.00 0.00 55.73 54.62 2km2 s ARG 18 Cb -0.17 -2.39 0.01 0.00 -1.56 0.00 0.00 34.95 30.84 2km2 s ARG 18 CO 0.08 0.14 -0.21 0.08 -0.81 0.00 0.00 175.30 174.58 2km2 s VAL 19 N 0.46 1.94 -0.16 7.11 1.01 -1.16 -1.32 120.40 128.29 2km2 s VAL 19 Ca -0.15 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 60.89 2km2 s VAL 19 Cb -0.17 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2km2 s VAL 19 CO 0.06 0.53 -0.05 -0.60 0.00 0.00 0.00 175.10 175.04 2km2 s ARG 20 N 0.83 3.61 0.00 2.72 3.52 -1.15 -2.49 118.95 125.99 2km2 s ARG 20 Ca -0.07 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 54.98 2km2 s ARG 20 Cb -0.15 -2.89 0.00 0.00 -1.56 0.00 0.00 34.95 30.34 2km2 s ARG 20 CO -0.01 0.20 0.00 0.41 -0.81 0.00 0.00 175.30 175.08 2km2 n GLY 21 N 3.65 3.09 2.94 8.12 0.00 -1.15 -2.85 105.19 118.99 2km2 n GLY 21 Ca -0.17 -1.36 -0.26 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.00 1.54 -0.00 1.61 2.12 0.43 -2.78 118.70 119.62 2km2 s GLU 22 Ca 0.00 -0.29 -0.30 0.00 0.36 0.00 0.00 54.97 54.74 2km2 s GLU 22 Cb 0.00 -1.50 -0.03 0.00 0.26 0.00 0.00 34.13 32.86 2km2 s GLU 22 CO 0.00 -0.18 1.01 0.08 -0.54 0.00 0.00 175.26 175.64 2km2 s VAL 23 N 1.38 4.75 1.01 3.70 1.01 -0.94 -0.12 120.40 131.18 2km2 s VAL 23 Ca -0.01 1.98 -0.13 0.00 0.00 0.00 0.00 61.98 63.81 2km2 s VAL 23 Cb -0.14 -4.27 0.10 0.00 0.00 0.00 0.00 36.38 32.08 2km2 s VAL 23 CO -0.04 0.14 0.54 0.00 0.00 0.00 0.00 175.10 175.73 2km2 n ALA 24 N 4.03 -2.62 0.31 5.51 0.00 0.49 -2.55 120.51 125.67 2km2 n ALA 24 Ca 0.07 -0.82 0.16 0.00 0.00 0.00 0.00 53.44 52.85 2km2 n ALA 24 Cb 0.50 -1.84 0.71 0.00 0.00 0.00 0.00 19.45 18.82 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 -1.88 0.00 -2.08 0.00 0.13 -1.87 0.40 132.00 126.70 2km2 h PRO 25 Ca -0.48 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.00 2km2 h PRO 25 Cb 1.30 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 32.06 2km2 h PRO 25 CO 0.38 0.00 -0.12 -3.47 -0.23 0.00 0.00 178.00 174.56 2km2 n ASP 26 N -2.81 5.48 -4.57 1.44 -0.08 -1.26 -4.11 116.55 110.64 2km2 n ASP 26 Ca 0.00 -3.71 -0.13 0.00 -1.51 0.00 0.00 54.79 49.44 2km2 n ASP 26 Cb 0.23 -0.72 -0.10 0.00 2.34 0.00 0.00 41.12 42.87 2km2 n ASP 26 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2km2 n ALA 27 N -0.29 0.26 -0.06 -1.67 0.00 -1.18 -4.55 120.51 113.03 2km2 n ALA 27 Ca 0.39 -1.82 -0.07 0.00 0.00 0.00 0.00 53.44 51.94 2km2 n ALA 27 Cb 0.40 -3.30 -0.07 0.00 0.00 0.00 0.00 19.45 16.48 2km2 n ALA 27 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2km2 n LYS 28 N 8.44 1.52 -3.80 0.00 4.81 -1.26 -4.31 118.16 123.56 2km2 n LYS 28 Ca 0.44 0.03 -0.13 0.00 -0.87 0.00 0.00 58.31 57.78 2km2 n LYS 28 Cb 0.45 -1.27 -0.12 0.00 0.02 0.00 0.00 35.03 34.11 2km2 n LYS 28 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2km2 s SER 29 N -4.69 -0.22 0.01 3.14 0.15 -1.26 -2.01 113.70 108.82 2km2 s SER 29 Ca -0.10 0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.97 2km2 s SER 29 Cb 0.04 0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 64.78 2km2 s SER 29 CO 0.38 -0.09 -0.02 -0.36 1.20 0.00 0.00 173.24 174.35 2km2 s PHE 30 N 0.05 0.22 -0.05 3.44 0.40 -1.21 -0.16 117.98 120.67 2km2 s PHE 30 Ca -0.01 -0.34 0.01 0.00 -0.60 0.00 0.00 56.93 55.99 2km2 s PHE 30 Cb -0.02 -0.15 0.02 0.00 0.51 0.00 0.00 43.02 43.38 2km2 s PHE 30 CO 0.00 -0.12 -0.06 0.08 0.70 0.00 0.00 175.22 175.83 2km2 s VAL 31 N -0.94 0.64 0.03 -0.44 1.01 -0.62 -4.05 120.40 116.01 2km2 s VAL 31 Ca -0.10 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.73 2km2 s VAL 31 Cb -0.07 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 2km2 s VAL 31 CO -0.01 0.24 -0.12 -0.76 0.00 0.00 0.00 175.10 174.46 2km2 s LEU 32 N 0.84 2.14 -0.22 3.92 1.43 -0.97 -0.80 118.68 125.02 2km2 s LEU 32 Ca -0.12 -0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 52.56 2km2 s LEU 32 Cb -0.15 -0.50 0.10 0.00 0.03 0.00 0.00 46.19 45.67 2km2 s LEU 32 CO 0.01 0.02 0.25 0.20 0.23 0.00 0.00 176.35 177.06 2km2 s ASN 33 N -0.92 1.29 -0.23 2.29 0.01 0.24 -3.21 114.94 114.41 2km2 s ASN 33 Ca 0.01 -0.24 0.01 0.00 -0.71 0.00 0.00 52.86 51.93 2km2 s ASN 33 Cb -0.07 0.48 0.06 0.00 0.41 0.00 0.00 41.25 42.13 2km2 s ASN 33 CO 0.01 -0.33 -0.08 -1.48 -1.51 0.00 0.00 177.10 173.71 2km2 s LEU 34 N 2.36 2.65 0.00 0.60 2.34 -1.14 0.53 118.68 126.02 2km2 s LEU 34 Ca 0.08 -1.14 0.00 0.00 0.06 0.00 0.00 54.13 53.13 2km2 s LEU 34 Cb -0.16 -1.26 0.00 0.00 -0.56 0.00 0.00 46.19 44.21 2km2 s LEU 34 CO -0.15 -0.20 0.00 0.61 -1.06 0.00 0.00 176.35 175.54 2km2 n GLY 35 N 4.63 2.49 0.93 -3.48 0.00 0.25 -2.51 105.19 107.50 2km2 n GLY 35 Ca -0.13 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 -4.49 1.61 2.85 -1.10 0.71 118.16 117.74 2km2 n LYS 36 Ca 0.00 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.02 2km2 n LYS 36 Cb 0.00 -0.43 -0.10 0.00 -0.65 0.00 0.00 35.03 33.84 2km2 n LYS 36 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2km2 s ASP 37 N -4.41 3.34 0.24 -5.58 1.01 -1.25 -3.87 116.67 106.15 2km2 s ASP 37 Ca 0.00 -1.17 -0.06 0.00 0.71 0.00 0.00 52.55 52.04 2km2 s ASP 37 Cb 0.00 -0.27 0.34 0.00 1.01 0.00 0.00 42.92 43.99 2km2 s ASP 37 CO 0.00 -0.22 1.83 -1.28 0.21 0.00 0.00 175.17 175.72 2km2 h SER 38 N 2.16 0.74 -0.01 0.27 0.87 -1.99 -1.63 113.55 113.96 2km2 h SER 38 Ca -0.41 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 2km2 h SER 38 Cb 1.24 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2km2 h SER 38 CO 0.68 0.46 -0.01 0.59 -0.53 0.00 0.00 176.83 178.02 2km2 n ASN 39 N -4.69 1.80 -3.11 6.23 3.02 -1.26 -4.37 115.26 112.88 2km2 n ASN 39 Ca 0.12 -1.59 -0.29 0.00 -0.03 0.00 0.00 54.58 52.79 2km2 n ASN 39 Cb 0.21 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.34 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 0.40 4.75 -4.80 6.41 3.02 -0.61 0.97 115.26 125.40 2km2 n ASN 40 Ca 0.18 -3.65 -0.38 0.00 -0.03 0.00 0.00 54.58 50.70 2km2 n ASN 40 Cb 0.40 -0.66 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 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 -3.41 4.47 -0.02 3.41 1.43 -0.96 -2.70 118.68 120.90 2km2 s LEU 41 Ca 0.46 1.13 0.12 0.00 -1.03 0.00 0.00 54.13 54.81 2km2 s LEU 41 Cb 0.25 -2.81 -0.23 0.00 0.03 0.00 0.00 46.19 43.42 2km2 s LEU 41 CO -0.11 0.22 0.76 0.00 0.23 0.00 0.00 176.35 177.44 2km2 s LEU 43 N -6.18 1.86 -0.05 0.00 1.43 -1.19 -4.51 118.68 110.04 2km2 s LEU 43 Ca -0.04 -0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 2km2 s LEU 43 Cb 0.08 -0.21 0.03 0.00 0.03 0.00 0.00 46.19 46.12 2km2 s LEU 43 CO 0.82 0.02 -0.01 -2.28 0.23 0.00 0.00 176.35 175.13 2km2 s HIS 44 N 0.11 0.58 -0.02 0.29 2.46 -0.48 -2.90 115.29 115.32 2km2 s HIS 44 Ca -0.01 -0.12 0.04 0.00 0.47 0.00 0.00 55.06 55.44 2km2 s HIS 44 Cb -0.04 -0.63 -0.03 0.00 -0.13 0.00 0.00 32.58 31.75 2km2 s HIS 44 CO -0.00 -0.22 -0.12 -0.06 -2.47 0.00 0.00 174.74 171.87 2km2 s PHE 45 N 1.30 2.77 -0.46 3.88 0.40 -1.20 -2.90 117.98 121.77 2km2 s PHE 45 Ca -0.05 -0.11 0.07 0.00 -0.60 0.00 0.00 56.93 56.23 2km2 s PHE 45 Cb -0.13 -1.61 0.24 0.00 0.51 0.00 0.00 43.02 42.03 2km2 s PHE 45 CO -0.02 0.27 0.79 -1.71 0.70 0.00 0.00 175.22 175.25 2km2 n ASN 46 N 1.97 -2.09 -4.77 1.36 4.05 -0.97 -2.29 115.26 112.52 2km2 n ASN 46 Ca -0.17 -3.15 -0.36 0.00 0.45 0.00 0.00 54.58 51.35 2km2 n ASN 46 Cb 0.52 1.19 -0.00 0.00 1.23 0.00 0.00 39.78 42.72 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 0.20 3.62 -0.16 1.20 0.04 -1.26 -3.30 135.00 135.33 2km2 s PRO 47 Ca 0.33 1.74 -0.04 0.00 0.04 0.00 0.00 61.00 63.07 2km2 s PRO 47 Cb 0.21 -2.28 0.06 0.00 0.04 0.00 0.00 34.50 32.53 2km2 s PRO 47 CO -0.21 -0.66 0.06 1.03 0.04 0.00 0.00 177.00 177.26 2km2 s ARG 48 N -2.88 0.29 0.13 4.56 0.52 -0.35 -3.28 118.95 117.94 2km2 s ARG 48 Ca 0.67 -0.16 -0.18 0.00 -0.52 0.00 0.00 55.73 55.55 2km2 s ARG 48 Cb -0.28 -1.78 -0.03 0.00 0.52 0.00 0.00 34.95 33.38 2km2 s ARG 48 CO 0.33 -0.61 1.71 0.35 0.02 0.00 0.00 175.30 177.10 2km2 h PHE 49 N 8.35 0.46 -0.77 -0.53 3.57 -1.59 -3.19 116.94 123.25 2km2 h PHE 49 Ca -0.15 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.41 2km2 h PHE 49 Cb 1.14 -0.14 -0.20 0.00 2.79 0.00 0.00 35.95 39.53 2km2 h PHE 49 CO 0.24 0.39 -0.27 1.21 -2.23 0.00 0.00 178.31 177.65 2km2 s ASN 50 N -5.66 -1.26 0.00 0.41 2.47 -1.26 -3.38 114.94 106.27 2km2 s ASN 50 Ca -0.13 0.11 0.00 0.00 0.42 0.00 0.00 52.86 53.25 2km2 s ASN 50 Cb 0.09 1.78 0.00 0.00 -1.45 0.00 0.00 41.25 41.68 2km2 s ASN 50 CO 0.73 -0.22 0.00 0.00 -3.72 0.00 0.00 177.10 173.88 2km2 n ALA 51 N 5.26 0.51 -0.22 1.71 0.00 -1.26 -4.83 120.51 121.67 2km2 n ALA 51 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 2km2 n ALA 51 Cb 0.55 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.04 2km2 n ALA 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2km2 h HIS 52 N 0.00 0.94 0.00 0.00 -0.00 -1.99 -3.44 115.15 110.66 2km2 h HIS 52 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 60.37 60.30 2km2 h HIS 52 Cb 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.13 2km2 h HIS 52 CO 0.00 0.74 0.00 0.41 -0.00 0.00 0.00 177.93 179.08 2km2 n GLY 53 N -0.84 0.00 0.62 5.26 0.00 -1.26 -5.17 105.19 103.80 2km2 n GLY 53 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 2.01 -3.87 1.61 8.00 -1.26 -5.11 116.55 117.92 2km2 n ASP 54 Ca 0.00 -1.36 -0.11 0.00 0.71 0.00 0.00 54.79 54.03 2km2 n ASP 54 Cb 0.00 0.04 -0.09 0.00 -0.02 0.00 0.00 41.12 41.05 2km2 n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2km2 s ALA 55 N -2.14 -0.29 -0.20 2.24 0.00 -1.25 -4.15 121.76 115.97 2km2 s ALA 55 Ca 0.01 -0.27 -0.04 0.00 0.00 0.00 0.00 51.96 51.67 2km2 s ALA 55 Cb -0.00 0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.32 2km2 s ALA 55 CO 0.01 -0.28 0.07 0.09 0.00 0.00 0.00 175.76 175.65 2km2 n ASN 56 N 1.04 -0.38 -4.43 0.00 4.13 -1.22 -4.87 115.26 109.53 2km2 n ASN 56 Ca -0.21 -0.20 -0.33 0.00 1.68 0.00 0.00 54.58 55.52 2km2 n ASN 56 Cb 0.57 -0.24 -0.13 0.00 -1.54 0.00 0.00 39.78 38.43 2km2 n ASN 56 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2km2 s THR 57 N -4.27 3.25 -0.07 3.41 2.01 -1.20 -4.58 115.64 114.19 2km2 s THR 57 Ca 0.05 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.49 2km2 s THR 57 Cb -0.03 -2.36 -0.02 0.00 0.01 0.00 0.00 72.50 70.11 2km2 s THR 57 CO 0.15 0.54 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.80 2km2 s ILE 58 N 0.06 2.56 -0.14 1.82 1.01 -0.69 -1.21 121.20 124.61 2km2 s ILE 58 Ca -0.04 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 59.71 2km2 s ILE 58 Cb -0.14 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 2km2 s ILE 58 CO 0.04 0.57 -0.07 -0.69 0.00 0.00 0.00 174.94 174.78 2km2 s VAL 59 N -0.22 3.58 -0.07 2.92 1.01 -1.21 -1.41 120.40 125.01 2km2 s VAL 59 Ca -0.01 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2km2 s VAL 59 Cb -0.13 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.72 2km2 s VAL 59 CO 0.03 0.51 -0.08 0.00 0.00 0.00 0.00 175.10 175.56 2km2 s ASN 61 N 1.14 0.21 0.11 0.00 4.22 -1.14 -0.08 114.94 119.39 2km2 s ASN 61 Ca -0.06 -1.12 0.04 0.00 -2.14 0.00 0.00 52.86 49.58 2km2 s ASN 61 Cb -0.14 0.63 -0.04 0.00 1.28 0.00 0.00 41.25 42.98 2km2 s ASN 61 CO -0.01 -1.24 -0.11 -0.44 -2.04 0.00 0.00 177.10 173.26 2km2 s SER 62 N -3.09 1.64 0.05 3.54 0.01 -1.26 -1.38 113.70 113.21 2km2 s SER 62 Ca 0.24 -0.82 0.03 0.00 1.31 0.00 0.00 55.95 56.71 2km2 s SER 62 Cb -0.01 -0.02 -0.03 0.00 0.21 0.00 0.00 66.02 66.18 2km2 s SER 62 CO 0.13 -0.22 -0.09 -0.75 0.41 0.00 0.00 173.24 172.71 2km2 s LYS 63 N -2.77 0.58 -0.28 12.44 2.20 -0.35 -3.49 119.74 128.08 2km2 s LYS 63 Ca 0.07 -0.81 0.02 0.00 -0.36 0.00 0.00 55.97 54.88 2km2 s LYS 63 Cb -0.03 -0.37 0.08 0.00 -1.51 0.00 0.00 37.83 36.00 2km2 s LYS 63 CO 0.01 0.07 -0.01 0.34 -0.36 0.00 0.00 175.35 175.40 2km2 s ASP 64 N -1.67 4.21 -1.69 1.43 2.15 -1.23 -2.26 116.67 117.60 2km2 s ASP 64 Ca -0.08 -1.56 0.00 0.00 0.43 0.00 0.00 52.55 51.35 2km2 s ASP 64 Cb -0.09 -1.29 0.00 0.00 -0.30 0.00 0.00 42.92 41.23 2km2 s ASP 64 CO 0.00 -0.30 0.00 0.61 -0.17 0.00 0.00 175.17 175.31 2km2 n GLY 65 N 4.56 0.18 2.12 2.66 0.00 0.27 -0.55 105.19 114.43 2km2 n GLY 65 Ca -0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.77 0.56 0.00 -0.02 0.00 0.10 -4.90 105.19 100.17 2km2 n GLY 66 Ca -0.21 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 0.35 0.00 -3.00 4.61 0.00 0.29 -5.09 120.51 117.67 2km2 n ALA 67 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2km2 n ALA 67 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.73 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 -0.26 0.00 0.00 0.00 7.02 -1.26 -4.94 117.44 118.00 2km2 n TRP 68 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2km2 n TRP 68 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 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 1.16 2.34 3.56 6.99 0.00 -1.23 -4.00 105.19 114.01 2km2 n GLY 69 Ca 0.00 0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 4.26 -0.03 2.61 2.01 -1.25 -4.76 115.64 118.47 2km2 s THR 70 Ca 0.00 -2.01 -0.30 0.00 0.31 0.00 0.00 61.69 59.69 2km2 s THR 70 Cb 0.00 -5.15 -0.05 0.00 0.01 0.00 0.00 72.50 67.31 2km2 s THR 70 CO 0.00 -1.96 1.34 -0.70 -0.69 0.00 0.00 174.62 172.60 2km2 s GLU 71 N 3.83 4.30 0.00 4.92 2.12 -1.26 -4.44 118.70 128.16 2km2 s GLU 71 Ca 0.52 1.86 0.00 0.00 0.36 0.00 0.00 54.97 57.71 2km2 s GLU 71 Cb 0.03 -3.59 0.00 0.00 0.26 0.00 0.00 34.13 30.83 2km2 s GLU 71 CO 0.06 -0.55 0.00 1.04 -0.54 0.00 0.00 175.26 175.28 2km2 n GLN 72 N 5.43 3.08 -3.61 4.30 6.02 0.88 -4.95 117.38 128.53 2km2 n GLN 72 Ca 0.13 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.96 2km2 n GLN 72 Cb 0.44 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.57 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 1.24 0.14 -0.18 -1.09 3.52 -1.26 -3.57 118.95 117.74 2km2 s ARG 73 Ca 0.00 0.58 -0.04 0.00 -0.13 0.00 0.00 55.73 56.14 2km2 s ARG 73 Cb 0.00 -0.37 -0.02 0.00 -1.56 0.00 0.00 34.95 33.00 2km2 s ARG 73 CO 0.00 -0.39 -0.04 -1.21 -0.81 0.00 0.00 175.30 172.85 2km2 s GLU 74 N 2.38 3.53 -0.66 5.12 0.41 -0.50 -5.00 118.70 123.99 2km2 s GLU 74 Ca 0.03 -0.57 0.00 0.00 -0.41 0.00 0.00 54.97 54.02 2km2 s GLU 74 Cb -0.13 -2.95 0.41 0.00 -1.78 0.00 0.00 34.13 29.68 2km2 s GLU 74 CO -0.09 0.05 1.77 0.00 -0.49 0.00 0.00 175.26 176.51 2km2 n ALA 75 N 4.08 6.04 -2.98 5.21 0.00 -1.26 -1.70 120.51 129.90 2km2 n ALA 75 Ca -0.18 -3.92 -0.30 0.00 0.00 0.00 0.00 53.44 49.04 2km2 n ALA 75 Cb 0.52 -1.48 -0.17 0.00 0.00 0.00 0.00 19.45 18.32 2km2 n ALA 75 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2km2 s VAL 76 N -5.02 1.91 -0.41 0.00 1.01 -1.26 -5.02 120.40 111.60 2km2 s VAL 76 Ca 0.55 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2km2 s VAL 76 Cb 0.45 -1.64 0.17 0.00 0.00 0.00 0.00 36.38 35.36 2km2 s VAL 76 CO -0.20 0.53 0.37 0.72 0.00 0.00 0.00 175.10 176.52 2km2 s PHE 77 N 0.10 0.60 0.00 5.22 -0.71 -1.26 -4.91 117.98 117.03 2km2 s PHE 77 Ca -0.10 -1.92 -0.01 0.00 -1.04 0.00 0.00 56.93 53.87 2km2 s PHE 77 Cb -0.15 -0.72 -0.03 0.00 -1.21 0.00 0.00 43.02 40.90 2km2 s PHE 77 CO 0.05 -0.89 2.21 -0.35 -1.34 0.00 0.00 175.22 174.90 2km2 n PRO 78 N 3.11 1.13 -3.85 1.99 -0.04 -1.26 -4.84 135.00 131.24 2km2 n PRO 78 Ca 0.25 -0.13 -0.09 0.00 -0.04 0.00 0.00 63.50 63.48 2km2 n PRO 78 Cb 0.47 -1.13 -0.06 0.00 -0.04 0.00 0.00 33.50 32.74 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 0.13 0.16 0.23 0.54 -0.12 -1.26 -4.64 117.98 113.01 2km2 s PHE 79 Ca 0.09 -0.53 0.04 0.00 -0.05 0.00 0.00 56.93 56.48 2km2 s PHE 79 Cb 0.04 0.07 -0.05 0.00 -0.63 0.00 0.00 43.02 42.45 2km2 s PHE 79 CO 0.00 -0.72 -0.03 -0.65 -0.05 0.00 0.00 175.22 173.77 2km2 s GLN 80 N -3.90 1.35 0.52 1.99 1.11 -1.26 -5.13 119.66 114.33 2km2 s GLN 80 Ca 0.11 -1.67 -0.21 0.00 0.01 0.00 0.00 55.36 53.61 2km2 s GLN 80 Cb 0.03 -0.74 -0.06 0.00 -1.01 0.00 0.00 33.01 31.22 2km2 s GLN 80 CO -0.05 -0.04 1.14 -1.25 0.01 0.00 0.00 175.29 175.10 2km2 s PRO 81 N -3.81 3.49 -1.10 2.91 0.04 -1.26 -3.42 135.00 131.84 2km2 s PRO 81 Ca 0.27 1.66 -0.06 0.00 0.04 0.00 0.00 61.00 62.91 2km2 s PRO 81 Cb 0.05 -2.13 0.01 0.00 0.04 0.00 0.00 34.50 32.46 2km2 s PRO 81 CO 0.08 -0.75 0.96 0.41 0.04 0.00 0.00 177.00 177.74 2km2 n GLY 82 N 0.25 -0.28 2.90 0.56 0.00 0.14 -4.81 105.19 103.95 2km2 n GLY 82 Ca 0.10 0.08 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.42 0.42 0.14 1.61 0.15 -1.16 -4.90 113.70 106.54 2km2 s SER 83 Ca 0.40 -0.06 -0.30 0.00 0.70 0.00 0.00 55.95 56.70 2km2 s SER 83 Cb -0.18 -0.10 -0.07 0.00 -1.71 0.00 0.00 66.02 63.97 2km2 s SER 83 CO 0.61 0.01 0.98 0.68 1.20 0.00 0.00 173.24 176.72 2km2 s VAL 84 N 0.20 4.33 0.04 4.45 -7.23 -1.26 -2.22 120.40 118.71 2km2 s VAL 84 Ca -0.02 1.99 -0.15 0.00 -1.81 0.00 0.00 61.98 62.00 2km2 s VAL 84 Cb -0.05 -4.27 0.02 0.00 0.56 0.00 0.00 36.38 32.65 2km2 s VAL 84 CO -0.00 0.33 0.33 0.00 -0.31 0.00 0.00 175.10 175.45 2km2 s ALA 85 N -0.19 -0.76 -0.02 1.32 0.00 -1.12 -4.96 121.76 116.03 2km2 s ALA 85 Ca 0.47 0.09 0.08 0.00 0.00 0.00 0.00 51.96 52.60 2km2 s ALA 85 Cb -0.25 0.31 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 2km2 s ALA 85 CO 0.31 -0.41 -0.25 -1.21 0.00 0.00 0.00 175.76 174.20 2km2 s GLU 86 N -2.47 1.99 -0.09 0.00 2.02 -1.26 -2.96 118.70 115.94 2km2 s GLU 86 Ca -0.05 -0.89 0.04 0.00 0.02 0.00 0.00 54.97 54.08 2km2 s GLU 86 Cb -0.01 -1.93 0.00 0.00 0.10 0.00 0.00 34.13 32.29 2km2 s GLU 86 CO -0.03 0.53 -0.20 0.08 0.02 0.00 0.00 175.26 175.66 2km2 s VAL 87 N -0.58 1.78 -0.19 2.63 1.01 -1.04 -3.42 120.40 120.58 2km2 s VAL 87 Ca 0.10 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 61.04 2km2 s VAL 87 Cb -0.09 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2km2 s VAL 87 CO -0.01 0.50 0.47 0.00 0.00 0.00 0.00 175.10 176.06 2km2 s ILE 89 N 1.44 1.84 -0.13 0.00 1.01 -0.20 -2.07 121.20 123.08 2km2 s ILE 89 Ca 0.22 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.05 2km2 s ILE 89 Cb -0.15 -1.65 0.01 0.00 0.01 0.00 0.00 42.46 40.69 2km2 s ILE 89 CO 0.09 0.51 -0.19 -0.89 0.00 0.00 0.00 174.94 174.45 2km2 s THR 90 N 0.90 1.87 -0.30 2.92 2.01 -0.36 -1.31 115.64 121.37 2km2 s THR 90 Ca -0.06 -0.86 -0.05 0.00 0.31 0.00 0.00 61.69 61.02 2km2 s THR 90 Cb -0.15 -1.67 0.03 0.00 0.01 0.00 0.00 72.50 70.71 2km2 s THR 90 CO -0.02 0.51 0.06 0.12 -0.69 0.00 0.00 174.62 174.60 2km2 s PHE 91 N 0.93 3.18 0.13 4.92 5.36 -1.26 -1.66 117.98 129.58 2km2 s PHE 91 Ca -0.06 -1.31 0.10 0.00 -0.96 0.00 0.00 56.93 54.71 2km2 s PHE 91 Cb -0.15 -2.21 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 2km2 s PHE 91 CO -0.03 -0.67 -0.26 -0.51 -1.46 0.00 0.00 175.22 172.29 2km2 s ASP 92 N 1.41 3.17 0.35 6.13 1.01 -0.96 -3.80 116.67 123.98 2km2 s ASP 92 Ca -0.00 -0.75 0.06 0.00 0.71 0.00 0.00 52.55 52.57 2km2 s ASP 92 Cb -0.18 -0.21 0.65 0.00 1.01 0.00 0.00 42.92 44.19 2km2 s ASP 92 CO 0.01 0.15 1.88 1.56 0.21 0.00 0.00 175.17 178.98 2km2 h GLN 93 N 3.87 0.42 -0.33 8.23 4.20 -1.94 -2.71 115.11 126.86 2km2 h GLN 93 Ca -0.50 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.10 2km2 h GLN 93 Cb 1.17 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.88 2km2 h GLN 93 CO 0.40 0.50 0.15 0.00 -0.67 0.00 0.00 178.83 179.21 2km2 h ALA 94 N 1.54 0.43 -2.38 3.87 0.00 -1.96 -3.44 119.26 117.31 2km2 h ALA 94 Ca 0.08 -0.11 0.19 0.00 0.00 0.00 0.00 54.91 55.07 2km2 h ALA 94 Cb 0.37 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 2km2 h ALA 94 CO 0.02 0.01 0.59 0.54 0.00 0.00 0.00 179.25 180.40 2km2 s ASN 95 N -5.73 -0.05 -0.17 0.00 2.20 -1.02 -4.63 114.94 105.53 2km2 s ASN 95 Ca -0.13 -0.54 -0.05 0.00 -0.94 0.00 0.00 52.86 51.20 2km2 s ASN 95 Cb 0.09 0.46 -0.03 0.00 -2.00 0.00 0.00 41.25 39.77 2km2 s ASN 95 CO 0.73 -0.89 -0.01 -0.76 -2.94 0.00 0.00 177.10 173.24 2km2 s LEU 96 N -3.25 3.38 -0.18 3.54 1.43 -0.91 -2.27 118.68 120.42 2km2 s LEU 96 Ca 0.19 -0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 53.15 2km2 s LEU 96 Cb -0.02 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 2km2 s LEU 96 CO 0.04 0.14 -0.04 -0.89 0.23 0.00 0.00 176.35 175.83 2km2 s THR 97 N 0.52 3.73 -0.05 5.49 2.01 -0.66 -2.89 115.64 123.78 2km2 s THR 97 Ca -0.01 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 61.60 2km2 s THR 97 Cb -0.14 -2.65 0.02 0.00 0.01 0.00 0.00 72.50 69.74 2km2 s THR 97 CO 0.02 0.46 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.67 2km2 s VAL 98 N 0.74 0.66 0.08 3.82 1.01 -1.16 -1.22 120.40 124.33 2km2 s VAL 98 Ca -0.02 -0.18 0.09 0.00 0.00 0.00 0.00 61.98 61.87 2km2 s VAL 98 Cb -0.14 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 2km2 s VAL 98 CO 0.02 0.26 -0.23 -0.54 0.00 0.00 0.00 175.10 174.61 2km2 s LYS 99 N 0.99 1.35 0.38 2.72 1.02 -0.88 -2.89 119.74 122.43 2km2 s LYS 99 Ca -0.10 -1.13 0.07 0.00 0.02 0.00 0.00 55.97 54.84 2km2 s LYS 99 Cb -0.14 -1.61 -0.00 0.00 -0.52 0.00 0.00 37.83 35.56 2km2 s LYS 99 CO -0.00 0.39 0.50 -0.51 -0.92 0.00 0.00 175.35 174.81 2km2 s LEU 100 N -1.63 3.77 0.55 3.17 1.02 -1.26 -2.37 118.68 121.93 2km2 s LEU 100 Ca 0.09 -0.35 0.32 0.00 0.02 0.00 0.00 54.13 54.21 2km2 s LEU 100 Cb -0.10 -2.63 1.56 0.00 0.02 0.00 0.00 46.19 45.04 2km2 s LEU 100 CO 0.04 -0.59 2.08 1.55 0.02 0.00 0.00 176.35 179.45 2km2 h PRO 101 N 0.81 0.00 -1.41 1.29 0.13 -1.90 -3.36 132.00 127.56 2km2 h PRO 101 Ca -0.43 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.37 2km2 h PRO 101 Cb 1.27 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.15 2km2 h PRO 101 CO 0.50 0.08 -0.69 -3.47 -0.23 0.00 0.00 178.00 174.18 2km2 n ASP 102 N -3.37 -2.19 -1.56 1.44 -0.08 -1.26 -5.07 116.55 104.46 2km2 n ASP 102 Ca -0.01 -2.77 0.01 0.00 -1.51 0.00 0.00 54.79 50.51 2km2 n ASP 102 Cb 0.24 0.85 0.00 0.00 2.34 0.00 0.00 41.12 44.55 2km2 n ASP 102 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2km2 n GLY 103 N 2.66 0.48 0.00 0.27 0.00 -1.26 -4.62 105.19 102.72 2km2 n GLY 103 Ca 0.21 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2km2 n GLY 103 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2km2 n TYR 104 N -0.18 0.00 -4.38 1.61 4.01 -1.26 -4.69 117.16 112.27 2km2 n TYR 104 Ca 0.01 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.54 2km2 n TYR 104 Cb 0.11 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.01 2km2 n TYR 104 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2km2 s GLU 105 N 1.49 1.01 -0.04 -0.72 2.12 -1.26 -4.07 118.70 117.23 2km2 s GLU 105 Ca 0.00 -0.83 0.03 0.00 0.36 0.00 0.00 54.97 54.53 2km2 s GLU 105 Cb 0.00 -1.05 0.00 0.00 0.26 0.00 0.00 34.13 33.34 2km2 s GLU 105 CO 0.00 0.26 -0.11 0.12 -0.54 0.00 0.00 175.26 174.99 2km2 s PHE 106 N -0.90 1.19 0.03 5.30 5.36 -1.14 -5.01 117.98 122.81 2km2 s PHE 106 Ca 0.02 -0.34 0.06 0.00 -0.96 0.00 0.00 56.93 55.71 2km2 s PHE 106 Cb -0.08 -0.85 -0.03 0.00 -0.34 0.00 0.00 43.02 41.71 2km2 s PHE 106 CO 0.02 -0.15 -0.15 0.15 -1.46 0.00 0.00 175.22 173.62 2km2 s LYS 107 N 0.29 2.21 -0.04 10.12 1.02 -1.26 -2.99 119.74 129.08 2km2 s LYS 107 Ca -0.06 -0.91 0.03 0.00 0.02 0.00 0.00 55.97 55.05 2km2 s LYS 107 Cb -0.11 -2.27 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 2km2 s LYS 107 CO 0.01 0.56 -0.13 0.12 -0.92 0.00 0.00 175.35 175.00 2km2 s PHE 108 N -0.93 1.35 0.31 3.18 5.36 -1.14 -4.95 117.98 121.15 2km2 s PHE 108 Ca 0.15 -0.41 -0.29 0.00 -0.96 0.00 0.00 56.93 55.42 2km2 s PHE 108 Cb -0.11 -0.95 -0.10 0.00 -0.34 0.00 0.00 43.02 41.52 2km2 s PHE 108 CO 0.06 -0.18 1.33 -1.25 -1.46 0.00 0.00 175.22 173.72 2km2 s PRO 109 N 0.31 4.34 -1.11 10.12 0.04 -1.26 -2.15 135.00 145.30 2km2 s PRO 109 Ca -0.07 2.22 -0.08 0.00 0.04 0.00 0.00 61.00 63.11 2km2 s PRO 109 Cb -0.12 -3.09 0.28 0.00 0.04 0.00 0.00 34.50 31.62 2km2 s PRO 109 CO 0.02 -0.23 1.16 0.27 0.04 0.00 0.00 177.00 178.26 2km2 n ASN 110 N 1.18 5.62 -0.56 6.66 6.94 -1.26 -4.87 115.26 128.96 2km2 n ASN 110 Ca 0.02 -3.10 0.45 0.00 -0.02 0.00 0.00 54.58 51.93 2km2 n ASN 110 Cb 0.42 -1.35 0.75 0.00 -2.36 0.00 0.00 39.78 37.23 2km2 n ASN 110 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 2km2 h ARG 111 N 6.43 0.03 -7.05 -3.83 2.43 -1.95 -3.39 114.38 107.05 2km2 h ARG 111 Ca 0.18 -0.00 -0.45 0.00 -0.81 0.00 0.00 59.98 58.90 2km2 h ARG 111 Cb 0.83 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 2km2 h ARG 111 CO 1.06 0.02 0.35 -0.51 -1.51 0.00 0.00 179.97 179.38 2km2 s LEU 112 N -8.62 3.94 -0.60 3.80 1.43 -1.26 -4.97 118.68 112.41 2km2 s LEU 112 Ca -0.06 1.75 -0.00 0.00 -1.03 0.00 0.00 54.13 54.79 2km2 s LEU 112 Cb 0.28 -4.51 0.45 0.00 0.03 0.00 0.00 46.19 42.43 2km2 s LEU 112 CO 0.86 -0.43 1.85 0.59 0.23 0.00 0.00 176.35 179.45 2km2 n ASN 113 N -0.64 7.09 -4.69 2.29 5.03 -1.26 -4.99 115.26 118.09 2km2 n ASN 113 Ca 0.07 -3.78 -0.42 0.00 0.87 0.00 0.00 54.58 51.32 2km2 n ASN 113 Cb 0.53 -0.84 -0.03 0.00 -1.02 0.00 0.00 39.78 38.42 2km2 n ASN 113 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2km2 s LEU 114 N -3.79 4.32 0.00 3.41 2.96 -1.26 -4.89 118.68 119.43 2km2 s LEU 114 Ca 0.61 2.10 0.24 0.00 -0.22 0.00 0.00 54.13 56.86 2km2 s LEU 114 Cb 0.48 -3.56 0.22 0.00 0.50 0.00 0.00 46.19 43.83 2km2 s LEU 114 CO -0.02 -0.69 1.23 -1.84 -1.32 0.00 0.00 176.35 173.71 2km2 n GLU 115 N 5.13 0.99 -3.87 1.98 0.28 -1.26 -4.77 120.64 119.12 2km2 n GLU 115 Ca 0.13 -0.75 -0.12 0.00 -0.16 0.00 0.00 57.16 56.26 2km2 n GLU 115 Cb 0.44 -1.48 -0.13 0.00 1.43 0.00 0.00 31.44 31.70 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 -2.53 -0.11 -0.26 -1.84 0.00 -1.26 -3.87 121.76 111.90 2km2 s ALA 116 Ca 0.19 0.03 -0.09 0.00 0.00 0.00 0.00 51.96 52.09 2km2 s ALA 116 Cb 0.18 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2km2 s ALA 116 CO 0.58 -0.05 0.13 0.42 0.00 0.00 0.00 175.76 176.83 2km2 s ILE 117 N -0.27 4.88 -0.01 0.00 -1.09 -0.02 -4.77 121.20 119.92 2km2 s ILE 117 Ca -0.03 0.02 0.02 0.00 -2.23 0.00 0.00 60.65 58.43 2km2 s ILE 117 Cb -0.02 -3.29 -0.03 0.00 -1.58 0.00 0.00 42.46 37.53 2km2 s ILE 117 CO 0.00 0.31 0.05 0.59 -1.23 0.00 0.00 174.94 174.67 2km2 n ASN 118 N 4.81 3.97 -4.38 3.58 3.02 0.15 -0.55 115.26 125.86 2km2 n ASN 118 Ca -0.15 -0.07 -0.33 0.00 -0.03 0.00 0.00 54.58 54.00 2km2 n ASN 118 Cb 0.52 1.09 -0.14 0.00 -0.61 0.00 0.00 39.78 40.64 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 -2.04 2.83 -0.14 3.10 5.04 0.22 -2.70 117.35 123.66 2km2 s TYR 119 Ca -0.01 -0.61 -0.04 0.00 -2.44 0.00 0.00 57.07 53.97 2km2 s TYR 119 Cb 0.01 -1.85 0.06 0.00 0.35 0.00 0.00 41.96 40.54 2km2 s TYR 119 CO 0.09 -0.19 0.14 1.41 -1.34 0.00 0.00 175.55 175.66 2km2 s MET 120 N 0.34 0.07 -0.01 4.97 -2.45 -1.16 0.84 119.30 121.91 2km2 s MET 120 Ca -0.10 0.25 0.02 0.00 -1.25 0.00 0.00 55.69 54.60 2km2 s MET 120 Cb -0.16 -1.04 -0.00 0.00 1.25 0.00 0.00 34.83 34.89 2km2 s MET 120 CO 0.06 -0.52 -0.05 0.00 1.05 0.00 0.00 175.02 175.56 2km2 s ALA 121 N 2.24 0.43 -0.04 4.11 0.00 0.19 -0.26 121.76 128.43 2km2 s ALA 121 Ca 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 51.96 51.79 2km2 s ALA 121 Cb -0.14 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.87 2km2 s ALA 121 CO -0.08 0.09 0.09 0.00 0.00 0.00 0.00 175.76 175.86 2km2 s ALA 122 N -0.01 -0.11 -0.18 0.00 0.00 -1.18 0.79 121.76 121.06 2km2 s ALA 122 Ca 0.01 0.44 -0.07 0.00 0.00 0.00 0.00 51.96 52.34 2km2 s ALA 122 Cb -0.03 -0.31 0.08 0.00 0.00 0.00 0.00 23.12 22.86 2km2 s ALA 122 CO -0.00 -0.11 0.40 0.34 0.00 0.00 0.00 175.76 176.38 2km2 s ASP 123 N 0.92 -0.24 0.00 0.00 -1.08 0.02 -3.27 116.67 113.02 2km2 s ASP 123 Ca -0.07 0.92 0.00 0.00 -0.52 0.00 0.00 52.55 52.88 2km2 s ASP 123 Cb -0.10 1.13 0.00 0.00 -1.46 0.00 0.00 42.92 42.49 2km2 s ASP 123 CO -0.04 -0.22 0.00 0.61 0.52 0.00 0.00 175.17 176.04 2km2 n GLY 124 N 5.12 -0.75 0.43 2.66 0.00 -0.85 -1.59 105.19 110.21 2km2 n GLY 124 Ca -0.12 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.59 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 1.24 -4.77 1.61 8.00 0.77 -1.19 116.55 122.21 2km2 n ASP 125 Ca 0.00 -1.94 -0.35 0.00 0.71 0.00 0.00 54.79 53.21 2km2 n ASP 125 Cb 0.00 -0.15 -0.08 0.00 -0.02 0.00 0.00 41.12 40.88 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 -1.71 3.33 -0.20 1.24 5.36 -1.26 -0.38 117.98 124.36 2km2 s PHE 126 Ca 0.18 0.30 -0.01 0.00 -0.96 0.00 0.00 56.93 56.43 2km2 s PHE 126 Cb 0.09 -1.82 0.01 0.00 -0.34 0.00 0.00 43.02 40.96 2km2 s PHE 126 CO 0.13 0.57 -0.12 0.21 -1.46 0.00 0.00 175.22 174.55 2km2 s LYS 127 N -1.21 3.18 -0.28 10.12 2.20 0.83 -4.35 119.74 130.24 2km2 s LYS 127 Ca 0.17 -0.73 -0.15 0.00 -0.36 0.00 0.00 55.97 54.90 2km2 s LYS 127 Cb -0.12 -2.78 -0.03 0.00 -1.51 0.00 0.00 37.83 33.39 2km2 s LYS 127 CO 0.07 -0.20 0.39 -1.50 -0.36 0.00 0.00 175.35 173.74 2km2 s ILE 128 N 1.38 5.16 -0.46 5.43 2.07 -1.26 0.16 121.20 133.68 2km2 s ILE 128 Ca 0.05 0.56 0.21 0.00 -1.41 0.00 0.00 60.65 60.05 2km2 s ILE 128 Cb -0.14 -3.72 -0.28 0.00 0.13 0.00 0.00 42.46 38.45 2km2 s ILE 128 CO -0.08 0.13 0.65 0.29 -1.91 0.00 0.00 174.94 174.01 2km2 n LYS 129 N 5.36 0.47 -3.64 3.50 5.02 -1.16 -4.83 118.16 122.88 2km2 n LYS 129 Ca -0.08 -0.10 -0.15 0.00 -2.02 0.00 0.00 58.31 55.95 2km2 n LYS 129 Cb 0.51 -1.48 -0.08 0.00 -0.02 0.00 0.00 35.03 33.96 2km2 n LYS 129 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2km2 s VAL 131 N -0.77 1.54 -0.02 0.00 1.01 -1.26 -2.96 120.40 117.94 2km2 s VAL 131 Ca -0.08 -0.71 0.07 0.00 0.00 0.00 0.00 61.98 61.26 2km2 s VAL 131 Cb -0.03 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2km2 s VAL 131 CO 0.05 0.45 -0.24 0.00 0.00 0.00 0.00 175.10 175.36 2km2 s ALA 132 N 0.58 2.25 -0.25 5.51 0.00 -0.43 -5.04 121.76 124.38 2km2 s ALA 132 Ca -0.15 -1.10 -0.07 0.00 0.00 0.00 0.00 51.96 50.64 2km2 s ALA 132 Cb -0.17 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 2km2 s ALA 132 CO 0.05 0.53 0.07 0.12 0.00 0.00 0.00 175.76 176.53 2km2 s PHE 133 N -0.64 3.09 0.00 0.00 5.36 -1.26 -2.28 117.98 122.25 2km2 s PHE 133 Ca 0.10 -0.47 0.00 0.00 -0.96 0.00 0.00 56.93 55.60 2km2 s PHE 133 Cb -0.10 -2.24 0.00 0.00 -0.34 0.00 0.00 43.02 40.34 2km2 s PHE 133 CO -0.01 -0.38 0.00 -3.47 -1.46 0.00 0.00 175.22 169.90