#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 0.59 -1.41 1.43 0.00 -1.26 -5.09 116.66 110.92 2rov n ARG 2 Ca 0.00 -1.71 -0.56 0.00 -0.00 0.00 0.00 57.85 55.57 2rov n ARG 2 Cb 0.00 1.82 -0.09 0.00 -0.00 0.00 0.00 32.46 34.19 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 -4.82 117.00 119.71 2rov n LEU 3 Ca -0.02 0.64 -0.11 0.00 -1.11 0.00 0.00 56.01 55.41 2rov n LEU 3 Cb 0.39 -1.07 -0.03 0.00 0.53 0.00 0.00 43.42 43.24 2rov n LEU 3 CO 0.19 -0.72 0.29 -1.83 -1.11 0.00 0.00 177.39 174.21 2rov s GLU 4 N 5.66 1.22 0.00 1.96 -1.05 -1.26 0.63 118.70 125.86 2rov s GLU 4 Ca 1.13 -0.63 0.00 0.00 -0.15 0.00 0.00 54.97 55.32 2rov s GLU 4 Cb -1.19 0.53 0.00 0.00 -0.44 0.00 0.00 34.13 33.03 2rov s GLU 4 CO 0.60 -0.51 0.00 0.41 0.95 0.00 0.00 175.26 176.71 2rov n GLY 5 N -0.32 -0.03 3.14 -3.83 0.00 -0.29 -4.99 105.19 98.87 2rov n GLY 5 Ca -0.15 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 44.44 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 -3.88 2.48 0.13 1.61 0.52 -1.26 -0.22 118.94 118.32 2rov s TRP 6 Ca 0.00 -1.25 0.11 0.00 0.02 0.00 0.00 56.10 54.98 2rov s TRP 6 Cb 0.00 -1.71 -0.04 0.00 -1.15 0.00 0.00 33.47 30.57 2rov s TRP 6 CO 0.00 -0.59 -0.27 -0.51 0.02 0.00 0.00 176.95 175.61 2rov s LEU 7 N 0.89 2.32 -0.02 2.99 1.43 -0.74 -4.78 118.68 120.77 2rov s LEU 7 Ca -0.06 -0.75 -0.19 0.00 -1.03 0.00 0.00 54.13 52.10 2rov s LEU 7 Cb -0.15 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.81 2rov s LEU 7 CO -0.02 0.17 0.54 -0.44 0.23 0.00 0.00 176.35 176.83 2rov s SER 8 N -2.06 6.90 0.19 2.29 0.01 0.28 0.58 113.70 121.89 2rov s SER 8 Ca 0.14 1.07 0.09 0.00 1.31 0.00 0.00 55.95 58.56 2rov s SER 8 Cb -0.10 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 2rov s SER 8 CO 0.06 0.12 -0.19 -0.76 0.41 0.00 0.00 173.24 172.89 2rov s LEU 9 N -0.21 2.48 -0.18 2.44 1.02 -0.50 0.70 118.68 124.42 2rov s LEU 9 Ca 0.29 -0.91 -0.28 0.00 0.02 0.00 0.00 54.13 53.24 2rov s LEU 9 Cb -0.17 -0.88 -0.05 0.00 0.02 0.00 0.00 46.19 45.10 2rov s LEU 9 CO 0.15 -0.03 2.15 -2.16 0.02 0.00 0.00 176.35 176.49 2rov s PRO 10 N -3.03 3.31 0.47 1.29 0.04 -1.26 -2.56 135.00 133.26 2rov s PRO 10 Ca 0.20 2.09 0.05 0.00 0.04 0.00 0.00 61.00 63.37 2rov s PRO 10 Cb -0.05 -4.33 -0.03 0.00 0.04 0.00 0.00 34.50 30.13 2rov s PRO 10 CO 0.08 -1.90 0.11 0.14 0.04 0.00 0.00 177.00 175.46 2rov s VAL 11 N 7.60 1.69 -0.04 -0.36 -7.23 -1.21 -4.99 120.40 115.86 2rov s VAL 11 Ca 0.97 -1.85 0.06 0.00 -1.81 0.00 0.00 61.98 59.35 2rov s VAL 11 Cb -0.34 -2.54 0.09 0.00 0.56 0.00 0.00 36.38 34.15 2rov s VAL 11 CO 0.36 0.00 0.97 0.54 -0.31 0.00 0.00 175.10 176.66 2rov n ARG 12 N -1.27 0.81 0.00 4.82 5.12 -1.26 -2.84 116.66 122.03 2rov n ARG 12 Ca -0.09 -1.49 0.00 0.00 -1.93 0.00 0.00 57.85 54.34 2rov n ARG 12 Cb 0.66 -0.89 0.00 0.00 -1.16 0.00 0.00 32.46 31.07 2rov n ARG 12 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2rov n ASN 13 N -0.53 0.00 -0.08 0.55 3.02 -1.24 -1.38 115.26 115.61 2rov n ASN 13 Ca 0.05 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.44 2rov n ASN 13 Cb 0.59 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.71 2rov n ASN 13 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2rov n ASN 14 N 1.65 1.28 0.00 6.41 6.94 -1.26 -5.07 115.26 125.21 2rov n ASN 14 Ca 0.00 0.22 0.00 0.00 -0.02 0.00 0.00 54.58 54.78 2rov n ASN 14 Cb 0.00 -0.52 0.00 0.00 -2.36 0.00 0.00 39.78 36.90 2rov n ASN 14 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2rov n THR 15 N -3.82 0.00 0.11 5.53 -2.24 -0.48 -4.96 114.28 108.42 2rov n THR 15 Ca -0.29 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.48 2rov n THR 15 Cb 0.67 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 69.14 2rov n THR 15 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2rov h LYS 16 N 0.00 0.18 -7.22 -0.78 1.57 -1.99 -3.44 116.57 104.89 2rov h LYS 16 Ca 0.00 -0.08 -0.50 0.00 -1.87 0.00 0.00 60.65 58.20 2rov h LYS 16 Cb 0.00 -0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.36 2rov h LYS 16 CO 0.00 0.57 0.30 0.21 -0.57 0.00 0.00 179.45 179.95 2rov s LYS 17 N -4.12 3.41 0.20 3.15 2.47 -1.26 -5.08 119.74 118.51 2rov s LYS 17 Ca -0.04 0.46 -0.22 0.00 -1.56 0.00 0.00 55.97 54.61 2rov s LYS 17 Cb 0.14 -2.19 0.07 0.00 -1.46 0.00 0.00 37.83 34.39 2rov s LYS 17 CO 0.76 -0.53 0.97 -0.59 0.16 0.00 0.00 175.35 176.12 2rov s PHE 18 N -3.05 -0.00 0.00 4.03 -0.71 -1.26 -3.63 117.98 113.36 2rov s PHE 18 Ca 0.53 -0.40 0.00 0.00 -1.04 0.00 0.00 56.93 56.02 2rov s PHE 18 Cb -0.11 0.70 0.00 0.00 -1.21 0.00 0.00 43.02 42.40 2rov s PHE 18 CO 0.50 -0.99 0.00 0.41 -1.34 0.00 0.00 175.22 173.80 2rov n GLY 19 N -0.58 -0.38 3.11 1.99 0.00 -1.13 -4.89 105.19 103.30 2rov n GLY 19 Ca -0.05 0.35 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 0.77 -0.16 1.61 0.52 -1.26 -3.31 118.94 117.11 2rov s TRP 20 Ca 0.00 -0.69 -0.04 0.00 0.02 0.00 0.00 56.10 55.38 2rov s TRP 20 Cb 0.00 -0.46 0.08 0.00 -1.15 0.00 0.00 33.47 31.95 2rov s TRP 20 CO 0.00 -0.12 0.26 0.54 0.02 0.00 0.00 176.95 177.65 2rov s VAL 21 N -2.43 -0.40 -0.45 4.03 0.11 -1.06 -4.89 120.40 115.31 2rov s VAL 21 Ca 0.00 0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 58.88 2rov s VAL 21 Cb -0.03 -0.55 0.02 0.00 -1.53 0.00 0.00 36.38 34.29 2rov s VAL 21 CO -0.02 -0.01 1.28 -1.59 -3.33 0.00 0.00 175.10 171.43 2rov s LYS 22 N 2.40 3.63 -0.03 1.54 -2.85 -1.24 -1.41 119.74 121.78 2rov s LYS 22 Ca 0.04 0.73 -0.02 0.00 -1.00 0.00 0.00 55.97 55.71 2rov s LYS 22 Cb -0.14 -3.97 -0.04 0.00 -2.06 0.00 0.00 37.83 31.62 2rov s LYS 22 CO -0.10 -1.50 0.11 0.15 0.10 0.00 0.00 175.35 174.11 2rov s LYS 23 N 4.74 3.23 -0.46 1.78 -0.14 0.20 -4.68 119.74 124.41 2rov s LYS 23 Ca 0.54 -0.37 -0.27 0.00 -1.36 0.00 0.00 55.97 54.52 2rov s LYS 23 Cb -0.10 -2.98 -0.03 0.00 -1.68 0.00 0.00 37.83 33.03 2rov s LYS 23 CO 0.32 0.68 2.01 -0.47 -0.76 0.00 0.00 175.35 177.13 2rov s TYR 24 N -1.17 1.51 -0.17 3.18 6.14 -0.49 -1.79 117.35 124.56 2rov s TYR 24 Ca 0.22 0.90 -0.06 0.00 0.64 0.00 0.00 57.07 58.76 2rov s TYR 24 Cb -0.12 -3.96 -0.04 0.00 0.42 0.00 0.00 41.96 38.26 2rov s TYR 24 CO 0.12 -2.74 0.03 0.08 0.64 0.00 0.00 175.55 173.68 2rov s VAL 25 N 9.07 4.47 -0.14 3.14 1.01 0.69 0.25 120.40 138.89 2rov s VAL 25 Ca 0.82 -0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.63 2rov s VAL 25 Cb -0.19 -3.00 0.04 0.00 0.00 0.00 0.00 36.38 33.24 2rov s VAL 25 CO 0.27 0.47 0.01 -0.63 0.00 0.00 0.00 175.10 175.23 2rov s ILE 26 N 0.34 0.57 -0.57 2.22 1.01 -0.39 -1.14 121.20 123.24 2rov s ILE 26 Ca 0.01 -0.32 -0.23 0.00 0.00 0.00 0.00 60.65 60.10 2rov s ILE 26 Cb -0.13 -0.89 0.05 0.00 0.01 0.00 0.00 42.46 41.50 2rov s ILE 26 CO 0.01 0.02 0.91 -0.69 0.00 0.00 0.00 174.94 175.20 2rov s VAL 27 N 1.86 4.43 0.66 2.92 1.01 0.20 -0.05 120.40 131.44 2rov s VAL 27 Ca 0.02 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 2rov s VAL 27 Cb -0.15 -4.55 0.07 0.00 0.00 0.00 0.00 36.38 31.76 2rov s VAL 27 CO -0.07 -1.16 0.93 -0.44 0.00 0.00 0.00 175.10 174.36 2rov s SER 28 N 3.02 4.80 -0.31 3.32 0.01 0.32 -3.93 113.70 120.93 2rov s SER 28 Ca 0.27 0.05 -0.40 0.00 1.31 0.00 0.00 55.95 57.18 2rov s SER 28 Cb -0.14 -0.69 -0.15 0.00 0.21 0.00 0.00 66.02 65.24 2rov s SER 28 CO 0.16 -1.54 1.82 -1.20 0.41 0.00 0.00 173.24 172.90 2rov n SER 29 N -2.71 2.22 -2.67 2.44 7.64 -1.26 -0.37 113.62 118.90 2rov n SER 29 Ca 0.10 0.97 -0.08 0.00 1.01 0.00 0.00 58.87 60.87 2rov n SER 29 Cb 0.60 -1.13 -0.01 0.00 -1.01 0.00 0.00 64.21 62.66 2rov n SER 29 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2rov n LYS 30 N 5.83 -2.66 -3.53 1.43 2.85 -1.26 -4.87 118.16 115.95 2rov n LYS 30 Ca 0.30 0.24 -0.14 0.00 -1.05 0.00 0.00 58.31 57.67 2rov n LYS 30 Cb 0.12 -4.80 -0.05 0.00 -0.65 0.00 0.00 35.03 29.66 2rov n LYS 30 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2rov s LYS 31 N -5.22 1.09 -0.09 -1.58 2.20 0.50 -3.77 119.74 112.87 2rov s LYS 31 Ca 0.08 -0.21 0.02 0.00 -0.36 0.00 0.00 55.97 55.51 2rov s LYS 31 Cb -0.05 0.50 0.01 0.00 -1.51 0.00 0.00 37.83 36.79 2rov s LYS 31 CO 0.10 -0.41 -0.14 0.42 -0.36 0.00 0.00 175.35 174.97 2rov s ILE 32 N -2.53 1.31 0.18 5.43 1.01 0.17 0.12 121.20 126.88 2rov s ILE 32 Ca -0.05 -0.55 0.09 0.00 0.00 0.00 0.00 60.65 60.14 2rov s ILE 32 Cb -0.01 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2rov s ILE 32 CO -0.02 0.40 -0.11 -0.76 0.00 0.00 0.00 174.94 174.45 2rov s LEU 33 N 0.83 2.94 -0.04 2.97 2.01 0.93 0.70 118.68 129.01 2rov s LEU 33 Ca -0.11 -0.59 0.01 0.00 0.01 0.00 0.00 54.13 53.45 2rov s LEU 33 Cb -0.15 -1.63 0.02 0.00 0.01 0.00 0.00 46.19 44.44 2rov s LEU 33 CO 0.02 0.11 -0.03 -0.36 1.01 0.00 0.00 176.35 177.09 2rov s PHE 34 N -1.67 0.66 0.23 0.29 0.40 0.40 -1.27 117.98 117.04 2rov s PHE 34 Ca 0.24 -0.16 0.03 0.00 -0.60 0.00 0.00 56.93 56.44 2rov s PHE 34 Cb -0.09 -0.62 -0.05 0.00 0.51 0.00 0.00 43.02 42.77 2rov s PHE 34 CO 0.15 -0.19 0.02 0.71 0.70 0.00 0.00 175.22 176.61 2rov s TYR 35 N 0.99 1.54 -0.05 0.36 1.51 0.14 0.11 117.35 121.95 2rov s TYR 35 Ca -0.10 -0.98 0.14 0.00 -1.01 0.00 0.00 57.07 55.12 2rov s TYR 35 Cb -0.14 -0.90 -0.22 0.00 -0.11 0.00 0.00 41.96 40.59 2rov s TYR 35 CO -0.01 -0.11 0.25 -0.40 -1.11 0.00 0.00 175.55 174.18 2rov n ASP 36 N -0.42 1.59 -3.11 2.29 5.75 -1.26 -1.39 116.55 119.99 2rov n ASP 36 Ca -0.04 0.00 -0.08 0.00 -0.01 0.00 0.00 54.79 54.66 2rov n ASP 36 Cb 0.64 1.46 0.02 0.00 -1.03 0.00 0.00 41.12 42.21 2rov n ASP 36 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2rov s SER 37 N -3.98 -0.05 0.15 -1.12 0.01 -1.26 -4.66 113.70 102.79 2rov s SER 37 Ca -0.06 -1.04 0.03 0.00 1.31 0.00 0.00 55.95 56.19 2rov s SER 37 Cb 0.08 0.82 -0.07 0.00 0.21 0.00 0.00 66.02 67.07 2rov s SER 37 CO 0.61 -1.61 1.34 -0.08 0.41 0.00 0.00 173.24 173.90 2rov h GLU 38 N 2.00 0.16 -0.71 12.44 4.81 -1.99 -2.87 114.58 128.42 2rov h GLU 38 Ca -0.30 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 2rov h GLU 38 Cb 1.25 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.66 2rov h GLU 38 CO 0.37 0.98 0.38 -0.56 -0.73 0.00 0.00 179.01 179.46 2rov h GLN 39 N 0.08 0.99 0.04 1.92 3.07 -1.99 -1.41 115.11 117.80 2rov h GLN 39 Ca -0.05 -0.11 -0.25 0.00 0.09 0.00 0.00 58.65 58.34 2rov h GLN 39 Cb 1.60 -0.20 0.01 0.00 0.08 0.00 0.00 27.48 28.97 2rov h GLN 39 CO 0.14 0.73 -1.04 -0.44 0.09 0.00 0.00 178.83 178.31 2rov h ASP 40 N 0.99 0.58 0.11 0.06 3.32 -1.90 -3.01 116.42 116.57 2rov h ASP 40 Ca 0.25 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 2rov h ASP 40 Cb 0.03 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.41 2rov h ASP 40 CO -0.04 1.31 -0.05 0.50 -1.72 0.00 0.00 179.24 179.24 2rov h LYS 41 N 0.22 -0.14 0.00 3.56 3.11 -1.23 -0.39 116.57 121.70 2rov h LYS 41 Ca -0.10 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.73 2rov h LYS 41 Cb 1.69 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.95 2rov h LYS 41 CO 0.18 -0.02 -0.07 1.05 -2.81 0.00 0.00 179.45 177.77 2rov h GLU 42 N -0.22 0.00 -0.13 1.90 4.11 -1.36 -0.54 114.58 118.34 2rov h GLU 42 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2rov h GLU 42 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2rov h GLU 42 CO 0.02 0.07 0.00 1.04 0.07 0.00 0.00 179.01 180.22 2rov n GLN 43 N -3.77 1.46 -3.37 1.06 1.13 -0.90 -4.90 117.38 108.09 2rov n GLN 43 Ca -0.02 -0.70 -0.23 0.00 -1.94 0.00 0.00 57.00 54.11 2rov n GLN 43 Cb 0.17 -1.31 0.06 0.00 0.11 0.00 0.00 30.24 29.27 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 -0.05 -6.19 -4.00 1.08 7.64 -0.21 -4.95 113.62 106.93 2rov n SER 44 Ca 0.13 -0.44 -0.33 0.00 1.01 0.00 0.00 58.87 59.24 2rov n SER 44 Cb 0.22 -4.88 -0.08 0.00 -1.01 0.00 0.00 64.21 58.46 2rov n SER 44 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2rov n ASN 45 N -2.71 3.92 -4.63 6.43 2.85 -0.21 -5.04 115.26 115.87 2rov n ASN 45 Ca -0.03 -3.19 -0.43 0.00 -0.11 0.00 0.00 54.58 50.82 2rov n ASN 45 Cb 0.58 -0.95 -0.02 0.00 1.24 0.00 0.00 39.78 40.62 2rov n ASN 45 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2rov s PRO 46 N -1.54 3.82 0.42 1.20 0.04 -1.26 -4.57 135.00 133.11 2rov s PRO 46 Ca 0.28 1.40 0.13 0.00 0.04 0.00 0.00 61.00 62.85 2rov s PRO 46 Cb -0.04 -3.97 0.99 0.00 0.04 0.00 0.00 34.50 31.52 2rov s PRO 46 CO -0.13 -1.25 1.95 -0.92 0.04 0.00 0.00 177.00 176.69 2rov h TYR 47 N 10.11 0.51 -2.14 0.56 3.20 0.40 -3.43 116.97 126.18 2rov h TYR 47 Ca -0.30 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.53 2rov h TYR 47 Cb 1.12 -0.16 -0.21 0.00 1.54 0.00 0.00 36.73 39.02 2rov h TYR 47 CO 0.90 0.23 0.08 1.41 -1.64 0.00 0.00 178.16 179.14 2rov s MET 48 N -5.44 0.84 -0.07 1.82 1.75 -0.85 -4.98 119.30 112.37 2rov s MET 48 Ca -0.08 0.70 -0.01 0.00 -1.25 0.00 0.00 55.69 55.05 2rov s MET 48 Cb 0.20 0.41 0.03 0.00 2.84 0.00 0.00 34.83 38.30 2rov s MET 48 CO 0.76 -0.16 -0.01 0.54 -0.65 0.00 0.00 175.02 175.50 2rov s VAL 49 N -0.13 0.42 0.19 10.11 0.11 -1.26 0.15 120.40 130.00 2rov s VAL 49 Ca -0.03 0.08 0.07 0.00 -2.93 0.00 0.00 61.98 59.16 2rov s VAL 49 Cb -0.03 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.21 2rov s VAL 49 CO 0.03 0.26 0.05 -0.76 -3.33 0.00 0.00 175.10 171.36 2rov s LEU 50 N 1.85 3.47 -0.27 2.54 1.02 0.22 -4.94 118.68 122.57 2rov s LEU 50 Ca 0.03 -0.35 -0.13 0.00 0.02 0.00 0.00 54.13 53.71 2rov s LEU 50 Cb -0.12 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.96 2rov s LEU 50 CO -0.05 0.06 0.30 -1.81 0.02 0.00 0.00 176.35 174.87 2rov s ASP 51 N -3.15 6.17 0.33 2.29 1.11 -1.26 0.43 116.67 122.58 2rov s ASP 51 Ca 0.29 0.18 0.01 0.00 0.18 0.00 0.00 52.55 53.21 2rov s ASP 51 Cb -0.09 -2.18 0.57 0.00 1.07 0.00 0.00 42.92 42.29 2rov s ASP 51 CO 0.20 -0.13 1.99 0.40 1.18 0.00 0.00 175.17 178.82 2rov h ILE 52 N 5.37 1.17 0.00 0.77 2.04 -1.86 -1.23 117.51 123.77 2rov h ILE 52 Ca -0.33 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.14 2rov h ILE 52 Cb 1.17 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2rov h ILE 52 CO 0.61 0.17 -0.29 -0.78 0.00 0.00 0.00 178.15 177.87 2rov h ASP 53 N 0.95 0.00 1.43 1.72 1.82 -1.92 -2.61 116.42 117.82 2rov h ASP 53 Ca 0.26 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.87 2rov h ASP 53 Cb -0.09 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 39.92 2rov h ASP 53 CO -0.06 0.29 -0.16 0.11 -1.61 0.00 0.00 179.24 177.81 2rov h LYS 54 N 0.00 0.00 -6.64 0.28 1.57 -1.63 -3.46 116.57 106.70 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 0.68 0.00 0.16 0.00 0.08 0.00 0.00 32.23 33.15 2rov h LYS 54 CO 0.04 0.16 -0.11 1.28 -0.57 0.00 0.00 179.45 180.25 2rov n LEU 55 N -3.20 2.10 -0.05 2.94 4.77 -0.99 -3.12 117.00 119.46 2rov n LEU 55 Ca 0.02 0.83 -0.05 0.00 -0.03 0.00 0.00 56.01 56.77 2rov n LEU 55 Cb 0.50 -1.28 -0.07 0.00 -2.33 0.00 0.00 43.42 40.25 2rov n LEU 55 CO 0.34 -2.33 -0.82 0.49 -1.33 0.00 0.00 177.39 173.74 2rov n PHE 56 N -1.43 0.00 -3.62 -1.77 3.01 0.14 -4.91 117.46 108.88 2rov n PHE 56 Ca 0.12 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.52 2rov n PHE 56 Cb 0.45 -0.46 -0.05 0.00 -0.01 0.00 0.00 39.48 39.41 2rov n PHE 56 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2rov s HIS 57 N -2.23 -0.19 -0.07 1.38 2.46 -1.23 -4.99 115.29 110.42 2rov s HIS 57 Ca -0.07 0.37 -0.01 0.00 0.47 0.00 0.00 55.06 55.82 2rov s HIS 57 Cb 0.03 0.47 0.03 0.00 -0.13 0.00 0.00 32.58 32.97 2rov s HIS 57 CO 0.36 -0.15 0.00 0.08 -2.47 0.00 0.00 174.74 172.56 2rov s VAL 58 N -0.78 0.35 0.08 0.89 1.01 -1.26 -1.22 120.40 119.46 2rov s VAL 58 Ca 0.05 0.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.90 2rov s VAL 58 Cb -0.02 -0.51 0.08 0.00 0.00 0.00 0.00 36.38 35.93 2rov s VAL 58 CO -0.06 0.26 0.67 0.00 0.00 0.00 0.00 175.10 175.97 2rov s ARG 59 N 1.96 1.15 0.75 2.72 1.70 -0.92 -5.00 118.95 121.31 2rov s ARG 59 Ca 0.05 -0.25 -0.15 0.00 -0.47 0.00 0.00 55.73 54.91 2rov s ARG 59 Cb -0.12 0.53 0.05 0.00 -0.57 0.00 0.00 34.95 34.84 2rov s ARG 59 CO -0.05 -0.47 1.24 -1.25 -1.08 0.00 0.00 175.30 173.69 2rov s PRO 60 N -2.95 1.96 0.60 3.89 0.04 -1.26 -1.27 135.00 136.00 2rov s PRO 60 Ca -0.02 1.86 0.04 0.00 0.04 0.00 0.00 61.00 62.93 2rov s PRO 60 Cb -0.01 -1.80 0.08 0.00 0.04 0.00 0.00 34.50 32.81 2rov s PRO 60 CO -0.06 -2.00 0.83 0.14 0.04 0.00 0.00 177.00 175.95 2rov s VAL 61 N -1.89 2.35 0.19 -0.36 -7.23 -0.16 -4.74 120.40 108.56 2rov s VAL 61 Ca 0.76 -0.79 0.01 0.00 -1.81 0.00 0.00 61.98 60.16 2rov s VAL 61 Cb -0.32 -2.56 -0.00 0.00 0.56 0.00 0.00 36.38 34.06 2rov s VAL 61 CO 0.47 0.00 0.04 0.35 -0.31 0.00 0.00 175.10 175.64 2rov n THR 62 N -2.43 0.00 0.30 5.32 -2.24 -1.26 -4.60 114.28 109.37 2rov n THR 62 Ca 0.13 -0.99 0.12 0.00 -2.27 0.00 0.00 64.05 61.04 2rov n THR 62 Cb 0.61 0.29 0.55 0.00 -2.10 0.00 0.00 70.33 69.68 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 -1.96 -2.04 115.11 116.08 2rov h GLN 63 Ca -0.15 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.18 2rov h GLN 63 Cb 0.51 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 2rov h GLN 63 CO 0.24 0.00 -0.98 1.79 -2.65 0.00 0.00 178.83 177.23 2rov h THR 64 N 0.00 1.08 0.00 2.39 1.35 -2.02 -3.29 112.91 112.42 2rov h THR 64 Ca 0.00 -2.64 -0.10 0.00 -0.55 0.00 0.00 66.41 63.13 2rov h THR 64 Cb 0.22 2.49 -0.01 0.00 -1.73 0.00 0.00 68.15 69.12 2rov h THR 64 CO 0.00 0.61 -0.47 -0.78 -0.25 0.00 0.00 175.52 174.64 2rov h ASP 65 N 0.00 0.00 -4.44 5.36 1.82 -1.76 -3.46 116.42 113.95 2rov h ASP 65 Ca -0.07 0.00 -0.53 0.00 -0.39 0.00 0.00 57.03 56.04 2rov h ASP 65 Cb 1.63 0.00 -0.13 0.00 0.68 0.00 0.00 39.33 41.50 2rov h ASP 65 CO 0.08 0.47 -0.49 0.68 -1.61 0.00 0.00 179.24 178.37 2rov s VAL 66 N -3.91 0.27 0.00 2.25 -7.23 -1.23 -5.03 120.40 105.52 2rov s VAL 66 Ca -0.02 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.15 2rov s VAL 66 Cb 0.13 -2.38 0.00 0.00 0.56 0.00 0.00 36.38 34.69 2rov s VAL 66 CO 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 175.52 2rov n TYR 67 N -0.80 -0.35 0.21 2.82 4.11 -1.26 -4.79 117.16 117.10 2rov n TYR 67 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.98 2rov n TYR 67 Cb 0.63 0.45 0.44 0.00 -0.00 0.00 0.00 39.34 40.86 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 -3.44 114.38 105.48 2rov h ARG 68 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.96 2rov h ARG 68 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 29.98 2rov h ARG 68 CO 0.00 0.30 -0.01 0.00 -0.00 0.00 0.00 179.97 180.26 2rov n ALA 69 N -2.30 -0.33 -2.50 0.08 0.00 -1.26 -5.04 120.51 109.16 2rov n ALA 69 Ca -0.01 -0.10 -0.25 0.00 0.00 0.00 0.00 53.44 53.09 2rov n ALA 69 Cb 0.43 -0.01 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 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 -1.87 2.24 0.56 0.00 2.15 -1.26 -5.01 116.67 113.47 2rov s ASP 70 Ca 0.04 -0.43 0.33 0.00 0.43 0.00 0.00 52.55 52.93 2rov s ASP 70 Cb -0.01 -0.21 1.47 0.00 -0.30 0.00 0.00 42.92 43.87 2rov s ASP 70 CO 0.03 0.18 1.80 0.00 -0.17 0.00 0.00 175.17 177.01 2rov h ALA 71 N 5.25 2.83 0.00 3.66 0.00 -1.96 0.90 119.26 129.94 2rov h ALA 71 Ca -0.40 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.30 2rov h ALA 71 Cb 1.16 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2rov h ALA 71 CO 0.46 -1.24 -0.95 0.87 0.00 0.00 0.00 179.25 178.38 2rov h LYS 72 N 0.00 0.00 0.04 0.00 1.57 -2.03 -3.31 116.57 112.84 2rov h LYS 72 Ca 0.45 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 59.00 2rov h LYS 72 Cb 1.96 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.25 2rov h LYS 72 CO -0.00 0.69 -1.06 0.93 -0.57 0.00 0.00 179.45 179.44 2rov h GLU 73 N 0.00 0.09 -0.60 3.15 4.39 0.33 -3.35 114.58 118.59 2rov h GLU 73 Ca -0.06 -0.15 0.11 0.00 0.34 0.00 0.00 59.36 59.61 2rov h GLU 73 Cb 1.64 0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 30.23 2rov h GLU 73 CO 0.09 1.06 -0.27 0.82 -1.16 0.00 0.00 179.01 179.55 2rov h ILE 74 N 0.03 0.23 0.00 3.13 1.08 -1.07 0.46 117.51 121.37 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 1.81 0.23 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 1.55 -0.69 0.00 0.00 178.15 179.16 2rov h PRO 75 N -0.11 0.00 -0.23 2.37 0.13 -1.75 -1.10 132.00 131.32 2rov h PRO 75 Ca 0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 2rov h PRO 75 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2rov h PRO 75 CO -0.67 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 177.64 2rov n ARG 76 N -2.42 2.32 -4.43 0.86 1.74 0.15 -4.83 116.66 110.07 2rov n ARG 76 Ca -0.00 -1.97 -0.34 0.00 -0.77 0.00 0.00 57.85 54.77 2rov n ARG 76 Cb 0.13 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 29.94 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 -1.72 3.13 0.01 0.55 1.01 -0.42 0.55 121.20 124.32 2rov s ILE 77 Ca 0.35 -0.61 0.08 0.00 0.00 0.00 0.00 60.65 60.47 2rov s ILE 77 Cb 0.21 -2.36 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 2rov s ILE 77 CO 0.31 0.49 -0.25 0.72 0.00 0.00 0.00 174.94 176.21 2rov s PHE 78 N 0.78 2.24 -0.07 3.97 -0.71 -0.90 -0.99 117.98 122.29 2rov s PHE 78 Ca -0.04 -0.41 0.00 0.00 -1.04 0.00 0.00 56.93 55.44 2rov s PHE 78 Cb -0.15 -1.39 -0.03 0.00 -1.21 0.00 0.00 43.02 40.24 2rov s PHE 78 CO 0.01 0.04 -0.05 -1.14 -1.34 0.00 0.00 175.22 172.74 2rov s GLN 79 N -0.90 2.82 -0.19 1.99 0.74 -0.40 -1.99 119.66 121.73 2rov s GLN 79 Ca 0.10 -0.51 0.00 0.00 0.05 0.00 0.00 55.36 55.01 2rov s GLN 79 Cb -0.10 -2.65 0.04 0.00 1.10 0.00 0.00 33.01 31.40 2rov s GLN 79 CO 0.00 0.67 -0.09 0.42 -0.55 0.00 0.00 175.29 175.75 2rov s ILE 80 N -0.82 1.50 0.10 -2.34 1.09 -0.77 -2.16 121.20 117.80 2rov s ILE 80 Ca 0.13 -0.91 -0.19 0.00 -1.10 0.00 0.00 60.65 58.57 2rov s ILE 80 Cb -0.11 -1.60 -0.07 0.00 -1.06 0.00 0.00 42.46 39.62 2rov s ILE 80 CO 0.02 0.16 0.60 -0.22 -0.10 0.00 0.00 174.94 175.40 2rov s LEU 81 N 1.46 4.50 -0.03 2.97 2.96 -0.36 -0.54 118.68 129.64 2rov s LEU 81 Ca -0.01 1.30 -0.20 0.00 -0.22 0.00 0.00 54.13 55.00 2rov s LEU 81 Cb -0.16 -3.04 0.04 0.00 0.50 0.00 0.00 46.19 43.53 2rov s LEU 81 CO -0.08 0.23 0.44 -0.72 -1.32 0.00 0.00 176.35 174.90 2rov s TYR 82 N -1.19 -0.36 -0.04 5.38 1.13 0.45 0.27 117.35 123.00 2rov s TYR 82 Ca 0.32 0.60 -0.30 0.00 -1.41 0.00 0.00 57.07 56.28 2rov s TYR 82 Cb -0.19 0.21 -0.05 0.00 -1.10 0.00 0.00 41.96 40.83 2rov s TYR 82 CO 0.20 -0.46 1.42 0.00 -2.51 0.00 0.00 175.55 174.21 2rov s ALA 83 N -1.21 3.60 -0.24 9.51 0.00 -1.18 -1.70 121.76 130.54 2rov s ALA 83 Ca -0.12 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 52.65 2rov s ALA 83 Cb -0.03 -3.63 -0.14 0.00 0.00 0.00 0.00 23.12 19.32 2rov s ALA 83 CO 0.06 -1.04 -0.23 0.27 0.00 0.00 0.00 175.76 174.82 2rov n ASN 84 N 5.90 2.11 0.00 0.00 0.23 -1.26 -4.86 115.26 117.38 2rov n ASN 84 Ca 0.14 -0.05 0.00 0.00 -0.53 0.00 0.00 54.58 54.14 2rov n ASN 84 Cb 0.44 -0.43 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 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 -3.35 0.00 0.00 -3.83 -0.58 -1.26 -5.05 120.64 106.56 2rov n GLU 85 Ca -0.43 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.31 2rov n GLU 85 Cb 0.92 -0.76 0.00 0.00 -0.57 0.00 0.00 31.44 31.03 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 2.97 1.20 1.83 0.62 0.00 -1.26 -5.08 105.19 105.48 2rov n GLY 86 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.24 -0.61 -0.00 -1.26 -4.74 119.36 113.05 2rov n ILE 87 Ca 0.00 0.02 0.08 0.00 -0.00 0.00 0.00 62.75 62.84 2rov n ILE 87 Cb 0.00 -0.31 0.61 0.00 -0.00 0.00 0.00 39.64 39.95 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 0.02 1.54 4.38 0.87 -2.00 -0.39 113.55 117.98 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 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2rov h SER 88 CO 0.00 0.04 -0.04 0.28 -0.53 0.00 0.00 176.83 176.58 2rov h SER 89 N 0.03 0.00 -0.53 6.23 0.02 -1.97 -3.46 113.55 113.87 2rov h SER 89 Ca 0.01 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 60.22 2rov h SER 89 Cb 0.03 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2rov h SER 89 CO 0.00 0.04 0.84 0.00 -1.14 0.00 0.00 176.83 176.57 2rov n ALA 90 N -2.11 -0.64 -2.20 3.77 0.00 -0.16 -4.70 120.51 114.47 2rov n ALA 90 Ca 0.02 0.33 -0.18 0.00 0.00 0.00 0.00 53.44 53.61 2rov n ALA 90 Cb 0.45 -1.76 0.13 0.00 0.00 0.00 0.00 19.45 18.26 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 4.81 -0.43 -4.36 0.00 4.76 -0.69 -4.68 118.16 117.58 2rov n LYS 91 Ca 0.36 -1.97 -0.18 0.00 -2.87 0.00 0.00 58.31 53.65 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 1.85 -0.13 4.39 6.03 -1.26 -0.41 114.94 120.85 2rov s ASN 92 Ca 0.57 -1.29 0.00 0.00 -1.03 0.00 0.00 52.86 51.10 2rov s ASN 92 Cb -0.02 0.01 0.02 0.00 -3.03 0.00 0.00 41.25 38.23 2rov s ASN 92 CO 0.39 -0.58 -0.12 -0.22 -2.03 0.00 0.00 177.10 174.54 2rov s LEU 93 N -3.36 1.49 -0.23 3.54 0.20 0.30 -4.91 118.68 115.71 2rov s LEU 93 Ca 0.32 -0.41 -0.17 0.00 0.69 0.00 0.00 54.13 54.56 2rov s LEU 93 Cb 0.07 -1.04 -0.03 0.00 -0.43 0.00 0.00 46.19 44.75 2rov s LEU 93 CO 0.11 -0.08 0.46 -0.76 -0.29 0.00 0.00 176.35 175.80 2rov s LEU 94 N 1.56 4.10 -0.20 -0.68 2.01 -1.26 -1.85 118.68 122.35 2rov s LEU 94 Ca 0.05 0.51 0.00 0.00 0.01 0.00 0.00 54.13 54.70 2rov s LEU 94 Cb -0.13 -2.59 0.05 0.00 0.01 0.00 0.00 46.19 43.53 2rov s LEU 94 CO -0.09 -0.19 -0.06 -0.76 1.01 0.00 0.00 176.35 176.25 2rov s LEU 95 N 1.85 2.12 -0.25 1.79 1.43 -0.84 -4.37 118.68 120.41 2rov s LEU 95 Ca 0.20 -0.91 -0.21 0.00 -1.03 0.00 0.00 54.13 52.19 2rov s LEU 95 Cb -0.15 -1.09 -0.02 0.00 0.03 0.00 0.00 46.19 44.96 2rov s LEU 95 CO 0.09 -0.19 0.64 -0.22 0.23 0.00 0.00 176.35 176.89 2rov s LEU 96 N 1.49 4.07 -0.06 1.79 2.96 0.22 -2.13 118.68 127.01 2rov s LEU 96 Ca -0.02 0.73 -0.16 0.00 -0.22 0.00 0.00 54.13 54.45 2rov s LEU 96 Cb -0.17 -2.87 -0.05 0.00 0.50 0.00 0.00 46.19 43.60 2rov s LEU 96 CO -0.07 -0.37 0.44 0.00 -1.32 0.00 0.00 176.35 175.02 2rov s ALA 97 N 2.50 3.58 0.60 5.97 0.00 0.19 -0.55 121.76 134.05 2rov s ALA 97 Ca 0.27 -0.21 0.29 0.00 0.00 0.00 0.00 51.96 52.31 2rov s ALA 97 Cb -0.15 -2.52 1.59 0.00 0.00 0.00 0.00 23.12 22.03 2rov s ALA 97 CO 0.08 0.22 1.99 -2.95 0.00 0.00 0.00 175.76 175.11 2rov h ASN 98 N 5.79 0.00 -4.58 0.00 7.08 -1.86 -3.41 115.58 118.59 2rov h ASN 98 Ca -0.46 0.00 -0.26 0.00 -3.08 0.00 0.00 56.30 52.51 2rov h ASN 98 Cb 1.20 0.00 -0.23 0.00 -2.08 0.00 0.00 38.32 37.21 2rov h ASN 98 CO 0.69 0.00 -0.73 -0.44 -2.08 0.00 0.00 177.43 174.87 2rov s SER 99 N -5.37 0.61 0.18 6.14 0.01 -1.26 -5.05 113.70 108.96 2rov s SER 99 Ca -0.04 -0.42 -0.13 0.00 1.31 0.00 0.00 55.95 56.67 2rov s SER 99 Cb 0.15 0.03 0.13 0.00 0.21 0.00 0.00 66.02 66.54 2rov s SER 99 CO 0.52 -0.16 1.80 0.74 0.41 0.00 0.00 173.24 176.54 2rov h THR 100 N 4.67 0.99 -0.97 1.44 2.02 -1.88 -1.98 112.91 117.19 2rov h THR 100 Ca -0.33 -0.19 0.15 0.00 0.77 0.00 0.00 66.41 66.81 2rov h THR 100 Cb 1.20 0.39 -0.09 0.00 -1.74 0.00 0.00 68.15 67.92 2rov h THR 100 CO 0.43 0.10 0.61 -0.33 0.37 0.00 0.00 175.52 176.70 2rov h GLU 101 N 0.55 0.81 -0.76 6.66 5.08 -1.96 -0.65 114.58 124.31 2rov h GLU 101 Ca 0.22 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 2rov h GLU 101 Cb 0.10 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 2rov h GLU 101 CO -0.14 0.54 0.48 1.49 -1.00 0.00 0.00 179.01 180.38 2rov h GLU 102 N 0.84 0.93 -0.73 2.33 4.57 -1.75 -1.69 114.58 119.08 2rov h GLU 102 Ca 0.51 -0.06 -0.05 0.00 -1.18 0.00 0.00 59.36 58.58 2rov h GLU 102 Cb 0.69 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.03 2rov h GLU 102 CO -0.28 0.61 0.26 0.37 -1.18 0.00 0.00 179.01 178.79 2rov h GLN 103 N 0.95 1.10 -0.67 1.92 -0.00 -1.04 0.13 115.11 117.50 2rov h GLN 103 Ca 0.30 -0.21 -0.05 0.00 -0.00 0.00 0.00 58.65 58.69 2rov h GLN 103 Cb -0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 27.48 27.26 2rov h GLN 103 CO -0.10 0.91 0.23 1.96 0.00 0.00 0.00 178.83 181.83 2rov h GLN 104 N 1.07 1.04 0.01 1.69 1.08 -0.91 -1.15 115.11 117.93 2rov h GLN 104 Ca 0.24 -0.21 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2rov h GLN 104 Cb 0.25 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2rov h GLN 104 CO -0.01 0.89 -0.01 -0.22 -0.95 0.00 0.00 178.83 178.53 2rov h LYS 105 N 0.98 -0.02 -0.15 1.46 3.64 -1.03 -1.95 116.57 119.50 2rov h LYS 105 Ca 0.22 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 2rov h LYS 105 Cb 0.28 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 2rov h LYS 105 CO -0.01 0.61 -0.11 -1.49 -2.27 0.00 0.00 179.45 176.18 2rov h TRP 106 N -0.67 -0.28 0.34 1.91 4.06 -0.73 0.38 115.95 120.97 2rov h TRP 106 Ca -0.00 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.95 2rov h TRP 106 Cb 0.64 0.15 0.00 0.00 -1.00 0.00 0.00 29.16 28.95 2rov h TRP 106 CO 0.15 -0.17 -0.16 0.28 -3.56 0.00 0.00 178.44 174.97 2rov h VAL 107 N -0.12 0.68 -0.76 1.49 2.07 -1.31 0.20 116.25 118.49 2rov h VAL 107 Ca 0.09 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.27 2rov h VAL 107 Cb 0.26 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 2rov h VAL 107 CO -0.22 0.07 0.51 -1.28 0.02 0.00 0.00 177.57 176.66 2rov h SER 108 N -0.65 0.86 0.11 0.57 0.87 -1.25 0.39 113.55 114.44 2rov h SER 108 Ca -0.05 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 2rov h SER 108 Cb 0.46 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2rov h SER 108 CO 0.08 0.61 -0.05 0.03 -0.53 0.00 0.00 176.83 176.97 2rov h ARG 109 N 1.01 -0.14 -0.56 2.24 2.47 -0.17 -1.38 114.38 117.85 2rov h ARG 109 Ca 0.29 0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.99 2rov h ARG 109 Cb -0.07 0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.25 2rov h ARG 109 CO -0.07 0.34 0.24 1.37 0.56 0.00 0.00 179.97 182.41 2rov h LEU 110 N -0.89 0.73 -0.20 3.04 8.10 -0.54 -1.76 115.31 123.78 2rov h LEU 110 Ca -0.01 -0.08 -0.16 0.00 0.11 0.00 0.00 57.88 57.73 2rov h LEU 110 Cb 0.55 -0.19 0.00 0.00 -0.44 0.00 0.00 40.66 40.58 2rov h LEU 110 CO 0.02 0.65 -0.50 1.62 -4.11 0.00 0.00 178.44 176.12 2rov h VAL 111 N 0.80 1.31 -0.05 0.15 3.04 -0.31 -3.04 116.25 118.15 2rov h VAL 111 Ca 0.19 -1.72 -0.02 0.00 -1.01 0.00 0.00 66.70 64.14 2rov h VAL 111 Cb 0.14 1.87 -0.00 0.00 -2.01 0.00 0.00 31.29 31.28 2rov h VAL 111 CO -0.02 0.54 -0.05 0.11 -1.01 0.00 0.00 177.57 177.14 2rov h LYS 112 N 0.39 0.07 0.00 4.17 1.57 -0.93 -0.37 116.57 121.46 2rov h LYS 112 Ca -0.01 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2rov h LYS 112 Cb 1.11 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 2rov h LYS 112 CO 0.11 0.12 -0.02 0.87 -0.57 0.00 0.00 179.45 179.96 2rov h LYS 113 N 0.07 0.00 -6.79 3.15 1.57 -1.21 -3.44 116.57 109.91 2rov h LYS 113 Ca 0.02 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.27 2rov h LYS 113 Cb 0.14 0.00 0.06 0.00 0.08 0.00 0.00 32.23 32.51 2rov h LYS 113 CO 0.01 0.02 0.74 0.42 -0.57 0.00 0.00 179.45 180.07 2rov s ILE 114 N -3.69 2.62 0.09 1.86 1.01 -0.15 -4.76 121.20 118.17 2rov s ILE 114 Ca 0.01 0.55 -0.13 0.00 0.00 0.00 0.00 60.65 61.07 2rov s ILE 114 Cb 0.09 -3.35 -0.19 0.00 0.01 0.00 0.00 42.46 39.03 2rov s ILE 114 CO 0.55 0.10 1.26 1.55 0.00 0.00 0.00 174.94 178.40 2rov h PRO 115 N 4.54 0.76 -2.26 2.79 0.13 -1.86 -3.36 132.00 132.75 2rov h PRO 115 Ca -0.47 -0.69 -0.61 0.00 -0.87 0.00 0.00 66.00 63.36 2rov h PRO 115 Cb 1.22 0.17 -0.41 0.00 0.13 0.00 0.00 31.00 32.11 2rov h PRO 115 CO 0.74 1.29 -0.51 1.63 -0.23 0.00 0.00 178.00 180.92 2rov n LYS 116 N -3.91 2.96 0.00 0.86 5.02 -1.26 -5.18 118.16 116.64 2rov n LYS 116 Ca -0.09 -4.74 0.00 0.00 -2.02 0.00 0.00 58.31 51.46 2rov n LYS 116 Cb 0.80 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05