#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 0.97 -1.52 1.43 0.00 -1.26 -5.02 116.66 111.26 2rov n ARG 2 Ca 0.00 -2.69 -0.28 0.00 -0.00 0.00 0.00 57.85 54.88 2rov n ARG 2 Cb 0.00 0.92 -0.13 0.00 -0.00 0.00 0.00 32.46 33.25 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 0.55 -4.14 2.89 7.94 -1.26 -4.82 117.00 118.16 2rov n LEU 3 Ca -0.12 -0.56 -0.09 0.00 -1.11 0.00 0.00 56.01 54.12 2rov n LEU 3 Cb 0.47 -1.12 -0.10 0.00 0.53 0.00 0.00 43.42 43.20 2rov n LEU 3 CO 0.25 -1.55 -0.36 -1.83 -1.11 0.00 0.00 177.39 172.79 2rov s GLU 4 N 8.26 0.78 0.00 1.96 -1.05 -1.26 -0.16 118.70 127.23 2rov s GLU 4 Ca 1.17 -1.32 0.00 0.00 -0.15 0.00 0.00 54.97 54.67 2rov s GLU 4 Cb -0.65 -0.02 0.00 0.00 -0.44 0.00 0.00 34.13 33.02 2rov s GLU 4 CO 0.37 -0.08 0.00 0.41 0.95 0.00 0.00 175.26 176.91 2rov n GLY 5 N -0.01 -0.13 3.16 -3.83 0.00 -0.22 -4.99 105.19 99.18 2rov n GLY 5 Ca -0.12 -1.12 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 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 -3.63 2.56 0.12 1.61 0.52 -1.26 0.56 118.94 119.43 2rov s TRP 6 Ca 0.00 -1.24 0.11 0.00 0.02 0.00 0.00 56.10 54.98 2rov s TRP 6 Cb 0.00 -1.75 -0.04 0.00 -1.15 0.00 0.00 33.47 30.53 2rov s TRP 6 CO 0.00 -0.56 -0.26 -0.51 0.02 0.00 0.00 176.95 175.63 2rov s LEU 7 N 0.75 2.31 0.10 2.99 1.43 -0.58 -4.74 118.68 120.95 2rov s LEU 7 Ca -0.09 -0.74 -0.16 0.00 -1.03 0.00 0.00 54.13 52.11 2rov s LEU 7 Cb -0.16 -1.19 -0.07 0.00 0.03 0.00 0.00 46.19 44.80 2rov s LEU 7 CO -0.00 0.17 0.54 -0.44 0.23 0.00 0.00 176.35 176.85 2rov s SER 8 N -2.00 6.90 0.12 2.29 0.01 -0.07 0.69 113.70 121.65 2rov s SER 8 Ca 0.13 1.13 0.07 0.00 1.31 0.00 0.00 55.95 58.59 2rov s SER 8 Cb -0.10 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 2rov s SER 8 CO 0.06 0.19 -0.17 -0.76 0.41 0.00 0.00 173.24 172.96 2rov s LEU 9 N -1.56 2.37 -0.65 2.44 1.02 -0.84 0.01 118.68 121.46 2rov s LEU 9 Ca 0.33 -0.77 -0.26 0.00 0.02 0.00 0.00 54.13 53.46 2rov s LEU 9 Cb -0.17 -0.72 -0.12 0.00 0.02 0.00 0.00 46.19 45.21 2rov s LEU 9 CO 0.18 -0.05 2.43 -0.81 0.02 0.00 0.00 176.35 178.13 2rov n PRO 10 N 0.71 0.75 -2.02 1.29 -0.04 -1.26 -2.81 135.00 131.62 2rov n PRO 10 Ca -0.17 -0.28 -0.29 0.00 -0.04 0.00 0.00 63.50 62.73 2rov n PRO 10 Cb 0.56 -3.25 0.15 0.00 -0.04 0.00 0.00 33.50 30.92 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 12.25 2.03 -0.44 0.52 0.11 -1.18 -4.89 120.40 128.80 2rov s VAL 11 Ca 1.01 -0.08 0.03 0.00 -2.93 0.00 0.00 61.98 60.00 2rov s VAL 11 Cb -0.28 -2.95 0.15 0.00 -1.53 0.00 0.00 36.38 31.77 2rov s VAL 11 CO 0.24 0.00 0.29 -0.13 -3.33 0.00 0.00 175.10 172.17 2rov s ARG 12 N -5.72 1.16 0.13 1.54 0.52 -1.26 -3.12 118.95 112.19 2rov s ARG 12 Ca 0.70 -2.05 -0.25 0.00 -0.52 0.00 0.00 55.73 53.61 2rov s ARG 12 Cb -0.06 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.40 2rov s ARG 12 CO 0.51 -1.25 1.64 -0.91 0.02 0.00 0.00 175.30 175.30 2rov h ASN 13 N 6.31 -0.75 0.00 0.23 -0.26 -1.93 -3.40 115.58 115.78 2rov h ASN 13 Ca 0.11 0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.95 2rov h ASN 13 Cb 0.91 0.31 0.00 0.00 -1.06 0.00 0.00 38.32 38.48 2rov h ASN 13 CO 0.43 -0.32 -0.28 -0.46 -1.06 0.00 0.00 177.43 175.75 2rov n ASN 14 N -5.37 1.34 0.00 5.81 0.23 -1.26 -5.07 115.26 110.93 2rov n ASN 14 Ca -0.04 0.19 0.00 0.00 -0.53 0.00 0.00 54.58 54.20 2rov n ASN 14 Cb 0.28 -0.45 0.00 0.00 -2.08 0.00 0.00 39.78 37.54 2rov n ASN 14 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 2rov n THR 15 N -3.76 0.00 -0.06 5.53 5.66 -1.26 -4.97 114.28 115.42 2rov n THR 15 Ca -0.04 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.82 2rov n THR 15 Cb 0.14 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.78 2rov n THR 15 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2rov n LYS 16 N 0.00 0.68 -3.25 1.09 5.02 -1.26 -4.91 118.16 115.52 2rov n LYS 16 Ca 0.00 0.17 -0.39 0.00 -2.02 0.00 0.00 58.31 56.07 2rov n LYS 16 Cb 0.00 -1.63 -0.06 0.00 -0.02 0.00 0.00 35.03 33.32 2rov n LYS 16 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2rov s LYS 17 N -2.54 4.25 -0.15 1.97 2.36 -1.26 -5.07 119.74 119.31 2rov s LYS 17 Ca -0.17 0.70 0.00 0.00 -2.55 0.00 0.00 55.97 53.95 2rov s LYS 17 Cb 0.07 -3.31 0.03 0.00 -1.05 0.00 0.00 37.83 33.58 2rov s LYS 17 CO 0.77 0.47 -0.11 -0.06 1.55 0.00 0.00 175.35 177.97 2rov s PHE 18 N -0.50 1.95 0.00 4.03 0.08 -1.26 -2.99 117.98 119.30 2rov s PHE 18 Ca 0.30 -1.13 0.00 0.00 0.12 0.00 0.00 56.93 56.22 2rov s PHE 18 Cb -0.18 -1.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.80 2rov s PHE 18 CO 0.17 -0.63 0.00 0.41 -0.10 0.00 0.00 175.22 175.07 2rov n GLY 19 N 4.82 1.03 3.01 4.36 0.00 -1.18 -4.76 105.19 112.47 2rov n GLY 19 Ca -0.15 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 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 3.84 -0.16 -0.10 1.61 0.52 -1.26 -3.09 118.94 120.29 2rov s TRP 20 Ca 0.00 0.39 -0.03 0.00 0.02 0.00 0.00 56.10 56.48 2rov s TRP 20 Cb 0.00 0.04 0.04 0.00 -1.15 0.00 0.00 33.47 32.40 2rov s TRP 20 CO 0.00 -0.09 0.07 0.54 0.02 0.00 0.00 176.95 177.49 2rov s VAL 21 N 0.22 -0.02 0.17 4.03 0.11 -1.12 -4.88 120.40 118.90 2rov s VAL 21 Ca -0.01 0.11 -0.30 0.00 -2.93 0.00 0.00 61.98 58.84 2rov s VAL 21 Cb -0.02 -0.40 -0.08 0.00 -1.53 0.00 0.00 36.38 34.34 2rov s VAL 21 CO -0.01 -0.02 1.17 -1.59 -3.33 0.00 0.00 175.10 171.32 2rov s LYS 22 N 2.12 4.51 0.04 1.54 0.00 -1.24 -1.99 119.74 124.72 2rov s LYS 22 Ca 0.03 1.82 0.07 0.00 0.00 0.00 0.00 55.97 57.90 2rov s LYS 22 Cb -0.14 -3.26 -0.03 0.00 0.00 0.00 0.00 37.83 34.40 2rov s LYS 22 CO -0.06 -0.06 -0.20 0.15 0.00 0.00 0.00 175.35 175.17 2rov s LYS 23 N -0.14 1.35 -0.49 1.78 -0.14 0.22 -4.77 119.74 117.54 2rov s LYS 23 Ca 0.53 -0.93 -0.27 0.00 -1.36 0.00 0.00 55.97 53.94 2rov s LYS 23 Cb -0.31 -1.46 -0.04 0.00 -1.68 0.00 0.00 37.83 34.34 2rov s LYS 23 CO 0.35 0.37 2.04 -0.47 -0.76 0.00 0.00 175.35 176.88 2rov s TYR 24 N -0.81 1.48 -0.19 3.18 5.04 -0.53 -1.52 117.35 124.00 2rov s TYR 24 Ca 0.07 0.97 -0.06 0.00 -2.44 0.00 0.00 57.07 55.61 2rov s TYR 24 Cb -0.09 -3.93 -0.03 0.00 0.35 0.00 0.00 41.96 38.26 2rov s TYR 24 CO 0.02 -2.63 0.03 0.08 -1.34 0.00 0.00 175.55 171.71 2rov s VAL 25 N 9.54 4.38 -0.17 3.14 1.01 0.19 -0.22 120.40 138.28 2rov s VAL 25 Ca 0.81 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 62.61 2rov s VAL 25 Cb -0.17 -2.98 0.04 0.00 0.00 0.00 0.00 36.38 33.27 2rov s VAL 25 CO 0.26 0.44 -0.04 -0.63 0.00 0.00 0.00 175.10 175.13 2rov s ILE 26 N 0.70 1.02 -0.55 2.22 1.01 -0.50 -1.05 121.20 124.05 2rov s ILE 26 Ca 0.02 -0.60 -0.21 0.00 0.00 0.00 0.00 60.65 59.85 2rov s ILE 26 Cb -0.14 -1.23 0.06 0.00 0.01 0.00 0.00 42.46 41.16 2rov s ILE 26 CO 0.02 0.09 0.79 -0.69 0.00 0.00 0.00 174.94 175.15 2rov s VAL 27 N 1.67 4.62 0.62 2.92 1.01 0.77 -0.30 120.40 131.71 2rov s VAL 27 Ca 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 61.98 61.65 2rov s VAL 27 Cb -0.15 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.76 2rov s VAL 27 CO -0.07 -1.04 0.98 -0.55 0.00 0.00 0.00 175.10 174.42 2rov s SER 28 N 2.97 5.82 -0.36 3.32 0.15 0.31 -4.02 113.70 121.90 2rov s SER 28 Ca 0.21 1.07 -0.32 0.00 0.70 0.00 0.00 55.95 57.61 2rov s SER 28 Cb -0.17 -2.07 -0.10 0.00 -1.71 0.00 0.00 66.02 61.98 2rov s SER 28 CO 0.14 -1.02 2.25 -1.54 1.20 0.00 0.00 173.24 174.26 2rov n SER 29 N -2.71 2.38 -1.52 5.45 3.41 -1.26 -0.16 113.62 119.20 2rov n SER 29 Ca 0.05 0.24 -0.14 0.00 -0.26 0.00 0.00 58.87 58.76 2rov n SER 29 Cb 0.56 -1.36 -0.01 0.00 -0.26 0.00 0.00 64.21 63.13 2rov n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2rov n LYS 30 N 8.46 -1.10 -3.52 4.33 4.76 -1.26 -4.98 118.16 124.84 2rov n LYS 30 Ca 0.39 0.73 -0.16 0.00 -2.87 0.00 0.00 58.31 56.40 2rov n LYS 30 Cb 0.32 -4.98 -0.05 0.00 -1.84 0.00 0.00 35.03 28.47 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 -4.48 0.97 -0.14 1.97 2.47 0.77 -4.07 119.74 117.25 2rov s LYS 31 Ca 0.00 0.17 0.01 0.00 -1.56 0.00 0.00 55.97 54.59 2rov s LYS 31 Cb 0.00 0.46 0.02 0.00 -1.46 0.00 0.00 37.83 36.85 2rov s LYS 31 CO 0.00 -0.32 -0.16 0.42 0.16 0.00 0.00 175.35 175.46 2rov s ILE 32 N -1.41 1.62 0.05 5.43 1.01 0.25 0.11 121.20 128.26 2rov s ILE 32 Ca -0.08 -0.68 0.05 0.00 0.00 0.00 0.00 60.65 59.93 2rov s ILE 32 Cb -0.00 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 2rov s ILE 32 CO 0.06 0.47 -0.06 -0.76 0.00 0.00 0.00 174.94 174.64 2rov s LEU 33 N 1.24 3.19 -0.04 2.97 1.43 0.59 -0.02 118.68 128.03 2rov s LEU 33 Ca -0.00 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 52.89 2rov s LEU 33 Cb -0.14 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.20 2rov s LEU 33 CO -0.07 0.23 -0.06 -0.36 0.23 0.00 0.00 176.35 176.32 2rov s PHE 34 N -1.12 0.86 0.18 0.29 0.40 0.32 -1.40 117.98 117.50 2rov s PHE 34 Ca 0.20 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 2rov s PHE 34 Cb -0.11 -0.70 -0.05 0.00 0.51 0.00 0.00 43.02 42.68 2rov s PHE 34 CO 0.11 -0.17 0.04 0.71 0.70 0.00 0.00 175.22 176.61 2rov s TYR 35 N 0.68 1.17 -0.04 0.36 1.51 0.70 0.98 117.35 122.71 2rov s TYR 35 Ca -0.10 -1.11 0.14 0.00 -1.01 0.00 0.00 57.07 54.99 2rov s TYR 35 Cb -0.13 -0.66 -0.21 0.00 -0.11 0.00 0.00 41.96 40.84 2rov s TYR 35 CO 0.01 -0.33 0.27 -0.40 -1.11 0.00 0.00 175.55 174.00 2rov n ASP 36 N -0.24 1.70 -3.76 2.29 5.75 -1.26 -1.45 116.55 119.59 2rov n ASP 36 Ca -0.05 0.00 -0.07 0.00 -0.01 0.00 0.00 54.79 54.66 2rov n ASP 36 Cb 0.64 1.53 -0.02 0.00 -1.03 0.00 0.00 41.12 42.24 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 -3.81 -0.23 0.33 -1.12 0.01 -1.26 -4.52 113.70 103.09 2rov s SER 37 Ca -0.05 -0.67 0.09 0.00 1.31 0.00 0.00 55.95 56.63 2rov s SER 37 Cb 0.08 0.74 0.57 0.00 0.21 0.00 0.00 66.02 67.62 2rov s SER 37 CO 0.59 -1.38 1.76 -0.08 0.41 0.00 0.00 173.24 174.54 2rov h GLU 38 N 2.00 0.16 -0.53 12.44 4.81 -1.99 -2.52 114.58 128.94 2rov h GLU 38 Ca -0.21 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 58.94 2rov h GLU 38 Cb 1.25 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 2rov h GLU 38 CO 0.25 0.51 0.26 -0.56 -0.73 0.00 0.00 179.01 178.75 2rov h GLN 39 N 0.14 0.76 -0.03 1.92 3.07 -1.99 -0.66 115.11 118.32 2rov h GLN 39 Ca 0.01 -0.11 -0.12 0.00 0.09 0.00 0.00 58.65 58.53 2rov h GLN 39 Cb 0.73 -0.14 -0.01 0.00 0.08 0.00 0.00 27.48 28.13 2rov h GLN 39 CO 0.05 0.62 -0.55 -0.44 0.09 0.00 0.00 178.83 178.61 2rov h ASP 40 N 0.71 0.10 -0.18 0.06 5.19 -1.89 -2.22 116.42 118.19 2rov h ASP 40 Ca 0.18 -0.05 -0.06 0.00 -0.62 0.00 0.00 57.03 56.48 2rov h ASP 40 Cb 0.10 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.58 2rov h ASP 40 CO -0.02 0.62 -0.13 0.50 -3.12 0.00 0.00 179.24 177.09 2rov h LYS 41 N 0.07 0.40 0.00 3.56 3.11 -1.03 -2.75 116.57 119.93 2rov h LYS 41 Ca -0.00 -0.19 -0.05 0.00 -2.81 0.00 0.00 60.65 57.60 2rov h LYS 41 Cb 0.99 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.21 2rov h LYS 41 CO 0.08 0.74 -0.23 1.05 -2.81 0.00 0.00 179.45 178.27 2rov h GLU 42 N 0.06 0.00 0.00 1.90 4.11 -1.10 -2.40 114.58 117.15 2rov h GLU 42 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 2rov h GLU 42 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2rov h GLU 42 CO 0.03 0.23 0.00 1.04 0.07 0.00 0.00 179.01 180.38 2rov n GLN 43 N -3.51 0.48 -3.21 1.06 1.13 -0.84 -4.89 117.38 107.61 2rov n GLN 43 Ca -0.01 0.03 -0.20 0.00 -1.94 0.00 0.00 57.00 54.89 2rov n GLN 43 Cb 0.39 -1.50 0.05 0.00 0.11 0.00 0.00 30.24 29.29 2rov n GLN 43 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2rov n SER 44 N -1.22 -5.67 -3.34 1.08 7.64 -0.90 -4.96 113.62 106.25 2rov n SER 44 Ca 0.14 -0.37 -0.26 0.00 1.01 0.00 0.00 58.87 59.40 2rov n SER 44 Cb 0.18 -4.38 -0.08 0.00 -1.01 0.00 0.00 64.21 58.92 2rov n SER 44 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2rov n ASN 45 N -2.18 2.21 -4.67 6.43 4.05 -1.05 -5.09 115.26 114.96 2rov n ASN 45 Ca -0.04 -3.11 -0.49 0.00 0.45 0.00 0.00 54.58 51.39 2rov n ASN 45 Cb 0.58 -0.66 -0.05 0.00 1.23 0.00 0.00 39.78 40.88 2rov n ASN 45 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 2rov n PRO 46 N 1.14 1.98 -0.04 1.20 -0.02 -1.26 -4.78 135.00 133.21 2rov n PRO 46 Ca 0.26 0.72 0.16 0.00 -2.02 0.00 0.00 63.50 62.62 2rov n PRO 46 Cb 0.46 -2.51 0.60 0.00 -0.02 0.00 0.00 33.50 32.02 2rov n PRO 46 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2rov h TYR 47 N 7.61 0.22 -1.94 6.00 3.20 0.25 -3.43 116.97 128.89 2rov h TYR 47 Ca -0.47 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.38 2rov h TYR 47 Cb 1.28 -0.07 -0.22 0.00 1.54 0.00 0.00 36.73 39.26 2rov h TYR 47 CO 0.77 0.10 0.19 1.41 -1.64 0.00 0.00 178.16 178.98 2rov s MET 48 N -5.20 0.80 -0.04 1.82 1.75 -0.83 -5.00 119.30 112.61 2rov s MET 48 Ca -0.06 0.88 0.01 0.00 -1.25 0.00 0.00 55.69 55.26 2rov s MET 48 Cb 0.20 0.39 0.02 0.00 2.84 0.00 0.00 34.83 38.28 2rov s MET 48 CO 0.74 -0.11 -0.02 0.54 -0.65 0.00 0.00 175.02 175.51 2rov s VAL 49 N 0.22 0.36 0.12 10.11 0.11 -1.26 0.12 120.40 130.18 2rov s VAL 49 Ca -0.00 -0.03 0.08 0.00 -2.93 0.00 0.00 61.98 59.10 2rov s VAL 49 Cb -0.05 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.35 2rov s VAL 49 CO 0.01 0.18 -0.20 -0.76 -3.33 0.00 0.00 175.10 171.00 2rov s LEU 50 N 0.92 2.34 -0.22 2.54 1.02 0.96 -4.97 118.68 121.28 2rov s LEU 50 Ca -0.11 -0.74 -0.20 0.00 0.02 0.00 0.00 54.13 53.10 2rov s LEU 50 Cb -0.14 -0.88 -0.02 0.00 0.02 0.00 0.00 46.19 45.17 2rov s LEU 50 CO -0.01 0.03 0.61 -1.81 0.02 0.00 0.00 176.35 175.20 2rov s ASP 51 N -2.16 6.63 0.32 2.29 1.01 -1.26 0.85 116.67 124.36 2rov s ASP 51 Ca 0.10 0.76 0.04 0.00 0.71 0.00 0.00 52.55 54.16 2rov s ASP 51 Cb -0.09 -2.34 0.64 0.00 1.01 0.00 0.00 42.92 42.15 2rov s ASP 51 CO 0.05 -0.30 1.90 0.40 0.21 0.00 0.00 175.17 177.43 2rov h ILE 52 N 5.26 0.98 0.00 0.77 2.04 -1.86 0.23 117.51 124.93 2rov h ILE 52 Ca -0.30 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.20 2rov h ILE 52 Cb 1.14 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 2rov h ILE 52 CO 0.77 0.16 -0.25 -0.78 0.00 0.00 0.00 178.15 178.05 2rov h ASP 53 N 0.89 0.00 1.09 1.72 1.82 -1.91 -1.89 116.42 118.14 2rov h ASP 53 Ca 0.41 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.03 2rov h ASP 53 Cb 0.39 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.39 2rov h ASP 53 CO -0.17 0.25 -0.07 0.11 -1.61 0.00 0.00 179.24 177.75 2rov h LYS 54 N 0.00 0.00 -6.67 0.28 1.57 -1.35 -3.46 116.57 106.95 2rov h LYS 54 Ca -0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 2rov h LYS 54 Cb 0.45 0.00 0.13 0.00 0.08 0.00 0.00 32.23 32.89 2rov h LYS 54 CO 0.03 0.07 0.24 1.28 -0.57 0.00 0.00 179.45 180.51 2rov n LEU 55 N -3.18 2.86 -0.10 2.94 4.77 -0.71 -2.89 117.00 120.69 2rov n LEU 55 Ca 0.01 1.07 -0.12 0.00 -0.03 0.00 0.00 56.01 56.94 2rov n LEU 55 Cb 0.37 -1.38 -0.12 0.00 -2.33 0.00 0.00 43.42 39.96 2rov n LEU 55 CO 0.30 -1.25 -1.14 0.49 -1.33 0.00 0.00 177.39 174.46 2rov n PHE 56 N -0.32 0.00 -3.65 -1.77 3.72 0.14 -4.92 117.46 110.66 2rov n PHE 56 Ca 0.09 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.47 2rov n PHE 56 Cb 0.38 -0.84 -0.07 0.00 -0.94 0.00 0.00 39.48 38.02 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 -2.42 -0.04 -0.16 1.38 2.46 -1.23 -5.01 115.29 110.27 2rov s HIS 57 Ca -0.19 0.09 0.02 0.00 0.47 0.00 0.00 55.06 55.45 2rov s HIS 57 Cb 0.06 0.37 0.01 0.00 -0.13 0.00 0.00 32.58 32.90 2rov s HIS 57 CO 0.59 -0.02 -0.21 0.08 -2.47 0.00 0.00 174.74 172.72 2rov s VAL 58 N 0.27 2.08 0.04 0.89 1.01 -1.26 -2.07 120.40 121.37 2rov s VAL 58 Ca 0.04 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 60.85 2rov s VAL 58 Cb -0.04 -1.85 0.05 0.00 0.00 0.00 0.00 36.38 34.54 2rov s VAL 58 CO -0.15 0.54 0.48 -0.13 0.00 0.00 0.00 175.10 175.85 2rov s ARG 59 N 0.99 0.98 0.86 2.72 0.52 -0.87 -5.01 118.95 119.14 2rov s ARG 59 Ca -0.03 -0.27 -0.11 0.00 -0.52 0.00 0.00 55.73 54.81 2rov s ARG 59 Cb -0.15 0.45 0.11 0.00 0.52 0.00 0.00 34.95 35.88 2rov s ARG 59 CO -0.06 -0.34 1.14 -1.25 0.02 0.00 0.00 175.30 174.80 2rov s PRO 60 N -2.39 1.48 0.53 3.54 0.04 -1.26 -1.24 135.00 135.70 2rov s PRO 60 Ca -0.06 1.46 0.09 0.00 0.04 0.00 0.00 61.00 62.53 2rov s PRO 60 Cb -0.01 -1.79 0.06 0.00 0.04 0.00 0.00 34.50 32.80 2rov s PRO 60 CO -0.01 -2.27 0.66 0.14 0.04 0.00 0.00 177.00 175.55 2rov s VAL 61 N -2.67 2.22 0.42 -0.36 -7.23 -0.37 -4.72 120.40 107.70 2rov s VAL 61 Ca 0.66 -1.12 0.03 0.00 -1.81 0.00 0.00 61.98 59.74 2rov s VAL 61 Cb -0.22 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 2rov s VAL 61 CO 0.56 0.00 0.11 0.35 -0.31 0.00 0.00 175.10 175.81 2rov n THR 62 N -2.05 0.00 0.33 5.32 -2.24 -1.26 -4.67 114.28 109.72 2rov n THR 62 Ca 0.10 -2.32 0.22 0.00 -2.27 0.00 0.00 64.05 59.78 2rov n THR 62 Cb 0.62 0.75 1.16 0.00 -2.10 0.00 0.00 70.33 70.75 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 0.43 115.11 118.57 2rov h GLN 63 Ca -0.33 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.15 2rov h GLN 63 Cb 1.20 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.74 2rov h GLN 63 CO 0.53 0.00 -0.08 1.79 -2.65 0.00 0.00 178.83 178.42 2rov h THR 64 N 0.00 0.16 -0.11 2.39 1.35 -2.02 -3.14 112.91 111.54 2rov h THR 64 Ca 0.00 -0.98 -0.12 0.00 -0.55 0.00 0.00 66.41 64.76 2rov h THR 64 Cb 0.07 1.85 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 2rov h THR 64 CO -0.00 0.08 -0.45 -0.78 -0.25 0.00 0.00 175.52 174.12 2rov h ASP 65 N 0.00 0.28 -5.04 5.36 1.82 -1.29 -3.45 116.42 114.10 2rov h ASP 65 Ca -0.00 -0.13 -0.12 0.00 -0.39 0.00 0.00 57.03 56.39 2rov h ASP 65 Cb 0.85 -0.08 -0.18 0.00 0.68 0.00 0.00 39.33 40.59 2rov h ASP 65 CO 0.01 0.70 -0.40 0.68 -1.61 0.00 0.00 179.24 178.62 2rov s VAL 66 N -4.06 0.10 -0.10 2.25 -7.23 -1.19 -5.05 120.40 105.11 2rov s VAL 66 Ca -0.05 -0.79 -0.04 0.00 -1.81 0.00 0.00 61.98 59.29 2rov s VAL 66 Cb 0.13 -0.77 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 2rov s VAL 66 CO 0.78 -0.44 -0.12 0.00 -0.31 0.00 0.00 175.10 175.02 2rov n TYR 67 N 0.93 0.00 0.51 2.82 4.11 -1.26 -4.60 117.16 119.67 2rov n TYR 67 Ca -0.20 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 57.78 2rov n TYR 67 Cb 0.58 -0.36 0.36 0.00 -0.00 0.00 0.00 39.34 39.92 2rov n TYR 67 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.86 179.75 2rov n ARG 68 N -3.29 0.04 0.00 -3.48 -4.01 -1.26 -4.76 116.66 99.90 2rov n ARG 68 Ca -0.19 0.26 0.00 0.00 -1.04 0.00 0.00 57.85 56.89 2rov n ARG 68 Cb 0.65 -1.57 0.00 0.00 -3.04 0.00 0.00 32.46 28.50 2rov n ARG 68 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2rov n ALA 69 N -1.55 0.00 -2.65 2.89 0.00 -1.26 -5.06 120.51 112.87 2rov n ALA 69 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.20 2rov n ALA 69 Cb 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.49 2rov n ALA 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2rov s ASP 70 N -1.54 2.38 0.44 0.00 1.11 -1.26 -5.02 116.67 112.77 2rov s ASP 70 Ca 0.00 -0.38 0.21 0.00 0.18 0.00 0.00 52.55 52.56 2rov s ASP 70 Cb 0.00 -0.47 1.18 0.00 1.07 0.00 0.00 42.92 44.70 2rov s ASP 70 CO 0.00 0.21 1.83 0.00 1.18 0.00 0.00 175.17 178.39 2rov h ALA 71 N 5.93 2.37 0.00 5.23 0.00 -1.97 0.58 119.26 131.41 2rov h ALA 71 Ca -0.35 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 2rov h ALA 71 Cb 1.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2rov h ALA 71 CO 0.48 -0.70 -0.51 0.87 0.00 0.00 0.00 179.25 179.39 2rov h LYS 72 N 0.31 0.00 0.08 0.00 1.57 -2.03 -3.19 116.57 113.31 2rov h LYS 72 Ca 0.51 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 59.04 2rov h LYS 72 Cb 1.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.74 2rov h LYS 72 CO -0.18 0.51 -1.14 0.93 -0.57 0.00 0.00 179.45 179.00 2rov h GLU 73 N 0.00 0.20 -0.60 3.15 4.39 -0.32 -3.35 114.58 118.06 2rov h GLU 73 Ca -0.01 -0.33 0.11 0.00 0.34 0.00 0.00 59.36 59.47 2rov h GLU 73 Cb 1.16 0.12 -0.12 0.00 -0.10 0.00 0.00 28.75 29.82 2rov h GLU 73 CO 0.07 1.14 -0.30 0.82 -1.16 0.00 0.00 179.01 179.58 2rov h ILE 74 N 0.06 0.20 0.00 3.13 1.08 -1.06 0.43 117.51 121.36 2rov h ILE 74 Ca -0.09 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 2rov h ILE 74 Cb 1.87 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 35.83 2rov h ILE 74 CO 0.18 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.83 2rov n PRO 75 N -5.44 0.16 -0.18 2.37 -0.04 -1.26 -1.40 135.00 129.21 2rov n PRO 75 Ca 0.05 0.55 0.10 0.00 -0.04 0.00 0.00 63.50 64.16 2rov n PRO 75 Cb 0.35 -1.92 0.20 0.00 -0.04 0.00 0.00 33.50 32.09 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 -2.24 2.38 -4.46 0.54 1.74 0.14 -4.82 116.66 109.93 2rov n ARG 76 Ca 0.00 -2.18 -0.34 0.00 -0.77 0.00 0.00 57.85 54.56 2rov n ARG 76 Cb 0.11 -1.45 -0.13 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 -1.32 3.42 0.12 0.55 1.01 -0.50 0.63 121.20 125.12 2rov s ILE 77 Ca 0.35 -0.52 0.09 0.00 0.00 0.00 0.00 60.65 60.57 2rov s ILE 77 Cb 0.20 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 2rov s ILE 77 CO 0.28 0.49 -0.21 0.72 0.00 0.00 0.00 174.94 176.22 2rov s PHE 78 N 0.59 1.84 0.02 3.97 -0.71 -0.75 -1.23 117.98 121.70 2rov s PHE 78 Ca -0.05 -0.43 0.07 0.00 -1.04 0.00 0.00 56.93 55.48 2rov s PHE 78 Cb -0.15 -0.98 -0.03 0.00 -1.21 0.00 0.00 43.02 40.65 2rov s PHE 78 CO 0.03 0.25 -0.18 -1.14 -1.34 0.00 0.00 175.22 172.84 2rov s GLN 79 N -2.16 2.14 -0.19 1.99 0.74 -0.37 -1.45 119.66 120.36 2rov s GLN 79 Ca 0.09 -0.93 -0.00 0.00 0.05 0.00 0.00 55.36 54.57 2rov s GLN 79 Cb -0.09 -2.21 0.05 0.00 1.10 0.00 0.00 33.01 31.86 2rov s GLN 79 CO 0.05 0.55 -0.06 0.42 -0.55 0.00 0.00 175.29 175.71 2rov s ILE 80 N -0.88 1.30 0.02 -2.34 1.01 -0.64 -2.04 121.20 117.62 2rov s ILE 80 Ca 0.14 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.72 2rov s ILE 80 Cb -0.10 -1.50 -0.06 0.00 0.01 0.00 0.00 42.46 40.81 2rov s ILE 80 CO 0.04 0.05 0.57 -0.22 0.00 0.00 0.00 174.94 175.39 2rov s LEU 81 N 1.53 4.45 0.00 2.97 2.96 -0.88 -0.84 118.68 128.88 2rov s LEU 81 Ca -0.02 1.17 -0.10 0.00 -0.22 0.00 0.00 54.13 54.96 2rov s LEU 81 Cb -0.17 -2.88 0.01 0.00 0.50 0.00 0.00 46.19 43.65 2rov s LEU 81 CO -0.07 0.17 0.20 -0.72 -1.32 0.00 0.00 176.35 174.60 2rov s TYR 82 N -0.50 -0.03 -0.19 5.38 -0.85 0.02 0.23 117.35 121.42 2rov s TYR 82 Ca 0.30 -0.03 -0.29 0.00 -0.52 0.00 0.00 57.07 56.53 2rov s TYR 82 Cb -0.18 0.00 -0.01 0.00 0.38 0.00 0.00 41.96 42.14 2rov s TYR 82 CO 0.17 -0.34 1.28 0.00 -1.52 0.00 0.00 175.55 175.14 2rov s ALA 83 N -1.51 3.60 -0.22 9.51 0.00 -1.14 -1.84 121.76 130.15 2rov s ALA 83 Ca -0.13 0.39 -0.09 0.00 0.00 0.00 0.00 51.96 52.13 2rov s ALA 83 Cb -0.06 -3.66 -0.18 0.00 0.00 0.00 0.00 23.12 19.22 2rov s ALA 83 CO 0.02 -1.30 -0.03 0.27 0.00 0.00 0.00 175.76 174.72 2rov n ASN 84 N 6.84 1.99 0.00 0.00 0.23 -1.26 -4.82 115.26 118.24 2rov n ASN 84 Ca 0.14 0.17 0.00 0.00 -0.53 0.00 0.00 54.58 54.37 2rov n ASN 84 Cb 0.45 -0.73 0.00 0.00 -2.08 0.00 0.00 39.78 37.42 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 -3.79 0.00 0.00 -3.83 -0.58 -1.26 -5.06 120.64 106.12 2rov n GLU 85 Ca -0.42 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.32 2rov n GLU 85 Cb 0.92 -0.89 0.00 0.00 -0.57 0.00 0.00 31.44 30.91 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 3.24 0.72 1.87 0.62 0.00 -1.26 -5.07 105.19 105.31 2rov n GLY 86 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -4.70 119.36 112.83 2rov n ILE 87 Ca 0.00 0.02 0.09 0.00 -0.00 0.00 0.00 62.75 62.86 2rov n ILE 87 Cb 0.00 -0.31 0.50 0.00 -0.00 0.00 0.00 39.64 39.83 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 0.34 1.62 4.38 0.87 -2.00 0.69 113.55 119.45 2rov h SER 88 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 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 0.23 0.00 0.28 -0.53 0.00 0.00 176.83 176.81 2rov h SER 89 N 0.39 0.00 -0.74 6.23 0.02 -1.97 -3.46 113.55 114.03 2rov h SER 89 Ca 0.20 0.00 -0.81 0.00 -0.84 0.00 0.00 61.79 60.34 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 -0.05 0.00 0.79 0.00 -1.14 0.00 0.00 176.83 176.43 2rov n ALA 90 N -2.05 -0.95 -2.19 3.77 0.00 0.23 -4.70 120.51 114.61 2rov n ALA 90 Ca 0.03 0.41 -0.18 0.00 0.00 0.00 0.00 53.44 53.70 2rov n ALA 90 Cb 0.44 -1.85 0.13 0.00 0.00 0.00 0.00 19.45 18.16 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 4.54 -0.44 -4.29 0.00 4.76 -0.77 -4.74 118.16 117.23 2rov n LYS 91 Ca 0.34 -1.96 -0.15 0.00 -2.87 0.00 0.00 58.31 53.68 2rov n LYS 91 Cb -0.05 -0.78 -0.10 0.00 -1.84 0.00 0.00 35.03 32.26 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 -4.55 1.18 -0.11 4.39 6.03 -1.26 -0.80 114.94 119.82 2rov s ASN 92 Ca 0.56 -1.31 -0.00 0.00 -1.03 0.00 0.00 52.86 51.08 2rov s ASN 92 Cb -0.02 0.15 0.02 0.00 -3.03 0.00 0.00 41.25 38.37 2rov s ASN 92 CO 0.38 -0.68 -0.08 -0.22 -2.03 0.00 0.00 177.10 174.48 2rov s LEU 93 N -3.26 1.23 -0.24 3.54 0.20 -0.02 -4.91 118.68 115.22 2rov s LEU 93 Ca 0.33 -0.31 -0.15 0.00 0.69 0.00 0.00 54.13 54.69 2rov s LEU 93 Cb 0.07 -0.86 -0.04 0.00 -0.43 0.00 0.00 46.19 44.93 2rov s LEU 93 CO 0.10 -0.11 0.38 -0.76 -0.29 0.00 0.00 176.35 175.67 2rov s LEU 94 N 1.66 4.09 -0.15 -0.68 2.01 -1.26 -1.62 118.68 122.72 2rov s LEU 94 Ca 0.04 0.38 0.00 0.00 0.01 0.00 0.00 54.13 54.56 2rov s LEU 94 Cb -0.13 -2.45 0.03 0.00 0.01 0.00 0.00 46.19 43.65 2rov s LEU 94 CO -0.08 -0.14 -0.12 -0.76 1.01 0.00 0.00 176.35 176.26 2rov s LEU 95 N 1.75 1.70 -0.26 1.79 1.43 -0.53 -4.40 118.68 120.16 2rov s LEU 95 Ca 0.16 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.56 2rov s LEU 95 Cb -0.15 -1.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 2rov s LEU 95 CO 0.09 -0.09 0.49 -0.22 0.23 0.00 0.00 176.35 176.85 2rov s LEU 96 N 1.51 4.05 -0.11 1.79 2.96 0.10 -1.81 118.68 127.17 2rov s LEU 96 Ca 0.04 0.49 -0.18 0.00 -0.22 0.00 0.00 54.13 54.26 2rov s LEU 96 Cb -0.13 -2.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.89 2rov s LEU 96 CO -0.10 -0.27 0.46 0.00 -1.32 0.00 0.00 176.35 175.13 2rov s ALA 97 N 2.26 3.49 0.58 5.97 0.00 0.21 -0.89 121.76 133.39 2rov s ALA 97 Ca 0.20 -0.20 0.29 0.00 0.00 0.00 0.00 51.96 52.25 2rov s ALA 97 Cb -0.16 -2.62 1.45 0.00 0.00 0.00 0.00 23.12 21.80 2rov s ALA 97 CO 0.09 0.03 1.87 -2.95 0.00 0.00 0.00 175.76 174.81 2rov h ASN 98 N 6.59 0.00 -4.39 0.00 7.08 -1.86 -3.40 115.58 119.59 2rov h ASN 98 Ca -0.42 0.00 -0.30 0.00 -3.08 0.00 0.00 56.30 52.50 2rov h ASN 98 Cb 1.18 0.00 -0.24 0.00 -2.08 0.00 0.00 38.32 37.18 2rov h ASN 98 CO 0.75 0.00 -0.75 -0.44 -2.08 0.00 0.00 177.43 174.91 2rov s SER 99 N -5.20 0.80 0.22 6.14 0.01 -1.26 -5.05 113.70 109.37 2rov s SER 99 Ca -0.04 -0.36 -0.08 0.00 1.31 0.00 0.00 55.95 56.78 2rov s SER 99 Cb 0.16 -0.01 0.29 0.00 0.21 0.00 0.00 66.02 66.67 2rov s SER 99 CO 0.58 -0.08 1.78 0.74 0.41 0.00 0.00 173.24 176.67 2rov h THR 100 N 4.71 0.87 -0.99 1.44 2.02 -1.88 -1.56 112.91 117.53 2rov h THR 100 Ca -0.33 -0.20 0.13 0.00 0.77 0.00 0.00 66.41 66.78 2rov h THR 100 Cb 1.20 0.24 -0.09 0.00 -1.74 0.00 0.00 68.15 67.76 2rov h THR 100 CO 0.45 0.11 0.61 -0.33 0.37 0.00 0.00 175.52 176.73 2rov h GLU 101 N 0.59 0.92 -0.89 6.66 5.08 -1.95 -0.96 114.58 124.02 2rov h GLU 101 Ca 0.32 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.66 2rov h GLU 101 Cb 0.31 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 2rov h GLU 101 CO -0.24 0.61 0.58 1.49 -1.00 0.00 0.00 179.01 180.44 2rov h GLU 102 N 0.95 1.09 -0.70 2.33 4.57 -1.66 -1.56 114.58 119.59 2rov h GLU 102 Ca 0.50 -0.07 -0.05 0.00 -1.18 0.00 0.00 59.36 58.56 2rov h GLU 102 Cb 0.53 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 28.85 2rov h GLU 102 CO -0.28 0.72 0.24 0.37 -1.18 0.00 0.00 179.01 178.88 2rov h GLN 103 N 1.12 1.07 -0.56 1.92 -0.00 -1.09 0.97 115.11 118.54 2rov h GLN 103 Ca 0.35 -0.21 -0.09 0.00 -0.00 0.00 0.00 58.65 58.70 2rov h GLN 103 Cb -0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 27.48 27.29 2rov h GLN 103 CO -0.12 0.90 -0.03 1.96 0.00 0.00 0.00 178.83 181.55 2rov h GLN 104 N 1.03 0.98 0.07 1.69 1.08 -0.95 -1.79 115.11 117.22 2rov h GLN 104 Ca 0.23 -0.31 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2rov h GLN 104 Cb 0.26 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 2rov h GLN 104 CO -0.01 0.98 -0.03 -0.22 -0.95 0.00 0.00 178.83 178.59 2rov h LYS 105 N 0.89 -0.09 -0.15 1.46 3.64 -0.98 -2.18 116.57 119.17 2rov h LYS 105 Ca 0.16 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 2rov h LYS 105 Cb 0.56 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 2rov h LYS 105 CO 0.03 0.47 -0.10 -1.49 -2.27 0.00 0.00 179.45 176.09 2rov h TRP 106 N -0.74 -0.25 0.36 1.91 4.06 -0.84 0.40 115.95 120.85 2rov h TRP 106 Ca -0.01 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.94 2rov h TRP 106 Cb 0.60 0.14 0.00 0.00 -1.00 0.00 0.00 29.16 28.90 2rov h TRP 106 CO 0.13 -0.16 -0.17 0.28 -3.56 0.00 0.00 178.44 174.95 2rov h VAL 107 N -0.11 0.66 -0.65 1.49 2.07 -1.44 0.32 116.25 118.59 2rov h VAL 107 Ca 0.09 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 2rov h VAL 107 Cb 0.24 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2rov h VAL 107 CO -0.21 0.04 0.29 -1.28 0.02 0.00 0.00 177.57 176.43 2rov h SER 108 N -0.60 0.85 0.10 0.57 0.87 -1.28 0.12 113.55 114.16 2rov h SER 108 Ca -0.05 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.41 2rov h SER 108 Cb 0.44 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 2rov h SER 108 CO 0.08 0.74 -0.05 0.03 -0.53 0.00 0.00 176.83 177.10 2rov h ARG 109 N 0.92 -0.12 -0.79 2.24 2.47 -0.13 -1.46 114.38 117.52 2rov h ARG 109 Ca 0.22 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 2rov h ARG 109 Cb 0.14 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.45 2rov h ARG 109 CO -0.02 0.38 0.50 1.37 0.56 0.00 0.00 179.97 182.75 2rov h LEU 110 N -0.89 0.92 -0.20 3.04 8.10 -0.35 -1.64 115.31 124.29 2rov h LEU 110 Ca -0.01 -0.04 -0.14 0.00 0.11 0.00 0.00 57.88 57.80 2rov h LEU 110 Cb 0.56 -0.23 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 2rov h LEU 110 CO 0.02 0.68 -0.42 1.62 -4.11 0.00 0.00 178.44 176.24 2rov h VAL 111 N 1.07 1.32 -0.06 0.15 3.04 -0.86 -3.03 116.25 117.89 2rov h VAL 111 Ca 0.29 -1.64 0.01 0.00 -1.01 0.00 0.00 66.70 64.34 2rov h VAL 111 Cb -0.09 1.86 -0.00 0.00 -2.01 0.00 0.00 31.29 31.05 2rov h VAL 111 CO -0.06 0.51 0.04 0.11 -1.01 0.00 0.00 177.57 177.16 2rov h LYS 112 N 0.33 0.03 0.00 4.17 1.57 -0.87 0.17 116.57 121.97 2rov h LYS 112 Ca 0.01 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2rov h LYS 112 Cb 1.02 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 2rov h LYS 112 CO 0.09 0.02 -0.14 0.87 -0.57 0.00 0.00 179.45 179.73 2rov h LYS 113 N 0.03 0.00 -6.78 3.15 1.57 -1.18 -3.44 116.57 109.93 2rov h LYS 113 Ca 0.02 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.28 2rov h LYS 113 Cb 0.05 0.00 0.06 0.00 0.08 0.00 0.00 32.23 32.42 2rov h LYS 113 CO -0.00 0.14 0.74 0.42 -0.57 0.00 0.00 179.45 180.17 2rov s ILE 114 N -3.79 2.64 0.01 1.86 1.01 0.05 -4.73 121.20 118.24 2rov s ILE 114 Ca -0.00 0.56 -0.19 0.00 0.00 0.00 0.00 60.65 61.01 2rov s ILE 114 Cb 0.11 -3.36 -0.24 0.00 0.01 0.00 0.00 42.46 38.98 2rov s ILE 114 CO 0.59 0.10 1.09 1.55 0.00 0.00 0.00 174.94 178.27 2rov h PRO 115 N 4.69 0.44 -1.08 2.79 0.13 -1.85 -3.29 132.00 133.83 2rov h PRO 115 Ca -0.47 -0.50 -0.58 0.00 -0.87 0.00 0.00 66.00 63.59 2rov h PRO 115 Cb 1.22 0.15 -0.26 0.00 0.13 0.00 0.00 31.00 32.23 2rov h PRO 115 CO 0.75 1.15 0.75 1.63 -0.23 0.00 0.00 178.00 182.05 2rov n LYS 116 N -4.16 2.43 0.00 0.86 4.76 -1.26 -5.18 118.16 115.62 2rov n LYS 116 Ca -0.11 -2.90 0.00 0.00 -2.87 0.00 0.00 58.31 52.43 2rov n LYS 116 Cb 0.72 -2.14 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20