#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 0.56 -1.43 1.43 0.00 -1.26 -5.09 116.66 110.86 2rov n ARG 2 Ca 0.00 -1.70 -0.55 0.00 -0.00 0.00 0.00 57.85 55.60 2rov n ARG 2 Cb 0.00 1.78 -0.09 0.00 -0.00 0.00 0.00 32.46 34.15 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 1.74 -3.53 2.89 7.94 -1.25 -4.84 117.00 119.95 2rov n LEU 3 Ca -0.02 0.59 -0.11 0.00 -1.11 0.00 0.00 56.01 55.36 2rov n LEU 3 Cb 0.38 -1.13 -0.03 0.00 0.53 0.00 0.00 43.42 43.17 2rov n LEU 3 CO 0.19 -0.70 0.32 -1.83 -1.11 0.00 0.00 177.39 174.25 2rov s GLU 4 N 5.75 1.25 0.00 1.96 -1.05 -1.26 0.61 118.70 125.95 2rov s GLU 4 Ca 1.11 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 55.34 2rov s GLU 4 Cb -1.09 0.55 0.00 0.00 -0.44 0.00 0.00 34.13 33.15 2rov s GLU 4 CO 0.57 -0.53 0.00 0.41 0.95 0.00 0.00 175.26 176.66 2rov n GLY 5 N -0.33 -0.00 3.14 -3.83 0.00 -0.42 -4.99 105.19 98.75 2rov n GLY 5 Ca -0.16 -1.07 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 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 -4.00 2.43 0.14 1.61 0.52 -1.26 -0.81 118.94 117.57 2rov s TRP 6 Ca 0.00 -1.16 0.11 0.00 0.02 0.00 0.00 56.10 55.07 2rov s TRP 6 Cb 0.00 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.61 2rov s TRP 6 CO 0.00 -0.53 -0.26 -0.51 0.02 0.00 0.00 176.95 175.67 2rov s LEU 7 N 0.77 2.34 -0.14 2.99 1.43 -0.37 -4.72 118.68 120.99 2rov s LEU 7 Ca -0.09 -0.76 -0.13 0.00 -1.03 0.00 0.00 54.13 52.11 2rov s LEU 7 Cb -0.16 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.85 2rov s LEU 7 CO 0.00 0.15 0.29 -0.44 0.23 0.00 0.00 176.35 176.58 2rov s SER 8 N -2.15 6.47 0.12 2.29 0.01 0.03 -0.06 113.70 120.41 2rov s SER 8 Ca 0.14 0.55 0.10 0.00 1.31 0.00 0.00 55.95 58.06 2rov s SER 8 Cb -0.10 -2.18 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 2rov s SER 8 CO 0.06 0.16 -0.25 -0.76 0.41 0.00 0.00 173.24 172.87 2rov s LEU 9 N 0.11 2.40 -0.24 2.44 1.02 -1.00 0.59 118.68 124.01 2rov s LEU 9 Ca 0.17 -0.70 -0.28 0.00 0.02 0.00 0.00 54.13 53.34 2rov s LEU 9 Cb -0.13 -1.30 -0.04 0.00 0.02 0.00 0.00 46.19 44.74 2rov s LEU 9 CO 0.05 0.18 2.08 -2.16 0.02 0.00 0.00 176.35 176.52 2rov s PRO 10 N -2.03 3.24 -0.10 1.29 0.04 -1.25 -2.45 135.00 133.74 2rov s PRO 10 Ca 0.15 1.88 0.03 0.00 0.04 0.00 0.00 61.00 63.10 2rov s PRO 10 Cb -0.10 -4.31 -0.00 0.00 0.04 0.00 0.00 34.50 30.13 2rov s PRO 10 CO 0.07 -1.97 -0.21 0.54 0.04 0.00 0.00 177.00 175.46 2rov s VAL 11 N 7.69 2.31 -0.64 -0.36 0.11 -1.24 -4.77 120.40 123.50 2rov s VAL 11 Ca 0.94 -0.94 -0.26 0.00 -2.93 0.00 0.00 61.98 58.79 2rov s VAL 11 Cb -0.30 -1.90 -0.12 0.00 -1.53 0.00 0.00 36.38 32.53 2rov s VAL 11 CO 0.35 0.55 2.46 0.54 -3.33 0.00 0.00 175.10 175.67 2rov n ARG 12 N 3.45 0.75 0.27 1.54 1.74 -1.25 0.43 116.66 123.58 2rov n ARG 12 Ca -0.19 -0.13 -0.15 0.00 -0.77 0.00 0.00 57.85 56.62 2rov n ARG 12 Cb 0.53 -3.05 -0.08 0.00 -1.02 0.00 0.00 32.46 28.84 2rov n ARG 12 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2rov h ASN 13 N 17.01 -0.59 0.00 0.55 -0.26 0.09 -3.41 115.58 128.97 2rov h ASN 13 Ca -0.16 -0.06 -0.28 0.00 -0.56 0.00 0.00 56.30 55.24 2rov h ASN 13 Cb 1.23 0.15 -0.04 0.00 -1.06 0.00 0.00 38.32 38.61 2rov h ASN 13 CO 1.20 -0.27 -1.89 -0.46 -1.06 0.00 0.00 177.43 174.95 2rov n ASN 14 N -5.31 1.53 0.00 5.81 6.94 -1.26 -5.05 115.26 117.92 2rov n ASN 14 Ca -0.11 0.26 0.00 0.00 -0.02 0.00 0.00 54.58 54.71 2rov n ASN 14 Cb 0.32 -0.62 0.00 0.00 -2.36 0.00 0.00 39.78 37.12 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 -4.00 0.00 -1.53 5.53 5.66 -1.26 -4.96 114.28 113.72 2rov n THR 15 Ca -0.35 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.58 2rov n THR 15 Cb 0.71 0.00 0.18 0.00 -1.55 0.00 0.00 70.33 69.67 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 -1.88 2.01 -3.65 1.09 4.76 -1.26 -4.93 118.16 114.30 2rov n LYS 16 Ca 0.00 -3.31 -0.13 0.00 -2.87 0.00 0.00 58.31 52.00 2rov n LYS 16 Cb 0.00 -1.86 -0.13 0.00 -1.84 0.00 0.00 35.03 31.20 2rov n LYS 16 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2rov s LYS 17 N -3.32 0.16 -0.39 1.97 2.20 -1.26 -5.07 119.74 114.03 2rov s LYS 17 Ca 0.46 0.73 -0.17 0.00 -0.36 0.00 0.00 55.97 56.63 2rov s LYS 17 Cb 0.41 -0.09 0.01 0.00 -1.51 0.00 0.00 37.83 36.65 2rov s LYS 17 CO -0.01 -0.31 0.42 -0.06 -0.36 0.00 0.00 175.35 175.02 2rov s PHE 18 N 2.43 3.18 0.00 4.03 0.08 -1.26 0.84 117.98 127.28 2rov s PHE 18 Ca 0.02 -0.26 0.00 0.00 0.12 0.00 0.00 56.93 56.81 2rov s PHE 18 Cb -0.12 -2.82 0.00 0.00 -0.57 0.00 0.00 43.02 39.50 2rov s PHE 18 CO -0.09 -0.61 0.00 0.41 -0.10 0.00 0.00 175.22 174.83 2rov n GLY 19 N 5.05 0.76 3.25 4.36 0.00 0.17 -4.45 105.19 114.33 2rov n GLY 19 Ca -0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 1.04 -0.16 -0.22 1.61 0.52 -1.25 -3.61 118.94 116.86 2rov s TRP 20 Ca 0.00 0.19 -0.06 0.00 0.02 0.00 0.00 56.10 56.24 2rov s TRP 20 Cb 0.00 0.10 0.11 0.00 -1.15 0.00 0.00 33.47 32.53 2rov s TRP 20 CO 0.00 -0.43 0.44 0.54 0.02 0.00 0.00 176.95 177.52 2rov s VAL 21 N -1.70 -0.69 -0.36 4.03 0.11 -1.03 -4.81 120.40 115.94 2rov s VAL 21 Ca -0.11 0.10 -0.29 0.00 -2.93 0.00 0.00 61.98 58.75 2rov s VAL 21 Cb -0.04 -0.74 -0.01 0.00 -1.53 0.00 0.00 36.38 34.06 2rov s VAL 21 CO 0.02 0.02 1.62 -0.54 -3.33 0.00 0.00 175.10 172.89 2rov s LYS 22 N 2.64 3.47 0.10 1.54 1.02 -1.25 -2.37 119.74 124.89 2rov s LYS 22 Ca 0.02 1.23 0.06 0.00 0.02 0.00 0.00 55.97 57.30 2rov s LYS 22 Cb -0.13 -4.11 -0.04 0.00 -0.52 0.00 0.00 37.83 33.03 2rov s LYS 22 CO -0.14 -1.69 -0.06 0.15 -0.92 0.00 0.00 175.35 172.69 2rov s LYS 23 N 5.28 2.31 -0.54 1.68 -0.14 0.91 -4.79 119.74 124.45 2rov s LYS 23 Ca 0.71 -0.94 -0.28 0.00 -1.36 0.00 0.00 55.97 54.10 2rov s LYS 23 Cb -0.19 -2.41 0.01 0.00 -1.68 0.00 0.00 37.83 33.57 2rov s LYS 23 CO 0.33 0.52 1.39 -0.47 -0.76 0.00 0.00 175.35 176.37 2rov s TYR 24 N -1.25 2.33 -0.15 3.18 5.04 -1.01 -1.23 117.35 124.26 2rov s TYR 24 Ca 0.23 0.50 -0.04 0.00 -2.44 0.00 0.00 57.07 55.32 2rov s TYR 24 Cb -0.11 -4.39 -0.03 0.00 0.35 0.00 0.00 41.96 37.77 2rov s TYR 24 CO 0.15 -1.93 0.00 0.08 -1.34 0.00 0.00 175.55 172.51 2rov s VAL 25 N 5.88 4.29 -0.13 3.14 1.01 0.01 -0.50 120.40 134.10 2rov s VAL 25 Ca 0.53 -0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.25 2rov s VAL 25 Cb -0.11 -2.88 0.05 0.00 0.00 0.00 0.00 36.38 33.44 2rov s VAL 25 CO 0.26 0.51 0.04 -0.63 0.00 0.00 0.00 175.10 175.28 2rov s ILE 26 N 0.04 0.24 -0.57 2.22 1.01 0.00 -1.31 121.20 122.85 2rov s ILE 26 Ca 0.02 -0.11 -0.23 0.00 0.00 0.00 0.00 60.65 60.33 2rov s ILE 26 Cb -0.13 -0.64 0.05 0.00 0.01 0.00 0.00 42.46 41.75 2rov s ILE 26 CO 0.02 -0.02 0.88 -0.69 0.00 0.00 0.00 174.94 175.12 2rov s VAL 27 N 2.00 4.48 1.06 2.92 1.01 0.20 -0.19 120.40 131.89 2rov s VAL 27 Ca 0.02 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.80 2rov s VAL 27 Cb -0.15 -4.52 0.22 0.00 0.00 0.00 0.00 36.38 31.93 2rov s VAL 27 CO -0.07 -1.13 1.12 -0.55 0.00 0.00 0.00 175.10 174.48 2rov s SER 28 N 3.02 2.12 0.33 3.32 0.15 0.37 -3.90 113.70 119.11 2rov s SER 28 Ca 0.25 0.85 0.11 0.00 0.70 0.00 0.00 55.95 57.87 2rov s SER 28 Cb -0.15 -1.29 1.01 0.00 -1.71 0.00 0.00 66.02 63.87 2rov s SER 28 CO 0.15 -3.41 1.64 0.28 1.20 0.00 0.00 173.24 173.11 2rov h SER 29 N -2.09 0.28 -0.27 5.45 0.02 -1.99 -3.11 113.55 111.85 2rov h SER 29 Ca -0.50 0.21 -0.22 0.00 -0.84 0.00 0.00 61.79 60.45 2rov h SER 29 Cb 1.31 0.22 -0.28 0.00 0.14 0.00 0.00 62.40 63.78 2rov h SER 29 CO 0.48 -0.20 -0.73 0.29 -1.14 0.00 0.00 176.83 175.53 2rov n LYS 30 N -5.16 1.51 -3.65 3.45 5.02 -1.26 -4.90 118.16 113.17 2rov n LYS 30 Ca 0.29 -2.45 -0.02 0.00 -2.02 0.00 0.00 58.31 54.12 2rov n LYS 30 Cb 0.94 -0.65 -0.06 0.00 -0.02 0.00 0.00 35.03 35.23 2rov n LYS 30 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2rov s LYS 31 N -1.91 0.27 -0.14 1.97 2.20 -1.18 -3.92 119.74 117.03 2rov s LYS 31 Ca 0.19 0.43 -0.18 0.00 -0.36 0.00 0.00 55.97 56.06 2rov s LYS 31 Cb 0.39 0.07 -0.04 0.00 -1.51 0.00 0.00 37.83 36.74 2rov s LYS 31 CO -0.07 -0.05 0.46 0.42 -0.36 0.00 0.00 175.35 175.74 2rov s ILE 32 N 1.01 5.19 -0.07 5.43 1.01 0.21 0.14 121.20 134.12 2rov s ILE 32 Ca -0.06 0.89 0.03 0.00 0.00 0.00 0.00 60.65 61.51 2rov s ILE 32 Cb -0.03 -3.79 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 2rov s ILE 32 CO -0.12 0.30 -0.15 -0.76 0.00 0.00 0.00 174.94 174.21 2rov s LEU 33 N 0.83 2.66 -0.16 2.97 1.43 0.73 0.11 118.68 127.26 2rov s LEU 33 Ca 0.24 -0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 2rov s LEU 33 Cb -0.15 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.54 2rov s LEU 33 CO 0.09 0.29 -0.20 0.12 0.23 0.00 0.00 176.35 176.88 2rov s PHE 34 N -0.42 2.66 0.41 0.29 5.36 0.64 -0.82 117.98 126.10 2rov s PHE 34 Ca 0.05 -1.47 0.04 0.00 -0.96 0.00 0.00 56.93 54.59 2rov s PHE 34 Cb -0.12 -1.84 -0.04 0.00 -0.34 0.00 0.00 43.02 40.68 2rov s PHE 34 CO 0.02 -0.71 0.05 0.71 -1.46 0.00 0.00 175.22 173.83 2rov s TYR 35 N 1.10 2.02 -0.06 10.12 1.51 0.35 0.47 117.35 132.86 2rov s TYR 35 Ca -0.00 -0.97 0.11 0.00 -1.01 0.00 0.00 57.07 55.20 2rov s TYR 35 Cb -0.14 -1.45 -0.16 0.00 -0.11 0.00 0.00 41.96 40.10 2rov s TYR 35 CO -0.08 0.09 0.16 -0.40 -1.11 0.00 0.00 175.55 174.21 2rov n ASP 36 N -1.04 2.23 -2.57 2.29 5.68 -1.26 -2.40 116.55 119.48 2rov n ASP 36 Ca -0.08 0.00 -0.05 0.00 -0.50 0.00 0.00 54.79 54.16 2rov n ASP 36 Cb 0.66 1.18 0.02 0.00 -1.14 0.00 0.00 41.12 41.85 2rov n ASP 36 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2rov n SER 37 N -2.16 -1.64 0.11 -1.12 7.64 -1.26 -4.56 113.62 110.63 2rov n SER 37 Ca -0.10 -2.04 -0.03 0.00 1.01 0.00 0.00 58.87 57.71 2rov n SER 37 Cb 0.58 2.71 0.11 0.00 -1.01 0.00 0.00 64.21 66.60 2rov n SER 37 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2rov h GLU 38 N 0.00 0.05 -0.46 1.43 4.57 -1.99 -2.94 114.58 115.24 2rov h GLU 38 Ca -0.25 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 57.84 2rov h GLU 38 Cb 0.96 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.54 2rov h GLU 38 CO 0.32 0.72 0.09 1.96 -1.18 0.00 0.00 179.01 180.92 2rov h GLN 39 N 0.03 0.74 -0.05 1.92 7.50 -1.99 -1.35 115.11 121.92 2rov h GLN 39 Ca -0.01 -0.19 -0.09 0.00 0.50 0.00 0.00 58.65 58.86 2rov h GLN 39 Cb 1.23 -0.09 -0.01 0.00 0.05 0.00 0.00 27.48 28.65 2rov h GLN 39 CO 0.09 0.75 -0.38 -0.44 -1.50 0.00 0.00 178.83 177.35 2rov h ASP 40 N 0.61 0.10 0.02 1.46 5.19 -1.88 -1.92 116.42 119.99 2rov h ASP 40 Ca 0.14 -0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2rov h ASP 40 Cb 0.35 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.84 2rov h ASP 40 CO 0.01 0.47 -0.01 0.50 -3.12 0.00 0.00 179.24 177.09 2rov h LYS 41 N 0.08 -0.02 0.00 3.56 3.11 -1.30 -1.20 116.57 120.80 2rov h LYS 41 Ca 0.01 0.00 -0.04 0.00 -2.81 0.00 0.00 60.65 57.81 2rov h LYS 41 Cb 0.72 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.95 2rov h LYS 41 CO 0.05 0.49 -0.17 0.93 -2.81 0.00 0.00 179.45 177.95 2rov h GLU 42 N -0.55 0.00 0.00 1.90 4.39 -1.22 -1.06 114.58 118.04 2rov h GLU 42 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2rov h GLU 42 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2rov h GLU 42 CO 0.00 0.17 0.00 1.04 -1.16 0.00 0.00 179.01 179.07 2rov n GLN 43 N -4.20 0.59 -2.36 2.33 1.13 -0.73 -4.88 117.38 109.25 2rov n GLN 43 Ca -0.02 0.02 -0.16 0.00 -1.94 0.00 0.00 57.00 54.89 2rov n GLN 43 Cb 0.24 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.09 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 -1.18 -4.84 -3.97 1.08 2.88 -0.40 -4.96 113.62 102.23 2rov n SER 44 Ca 0.16 -0.04 -0.32 0.00 -1.33 0.00 0.00 58.87 57.35 2rov n SER 44 Cb 0.18 -3.93 -0.09 0.00 -0.75 0.00 0.00 64.21 59.62 2rov n SER 44 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2rov n ASN 45 N -1.13 3.73 -4.72 -3.46 4.05 -0.47 -5.05 115.26 108.20 2rov n ASN 45 Ca -0.18 -3.20 -0.42 0.00 0.45 0.00 0.00 54.58 51.24 2rov n ASN 45 Cb 0.64 -0.91 -0.03 0.00 1.23 0.00 0.00 39.78 40.71 2rov n ASN 45 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2rov s PRO 46 N -1.53 4.40 0.18 1.20 0.04 -1.26 -4.65 135.00 133.37 2rov s PRO 46 Ca 0.27 1.94 -0.12 0.00 0.04 0.00 0.00 61.00 63.13 2rov s PRO 46 Cb -0.04 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 31.32 2rov s PRO 46 CO -0.13 -0.27 1.74 -0.92 0.04 0.00 0.00 177.00 177.45 2rov h TYR 47 N 6.18 0.92 -1.66 0.56 5.03 -0.33 -3.44 116.97 124.23 2rov h TYR 47 Ca -0.43 -0.06 0.10 0.00 2.58 0.00 0.00 58.73 60.91 2rov h TYR 47 Cb 1.21 -0.28 -0.21 0.00 1.55 0.00 0.00 36.73 39.01 2rov h TYR 47 CO 0.65 0.73 -0.11 1.41 -1.32 0.00 0.00 178.16 179.52 2rov s MET 48 N -5.58 0.53 -0.21 1.82 0.00 -0.87 -5.00 119.30 109.98 2rov s MET 48 Ca -0.13 1.26 -0.04 0.00 0.00 0.00 0.00 55.69 56.79 2rov s MET 48 Cb 0.13 0.75 -0.01 0.00 0.00 0.00 0.00 34.83 35.70 2rov s MET 48 CO 0.80 -0.26 -0.05 0.08 0.00 0.00 0.00 175.02 175.58 2rov s VAL 49 N 2.84 3.36 0.17 10.11 1.01 -1.26 -0.26 120.40 136.38 2rov s VAL 49 Ca -0.01 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.50 2rov s VAL 49 Cb -0.12 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 2rov s VAL 49 CO -0.19 0.43 0.31 -0.76 0.00 0.00 0.00 175.10 174.89 2rov s LEU 50 N 1.38 4.32 -0.32 3.92 1.02 0.31 -4.92 118.68 124.39 2rov s LEU 50 Ca 0.05 0.17 -0.18 0.00 0.02 0.00 0.00 54.13 54.19 2rov s LEU 50 Cb -0.14 -2.92 -0.01 0.00 0.02 0.00 0.00 46.19 43.13 2rov s LEU 50 CO -0.03 0.01 0.50 -1.81 0.02 0.00 0.00 176.35 175.04 2rov s ASP 51 N -3.40 6.33 0.51 2.29 1.11 -1.26 0.66 116.67 122.91 2rov s ASP 51 Ca 0.35 0.11 0.20 0.00 0.18 0.00 0.00 52.55 53.38 2rov s ASP 51 Cb -0.11 -2.26 1.28 0.00 1.07 0.00 0.00 42.92 42.90 2rov s ASP 51 CO 0.29 -0.41 2.06 0.40 1.18 0.00 0.00 175.17 178.68 2rov h ILE 52 N 5.55 0.87 0.00 0.77 2.04 -1.89 0.94 117.51 125.79 2rov h ILE 52 Ca -0.28 -0.02 -0.09 0.00 1.00 0.00 0.00 64.86 65.46 2rov h ILE 52 Cb 1.13 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 2rov h ILE 52 CO 0.75 0.01 -0.45 -0.78 0.00 0.00 0.00 178.15 177.68 2rov h ASP 53 N 0.07 0.00 1.66 1.72 3.58 -1.92 -2.93 116.42 118.60 2rov h ASP 53 Ca 0.15 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.60 2rov h ASP 53 Cb 0.52 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.57 2rov h ASP 53 CO -0.01 0.45 0.00 0.11 -2.88 0.00 0.00 179.24 176.90 2rov h LYS 54 N 0.00 0.00 -6.74 0.28 1.57 -1.22 -3.43 116.57 107.02 2rov h LYS 54 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.20 2rov h LYS 54 Cb 1.01 0.00 0.17 0.00 0.08 0.00 0.00 32.23 33.49 2rov h LYS 54 CO 0.06 0.00 -0.07 1.28 -0.57 0.00 0.00 179.45 180.15 2rov n LEU 55 N -3.02 2.67 -0.04 2.94 4.77 -1.07 -3.05 117.00 120.20 2rov n LEU 55 Ca 0.03 0.75 -0.06 0.00 -0.03 0.00 0.00 56.01 56.70 2rov n LEU 55 Cb 0.45 -1.32 -0.03 0.00 -2.33 0.00 0.00 43.42 40.19 2rov n LEU 55 CO 0.31 -2.33 -0.75 0.49 -1.33 0.00 0.00 177.39 173.79 2rov n PHE 56 N -1.89 0.00 -3.30 -1.77 3.72 -0.24 -4.90 117.46 109.08 2rov n PHE 56 Ca 0.13 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.56 2rov n PHE 56 Cb 0.48 -0.29 -0.04 0.00 -0.94 0.00 0.00 39.48 38.69 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 -2.15 -0.23 -0.27 1.38 2.46 -1.24 -4.94 115.29 110.30 2rov s HIS 57 Ca -0.10 0.41 -0.02 0.00 0.47 0.00 0.00 55.06 55.82 2rov s HIS 57 Cb 0.03 0.14 0.03 0.00 -0.13 0.00 0.00 32.58 32.65 2rov s HIS 57 CO 0.17 -0.12 -0.04 0.54 -2.47 0.00 0.00 174.74 172.83 2rov s VAL 58 N 2.01 2.95 0.06 0.89 0.11 -1.26 -2.07 120.40 123.09 2rov s VAL 58 Ca -0.01 -1.14 0.01 0.00 -2.93 0.00 0.00 61.98 57.91 2rov s VAL 58 Cb -0.02 -2.57 -0.03 0.00 -1.53 0.00 0.00 36.38 32.23 2rov s VAL 58 CO -0.16 0.09 -0.06 -0.13 -3.33 0.00 0.00 175.10 171.51 2rov s ARG 59 N 1.31 0.64 0.66 1.54 1.81 -0.34 -4.91 118.95 119.66 2rov s ARG 59 Ca -0.02 -1.03 -0.18 0.00 -1.72 0.00 0.00 55.73 52.78 2rov s ARG 59 Cb -0.18 -0.16 -0.01 0.00 -0.45 0.00 0.00 34.95 34.16 2rov s ARG 59 CO -0.03 -0.01 1.27 -0.35 -0.68 0.00 0.00 175.30 175.51 2rov n PRO 60 N 0.70 1.06 -2.80 3.54 -0.04 -1.26 -0.90 135.00 135.29 2rov n PRO 60 Ca -0.18 0.42 -0.21 0.00 -0.04 0.00 0.00 63.50 63.49 2rov n PRO 60 Cb 0.58 -2.51 0.03 0.00 -0.04 0.00 0.00 33.50 31.55 2rov n PRO 60 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2rov s VAL 61 N -1.43 3.13 0.16 0.52 -7.23 0.16 -4.70 120.40 111.01 2rov s VAL 61 Ca 0.82 -0.66 0.01 0.00 -1.81 0.00 0.00 61.98 60.34 2rov s VAL 61 Cb -0.38 -3.15 -0.00 0.00 0.56 0.00 0.00 36.38 33.41 2rov s VAL 61 CO 0.41 -0.10 0.02 0.35 -0.31 0.00 0.00 175.10 175.47 2rov n THR 62 N -2.20 0.00 0.29 5.32 -2.24 -1.26 -4.63 114.28 109.56 2rov n THR 62 Ca 0.06 -0.80 0.18 0.00 -2.27 0.00 0.00 64.05 61.22 2rov n THR 62 Cb 0.59 0.21 0.91 0.00 -2.10 0.00 0.00 70.33 69.94 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 -1.91 -1.19 115.11 116.98 2rov h GLN 63 Ca -0.13 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.28 2rov h GLN 63 Cb 0.42 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 2rov h GLN 63 CO 0.21 0.00 -0.46 1.79 -2.65 0.00 0.00 178.83 177.71 2rov h THR 64 N 0.00 0.90 0.00 2.39 1.35 -2.02 -3.15 112.91 112.39 2rov h THR 64 Ca 0.00 -1.94 -0.07 0.00 -0.55 0.00 0.00 66.41 63.85 2rov h THR 64 Cb 0.10 2.21 -0.01 0.00 -1.73 0.00 0.00 68.15 68.72 2rov h THR 64 CO 0.00 0.45 -0.34 -0.78 -0.25 0.00 0.00 175.52 174.60 2rov h ASP 65 N 0.00 0.00 -4.19 5.36 1.82 -1.60 -3.45 116.42 114.36 2rov h ASP 65 Ca -0.00 0.00 -0.39 0.00 -0.39 0.00 0.00 57.03 56.25 2rov h ASP 65 Cb 1.17 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 41.09 2rov h ASP 65 CO 0.06 0.34 -0.34 1.33 -1.61 0.00 0.00 179.24 179.02 2rov n VAL 66 N -4.04 0.00 0.01 2.25 0.24 -1.19 -5.06 118.33 110.54 2rov n VAL 66 Ca -0.02 -1.76 0.00 0.00 -2.04 0.00 0.00 64.34 60.52 2rov n VAL 66 Cb 0.39 0.73 0.00 0.00 -1.47 0.00 0.00 33.84 33.49 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 -0.85 0.20 6.34 4.11 -1.26 -4.85 117.16 120.25 2rov n TYR 67 Ca -0.00 0.04 0.07 0.00 -0.00 0.00 0.00 57.90 58.01 2rov n TYR 67 Cb 0.45 0.56 0.35 0.00 -0.00 0.00 0.00 39.34 40.70 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 -1.98 -3.45 114.38 105.47 2rov h ARG 68 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 59.98 59.78 2rov h ARG 68 Cb 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 29.97 30.09 2rov h ARG 68 CO 0.00 0.32 -0.10 0.00 -0.00 0.00 0.00 179.97 180.19 2rov n ALA 69 N -2.25 -2.86 -2.54 0.08 0.00 -1.26 -5.02 120.51 106.65 2rov n ALA 69 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 53.44 52.29 2rov n ALA 69 Cb 0.50 -0.07 -0.14 0.00 0.00 0.00 0.00 19.45 19.73 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 -2.48 3.69 0.60 0.00 -1.08 -1.26 -5.00 116.67 111.14 2rov s ASP 70 Ca 0.36 -0.31 0.28 0.00 -0.52 0.00 0.00 52.55 52.37 2rov s ASP 70 Cb -0.06 -0.82 1.34 0.00 -1.46 0.00 0.00 42.92 41.91 2rov s ASP 70 CO 0.30 0.31 1.73 0.00 0.52 0.00 0.00 175.17 178.04 2rov h ALA 71 N 5.62 2.37 -0.31 3.66 0.00 -1.96 0.20 119.26 128.83 2rov h ALA 71 Ca -0.42 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.30 2rov h ALA 71 Cb 1.16 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2rov h ALA 71 CO 0.50 -0.99 -0.48 0.87 0.00 0.00 0.00 179.25 179.14 2rov h LYS 72 N 0.00 0.88 0.00 0.00 1.79 -2.03 -3.22 116.57 113.99 2rov h LYS 72 Ca 0.29 -0.53 -0.17 0.00 -2.18 0.00 0.00 60.65 58.06 2rov h LYS 72 Cb 1.65 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 32.32 2rov h LYS 72 CO -0.00 1.17 -0.80 1.05 -1.08 0.00 0.00 179.45 179.78 2rov h GLU 73 N 0.67 0.00 -0.69 3.15 4.11 -1.05 -3.35 114.58 117.43 2rov h GLU 73 Ca 0.03 0.00 0.13 0.00 0.07 0.00 0.00 59.36 59.59 2rov h GLU 73 Cb 1.09 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.20 2rov h GLU 73 CO 0.11 0.80 -0.22 0.82 0.07 0.00 0.00 179.01 180.59 2rov h ILE 74 N 0.00 0.26 0.00 -1.06 1.08 -1.34 0.67 117.51 117.11 2rov h ILE 74 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 2rov h ILE 74 Cb 1.61 0.26 0.00 0.00 -3.07 0.00 0.00 36.82 35.61 2rov h ILE 74 CO 0.10 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.75 2rov n PRO 75 N -5.47 0.02 -0.11 2.37 -0.04 -1.26 -1.95 135.00 128.57 2rov n PRO 75 Ca 0.08 0.26 0.10 0.00 -0.04 0.00 0.00 63.50 63.91 2rov n PRO 75 Cb 0.36 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.48 2.15 -4.73 0.54 1.74 0.23 -4.77 116.66 110.34 2rov n ARG 76 Ca 0.03 -1.99 -0.33 0.00 -0.77 0.00 0.00 57.85 54.79 2rov n ARG 76 Cb 0.15 -1.43 -0.13 0.00 -1.02 0.00 0.00 32.46 30.03 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 -1.45 3.26 0.26 0.55 1.01 -0.80 0.89 121.20 124.92 2rov s ILE 77 Ca 0.30 -0.61 0.07 0.00 0.00 0.00 0.00 60.65 60.41 2rov s ILE 77 Cb 0.19 -2.35 -0.05 0.00 0.01 0.00 0.00 42.46 40.25 2rov s ILE 77 CO 0.27 0.55 -0.08 0.72 0.00 0.00 0.00 174.94 176.39 2rov s PHE 78 N -0.06 1.90 -0.02 3.97 -0.71 -0.87 -0.67 117.98 121.52 2rov s PHE 78 Ca -0.02 -0.67 0.05 0.00 -1.04 0.00 0.00 56.93 55.26 2rov s PHE 78 Cb -0.14 -1.04 -0.01 0.00 -1.21 0.00 0.00 43.02 40.62 2rov s PHE 78 CO 0.04 0.30 -0.18 -1.14 -1.34 0.00 0.00 175.22 172.89 2rov s GLN 79 N -3.71 1.58 -0.20 1.99 0.74 -0.08 -1.97 119.66 118.02 2rov s GLN 79 Ca 0.28 -0.65 0.01 0.00 0.05 0.00 0.00 55.36 55.05 2rov s GLN 79 Cb 0.03 -1.48 0.04 0.00 1.10 0.00 0.00 33.01 32.69 2rov s GLN 79 CO 0.11 0.36 -0.13 0.42 -0.55 0.00 0.00 175.29 175.49 2rov s ILE 80 N -0.31 1.82 0.08 -2.34 1.09 -0.38 -1.20 121.20 119.96 2rov s ILE 80 Ca 0.04 -1.03 -0.20 0.00 -1.10 0.00 0.00 60.65 58.36 2rov s ILE 80 Cb -0.08 -1.80 -0.07 0.00 -1.06 0.00 0.00 42.46 39.45 2rov s ILE 80 CO 0.00 0.28 0.60 -0.22 -0.10 0.00 0.00 174.94 175.50 2rov s LEU 81 N 1.34 4.53 -0.07 2.97 2.96 -0.88 -0.19 118.68 129.33 2rov s LEU 81 Ca 0.00 1.30 -0.16 0.00 -0.22 0.00 0.00 54.13 55.05 2rov s LEU 81 Cb -0.15 -2.95 0.03 0.00 0.50 0.00 0.00 46.19 43.62 2rov s LEU 81 CO -0.09 0.25 0.37 -0.72 -1.32 0.00 0.00 176.35 174.84 2rov s TYR 82 N -1.02 -0.32 -0.07 5.38 1.13 0.25 -1.08 117.35 121.62 2rov s TYR 82 Ca 0.30 0.64 -0.30 0.00 -1.41 0.00 0.00 57.07 56.30 2rov s TYR 82 Cb -0.20 0.14 -0.04 0.00 -1.10 0.00 0.00 41.96 40.76 2rov s TYR 82 CO 0.20 -0.34 1.43 0.00 -2.51 0.00 0.00 175.55 174.33 2rov s ALA 83 N -0.73 3.62 -0.25 9.51 0.00 -1.17 -1.65 121.76 131.09 2rov s ALA 83 Ca -0.08 0.75 -0.04 0.00 0.00 0.00 0.00 51.96 52.59 2rov s ALA 83 Cb -0.04 -3.65 -0.16 0.00 0.00 0.00 0.00 23.12 19.27 2rov s ALA 83 CO 0.03 -1.14 -0.20 0.27 0.00 0.00 0.00 175.76 174.72 2rov n ASN 84 N 6.31 1.98 0.00 0.00 0.23 -1.26 -4.84 115.26 117.68 2rov n ASN 84 Ca 0.15 0.05 0.00 0.00 -0.53 0.00 0.00 54.58 54.25 2rov n ASN 84 Cb 0.44 -0.59 0.00 0.00 -2.08 0.00 0.00 39.78 37.55 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 -3.62 0.00 0.00 -3.83 1.02 -1.26 -5.06 120.64 107.89 2rov n GLU 85 Ca -0.47 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.67 2rov n GLU 85 Cb 0.95 -0.85 0.00 0.00 -0.02 0.00 0.00 31.44 31.52 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 3.15 0.90 1.85 0.62 0.00 -1.26 -5.07 105.19 105.37 2rov n GLY 86 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 0.08 0.12 -0.61 -0.00 -1.26 -4.71 119.36 112.97 2rov n ILE 87 Ca 0.00 0.03 0.08 0.00 -0.00 0.00 0.00 62.75 62.86 2rov n ILE 87 Cb 0.00 -0.37 0.56 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 0.19 1.77 4.38 0.87 -2.00 -0.30 113.55 118.46 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 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2rov h SER 88 CO 0.00 0.13 0.00 0.28 -0.53 0.00 0.00 176.83 176.71 2rov h SER 89 N 0.22 0.00 -0.79 6.23 0.02 -1.97 -3.46 113.55 113.80 2rov h SER 89 Ca 0.10 0.00 -0.77 0.00 -0.84 0.00 0.00 61.79 60.28 2rov h SER 89 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2rov h SER 89 CO -0.02 0.00 0.67 0.00 -1.14 0.00 0.00 176.83 176.34 2rov n ALA 90 N -2.06 -1.05 -2.19 3.77 0.00 -0.12 -4.70 120.51 114.15 2rov n ALA 90 Ca 0.04 0.41 -0.18 0.00 0.00 0.00 0.00 53.44 53.71 2rov n ALA 90 Cb 0.48 -1.72 0.13 0.00 0.00 0.00 0.00 19.45 18.34 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 3.89 -0.44 -4.27 0.00 4.76 -0.66 -4.72 118.16 116.71 2rov n LYS 91 Ca 0.30 -1.96 -0.15 0.00 -2.87 0.00 0.00 58.31 53.63 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 -4.56 1.54 -0.09 4.39 6.03 -1.26 -0.58 114.94 120.41 2rov s ASN 92 Ca 0.57 -1.16 0.03 0.00 -1.03 0.00 0.00 52.86 51.27 2rov s ASN 92 Cb -0.02 0.05 0.01 0.00 -3.03 0.00 0.00 41.25 38.26 2rov s ASN 92 CO 0.39 -0.50 -0.19 -0.22 -2.03 0.00 0.00 177.10 174.54 2rov s LEU 93 N -3.22 1.91 -0.26 3.54 0.20 0.73 -4.90 118.68 116.69 2rov s LEU 93 Ca 0.24 -0.47 -0.11 0.00 0.69 0.00 0.00 54.13 54.48 2rov s LEU 93 Cb 0.05 -1.20 -0.05 0.00 -0.43 0.00 0.00 46.19 44.56 2rov s LEU 93 CO 0.05 0.10 0.17 -0.76 -0.29 0.00 0.00 176.35 175.62 2rov s LEU 94 N 0.54 4.06 -0.12 -0.68 2.01 -1.26 -1.25 118.68 121.98 2rov s LEU 94 Ca -0.15 0.05 -0.01 0.00 0.01 0.00 0.00 54.13 54.03 2rov s LEU 94 Cb -0.17 -2.11 0.03 0.00 0.01 0.00 0.00 46.19 43.95 2rov s LEU 94 CO 0.05 0.01 -0.06 -0.76 1.01 0.00 0.00 176.35 176.60 2rov s LEU 95 N 1.41 1.19 -0.07 1.79 1.43 -0.83 -4.41 118.68 119.19 2rov s LEU 95 Ca 0.07 -0.35 -0.20 0.00 -1.03 0.00 0.00 54.13 52.63 2rov s LEU 95 Cb -0.15 -0.80 -0.04 0.00 0.03 0.00 0.00 46.19 45.22 2rov s LEU 95 CO 0.08 -0.14 0.55 -0.22 0.23 0.00 0.00 176.35 176.85 2rov s LEU 96 N 1.73 4.33 -0.14 1.79 2.96 0.20 -2.05 118.68 127.50 2rov s LEU 96 Ca 0.04 0.99 -0.07 0.00 -0.22 0.00 0.00 54.13 54.87 2rov s LEU 96 Cb -0.13 -2.83 -0.04 0.00 0.50 0.00 0.00 46.19 43.69 2rov s LEU 96 CO -0.08 0.02 0.12 0.00 -1.32 0.00 0.00 176.35 175.09 2rov s ALA 97 N 0.37 3.76 0.55 5.97 0.00 0.26 -0.79 121.76 131.89 2rov s ALA 97 Ca 0.30 -0.67 0.26 0.00 0.00 0.00 0.00 51.96 51.85 2rov s ALA 97 Cb -0.17 -1.98 1.46 0.00 0.00 0.00 0.00 23.12 22.43 2rov s ALA 97 CO 0.14 0.48 2.01 -0.91 0.00 0.00 0.00 175.76 177.48 2rov h ASN 98 N 5.51 0.00 -4.70 0.00 2.35 -1.85 -3.42 115.58 113.47 2rov h ASN 98 Ca -0.50 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.01 2rov h ASN 98 Cb 1.20 0.00 -0.22 0.00 0.05 0.00 0.00 38.32 39.35 2rov h ASN 98 CO 0.63 0.00 -0.72 -0.44 -1.65 0.00 0.00 177.43 175.25 2rov s SER 99 N -6.03 0.54 0.18 5.81 0.01 -1.26 -5.05 113.70 107.90 2rov s SER 99 Ca -0.05 -0.45 -0.13 0.00 1.31 0.00 0.00 55.95 56.63 2rov s SER 99 Cb 0.18 0.05 0.16 0.00 0.21 0.00 0.00 66.02 66.62 2rov s SER 99 CO 0.66 -0.20 1.74 0.74 0.41 0.00 0.00 173.24 176.59 2rov h THR 100 N 4.64 0.81 -0.81 1.44 2.02 -1.86 -0.85 112.91 118.29 2rov h THR 100 Ca -0.33 -0.11 0.17 0.00 0.77 0.00 0.00 66.41 66.91 2rov h THR 100 Cb 1.20 0.47 -0.06 0.00 -1.74 0.00 0.00 68.15 68.03 2rov h THR 100 CO 0.42 0.06 0.54 -0.33 0.37 0.00 0.00 175.52 176.58 2rov h GLU 101 N 0.31 0.41 -0.71 6.66 5.08 -1.97 0.42 114.58 124.78 2rov h GLU 101 Ca 0.23 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.52 2rov h GLU 101 Cb 0.26 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2rov h GLU 101 CO -0.26 0.27 0.25 1.49 -1.00 0.00 0.00 179.01 179.77 2rov h GLU 102 N 0.42 1.08 -0.52 2.33 4.57 -1.54 -1.79 114.58 119.12 2rov h GLU 102 Ca 0.41 -0.21 -0.09 0.00 -1.18 0.00 0.00 59.36 58.29 2rov h GLU 102 Cb 0.96 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.36 2rov h GLU 102 CO -0.14 0.90 -0.04 0.37 -1.18 0.00 0.00 179.01 178.92 2rov h GLN 103 N 1.05 0.91 -0.38 1.92 -0.00 -0.80 0.22 115.11 118.03 2rov h GLN 103 Ca 0.24 -0.28 -0.10 0.00 -0.00 0.00 0.00 58.65 58.50 2rov h GLN 103 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 27.48 27.63 2rov h GLN 103 CO -0.01 0.93 -0.18 1.96 0.00 0.00 0.00 178.83 181.52 2rov h GLN 104 N 0.83 0.72 0.00 1.69 1.08 -1.09 -1.72 115.11 116.63 2rov h GLN 104 Ca 0.15 -0.27 -0.03 0.00 -1.45 0.00 0.00 58.65 57.05 2rov h GLN 104 Cb 0.54 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2rov h GLN 104 CO 0.03 0.86 -0.10 -0.22 -0.95 0.00 0.00 178.83 178.45 2rov h LYS 105 N 0.64 0.06 -0.04 1.46 3.64 -1.08 -1.93 116.57 119.32 2rov h LYS 105 Ca 0.10 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 2rov h LYS 105 Cb 0.67 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 2rov h LYS 105 CO 0.05 0.88 -0.11 -1.49 -2.27 0.00 0.00 179.45 176.51 2rov h TRP 106 N -0.72 -0.27 0.11 1.91 4.06 -0.59 0.49 115.95 120.94 2rov h TRP 106 Ca -0.01 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2rov h TRP 106 Cb 0.92 0.13 0.00 0.00 -1.00 0.00 0.00 29.16 29.20 2rov h TRP 106 CO 0.21 -0.16 -0.05 0.28 -3.56 0.00 0.00 178.44 175.16 2rov h VAL 107 N -0.16 1.06 -0.56 1.49 2.07 -1.44 0.82 116.25 119.52 2rov h VAL 107 Ca 0.05 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 2rov h VAL 107 Cb 0.24 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2rov h VAL 107 CO -0.14 0.16 0.25 -1.28 0.02 0.00 0.00 177.57 176.58 2rov h SER 108 N -0.44 0.73 0.10 0.57 0.87 -1.27 0.87 113.55 114.97 2rov h SER 108 Ca -0.01 -0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2rov h SER 108 Cb 0.36 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 2rov h SER 108 CO 0.02 0.64 -0.05 0.03 -0.53 0.00 0.00 176.83 176.94 2rov h ARG 109 N 0.80 -0.13 -0.73 2.24 2.47 0.02 -1.93 114.38 117.11 2rov h ARG 109 Ca 0.20 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.92 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 0.37 0.43 1.37 0.56 0.00 0.00 179.97 182.68 2rov h LEU 110 N -0.90 0.88 -0.27 3.04 8.10 -0.81 -1.43 115.31 123.92 2rov h LEU 110 Ca -0.01 -0.05 -0.15 0.00 0.11 0.00 0.00 57.88 57.77 2rov h LEU 110 Cb 0.55 -0.22 -0.00 0.00 -0.44 0.00 0.00 40.66 40.55 2rov h LEU 110 CO 0.02 0.68 -0.43 1.62 -4.11 0.00 0.00 178.44 176.22 2rov h VAL 111 N 1.01 1.30 0.00 0.15 3.04 -0.92 -2.95 116.25 117.87 2rov h VAL 111 Ca 0.26 -1.62 -0.03 0.00 -1.01 0.00 0.00 66.70 64.30 2rov h VAL 111 Cb -0.03 1.68 -0.00 0.00 -2.01 0.00 0.00 31.29 30.92 2rov h VAL 111 CO -0.05 0.52 -0.15 0.11 -1.01 0.00 0.00 177.57 176.99 2rov h LYS 112 N 0.50 0.00 0.00 4.17 1.57 -0.96 -1.63 116.57 120.23 2rov h LYS 112 Ca 0.02 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2rov h LYS 112 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 2rov h LYS 112 CO 0.10 0.15 -0.19 0.87 -0.57 0.00 0.00 179.45 179.81 2rov h LYS 113 N 0.00 0.00 -6.74 3.15 1.57 -1.11 -3.45 116.57 109.99 2rov h LYS 113 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2rov h LYS 113 Cb 0.33 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.71 2rov h LYS 113 CO 0.02 0.19 0.92 -0.89 -0.57 0.00 0.00 179.45 179.12 2rov n ILE 114 N -3.21 0.65 0.01 1.86 5.41 -0.61 -4.89 119.36 118.58 2rov n ILE 114 Ca 0.02 -0.16 -0.18 0.00 1.00 0.00 0.00 62.75 63.43 2rov n ILE 114 Cb 0.53 -1.95 -0.11 0.00 -0.71 0.00 0.00 39.64 37.39 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 5.48 0.43 -1.51 0.38 0.13 -1.88 -3.32 132.00 131.71 2rov h PRO 115 Ca -0.46 -0.47 -0.69 0.00 -0.87 0.00 0.00 66.00 63.51 2rov h PRO 115 Cb 1.22 0.14 -0.32 0.00 0.13 0.00 0.00 31.00 32.17 2rov h PRO 115 CO 0.85 1.13 0.54 1.63 -0.23 0.00 0.00 178.00 181.92 2rov n LYS 116 N -4.18 2.93 0.00 0.86 5.02 -1.26 -5.15 118.16 116.38 2rov n LYS 116 Ca -0.11 -3.67 0.00 0.00 -2.02 0.00 0.00 58.31 52.51 2rov n LYS 116 Cb 0.70 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.44 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05