#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 1.04 -1.52 1.43 0.00 -1.26 -5.01 116.66 111.34 2rov n ARG 2 Ca 0.00 -2.81 -0.28 0.00 -0.00 0.00 0.00 57.85 54.76 2rov n ARG 2 Cb 0.00 0.79 -0.13 0.00 -0.00 0.00 0.00 32.46 33.11 2rov n ARG 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2rov n LEU 3 N 0.00 0.48 -4.24 2.89 7.94 -1.26 -4.81 117.00 118.00 2rov n LEU 3 Ca -0.15 -0.55 -0.13 0.00 -1.11 0.00 0.00 56.01 54.06 2rov n LEU 3 Cb 0.49 -1.10 -0.10 0.00 0.53 0.00 0.00 43.42 43.24 2rov n LEU 3 CO 0.26 -1.54 -0.30 -1.83 -1.11 0.00 0.00 177.39 172.87 2rov s GLU 4 N 8.23 1.15 0.00 1.96 -1.05 -1.26 -0.14 118.70 127.59 2rov s GLU 4 Ca 1.18 -1.57 0.00 0.00 -0.15 0.00 0.00 54.97 54.42 2rov s GLU 4 Cb -0.67 -0.15 0.00 0.00 -0.44 0.00 0.00 34.13 32.87 2rov s GLU 4 CO 0.38 -0.20 0.00 0.41 0.95 0.00 0.00 175.26 176.80 2rov n GLY 5 N -0.27 0.28 3.23 -3.83 0.00 -0.22 -4.98 105.19 99.40 2rov n GLY 5 Ca -0.04 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.18 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 -3.24 2.78 0.09 1.61 0.52 -1.26 0.35 118.94 119.79 2rov s TRP 6 Ca 0.00 -1.19 0.10 0.00 0.02 0.00 0.00 56.10 55.03 2rov s TRP 6 Cb 0.00 -1.90 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 2rov s TRP 6 CO 0.00 -0.56 -0.26 -0.51 0.02 0.00 0.00 176.95 175.64 2rov s LEU 7 N 0.96 2.26 0.06 2.99 1.43 -0.51 -4.73 118.68 121.14 2rov s LEU 7 Ca -0.03 -0.68 -0.18 0.00 -1.03 0.00 0.00 54.13 52.22 2rov s LEU 7 Cb -0.15 -1.21 -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 -0.94 0.23 0.00 0.00 176.35 176.34 2rov s SER 8 N -1.72 6.98 0.15 2.29 1.04 0.10 0.52 113.70 123.07 2rov s SER 8 Ca 0.12 1.17 0.07 0.00 0.48 0.00 0.00 55.95 57.80 2rov s SER 8 Cb -0.10 -2.33 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 2rov s SER 8 CO 0.04 0.27 -0.16 -0.76 0.98 0.00 0.00 173.24 173.61 2rov s LEU 9 N -1.20 2.44 -0.64 2.42 1.02 -0.91 0.39 118.68 122.21 2rov s LEU 9 Ca 0.29 -0.87 -0.26 0.00 0.02 0.00 0.00 54.13 53.31 2rov s LEU 9 Cb -0.18 -0.69 -0.11 0.00 0.02 0.00 0.00 46.19 45.23 2rov s LEU 9 CO 0.18 -0.10 2.42 -0.81 0.02 0.00 0.00 176.35 178.06 2rov n PRO 10 N 0.28 0.78 -2.07 1.29 -0.04 -1.26 -2.58 135.00 131.40 2rov n PRO 10 Ca -0.13 -0.32 -0.28 0.00 -0.04 0.00 0.00 63.50 62.73 2rov n PRO 10 Cb 0.58 -3.39 0.11 0.00 -0.04 0.00 0.00 33.50 30.76 2rov n PRO 10 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2rov s VAL 11 N 12.76 2.10 -0.43 0.52 0.11 -1.20 -4.90 120.40 129.36 2rov s VAL 11 Ca 0.99 -0.14 0.02 0.00 -2.93 0.00 0.00 61.98 59.92 2rov s VAL 11 Cb -0.22 -2.96 0.14 0.00 -1.53 0.00 0.00 36.38 31.81 2rov s VAL 11 CO 0.21 0.00 0.26 -0.13 -3.33 0.00 0.00 175.10 172.12 2rov s ARG 12 N -5.53 1.13 0.08 1.54 0.52 -1.26 -2.88 118.95 112.55 2rov s ARG 12 Ca 0.65 -1.94 -0.24 0.00 -0.52 0.00 0.00 55.73 53.69 2rov s ARG 12 Cb -0.08 -2.03 -0.09 0.00 0.52 0.00 0.00 34.95 33.27 2rov s ARG 12 CO 0.48 -1.21 1.39 -0.91 0.02 0.00 0.00 175.30 175.07 2rov h ASN 13 N 6.57 -1.20 0.00 0.23 2.35 -1.94 -3.43 115.58 118.15 2rov h ASN 13 Ca 0.06 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2rov h ASN 13 Cb 0.92 0.47 0.00 0.00 0.05 0.00 0.00 38.32 39.76 2rov h ASN 13 CO 0.43 -0.34 0.00 -0.46 -1.65 0.00 0.00 177.43 175.41 2rov n ASN 14 N -4.57 0.00 0.05 5.81 6.94 -1.26 -5.08 115.26 117.16 2rov n ASN 14 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.52 2rov n ASN 14 Cb 0.27 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.69 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 -0.99 0.00 -0.77 5.53 -2.24 -1.26 -4.91 114.28 109.65 2rov n THR 15 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 2rov n THR 15 Cb 0.00 -0.16 0.21 0.00 -2.10 0.00 0.00 70.33 68.28 2rov n THR 15 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2rov n LYS 16 N -2.74 2.75 -4.06 -0.78 4.76 -1.26 -4.91 118.16 111.92 2rov n LYS 16 Ca 0.00 -2.54 -0.08 0.00 -2.87 0.00 0.00 58.31 52.82 2rov n LYS 16 Cb 0.00 -2.03 -0.10 0.00 -1.84 0.00 0.00 35.03 31.06 2rov n LYS 16 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2rov s LYS 17 N -2.65 0.53 -0.29 1.97 1.02 -1.26 -5.13 119.74 113.94 2rov s LYS 17 Ca 0.47 -1.07 -0.12 0.00 0.02 0.00 0.00 55.97 55.28 2rov s LYS 17 Cb 0.38 0.18 0.11 0.00 -0.52 0.00 0.00 37.83 37.99 2rov s LYS 17 CO 0.10 -0.09 0.65 -0.59 -0.92 0.00 0.00 175.35 174.50 2rov s PHE 18 N -3.30 -1.23 0.00 3.18 -0.71 -1.26 -3.64 117.98 111.02 2rov s PHE 18 Ca 0.01 2.22 0.00 0.00 -1.04 0.00 0.00 56.93 58.13 2rov s PHE 18 Cb 0.03 0.73 0.00 0.00 -1.21 0.00 0.00 43.02 42.57 2rov s PHE 18 CO -0.08 -0.62 0.00 0.41 -1.34 0.00 0.00 175.22 173.60 2rov n GLY 19 N 5.10 1.24 3.10 1.99 0.00 -1.14 -4.82 105.19 110.66 2rov n GLY 19 Ca -0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 3.26 -0.05 -0.19 1.61 0.52 -1.26 -3.22 118.94 119.62 2rov s TRP 20 Ca 0.00 0.10 -0.04 0.00 0.02 0.00 0.00 56.10 56.18 2rov s TRP 20 Cb 0.00 0.00 0.09 0.00 -1.15 0.00 0.00 33.47 32.41 2rov s TRP 20 CO 0.00 -0.23 0.22 0.54 0.02 0.00 0.00 176.95 177.50 2rov s VAL 21 N -0.88 -0.32 -0.37 4.03 0.11 -1.07 -4.84 120.40 117.07 2rov s VAL 21 Ca -0.10 -0.04 -0.29 0.00 -2.93 0.00 0.00 61.98 58.62 2rov s VAL 21 Cb -0.05 -0.62 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 2rov s VAL 21 CO 0.01 -0.15 1.47 -1.59 -3.33 0.00 0.00 175.10 171.51 2rov s LYS 22 N 2.33 3.61 0.07 1.54 -2.85 -1.24 -2.14 119.74 121.05 2rov s LYS 22 Ca 0.06 1.12 0.02 0.00 -1.00 0.00 0.00 55.97 56.17 2rov s LYS 22 Cb -0.15 -4.03 -0.04 0.00 -2.06 0.00 0.00 37.83 31.55 2rov s LYS 22 CO -0.11 -1.52 0.13 0.15 0.10 0.00 0.00 175.35 174.10 2rov s LYS 23 N 4.90 3.10 -0.55 1.78 -0.14 0.19 -4.68 119.74 124.34 2rov s LYS 23 Ca 0.64 -0.59 -0.27 0.00 -1.36 0.00 0.00 55.97 54.40 2rov s LYS 23 Cb -0.16 -2.85 -0.02 0.00 -1.68 0.00 0.00 37.83 33.12 2rov s LYS 23 CO 0.31 0.59 1.80 -0.47 -0.76 0.00 0.00 175.35 176.82 2rov s TYR 24 N -1.43 1.76 -0.20 3.18 6.14 -0.87 -1.42 117.35 124.51 2rov s TYR 24 Ca 0.31 0.73 -0.09 0.00 0.64 0.00 0.00 57.07 58.66 2rov s TYR 24 Cb -0.12 -4.13 -0.04 0.00 0.42 0.00 0.00 41.96 38.08 2rov s TYR 24 CO 0.24 -2.39 0.10 0.08 0.64 0.00 0.00 175.55 174.22 2rov s VAL 25 N 8.34 5.05 -0.14 3.14 1.01 0.15 -0.46 120.40 137.49 2rov s VAL 25 Ca 0.68 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 62.70 2rov s VAL 25 Cb -0.14 -3.30 0.04 0.00 0.00 0.00 0.00 36.38 32.98 2rov s VAL 25 CO 0.24 0.43 0.01 -0.63 0.00 0.00 0.00 175.10 175.14 2rov s ILE 26 N 0.54 0.56 -0.56 2.22 1.01 -0.55 -1.05 121.20 123.37 2rov s ILE 26 Ca 0.05 -0.31 -0.22 0.00 0.00 0.00 0.00 60.65 60.17 2rov s ILE 26 Cb -0.12 -0.88 0.05 0.00 0.01 0.00 0.00 42.46 41.52 2rov s ILE 26 CO 0.00 0.03 0.86 -0.69 0.00 0.00 0.00 174.94 175.14 2rov s VAL 27 N 1.87 4.51 0.73 2.92 1.01 0.80 0.20 120.40 132.43 2rov s VAL 27 Ca 0.02 -0.08 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 2rov s VAL 27 Cb -0.15 -4.51 0.03 0.00 0.00 0.00 0.00 36.38 31.75 2rov s VAL 27 CO -0.07 -1.10 1.09 -0.55 0.00 0.00 0.00 175.10 174.46 2rov s SER 28 N 2.99 5.22 -0.33 3.32 0.15 0.31 -4.06 113.70 121.30 2rov s SER 28 Ca 0.24 1.26 -0.33 0.00 0.70 0.00 0.00 55.95 57.82 2rov s SER 28 Cb -0.15 -2.06 -0.09 0.00 -1.71 0.00 0.00 66.02 62.00 2rov s SER 28 CO 0.15 -1.50 2.22 -1.20 1.20 0.00 0.00 173.24 174.11 2rov n SER 29 N -3.13 2.44 -1.75 5.45 7.64 -1.26 -0.21 113.62 122.80 2rov n SER 29 Ca 0.07 0.30 -0.16 0.00 1.01 0.00 0.00 58.87 60.10 2rov n SER 29 Cb 0.56 -1.36 -0.01 0.00 -1.01 0.00 0.00 64.21 62.39 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 8.41 -1.24 -3.52 1.43 4.76 -1.26 -4.98 118.16 121.77 2rov n LYS 30 Ca 0.38 0.76 -0.14 0.00 -2.87 0.00 0.00 58.31 56.45 2rov n LYS 30 Cb 0.30 -5.12 -0.05 0.00 -1.84 0.00 0.00 35.03 28.33 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 -4.72 0.94 -0.15 1.97 2.20 0.70 -4.10 119.74 116.58 2rov s LYS 31 Ca 0.00 0.03 0.02 0.00 -0.36 0.00 0.00 55.97 55.66 2rov s LYS 31 Cb 0.00 0.44 0.01 0.00 -1.51 0.00 0.00 37.83 36.77 2rov s LYS 31 CO 0.00 -0.33 -0.21 0.42 -0.36 0.00 0.00 175.35 174.87 2rov s ILE 32 N -1.87 2.16 0.10 5.43 1.01 0.23 0.12 121.20 128.39 2rov s ILE 32 Ca -0.04 -0.94 0.06 0.00 0.00 0.00 0.00 60.65 59.73 2rov s ILE 32 Cb -0.00 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 2rov s ILE 32 CO 0.01 0.54 -0.06 -0.76 0.00 0.00 0.00 174.94 174.68 2rov s LEU 33 N 0.89 3.23 -0.03 2.97 1.43 0.13 -0.16 118.68 127.14 2rov s LEU 33 Ca -0.05 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 2rov s LEU 33 Cb -0.15 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.10 2rov s LEU 33 CO -0.03 0.18 -0.01 0.12 0.23 0.00 0.00 176.35 176.84 2rov s PHE 34 N -1.26 0.36 0.32 0.29 2.19 0.31 -1.48 117.98 118.71 2rov s PHE 34 Ca 0.23 -0.02 0.04 0.00 0.33 0.00 0.00 56.93 57.51 2rov s PHE 34 Cb -0.11 -0.42 -0.03 0.00 -1.31 0.00 0.00 43.02 41.14 2rov s PHE 34 CO 0.16 -0.13 0.18 0.71 1.83 0.00 0.00 175.22 177.97 2rov s TYR 35 N 0.96 1.63 -0.10 10.12 1.51 0.39 0.66 117.35 132.53 2rov s TYR 35 Ca -0.10 -1.43 0.13 0.00 -1.01 0.00 0.00 57.07 54.65 2rov s TYR 35 Cb -0.13 -0.84 -0.18 0.00 -0.11 0.00 0.00 41.96 40.69 2rov s TYR 35 CO -0.01 -0.59 0.12 -3.47 -1.11 0.00 0.00 175.55 170.49 2rov n ASP 36 N -1.08 1.68 -3.45 2.29 -0.08 -1.26 -2.04 116.55 112.61 2rov n ASP 36 Ca 0.02 0.00 -0.05 0.00 -1.51 0.00 0.00 54.79 53.25 2rov n ASP 36 Cb 0.64 1.07 0.00 0.00 2.34 0.00 0.00 41.12 45.18 2rov n ASP 36 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2rov s SER 37 N -4.37 -0.09 0.31 1.67 0.01 -1.26 -4.33 113.70 105.64 2rov s SER 37 Ca -0.06 -0.69 0.05 0.00 1.31 0.00 0.00 55.95 56.55 2rov s SER 37 Cb 0.05 0.61 0.52 0.00 0.21 0.00 0.00 66.02 67.42 2rov s SER 37 CO 0.57 -1.18 1.79 -0.33 0.41 0.00 0.00 173.24 174.49 2rov h GLU 38 N 2.00 0.41 0.09 12.44 5.08 -1.98 -2.12 114.58 130.50 2rov h GLU 38 Ca -0.26 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2rov h GLU 38 Cb 1.23 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2rov h GLU 38 CO 0.32 0.60 -0.05 1.96 -1.00 0.00 0.00 179.01 180.84 2rov h GLN 39 N 0.37 -0.13 0.00 2.33 7.50 -1.99 0.97 115.11 124.17 2rov h GLN 39 Ca 0.06 0.01 -0.07 0.00 0.50 0.00 0.00 58.65 59.15 2rov h GLN 39 Cb 0.56 0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.11 2rov h GLN 39 CO 0.04 -0.08 -0.33 -0.44 -1.50 0.00 0.00 178.83 176.51 2rov h ASP 40 N -0.13 0.00 0.07 1.46 3.32 -1.88 -2.72 116.42 116.54 2rov h ASP 40 Ca -0.01 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 2rov h ASP 40 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2rov h ASP 40 CO 0.02 0.33 -0.04 0.50 -1.72 0.00 0.00 179.24 178.33 2rov h LYS 41 N 0.00 -0.10 -0.02 3.56 3.11 -0.89 -1.56 116.57 120.68 2rov h LYS 41 Ca -0.00 0.01 0.01 0.00 -2.81 0.00 0.00 60.65 57.85 2rov h LYS 41 Cb 0.61 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.86 2rov h LYS 41 CO 0.04 0.38 0.03 0.93 -2.81 0.00 0.00 179.45 178.02 2rov h GLU 42 N -0.63 0.00 -0.19 1.90 5.08 -0.76 0.10 114.58 120.09 2rov h GLU 42 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2rov h GLU 42 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2rov h GLU 42 CO 0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 2rov n GLN 43 N -3.57 1.55 -2.47 2.33 1.13 -1.03 -4.89 117.38 110.43 2rov n GLN 43 Ca -0.03 -0.85 -0.20 0.00 -1.94 0.00 0.00 57.00 53.99 2rov n GLN 43 Cb 0.11 -1.28 -0.01 0.00 0.11 0.00 0.00 30.24 29.18 2rov n GLN 43 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2rov n SER 44 N 0.13 -5.69 -4.16 1.08 2.88 0.35 -4.93 113.62 103.28 2rov n SER 44 Ca 0.12 -0.02 -0.38 0.00 -1.33 0.00 0.00 58.87 57.26 2rov n SER 44 Cb 0.23 -4.73 -0.05 0.00 -0.75 0.00 0.00 64.21 58.91 2rov n SER 44 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2rov s ASN 45 N -2.11 6.19 -0.15 -3.46 3.04 -0.59 -5.05 114.94 112.80 2rov s ASN 45 Ca 0.03 -3.55 -0.29 0.00 0.04 0.00 0.00 52.86 49.09 2rov s ASN 45 Cb -0.01 -1.97 -0.02 0.00 -1.54 0.00 0.00 41.25 37.70 2rov s ASN 45 CO 0.04 -0.24 1.38 -2.16 -3.04 0.00 0.00 177.10 173.08 2rov s PRO 46 N -1.11 4.17 0.43 0.43 0.04 -1.26 -4.57 135.00 133.12 2rov s PRO 46 Ca 0.26 1.76 0.09 0.00 0.04 0.00 0.00 61.00 63.15 2rov s PRO 46 Cb -0.09 -3.85 0.94 0.00 0.04 0.00 0.00 34.50 31.54 2rov s PRO 46 CO -0.10 -0.81 2.07 -0.92 0.04 0.00 0.00 177.00 177.27 2rov h TYR 47 N 8.77 0.40 -1.81 0.56 5.03 -0.12 -3.44 116.97 126.37 2rov h TYR 47 Ca -0.30 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.02 2rov h TYR 47 Cb 1.12 -0.13 -0.23 0.00 1.55 0.00 0.00 36.73 39.04 2rov h TYR 47 CO 0.83 0.26 0.30 1.41 -1.32 0.00 0.00 178.16 179.65 2rov s MET 48 N -5.36 0.71 -0.02 1.82 0.00 -0.86 -5.00 119.30 110.59 2rov s MET 48 Ca -0.07 0.70 0.01 0.00 0.00 0.00 0.00 55.69 56.33 2rov s MET 48 Cb 0.17 0.34 0.01 0.00 0.00 0.00 0.00 34.83 35.36 2rov s MET 48 CO 0.72 -0.11 -0.03 0.54 0.00 0.00 0.00 175.02 176.14 2rov s VAL 49 N 0.05 0.31 0.07 10.11 0.11 -1.26 0.11 120.40 129.90 2rov s VAL 49 Ca 0.00 -0.08 0.07 0.00 -2.93 0.00 0.00 61.98 59.04 2rov s VAL 49 Cb -0.04 -0.32 -0.03 0.00 -1.53 0.00 0.00 36.38 34.46 2rov s VAL 49 CO -0.01 0.13 -0.19 -0.76 -3.33 0.00 0.00 175.10 170.93 2rov s LEU 50 N 0.40 2.24 -0.21 2.54 1.02 0.77 -4.97 118.68 120.47 2rov s LEU 50 Ca -0.04 -0.60 -0.23 0.00 0.02 0.00 0.00 54.13 53.28 2rov s LEU 50 Cb -0.07 -0.84 -0.02 0.00 0.02 0.00 0.00 46.19 45.28 2rov s LEU 50 CO -0.01 0.07 0.74 -1.81 0.02 0.00 0.00 176.35 175.37 2rov s ASP 51 N -1.58 6.78 0.24 2.29 1.11 -1.26 0.78 116.67 125.03 2rov s ASP 51 Ca 0.05 0.96 -0.06 0.00 0.18 0.00 0.00 52.55 53.68 2rov s ASP 51 Cb -0.09 -2.40 0.30 0.00 1.07 0.00 0.00 42.92 41.80 2rov s ASP 51 CO 0.03 -0.39 1.87 0.40 1.18 0.00 0.00 175.17 178.25 2rov h ILE 52 N 5.29 1.10 0.00 0.77 2.04 -1.87 -0.44 117.51 124.40 2rov h ILE 52 Ca -0.28 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 2rov h ILE 52 Cb 1.12 -0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2rov h ILE 52 CO 0.82 0.19 -0.06 -0.78 0.00 0.00 0.00 178.15 178.32 2rov h ASP 53 N 1.04 0.00 1.64 1.72 3.58 -1.91 -0.85 116.42 121.65 2rov h ASP 53 Ca 0.36 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.81 2rov h ASP 53 Cb 0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2rov h ASP 53 CO -0.14 0.06 0.00 0.11 -2.88 0.00 0.00 179.24 176.39 2rov h LYS 54 N 0.00 0.00 -6.75 0.28 1.57 -1.47 -3.45 116.57 106.76 2rov h LYS 54 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 2rov h LYS 54 Cb 0.18 0.00 0.16 0.00 0.08 0.00 0.00 32.23 32.65 2rov h LYS 54 CO 0.01 0.00 0.05 1.28 -0.57 0.00 0.00 179.45 180.22 2rov n LEU 55 N -2.81 3.02 -0.04 2.94 4.77 -0.33 -2.55 117.00 122.00 2rov n LEU 55 Ca 0.04 0.84 -0.05 0.00 -0.03 0.00 0.00 56.01 56.80 2rov n LEU 55 Cb 0.45 -1.35 -0.05 0.00 -2.33 0.00 0.00 43.42 40.15 2rov n LEU 55 CO 0.31 -1.98 -0.78 0.49 -1.33 0.00 0.00 177.39 174.10 2rov n PHE 56 N -1.50 0.00 -3.65 -1.77 3.72 0.10 -4.87 117.46 109.50 2rov n PHE 56 Ca 0.12 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.55 2rov n PHE 56 Cb 0.46 -0.36 -0.06 0.00 -0.94 0.00 0.00 39.48 38.58 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 -2.18 -0.09 -0.06 1.38 2.46 -1.24 -5.02 115.29 110.54 2rov s HIS 57 Ca -0.09 0.19 0.02 0.00 0.47 0.00 0.00 55.06 55.65 2rov s HIS 57 Cb 0.03 0.06 0.02 0.00 -0.13 0.00 0.00 32.58 32.55 2rov s HIS 57 CO 0.25 -0.05 -0.10 0.54 -2.47 0.00 0.00 174.74 172.91 2rov s VAL 58 N 1.06 0.95 0.07 0.89 0.11 -1.26 -1.41 120.40 120.82 2rov s VAL 58 Ca -0.08 -0.38 -0.26 0.00 -2.93 0.00 0.00 61.98 58.33 2rov s VAL 58 Cb -0.02 -0.89 0.08 0.00 -1.53 0.00 0.00 36.38 34.02 2rov s VAL 58 CO -0.10 0.31 0.71 0.00 -3.33 0.00 0.00 175.10 172.70 2rov s ARG 59 N 0.70 1.08 0.46 1.54 1.70 -0.79 -4.98 118.95 118.67 2rov s ARG 59 Ca -0.13 -0.31 -0.24 0.00 -0.47 0.00 0.00 55.73 54.58 2rov s ARG 59 Cb -0.15 0.50 -0.07 0.00 -0.57 0.00 0.00 34.95 34.66 2rov s ARG 59 CO 0.03 -0.45 1.35 -1.25 -1.08 0.00 0.00 175.30 173.89 2rov s PRO 60 N -3.14 3.64 0.49 3.89 0.04 -1.26 -1.81 135.00 136.86 2rov s PRO 60 Ca 0.01 2.24 0.02 0.00 0.04 0.00 0.00 61.00 63.30 2rov s PRO 60 Cb -0.01 -2.57 0.02 0.00 0.04 0.00 0.00 34.50 31.98 2rov s PRO 60 CO -0.08 -0.79 0.70 0.14 0.04 0.00 0.00 177.00 177.01 2rov s VAL 61 N -1.28 3.21 0.16 -0.36 -7.23 -0.07 -4.85 120.40 110.00 2rov s VAL 61 Ca 0.63 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 60.14 2rov s VAL 61 Cb -0.40 -3.18 -0.00 0.00 0.56 0.00 0.00 36.38 33.36 2rov s VAL 61 CO 0.50 -0.12 0.01 0.35 -0.31 0.00 0.00 175.10 175.53 2rov n THR 62 N -2.17 0.00 0.27 5.32 -2.24 -1.26 -4.56 114.28 109.64 2rov n THR 62 Ca 0.05 -0.81 0.15 0.00 -2.27 0.00 0.00 64.05 61.17 2rov n THR 62 Cb 0.59 0.19 0.73 0.00 -2.10 0.00 0.00 70.33 69.74 2rov n THR 62 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2rov h GLN 63 N 0.00 0.00 0.00 -0.78 5.75 -1.91 -1.55 115.11 116.62 2rov h GLN 63 Ca -0.14 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.24 2rov h GLN 63 Cb 0.43 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.96 2rov h GLN 63 CO 0.22 0.00 -0.59 1.79 -2.65 0.00 0.00 178.83 177.61 2rov h THR 64 N 0.00 1.04 0.00 2.39 1.35 -2.02 -3.20 112.91 112.46 2rov h THR 64 Ca 0.00 -2.38 -0.06 0.00 -0.55 0.00 0.00 66.41 63.42 2rov h THR 64 Cb 0.15 2.45 -0.01 0.00 -1.73 0.00 0.00 68.15 69.01 2rov h THR 64 CO 0.00 0.57 -0.28 -0.78 -0.25 0.00 0.00 175.52 174.79 2rov h ASP 65 N 0.00 0.00 -4.44 5.36 1.82 -1.66 -3.46 116.42 114.03 2rov h ASP 65 Ca -0.01 0.00 -0.43 0.00 -0.39 0.00 0.00 57.03 56.20 2rov h ASP 65 Cb 1.40 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 41.31 2rov h ASP 65 CO 0.08 0.28 -0.39 1.33 -1.61 0.00 0.00 179.24 178.92 2rov n VAL 66 N -3.33 0.00 0.00 2.25 0.24 -1.21 -5.03 118.33 111.25 2rov n VAL 66 Ca 0.01 -2.02 0.00 0.00 -2.04 0.00 0.00 64.34 60.29 2rov n VAL 66 Cb 0.51 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.75 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 -0.65 -0.88 0.24 6.34 4.11 -1.26 -4.82 117.16 120.23 2rov n TYR 67 Ca 0.01 0.00 0.13 0.00 -0.00 0.00 0.00 57.90 58.04 2rov n TYR 67 Cb 0.51 0.44 0.37 0.00 -0.00 0.00 0.00 39.34 40.65 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 0.05 0.00 0.00 -0.00 0.00 0.00 179.97 180.02 2rov n ALA 69 N -2.11 0.00 -2.55 0.08 0.00 -1.26 -5.03 120.51 109.64 2rov n ALA 69 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.17 2rov n ALA 69 Cb 0.46 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.75 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 2.75 0.55 0.00 2.15 -1.26 -5.01 116.67 113.93 2rov s ASP 70 Ca 0.00 -0.44 0.34 0.00 0.43 0.00 0.00 52.55 52.88 2rov s ASP 70 Cb 0.00 -0.50 1.50 0.00 -0.30 0.00 0.00 42.92 43.61 2rov s ASP 70 CO 0.00 0.26 1.82 0.00 -0.17 0.00 0.00 175.17 177.07 2rov h ALA 71 N 5.80 2.90 0.01 3.66 0.00 -1.96 0.74 119.26 130.42 2rov h ALA 71 Ca -0.37 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.31 2rov h ALA 71 Cb 1.15 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2rov h ALA 71 CO 0.47 -1.28 -0.89 0.87 0.00 0.00 0.00 179.25 178.43 2rov h LYS 72 N 0.00 0.05 0.04 0.00 1.79 -2.03 -3.26 116.57 113.16 2rov h LYS 72 Ca 0.47 -0.06 -0.23 0.00 -2.18 0.00 0.00 60.65 58.65 2rov h LYS 72 Cb 1.99 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 32.65 2rov h LYS 72 CO -0.00 0.90 -1.06 0.93 -1.08 0.00 0.00 179.45 179.14 2rov h GLU 73 N 0.02 0.09 -0.62 3.15 4.39 0.01 -3.35 114.58 118.28 2rov h GLU 73 Ca -0.02 -0.15 0.12 0.00 0.34 0.00 0.00 59.36 59.65 2rov h GLU 73 Cb 1.55 0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 30.14 2rov h GLU 73 CO 0.12 1.06 -0.27 0.82 -1.16 0.00 0.00 179.01 179.58 2rov h ILE 74 N 0.03 0.23 0.00 3.13 1.08 -1.12 0.50 117.51 121.35 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 -0.81 -0.69 0.00 0.00 178.15 176.80 2rov n PRO 75 N -5.44 0.12 -0.28 2.37 -0.04 -1.26 -2.42 135.00 128.05 2rov n PRO 75 Ca 0.06 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.76 2rov n PRO 75 Cb 0.35 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.39 2.81 -5.19 0.54 1.74 0.16 -4.72 116.66 110.61 2rov n ARG 76 Ca 0.06 -2.42 -0.31 0.00 -0.77 0.00 0.00 57.85 54.41 2rov n ARG 76 Cb 0.16 -1.54 -0.17 0.00 -1.02 0.00 0.00 32.46 29.90 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 -1.97 1.98 0.03 0.55 1.01 -0.55 0.11 121.20 122.36 2rov s ILE 77 Ca 0.31 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.99 2rov s ILE 77 Cb 0.23 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.98 2rov s ILE 77 CO 0.11 0.55 -0.11 0.72 0.00 0.00 0.00 174.94 176.21 2rov s PHE 78 N 0.12 0.92 -0.06 3.97 -0.71 -0.92 -0.89 117.98 120.42 2rov s PHE 78 Ca -0.11 -0.34 0.02 0.00 -1.04 0.00 0.00 56.93 55.46 2rov s PHE 78 Cb -0.16 -0.56 -0.03 0.00 -1.21 0.00 0.00 43.02 41.07 2rov s PHE 78 CO 0.06 -0.01 -0.09 -1.14 -1.34 0.00 0.00 175.22 172.70 2rov s GLN 79 N -1.04 2.65 -0.19 1.99 0.74 -0.75 -1.73 119.66 121.33 2rov s GLN 79 Ca -0.01 -0.61 0.01 0.00 0.05 0.00 0.00 55.36 54.80 2rov s GLN 79 Cb -0.07 -2.51 0.04 0.00 1.10 0.00 0.00 33.01 31.56 2rov s GLN 79 CO 0.01 0.65 -0.13 0.42 -0.55 0.00 0.00 175.29 175.68 2rov s ILE 80 N -0.80 1.77 0.01 -2.34 1.01 -0.74 -1.89 121.20 118.23 2rov s ILE 80 Ca 0.12 -0.99 -0.19 0.00 0.00 0.00 0.00 60.65 59.59 2rov s ILE 80 Cb -0.11 -1.76 -0.06 0.00 0.01 0.00 0.00 42.46 40.54 2rov s ILE 80 CO 0.02 0.28 0.56 -0.22 0.00 0.00 0.00 174.94 175.58 2rov s LEU 81 N 1.36 4.45 -0.06 2.97 2.96 -0.50 -0.55 118.68 129.31 2rov s LEU 81 Ca 0.00 1.15 -0.06 0.00 -0.22 0.00 0.00 54.13 55.01 2rov s LEU 81 Cb -0.15 -2.87 0.02 0.00 0.50 0.00 0.00 46.19 43.68 2rov s LEU 81 CO -0.09 0.17 0.16 -0.72 -1.32 0.00 0.00 176.35 174.55 2rov s TYR 82 N -0.49 -0.17 -0.05 5.38 1.13 -0.03 -0.72 117.35 122.40 2rov s TYR 82 Ca 0.29 0.40 -0.30 0.00 -1.41 0.00 0.00 57.07 56.06 2rov s TYR 82 Cb -0.18 0.05 -0.04 0.00 -1.10 0.00 0.00 41.96 40.69 2rov s TYR 82 CO 0.17 -0.10 1.39 0.00 -2.51 0.00 0.00 175.55 174.50 2rov s ALA 83 N -0.02 3.60 -0.25 9.51 0.00 -1.06 -1.82 121.76 131.72 2rov s ALA 83 Ca -0.01 0.76 -0.06 0.00 0.00 0.00 0.00 51.96 52.65 2rov s ALA 83 Cb -0.02 -3.62 -0.13 0.00 0.00 0.00 0.00 23.12 19.36 2rov s ALA 83 CO 0.00 -1.04 -0.27 0.27 0.00 0.00 0.00 175.76 174.72 2rov n ASN 84 N 5.95 1.95 -0.03 0.00 0.23 -1.26 -4.86 115.26 117.24 2rov n ASN 84 Ca 0.14 0.11 -0.05 0.00 -0.53 0.00 0.00 54.58 54.25 2rov n ASN 84 Cb 0.44 -0.58 -0.02 0.00 -2.08 0.00 0.00 39.78 37.54 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 -3.71 0.12 0.00 -3.83 -0.58 -1.26 -5.05 120.64 106.33 2rov n GLU 85 Ca -0.46 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.32 2rov n GLU 85 Cb 0.90 -0.85 0.00 0.00 -0.57 0.00 0.00 31.44 30.92 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 2.87 0.36 1.87 0.62 0.00 -1.26 -5.07 105.19 104.59 2rov n GLY 86 Ca -0.10 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.01 0.10 -0.61 -0.00 -1.26 -4.76 119.36 112.84 2rov n ILE 87 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 62.75 62.85 2rov n ILE 87 Cb 0.00 -0.17 0.57 0.00 -0.00 0.00 0.00 39.64 40.04 2rov n ILE 87 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 2rov h SER 88 N 0.00 0.17 1.23 4.38 0.02 -2.00 0.38 113.55 117.73 2rov h SER 88 Ca 0.00 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2rov h SER 88 Cb 0.00 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 2rov h SER 88 CO 0.00 0.12 -0.13 0.28 -1.14 0.00 0.00 176.83 175.96 2rov h SER 89 N 0.20 0.00 -0.87 3.07 0.02 -1.97 -3.46 113.55 110.54 2rov h SER 89 Ca 0.12 0.00 -0.83 0.00 -0.84 0.00 0.00 61.79 60.24 2rov h SER 89 Cb 0.23 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.77 2rov h SER 89 CO -0.02 0.13 0.72 0.00 -1.14 0.00 0.00 176.83 176.51 2rov n ALA 90 N -2.15 -1.17 -2.12 3.77 0.00 0.12 -4.71 120.51 114.25 2rov n ALA 90 Ca 0.01 0.45 -0.18 0.00 0.00 0.00 0.00 53.44 53.73 2rov n ALA 90 Cb 0.44 -1.86 0.13 0.00 0.00 0.00 0.00 19.45 18.16 2rov n ALA 90 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2rov n LYS 91 N 4.14 -0.54 -4.22 0.00 4.76 -0.76 -4.73 118.16 116.81 2rov n LYS 91 Ca 0.32 -1.91 -0.13 0.00 -2.87 0.00 0.00 58.31 53.72 2rov n LYS 91 Cb -0.06 -0.83 -0.10 0.00 -1.84 0.00 0.00 35.03 32.20 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 -4.61 1.29 -0.18 4.39 6.03 -1.26 -0.85 114.94 119.76 2rov s ASN 92 Ca 0.57 -1.10 0.00 0.00 -1.03 0.00 0.00 52.86 51.30 2rov s ASN 92 Cb -0.02 0.09 0.04 0.00 -3.03 0.00 0.00 41.25 38.33 2rov s ASN 92 CO 0.39 -0.50 -0.09 -0.22 -2.03 0.00 0.00 177.10 174.65 2rov s LEU 93 N -3.14 1.97 -0.22 3.54 0.20 0.29 -4.91 118.68 116.41 2rov s LEU 93 Ca 0.19 -0.75 -0.20 0.00 0.69 0.00 0.00 54.13 54.07 2rov s LEU 93 Cb 0.05 -1.12 -0.02 0.00 -0.43 0.00 0.00 46.19 44.67 2rov s LEU 93 CO 0.01 -0.14 0.60 -0.76 -0.29 0.00 0.00 176.35 175.77 2rov s LEU 94 N 1.49 4.11 -0.14 -0.68 2.01 -1.26 -1.79 118.68 122.41 2rov s LEU 94 Ca 0.00 0.74 -0.00 0.00 0.01 0.00 0.00 54.13 54.89 2rov s LEU 94 Cb -0.15 -2.83 0.03 0.00 0.01 0.00 0.00 46.19 43.25 2rov s LEU 94 CO -0.08 -0.29 -0.10 -0.76 1.01 0.00 0.00 176.35 176.13 2rov s LEU 95 N 2.07 1.56 -0.09 1.79 1.43 -0.71 -4.38 118.68 120.34 2rov s LEU 95 Ca 0.26 -0.50 -0.16 0.00 -1.03 0.00 0.00 54.13 52.71 2rov s LEU 95 Cb -0.16 -1.01 -0.05 0.00 0.03 0.00 0.00 46.19 45.01 2rov s LEU 95 CO 0.10 -0.12 0.40 -0.22 0.23 0.00 0.00 176.35 176.74 2rov s LEU 96 N 1.59 4.33 -0.09 1.79 2.96 0.16 -2.16 118.68 127.25 2rov s LEU 96 Ca 0.03 0.77 -0.04 0.00 -0.22 0.00 0.00 54.13 54.67 2rov s LEU 96 Cb -0.14 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.95 2rov s LEU 96 CO -0.09 0.13 0.08 0.00 -1.32 0.00 0.00 176.35 175.15 2rov s ALA 97 N 0.05 3.61 0.55 5.97 0.00 0.30 0.01 121.76 132.25 2rov s ALA 97 Ca 0.22 -0.74 0.22 0.00 0.00 0.00 0.00 51.96 51.67 2rov s ALA 97 Cb -0.15 -1.73 1.50 0.00 0.00 0.00 0.00 23.12 22.74 2rov s ALA 97 CO 0.09 0.62 2.17 -0.91 0.00 0.00 0.00 175.76 177.73 2rov h ASN 98 N 4.91 0.00 -4.53 0.00 2.35 -1.86 -3.42 115.58 113.03 2rov h ASN 98 Ca -0.53 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 54.90 2rov h ASN 98 Cb 1.21 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 39.35 2rov h ASN 98 CO 0.57 0.00 -0.75 -0.44 -1.65 0.00 0.00 177.43 175.16 2rov s SER 99 N -6.59 1.06 0.19 5.81 0.01 -1.26 -5.05 113.70 107.87 2rov s SER 99 Ca -0.05 -0.48 -0.11 0.00 1.31 0.00 0.00 55.95 56.62 2rov s SER 99 Cb 0.16 -0.01 0.19 0.00 0.21 0.00 0.00 66.02 66.57 2rov s SER 99 CO 0.62 -0.11 1.79 0.74 0.41 0.00 0.00 173.24 176.69 2rov h THR 100 N 4.54 0.93 -0.95 1.44 2.02 -1.84 -1.67 112.91 117.38 2rov h THR 100 Ca -0.36 -0.19 0.15 0.00 0.77 0.00 0.00 66.41 66.79 2rov h THR 100 Cb 1.20 0.34 -0.08 0.00 -1.74 0.00 0.00 68.15 67.87 2rov h THR 100 CO 0.42 0.10 0.60 -0.33 0.37 0.00 0.00 175.52 176.69 2rov h GLU 101 N 0.54 0.76 -0.70 6.66 5.08 -1.97 -0.66 114.58 124.29 2rov h GLU 101 Ca 0.26 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2rov h GLU 101 Cb 0.18 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 2rov h GLU 101 CO -0.19 0.50 0.46 1.49 -1.00 0.00 0.00 179.01 180.28 2rov h GLU 102 N 0.78 0.91 -0.70 2.33 4.57 -1.70 -1.58 114.58 119.20 2rov h GLU 102 Ca 0.49 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.58 2rov h GLU 102 Cb 0.72 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.07 2rov h GLU 102 CO -0.26 0.60 0.30 0.37 -1.18 0.00 0.00 179.01 178.84 2rov h GLN 103 N 0.94 1.01 -0.62 1.92 -0.00 -1.03 0.19 115.11 117.52 2rov h GLN 103 Ca 0.26 -0.16 -0.09 0.00 -0.00 0.00 0.00 58.65 58.66 2rov h GLN 103 Cb -0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 27.48 27.19 2rov h GLN 103 CO -0.06 0.81 0.03 1.96 0.00 0.00 0.00 178.83 181.56 2rov h GLN 104 N 1.00 1.08 0.02 1.69 1.08 -0.96 -1.65 115.11 117.36 2rov h GLN 104 Ca 0.24 -0.33 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 2rov h GLN 104 Cb 0.16 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 2rov h GLN 104 CO -0.02 1.03 -0.01 -0.22 -0.95 0.00 0.00 178.83 178.66 2rov h LYS 105 N 0.99 -0.03 -0.06 1.46 3.64 -0.87 -2.12 116.57 119.59 2rov h LYS 105 Ca 0.18 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 2rov h LYS 105 Cb 0.53 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 2rov h LYS 105 CO 0.03 0.60 -0.11 -1.49 -2.27 0.00 0.00 179.45 176.21 2rov h TRP 106 N -0.68 -0.28 -0.09 1.91 4.06 -0.64 0.50 115.95 120.73 2rov h TRP 106 Ca -0.00 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.96 2rov h TRP 106 Cb 0.64 0.13 -0.00 0.00 -1.00 0.00 0.00 29.16 28.93 2rov h TRP 106 CO 0.15 -0.17 0.03 0.28 -3.56 0.00 0.00 178.44 175.17 2rov h VAL 107 N -0.16 1.15 -0.38 1.49 2.07 -1.42 0.26 116.25 119.27 2rov h VAL 107 Ca 0.06 -0.45 -0.08 0.00 0.82 0.00 0.00 66.70 67.05 2rov h VAL 107 Cb 0.24 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2rov h VAL 107 CO -0.15 0.13 -0.09 0.28 0.02 0.00 0.00 177.57 177.76 2rov h SER 108 N -0.03 0.63 0.09 0.57 0.02 -1.24 -0.60 113.55 113.00 2rov h SER 108 Ca 0.03 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2rov h SER 108 Cb 0.18 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2rov h SER 108 CO -0.00 0.76 -0.04 0.03 -1.14 0.00 0.00 176.83 176.43 2rov h ARG 109 N 0.60 -0.12 -0.84 3.45 2.47 0.12 -1.79 114.38 118.26 2rov h ARG 109 Ca 0.11 0.01 0.03 0.00 -1.26 0.00 0.00 59.98 58.87 2rov h ARG 109 Cb 0.51 0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 28.81 2rov h ARG 109 CO 0.03 0.37 0.55 1.37 0.56 0.00 0.00 179.97 182.86 2rov h LEU 110 N -0.91 0.92 -0.22 3.04 8.10 -0.52 -1.66 115.31 124.04 2rov h LEU 110 Ca -0.01 -0.01 -0.15 0.00 0.11 0.00 0.00 57.88 57.82 2rov h LEU 110 Cb 0.55 -0.22 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 2rov h LEU 110 CO 0.02 0.64 -0.43 1.62 -4.11 0.00 0.00 178.44 176.18 2rov h VAL 111 N 1.07 1.31 -0.13 0.15 3.04 -1.20 -2.98 116.25 117.50 2rov h VAL 111 Ca 0.33 -1.64 0.03 0.00 -1.01 0.00 0.00 66.70 64.40 2rov h VAL 111 Cb -0.00 1.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.06 2rov h VAL 111 CO -0.09 0.52 0.09 0.11 -1.01 0.00 0.00 177.57 177.19 2rov h LYS 112 N 0.40 0.06 0.00 4.17 1.57 -0.81 0.74 116.57 122.69 2rov h LYS 112 Ca 0.01 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 2rov h LYS 112 Cb 1.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 2rov h LYS 112 CO 0.10 0.04 -0.27 0.87 -0.57 0.00 0.00 179.45 179.62 2rov h LYS 113 N 0.06 0.00 -6.72 3.15 1.57 -1.17 -3.44 116.57 110.02 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 0.16 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.53 2rov h LYS 113 CO -0.01 0.27 0.91 0.42 -0.57 0.00 0.00 179.45 180.47 2rov s ILE 114 N -3.68 2.21 0.01 1.86 1.01 0.25 -4.75 121.20 118.11 2rov s ILE 114 Ca 0.00 0.17 -0.19 0.00 0.00 0.00 0.00 60.65 60.63 2rov s ILE 114 Cb 0.11 -3.11 -0.25 0.00 0.01 0.00 0.00 42.46 39.22 2rov s ILE 114 CO 0.65 0.02 1.08 1.55 0.00 0.00 0.00 174.94 178.24 2rov h PRO 115 N 5.80 0.44 -1.78 2.79 0.13 -1.86 -3.31 132.00 134.21 2rov h PRO 115 Ca -0.45 -0.52 -0.56 0.00 -0.87 0.00 0.00 66.00 63.60 2rov h PRO 115 Cb 1.21 0.16 -0.21 0.00 0.13 0.00 0.00 31.00 32.29 2rov h PRO 115 CO 0.86 1.18 0.62 1.63 -0.23 0.00 0.00 178.00 182.06 2rov n LYS 116 N -4.13 2.41 0.00 0.86 5.02 -1.26 -5.16 118.16 115.91 2rov n LYS 116 Ca -0.11 -2.61 0.01 0.00 -2.02 0.00 0.00 58.31 53.58 2rov n LYS 116 Cb 0.75 -2.10 0.03 0.00 -0.02 0.00 0.00 35.03 33.69 2rov n LYS 116 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05