#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 0.47 -1.43 1.43 0.00 -1.26 -5.10 116.66 110.78 2rov n ARG 2 Ca 0.00 -1.05 -0.56 0.00 -0.00 0.00 0.00 57.85 56.24 2rov n ARG 2 Cb 0.00 1.24 -0.09 0.00 -0.00 0.00 0.00 32.46 33.61 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 1.60 -3.65 2.89 7.94 -1.25 -4.83 117.00 119.70 2rov n LEU 3 Ca -0.03 0.65 -0.10 0.00 -1.11 0.00 0.00 56.01 55.41 2rov n LEU 3 Cb 0.27 -1.09 -0.04 0.00 0.53 0.00 0.00 43.42 43.09 2rov n LEU 3 CO 0.13 -0.71 0.24 -1.83 -1.11 0.00 0.00 177.39 174.10 2rov s GLU 4 N 5.59 1.22 0.00 1.96 -1.05 -1.26 0.81 118.70 125.97 2rov s GLU 4 Ca 1.12 -0.74 0.00 0.00 -0.15 0.00 0.00 54.97 55.20 2rov s GLU 4 Cb -1.16 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 33.03 2rov s GLU 4 CO 0.60 -0.50 0.00 0.41 0.95 0.00 0.00 175.26 176.71 2rov n GLY 5 N -0.29 0.19 3.19 -3.83 0.00 0.14 -4.97 105.19 99.62 2rov n GLY 5 Ca -0.14 -1.34 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 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 -3.51 2.75 0.09 1.61 0.52 -1.26 0.33 118.94 119.48 2rov s TRP 6 Ca 0.00 -1.31 0.10 0.00 0.02 0.00 0.00 56.10 54.91 2rov s TRP 6 Cb 0.00 -1.89 -0.03 0.00 -1.15 0.00 0.00 33.47 30.40 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 0.99 2.26 0.12 2.99 1.43 -0.77 -4.77 118.68 120.92 2rov s LEU 7 Ca -0.02 -0.68 -0.15 0.00 -1.03 0.00 0.00 54.13 52.25 2rov s LEU 7 Cb -0.15 -1.22 -0.07 0.00 0.03 0.00 0.00 46.19 44.78 2rov s LEU 7 CO -0.04 0.20 0.54 -0.44 0.23 0.00 0.00 176.35 176.84 2rov s SER 8 N -1.71 6.85 0.14 2.29 0.01 0.20 0.63 113.70 122.12 2rov s SER 8 Ca 0.13 1.09 0.07 0.00 1.31 0.00 0.00 55.95 58.54 2rov s SER 8 Cb -0.10 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.80 2rov s SER 8 CO 0.04 0.14 -0.15 -0.76 0.41 0.00 0.00 173.24 172.92 2rov s LEU 9 N -1.78 2.42 -0.57 2.44 1.02 -0.98 0.44 118.68 121.67 2rov s LEU 9 Ca 0.35 -0.84 -0.26 0.00 0.02 0.00 0.00 54.13 53.41 2rov s LEU 9 Cb -0.16 -0.64 -0.06 0.00 0.02 0.00 0.00 46.19 45.34 2rov s LEU 9 CO 0.19 -0.11 2.26 -2.16 0.02 0.00 0.00 176.35 176.55 2rov s PRO 10 N -2.76 2.18 0.81 1.29 0.04 -1.26 -2.85 135.00 132.45 2rov s PRO 10 Ca 0.12 1.03 -0.09 0.00 0.04 0.00 0.00 61.00 62.10 2rov s PRO 10 Cb -0.05 -4.59 0.13 0.00 0.04 0.00 0.00 34.50 30.04 2rov s PRO 10 CO 0.04 -3.30 1.14 0.54 0.04 0.00 0.00 177.00 175.45 2rov s VAL 11 N 11.71 2.12 -0.47 -0.36 0.11 -1.15 -4.90 120.40 127.46 2rov s VAL 11 Ca 0.88 -0.25 0.03 0.00 -2.93 0.00 0.00 61.98 59.72 2rov s VAL 11 Cb -0.15 -2.87 0.13 0.00 -1.53 0.00 0.00 36.38 31.96 2rov s VAL 11 CO 0.21 0.00 0.25 -0.13 -3.33 0.00 0.00 175.10 172.10 2rov s ARG 12 N -5.48 1.55 0.00 1.54 0.52 -1.26 -2.98 118.95 112.84 2rov s ARG 12 Ca 0.67 -2.24 0.00 0.00 -0.52 0.00 0.00 55.73 53.64 2rov s ARG 12 Cb -0.07 -2.70 0.00 0.00 0.52 0.00 0.00 34.95 32.70 2rov s ARG 12 CO 0.48 -1.14 0.59 0.09 0.02 0.00 0.00 175.30 175.33 2rov n ASN 13 N 3.37 0.00 -2.60 0.23 3.02 -1.17 -3.83 115.26 114.28 2rov n ASN 13 Ca 0.07 0.59 -0.27 0.00 -0.03 0.00 0.00 54.58 54.95 2rov n ASN 13 Cb 0.34 -0.09 -0.01 0.00 -0.61 0.00 0.00 39.78 39.41 2rov n ASN 13 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2rov n ASN 14 N -1.21 4.55 -1.93 6.41 2.04 -1.26 -4.90 115.26 118.96 2rov n ASN 14 Ca 0.00 -3.68 -0.12 0.00 -0.44 0.00 0.00 54.58 50.33 2rov n ASN 14 Cb 0.00 -0.49 -0.03 0.00 -2.53 0.00 0.00 39.78 36.74 2rov n ASN 14 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 2rov n THR 15 N -0.41 -0.31 0.06 5.53 -2.24 -1.25 -4.63 114.28 111.03 2rov n THR 15 Ca 0.36 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.14 2rov n THR 15 Cb 0.60 -1.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.36 2rov n THR 15 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2rov n LYS 16 N -2.34 0.00 -2.14 -0.78 5.02 -1.26 -5.13 118.16 111.54 2rov n LYS 16 Ca -0.13 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 55.91 2rov n LYS 16 Cb 0.51 -0.03 0.15 0.00 -0.02 0.00 0.00 35.03 35.64 2rov n LYS 16 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2rov n LYS 17 N -2.94 -0.59 -3.66 1.97 4.76 -1.26 -4.99 118.16 111.44 2rov n LYS 17 Ca 0.00 -2.27 -0.13 0.00 -2.87 0.00 0.00 58.31 53.04 2rov n LYS 17 Cb 0.00 -0.93 -0.13 0.00 -1.84 0.00 0.00 35.03 32.14 2rov n LYS 17 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2rov s PHE 18 N -3.27 -0.45 0.00 2.13 0.40 -1.26 -3.05 117.98 112.48 2rov s PHE 18 Ca 0.66 1.01 0.00 0.00 -0.60 0.00 0.00 56.93 58.00 2rov s PHE 18 Cb -0.03 -0.01 0.00 0.00 0.51 0.00 0.00 43.02 43.49 2rov s PHE 18 CO 0.45 -0.36 0.00 0.41 0.70 0.00 0.00 175.22 176.42 2rov n GLY 19 N 5.35 1.84 2.93 4.36 0.00 -1.16 -4.78 105.19 113.73 2rov n GLY 19 Ca -0.06 -1.45 -0.12 0.00 0.00 0.00 0.00 46.02 44.39 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 4.78 -0.07 -0.16 1.61 0.52 -1.26 -2.94 118.94 121.43 2rov s TRP 20 Ca 0.00 0.18 -0.04 0.00 0.02 0.00 0.00 56.10 56.26 2rov s TRP 20 Cb 0.00 0.01 0.06 0.00 -1.15 0.00 0.00 33.47 32.38 2rov s TRP 20 CO 0.00 -0.04 0.07 0.54 0.02 0.00 0.00 176.95 177.54 2rov s VAL 21 N 0.13 0.08 -0.39 4.03 0.11 -1.13 -4.88 120.40 118.34 2rov s VAL 21 Ca -0.01 -0.19 -0.29 0.00 -2.93 0.00 0.00 61.98 58.57 2rov s VAL 21 Cb -0.01 -0.64 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 2rov s VAL 21 CO -0.00 -0.19 1.51 -1.59 -3.33 0.00 0.00 175.10 171.50 2rov s LYS 22 N 2.07 3.51 -0.07 1.54 -2.85 -1.24 -2.33 119.74 120.36 2rov s LYS 22 Ca 0.02 1.05 -0.04 0.00 -1.00 0.00 0.00 55.97 56.00 2rov s LYS 22 Cb -0.16 -4.07 -0.04 0.00 -2.06 0.00 0.00 37.83 31.50 2rov s LYS 22 CO -0.08 -1.65 0.11 0.15 0.10 0.00 0.00 175.35 173.98 2rov s LYS 23 N 5.14 3.29 -0.40 1.78 -0.14 0.21 -4.67 119.74 124.94 2rov s LYS 23 Ca 0.66 -0.28 -0.27 0.00 -1.36 0.00 0.00 55.97 54.72 2rov s LYS 23 Cb -0.16 -3.04 -0.05 0.00 -1.68 0.00 0.00 37.83 32.90 2rov s LYS 23 CO 0.33 0.72 2.15 -0.47 -0.76 0.00 0.00 175.35 177.32 2rov s TYR 24 N -1.09 1.33 -0.12 3.18 6.14 -1.05 -1.85 117.35 123.89 2rov s TYR 24 Ca 0.18 0.97 -0.03 0.00 0.64 0.00 0.00 57.07 58.83 2rov s TYR 24 Cb -0.12 -3.86 -0.03 0.00 0.42 0.00 0.00 41.96 38.36 2rov s TYR 24 CO 0.08 -3.01 0.00 0.08 0.64 0.00 0.00 175.55 173.34 2rov s VAL 25 N 9.61 4.29 -0.11 3.14 1.01 0.15 -0.23 120.40 138.27 2rov s VAL 25 Ca 0.90 -0.24 -0.04 0.00 0.00 0.00 0.00 61.98 62.61 2rov s VAL 25 Cb -0.22 -2.85 0.05 0.00 0.00 0.00 0.00 36.38 33.36 2rov s VAL 25 CO 0.29 0.55 0.08 -0.63 0.00 0.00 0.00 175.10 175.39 2rov s ILE 26 N -0.33 -0.09 -0.58 2.22 1.01 -0.06 -0.68 121.20 122.69 2rov s ILE 26 Ca 0.07 0.10 -0.24 0.00 0.00 0.00 0.00 60.65 60.58 2rov s ILE 26 Cb -0.12 -0.39 0.05 0.00 0.01 0.00 0.00 42.46 42.01 2rov s ILE 26 CO 0.02 -0.07 0.96 -0.69 0.00 0.00 0.00 174.94 175.16 2rov s VAL 27 N 2.15 4.35 0.51 2.92 1.01 0.24 0.05 120.40 131.62 2rov s VAL 27 Ca 0.03 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.18 2rov s VAL 27 Cb -0.14 -4.58 0.02 0.00 0.00 0.00 0.00 36.38 31.67 2rov s VAL 27 CO -0.06 -1.22 0.74 -0.55 0.00 0.00 0.00 175.10 174.01 2rov s SER 28 N 3.05 5.49 -0.19 3.32 0.15 0.36 -3.95 113.70 121.92 2rov s SER 28 Ca 0.29 0.13 -0.39 0.00 0.70 0.00 0.00 55.95 56.68 2rov s SER 28 Cb -0.13 -1.15 -0.15 0.00 -1.71 0.00 0.00 66.02 62.87 2rov s SER 28 CO 0.17 -0.98 1.69 -0.24 1.20 0.00 0.00 173.24 175.09 2rov n SER 29 N -2.25 2.40 -3.72 5.45 2.88 -1.26 -0.92 113.62 116.19 2rov n SER 29 Ca 0.05 1.07 -0.27 0.00 -1.33 0.00 0.00 58.87 58.40 2rov n SER 29 Cb 0.59 -1.18 -0.04 0.00 -0.75 0.00 0.00 64.21 62.83 2rov n SER 29 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2rov n LYS 30 N 5.03 -2.12 -3.64 -1.46 -0.00 -1.26 -4.87 118.16 109.84 2rov n LYS 30 Ca 0.25 0.20 -0.03 0.00 -0.00 0.00 0.00 58.31 58.73 2rov n LYS 30 Cb 0.16 -4.80 -0.07 0.00 -0.00 0.00 0.00 35.03 30.32 2rov n LYS 30 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2rov s LYS 31 N -6.36 0.33 -0.19 -1.58 2.47 -0.10 -4.35 119.74 109.96 2rov s LYS 31 Ca 0.51 0.53 -0.07 0.00 -1.56 0.00 0.00 55.97 55.39 2rov s LYS 31 Cb -0.29 0.09 -0.03 0.00 -1.46 0.00 0.00 37.83 36.13 2rov s LYS 31 CO 0.63 -0.06 0.04 0.42 0.16 0.00 0.00 175.35 176.54 2rov s ILE 32 N 1.05 4.48 -0.05 5.43 1.01 0.14 0.13 121.20 133.39 2rov s ILE 32 Ca -0.06 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.45 2rov s ILE 32 Cb -0.04 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 2rov s ILE 32 CO -0.13 0.44 -0.02 -0.76 0.00 0.00 0.00 174.94 174.47 2rov s LEU 33 N 0.69 3.46 -0.08 2.97 1.43 0.11 -0.26 118.68 126.99 2rov s LEU 33 Ca 0.02 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2rov s LEU 33 Cb -0.14 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.25 2rov s LEU 33 CO 0.02 0.34 -0.10 0.12 0.23 0.00 0.00 176.35 176.96 2rov s PHE 34 N -0.94 1.39 0.40 0.29 5.36 0.18 -0.88 117.98 123.78 2rov s PHE 34 Ca 0.15 -0.56 0.04 0.00 -0.96 0.00 0.00 56.93 55.60 2rov s PHE 34 Cb -0.11 -1.07 -0.03 0.00 -0.34 0.00 0.00 43.02 41.47 2rov s PHE 34 CO 0.05 -0.33 0.11 0.71 -1.46 0.00 0.00 175.22 174.30 2rov s TYR 35 N 0.97 1.81 -0.06 10.12 1.51 0.68 0.17 117.35 132.55 2rov s TYR 35 Ca -0.09 -1.22 0.10 0.00 -1.01 0.00 0.00 57.07 54.84 2rov s TYR 35 Cb -0.15 -1.19 -0.14 0.00 -0.11 0.00 0.00 41.96 40.37 2rov s TYR 35 CO 0.00 -0.23 0.12 -3.47 -1.11 0.00 0.00 175.55 170.86 2rov n ASP 36 N -1.20 2.54 -3.61 2.29 2.03 -1.26 -2.51 116.55 114.82 2rov n ASP 36 Ca -0.06 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.13 2rov n ASP 36 Cb 0.65 1.06 -0.05 0.00 -0.72 0.00 0.00 41.12 42.07 2rov n ASP 36 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2rov s SER 37 N -3.81 -0.33 0.21 1.67 0.01 -1.26 -4.45 113.70 105.74 2rov s SER 37 Ca -0.05 -0.09 -0.10 0.00 1.31 0.00 0.00 55.95 57.03 2rov s SER 37 Cb 0.05 0.48 0.15 0.00 0.21 0.00 0.00 66.02 66.90 2rov s SER 37 CO 0.43 -0.79 1.82 -0.08 0.41 0.00 0.00 173.24 175.03 2rov h GLU 38 N 2.59 1.05 -0.65 12.44 4.57 -1.97 -2.43 114.58 130.18 2rov h GLU 38 Ca -0.33 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 57.74 2rov h GLU 38 Cb 1.24 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.59 2rov h GLU 38 CO 0.44 0.78 0.43 1.96 -1.18 0.00 0.00 179.01 181.44 2rov h GLN 39 N 1.04 0.84 0.00 1.92 7.50 -2.00 -1.47 115.11 122.94 2rov h GLN 39 Ca 0.27 -0.05 -0.03 0.00 0.50 0.00 0.00 58.65 59.34 2rov h GLN 39 Cb 0.03 -0.19 -0.00 0.00 0.05 0.00 0.00 27.48 27.37 2rov h GLN 39 CO -0.04 0.56 -0.13 -0.44 -1.50 0.00 0.00 178.83 177.27 2rov h ASP 40 N 0.86 0.00 -0.07 1.46 5.19 -1.85 -2.70 116.42 119.33 2rov h ASP 40 Ca 0.24 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.63 2rov h ASP 40 Cb -0.08 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.43 2rov h ASP 40 CO -0.06 0.13 -0.06 0.50 -3.12 0.00 0.00 179.24 176.63 2rov h LYS 41 N 0.00 0.16 -0.09 3.56 3.11 -0.82 -2.45 116.57 120.04 2rov h LYS 41 Ca -0.00 -0.08 0.03 0.00 -2.81 0.00 0.00 60.65 57.78 2rov h LYS 41 Cb 0.24 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.47 2rov h LYS 41 CO 0.02 0.60 0.09 0.93 -2.81 0.00 0.00 179.45 178.28 2rov h GLU 42 N -0.28 0.00 -0.03 1.90 5.08 -1.11 0.18 114.58 120.33 2rov h GLU 42 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2rov h GLU 42 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2rov h GLU 42 CO 0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 2rov n GLN 43 N -3.95 1.22 -3.38 2.33 1.13 -1.06 -4.90 117.38 108.76 2rov n GLN 43 Ca -0.01 -0.33 -0.19 0.00 -1.94 0.00 0.00 57.00 54.54 2rov n GLN 43 Cb 0.19 -1.41 0.07 0.00 0.11 0.00 0.00 30.24 29.21 2rov n GLN 43 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2rov n SER 44 N -0.53 -4.80 -3.92 1.08 2.88 0.62 -4.98 113.62 103.97 2rov n SER 44 Ca 0.19 -0.48 -0.29 0.00 -1.33 0.00 0.00 58.87 56.96 2rov n SER 44 Cb 0.17 -4.40 -0.12 0.00 -0.75 0.00 0.00 64.21 59.11 2rov n SER 44 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2rov s ASN 45 N -3.50 4.92 -0.03 -3.46 3.84 -0.93 -5.06 114.94 110.71 2rov s ASN 45 Ca 0.37 -3.80 -0.30 0.00 0.21 0.00 0.00 52.86 49.34 2rov s ASN 45 Cb -0.16 -1.67 -0.04 0.00 -0.55 0.00 0.00 41.25 38.83 2rov s ASN 45 CO 0.62 -0.10 1.28 -2.16 -2.79 0.00 0.00 177.10 173.96 2rov s PRO 46 N -1.39 4.33 0.19 0.43 0.04 -1.26 -4.65 135.00 132.69 2rov s PRO 46 Ca 0.25 1.80 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 2rov s PRO 46 Cb -0.06 -3.55 0.09 0.00 0.04 0.00 0.00 34.50 31.02 2rov s PRO 46 CO -0.15 -0.49 1.62 -0.92 0.04 0.00 0.00 177.00 177.09 2rov h TYR 47 N 7.58 1.09 -1.65 0.56 5.03 -0.63 -3.46 116.97 125.49 2rov h TYR 47 Ca -0.36 -0.22 0.05 0.00 2.58 0.00 0.00 58.73 60.78 2rov h TYR 47 Cb 1.17 -0.27 -0.24 0.00 1.55 0.00 0.00 36.73 38.94 2rov h TYR 47 CO 0.74 1.02 0.44 1.41 -1.32 0.00 0.00 178.16 180.44 2rov s MET 48 N -4.82 0.61 0.03 1.82 0.00 -0.85 -5.01 119.30 111.07 2rov s MET 48 Ca -0.11 0.46 0.06 0.00 0.00 0.00 0.00 55.69 56.10 2rov s MET 48 Cb 0.13 0.29 -0.02 0.00 0.00 0.00 0.00 34.83 35.23 2rov s MET 48 CO 0.86 -0.13 -0.18 0.14 0.00 0.00 0.00 175.02 175.71 2rov s VAL 49 N -0.31 1.40 -0.04 10.11 -7.23 -1.26 0.51 120.40 123.59 2rov s VAL 49 Ca 0.00 -0.99 0.07 0.00 -1.81 0.00 0.00 61.98 59.24 2rov s VAL 49 Cb -0.03 -1.22 -0.01 0.00 0.56 0.00 0.00 36.38 35.68 2rov s VAL 49 CO -0.02 0.20 -0.24 -0.76 -0.31 0.00 0.00 175.10 173.97 2rov s LEU 50 N -0.93 2.04 -0.33 1.32 1.43 0.63 -4.94 118.68 117.91 2rov s LEU 50 Ca 0.05 -0.46 -0.29 0.00 -1.03 0.00 0.00 54.13 52.40 2rov s LEU 50 Cb -0.08 -1.28 0.02 0.00 0.03 0.00 0.00 46.19 44.88 2rov s LEU 50 CO 0.01 0.27 1.10 -1.81 0.23 0.00 0.00 176.35 176.15 2rov s ASP 51 N -0.36 6.89 0.29 2.29 1.11 -1.26 0.28 116.67 125.91 2rov s ASP 51 Ca 0.03 1.03 -0.01 0.00 0.18 0.00 0.00 52.55 53.78 2rov s ASP 51 Cb -0.11 -2.54 0.47 0.00 1.07 0.00 0.00 42.92 41.80 2rov s ASP 51 CO 0.01 -0.92 1.92 0.40 1.18 0.00 0.00 175.17 177.76 2rov h ILE 52 N 5.79 1.11 -0.07 0.77 2.04 -1.90 -0.99 117.51 124.26 2rov h ILE 52 Ca -0.21 -0.38 -0.05 0.00 1.00 0.00 0.00 64.86 65.22 2rov h ILE 52 Cb 1.06 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2rov h ILE 52 CO 1.04 0.20 -0.20 -0.78 0.00 0.00 0.00 178.15 178.41 2rov h ASP 53 N 1.10 0.10 0.94 1.72 1.82 -1.91 -1.86 116.42 118.33 2rov h ASP 53 Ca 0.38 -0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.96 2rov h ASP 53 Cb 0.10 -0.03 -0.00 0.00 0.68 0.00 0.00 39.33 40.08 2rov h ASP 53 CO -0.13 0.31 -0.15 0.11 -1.61 0.00 0.00 179.24 177.77 2rov h LYS 54 N 0.10 0.00 -6.66 0.28 1.57 -1.58 -3.44 116.57 106.84 2rov h LYS 54 Ca 0.02 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.22 2rov h LYS 54 Cb 0.42 0.00 0.10 0.00 0.08 0.00 0.00 32.23 32.83 2rov h LYS 54 CO 0.03 0.15 0.49 1.28 -0.57 0.00 0.00 179.45 180.84 2rov n LEU 55 N -3.32 3.18 -0.09 2.94 4.77 -0.70 -2.75 117.00 121.03 2rov n LEU 55 Ca 0.00 1.18 -0.09 0.00 -0.03 0.00 0.00 56.01 57.07 2rov n LEU 55 Cb 0.39 -1.44 -0.14 0.00 -2.33 0.00 0.00 43.42 39.90 2rov n LEU 55 CO 0.31 -0.60 -1.09 0.49 -1.33 0.00 0.00 177.39 175.17 2rov n PHE 56 N 0.83 0.00 -3.65 -1.77 3.72 -0.20 -4.93 117.46 111.47 2rov n PHE 56 Ca 0.08 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.44 2rov n PHE 56 Cb 0.34 -0.88 -0.07 0.00 -0.94 0.00 0.00 39.48 37.93 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 -2.43 -0.10 -0.20 1.38 2.46 -1.25 -5.01 115.29 110.13 2rov s HIS 57 Ca -0.10 0.24 0.00 0.00 0.47 0.00 0.00 55.06 55.67 2rov s HIS 57 Cb 0.05 0.47 0.05 0.00 -0.13 0.00 0.00 32.58 33.03 2rov s HIS 57 CO 0.72 -0.05 -0.06 0.08 -2.47 0.00 0.00 174.74 172.96 2rov s VAL 58 N -0.09 1.33 0.11 0.89 1.01 -1.26 -1.25 120.40 121.13 2rov s VAL 58 Ca 0.07 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 2rov s VAL 58 Cb -0.04 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 2rov s VAL 58 CO -0.14 0.03 0.22 -0.13 0.00 0.00 0.00 175.10 175.09 2rov s ARG 59 N 1.52 0.93 0.99 2.72 1.81 -0.79 -4.95 118.95 121.18 2rov s ARG 59 Ca -0.02 -1.01 -0.12 0.00 -1.72 0.00 0.00 55.73 52.87 2rov s ARG 59 Cb -0.17 0.36 0.19 0.00 -0.45 0.00 0.00 34.95 34.87 2rov s ARG 59 CO -0.07 -0.31 1.08 -1.25 -0.68 0.00 0.00 175.30 174.07 2rov s PRO 60 N -3.89 0.44 0.53 3.54 0.04 -1.26 -0.70 135.00 133.71 2rov s PRO 60 Ca 0.08 0.95 0.08 0.00 0.04 0.00 0.00 61.00 62.14 2rov s PRO 60 Cb 0.04 -1.70 0.05 0.00 0.04 0.00 0.00 34.50 32.93 2rov s PRO 60 CO -0.08 -2.84 0.58 0.14 0.04 0.00 0.00 177.00 174.84 2rov s VAL 61 N -2.73 2.11 0.34 -0.36 -7.23 -0.45 -4.62 120.40 107.45 2rov s VAL 61 Ca 0.66 -1.22 0.03 0.00 -1.81 0.00 0.00 61.98 59.64 2rov s VAL 61 Cb -0.21 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.39 2rov s VAL 61 CO 0.60 0.00 0.11 0.35 -0.31 0.00 0.00 175.10 175.85 2rov n THR 62 N -1.95 0.00 0.34 5.32 -2.24 -1.26 -4.65 114.28 109.85 2rov n THR 62 Ca 0.07 -1.93 0.23 0.00 -2.27 0.00 0.00 64.05 60.15 2rov n THR 62 Cb 0.62 0.68 1.21 0.00 -2.10 0.00 0.00 70.33 70.74 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 -1.94 -0.10 115.11 118.04 2rov h GLN 63 Ca -0.26 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.17 2rov h GLN 63 Cb 0.99 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.53 2rov h GLN 63 CO 0.42 0.00 -0.30 1.79 -2.65 0.00 0.00 178.83 178.08 2rov h THR 64 N 0.00 0.66 -0.38 2.39 1.35 -2.02 -3.11 112.91 111.81 2rov h THR 64 Ca 0.00 -1.43 -0.07 0.00 -0.55 0.00 0.00 66.41 64.37 2rov h THR 64 Cb 0.01 1.94 -0.02 0.00 -1.73 0.00 0.00 68.15 68.35 2rov h THR 64 CO -0.00 0.30 -0.05 -0.78 -0.25 0.00 0.00 175.52 174.74 2rov h ASP 65 N 0.00 0.60 -5.01 5.36 3.58 -1.40 -3.45 116.42 116.10 2rov h ASP 65 Ca -0.00 -0.14 -0.12 0.00 0.42 0.00 0.00 57.03 57.19 2rov h ASP 65 Cb 0.92 -0.16 -0.19 0.00 1.72 0.00 0.00 39.33 41.62 2rov h ASP 65 CO 0.04 0.70 -0.33 0.68 -2.88 0.00 0.00 179.24 177.45 2rov s VAL 66 N -4.88 0.08 -0.18 2.25 -7.23 -1.17 -5.06 120.40 104.20 2rov s VAL 66 Ca -0.08 -0.62 -0.08 0.00 -1.81 0.00 0.00 61.98 59.38 2rov s VAL 66 Cb 0.15 -0.68 -0.08 0.00 0.56 0.00 0.00 36.38 36.33 2rov s VAL 66 CO 0.79 -0.34 -0.23 0.00 -0.31 0.00 0.00 175.10 175.01 2rov n TYR 67 N 1.10 0.00 0.25 2.82 4.11 -1.26 -4.56 117.16 119.61 2rov n TYR 67 Ca -0.21 0.00 0.10 0.00 -0.00 0.00 0.00 57.90 57.80 2rov n TYR 67 Cb 0.57 -0.64 0.63 0.00 -0.00 0.00 0.00 39.34 39.90 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 -0.60 0.00 0.00 -3.48 -0.00 -1.97 -3.44 114.38 104.89 2rov h ARG 68 Ca -0.45 0.00 -0.21 0.00 -0.00 0.00 0.00 59.98 59.32 2rov h ARG 68 Cb 1.41 0.00 0.12 0.00 -0.00 0.00 0.00 29.97 31.51 2rov h ARG 68 CO -0.26 0.17 -0.10 0.00 -0.00 0.00 0.00 179.97 179.78 2rov n ALA 69 N -2.32 -2.98 -2.38 0.08 0.00 -1.26 -5.02 120.51 106.64 2rov n ALA 69 Ca -0.02 -0.87 -0.32 0.00 0.00 0.00 0.00 53.44 52.24 2rov n ALA 69 Cb 0.28 -0.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.50 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 -2.37 3.43 0.57 0.00 -1.08 -1.26 -5.00 116.67 110.96 2rov s ASP 70 Ca 0.38 -0.37 0.31 0.00 -0.52 0.00 0.00 52.55 52.35 2rov s ASP 70 Cb -0.07 -0.53 1.43 0.00 -1.46 0.00 0.00 42.92 42.28 2rov s ASP 70 CO 0.32 0.33 1.79 0.00 0.52 0.00 0.00 175.17 178.13 2rov h ALA 71 N 5.42 2.60 0.00 3.66 0.00 -1.95 0.67 119.26 129.67 2rov h ALA 71 Ca -0.44 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.25 2rov h ALA 71 Cb 1.13 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2rov h ALA 71 CO 0.48 -1.09 -0.91 0.87 0.00 0.00 0.00 179.25 178.60 2rov h LYS 72 N 0.00 0.02 0.12 0.00 1.57 -2.02 -3.29 116.57 112.97 2rov h LYS 72 Ca 0.37 -0.03 -0.27 0.00 -1.87 0.00 0.00 60.65 58.85 2rov h LYS 72 Cb 1.75 0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.08 2rov h LYS 72 CO -0.00 0.92 -1.22 0.93 -0.57 0.00 0.00 179.45 179.50 2rov h GLU 73 N 0.01 0.28 -0.56 3.15 4.39 -0.11 -3.35 114.58 118.39 2rov h GLU 73 Ca -0.02 -0.47 0.11 0.00 0.34 0.00 0.00 59.36 59.32 2rov h GLU 73 Cb 1.61 0.17 -0.11 0.00 -0.10 0.00 0.00 28.75 30.32 2rov h GLU 73 CO 0.12 1.21 -0.29 0.82 -1.16 0.00 0.00 179.01 179.72 2rov h ILE 74 N 0.09 0.23 0.00 3.13 1.08 -1.25 0.37 117.51 121.15 2rov h ILE 74 Ca -0.13 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.34 2rov h ILE 74 Cb 1.95 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 35.93 2rov h ILE 74 CO 0.20 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.85 2rov n PRO 75 N -5.43 0.16 -0.34 2.37 -0.04 -1.26 -1.84 135.00 128.63 2rov n PRO 75 Ca 0.04 0.46 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 2rov n PRO 75 Cb 0.35 -1.86 0.30 0.00 -0.04 0.00 0.00 33.50 32.25 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 -2.17 2.69 -5.13 0.54 1.74 0.12 -4.77 116.66 109.68 2rov n ARG 76 Ca 0.01 -2.59 -0.32 0.00 -0.77 0.00 0.00 57.85 54.19 2rov n ARG 76 Cb 0.17 -1.55 -0.17 0.00 -1.02 0.00 0.00 32.46 29.90 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 -1.08 2.19 0.10 0.55 1.01 -0.72 0.64 121.20 123.90 2rov s ILE 77 Ca 0.47 -0.97 0.09 0.00 0.00 0.00 0.00 60.65 60.24 2rov s ILE 77 Cb 0.25 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.83 2rov s ILE 77 CO 0.33 0.55 -0.23 0.72 0.00 0.00 0.00 174.94 176.31 2rov s PHE 78 N 0.36 2.01 -0.05 3.97 -0.71 -0.92 -1.35 117.98 121.31 2rov s PHE 78 Ca -0.17 -0.40 0.03 0.00 -1.04 0.00 0.00 56.93 55.35 2rov s PHE 78 Cb -0.18 -1.12 -0.03 0.00 -1.21 0.00 0.00 43.02 40.49 2rov s PHE 78 CO 0.08 0.24 -0.14 -1.14 -1.34 0.00 0.00 175.22 172.92 2rov s GLN 79 N -1.84 2.53 -0.19 1.99 0.74 0.13 -1.51 119.66 121.51 2rov s GLN 79 Ca 0.10 -0.68 0.01 0.00 0.05 0.00 0.00 55.36 54.83 2rov s GLN 79 Cb -0.10 -2.40 0.04 0.00 1.10 0.00 0.00 33.01 31.65 2rov s GLN 79 CO 0.04 0.62 -0.11 0.42 -0.55 0.00 0.00 175.29 175.72 2rov s ILE 80 N -0.73 1.64 0.22 -2.34 1.09 -0.66 -1.89 121.20 118.54 2rov s ILE 80 Ca 0.11 -0.96 -0.17 0.00 -1.10 0.00 0.00 60.65 58.53 2rov s ILE 80 Cb -0.11 -1.69 -0.08 0.00 -1.06 0.00 0.00 42.46 39.52 2rov s ILE 80 CO 0.01 0.21 0.68 -0.22 -0.10 0.00 0.00 174.94 175.52 2rov s LEU 81 N 1.40 4.29 -0.12 2.97 2.96 -0.38 -0.65 118.68 129.16 2rov s LEU 81 Ca -0.00 1.30 -0.24 0.00 -0.22 0.00 0.00 54.13 54.96 2rov s LEU 81 Cb -0.16 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.00 2rov s LEU 81 CO -0.09 0.01 0.58 -0.72 -1.32 0.00 0.00 176.35 174.81 2rov s TYR 82 N -1.59 -0.58 -0.02 5.38 1.13 0.41 -1.04 117.35 121.05 2rov s TYR 82 Ca 0.44 1.18 -0.30 0.00 -1.41 0.00 0.00 57.07 56.98 2rov s TYR 82 Cb -0.15 0.28 -0.05 0.00 -1.10 0.00 0.00 41.96 40.94 2rov s TYR 82 CO 0.20 -0.45 1.36 0.00 -2.51 0.00 0.00 175.55 174.15 2rov s ALA 83 N -0.58 3.57 -0.22 9.51 0.00 -1.11 -1.61 121.76 131.31 2rov s ALA 83 Ca -0.07 0.82 -0.04 0.00 0.00 0.00 0.00 51.96 52.67 2rov s ALA 83 Cb -0.03 -3.58 -0.12 0.00 0.00 0.00 0.00 23.12 19.39 2rov s ALA 83 CO 0.05 -0.90 -0.24 0.27 0.00 0.00 0.00 175.76 174.95 2rov n ASN 84 N 5.39 2.02 0.00 0.00 0.23 -1.26 -4.85 115.26 116.78 2rov n ASN 84 Ca 0.13 0.06 0.00 0.00 -0.53 0.00 0.00 54.58 54.24 2rov n ASN 84 Cb 0.44 -0.49 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 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 -3.53 0.14 0.00 -3.83 1.02 -1.26 -5.05 120.64 108.13 2rov n GLU 85 Ca -0.41 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.73 2rov n GLU 85 Cb 0.87 -0.99 0.00 0.00 -0.02 0.00 0.00 31.44 31.30 2rov n GLU 85 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rov n GLY 86 N 3.45 0.52 1.84 0.62 0.00 -1.26 -5.07 105.19 105.28 2rov n GLY 86 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 0.15 -0.61 -0.00 -1.26 -4.72 119.36 112.98 2rov n ILE 87 Ca 0.00 0.02 0.07 0.00 -0.00 0.00 0.00 62.75 62.84 2rov n ILE 87 Cb 0.00 -0.32 0.56 0.00 -0.00 0.00 0.00 39.64 39.88 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 0.18 1.58 4.38 0.87 -2.00 -0.30 113.55 118.26 2rov h SER 88 Ca 0.00 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2rov h SER 88 Cb 0.00 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 61.92 2rov h SER 88 CO 0.00 0.13 -0.02 0.28 -0.53 0.00 0.00 176.83 176.68 2rov h SER 89 N 0.21 0.00 -0.91 6.23 0.02 -1.97 -3.46 113.55 113.66 2rov h SER 89 Ca 0.07 0.00 -0.79 0.00 -0.84 0.00 0.00 61.79 60.22 2rov h SER 89 Cb 0.02 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.57 2rov h SER 89 CO -0.01 0.02 0.56 0.00 -1.14 0.00 0.00 176.83 176.26 2rov n ALA 90 N -2.10 -1.49 -2.46 3.77 0.00 -0.13 -4.71 120.51 113.39 2rov n ALA 90 Ca 0.03 0.47 -0.19 0.00 0.00 0.00 0.00 53.44 53.75 2rov n ALA 90 Cb 0.45 -1.74 0.10 0.00 0.00 0.00 0.00 19.45 18.27 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 3.39 -0.08 -4.28 0.00 4.76 -0.64 -4.73 118.16 116.59 2rov n LYS 91 Ca 0.27 -2.15 -0.15 0.00 -2.87 0.00 0.00 58.31 53.41 2rov n LYS 91 Cb -0.04 -0.59 -0.10 0.00 -1.84 0.00 0.00 35.03 32.46 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 -4.35 1.09 -0.12 4.39 6.03 -1.26 -0.44 114.94 120.28 2rov s ASN 92 Ca 0.54 -1.31 0.00 0.00 -1.03 0.00 0.00 52.86 51.07 2rov s ASN 92 Cb -0.03 0.17 0.02 0.00 -3.03 0.00 0.00 41.25 38.38 2rov s ASN 92 CO 0.36 -0.69 -0.10 -0.22 -2.03 0.00 0.00 177.10 174.43 2rov s LEU 93 N -3.25 1.37 -0.24 3.54 0.20 0.18 -4.90 118.68 115.58 2rov s LEU 93 Ca 0.33 -0.35 -0.16 0.00 0.69 0.00 0.00 54.13 54.64 2rov s LEU 93 Cb 0.07 -0.93 -0.04 0.00 -0.43 0.00 0.00 46.19 44.87 2rov s LEU 93 CO 0.10 -0.08 0.40 -0.76 -0.29 0.00 0.00 176.35 175.72 2rov s LEU 94 N 1.51 4.09 -0.20 -0.68 2.01 -1.26 -1.65 118.68 122.50 2rov s LEU 94 Ca 0.02 0.42 0.01 0.00 0.01 0.00 0.00 54.13 54.59 2rov s LEU 94 Cb -0.13 -2.49 0.04 0.00 0.01 0.00 0.00 46.19 43.62 2rov s LEU 94 CO -0.07 -0.15 -0.13 -0.76 1.01 0.00 0.00 176.35 176.25 2rov s LEU 95 N 1.74 2.42 -0.25 1.79 1.43 -0.57 -4.42 118.68 120.82 2rov s LEU 95 Ca 0.17 -0.89 -0.21 0.00 -1.03 0.00 0.00 54.13 52.18 2rov s LEU 95 Cb -0.15 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 2rov s LEU 95 CO 0.09 -0.11 0.67 -0.22 0.23 0.00 0.00 176.35 177.01 2rov s LEU 96 N 1.32 4.07 -0.08 1.79 2.96 0.17 -2.15 118.68 126.75 2rov s LEU 96 Ca -0.00 0.77 -0.14 0.00 -0.22 0.00 0.00 54.13 54.54 2rov s LEU 96 Cb -0.16 -2.92 -0.05 0.00 0.50 0.00 0.00 46.19 43.56 2rov s LEU 96 CO -0.09 -0.40 0.34 0.00 -1.32 0.00 0.00 176.35 174.88 2rov s ALA 97 N 2.56 3.67 0.60 5.97 0.00 0.21 -0.63 121.76 134.14 2rov s ALA 97 Ca 0.28 -0.35 0.29 0.00 0.00 0.00 0.00 51.96 52.18 2rov s ALA 97 Cb -0.15 -2.36 1.59 0.00 0.00 0.00 0.00 23.12 22.20 2rov s ALA 97 CO 0.08 0.33 1.99 -2.95 0.00 0.00 0.00 175.76 175.21 2rov h ASN 98 N 5.59 0.00 -4.43 0.00 7.08 -1.86 -3.41 115.58 118.54 2rov h ASN 98 Ca -0.48 0.00 -0.25 0.00 -3.08 0.00 0.00 56.30 52.50 2rov h ASN 98 Cb 1.20 0.00 -0.24 0.00 -2.08 0.00 0.00 38.32 37.20 2rov h ASN 98 CO 0.67 0.00 -0.73 -0.44 -2.08 0.00 0.00 177.43 174.85 2rov s SER 99 N -5.32 0.46 0.20 6.14 0.01 -1.26 -5.05 113.70 108.88 2rov s SER 99 Ca -0.04 -0.33 -0.11 0.00 1.31 0.00 0.00 55.95 56.78 2rov s SER 99 Cb 0.14 0.02 0.20 0.00 0.21 0.00 0.00 66.02 66.60 2rov s SER 99 CO 0.50 -0.13 1.80 0.74 0.41 0.00 0.00 173.24 176.56 2rov h THR 100 N 4.78 0.96 -0.93 1.44 2.02 -1.86 -1.62 112.91 117.70 2rov h THR 100 Ca -0.31 -0.21 0.17 0.00 0.77 0.00 0.00 66.41 66.84 2rov h THR 100 Cb 1.20 0.30 -0.08 0.00 -1.74 0.00 0.00 68.15 67.84 2rov h THR 100 CO 0.45 0.11 0.59 -0.33 0.37 0.00 0.00 175.52 176.71 2rov h GLU 101 N 0.60 0.64 -0.55 6.66 5.08 -1.96 -0.51 114.58 124.53 2rov h GLU 101 Ca 0.27 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2rov h GLU 101 Cb 0.17 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2rov h GLU 101 CO -0.18 0.42 0.31 1.49 -1.00 0.00 0.00 179.01 180.05 2rov h GLU 102 N 0.66 0.76 -0.47 2.33 4.57 -1.68 -2.02 114.58 118.73 2rov h GLU 102 Ca 0.49 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.57 2rov h GLU 102 Cb 0.86 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 2rov h GLU 102 CO -0.24 0.58 0.24 0.37 -1.18 0.00 0.00 179.01 178.78 2rov h GLN 103 N 0.74 0.65 -0.39 1.92 -0.00 -1.01 0.20 115.11 117.22 2rov h GLN 103 Ca 0.19 -0.07 -0.10 0.00 -0.00 0.00 0.00 58.65 58.67 2rov h GLN 103 Cb 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.37 2rov h GLN 103 CO -0.03 0.49 -0.16 1.96 0.00 0.00 0.00 178.83 181.09 2rov h GLN 104 N 0.65 0.79 -0.00 1.69 1.08 -0.98 -1.88 115.11 116.46 2rov h GLN 104 Ca 0.17 -0.34 -0.00 0.00 -1.45 0.00 0.00 58.65 57.03 2rov h GLN 104 Cb 0.05 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 2rov h GLN 104 CO -0.03 0.96 -0.02 -0.22 -0.95 0.00 0.00 178.83 178.58 2rov h LYS 105 N 0.60 0.02 -0.13 1.46 3.64 -0.91 -1.85 116.57 119.39 2rov h LYS 105 Ca 0.09 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2rov h LYS 105 Cb 0.71 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.49 2rov h LYS 105 CO 0.05 0.65 -0.12 -1.49 -2.27 0.00 0.00 179.45 176.27 2rov h TRP 106 N -0.61 -0.30 -0.16 1.91 4.06 -0.68 0.41 115.95 120.59 2rov h TRP 106 Ca -0.00 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 2rov h TRP 106 Cb 0.65 0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.96 2rov h TRP 106 CO 0.15 -0.18 0.04 0.28 -3.56 0.00 0.00 178.44 175.17 2rov h VAL 107 N -0.14 1.20 -0.43 1.49 2.07 -1.44 0.80 116.25 119.80 2rov h VAL 107 Ca 0.09 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 2rov h VAL 107 Cb 0.27 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2rov h VAL 107 CO -0.21 0.19 -0.05 -1.28 0.02 0.00 0.00 177.57 176.23 2rov h SER 108 N 0.07 0.70 0.10 0.57 0.87 -1.14 -0.42 113.55 114.30 2rov h SER 108 Ca 0.05 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.43 2rov h SER 108 Cb 0.25 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2rov h SER 108 CO -0.00 0.80 -0.05 0.03 -0.53 0.00 0.00 176.83 177.08 2rov h ARG 109 N 0.67 -0.13 -0.78 2.24 2.47 -0.10 -1.66 114.38 117.10 2rov h ARG 109 Ca 0.13 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2rov h ARG 109 Cb 0.49 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.80 2rov h ARG 109 CO 0.03 0.37 0.50 1.37 0.56 0.00 0.00 179.97 182.80 2rov h LEU 110 N -0.88 0.90 -0.18 3.04 8.10 -0.87 -1.53 115.31 123.88 2rov h LEU 110 Ca -0.01 -0.03 -0.13 0.00 0.11 0.00 0.00 57.88 57.82 2rov h LEU 110 Cb 0.56 -0.23 0.00 0.00 -0.44 0.00 0.00 40.66 40.56 2rov h LEU 110 CO 0.02 0.66 -0.39 1.62 -4.11 0.00 0.00 178.44 176.24 2rov h VAL 111 N 1.06 1.34 0.00 0.15 3.04 -1.17 -3.03 116.25 117.64 2rov h VAL 111 Ca 0.28 -1.63 -0.01 0.00 -1.01 0.00 0.00 66.70 64.33 2rov h VAL 111 Cb -0.10 1.91 -0.00 0.00 -2.01 0.00 0.00 31.29 31.09 2rov h VAL 111 CO -0.06 0.50 -0.03 0.11 -1.01 0.00 0.00 177.57 177.09 2rov h LYS 112 N 0.25 0.00 0.00 4.17 1.57 -0.93 -0.27 116.57 121.36 2rov h LYS 112 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2rov h LYS 112 Cb 1.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.30 2rov h LYS 112 CO 0.09 0.03 -0.13 0.87 -0.57 0.00 0.00 179.45 179.73 2rov h LYS 113 N 0.00 0.00 -6.70 3.15 1.57 -1.17 -3.45 116.57 109.97 2rov h LYS 113 Ca -0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2rov h LYS 113 Cb 0.05 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.44 2rov h LYS 113 CO 0.00 0.13 0.87 -0.89 -0.57 0.00 0.00 179.45 178.99 2rov n ILE 114 N -3.21 0.63 0.04 1.86 5.41 -0.11 -4.73 119.36 119.25 2rov n ILE 114 Ca 0.01 -0.16 -0.18 0.00 1.00 0.00 0.00 62.75 63.42 2rov n ILE 114 Cb 0.45 -1.85 -0.08 0.00 -0.71 0.00 0.00 39.64 37.44 2rov n ILE 114 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2rov h PRO 115 N 5.35 0.64 -2.08 0.38 0.13 -1.87 -3.30 132.00 131.25 2rov h PRO 115 Ca -0.45 -0.67 -0.53 0.00 -0.87 0.00 0.00 66.00 63.48 2rov h PRO 115 Cb 1.23 0.19 -0.17 0.00 0.13 0.00 0.00 31.00 32.37 2rov h PRO 115 CO 0.84 1.27 0.63 1.63 -0.23 0.00 0.00 178.00 182.14 2rov n LYS 116 N -3.84 2.68 0.00 0.86 5.02 -1.26 -5.14 118.16 116.48 2rov n LYS 116 Ca -0.10 -2.48 0.06 0.00 -2.02 0.00 0.00 58.31 53.77 2rov n LYS 116 Cb 0.86 -2.20 0.34 0.00 -0.02 0.00 0.00 35.03 34.01 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05