#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 0.65 -1.41 1.43 0.00 -1.26 -5.10 116.66 110.97 2rov n ARG 2 Ca 0.00 -1.34 -0.56 0.00 -0.00 0.00 0.00 57.85 55.95 2rov n ARG 2 Cb 0.00 1.71 -0.09 0.00 -0.00 0.00 0.00 32.46 34.08 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 1.51 -3.55 2.89 7.94 -1.25 -4.83 117.00 119.71 2rov n LEU 3 Ca -0.04 0.65 -0.12 0.00 -1.11 0.00 0.00 56.01 55.39 2rov n LEU 3 Cb 0.41 -1.07 -0.04 0.00 0.53 0.00 0.00 43.42 43.25 2rov n LEU 3 CO 0.17 -0.72 0.27 -1.83 -1.11 0.00 0.00 177.39 174.17 2rov s GLU 4 N 5.64 1.13 0.00 1.96 -1.05 -1.26 0.75 118.70 125.87 2rov s GLU 4 Ca 1.13 -0.53 0.00 0.00 -0.15 0.00 0.00 54.97 55.42 2rov s GLU 4 Cb -1.20 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 33.01 2rov s GLU 4 CO 0.60 -0.46 0.00 0.41 0.95 0.00 0.00 175.26 176.76 2rov n GLY 5 N -0.15 0.00 3.15 -3.83 0.00 -0.07 -4.98 105.19 99.30 2rov n GLY 5 Ca -0.17 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 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 -3.74 2.57 0.10 1.61 0.52 -1.26 -0.07 118.94 118.67 2rov s TRP 6 Ca 0.00 -1.32 0.10 0.00 0.02 0.00 0.00 56.10 54.91 2rov s TRP 6 Cb 0.00 -1.77 -0.04 0.00 -1.15 0.00 0.00 33.47 30.52 2rov s TRP 6 CO 0.00 -0.62 -0.26 -0.51 0.02 0.00 0.00 176.95 175.58 2rov s LEU 7 N 0.90 2.27 0.03 2.99 1.43 -0.62 -4.74 118.68 120.94 2rov s LEU 7 Ca -0.06 -0.70 -0.18 0.00 -1.03 0.00 0.00 54.13 52.16 2rov s LEU 7 Cb -0.15 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.79 2rov s LEU 7 CO -0.03 0.20 0.53 -0.44 0.23 0.00 0.00 176.35 176.83 2rov s SER 8 N -1.81 6.96 0.17 2.29 0.01 0.07 0.64 113.70 122.04 2rov s SER 8 Ca 0.13 1.14 0.09 0.00 1.31 0.00 0.00 55.95 58.61 2rov s SER 8 Cb -0.10 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.76 2rov s SER 8 CO 0.05 0.23 -0.18 -0.76 0.41 0.00 0.00 173.24 172.99 2rov s LEU 9 N -0.79 2.46 -0.29 2.44 1.02 -0.81 0.26 118.68 122.97 2rov s LEU 9 Ca 0.28 -0.88 -0.28 0.00 0.02 0.00 0.00 54.13 53.27 2rov s LEU 9 Cb -0.18 -0.82 -0.05 0.00 0.02 0.00 0.00 46.19 45.15 2rov s LEU 9 CO 0.17 -0.04 2.23 -2.16 0.02 0.00 0.00 176.35 176.56 2rov s PRO 10 N -2.91 2.89 0.34 1.29 0.04 -1.26 -2.58 135.00 132.81 2rov s PRO 10 Ca 0.17 1.83 0.07 0.00 0.04 0.00 0.00 61.00 63.11 2rov s PRO 10 Cb -0.05 -4.41 -0.01 0.00 0.04 0.00 0.00 34.50 30.07 2rov s PRO 10 CO 0.07 -2.37 0.46 0.54 0.04 0.00 0.00 177.00 175.74 2rov s VAL 11 N 9.14 3.98 -0.37 -0.36 0.11 -1.15 -4.95 120.40 126.80 2rov s VAL 11 Ca 0.98 -1.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.01 2rov s VAL 11 Cb -0.28 -3.37 0.14 0.00 -1.53 0.00 0.00 36.38 31.33 2rov s VAL 11 CO 0.33 -0.15 0.21 -0.13 -3.33 0.00 0.00 175.10 172.03 2rov s ARG 12 N -4.17 0.71 0.25 1.54 0.52 -1.26 -2.42 118.95 114.13 2rov s ARG 12 Ca 0.45 -1.46 -0.07 0.00 -0.52 0.00 0.00 55.73 54.13 2rov s ARG 12 Cb -0.09 -1.56 0.45 0.00 0.52 0.00 0.00 34.95 34.27 2rov s ARG 12 CO 0.31 -1.19 1.61 -0.91 0.02 0.00 0.00 175.30 175.14 2rov h ASN 13 N 7.02 -0.50 0.00 0.23 2.35 -1.85 -3.41 115.58 119.42 2rov h ASN 13 Ca 0.03 0.22 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2rov h ASN 13 Cb 0.96 0.41 0.00 0.00 0.05 0.00 0.00 38.32 39.75 2rov h ASN 13 CO 0.32 -0.23 0.00 -0.46 -1.65 0.00 0.00 177.43 175.41 2rov n ASN 14 N -5.42 0.00 0.02 5.81 0.23 -1.26 -5.06 115.26 109.58 2rov n ASN 14 Ca 0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.19 2rov n ASN 14 Cb 0.49 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.19 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 -1.03 0.00 -0.01 5.53 5.66 -1.26 -4.92 114.28 118.24 2rov n THR 15 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 2rov n THR 15 Cb 0.00 -0.33 -0.12 0.00 -1.55 0.00 0.00 70.33 68.33 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 -2.59 0.64 -2.74 1.09 5.02 -1.26 -4.89 118.16 113.42 2rov n LYS 16 Ca 0.00 0.21 -0.41 0.00 -2.02 0.00 0.00 58.31 56.09 2rov n LYS 16 Cb 0.00 -1.75 -0.05 0.00 -0.02 0.00 0.00 35.03 33.21 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 -2.73 4.72 -0.19 1.97 2.36 -1.26 -5.04 119.74 119.56 2rov s LYS 17 Ca -0.05 1.44 -0.12 0.00 -2.55 0.00 0.00 55.97 54.69 2rov s LYS 17 Cb 0.08 -3.36 0.06 0.00 -1.05 0.00 0.00 37.83 33.56 2rov s LYS 17 CO 0.82 0.28 0.48 -0.59 1.55 0.00 0.00 175.35 177.89 2rov s PHE 18 N -0.24 -0.67 0.00 4.03 -0.12 -1.26 -2.30 117.98 117.43 2rov s PHE 18 Ca 0.45 1.44 0.00 0.00 -0.05 0.00 0.00 56.93 58.78 2rov s PHE 18 Cb -0.24 0.31 0.00 0.00 -0.63 0.00 0.00 43.02 42.46 2rov s PHE 18 CO 0.30 -0.35 0.00 0.41 -0.05 0.00 0.00 175.22 175.53 2rov n GLY 19 N 3.88 3.69 2.98 1.99 0.00 -1.02 -4.90 105.19 111.81 2rov n GLY 19 Ca -0.20 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 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 3.57 0.25 -0.18 1.61 0.52 -1.26 -2.95 118.94 120.51 2rov s TRP 20 Ca 0.00 -0.52 -0.04 0.00 0.02 0.00 0.00 56.10 55.56 2rov s TRP 20 Cb 0.00 -0.18 0.09 0.00 -1.15 0.00 0.00 33.47 32.22 2rov s TRP 20 CO 0.00 -0.19 0.24 0.54 0.02 0.00 0.00 176.95 177.57 2rov s VAL 21 N -1.43 -0.37 -0.41 4.03 0.11 -1.07 -4.88 120.40 116.39 2rov s VAL 21 Ca -0.16 0.03 -0.29 0.00 -2.93 0.00 0.00 61.98 58.64 2rov s VAL 21 Cb -0.10 -0.60 0.01 0.00 -1.53 0.00 0.00 36.38 34.16 2rov s VAL 21 CO -0.01 -0.08 1.45 -1.59 -3.33 0.00 0.00 175.10 171.54 2rov s LYS 22 N 2.37 3.53 0.00 1.54 -2.85 -1.24 -1.92 119.74 121.18 2rov s LYS 22 Ca 0.06 0.96 -0.01 0.00 -1.00 0.00 0.00 55.97 55.97 2rov s LYS 22 Cb -0.14 -4.05 -0.04 0.00 -2.06 0.00 0.00 37.83 31.54 2rov s LYS 22 CO -0.11 -1.62 0.15 0.15 0.10 0.00 0.00 175.35 174.02 2rov s LYS 23 N 5.04 3.30 -0.50 1.78 -0.14 0.21 -4.68 119.74 124.75 2rov s LYS 23 Ca 0.63 -0.40 -0.27 0.00 -1.36 0.00 0.00 55.97 54.57 2rov s LYS 23 Cb -0.14 -3.01 -0.03 0.00 -1.68 0.00 0.00 37.83 32.98 2rov s LYS 23 CO 0.33 0.66 1.92 -0.47 -0.76 0.00 0.00 175.35 177.02 2rov s TYR 24 N -1.31 1.63 -0.15 3.18 6.14 -1.22 -1.59 117.35 124.03 2rov s TYR 24 Ca 0.27 0.84 -0.05 0.00 0.64 0.00 0.00 57.07 58.76 2rov s TYR 24 Cb -0.12 -4.03 -0.04 0.00 0.42 0.00 0.00 41.96 38.19 2rov s TYR 24 CO 0.18 -2.55 0.03 0.08 0.64 0.00 0.00 175.55 173.93 2rov s VAL 25 N 8.80 4.57 -0.11 3.14 1.01 0.89 -0.92 120.40 137.77 2rov s VAL 25 Ca 0.75 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.57 2rov s VAL 25 Cb -0.16 -3.01 0.05 0.00 0.00 0.00 0.00 36.38 33.25 2rov s VAL 25 CO 0.26 0.52 0.06 -0.63 0.00 0.00 0.00 175.10 175.31 2rov s ILE 26 N -0.09 0.02 -0.57 2.22 1.01 -0.66 -0.89 121.20 122.24 2rov s ILE 26 Ca 0.05 0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.51 2rov s ILE 26 Cb -0.12 -0.46 0.05 0.00 0.01 0.00 0.00 42.46 41.93 2rov s ILE 26 CO 0.02 -0.05 0.94 -0.69 0.00 0.00 0.00 174.94 175.15 2rov s VAL 27 N 2.10 4.39 0.58 2.92 1.01 0.23 -0.73 120.40 130.90 2rov s VAL 27 Ca 0.03 0.12 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 2rov s VAL 27 Cb -0.14 -4.56 0.01 0.00 0.00 0.00 0.00 36.38 31.69 2rov s VAL 27 CO -0.06 -1.18 0.88 -0.55 0.00 0.00 0.00 175.10 174.19 2rov s SER 28 N 3.00 5.52 -0.30 3.32 0.15 0.42 -3.96 113.70 121.85 2rov s SER 28 Ca 0.28 0.59 -0.31 0.00 0.70 0.00 0.00 55.95 57.22 2rov s SER 28 Cb -0.14 -1.58 -0.08 0.00 -1.71 0.00 0.00 66.02 62.52 2rov s SER 28 CO 0.17 -1.08 2.24 -1.20 1.20 0.00 0.00 173.24 174.57 2rov n SER 29 N -2.54 2.68 -3.04 5.45 7.64 -1.26 -1.22 113.62 121.33 2rov n SER 29 Ca 0.05 0.23 -0.22 0.00 1.01 0.00 0.00 58.87 59.94 2rov n SER 29 Cb 0.58 -1.43 0.05 0.00 -1.01 0.00 0.00 64.21 62.40 2rov n SER 29 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2rov n LYS 30 N 8.56 -5.60 -3.65 1.43 4.76 -1.26 -4.97 118.16 117.43 2rov n LYS 30 Ca 0.36 0.84 -0.00 0.00 -2.87 0.00 0.00 58.31 56.64 2rov n LYS 30 Cb 0.36 -5.65 -0.06 0.00 -1.84 0.00 0.00 35.03 27.84 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 -5.83 0.14 -0.06 1.97 2.47 -0.35 -4.49 119.74 113.58 2rov s LYS 31 Ca 0.37 0.22 -0.02 0.00 -1.56 0.00 0.00 55.97 54.99 2rov s LYS 31 Cb -0.17 0.04 -0.04 0.00 -1.46 0.00 0.00 37.83 36.21 2rov s LYS 31 CO 0.46 -0.03 0.05 0.42 0.16 0.00 0.00 175.35 176.42 2rov s ILE 32 N 0.89 4.66 0.05 5.43 1.01 0.97 0.16 121.20 134.37 2rov s ILE 32 Ca -0.05 -0.23 0.08 0.00 0.00 0.00 0.00 60.65 60.44 2rov s ILE 32 Cb -0.03 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 2rov s ILE 32 CO -0.12 0.51 -0.21 -0.76 0.00 0.00 0.00 174.94 174.36 2rov s LEU 33 N -1.23 2.18 -0.05 2.97 1.02 0.09 -1.21 118.68 122.44 2rov s LEU 33 Ca 0.17 -0.54 0.01 0.00 0.02 0.00 0.00 54.13 53.80 2rov s LEU 33 Cb -0.12 -1.00 0.02 0.00 0.02 0.00 0.00 46.19 45.11 2rov s LEU 33 CO 0.07 0.16 -0.08 -0.36 0.02 0.00 0.00 176.35 176.17 2rov s PHE 34 N -0.83 1.03 0.28 0.29 0.08 0.33 -1.65 117.98 117.53 2rov s PHE 34 Ca 0.08 -0.34 0.02 0.00 0.12 0.00 0.00 56.93 56.80 2rov s PHE 34 Cb -0.09 -0.83 -0.01 0.00 -0.57 0.00 0.00 43.02 41.52 2rov s PHE 34 CO 0.02 -0.23 0.06 0.66 -0.10 0.00 0.00 175.22 175.63 2rov n TYR 35 N 3.97 0.34 -0.85 0.36 4.02 -0.09 0.11 117.16 125.03 2rov n TYR 35 Ca -0.24 -1.64 0.00 0.00 -0.01 0.00 0.00 57.90 56.01 2rov n TYR 35 Cb 0.51 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.75 2rov n TYR 35 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2rov n ASP 36 N -1.51 0.35 0.00 7.72 2.03 -1.26 -3.41 116.55 120.47 2rov n ASP 36 Ca -0.07 -1.20 0.00 0.00 0.52 0.00 0.00 54.79 54.04 2rov n ASP 36 Cb 0.40 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.79 2rov n ASP 36 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2rov n SER 37 N -0.09 0.00 0.16 1.67 7.64 -1.26 -4.87 113.62 116.86 2rov n SER 37 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 2rov n SER 37 Cb 0.46 0.00 0.25 0.00 -1.01 0.00 0.00 64.21 63.91 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 0.00 -0.61 1.43 4.22 -1.99 -2.79 114.58 114.84 2rov h GLU 38 Ca 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.38 2rov h GLU 38 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2rov h GLU 38 CO 0.00 0.50 0.13 -0.56 -2.18 0.00 0.00 179.01 176.90 2rov h GLN 39 N 0.00 0.98 -0.06 1.92 3.07 -2.00 -2.34 115.11 116.69 2rov h GLN 39 Ca -0.01 -0.25 -0.17 0.00 0.09 0.00 0.00 58.65 58.32 2rov h GLN 39 Cb 1.01 -0.12 -0.01 0.00 0.08 0.00 0.00 27.48 28.44 2rov h GLN 39 CO 0.07 0.91 -0.69 -0.44 0.09 0.00 0.00 178.83 178.76 2rov h ASP 40 N 0.89 0.33 0.18 0.06 5.19 -1.91 -2.54 116.42 118.62 2rov h ASP 40 Ca 0.19 -0.21 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 2rov h ASP 40 Cb 0.38 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.80 2rov h ASP 40 CO 0.01 0.92 -0.09 0.50 -3.12 0.00 0.00 179.24 177.46 2rov h LYS 41 N 0.19 -0.23 0.00 3.56 3.11 -1.27 -2.53 116.57 119.40 2rov h LYS 41 Ca -0.02 0.02 -0.03 0.00 -2.81 0.00 0.00 60.65 57.80 2rov h LYS 41 Cb 1.24 0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 32.52 2rov h LYS 41 CO 0.11 -0.09 -0.16 1.05 -2.81 0.00 0.00 179.45 177.54 2rov h GLU 42 N -0.31 0.00 0.00 1.90 4.11 -1.48 -2.24 114.58 116.56 2rov h GLU 42 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.41 2rov h GLU 42 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2rov h GLU 42 CO 0.04 0.16 0.00 0.94 0.07 0.00 0.00 179.01 180.22 2rov n GLN 43 N -3.48 0.20 -2.64 1.06 7.27 -0.96 -4.88 117.38 113.96 2rov n GLN 43 Ca -0.01 0.10 -0.20 0.00 0.07 0.00 0.00 57.00 56.96 2rov n GLN 43 Cb 0.33 -1.50 0.01 0.00 2.41 0.00 0.00 30.24 31.49 2rov n GLN 43 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2rov n SER 44 N -1.36 -5.70 -3.53 1.69 7.64 -0.84 -4.95 113.62 106.56 2rov n SER 44 Ca 0.08 -0.13 -0.27 0.00 1.01 0.00 0.00 58.87 59.57 2rov n SER 44 Cb 0.20 -4.64 -0.09 0.00 -1.01 0.00 0.00 64.21 58.66 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 -1.94 2.42 -4.64 6.43 4.05 -1.12 -5.09 115.26 115.36 2rov n ASN 45 Ca -0.18 -3.12 -0.39 0.00 0.45 0.00 0.00 54.58 51.35 2rov n ASN 45 Cb 0.65 -0.68 0.04 0.00 1.23 0.00 0.00 39.78 41.02 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 1.54 1.17 0.09 1.20 -0.02 -1.26 -4.81 135.00 132.90 2rov n PRO 46 Ca 0.25 0.44 -0.14 0.00 -2.02 0.00 0.00 63.50 62.03 2rov n PRO 46 Cb 0.42 -2.24 -0.08 0.00 -0.02 0.00 0.00 33.50 31.58 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 0.91 0.56 -1.75 6.00 5.03 0.46 -3.48 116.97 124.69 2rov h TYR 47 Ca -0.48 -0.34 0.02 0.00 2.58 0.00 0.00 58.73 60.50 2rov h TYR 47 Cb 1.34 -0.05 -0.22 0.00 1.55 0.00 0.00 36.73 39.36 2rov h TYR 47 CO 0.40 1.20 0.38 1.41 -1.32 0.00 0.00 178.16 180.24 2rov s MET 48 N -3.01 0.78 -0.02 1.82 0.00 -0.82 -4.99 119.30 113.06 2rov s MET 48 Ca -0.05 0.26 0.02 0.00 0.00 0.00 0.00 55.69 55.92 2rov s MET 48 Cb 0.08 0.37 0.00 0.00 0.00 0.00 0.00 34.83 35.28 2rov s MET 48 CO 0.87 -0.23 -0.07 0.14 0.00 0.00 0.00 175.02 175.73 2rov s VAL 49 N -0.99 0.59 0.20 10.11 -7.23 -1.26 0.12 120.40 121.94 2rov s VAL 49 Ca -0.05 -0.27 0.08 0.00 -1.81 0.00 0.00 61.98 59.93 2rov s VAL 49 Cb -0.01 -0.52 -0.04 0.00 0.56 0.00 0.00 36.38 36.37 2rov s VAL 49 CO 0.04 0.18 -0.01 -0.76 -0.31 0.00 0.00 175.10 174.25 2rov s LEU 50 N 0.10 3.25 -0.36 1.32 1.43 -0.35 -4.92 118.68 119.15 2rov s LEU 50 Ca -0.01 -0.47 -0.16 0.00 -1.03 0.00 0.00 54.13 52.45 2rov s LEU 50 Cb -0.06 -1.87 -0.00 0.00 0.03 0.00 0.00 46.19 44.28 2rov s LEU 50 CO -0.00 0.07 0.42 -1.81 0.23 0.00 0.00 176.35 175.26 2rov s ASP 51 N -3.10 6.22 0.32 2.29 1.01 -1.26 -0.02 116.67 122.13 2rov s ASP 51 Ca 0.28 -0.25 0.03 0.00 0.71 0.00 0.00 52.55 53.31 2rov s ASP 51 Cb -0.09 -2.22 0.60 0.00 1.01 0.00 0.00 42.92 42.23 2rov s ASP 51 CO 0.18 -0.43 1.90 0.40 0.21 0.00 0.00 175.17 177.44 2rov h ILE 52 N 5.60 1.01 0.00 0.77 2.04 -1.91 0.38 117.51 125.40 2rov h ILE 52 Ca -0.29 -0.32 -0.07 0.00 1.00 0.00 0.00 64.86 65.18 2rov h ILE 52 Cb 1.13 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 2rov h ILE 52 CO 0.74 0.17 -0.34 -0.78 0.00 0.00 0.00 178.15 177.93 2rov h ASP 53 N 0.94 0.00 1.35 1.72 1.82 -1.91 -2.47 116.42 117.87 2rov h ASP 53 Ca 0.40 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 57.03 2rov h ASP 53 Cb 0.32 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.33 2rov h ASP 53 CO -0.16 0.34 -0.07 0.11 -1.61 0.00 0.00 179.24 177.84 2rov h LYS 54 N 0.00 0.00 -6.68 0.28 1.57 -1.32 -3.46 116.57 106.97 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 0.70 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.13 2rov h LYS 54 CO 0.04 0.07 0.32 1.28 -0.57 0.00 0.00 179.45 180.60 2rov n LEU 55 N -3.16 3.01 -0.06 2.94 4.77 -0.93 -2.15 117.00 121.42 2rov n LEU 55 Ca 0.02 1.12 -0.06 0.00 -0.03 0.00 0.00 56.01 57.06 2rov n LEU 55 Cb 0.43 -1.41 -0.10 0.00 -2.33 0.00 0.00 43.42 40.01 2rov n LEU 55 CO 0.31 -1.02 -0.92 0.49 -1.33 0.00 0.00 177.39 174.92 2rov n PHE 56 N -0.08 0.00 -3.60 -1.77 3.72 0.28 -4.88 117.46 111.13 2rov n PHE 56 Ca 0.08 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.39 2rov n PHE 56 Cb 0.37 -0.63 -0.05 0.00 -0.94 0.00 0.00 39.48 38.24 2rov n PHE 56 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 2rov s HIS 57 N -2.31 -0.28 -0.19 1.38 -3.43 -1.24 -4.99 115.29 104.23 2rov s HIS 57 Ca -0.07 0.49 -0.05 0.00 -0.80 0.00 0.00 55.06 54.64 2rov s HIS 57 Cb 0.04 0.46 0.07 0.00 -1.43 0.00 0.00 32.58 31.72 2rov s HIS 57 CO 0.51 -0.25 0.12 0.08 -2.00 0.00 0.00 174.74 173.20 2rov s VAL 58 N -1.02 -0.14 0.07 -5.38 1.01 -1.26 -0.17 120.40 113.51 2rov s VAL 58 Ca 0.01 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.69 2rov s VAL 58 Cb -0.01 -0.63 0.01 0.00 0.00 0.00 0.00 36.38 35.75 2rov s VAL 58 CO -0.01 -0.30 0.24 -0.13 0.00 0.00 0.00 175.10 174.89 2rov s ARG 59 N 2.17 0.81 0.70 2.72 1.81 -0.79 -4.97 118.95 121.40 2rov s ARG 59 Ca 0.04 -0.74 -0.16 0.00 -1.72 0.00 0.00 55.73 53.15 2rov s ARG 59 Cb -0.16 0.34 0.02 0.00 -0.45 0.00 0.00 34.95 34.70 2rov s ARG 59 CO -0.12 -0.26 1.23 -1.25 -0.68 0.00 0.00 175.30 174.22 2rov s PRO 60 N -3.17 2.29 0.31 3.54 0.04 -1.26 -1.04 135.00 135.70 2rov s PRO 60 Ca -0.00 1.83 0.06 0.00 0.04 0.00 0.00 61.00 62.92 2rov s PRO 60 Cb 0.02 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.70 2rov s PRO 60 CO -0.07 -1.73 0.45 0.14 0.04 0.00 0.00 177.00 175.82 2rov s VAL 61 N -1.83 4.47 0.28 -0.36 -7.23 -0.46 -4.72 120.40 110.56 2rov s VAL 61 Ca 0.76 -0.95 0.01 0.00 -1.81 0.00 0.00 61.98 59.99 2rov s VAL 61 Cb -0.31 -3.57 0.01 0.00 0.56 0.00 0.00 36.38 33.07 2rov s VAL 61 CO 0.43 -0.23 0.06 0.35 -0.31 0.00 0.00 175.10 175.39 2rov n THR 62 N -1.60 0.00 0.28 5.32 -2.24 -1.26 -4.55 114.28 110.23 2rov n THR 62 Ca -0.03 -1.26 0.17 0.00 -2.27 0.00 0.00 64.05 60.65 2rov n THR 62 Cb 0.58 0.13 0.83 0.00 -2.10 0.00 0.00 70.33 69.77 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 -1.42 115.11 116.73 2rov h GLN 63 Ca -0.22 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.13 2rov h GLN 63 Cb 0.69 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.22 2rov h GLN 63 CO 0.36 0.00 -0.73 1.79 -2.65 0.00 0.00 178.83 177.59 2rov h THR 64 N 0.00 1.29 0.00 2.39 1.35 -2.02 -3.22 112.91 112.69 2rov h THR 64 Ca 0.00 -2.75 -0.08 0.00 -0.55 0.00 0.00 66.41 63.03 2rov h THR 64 Cb 0.14 2.59 -0.01 0.00 -1.73 0.00 0.00 68.15 69.14 2rov h THR 64 CO 0.00 0.72 -0.39 -0.78 -0.25 0.00 0.00 175.52 174.82 2rov h ASP 65 N 0.00 0.00 -4.81 5.36 1.82 -1.64 -3.46 116.42 113.69 2rov h ASP 65 Ca -0.01 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.10 2rov h ASP 65 Cb 1.53 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 41.42 2rov h ASP 65 CO 0.10 0.39 -0.45 1.33 -1.61 0.00 0.00 179.24 179.00 2rov n VAL 66 N -3.44 0.00 0.00 2.25 0.24 -1.22 -5.02 118.33 111.14 2rov n VAL 66 Ca 0.00 -2.31 0.00 0.00 -2.04 0.00 0.00 64.34 60.00 2rov n VAL 66 Cb 0.56 0.83 0.00 0.00 -1.47 0.00 0.00 33.84 33.76 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 -0.88 -1.19 0.22 6.34 4.11 -1.26 -4.81 117.16 119.68 2rov n TYR 67 Ca -0.05 0.00 0.09 0.00 -0.00 0.00 0.00 57.90 57.94 2rov n TYR 67 Cb 0.59 0.49 0.47 0.00 -0.00 0.00 0.00 39.34 40.89 2rov n TYR 67 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.86 176.93 2rov h ARG 68 N 0.00 0.00 0.00 -3.48 -0.00 -1.96 -3.44 114.38 105.50 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 0.25 0.00 0.00 -0.00 0.00 0.00 179.97 180.22 2rov n ALA 69 N -2.25 0.00 -2.54 0.08 0.00 -1.26 -5.04 120.51 109.49 2rov n ALA 69 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.20 2rov n ALA 69 Cb 0.42 0.00 -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 -0.51 0.00 0.00 0.00 177.50 176.99 2rov s ASP 70 N -1.97 2.13 0.54 0.00 1.01 -1.26 -5.01 116.67 112.11 2rov s ASP 70 Ca 0.00 -0.47 0.35 0.00 0.71 0.00 0.00 52.55 53.14 2rov s ASP 70 Cb 0.00 -0.17 1.52 0.00 1.01 0.00 0.00 42.92 45.28 2rov s ASP 70 CO 0.00 0.12 1.83 0.00 0.21 0.00 0.00 175.17 177.33 2rov h ALA 71 N 5.00 3.01 0.00 5.23 0.00 -1.96 0.84 119.26 131.38 2rov h ALA 71 Ca -0.40 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 2rov h ALA 71 Cb 1.17 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2rov h ALA 71 CO 0.44 -1.34 -0.86 1.57 0.00 0.00 0.00 179.25 179.07 2rov h LYS 72 N 0.00 0.00 0.04 0.00 -0.00 -2.03 -3.31 116.57 111.27 2rov h LYS 72 Ca 0.51 0.00 -0.23 0.00 -0.00 0.00 0.00 60.65 60.93 2rov h LYS 72 Cb 2.07 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 34.28 2rov h LYS 72 CO -0.01 0.55 -1.06 0.93 -0.00 0.00 0.00 179.45 179.87 2rov h GLU 73 N 0.00 0.10 -0.56 0.07 4.39 0.20 -3.35 114.58 115.43 2rov h GLU 73 Ca -0.05 -0.17 0.11 0.00 0.34 0.00 0.00 59.36 59.58 2rov h GLU 73 Cb 1.53 0.06 -0.11 0.00 -0.10 0.00 0.00 28.75 30.13 2rov h GLU 73 CO 0.07 1.06 -0.28 0.82 -1.16 0.00 0.00 179.01 179.53 2rov h ILE 74 N 0.03 0.24 0.00 3.13 1.08 -1.09 0.40 117.51 121.30 2rov h ILE 74 Ca -0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 2rov h ILE 74 Cb 1.80 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 35.79 2rov h ILE 74 CO 0.15 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.80 2rov n PRO 75 N -5.43 0.06 -0.17 2.37 -0.04 -1.26 -1.75 135.00 128.79 2rov n PRO 75 Ca 0.05 0.39 0.10 0.00 -0.04 0.00 0.00 63.50 64.00 2rov n PRO 75 Cb 0.35 -1.64 0.19 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.77 2.34 -4.95 0.54 1.74 0.13 -4.78 116.66 109.92 2rov n ARG 76 Ca 0.02 -2.15 -0.32 0.00 -0.77 0.00 0.00 57.85 54.63 2rov n ARG 76 Cb 0.13 -1.45 -0.14 0.00 -1.02 0.00 0.00 32.46 29.98 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 -1.34 2.88 0.09 0.55 1.01 -0.72 0.42 121.20 124.10 2rov s ILE 77 Ca 0.34 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 60.25 2rov s ILE 77 Cb 0.20 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.51 2rov s ILE 77 CO 0.28 0.58 -0.12 0.72 0.00 0.00 0.00 174.94 176.40 2rov s PHE 78 N -0.54 1.16 -0.05 3.97 -0.71 -0.84 -1.35 117.98 119.62 2rov s PHE 78 Ca 0.07 -0.56 0.06 0.00 -1.04 0.00 0.00 56.93 55.46 2rov s PHE 78 Cb -0.11 -0.63 -0.02 0.00 -1.21 0.00 0.00 43.02 41.04 2rov s PHE 78 CO 0.01 0.05 -0.21 -1.14 -1.34 0.00 0.00 175.22 172.59 2rov s GLN 79 N -2.36 2.44 -0.18 1.99 0.74 -0.21 -1.79 119.66 120.28 2rov s GLN 79 Ca 0.03 -0.83 0.01 0.00 0.05 0.00 0.00 55.36 54.61 2rov s GLN 79 Cb -0.06 -2.22 0.04 0.00 1.10 0.00 0.00 33.01 31.86 2rov s GLN 79 CO 0.01 0.51 -0.12 0.42 -0.55 0.00 0.00 175.29 175.57 2rov s ILE 80 N -0.47 1.65 0.19 -2.34 1.09 -0.79 -1.89 121.20 118.64 2rov s ILE 80 Ca 0.06 -0.90 -0.16 0.00 -1.10 0.00 0.00 60.65 58.55 2rov s ILE 80 Cb -0.12 -1.66 -0.08 0.00 -1.06 0.00 0.00 42.46 39.55 2rov s ILE 80 CO 0.01 0.28 0.63 -0.22 -0.10 0.00 0.00 174.94 175.54 2rov s LEU 81 N 1.41 4.32 -0.13 2.97 2.96 0.76 -0.60 118.68 130.38 2rov s LEU 81 Ca 0.01 1.23 -0.17 0.00 -0.22 0.00 0.00 54.13 54.98 2rov s LEU 81 Cb -0.15 -3.44 0.04 0.00 0.50 0.00 0.00 46.19 43.14 2rov s LEU 81 CO -0.09 0.06 0.44 -0.72 -1.32 0.00 0.00 176.35 174.72 2rov s TYR 82 N -1.52 -0.45 -0.12 5.38 1.13 0.60 -0.55 117.35 121.82 2rov s TYR 82 Ca 0.41 1.02 -0.29 0.00 -1.41 0.00 0.00 57.07 56.80 2rov s TYR 82 Cb -0.15 0.17 -0.03 0.00 -1.10 0.00 0.00 41.96 40.85 2rov s TYR 82 CO 0.20 -0.30 1.37 0.00 -2.51 0.00 0.00 175.55 174.31 2rov s ALA 83 N -0.17 3.63 -0.25 9.51 0.00 -0.92 -1.62 121.76 131.95 2rov s ALA 83 Ca -0.03 0.62 -0.07 0.00 0.00 0.00 0.00 51.96 52.48 2rov s ALA 83 Cb -0.03 -3.64 -0.16 0.00 0.00 0.00 0.00 23.12 19.28 2rov s ALA 83 CO 0.02 -1.18 -0.17 0.27 0.00 0.00 0.00 175.76 174.70 2rov n ASN 84 N 6.55 1.98 0.00 0.00 0.23 -1.26 -4.82 115.26 117.93 2rov n ASN 84 Ca 0.14 0.12 0.00 0.00 -0.53 0.00 0.00 54.58 54.32 2rov n ASN 84 Cb 0.44 -0.66 0.00 0.00 -2.08 0.00 0.00 39.78 37.48 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 -3.75 0.00 0.00 -3.83 -0.58 -1.26 -5.05 120.64 106.17 2rov n GLU 85 Ca -0.46 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.28 2rov n GLU 85 Cb 0.93 -0.97 0.00 0.00 -0.57 0.00 0.00 31.44 30.83 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 3.46 0.49 1.84 0.62 0.00 -1.26 -5.07 105.19 105.26 2rov n GLY 86 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.06 -0.61 -0.00 -1.26 -4.71 119.36 112.90 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 -0.32 0.53 0.00 -0.00 0.00 0.00 39.64 39.85 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 0.26 1.51 4.38 0.87 -2.00 0.08 113.55 118.65 2rov h SER 88 Ca 0.00 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2rov h SER 88 Cb 0.00 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2rov h SER 88 CO 0.00 0.18 -0.06 0.28 -0.53 0.00 0.00 176.83 176.70 2rov h SER 89 N 0.30 0.00 -0.95 6.23 0.02 -1.97 -3.46 113.55 113.72 2rov h SER 89 Ca 0.15 0.00 -0.87 0.00 -0.84 0.00 0.00 61.79 60.22 2rov h SER 89 Cb 0.20 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.75 2rov h SER 89 CO -0.03 0.06 0.72 0.00 -1.14 0.00 0.00 176.83 176.44 2rov n ALA 90 N -2.12 -1.28 -2.42 3.77 0.00 0.01 -4.70 120.51 113.78 2rov n ALA 90 Ca 0.02 0.48 -0.23 0.00 0.00 0.00 0.00 53.44 53.72 2rov n ALA 90 Cb 0.46 -1.93 0.14 0.00 0.00 0.00 0.00 19.45 18.12 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 4.17 -0.45 -4.32 0.00 4.76 -0.64 -4.71 118.16 116.97 2rov n LYS 91 Ca 0.32 -2.55 -0.17 0.00 -2.87 0.00 0.00 58.31 53.05 2rov n LYS 91 Cb -0.06 -0.86 -0.10 0.00 -1.84 0.00 0.00 35.03 32.16 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 -5.31 1.49 -0.12 4.39 6.03 -1.26 -0.29 114.94 119.87 2rov s ASN 92 Ca 0.69 -1.31 -0.00 0.00 -1.03 0.00 0.00 52.86 51.21 2rov s ASN 92 Cb -0.03 0.09 0.02 0.00 -3.03 0.00 0.00 41.25 38.30 2rov s ASN 92 CO 0.47 -0.64 -0.10 -0.22 -2.03 0.00 0.00 177.10 174.58 2rov s LEU 93 N -3.31 1.38 -0.24 3.54 0.20 0.23 -4.91 118.68 115.57 2rov s LEU 93 Ca 0.33 -0.36 -0.16 0.00 0.69 0.00 0.00 54.13 54.63 2rov s LEU 93 Cb 0.07 -0.95 -0.04 0.00 -0.43 0.00 0.00 46.19 44.84 2rov s LEU 93 CO 0.11 -0.09 0.41 -0.76 -0.29 0.00 0.00 176.35 175.73 2rov s LEU 94 N 1.57 4.09 -0.13 -0.68 2.01 -1.26 -1.88 118.68 122.40 2rov s LEU 94 Ca 0.04 0.43 0.00 0.00 0.01 0.00 0.00 54.13 54.62 2rov s LEU 94 Cb -0.13 -2.51 0.02 0.00 0.01 0.00 0.00 46.19 43.58 2rov s LEU 94 CO -0.08 -0.15 -0.13 -0.76 1.01 0.00 0.00 176.35 176.23 2rov s LEU 95 N 1.77 1.58 -0.28 1.79 1.43 -0.74 -4.42 118.68 119.81 2rov s LEU 95 Ca 0.18 -0.43 -0.17 0.00 -1.03 0.00 0.00 54.13 52.68 2rov s LEU 95 Cb -0.15 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 44.96 2rov s LEU 95 CO 0.09 -0.05 0.46 -0.22 0.23 0.00 0.00 176.35 176.86 2rov s LEU 96 N 1.42 4.10 -0.05 1.79 2.96 0.14 -2.00 118.68 127.05 2rov s LEU 96 Ca 0.02 0.33 -0.16 0.00 -0.22 0.00 0.00 54.13 54.10 2rov s LEU 96 Cb -0.13 -2.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.95 2rov s LEU 96 CO -0.08 -0.29 0.44 0.00 -1.32 0.00 0.00 176.35 175.11 2rov s ALA 97 N 2.23 3.59 0.53 5.97 0.00 0.17 -0.75 121.76 133.51 2rov s ALA 97 Ca 0.18 -0.20 0.24 0.00 0.00 0.00 0.00 51.96 52.19 2rov s ALA 97 Cb -0.16 -2.51 1.40 0.00 0.00 0.00 0.00 23.12 21.85 2rov s ALA 97 CO 0.10 0.26 2.03 -0.91 0.00 0.00 0.00 175.76 177.24 2rov h ASN 98 N 5.60 0.00 -4.27 0.00 2.35 -1.85 -3.41 115.58 114.00 2rov h ASN 98 Ca -0.47 0.00 -0.41 0.00 -0.55 0.00 0.00 56.30 54.87 2rov h ASN 98 Cb 1.20 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.31 2rov h ASN 98 CO 0.68 0.00 -0.78 -0.44 -1.65 0.00 0.00 177.43 175.24 2rov s SER 99 N -6.31 1.37 0.21 5.81 0.01 -1.26 -5.04 113.70 108.48 2rov s SER 99 Ca -0.05 -0.36 -0.10 0.00 1.31 0.00 0.00 55.95 56.75 2rov s SER 99 Cb 0.19 -0.10 0.22 0.00 0.21 0.00 0.00 66.02 66.54 2rov s SER 99 CO 0.70 0.04 1.81 0.74 0.41 0.00 0.00 173.24 176.94 2rov h THR 100 N 4.66 0.98 -0.99 1.44 2.02 -1.86 -1.84 112.91 117.31 2rov h THR 100 Ca -0.35 -0.23 0.13 0.00 0.77 0.00 0.00 66.41 66.73 2rov h THR 100 Cb 1.18 0.24 -0.08 0.00 -1.74 0.00 0.00 68.15 67.75 2rov h THR 100 CO 0.46 0.12 0.62 -0.33 0.37 0.00 0.00 175.52 176.76 2rov h GLU 101 N 0.67 0.90 -0.66 6.66 5.08 -1.96 -1.14 114.58 124.14 2rov h GLU 101 Ca 0.29 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.60 2rov h GLU 101 Cb 0.17 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2rov h GLU 101 CO -0.17 0.60 0.43 1.49 -1.00 0.00 0.00 179.01 180.35 2rov h GLU 102 N 0.93 0.86 -0.88 2.33 4.57 -1.73 -2.02 114.58 118.63 2rov h GLU 102 Ca 0.50 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.62 2rov h GLU 102 Cb 0.56 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 28.92 2rov h GLU 102 CO -0.26 0.57 0.52 0.37 -1.18 0.00 0.00 179.01 179.02 2rov h GLN 103 N 0.88 1.20 -0.65 1.92 -0.00 -1.10 0.20 115.11 117.57 2rov h GLN 103 Ca 0.24 -0.11 -0.05 0.00 -0.00 0.00 0.00 58.65 58.73 2rov h GLN 103 Cb -0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 27.48 27.11 2rov h GLN 103 CO -0.06 0.85 0.21 1.96 0.00 0.00 0.00 178.83 181.79 2rov h GLN 104 N 1.22 1.01 -0.06 1.69 1.08 -0.97 -1.26 115.11 117.82 2rov h GLN 104 Ca 0.32 -0.21 -0.07 0.00 -1.45 0.00 0.00 58.65 57.23 2rov h GLN 104 Cb -0.04 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.25 2rov h GLN 104 CO -0.06 0.88 -0.24 -0.22 -0.95 0.00 0.00 178.83 178.24 2rov h LYS 105 N 0.94 0.27 -0.05 1.46 3.64 -0.91 -1.91 116.57 120.02 2rov h LYS 105 Ca 0.21 -0.21 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2rov h LYS 105 Cb 0.28 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 2rov h LYS 105 CO -0.01 0.84 -0.10 -1.49 -2.27 0.00 0.00 179.45 176.43 2rov h TRP 106 N -0.24 -0.24 0.06 1.91 4.06 -0.56 0.44 115.95 121.38 2rov h TRP 106 Ca -0.01 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2rov h TRP 106 Cb 0.88 0.12 0.00 0.00 -1.00 0.00 0.00 29.16 29.15 2rov h TRP 106 CO 0.13 -0.15 -0.03 0.28 -3.56 0.00 0.00 178.44 175.11 2rov h VAL 107 N -0.14 1.09 -0.47 1.49 2.07 -1.32 0.17 116.25 119.14 2rov h VAL 107 Ca 0.05 -0.49 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 2rov h VAL 107 Cb 0.22 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 2rov h VAL 107 CO -0.13 0.12 0.05 0.28 0.02 0.00 0.00 177.57 177.90 2rov h SER 108 N -0.30 0.70 0.11 0.57 0.02 -1.25 0.12 113.55 113.52 2rov h SER 108 Ca -0.01 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 2rov h SER 108 Cb 0.26 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2rov h SER 108 CO 0.01 0.74 -0.05 0.03 -1.14 0.00 0.00 176.83 176.43 2rov h ARG 109 N 0.71 -0.14 -0.61 3.45 2.47 -0.06 -1.31 114.38 118.89 2rov h ARG 109 Ca 0.15 0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.86 2rov h ARG 109 Cb 0.37 0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.69 2rov h ARG 109 CO 0.01 0.35 0.30 1.37 0.56 0.00 0.00 179.97 182.56 2rov h LEU 110 N -0.90 0.77 -0.18 3.04 8.10 -0.67 -1.85 115.31 123.62 2rov h LEU 110 Ca -0.01 -0.07 -0.14 0.00 0.11 0.00 0.00 57.88 57.76 2rov h LEU 110 Cb 0.55 -0.20 0.00 0.00 -0.44 0.00 0.00 40.66 40.57 2rov h LEU 110 CO 0.02 0.65 -0.43 1.62 -4.11 0.00 0.00 178.44 176.19 2rov h VAL 111 N 0.86 1.33 -0.28 0.15 3.04 -0.86 -3.03 116.25 117.46 2rov h VAL 111 Ca 0.21 -1.67 0.03 0.00 -1.01 0.00 0.00 66.70 64.26 2rov h VAL 111 Cb 0.08 1.92 -0.01 0.00 -2.01 0.00 0.00 31.29 31.26 2rov h VAL 111 CO -0.03 0.52 0.19 0.11 -1.01 0.00 0.00 177.57 177.35 2rov h LYS 112 N 0.29 0.23 0.00 4.17 1.57 -0.90 0.79 116.57 122.71 2rov h LYS 112 Ca -0.00 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2rov h LYS 112 Cb 1.04 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.30 2rov h LYS 112 CO 0.09 0.15 -0.16 0.87 -0.57 0.00 0.00 179.45 179.84 2rov h LYS 113 N 0.23 0.00 -6.83 3.15 1.57 -1.23 -3.45 116.57 110.02 2rov h LYS 113 Ca 0.12 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.36 2rov h LYS 113 Cb 0.17 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.58 2rov h LYS 113 CO -0.02 0.16 0.85 -0.89 -0.57 0.00 0.00 179.45 178.98 2rov n ILE 114 N -3.36 1.29 -0.01 1.86 5.41 0.27 -4.78 119.36 120.05 2rov n ILE 114 Ca -0.00 -0.32 -0.18 0.00 1.00 0.00 0.00 62.75 63.25 2rov n ILE 114 Cb 0.37 -1.97 -0.08 0.00 -0.71 0.00 0.00 39.64 37.25 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 4.28 0.70 -1.63 0.38 0.13 -1.86 -3.27 132.00 130.73 2rov h PRO 115 Ca -0.48 -0.63 -0.55 0.00 -0.87 0.00 0.00 66.00 63.47 2rov h PRO 115 Cb 1.23 0.15 -0.21 0.00 0.13 0.00 0.00 31.00 32.29 2rov h PRO 115 CO 0.75 1.23 0.65 1.63 -0.23 0.00 0.00 178.00 182.04 2rov n LYS 116 N -3.99 2.38 0.00 0.86 5.02 -1.26 -5.16 118.16 116.01 2rov n LYS 116 Ca -0.09 -2.60 0.06 0.00 -2.02 0.00 0.00 58.31 53.66 2rov n LYS 116 Cb 0.75 -2.06 0.33 0.00 -0.02 0.00 0.00 35.03 34.03 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05