#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 0.50 -1.40 1.43 0.00 -1.26 -5.09 116.66 110.83 2rov n ARG 2 Ca 0.00 -1.56 -0.54 0.00 -0.00 0.00 0.00 57.85 55.75 2rov n ARG 2 Cb 0.00 1.62 -0.09 0.00 -0.00 0.00 0.00 32.46 33.99 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 1.70 -3.64 2.89 7.94 -1.26 -4.85 117.00 119.79 2rov n LEU 3 Ca -0.01 0.54 -0.10 0.00 -1.11 0.00 0.00 56.01 55.33 2rov n LEU 3 Cb 0.35 -1.14 -0.04 0.00 0.53 0.00 0.00 43.42 43.12 2rov n LEU 3 CO 0.17 -0.72 0.22 -1.83 -1.11 0.00 0.00 177.39 174.11 2rov s GLU 4 N 5.96 1.18 0.00 1.96 -1.05 -1.26 0.72 118.70 126.21 2rov s GLU 4 Ca 1.12 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 55.21 2rov s GLU 4 Cb -1.08 0.50 0.00 0.00 -0.44 0.00 0.00 34.13 33.11 2rov s GLU 4 CO 0.56 -0.48 0.00 0.41 0.95 0.00 0.00 175.26 176.70 2rov n GLY 5 N -0.28 0.24 3.17 -3.83 0.00 0.08 -4.98 105.19 99.59 2rov n GLY 5 Ca -0.14 -1.35 -0.32 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 -3.62 2.63 0.10 1.61 0.52 -1.26 0.31 118.94 119.24 2rov s TRP 6 Ca 0.00 -1.32 0.10 0.00 0.02 0.00 0.00 56.10 54.90 2rov s TRP 6 Cb 0.00 -1.79 -0.04 0.00 -1.15 0.00 0.00 33.47 30.49 2rov s TRP 6 CO 0.00 -0.60 -0.26 -0.51 0.02 0.00 0.00 176.95 175.59 2rov s LEU 7 N 0.80 2.27 0.09 2.99 1.43 -0.49 -4.79 118.68 120.98 2rov s LEU 7 Ca -0.07 -0.69 -0.16 0.00 -1.03 0.00 0.00 54.13 52.17 2rov s LEU 7 Cb -0.16 -1.23 -0.07 0.00 0.03 0.00 0.00 46.19 44.77 2rov s LEU 7 CO -0.02 0.20 0.53 -0.44 0.23 0.00 0.00 176.35 176.86 2rov s SER 8 N -1.78 6.92 0.14 2.29 0.01 0.39 0.51 113.70 122.19 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 63.78 2rov s SER 8 CO 0.05 0.21 -0.16 -0.76 0.41 0.00 0.00 173.24 172.99 2rov s LEU 9 N -1.48 2.43 -0.32 2.44 1.02 -0.94 0.43 118.68 122.27 2rov s LEU 9 Ca 0.32 -0.84 -0.28 0.00 0.02 0.00 0.00 54.13 53.35 2rov s LEU 9 Cb -0.17 -0.68 -0.04 0.00 0.02 0.00 0.00 46.19 45.32 2rov s LEU 9 CO 0.18 -0.09 2.08 -2.16 0.02 0.00 0.00 176.35 176.37 2rov s PRO 10 N -2.77 3.03 0.28 1.29 0.04 -1.26 -2.80 135.00 132.81 2rov s PRO 10 Ca 0.13 1.65 0.06 0.00 0.04 0.00 0.00 61.00 62.88 2rov s PRO 10 Cb -0.05 -4.34 -0.03 0.00 0.04 0.00 0.00 34.50 30.12 2rov s PRO 10 CO 0.05 -2.22 0.33 0.54 0.04 0.00 0.00 177.00 175.74 2rov s VAL 11 N 8.39 4.43 -0.38 -0.36 0.11 -1.01 -4.95 120.40 126.62 2rov s VAL 11 Ca 0.91 -1.18 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 2rov s VAL 11 Cb -0.26 -3.50 0.13 0.00 -1.53 0.00 0.00 36.38 31.22 2rov s VAL 11 CO 0.32 -0.26 0.20 -0.13 -3.33 0.00 0.00 175.10 171.90 2rov s ARG 12 N -3.99 0.89 0.31 1.54 3.00 -1.26 -1.99 118.95 117.44 2rov s ARG 12 Ca 0.38 -1.54 0.06 0.00 0.00 0.00 0.00 55.73 54.63 2rov s ARG 12 Cb -0.08 -1.88 0.87 0.00 0.00 0.00 0.00 34.95 33.85 2rov s ARG 12 CO 0.28 -1.14 1.62 -0.91 0.00 0.00 0.00 175.30 175.15 2rov h ASN 13 N 7.17 -0.01 0.00 0.23 2.35 -1.93 -3.41 115.58 119.98 2rov h ASN 13 Ca -0.02 0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2rov h ASN 13 Cb 0.96 0.31 0.00 0.00 0.05 0.00 0.00 38.32 39.64 2rov h ASN 13 CO 0.41 -0.25 0.00 0.59 -1.65 0.00 0.00 177.43 176.53 2rov n ASN 14 N -5.28 0.00 0.00 5.81 3.02 -1.26 -5.05 115.26 112.50 2rov n ASN 14 Ca 0.26 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 2rov n ASN 14 Cb 0.83 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.00 2rov n ASN 14 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2rov n THR 15 N -1.56 0.00 0.06 3.41 -2.24 -1.26 -4.92 114.28 107.76 2rov n THR 15 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 2rov n THR 15 Cb 0.00 -0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.10 2rov n THR 15 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2rov h LYS 16 N 0.00 0.00 -7.20 -0.78 3.64 -1.98 -3.47 116.57 106.78 2rov h LYS 16 Ca 0.00 0.00 -0.46 0.00 -1.27 0.00 0.00 60.65 58.92 2rov h LYS 16 Cb 0.00 0.00 0.08 0.00 -0.41 0.00 0.00 32.23 31.90 2rov h LYS 16 CO 0.00 0.30 0.15 0.21 -2.27 0.00 0.00 179.45 177.85 2rov s LYS 17 N -2.97 1.88 0.00 1.90 2.20 -1.26 -5.08 119.74 116.42 2rov s LYS 17 Ca -0.01 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 54.90 2rov s LYS 17 Cb 0.09 -2.25 0.00 0.00 -1.51 0.00 0.00 37.83 34.15 2rov s LYS 17 CO 0.80 -1.35 0.00 1.97 -0.36 0.00 0.00 175.35 176.40 2rov n PHE 18 N -2.87 0.00 0.00 4.03 1.16 -1.26 -4.03 117.46 114.49 2rov n PHE 18 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.69 2rov n PHE 18 Cb 0.60 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.47 2rov n PHE 18 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2rov n GLY 19 N -0.38 4.34 3.05 4.97 0.00 -0.84 -4.94 105.19 111.39 2rov n GLY 19 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 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 1.62 0.80 -0.14 1.61 0.52 -1.26 -2.41 118.94 119.68 2rov s TRP 20 Ca 0.00 -0.29 -0.04 0.00 0.02 0.00 0.00 56.10 55.79 2rov s TRP 20 Cb 0.00 -0.49 0.06 0.00 -1.15 0.00 0.00 33.47 31.89 2rov s TRP 20 CO 0.00 -0.02 0.11 0.54 0.02 0.00 0.00 176.95 177.60 2rov s VAL 21 N -0.69 -0.15 -0.34 4.03 0.11 -1.12 -4.88 120.40 117.36 2rov s VAL 21 Ca -0.01 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.75 2rov s VAL 21 Cb -0.06 -0.48 0.00 0.00 -1.53 0.00 0.00 36.38 34.31 2rov s VAL 21 CO 0.00 -0.14 1.39 -1.59 -3.33 0.00 0.00 175.10 171.43 2rov s LYS 22 N 2.19 3.75 0.08 1.54 -2.85 -1.24 -2.21 119.74 120.99 2rov s LYS 22 Ca 0.03 1.16 0.02 0.00 -1.00 0.00 0.00 55.97 56.18 2rov s LYS 22 Cb -0.15 -3.96 -0.04 0.00 -2.06 0.00 0.00 37.83 31.62 2rov s LYS 22 CO -0.08 -1.34 0.13 0.15 0.10 0.00 0.00 175.35 174.31 2rov s LYS 23 N 4.57 3.08 -0.46 1.78 -0.14 0.18 -4.69 119.74 124.07 2rov s LYS 23 Ca 0.60 -0.61 -0.28 0.00 -1.36 0.00 0.00 55.97 54.32 2rov s LYS 23 Cb -0.16 -2.83 -0.02 0.00 -1.68 0.00 0.00 37.83 33.14 2rov s LYS 23 CO 0.28 0.58 1.77 -0.47 -0.76 0.00 0.00 175.35 176.75 2rov s TYR 24 N -1.45 1.82 -0.13 3.18 6.14 -1.08 -1.40 117.35 124.43 2rov s TYR 24 Ca 0.31 0.70 -0.03 0.00 0.64 0.00 0.00 57.07 58.70 2rov s TYR 24 Cb -0.12 -4.14 -0.03 0.00 0.42 0.00 0.00 41.96 38.09 2rov s TYR 24 CO 0.24 -2.54 -0.03 0.08 0.64 0.00 0.00 175.55 173.94 2rov s VAL 25 N 7.64 3.98 -0.11 3.14 1.01 0.15 -0.87 120.40 135.34 2rov s VAL 25 Ca 0.72 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 62.32 2rov s VAL 25 Cb -0.17 -2.71 0.05 0.00 0.00 0.00 0.00 36.38 33.55 2rov s VAL 25 CO 0.28 0.54 0.07 -0.63 0.00 0.00 0.00 175.10 175.36 2rov s ILE 26 N -0.12 -0.08 -0.57 2.22 1.01 -0.78 -0.74 121.20 122.14 2rov s ILE 26 Ca 0.03 0.10 -0.24 0.00 0.00 0.00 0.00 60.65 60.54 2rov s ILE 26 Cb -0.13 -0.39 0.05 0.00 0.01 0.00 0.00 42.46 42.00 2rov s ILE 26 CO 0.02 -0.06 0.95 -0.69 0.00 0.00 0.00 174.94 175.16 2rov s VAL 27 N 2.14 4.37 0.71 2.92 1.01 0.22 -0.41 120.40 131.36 2rov s VAL 27 Ca 0.03 0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.08 2rov s VAL 27 Cb -0.14 -4.57 0.01 0.00 0.00 0.00 0.00 36.38 31.69 2rov s VAL 27 CO -0.06 -1.18 1.09 -0.55 0.00 0.00 0.00 175.10 174.40 2rov s SER 28 N 2.98 5.43 -0.34 3.32 0.15 0.29 -4.02 113.70 121.51 2rov s SER 28 Ca 0.29 1.17 -0.30 0.00 0.70 0.00 0.00 55.95 57.81 2rov s SER 28 Cb -0.13 -1.99 -0.08 0.00 -1.71 0.00 0.00 66.02 62.11 2rov s SER 28 CO 0.18 -1.35 2.27 -0.24 1.20 0.00 0.00 173.24 175.29 2rov n SER 29 N -3.02 2.57 -1.54 5.45 2.88 -1.26 -0.42 113.62 118.27 2rov n SER 29 Ca 0.07 0.15 -0.14 0.00 -1.33 0.00 0.00 58.87 57.62 2rov n SER 29 Cb 0.57 -1.43 -0.01 0.00 -0.75 0.00 0.00 64.21 62.58 2rov n SER 29 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2rov n LYS 30 N 8.60 -1.10 -3.49 -1.46 4.76 -1.26 -4.98 118.16 119.22 2rov n LYS 30 Ca 0.37 0.70 -0.13 0.00 -2.87 0.00 0.00 58.31 56.38 2rov n LYS 30 Cb 0.37 -4.96 -0.04 0.00 -1.84 0.00 0.00 35.03 28.56 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 -4.56 1.02 -0.13 1.97 2.20 0.44 -4.13 119.74 116.55 2rov s LYS 31 Ca 0.00 -0.10 0.01 0.00 -0.36 0.00 0.00 55.97 55.52 2rov s LYS 31 Cb 0.00 0.47 0.02 0.00 -1.51 0.00 0.00 37.83 36.81 2rov s LYS 31 CO 0.00 -0.39 -0.16 0.42 -0.36 0.00 0.00 175.35 174.86 2rov s ILE 32 N -2.39 1.59 0.05 5.43 1.01 0.23 0.11 121.20 127.23 2rov s ILE 32 Ca -0.03 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 59.98 2rov s ILE 32 Cb -0.01 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2rov s ILE 32 CO -0.02 0.46 -0.01 -0.76 0.00 0.00 0.00 174.94 174.61 2rov s LEU 33 N 1.13 3.45 -0.04 2.97 1.43 0.45 0.12 118.68 128.19 2rov s LEU 33 Ca -0.03 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2rov s LEU 33 Cb -0.14 -2.10 0.03 0.00 0.03 0.00 0.00 46.19 44.01 2rov s LEU 33 CO -0.05 0.22 -0.01 0.12 0.23 0.00 0.00 176.35 176.87 2rov s PHE 34 N -1.20 0.47 0.34 0.29 2.19 0.28 -1.86 117.98 118.49 2rov s PHE 34 Ca 0.23 -0.07 0.04 0.00 0.33 0.00 0.00 56.93 57.46 2rov s PHE 34 Cb -0.12 -0.54 -0.03 0.00 -1.31 0.00 0.00 43.02 41.02 2rov s PHE 34 CO 0.14 -0.18 0.16 0.71 1.83 0.00 0.00 175.22 177.89 2rov s TYR 35 N 1.19 1.69 -0.06 10.12 1.51 -0.05 -0.09 117.35 131.66 2rov s TYR 35 Ca -0.07 -1.36 0.10 0.00 -1.01 0.00 0.00 57.07 54.73 2rov s TYR 35 Cb -0.13 -0.95 -0.15 0.00 -0.11 0.00 0.00 41.96 40.61 2rov s TYR 35 CO -0.02 -0.47 0.14 -3.47 -1.11 0.00 0.00 175.55 170.62 2rov n ASP 36 N -1.10 2.40 -3.63 2.29 2.03 -1.26 -2.64 116.55 114.64 2rov n ASP 36 Ca -0.00 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.27 2rov n ASP 36 Cb 0.65 1.11 -0.01 0.00 -0.72 0.00 0.00 41.12 42.14 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 -3.84 -0.20 0.41 1.67 0.01 -1.26 -4.44 113.70 106.05 2rov s SER 37 Ca -0.05 -0.18 0.14 0.00 1.31 0.00 0.00 55.95 57.18 2rov s SER 37 Cb 0.05 0.34 0.87 0.00 0.21 0.00 0.00 66.02 67.49 2rov s SER 37 CO 0.45 -0.61 1.90 -0.33 0.41 0.00 0.00 173.24 175.07 2rov h GLU 38 N 2.00 0.00 -0.51 12.44 5.08 -1.99 -2.29 114.58 129.31 2rov h GLU 38 Ca -0.23 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 2rov h GLU 38 Cb 1.22 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 2rov h GLU 38 CO 0.27 0.28 0.34 1.96 -1.00 0.00 0.00 179.01 180.86 2rov h GLN 39 N 0.00 0.66 -0.00 2.33 4.20 -2.01 -1.88 115.11 118.42 2rov h GLN 39 Ca -0.00 -0.04 -0.16 0.00 0.06 0.00 0.00 58.65 58.51 2rov h GLN 39 Cb 0.51 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 2rov h GLN 39 CO 0.04 0.44 -0.75 -0.44 -0.67 0.00 0.00 178.83 177.44 2rov h ASP 40 N 0.68 0.03 -0.41 1.46 5.19 -1.88 -3.24 116.42 118.25 2rov h ASP 40 Ca 0.19 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.58 2rov h ASP 40 Cb -0.07 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.42 2rov h ASP 40 CO -0.05 0.77 0.24 0.50 -3.12 0.00 0.00 179.24 177.58 2rov h LYS 41 N 0.01 0.56 0.00 3.56 3.11 -0.91 -2.06 116.57 120.84 2rov h LYS 41 Ca -0.01 -0.06 -0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2rov h LYS 41 Cb 1.33 -0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 32.44 2rov h LYS 41 CO 0.10 0.43 -0.01 0.93 -2.81 0.00 0.00 179.45 178.09 2rov h GLU 42 N 0.54 0.00 0.00 1.90 5.08 -1.38 0.64 114.58 121.35 2rov h GLU 42 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2rov h GLU 42 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2rov h GLU 42 CO -0.03 0.01 0.00 1.04 -1.00 0.00 0.00 179.01 179.04 2rov n GLN 43 N -4.36 0.54 -3.34 2.33 1.13 -0.79 -4.90 117.38 107.99 2rov n GLN 43 Ca -0.03 0.02 -0.18 0.00 -1.94 0.00 0.00 57.00 54.87 2rov n GLN 43 Cb 0.10 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.01 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 -1.21 -5.09 -3.90 1.08 7.64 0.22 -4.99 113.62 107.37 2rov n SER 44 Ca 0.16 -0.43 -0.29 0.00 1.01 0.00 0.00 58.87 59.31 2rov n SER 44 Cb 0.19 -4.09 -0.13 0.00 -1.01 0.00 0.00 64.21 59.17 2rov n SER 44 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2rov s ASN 45 N -3.34 4.31 -0.11 6.43 3.84 -1.15 -5.07 114.94 119.85 2rov s ASN 45 Ca 0.41 -3.19 -0.29 0.00 0.21 0.00 0.00 52.86 50.00 2rov s ASN 45 Cb -0.18 -1.54 -0.04 0.00 -0.55 0.00 0.00 41.25 38.94 2rov s ASN 45 CO 0.58 -0.19 1.47 -2.16 -2.79 0.00 0.00 177.10 174.00 2rov s PRO 46 N -0.52 4.21 0.52 0.43 0.04 -1.26 -4.69 135.00 133.73 2rov s PRO 46 Ca 0.19 1.94 0.18 0.00 0.04 0.00 0.00 61.00 63.36 2rov s PRO 46 Cb -0.20 -3.88 1.31 0.00 0.04 0.00 0.00 34.50 31.78 2rov s PRO 46 CO -0.05 -0.78 2.12 -0.92 0.04 0.00 0.00 177.00 177.42 2rov h TYR 47 N 8.88 0.00 -1.45 0.56 3.20 -0.85 -3.44 116.97 123.88 2rov h TYR 47 Ca -0.33 0.00 0.11 0.00 3.14 0.00 0.00 58.73 61.64 2rov h TYR 47 Cb 1.14 0.00 -0.28 0.00 1.54 0.00 0.00 36.73 39.13 2rov h TYR 47 CO 0.84 0.00 0.55 1.41 -1.64 0.00 0.00 178.16 179.32 2rov s MET 48 N -5.04 0.36 -0.05 1.82 1.75 -0.78 -5.00 119.30 112.36 2rov s MET 48 Ca -0.05 0.47 0.02 0.00 -1.25 0.00 0.00 55.69 54.88 2rov s MET 48 Cb 0.17 0.15 0.02 0.00 2.84 0.00 0.00 34.83 38.01 2rov s MET 48 CO 0.68 -0.05 -0.08 0.54 -0.65 0.00 0.00 175.02 175.46 2rov s VAL 49 N 0.46 0.82 0.19 10.11 0.11 -1.26 0.10 120.40 130.92 2rov s VAL 49 Ca 0.01 -0.29 0.10 0.00 -2.93 0.00 0.00 61.98 58.87 2rov s VAL 49 Cb -0.05 -0.78 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 2rov s VAL 49 CO -0.10 0.29 -0.14 -0.76 -3.33 0.00 0.00 175.10 171.06 2rov s LEU 50 N 0.80 2.81 -0.26 2.54 1.02 0.12 -4.96 118.68 120.76 2rov s LEU 50 Ca -0.13 -0.67 -0.14 0.00 0.02 0.00 0.00 54.13 53.21 2rov s LEU 50 Cb -0.15 -1.51 -0.04 0.00 0.02 0.00 0.00 46.19 44.51 2rov s LEU 50 CO 0.02 0.11 0.32 -1.81 0.02 0.00 0.00 176.35 175.00 2rov s ASP 51 N -2.81 6.22 0.29 2.29 1.01 -1.26 0.76 116.67 123.18 2rov s ASP 51 Ca 0.24 0.25 0.01 0.00 0.71 0.00 0.00 52.55 53.76 2rov s ASP 51 Cb -0.08 -2.19 0.55 0.00 1.01 0.00 0.00 42.92 42.21 2rov s ASP 51 CO 0.14 -0.12 1.87 0.40 0.21 0.00 0.00 175.17 177.67 2rov h ILE 52 N 5.29 0.98 0.00 0.77 2.04 -1.86 0.92 117.51 125.65 2rov h ILE 52 Ca -0.34 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.15 2rov h ILE 52 Cb 1.17 -0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2rov h ILE 52 CO 0.64 0.18 -0.13 -0.78 0.00 0.00 0.00 178.15 178.06 2rov h ASP 53 N 1.01 0.00 1.66 1.72 1.82 -1.89 -1.94 116.42 118.80 2rov h ASP 53 Ca 0.45 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 57.06 2rov h ASP 53 Cb 0.38 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.38 2rov h ASP 53 CO -0.21 0.13 -0.17 0.11 -1.61 0.00 0.00 179.24 177.49 2rov h LYS 54 N 0.00 0.00 -6.63 0.28 1.57 -1.22 -3.46 116.57 107.11 2rov h LYS 54 Ca -0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.19 2rov h LYS 54 Cb 0.38 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.79 2rov h LYS 54 CO 0.02 0.17 0.38 1.28 -0.57 0.00 0.00 179.45 180.72 2rov n LEU 55 N -3.16 2.87 -0.09 2.94 4.77 -0.73 -2.82 117.00 120.78 2rov n LEU 55 Ca 0.03 1.19 -0.10 0.00 -0.03 0.00 0.00 56.01 57.10 2rov n LEU 55 Cb 0.56 -1.41 -0.11 0.00 -2.33 0.00 0.00 43.42 40.13 2rov n LEU 55 CO 0.35 -0.82 -1.06 0.49 -1.33 0.00 0.00 177.39 175.02 2rov n PHE 56 N 0.46 0.00 -3.65 -1.77 3.72 0.16 -4.90 117.46 111.48 2rov n PHE 56 Ca 0.07 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.44 2rov n PHE 56 Cb 0.34 -0.78 -0.07 0.00 -0.94 0.00 0.00 39.48 38.04 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 -2.39 -0.11 -0.04 1.38 2.46 -1.24 -5.02 115.29 110.34 2rov s HIS 57 Ca -0.15 0.27 -0.00 0.00 0.47 0.00 0.00 55.06 55.65 2rov s HIS 57 Cb 0.05 0.41 0.03 0.00 -0.13 0.00 0.00 32.58 32.94 2rov s HIS 57 CO 0.58 -0.06 0.02 0.54 -2.47 0.00 0.00 174.74 173.36 2rov s VAL 58 N 0.21 0.09 0.05 0.89 0.11 -1.26 -0.96 120.40 119.52 2rov s VAL 58 Ca 0.05 0.19 -0.27 0.00 -2.93 0.00 0.00 61.98 59.02 2rov s VAL 58 Cb -0.05 -0.24 0.08 0.00 -1.53 0.00 0.00 36.38 34.65 2rov s VAL 58 CO -0.14 0.16 0.72 0.00 -3.33 0.00 0.00 175.10 172.51 2rov s ARG 59 N 1.41 1.06 0.45 1.54 1.70 -0.73 -4.97 118.95 119.42 2rov s ARG 59 Ca -0.04 -0.23 -0.24 0.00 -0.47 0.00 0.00 55.73 54.75 2rov s ARG 59 Cb -0.13 0.49 -0.09 0.00 -0.57 0.00 0.00 34.95 34.65 2rov s ARG 59 CO -0.03 -0.43 1.10 -0.35 -1.08 0.00 0.00 175.30 174.51 2rov n PRO 60 N 0.00 1.47 -3.12 3.89 -0.04 -1.26 -1.73 135.00 134.21 2rov n PRO 60 Ca -0.15 0.53 -0.23 0.00 -0.04 0.00 0.00 63.50 63.62 2rov n PRO 60 Cb 0.62 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 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 -1.29 4.24 0.39 0.52 -7.23 0.30 -4.79 120.40 112.54 2rov s VAL 61 Ca 0.65 -0.54 0.03 0.00 -1.81 0.00 0.00 61.98 60.31 2rov s VAL 61 Cb -0.51 -3.55 0.03 0.00 0.56 0.00 0.00 36.38 32.91 2rov s VAL 61 CO 0.55 -0.36 0.27 0.35 -0.31 0.00 0.00 175.10 175.60 2rov n THR 62 N -1.97 0.00 0.28 5.32 -2.24 -1.26 -4.52 114.28 109.89 2rov n THR 62 Ca -0.00 -1.57 0.14 0.00 -2.27 0.00 0.00 64.05 60.35 2rov n THR 62 Cb 0.57 -0.12 0.67 0.00 -2.10 0.00 0.00 70.33 69.36 2rov n THR 62 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2rov h GLN 63 N 0.00 0.00 0.00 -0.78 5.75 -1.93 -1.80 115.11 116.35 2rov h GLN 63 Ca -0.25 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.10 2rov h GLN 63 Cb 0.91 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.44 2rov h GLN 63 CO 0.40 0.00 -0.68 1.79 -2.65 0.00 0.00 178.83 177.69 2rov h THR 64 N 0.00 1.20 0.00 2.39 1.35 -2.02 -3.21 112.91 112.62 2rov h THR 64 Ca 0.00 -2.59 -0.08 0.00 -0.55 0.00 0.00 66.41 63.20 2rov h THR 64 Cb 0.19 2.52 -0.01 0.00 -1.73 0.00 0.00 68.15 69.12 2rov h THR 64 CO 0.00 0.66 -0.36 -0.78 -0.25 0.00 0.00 175.52 174.79 2rov h ASP 65 N 0.00 0.00 -4.81 5.36 3.58 -1.71 -3.45 116.42 115.39 2rov h ASP 65 Ca -0.01 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 2rov h ASP 65 Cb 1.46 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 42.39 2rov h ASP 65 CO 0.09 0.36 -0.45 1.33 -2.88 0.00 0.00 179.24 177.68 2rov n VAL 66 N -3.72 0.00 0.00 2.25 0.24 -1.21 -5.05 118.33 110.84 2rov n VAL 66 Ca -0.01 -2.32 0.00 0.00 -2.04 0.00 0.00 64.34 59.97 2rov n VAL 66 Cb 0.45 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.71 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 -0.84 -0.56 0.20 6.34 4.11 -1.26 -4.83 117.16 120.32 2rov n TYR 67 Ca -0.03 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 57.94 2rov n TYR 67 Cb 0.59 0.40 0.39 0.00 -0.00 0.00 0.00 39.34 40.72 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 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2rov h ARG 68 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 2rov h ARG 68 CO 0.00 0.30 0.00 0.00 -0.00 0.00 0.00 179.97 180.27 2rov n ALA 69 N -2.26 0.00 -2.58 0.08 0.00 -1.26 -5.04 120.51 109.45 2rov n ALA 69 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2rov n ALA 69 Cb 0.47 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.78 2rov n ALA 69 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2rov s ASP 70 N -1.92 1.81 0.56 0.00 -1.08 -1.26 -5.01 116.67 109.76 2rov s ASP 70 Ca 0.00 -0.37 0.33 0.00 -0.52 0.00 0.00 52.55 51.99 2rov s ASP 70 Cb 0.00 -0.16 1.48 0.00 -1.46 0.00 0.00 42.92 42.78 2rov s ASP 70 CO 0.00 0.12 1.81 0.00 0.52 0.00 0.00 175.17 177.62 2rov h ALA 71 N 5.32 2.84 0.00 3.66 0.00 -1.96 0.80 119.26 129.93 2rov h ALA 71 Ca -0.37 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.30 2rov h ALA 71 Cb 1.17 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2rov h ALA 71 CO 0.46 -1.24 -0.96 0.87 0.00 0.00 0.00 179.25 178.38 2rov h LYS 72 N 0.00 0.01 0.02 0.00 1.57 -2.03 -3.28 116.57 112.87 2rov h LYS 72 Ca 0.45 -0.02 -0.22 0.00 -1.87 0.00 0.00 60.65 58.99 2rov h LYS 72 Cb 1.96 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 34.25 2rov h LYS 72 CO -0.00 0.96 -1.03 0.93 -0.57 0.00 0.00 179.45 179.74 2rov h GLU 73 N 0.00 0.06 -0.63 3.15 4.39 0.13 -3.35 114.58 118.34 2rov h GLU 73 Ca -0.01 -0.09 0.12 0.00 0.34 0.00 0.00 59.36 59.71 2rov h GLU 73 Cb 1.69 0.03 -0.12 0.00 -0.10 0.00 0.00 28.75 30.25 2rov h GLU 73 CO 0.13 1.02 -0.28 0.82 -1.16 0.00 0.00 179.01 179.54 2rov h ILE 74 N 0.02 0.22 0.00 3.13 1.08 -1.09 0.52 117.51 121.38 2rov h ILE 74 Ca -0.03 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.44 2rov h ILE 74 Cb 1.77 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.74 2rov h ILE 74 CO 0.14 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.79 2rov n PRO 75 N -5.45 0.04 -0.22 2.37 -0.04 -1.26 -1.89 135.00 128.56 2rov n PRO 75 Ca 0.06 0.35 0.09 0.00 -0.04 0.00 0.00 63.50 63.96 2rov n PRO 75 Cb 0.36 -1.60 0.21 0.00 -0.04 0.00 0.00 33.50 32.43 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 -1.68 2.52 -4.99 0.54 1.74 0.18 -4.76 116.66 110.20 2rov n ARG 76 Ca 0.02 -2.20 -0.32 0.00 -0.77 0.00 0.00 57.85 54.58 2rov n ARG 76 Cb 0.14 -1.41 -0.16 0.00 -1.02 0.00 0.00 32.46 30.02 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 -1.10 2.57 0.04 0.55 1.01 -0.68 0.99 121.20 124.59 2rov s ILE 77 Ca 0.33 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 60.21 2rov s ILE 77 Cb 0.18 -2.04 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 2rov s ILE 77 CO 0.24 0.54 -0.18 0.72 0.00 0.00 0.00 174.94 176.26 2rov s PHE 78 N 0.35 1.58 -0.05 3.97 -0.71 -0.92 -0.54 117.98 121.66 2rov s PHE 78 Ca -0.15 -0.37 0.01 0.00 -1.04 0.00 0.00 56.93 55.39 2rov s PHE 78 Cb -0.17 -0.94 -0.03 0.00 -1.21 0.00 0.00 43.02 40.67 2rov s PHE 78 CO 0.07 0.08 -0.06 -1.14 -1.34 0.00 0.00 175.22 172.82 2rov s GLN 79 N -1.20 2.70 -0.21 1.99 0.74 -0.71 -1.58 119.66 121.40 2rov s GLN 79 Ca 0.05 -0.59 -0.00 0.00 0.05 0.00 0.00 55.36 54.87 2rov s GLN 79 Cb -0.08 -2.57 0.05 0.00 1.10 0.00 0.00 33.01 31.50 2rov s GLN 79 CO 0.02 0.65 -0.05 0.42 -0.55 0.00 0.00 175.29 175.78 2rov s ILE 80 N -0.87 1.30 0.08 -2.34 1.09 -0.72 -1.78 121.20 117.96 2rov s ILE 80 Ca 0.14 -0.94 -0.22 0.00 -1.10 0.00 0.00 60.65 58.53 2rov s ILE 80 Cb -0.11 -1.55 -0.07 0.00 -1.06 0.00 0.00 42.46 39.68 2rov s ILE 80 CO 0.03 -0.01 0.65 -0.22 -0.10 0.00 0.00 174.94 175.29 2rov s LEU 81 N 1.52 4.52 -0.03 2.97 2.96 -0.14 -0.17 118.68 130.32 2rov s LEU 81 Ca -0.03 1.37 -0.05 0.00 -0.22 0.00 0.00 54.13 55.20 2rov s LEU 81 Cb -0.17 -3.04 0.01 0.00 0.50 0.00 0.00 46.19 43.48 2rov s LEU 81 CO -0.07 0.20 0.12 -0.72 -1.32 0.00 0.00 176.35 174.56 2rov s TYR 82 N -0.86 -0.05 -0.12 5.38 1.13 0.27 -0.66 117.35 122.44 2rov s TYR 82 Ca 0.32 0.12 -0.29 0.00 -1.41 0.00 0.00 57.07 55.81 2rov s TYR 82 Cb -0.20 -0.00 -0.03 0.00 -1.10 0.00 0.00 41.96 40.63 2rov s TYR 82 CO 0.21 -0.15 1.35 0.00 -2.51 0.00 0.00 175.55 174.45 2rov s ALA 83 N -0.52 3.63 -0.23 9.51 0.00 -1.13 -0.61 121.76 132.42 2rov s ALA 83 Ca -0.06 0.61 -0.05 0.00 0.00 0.00 0.00 51.96 52.46 2rov s ALA 83 Cb -0.04 -3.63 -0.12 0.00 0.00 0.00 0.00 23.12 19.33 2rov s ALA 83 CO 0.01 -1.16 -0.25 0.09 0.00 0.00 0.00 175.76 174.45 2rov n ASN 84 N 6.48 1.97 -0.05 0.00 3.02 -1.26 -4.77 115.26 120.65 2rov n ASN 84 Ca 0.14 0.09 -0.06 0.00 -0.03 0.00 0.00 54.58 54.72 2rov n ASN 84 Cb 0.44 -0.51 -0.08 0.00 -0.61 0.00 0.00 39.78 39.02 2rov n ASN 84 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2rov n GLU 85 N -3.59 1.82 0.00 3.52 -0.58 -1.26 -5.03 120.64 115.51 2rov n GLU 85 Ca -0.42 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.33 2rov n GLU 85 Cb 0.87 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 30.47 2rov n GLU 85 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2rov n GLY 86 N 2.49 -1.96 1.93 0.62 0.00 -1.26 -5.03 105.19 101.98 2rov n GLY 86 Ca -0.19 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.56 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 -0.10 0.05 0.29 -0.61 -0.00 -1.26 -4.68 119.36 113.05 2rov n ILE 87 Ca 0.00 0.02 0.15 0.00 -0.00 0.00 0.00 62.75 62.92 2rov n ILE 87 Cb 0.00 -0.38 0.87 0.00 -0.00 0.00 0.00 39.64 40.13 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 0.00 1.03 4.38 0.87 -2.00 -1.55 113.55 116.28 2rov h SER 88 Ca 0.00 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.38 2rov h SER 88 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 2rov h SER 88 CO 0.00 0.04 -1.02 0.28 -0.53 0.00 0.00 176.83 175.60 2rov h SER 89 N 0.00 0.00 -0.53 6.23 0.02 -1.96 -3.47 113.55 113.84 2rov h SER 89 Ca -0.00 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.50 2rov h SER 89 Cb 0.12 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.67 2rov h SER 89 CO 0.01 0.73 0.29 0.00 -1.14 0.00 0.00 176.83 176.71 2rov n ALA 90 N -2.35 -1.05 -2.00 3.77 0.00 -0.58 -4.70 120.51 113.60 2rov n ALA 90 Ca -0.04 0.28 -0.21 0.00 0.00 0.00 0.00 53.44 53.47 2rov n ALA 90 Cb 0.86 -0.99 0.07 0.00 0.00 0.00 0.00 19.45 19.39 2rov n ALA 90 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2rov s LYS 91 N 1.21 2.20 0.23 0.00 -0.14 0.22 -4.73 119.74 118.72 2rov s LYS 91 Ca 0.53 -1.21 0.07 0.00 -1.36 0.00 0.00 55.97 54.00 2rov s LYS 91 Cb -0.76 -2.51 -0.05 0.00 -1.68 0.00 0.00 37.83 32.82 2rov s LYS 91 CO 0.40 -0.96 -0.10 0.54 -0.76 0.00 0.00 175.35 174.46 2rov s ASN 92 N -4.60 2.54 -0.19 2.83 6.03 -1.26 0.94 114.94 121.23 2rov s ASN 92 Ca 0.62 -1.09 0.00 0.00 -1.03 0.00 0.00 52.86 51.36 2rov s ASN 92 Cb -0.07 -0.13 0.04 0.00 -3.03 0.00 0.00 41.25 38.06 2rov s ASN 92 CO 0.40 -0.26 -0.08 -0.22 -2.03 0.00 0.00 177.10 174.91 2rov s LEU 93 N -3.35 2.08 -0.22 3.54 0.20 0.76 -4.89 118.68 116.80 2rov s LEU 93 Ca 0.25 -0.83 -0.21 0.00 0.69 0.00 0.00 54.13 54.03 2rov s LEU 93 Cb 0.01 -1.13 -0.02 0.00 -0.43 0.00 0.00 46.19 44.63 2rov s LEU 93 CO 0.08 -0.16 0.64 -0.76 -0.29 0.00 0.00 176.35 175.86 2rov s LEU 94 N 1.47 4.12 -0.18 -0.68 2.01 -1.26 -1.76 118.68 122.39 2rov s LEU 94 Ca -0.01 0.81 0.00 0.00 0.01 0.00 0.00 54.13 54.95 2rov s LEU 94 Cb -0.16 -2.90 0.04 0.00 0.01 0.00 0.00 46.19 43.18 2rov s LEU 94 CO -0.08 -0.32 -0.09 -0.76 1.01 0.00 0.00 176.35 176.11 2rov s LEU 95 N 2.15 1.99 -0.12 1.79 1.43 -0.61 -4.39 118.68 120.92 2rov s LEU 95 Ca 0.28 -0.77 -0.21 0.00 -1.03 0.00 0.00 54.13 52.40 2rov s LEU 95 Cb -0.16 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 2rov s LEU 95 CO 0.10 -0.15 0.59 -0.22 0.23 0.00 0.00 176.35 176.90 2rov s LEU 96 N 1.49 4.26 -0.12 1.79 2.96 0.17 -2.17 118.68 127.06 2rov s LEU 96 Ca 0.00 0.95 -0.07 0.00 -0.22 0.00 0.00 54.13 54.79 2rov s LEU 96 Cb -0.16 -2.88 -0.04 0.00 0.50 0.00 0.00 46.19 43.61 2rov s LEU 96 CO -0.08 -0.11 0.13 0.00 -1.32 0.00 0.00 176.35 174.98 2rov s ALA 97 N 0.99 3.84 0.53 5.97 0.00 0.28 -0.46 121.76 132.91 2rov s ALA 97 Ca 0.31 -0.65 0.21 0.00 0.00 0.00 0.00 51.96 51.83 2rov s ALA 97 Cb -0.16 -1.96 1.35 0.00 0.00 0.00 0.00 23.12 22.34 2rov s ALA 97 CO 0.13 0.59 2.06 -0.91 0.00 0.00 0.00 175.76 177.63 2rov h ASN 98 N 5.09 0.00 -4.62 0.00 2.35 -1.86 -3.42 115.58 113.12 2rov h ASN 98 Ca -0.54 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 54.90 2rov h ASN 98 Cb 1.22 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.39 2rov h ASN 98 CO 0.59 0.00 -0.74 -0.44 -1.65 0.00 0.00 177.43 175.19 2rov s SER 99 N -6.57 1.17 0.19 5.81 0.01 -1.26 -5.05 113.70 108.00 2rov s SER 99 Ca -0.05 -0.64 -0.12 0.00 1.31 0.00 0.00 55.95 56.45 2rov s SER 99 Cb 0.18 0.01 0.14 0.00 0.21 0.00 0.00 66.02 66.57 2rov s SER 99 CO 0.70 -0.20 1.83 0.74 0.41 0.00 0.00 173.24 176.72 2rov h THR 100 N 4.18 1.07 -0.98 1.44 2.02 -1.86 -2.17 112.91 116.60 2rov h THR 100 Ca -0.37 -0.25 0.15 0.00 0.77 0.00 0.00 66.41 66.71 2rov h THR 100 Cb 1.19 0.28 -0.09 0.00 -1.74 0.00 0.00 68.15 67.80 2rov h THR 100 CO 0.44 0.13 0.62 -0.33 0.37 0.00 0.00 175.52 176.75 2rov h GLU 101 N 0.72 0.82 -0.60 6.66 5.08 -1.97 -0.90 114.58 124.40 2rov h GLU 101 Ca 0.24 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.57 2rov h GLU 101 Cb 0.03 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2rov h GLU 101 CO -0.10 0.55 0.39 0.93 -1.00 0.00 0.00 179.01 179.77 2rov h GLU 102 N 0.85 0.76 -0.48 2.33 3.07 -1.79 -1.53 114.58 117.79 2rov h GLU 102 Ca 0.52 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.33 2rov h GLU 102 Cb 0.69 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 28.40 2rov h GLU 102 CO -0.29 0.50 0.28 0.37 -1.40 0.00 0.00 179.01 178.47 2rov h GLN 103 N 0.79 0.65 -0.26 2.33 -0.00 -1.10 0.19 115.11 117.71 2rov h GLN 103 Ca 0.23 -0.06 -0.17 0.00 -0.00 0.00 0.00 58.65 58.66 2rov h GLN 103 Cb -0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 27.48 27.29 2rov h GLN 103 CO -0.07 0.47 -0.51 1.96 0.00 0.00 0.00 178.83 180.68 2rov h GLN 104 N 0.66 0.73 -0.00 1.69 1.08 -0.97 -2.26 115.11 116.04 2rov h GLN 104 Ca 0.17 -0.44 -0.01 0.00 -1.45 0.00 0.00 58.65 56.92 2rov h GLN 104 Cb -0.00 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2rov h GLN 104 CO -0.03 1.07 -0.05 -0.22 -0.95 0.00 0.00 178.83 178.65 2rov h LYS 105 N 0.57 0.04 -0.01 1.46 3.64 -0.69 -1.79 116.57 119.80 2rov h LYS 105 Ca 0.02 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2rov h LYS 105 Cb 1.09 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 2rov h LYS 105 CO 0.11 0.75 -0.10 -1.49 -2.27 0.00 0.00 179.45 176.46 2rov h TRP 106 N -0.66 -0.24 0.05 1.91 4.06 -0.72 0.28 115.95 120.62 2rov h TRP 106 Ca -0.00 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2rov h TRP 106 Cb 0.77 0.11 0.00 0.00 -1.00 0.00 0.00 29.16 29.04 2rov h TRP 106 CO 0.18 -0.15 -0.02 0.28 -3.56 0.00 0.00 178.44 175.16 2rov h VAL 107 N -0.16 1.13 -0.79 1.49 2.07 -1.53 0.23 116.25 118.69 2rov h VAL 107 Ca 0.04 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2rov h VAL 107 Cb 0.21 1.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2rov h VAL 107 CO -0.10 0.15 0.51 -1.28 0.02 0.00 0.00 177.57 176.86 2rov h SER 108 N -0.32 0.91 0.10 0.57 0.87 -1.24 0.38 113.55 114.82 2rov h SER 108 Ca -0.01 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2rov h SER 108 Cb 0.29 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2rov h SER 108 CO 0.01 0.67 -0.05 0.03 -0.53 0.00 0.00 176.83 176.97 2rov h ARG 109 N 1.07 -0.13 -0.88 2.24 2.47 -0.36 -1.73 114.38 117.05 2rov h ARG 109 Ca 0.29 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.02 2rov h ARG 109 Cb -0.10 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.20 2rov h ARG 109 CO -0.06 0.36 0.56 1.37 0.56 0.00 0.00 179.97 182.76 2rov h LEU 110 N -0.90 1.03 -0.30 3.04 8.10 -0.48 -1.74 115.31 124.05 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 0.55 -0.26 -0.00 0.00 -0.44 0.00 0.00 40.66 40.51 2rov h LEU 110 CO 0.02 0.77 -0.35 1.62 -4.11 0.00 0.00 178.44 176.38 2rov h VAL 111 N 1.20 1.29 -0.16 0.15 3.04 -0.34 -2.89 116.25 118.55 2rov h VAL 111 Ca 0.32 -1.53 0.01 0.00 -1.01 0.00 0.00 66.70 64.49 2rov h VAL 111 Cb -0.10 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 30.75 2rov h VAL 111 CO -0.07 0.50 0.10 0.11 -1.01 0.00 0.00 177.57 177.20 2rov h LYS 112 N 0.52 0.18 0.00 4.17 1.57 -0.90 0.35 116.57 122.46 2rov h LYS 112 Ca 0.04 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2rov h LYS 112 Cb 0.94 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 2rov h LYS 112 CO 0.08 0.12 -0.23 0.87 -0.57 0.00 0.00 179.45 179.72 2rov h LYS 113 N 0.18 0.00 -6.79 3.15 1.57 -1.12 -3.44 116.57 110.12 2rov h LYS 113 Ca 0.06 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.31 2rov h LYS 113 Cb 0.02 0.00 0.06 0.00 0.08 0.00 0.00 32.23 32.39 2rov h LYS 113 CO -0.01 0.23 0.73 0.42 -0.57 0.00 0.00 179.45 180.25 2rov s ILE 114 N -3.67 2.64 0.09 1.86 1.01 0.11 -4.80 121.20 118.44 2rov s ILE 114 Ca 0.00 0.56 -0.14 0.00 0.00 0.00 0.00 60.65 61.08 2rov s ILE 114 Cb 0.10 -3.36 -0.16 0.00 0.01 0.00 0.00 42.46 39.05 2rov s ILE 114 CO 0.64 0.10 1.29 1.55 0.00 0.00 0.00 174.94 178.52 2rov h PRO 115 N 4.56 0.72 -1.47 2.79 0.13 -1.85 -3.25 132.00 133.62 2rov h PRO 115 Ca -0.47 -0.58 -0.56 0.00 -0.87 0.00 0.00 66.00 63.52 2rov h PRO 115 Cb 1.22 0.12 -0.23 0.00 0.13 0.00 0.00 31.00 32.24 2rov h PRO 115 CO 0.74 1.19 0.70 1.63 -0.23 0.00 0.00 178.00 182.04 2rov n LYS 116 N -4.03 2.40 0.00 0.86 5.02 -1.26 -5.18 118.16 115.96 2rov n LYS 116 Ca -0.07 -2.69 0.02 0.00 -2.02 0.00 0.00 58.31 53.55 2rov n LYS 116 Cb 0.69 -2.07 0.14 0.00 -0.02 0.00 0.00 35.03 33.77 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05