#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rov n ARG 2 N 0.00 0.26 -1.42 1.43 0.00 -1.26 -5.08 116.66 110.59 2rov n ARG 2 Ca 0.00 -1.91 -0.54 0.00 -0.00 0.00 0.00 57.85 55.39 2rov n ARG 2 Cb 0.00 1.54 -0.09 0.00 -0.00 0.00 0.00 32.46 33.92 2rov n ARG 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2rov n LEU 3 N 0.00 1.76 -3.63 2.89 7.94 -1.25 -4.85 117.00 119.86 2rov n LEU 3 Ca 0.04 0.58 -0.10 0.00 -1.11 0.00 0.00 56.01 55.41 2rov n LEU 3 Cb 0.35 -1.14 -0.04 0.00 0.53 0.00 0.00 43.42 43.12 2rov n LEU 3 CO 0.18 -0.71 0.26 -1.83 -1.11 0.00 0.00 177.39 174.19 2rov s GLU 4 N 5.79 1.24 0.00 1.96 -1.05 -1.26 0.61 118.70 126.00 2rov s GLU 4 Ca 1.11 -0.72 0.00 0.00 -0.15 0.00 0.00 54.97 55.21 2rov s GLU 4 Cb -1.07 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 33.13 2rov s GLU 4 CO 0.56 -0.52 0.00 0.41 0.95 0.00 0.00 175.26 176.66 2rov n GLY 5 N -0.31 0.11 3.15 -3.83 0.00 -0.16 -4.98 105.19 99.17 2rov n GLY 5 Ca -0.14 -1.24 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 2rov n GLY 5 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2rov s TRP 6 N -3.75 2.59 0.09 1.61 0.52 -1.26 -0.13 118.94 118.60 2rov s TRP 6 Ca 0.00 -1.33 0.10 0.00 0.02 0.00 0.00 56.10 54.89 2rov s TRP 6 Cb 0.00 -1.78 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 2rov s TRP 6 CO 0.00 -0.62 -0.26 -0.51 0.02 0.00 0.00 176.95 175.58 2rov s LEU 7 N 0.89 2.25 0.16 2.99 1.43 -0.48 -4.80 118.68 121.12 2rov s LEU 7 Ca -0.06 -0.67 -0.13 0.00 -1.03 0.00 0.00 54.13 52.24 2rov s LEU 7 Cb -0.15 -1.23 -0.07 0.00 0.03 0.00 0.00 46.19 44.77 2rov s LEU 7 CO -0.03 0.21 0.55 -0.44 0.23 0.00 0.00 176.35 176.87 2rov s SER 8 N -1.66 6.78 0.09 2.29 0.01 -0.07 0.62 113.70 121.76 2rov s SER 8 Ca 0.13 1.04 0.03 0.00 1.31 0.00 0.00 55.95 58.46 2rov s SER 8 Cb -0.10 -2.27 -0.03 0.00 0.21 0.00 0.00 66.02 63.82 2rov s SER 8 CO 0.04 0.07 -0.09 -0.76 0.41 0.00 0.00 173.24 172.90 2rov s LEU 9 N -2.14 2.39 -0.16 2.44 1.02 -1.01 0.28 118.68 121.50 2rov s LEU 9 Ca 0.40 -0.78 -0.29 0.00 0.02 0.00 0.00 54.13 53.48 2rov s LEU 9 Cb -0.14 -0.26 -0.06 0.00 0.02 0.00 0.00 46.19 45.74 2rov s LEU 9 CO 0.19 -0.27 2.16 -0.81 0.02 0.00 0.00 176.35 177.65 2rov n PRO 10 N 0.68 2.14 -4.02 1.29 -0.04 -1.26 -2.73 135.00 131.07 2rov n PRO 10 Ca -0.17 0.65 -0.31 0.00 -0.04 0.00 0.00 63.50 63.63 2rov n PRO 10 Cb 0.57 -3.16 -0.16 0.00 -0.04 0.00 0.00 33.50 30.72 2rov n PRO 10 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2rov s VAL 11 N 7.37 1.81 -0.37 0.52 0.11 -1.26 -4.90 120.40 123.68 2rov s VAL 11 Ca 0.98 -1.24 -0.27 0.00 -2.93 0.00 0.00 61.98 58.52 2rov s VAL 11 Cb -0.38 -1.92 -0.05 0.00 -1.53 0.00 0.00 36.38 32.50 2rov s VAL 11 CO 0.37 0.08 2.18 -0.13 -3.33 0.00 0.00 175.10 174.27 2rov s ARG 12 N 1.30 2.74 0.13 1.54 0.52 -1.24 -1.20 118.95 122.74 2rov s ARG 12 Ca -0.04 1.56 -0.07 0.00 -0.52 0.00 0.00 55.73 56.66 2rov s ARG 12 Cb -0.18 -4.42 -0.07 0.00 0.52 0.00 0.00 34.95 30.80 2rov s ARG 12 CO -0.07 -2.55 1.35 -0.91 0.02 0.00 0.00 175.30 173.14 2rov h ASN 13 N 16.31 0.72 0.00 0.23 2.35 -1.94 -3.39 115.58 129.86 2rov h ASN 13 Ca -0.32 -0.49 -0.21 0.00 -0.55 0.00 0.00 56.30 54.72 2rov h ASN 13 Cb 1.23 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.35 2rov h ASN 13 CO 1.07 1.27 -1.64 -0.46 -1.65 0.00 0.00 177.43 176.02 2rov n ASN 14 N -3.87 1.76 0.00 5.81 6.94 -1.26 -5.04 115.26 119.59 2rov n ASN 14 Ca -0.06 0.30 0.00 0.00 -0.02 0.00 0.00 54.58 54.80 2rov n ASN 14 Cb 0.75 -0.70 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 2rov n ASN 14 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 2rov n THR 15 N -4.20 0.00 -0.05 5.53 5.66 -1.26 -5.00 114.28 114.96 2rov n THR 15 Ca -0.31 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.61 2rov n THR 15 Cb 0.65 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.39 2rov n THR 15 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 2rov n LYS 16 N 0.00 0.23 0.00 1.09 2.85 -1.26 -4.94 118.16 116.13 2rov n LYS 16 Ca 0.00 0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 2rov n LYS 16 Cb 0.00 -1.05 0.00 0.00 -0.65 0.00 0.00 35.03 33.33 2rov n LYS 16 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2rov n LYS 17 N -3.07 -0.76 -3.15 -1.58 4.81 -1.26 -4.90 118.16 108.24 2rov n LYS 17 Ca -0.18 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.31 2rov n LYS 17 Cb 0.67 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.70 2rov n LYS 17 CO 0.00 0.00 0.00 -0.59 1.17 0.00 0.00 177.40 177.98 2rov s PHE 18 N -0.63 -0.28 0.00 5.64 -0.71 -1.26 -3.72 117.98 117.02 2rov s PHE 18 Ca 0.00 0.26 0.00 0.00 -1.04 0.00 0.00 56.93 56.15 2rov s PHE 18 Cb 0.00 0.08 0.00 0.00 -1.21 0.00 0.00 43.02 41.89 2rov s PHE 18 CO 0.00 -0.15 0.00 0.41 -1.34 0.00 0.00 175.22 174.14 2rov n GLY 19 N 5.39 0.74 3.34 1.99 0.00 -0.34 -4.57 105.19 111.74 2rov n GLY 19 Ca -0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 2rov n GLY 19 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2rov s TRP 20 N 0.91 -0.61 -0.19 1.61 0.52 -1.26 -3.98 118.94 115.94 2rov s TRP 20 Ca 0.00 1.34 -0.03 0.00 0.02 0.00 0.00 56.10 57.43 2rov s TRP 20 Cb 0.00 0.26 0.06 0.00 -1.15 0.00 0.00 33.47 32.65 2rov s TRP 20 CO 0.00 -0.32 0.05 0.54 0.02 0.00 0.00 176.95 177.24 2rov s VAL 21 N 0.97 0.40 -0.36 4.03 0.11 -1.10 -4.87 120.40 119.58 2rov s VAL 21 Ca -0.06 -0.50 -0.29 0.00 -2.93 0.00 0.00 61.98 58.21 2rov s VAL 21 Cb -0.06 -0.95 -0.00 0.00 -1.53 0.00 0.00 36.38 33.83 2rov s VAL 21 CO -0.08 -0.24 1.53 -1.59 -3.33 0.00 0.00 175.10 171.39 2rov s LYS 22 N 1.91 3.55 0.05 1.54 -2.85 -1.24 -2.41 119.74 120.29 2rov s LYS 22 Ca -0.00 1.16 0.00 0.00 -1.00 0.00 0.00 55.97 56.13 2rov s LYS 22 Cb -0.17 -4.06 -0.04 0.00 -2.06 0.00 0.00 37.83 31.50 2rov s LYS 22 CO -0.09 -1.59 0.16 0.15 0.10 0.00 0.00 175.35 174.08 2rov s LYS 23 N 5.06 3.27 -0.50 1.78 -0.14 0.20 -4.68 119.74 124.74 2rov s LYS 23 Ca 0.67 -0.49 -0.27 0.00 -1.36 0.00 0.00 55.97 54.51 2rov s LYS 23 Cb -0.17 -2.96 -0.01 0.00 -1.68 0.00 0.00 37.83 33.01 2rov s LYS 23 CO 0.32 0.61 1.73 -0.47 -0.76 0.00 0.00 175.35 176.78 2rov s TYR 24 N -1.43 1.87 -0.13 3.18 5.04 -0.79 -1.39 117.35 123.70 2rov s TYR 24 Ca 0.32 0.68 -0.04 0.00 -2.44 0.00 0.00 57.07 55.58 2rov s TYR 24 Cb -0.13 -4.17 -0.03 0.00 0.35 0.00 0.00 41.96 37.98 2rov s TYR 24 CO 0.24 -2.43 0.02 0.08 -1.34 0.00 0.00 175.55 172.12 2rov s VAL 25 N 7.59 4.49 -0.11 3.14 1.01 0.81 -0.40 120.40 136.93 2rov s VAL 25 Ca 0.68 -0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.47 2rov s VAL 25 Cb -0.16 -2.95 0.05 0.00 0.00 0.00 0.00 36.38 33.32 2rov s VAL 25 CO 0.27 0.54 0.07 -0.63 0.00 0.00 0.00 175.10 175.35 2rov s ILE 26 N -0.31 -0.01 -0.57 2.22 1.01 -0.35 -0.99 121.20 122.21 2rov s ILE 26 Ca 0.07 0.06 -0.23 0.00 0.00 0.00 0.00 60.65 60.55 2rov s ILE 26 Cb -0.12 -0.44 0.05 0.00 0.01 0.00 0.00 42.46 41.96 2rov s ILE 26 CO 0.02 -0.05 0.89 -0.69 0.00 0.00 0.00 174.94 175.11 2rov s VAL 27 N 2.12 4.46 0.99 2.92 1.01 0.20 -0.07 120.40 132.03 2rov s VAL 27 Ca 0.03 0.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.89 2rov s VAL 27 Cb -0.14 -4.53 0.18 0.00 0.00 0.00 0.00 36.38 31.89 2rov s VAL 27 CO -0.06 -1.13 1.11 -0.55 0.00 0.00 0.00 175.10 174.47 2rov s SER 28 N 2.99 2.78 0.61 3.32 0.15 0.35 -3.93 113.70 119.98 2rov s SER 28 Ca 0.26 1.03 0.30 0.00 0.70 0.00 0.00 55.95 58.24 2rov s SER 28 Cb -0.15 -1.63 1.59 0.00 -1.71 0.00 0.00 66.02 64.13 2rov s SER 28 CO 0.16 -3.01 1.97 0.28 1.20 0.00 0.00 173.24 173.83 2rov h SER 29 N -1.81 0.00 -0.03 5.45 0.02 -1.98 -3.16 113.55 112.03 2rov h SER 29 Ca -0.53 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.25 2rov h SER 29 Cb 1.33 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.70 2rov h SER 29 CO 0.58 0.00 -0.34 0.29 -1.14 0.00 0.00 176.83 176.22 2rov n LYS 30 N -3.46 1.23 -3.65 3.45 4.76 -1.26 -4.96 118.16 114.27 2rov n LYS 30 Ca 0.03 -1.35 -0.00 0.00 -2.87 0.00 0.00 58.31 54.12 2rov n LYS 30 Cb 0.48 0.30 -0.06 0.00 -1.84 0.00 0.00 35.03 33.90 2rov n LYS 30 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2rov s LYS 31 N -0.15 0.14 -0.32 1.97 2.47 -1.20 -4.27 119.74 118.39 2rov s LYS 31 Ca 0.09 0.22 -0.18 0.00 -1.56 0.00 0.00 55.97 54.55 2rov s LYS 31 Cb 0.39 0.04 -0.01 0.00 -1.46 0.00 0.00 37.83 36.79 2rov s LYS 31 CO -0.11 -0.03 0.53 0.42 0.16 0.00 0.00 175.35 176.32 2rov s ILE 32 N 0.89 5.02 -0.03 5.43 1.01 0.11 0.13 121.20 133.76 2rov s ILE 32 Ca -0.05 0.57 -0.03 0.00 0.00 0.00 0.00 60.65 61.14 2rov s ILE 32 Cb -0.03 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 2rov s ILE 32 CO -0.12 -0.11 0.16 -0.76 0.00 0.00 0.00 174.94 174.10 2rov s LEU 33 N 2.40 4.29 -0.05 2.97 1.43 0.90 -0.04 118.68 130.58 2rov s LEU 33 Ca 0.20 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.66 2rov s LEU 33 Cb -0.15 -2.45 0.01 0.00 0.03 0.00 0.00 46.19 43.63 2rov s LEU 33 CO 0.12 0.29 -0.11 0.12 0.23 0.00 0.00 176.35 177.00 2rov s PHE 34 N -1.24 1.28 0.25 0.29 2.19 0.36 -1.21 117.98 119.88 2rov s PHE 34 Ca 0.24 -0.42 0.01 0.00 0.33 0.00 0.00 56.93 57.10 2rov s PHE 34 Cb -0.12 -0.93 -0.05 0.00 -1.31 0.00 0.00 43.02 40.61 2rov s PHE 34 CO 0.15 -0.21 0.12 0.71 1.83 0.00 0.00 175.22 177.82 2rov s TYR 35 N 0.51 1.44 -0.02 10.12 1.51 0.47 0.10 117.35 131.48 2rov s TYR 35 Ca -0.10 -1.27 0.09 0.00 -1.01 0.00 0.00 57.07 54.78 2rov s TYR 35 Cb -0.13 -0.80 -0.14 0.00 -0.11 0.00 0.00 41.96 40.78 2rov s TYR 35 CO 0.02 -0.45 0.19 -0.40 -1.11 0.00 0.00 175.55 173.80 2rov n ASP 36 N -0.49 2.85 -3.35 2.29 5.75 -1.26 -1.88 116.55 120.46 2rov n ASP 36 Ca 0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.70 2rov n ASP 36 Cb 0.66 1.38 -0.00 0.00 -1.03 0.00 0.00 41.12 42.13 2rov n ASP 36 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2rov s SER 37 N -3.15 -0.03 0.21 -1.12 0.01 -1.26 -4.62 113.70 103.73 2rov s SER 37 Ca -0.03 -0.97 -0.00 0.00 1.31 0.00 0.00 55.95 56.25 2rov s SER 37 Cb 0.06 0.78 0.16 0.00 0.21 0.00 0.00 66.02 67.23 2rov s SER 37 CO 0.39 -1.51 1.52 -0.33 0.41 0.00 0.00 173.24 173.73 2rov h GLU 38 N 2.03 0.43 0.31 12.44 5.08 -1.99 -2.88 114.58 130.00 2rov h GLU 38 Ca -0.27 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 57.80 2rov h GLU 38 Cb 1.25 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 2rov h GLU 38 CO 0.34 0.89 -0.17 1.96 -1.00 0.00 0.00 179.01 181.02 2rov h GLN 39 N 0.33 -0.44 0.00 2.33 7.50 -1.99 -1.12 115.11 121.72 2rov h GLN 39 Ca 0.00 0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.17 2rov h GLN 39 Cb 1.10 0.10 -0.00 0.00 0.05 0.00 0.00 27.48 28.73 2rov h GLN 39 CO 0.10 -0.29 -0.05 -0.44 -1.50 0.00 0.00 178.83 176.65 2rov h ASP 40 N -0.46 0.00 0.11 1.46 5.19 -1.87 -0.61 116.42 120.25 2rov h ASP 40 Ca -0.04 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.37 2rov h ASP 40 Cb 0.37 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.88 2rov h ASP 40 CO 0.05 0.05 -0.05 0.50 -3.12 0.00 0.00 179.24 176.67 2rov h LYS 41 N 0.00 -0.14 0.00 3.56 3.11 -1.14 0.25 116.57 122.21 2rov h LYS 41 Ca -0.00 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.83 2rov h LYS 41 Cb 0.17 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.43 2rov h LYS 41 CO 0.01 0.35 -0.09 1.05 -2.81 0.00 0.00 179.45 177.95 2rov h GLU 42 N -0.77 0.00 -0.08 1.90 4.11 -0.98 -2.40 114.58 116.36 2rov h GLU 42 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.41 2rov h GLU 42 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2rov h GLU 42 CO 0.02 0.09 0.00 0.94 0.07 0.00 0.00 179.01 180.14 2rov n GLN 43 N -3.25 1.36 -2.70 1.06 -0.06 -0.26 -4.89 117.38 108.65 2rov n GLN 43 Ca 0.00 -0.54 -0.20 0.00 -2.00 0.00 0.00 57.00 54.26 2rov n GLN 43 Cb 0.34 -1.34 0.02 0.00 -4.06 0.00 0.00 30.24 25.20 2rov n GLN 43 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2rov n SER 44 N -0.23 -5.64 -4.10 1.69 7.64 -0.90 -4.95 113.62 107.13 2rov n SER 44 Ca 0.15 -0.16 -0.36 0.00 1.01 0.00 0.00 58.87 59.51 2rov n SER 44 Cb 0.19 -4.56 -0.07 0.00 -1.01 0.00 0.00 64.21 58.76 2rov n SER 44 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2rov s ASN 45 N -2.48 5.92 -0.19 6.43 3.84 0.87 -5.05 114.94 124.28 2rov s ASN 45 Ca 0.16 -3.71 -0.29 0.00 0.21 0.00 0.00 52.86 49.22 2rov s ASN 45 Cb -0.07 -1.89 -0.02 0.00 -0.55 0.00 0.00 41.25 38.72 2rov s ASN 45 CO 0.20 -0.18 1.35 -2.16 -2.79 0.00 0.00 177.10 173.52 2rov s PRO 46 N -1.33 4.12 0.47 0.43 0.04 -1.26 -4.54 135.00 132.92 2rov s PRO 46 Ca 0.27 1.64 0.13 0.00 0.04 0.00 0.00 61.00 63.08 2rov s PRO 46 Cb -0.07 -3.84 1.09 0.00 0.04 0.00 0.00 34.50 31.72 2rov s PRO 46 CO -0.13 -0.87 2.08 -0.92 0.04 0.00 0.00 177.00 177.21 2rov h TYR 47 N 8.84 0.26 -1.87 0.56 5.03 0.34 -3.44 116.97 126.69 2rov h TYR 47 Ca -0.29 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.02 2rov h TYR 47 Cb 1.12 -0.09 -0.21 0.00 1.55 0.00 0.00 36.73 39.10 2rov h TYR 47 CO 0.84 0.15 0.28 1.41 -1.32 0.00 0.00 178.16 179.52 2rov s MET 48 N -5.27 0.88 -0.03 1.82 1.75 -0.83 -4.99 119.30 112.62 2rov s MET 48 Ca -0.07 0.37 -0.02 0.00 -1.25 0.00 0.00 55.69 54.72 2rov s MET 48 Cb 0.18 0.42 0.02 0.00 2.84 0.00 0.00 34.83 38.28 2rov s MET 48 CO 0.71 -0.24 0.08 0.54 -0.65 0.00 0.00 175.02 175.46 2rov s VAL 49 N -0.83 -0.02 0.18 10.11 0.11 -1.26 0.13 120.40 128.83 2rov s VAL 49 Ca -0.06 0.06 0.09 0.00 -2.93 0.00 0.00 61.98 59.14 2rov s VAL 49 Cb -0.01 -0.14 -0.04 0.00 -1.53 0.00 0.00 36.38 34.66 2rov s VAL 49 CO 0.05 0.02 -0.19 -0.76 -3.33 0.00 0.00 175.10 170.90 2rov s LEU 50 N 0.37 2.46 -0.37 2.54 1.02 0.94 -4.97 118.68 120.68 2rov s LEU 50 Ca -0.03 -0.89 -0.19 0.00 0.02 0.00 0.00 54.13 53.04 2rov s LEU 50 Cb -0.04 -0.89 0.00 0.00 0.02 0.00 0.00 46.19 45.28 2rov s LEU 50 CO -0.01 -0.02 0.55 -1.81 0.02 0.00 0.00 176.35 175.07 2rov s ASP 51 N -2.79 6.33 0.54 2.29 1.01 -1.26 0.06 116.67 122.84 2rov s ASP 51 Ca 0.18 -0.07 0.25 0.00 0.71 0.00 0.00 52.55 53.62 2rov s ASP 51 Cb -0.06 -2.28 1.41 0.00 1.01 0.00 0.00 42.92 43.00 2rov s ASP 51 CO 0.08 -0.54 2.00 0.40 0.21 0.00 0.00 175.17 177.32 2rov h ILE 52 N 5.66 0.71 0.00 0.77 2.04 -1.90 0.27 117.51 125.06 2rov h ILE 52 Ca -0.27 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.47 2rov h ILE 52 Cb 1.12 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2rov h ILE 52 CO 0.80 0.00 -0.58 -0.78 0.00 0.00 0.00 178.15 177.59 2rov h ASP 53 N 0.00 0.00 1.23 1.72 3.58 -1.92 -3.04 116.42 118.00 2rov h ASP 53 Ca 0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2rov h ASP 53 Cb 0.96 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.01 2rov h ASP 53 CO -0.00 0.58 0.00 0.11 -2.88 0.00 0.00 179.24 177.05 2rov h LYS 54 N 0.00 0.00 -6.83 0.28 1.57 -0.87 -3.46 116.57 107.26 2rov h LYS 54 Ca -0.01 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 2rov h LYS 54 Cb 1.25 0.00 0.19 0.00 0.08 0.00 0.00 32.23 33.75 2rov h LYS 54 CO 0.08 0.00 -0.23 1.28 -0.57 0.00 0.00 179.45 180.00 2rov n LEU 55 N -2.33 1.63 -0.02 2.94 4.77 -1.06 -2.67 117.00 120.27 2rov n LEU 55 Ca 0.04 0.54 -0.03 0.00 -0.03 0.00 0.00 56.01 56.53 2rov n LEU 55 Cb 0.36 -1.30 -0.02 0.00 -2.33 0.00 0.00 43.42 40.14 2rov n LEU 55 CO 0.27 -2.82 -0.61 0.49 -1.33 0.00 0.00 177.39 173.38 2rov n PHE 56 N -2.86 0.00 -3.65 -1.77 3.72 -0.24 -4.85 117.46 107.82 2rov n PHE 56 Ca 0.10 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.49 2rov n PHE 56 Cb 0.51 -0.13 -0.07 0.00 -0.94 0.00 0.00 39.48 38.85 2rov n PHE 56 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2rov s HIS 57 N -2.07 -0.12 -0.20 1.38 2.46 -1.24 -5.04 115.29 110.46 2rov s HIS 57 Ca -0.05 0.26 -0.01 0.00 0.47 0.00 0.00 55.06 55.73 2rov s HIS 57 Cb 0.01 0.29 0.01 0.00 -0.13 0.00 0.00 32.58 32.76 2rov s HIS 57 CO 0.08 -0.06 -0.13 0.08 -2.47 0.00 0.00 174.74 172.24 2rov s VAL 58 N 0.53 2.59 0.04 0.89 1.01 -1.26 -2.17 120.40 122.03 2rov s VAL 58 Ca -0.00 -0.81 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 2rov s VAL 58 Cb -0.04 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 2rov s VAL 58 CO -0.13 0.45 0.11 -0.13 0.00 0.00 0.00 175.10 175.41 2rov s ARG 59 N 1.35 0.60 0.99 2.72 1.81 -0.70 -5.01 118.95 120.71 2rov s ARG 59 Ca 0.04 -0.72 -0.12 0.00 -1.72 0.00 0.00 55.73 53.22 2rov s ARG 59 Cb -0.14 0.24 0.18 0.00 -0.45 0.00 0.00 34.95 34.78 2rov s ARG 59 CO -0.09 -0.15 1.08 -1.25 -0.68 0.00 0.00 175.30 174.21 2rov s PRO 60 N -2.55 0.51 0.52 3.54 0.04 -1.26 -0.90 135.00 134.91 2rov s PRO 60 Ca -0.05 0.81 0.07 0.00 0.04 0.00 0.00 61.00 61.87 2rov s PRO 60 Cb -0.01 -1.72 0.04 0.00 0.04 0.00 0.00 34.50 32.84 2rov s PRO 60 CO -0.04 -2.75 0.49 0.14 0.04 0.00 0.00 177.00 174.88 2rov s VAL 61 N -2.81 1.98 0.24 -0.36 -7.23 -0.92 -4.67 120.40 106.63 2rov s VAL 61 Ca 0.65 -1.35 0.02 0.00 -1.81 0.00 0.00 61.98 59.50 2rov s VAL 61 Cb -0.20 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.40 2rov s VAL 61 CO 0.59 0.00 0.08 0.35 -0.31 0.00 0.00 175.10 175.81 2rov n THR 62 N -1.83 0.00 0.27 5.32 -2.24 -1.26 -4.69 114.28 109.85 2rov n THR 62 Ca 0.03 -1.36 0.16 0.00 -2.27 0.00 0.00 64.05 60.61 2rov n THR 62 Cb 0.63 0.47 0.79 0.00 -2.10 0.00 0.00 70.33 70.13 2rov n THR 62 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2rov h GLN 63 N 0.00 0.00 0.00 -0.78 5.75 -1.93 -1.09 115.11 117.06 2rov h GLN 63 Ca -0.19 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.26 2rov h GLN 63 Cb 0.70 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.24 2rov h GLN 63 CO 0.30 0.00 -0.26 1.79 -2.65 0.00 0.00 178.83 178.00 2rov h THR 64 N 0.00 0.48 0.00 2.39 1.35 -2.02 -3.19 112.91 111.92 2rov h THR 64 Ca 0.00 -1.54 -0.07 0.00 -0.55 0.00 0.00 66.41 64.25 2rov h THR 64 Cb 0.12 2.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 2rov h THR 64 CO 0.00 0.26 -0.34 -0.78 -0.25 0.00 0.00 175.52 174.41 2rov h ASP 65 N 0.00 0.00 -4.66 5.36 1.82 -1.59 -3.45 116.42 113.90 2rov h ASP 65 Ca -0.00 0.00 -0.44 0.00 -0.39 0.00 0.00 57.03 56.19 2rov h ASP 65 Cb 1.10 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 41.00 2rov h ASP 65 CO 0.03 0.34 -0.44 1.33 -1.61 0.00 0.00 179.24 178.90 2rov n VAL 66 N -4.00 0.00 0.00 2.25 0.24 -1.20 -5.06 118.33 110.56 2rov n VAL 66 Ca -0.02 -2.27 0.00 0.00 -2.04 0.00 0.00 64.34 60.01 2rov n VAL 66 Cb 0.40 1.13 0.00 0.00 -1.47 0.00 0.00 33.84 33.90 2rov n VAL 66 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2rov n TYR 67 N -0.59 -0.11 0.20 6.34 4.11 -1.26 -4.84 117.16 121.01 2rov n TYR 67 Ca 0.07 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 58.04 2rov n TYR 67 Cb 0.56 0.40 0.37 0.00 -0.00 0.00 0.00 39.34 40.67 2rov n TYR 67 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.86 176.93 2rov h ARG 68 N 0.00 0.00 0.00 -3.48 -0.00 -1.96 -3.45 114.38 105.49 2rov h ARG 68 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.97 2rov h ARG 68 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 29.98 2rov h ARG 68 CO 0.00 0.34 -0.01 0.00 -0.00 0.00 0.00 179.97 180.30 2rov n ALA 69 N -2.29 -0.21 -2.42 0.08 0.00 -1.26 -5.03 120.51 109.38 2rov n ALA 69 Ca -0.00 -0.06 -0.27 0.00 0.00 0.00 0.00 53.44 53.10 2rov n ALA 69 Cb 0.48 -0.01 -0.15 0.00 0.00 0.00 0.00 19.45 19.77 2rov n ALA 69 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2rov s ASP 70 N -1.84 2.53 0.57 0.00 2.15 -1.26 -5.01 116.67 113.80 2rov s ASP 70 Ca 0.03 -0.42 0.32 0.00 0.43 0.00 0.00 52.55 52.91 2rov s ASP 70 Cb -0.00 -0.27 1.45 0.00 -0.30 0.00 0.00 42.92 43.79 2rov s ASP 70 CO 0.02 0.24 1.79 0.00 -0.17 0.00 0.00 175.17 177.06 2rov h ALA 71 N 5.44 2.73 0.00 3.66 0.00 -1.96 0.78 119.26 129.91 2rov h ALA 71 Ca -0.40 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.29 2rov h ALA 71 Cb 1.14 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2rov h ALA 71 CO 0.47 -1.18 -0.90 0.87 0.00 0.00 0.00 179.25 178.50 2rov h LYS 72 N 0.00 0.01 0.03 0.00 1.57 -2.03 -3.26 116.57 112.90 2rov h LYS 72 Ca 0.41 -0.02 -0.22 0.00 -1.87 0.00 0.00 60.65 58.95 2rov h LYS 72 Cb 1.88 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 34.18 2rov h LYS 72 CO -0.00 0.90 -1.04 0.93 -0.57 0.00 0.00 179.45 179.67 2rov h GLU 73 N 0.01 0.07 -0.35 3.15 4.39 0.11 -3.35 114.58 118.60 2rov h GLU 73 Ca -0.01 -0.12 0.08 0.00 0.34 0.00 0.00 59.36 59.65 2rov h GLU 73 Cb 1.59 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 30.19 2rov h GLU 73 CO 0.12 1.04 -0.26 0.82 -1.16 0.00 0.00 179.01 179.56 2rov h ILE 74 N 0.02 0.33 0.00 3.13 1.08 -1.22 0.12 117.51 120.96 2rov h ILE 74 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 2rov h ILE 74 Cb 1.79 0.33 0.00 0.00 -3.07 0.00 0.00 36.82 35.86 2rov h ILE 74 CO 0.15 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.80 2rov n PRO 75 N -5.40 0.14 -0.15 2.37 -0.04 -1.25 -1.64 135.00 129.03 2rov n PRO 75 Ca 0.01 0.48 0.12 0.00 -0.04 0.00 0.00 63.50 64.07 2rov n PRO 75 Cb 0.31 -1.83 0.21 0.00 -0.04 0.00 0.00 33.50 32.15 2rov n PRO 75 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2rov n ARG 76 N -2.11 2.43 -4.68 0.54 1.74 0.35 -4.75 116.66 110.19 2rov n ARG 76 Ca 0.01 -2.14 -0.33 0.00 -0.77 0.00 0.00 57.85 54.61 2rov n ARG 76 Cb 0.14 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 29.96 2rov n ARG 76 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2rov s ILE 77 N -1.62 3.46 0.11 0.55 1.01 -0.65 0.59 121.20 124.65 2rov s ILE 77 Ca 0.36 -0.55 0.05 0.00 0.00 0.00 0.00 60.65 60.52 2rov s ILE 77 Cb 0.22 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 2rov s ILE 77 CO 0.31 0.56 -0.13 0.72 0.00 0.00 0.00 174.94 176.40 2rov s PHE 78 N -0.34 1.31 0.01 3.97 -0.71 -0.81 -2.16 117.98 119.24 2rov s PHE 78 Ca 0.04 -0.55 0.07 0.00 -1.04 0.00 0.00 56.93 55.46 2rov s PHE 78 Cb -0.13 -0.70 -0.03 0.00 -1.21 0.00 0.00 43.02 40.96 2rov s PHE 78 CO 0.02 0.10 -0.22 -1.14 -1.34 0.00 0.00 175.22 172.65 2rov s GLN 79 N -2.47 2.08 -0.18 1.99 0.74 -0.08 -1.38 119.66 120.37 2rov s GLN 79 Ca 0.06 -0.96 -0.00 0.00 0.05 0.00 0.00 55.36 54.51 2rov s GLN 79 Cb -0.06 -2.12 0.04 0.00 1.10 0.00 0.00 33.01 31.97 2rov s GLN 79 CO 0.02 0.55 -0.07 0.42 -0.55 0.00 0.00 175.29 175.67 2rov s ILE 80 N -0.77 1.27 0.02 -2.34 1.01 -0.66 -1.72 121.20 118.00 2rov s ILE 80 Ca 0.12 -0.75 -0.18 0.00 0.00 0.00 0.00 60.65 59.84 2rov s ILE 80 Cb -0.10 -1.42 -0.06 0.00 0.01 0.00 0.00 42.46 40.89 2rov s ILE 80 CO 0.02 0.14 0.53 -0.22 0.00 0.00 0.00 174.94 175.40 2rov s LEU 81 N 1.56 4.47 -0.03 2.97 2.96 -0.92 -0.73 118.68 128.95 2rov s LEU 81 Ca 0.00 1.12 -0.09 0.00 -0.22 0.00 0.00 54.13 54.94 2rov s LEU 81 Cb -0.16 -2.81 0.01 0.00 0.50 0.00 0.00 46.19 43.74 2rov s LEU 81 CO -0.08 0.22 0.21 -0.72 -1.32 0.00 0.00 176.35 174.66 2rov s TYR 82 N -0.73 -0.11 -0.17 5.38 -0.85 0.09 -1.08 117.35 119.87 2rov s TYR 82 Ca 0.28 0.23 -0.29 0.00 -0.52 0.00 0.00 57.07 56.76 2rov s TYR 82 Cb -0.18 0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.18 2rov s TYR 82 CO 0.16 -0.25 1.31 0.00 -1.52 0.00 0.00 175.55 175.25 2rov s ALA 83 N -0.83 3.62 -0.18 9.51 0.00 -1.09 -1.87 121.76 130.93 2rov s ALA 83 Ca -0.09 0.46 -0.08 0.00 0.00 0.00 0.00 51.96 52.25 2rov s ALA 83 Cb -0.05 -3.65 -0.22 0.00 0.00 0.00 0.00 23.12 19.20 2rov s ALA 83 CO 0.02 -1.28 0.14 0.27 0.00 0.00 0.00 175.76 174.91 2rov n ASN 84 N 6.81 2.03 0.00 0.00 0.23 -1.26 -4.83 115.26 118.24 2rov n ASN 84 Ca 0.14 0.18 0.00 0.00 -0.53 0.00 0.00 54.58 54.37 2rov n ASN 84 Cb 0.45 -0.78 0.00 0.00 -2.08 0.00 0.00 39.78 37.37 2rov n ASN 84 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2rov n GLU 85 N -3.67 0.00 0.00 -3.83 -0.58 -1.26 -5.06 120.64 106.24 2rov n GLU 85 Ca -0.37 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.37 2rov n GLU 85 Cb 0.96 -0.64 0.00 0.00 -0.57 0.00 0.00 31.44 31.19 2rov n GLU 85 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2rov n GLY 86 N 2.72 1.60 1.86 0.62 0.00 -1.26 -5.08 105.19 105.65 2rov n GLY 86 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2rov n GLY 86 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2rov n ILE 87 N 0.00 0.06 0.01 -0.61 -0.00 -1.26 -4.74 119.36 112.82 2rov n ILE 87 Ca 0.00 0.02 0.10 0.00 -0.00 0.00 0.00 62.75 62.87 2rov n ILE 87 Cb 0.00 -0.31 0.52 0.00 -0.00 0.00 0.00 39.64 39.84 2rov n ILE 87 CO 0.00 0.00 0.00 -1.28 -0.00 0.00 0.00 176.55 175.27 2rov h SER 88 N 0.00 0.31 1.51 4.38 0.87 -2.00 0.52 113.55 119.13 2rov h SER 88 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2rov h SER 88 Cb 0.00 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 61.89 2rov h SER 88 CO 0.00 0.20 -0.03 0.28 -0.53 0.00 0.00 176.83 176.75 2rov h SER 89 N 0.35 0.00 -0.76 6.23 0.02 -1.97 -3.46 113.55 113.96 2rov h SER 89 Ca 0.19 0.00 -0.84 0.00 -0.84 0.00 0.00 61.79 60.30 2rov h SER 89 Cb 0.31 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 2rov h SER 89 CO -0.04 0.03 0.89 0.00 -1.14 0.00 0.00 176.83 176.56 2rov n ALA 90 N -2.11 -0.80 -2.18 3.77 0.00 0.17 -4.70 120.51 114.66 2rov n ALA 90 Ca 0.02 0.40 -0.19 0.00 0.00 0.00 0.00 53.44 53.67 2rov n ALA 90 Cb 0.44 -2.00 0.14 0.00 0.00 0.00 0.00 19.45 18.03 2rov n ALA 90 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2rov n LYS 91 N 5.13 -0.54 -4.30 0.00 4.76 -0.78 -4.73 118.16 117.71 2rov n LYS 91 Ca 0.37 -2.04 -0.16 0.00 -2.87 0.00 0.00 58.31 53.62 2rov n LYS 91 Cb -0.04 -0.85 -0.10 0.00 -1.84 0.00 0.00 35.03 32.20 2rov n LYS 91 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2rov s ASN 92 N -4.78 1.29 -0.11 4.39 6.03 -1.26 -0.74 114.94 119.77 2rov s ASN 92 Ca 0.60 -1.31 -0.01 0.00 -1.03 0.00 0.00 52.86 51.11 2rov s ASN 92 Cb -0.02 0.13 0.03 0.00 -3.03 0.00 0.00 41.25 38.35 2rov s ASN 92 CO 0.41 -0.66 -0.06 -0.22 -2.03 0.00 0.00 177.10 174.53 2rov s LEU 93 N -3.28 1.13 -0.24 3.54 0.20 0.09 -4.91 118.68 115.22 2rov s LEU 93 Ca 0.33 -0.30 -0.16 0.00 0.69 0.00 0.00 54.13 54.69 2rov s LEU 93 Cb 0.07 -0.80 -0.04 0.00 -0.43 0.00 0.00 46.19 45.00 2rov s LEU 93 CO 0.11 -0.13 0.42 -0.76 -0.29 0.00 0.00 176.35 175.69 2rov s LEU 94 N 1.74 4.09 -0.16 -0.68 2.01 -1.26 -1.66 118.68 122.76 2rov s LEU 94 Ca 0.05 0.45 0.00 0.00 0.01 0.00 0.00 54.13 54.64 2rov s LEU 94 Cb -0.13 -2.52 0.03 0.00 0.01 0.00 0.00 46.19 43.58 2rov s LEU 94 CO -0.08 -0.16 -0.12 -0.76 1.01 0.00 0.00 176.35 176.24 2rov s LEU 95 N 1.79 1.80 -0.15 1.79 1.43 -0.48 -4.43 118.68 120.43 2rov s LEU 95 Ca 0.18 -0.60 -0.21 0.00 -1.03 0.00 0.00 54.13 52.47 2rov s LEU 95 Cb -0.15 -1.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 2rov s LEU 95 CO 0.09 -0.10 0.64 -0.22 0.23 0.00 0.00 176.35 176.99 2rov s LEU 96 N 1.49 4.21 -0.12 1.79 2.96 0.14 -1.93 118.68 127.22 2rov s LEU 96 Ca 0.03 0.94 -0.07 0.00 -0.22 0.00 0.00 54.13 54.80 2rov s LEU 96 Cb -0.14 -2.93 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 2rov s LEU 96 CO -0.10 -0.20 0.14 0.00 -1.32 0.00 0.00 176.35 174.87 2rov s ALA 97 N 1.47 3.86 0.59 5.97 0.00 0.20 -0.89 121.76 132.95 2rov s ALA 97 Ca 0.31 -0.65 0.29 0.00 0.00 0.00 0.00 51.96 51.91 2rov s ALA 97 Cb -0.16 -1.96 1.71 0.00 0.00 0.00 0.00 23.12 22.70 2rov s ALA 97 CO 0.12 0.60 2.16 -2.95 0.00 0.00 0.00 175.76 175.70 2rov h ASN 98 N 5.04 0.00 -4.82 0.00 7.08 -1.87 -3.42 115.58 117.59 2rov h ASN 98 Ca -0.54 0.00 -0.21 0.00 -3.08 0.00 0.00 56.30 52.47 2rov h ASN 98 Cb 1.23 0.00 -0.22 0.00 -2.08 0.00 0.00 38.32 37.25 2rov h ASN 98 CO 0.58 0.00 -0.71 -0.44 -2.08 0.00 0.00 177.43 174.78 2rov s SER 99 N -5.99 0.42 0.19 6.14 0.01 -1.26 -5.05 113.70 108.15 2rov s SER 99 Ca -0.05 -0.48 -0.12 0.00 1.31 0.00 0.00 55.95 56.61 2rov s SER 99 Cb 0.15 0.07 0.15 0.00 0.21 0.00 0.00 66.02 66.60 2rov s SER 99 CO 0.55 -0.25 1.80 0.74 0.41 0.00 0.00 173.24 176.50 2rov h THR 100 N 4.64 1.00 -0.91 1.44 2.02 -1.85 -1.81 112.91 117.43 2rov h THR 100 Ca -0.33 -0.20 0.16 0.00 0.77 0.00 0.00 66.41 66.81 2rov h THR 100 Cb 1.21 0.36 -0.07 0.00 -1.74 0.00 0.00 68.15 67.90 2rov h THR 100 CO 0.42 0.11 0.59 -0.33 0.37 0.00 0.00 175.52 176.67 2rov h GLU 101 N 0.59 0.65 -0.77 6.66 5.08 -1.97 -0.26 114.58 124.56 2rov h GLU 101 Ca 0.24 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2rov h GLU 101 Cb 0.10 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 2rov h GLU 101 CO -0.14 0.43 0.45 1.49 -1.00 0.00 0.00 179.01 180.24 2rov h GLU 102 N 0.67 1.05 -0.37 2.33 4.57 -1.73 -1.48 114.58 119.62 2rov h GLU 102 Ca 0.47 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 58.49 2rov h GLU 102 Cb 0.80 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.16 2rov h GLU 102 CO -0.23 0.75 -0.00 0.37 -1.18 0.00 0.00 179.01 178.73 2rov h GLN 103 N 1.05 0.58 -0.32 1.92 -0.00 -0.97 0.23 115.11 117.61 2rov h GLN 103 Ca 0.27 -0.13 -0.12 0.00 -0.00 0.00 0.00 58.65 58.68 2rov h GLN 103 Cb -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.37 2rov h GLN 103 CO -0.05 0.61 -0.26 1.96 0.00 0.00 0.00 178.83 181.09 2rov h GLN 104 N 0.56 0.74 -0.03 1.69 1.08 -0.93 -1.95 115.11 116.26 2rov h GLN 104 Ca 0.12 -0.37 -0.03 0.00 -1.45 0.00 0.00 58.65 56.92 2rov h GLN 104 Cb 0.36 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2rov h GLN 104 CO 0.01 0.99 -0.11 -0.22 -0.95 0.00 0.00 178.83 178.55 2rov h LYS 105 N 0.51 0.13 -0.07 1.46 3.64 -1.03 -1.36 116.57 119.86 2rov h LYS 105 Ca 0.06 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2rov h LYS 105 Cb 0.82 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.63 2rov h LYS 105 CO 0.07 0.73 -0.11 -1.49 -2.27 0.00 0.00 179.45 176.38 2rov h TRP 106 N -0.44 -0.28 0.01 1.91 4.06 -0.61 0.45 115.95 121.06 2rov h TRP 106 Ca -0.00 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.96 2rov h TRP 106 Cb 0.75 0.13 0.00 0.00 -1.00 0.00 0.00 29.16 29.04 2rov h TRP 106 CO 0.14 -0.17 -0.01 0.28 -3.56 0.00 0.00 178.44 175.13 2rov h VAL 107 N -0.15 1.21 -0.56 1.49 2.07 -1.45 0.75 116.25 119.62 2rov h VAL 107 Ca 0.06 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 2rov h VAL 107 Cb 0.24 1.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 2rov h VAL 107 CO -0.16 0.17 0.24 0.28 0.02 0.00 0.00 177.57 178.13 2rov h SER 108 N -0.31 0.71 0.10 0.57 0.02 -1.13 0.10 113.55 113.62 2rov h SER 108 Ca -0.00 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2rov h SER 108 Cb 0.30 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2rov h SER 108 CO 0.00 0.63 -0.05 0.03 -1.14 0.00 0.00 176.83 176.30 2rov h ARG 109 N 0.79 -0.13 -0.85 3.45 2.47 -0.04 -1.66 114.38 118.41 2rov h ARG 109 Ca 0.19 0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.93 2rov h ARG 109 Cb 0.12 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.43 2rov h ARG 109 CO -0.02 0.38 0.56 1.37 0.56 0.00 0.00 179.97 182.82 2rov h LEU 110 N -0.89 0.97 -0.24 3.04 8.10 -0.82 -1.55 115.31 123.92 2rov h LEU 110 Ca -0.01 -0.02 -0.15 0.00 0.11 0.00 0.00 57.88 57.80 2rov h LEU 110 Cb 0.56 -0.24 0.00 0.00 -0.44 0.00 0.00 40.66 40.54 2rov h LEU 110 CO 0.02 0.70 -0.45 1.62 -4.11 0.00 0.00 178.44 176.22 2rov h VAL 111 N 1.14 1.30 0.00 0.15 3.04 -0.88 -2.98 116.25 118.02 2rov h VAL 111 Ca 0.31 -1.65 -0.01 0.00 -1.01 0.00 0.00 66.70 64.34 2rov h VAL 111 Cb -0.12 1.75 -0.00 0.00 -2.01 0.00 0.00 31.29 30.91 2rov h VAL 111 CO -0.07 0.53 -0.06 0.11 -1.01 0.00 0.00 177.57 177.07 2rov h LYS 112 N 0.45 0.00 0.00 4.17 1.57 -0.87 -0.14 116.57 121.75 2rov h LYS 112 Ca 0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2rov h LYS 112 Cb 1.05 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.36 2rov h LYS 112 CO 0.10 0.06 -0.00 0.87 -0.57 0.00 0.00 179.45 179.90 2rov h LYS 113 N 0.00 0.00 -6.90 3.15 1.79 -1.14 -3.45 116.57 110.02 2rov h LYS 113 Ca -0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 2rov h LYS 113 Cb 0.11 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 30.84 2rov h LYS 113 CO 0.01 0.00 0.71 0.42 -1.08 0.00 0.00 179.45 179.51 2rov s ILE 114 N -3.52 2.44 0.00 1.86 1.01 -0.07 -4.91 121.20 118.01 2rov s ILE 114 Ca 0.03 0.44 -0.25 0.00 0.00 0.00 0.00 60.65 60.87 2rov s ILE 114 Cb 0.08 -3.28 -0.18 0.00 0.01 0.00 0.00 42.46 39.09 2rov s ILE 114 CO 0.59 0.10 1.31 -0.65 0.00 0.00 0.00 174.94 176.29 2rov h PRO 115 N 3.37 -0.12 -2.16 2.79 0.11 -1.87 -3.24 132.00 130.87 2rov h PRO 115 Ca -0.49 0.01 -0.49 0.00 0.11 0.00 0.00 66.00 65.13 2rov h PRO 115 Cb 1.23 0.03 -0.14 0.00 0.11 0.00 0.00 31.00 32.23 2rov h PRO 115 CO 0.66 0.25 0.78 0.36 -0.21 0.00 0.00 178.00 179.84 2rov n LYS 116 N -4.97 2.79 0.00 1.05 2.85 -1.26 -5.18 118.16 113.44 2rov n LYS 116 Ca -0.08 -2.28 0.04 0.00 -1.05 0.00 0.00 58.31 54.94 2rov n LYS 116 Cb 0.22 -2.24 0.27 0.00 -0.65 0.00 0.00 35.03 32.63 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52