#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gov s SER 8 N 0.00 6.27 -0.15 0.53 1.04 -1.26 -5.03 113.70 115.10 2gov s SER 8 Ca 0.00 -0.62 -0.11 0.00 0.48 0.00 0.00 55.95 55.70 2gov s SER 8 Cb 0.00 -2.31 -0.05 0.00 0.10 0.00 0.00 66.02 63.77 2gov s SER 8 CO 0.00 -0.85 0.20 -0.76 0.98 0.00 0.00 173.24 172.81 2gov s LEU 9 N 2.77 4.30 -0.01 2.42 1.43 -1.26 -5.07 118.68 123.27 2gov s LEU 9 Ca 0.19 0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 53.54 2gov s LEU 9 Cb -0.16 -2.20 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 2gov s LEU 9 CO 0.15 0.24 0.55 -0.36 0.23 0.00 0.00 176.35 177.17 2gov s PHE 10 N -0.17 3.68 -0.55 0.29 0.08 -1.26 -4.97 117.98 115.08 2gov s PHE 10 Ca 0.14 1.14 -0.26 0.00 0.12 0.00 0.00 56.93 58.06 2gov s PHE 10 Cb -0.12 -2.55 -0.04 0.00 -0.57 0.00 0.00 43.02 39.74 2gov s PHE 10 CO 0.03 0.39 2.05 0.20 -0.10 0.00 0.00 175.22 177.80 2gov s GLY 11 N -0.31 0.02 0.10 4.36 0.00 -1.26 -4.91 107.32 105.31 2gov s GLY 11 Ca 0.29 -0.34 -0.31 0.00 0.00 0.00 0.00 44.72 44.36 2gov s GLY 11 CO 0.16 3.67 1.49 -0.56 0.00 0.00 0.00 173.10 177.86 2gov s SER 12 N 9.41 6.72 -1.01 1.64 0.01 -1.26 -4.94 113.70 124.26 2gov s SER 12 Ca 0.79 2.40 -0.14 0.00 1.31 0.00 0.00 55.95 60.31 2gov s SER 12 Cb -0.15 -2.58 0.19 0.00 0.21 0.00 0.00 66.02 63.69 2gov s SER 12 CO 0.23 -0.76 1.11 0.68 0.41 0.00 0.00 173.24 174.92 2gov s VAL 13 N 1.64 5.29 0.26 3.43 -7.23 -1.26 -5.01 120.40 117.52 2gov s VAL 13 Ca 0.68 -2.45 -0.29 0.00 -1.81 0.00 0.00 61.98 58.10 2gov s VAL 13 Cb -0.38 -4.70 -0.09 0.00 0.56 0.00 0.00 36.38 31.76 2gov s VAL 13 CO 0.30 -1.35 1.25 -1.61 -0.31 0.00 0.00 175.10 173.38 2gov s GLU 14 N 0.97 4.45 -0.24 4.82 0.41 -1.26 -3.88 118.70 123.96 2gov s GLU 14 Ca 0.31 2.03 -0.00 0.00 -0.41 0.00 0.00 54.97 56.90 2gov s GLU 14 Cb -0.07 -3.16 -0.00 0.00 -1.78 0.00 0.00 34.13 29.12 2gov s GLU 14 CO -0.07 -0.11 0.23 2.41 -0.49 0.00 0.00 175.26 177.23 2gov n THR 15 N 1.70 -3.84 -2.85 3.63 -1.04 -1.26 -4.84 114.28 105.78 2gov n THR 15 Ca 0.02 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.05 61.51 2gov n THR 15 Cb 0.43 -4.52 -0.04 0.00 -1.82 0.00 0.00 70.33 64.38 2gov n THR 15 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 2gov s TRP 16 N -3.01 3.73 0.58 -1.42 -0.11 -1.25 -5.04 118.94 112.41 2gov s TRP 16 Ca 0.02 1.60 -0.19 0.00 1.22 0.00 0.00 56.10 58.75 2gov s TRP 16 Cb -0.00 -2.95 -0.04 0.00 -1.50 0.00 0.00 33.47 28.97 2gov s TRP 16 CO 0.23 0.18 1.18 -1.25 -4.62 0.00 0.00 176.95 172.67 2gov s PRO 17 N 0.26 3.09 0.06 5.86 0.04 -1.26 -4.65 135.00 138.38 2gov s PRO 17 Ca 0.44 1.75 -0.00 0.00 0.04 0.00 0.00 61.00 63.22 2gov s PRO 17 Cb -0.21 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2gov s PRO 17 CO 0.26 -1.09 0.21 1.67 0.04 0.00 0.00 177.00 178.08 2gov s TRP 18 N -1.67 3.52 -0.38 0.56 -2.14 -1.26 -4.75 118.94 112.82 2gov s TRP 18 Ca 0.76 0.26 -0.10 0.00 2.66 0.00 0.00 56.10 59.68 2gov s TRP 18 Cb -0.28 -1.77 0.04 0.00 -3.10 0.00 0.00 33.47 28.36 2gov s TRP 18 CO 0.31 0.59 0.20 -1.14 -2.66 0.00 0.00 176.95 174.26 2gov s GLN 19 N -2.46 2.75 -0.15 3.25 0.74 -1.23 -4.96 119.66 117.60 2gov s GLN 19 Ca 0.34 -1.17 -0.18 0.00 0.05 0.00 0.00 55.36 54.41 2gov s GLN 19 Cb -0.13 -3.70 -0.04 0.00 1.10 0.00 0.00 33.01 30.24 2gov s GLN 19 CO 0.27 -0.74 0.48 0.08 -0.55 0.00 0.00 175.29 174.82 2gov s VAL 20 N 1.51 5.17 -0.16 1.34 1.01 -1.26 -1.40 120.40 126.61 2gov s VAL 20 Ca 0.01 0.92 0.12 0.00 0.00 0.00 0.00 61.98 63.03 2gov s VAL 20 Cb -0.20 -3.81 -0.23 0.00 0.00 0.00 0.00 36.38 32.14 2gov s VAL 20 CO 0.05 0.29 0.20 0.00 0.00 0.00 0.00 175.10 175.64 2gov n LEU 21 N 4.01 0.93 -3.70 3.92 -0.00 -0.48 -4.99 117.00 116.69 2gov n LEU 21 Ca -0.07 0.10 -0.13 0.00 -0.00 0.00 0.00 56.01 55.92 2gov n LEU 21 Cb 0.51 0.05 -0.07 0.00 -0.00 0.00 0.00 43.42 43.91 2gov n LEU 21 CO 0.42 0.57 0.11 -0.55 -0.00 0.00 0.00 177.39 177.94 2gov s SER 22 N -5.94 -0.25 0.07 1.45 0.15 -1.26 -5.03 113.70 102.90 2gov s SER 22 Ca -0.14 0.04 0.03 0.00 0.70 0.00 0.00 55.95 56.59 2gov s SER 22 Cb 0.07 0.38 -0.03 0.00 -1.71 0.00 0.00 66.02 64.73 2gov s SER 22 CO 0.79 -0.58 -0.10 0.42 1.20 0.00 0.00 173.24 174.97 2gov s THR 23 N -2.03 0.82 0.00 6.45 -4.23 -1.26 -2.62 115.64 112.77 2gov s THR 23 Ca -0.08 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 2gov s THR 23 Cb -0.02 -1.08 0.00 0.00 1.34 0.00 0.00 72.50 72.74 2gov s THR 23 CO 0.00 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 2gov n GLY 24 N 0.95 0.54 0.00 3.99 0.00 0.58 -4.91 105.19 106.34 2gov n GLY 24 Ca -0.19 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.31 2gov n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gov n GLY 25 N 0.00 1.31 3.72 -0.02 0.00 -1.26 0.16 105.19 109.10 2gov n GLY 25 Ca 0.00 -0.90 -0.27 0.00 0.00 0.00 0.00 46.02 44.85 2gov n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gov s LYS 26 N 0.00 2.15 0.55 1.61 1.02 -1.23 -5.07 119.74 118.77 2gov s LYS 26 Ca 0.00 -2.00 -0.12 0.00 0.02 0.00 0.00 55.97 53.86 2gov s LYS 26 Cb 0.00 -1.83 -0.06 0.00 -0.52 0.00 0.00 37.83 35.42 2gov s LYS 26 CO 0.00 -0.16 0.97 -2.00 -0.92 0.00 0.00 175.35 173.24 2gov s GLU 27 N -3.87 3.74 0.00 1.68 -6.30 -1.26 -4.01 118.70 108.68 2gov s GLU 27 Ca 0.34 0.75 0.00 0.00 -2.50 0.00 0.00 54.97 53.57 2gov s GLU 27 Cb 0.05 -2.15 0.00 0.00 0.00 0.00 0.00 34.13 32.03 2gov s GLU 27 CO 0.19 -0.38 0.00 -3.47 0.02 0.00 0.00 175.26 171.61 2gov n ASP 28 N -2.15 0.00 -4.17 -1.70 2.03 -1.26 -4.78 116.55 104.51 2gov n ASP 28 Ca 0.05 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 55.02 2gov n ASP 28 Cb 0.54 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.80 2gov n ASP 28 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2gov s VAL 29 N 0.00 2.90 -0.10 5.18 0.11 -1.26 -4.78 120.40 122.46 2gov s VAL 29 Ca 0.00 -1.34 -0.00 0.00 -2.93 0.00 0.00 61.98 57.71 2gov s VAL 29 Cb 0.00 -2.63 -0.03 0.00 -1.53 0.00 0.00 36.38 32.19 2gov s VAL 29 CO 0.00 -0.04 -0.07 -0.94 -3.33 0.00 0.00 175.10 170.72 2gov s SER 30 N 1.25 4.56 0.30 3.54 1.04 -1.26 -3.49 113.70 119.65 2gov s SER 30 Ca -0.05 -0.10 0.09 0.00 0.48 0.00 0.00 55.95 56.37 2gov s SER 30 Cb -0.19 -1.38 -0.04 0.00 0.10 0.00 0.00 66.02 64.51 2gov s SER 30 CO -0.02 0.28 0.07 -0.72 0.98 0.00 0.00 173.24 173.83 2gov s TYR 31 N -0.33 2.72 -0.19 5.02 -0.85 0.12 -3.58 117.35 120.27 2gov s TYR 31 Ca 0.05 -0.29 -0.10 0.00 -0.52 0.00 0.00 57.07 56.20 2gov s TYR 31 Cb -0.13 -1.40 0.06 0.00 0.38 0.00 0.00 41.96 40.88 2gov s TYR 31 CO 0.02 0.50 0.46 -1.83 -1.52 0.00 0.00 175.55 173.18 2gov s GLU 32 N -3.76 0.45 -0.02 -3.49 -1.05 -0.45 -0.30 118.70 110.07 2gov s GLU 32 Ca 0.34 0.87 0.05 0.00 -0.15 0.00 0.00 54.97 56.08 2gov s GLU 32 Cb -0.05 0.01 -0.03 0.00 -0.44 0.00 0.00 34.13 33.63 2gov s GLU 32 CO 0.21 -0.16 -0.15 -1.83 0.95 0.00 0.00 175.26 174.29 2gov s GLU 33 N 1.46 2.39 0.04 -4.83 1.03 -1.08 -0.16 118.70 117.57 2gov s GLU 33 Ca -0.10 -0.77 -0.01 0.00 0.03 0.00 0.00 54.97 54.13 2gov s GLU 33 Cb -0.08 -2.33 -0.03 0.00 -0.80 0.00 0.00 34.13 30.88 2gov s GLU 33 CO -0.14 0.60 -0.03 -0.98 -1.33 0.00 0.00 175.26 173.38 2gov s ARG 34 N -0.96 0.53 0.07 -4.83 3.03 -0.92 -1.38 118.95 114.49 2gov s ARG 34 Ca 0.13 -1.05 -0.28 0.00 2.03 0.00 0.00 55.73 56.56 2gov s ARG 34 Cb -0.11 0.17 -0.05 0.00 -1.03 0.00 0.00 34.95 33.93 2gov s ARG 34 CO 0.02 -0.09 0.89 0.00 -1.13 0.00 0.00 175.30 175.00 2gov s ALA 35 N -3.20 3.27 0.41 7.88 0.00 -0.49 -2.38 121.76 127.25 2gov s ALA 35 Ca 0.01 0.47 -0.26 0.00 0.00 0.00 0.00 51.96 52.17 2gov s ALA 35 Cb 0.03 -3.19 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 2gov s ALA 35 CO -0.07 -0.03 1.38 0.00 0.00 0.00 0.00 175.76 177.04 2gov h GLU 37 N 2.43 0.00 0.00 0.00 9.09 -1.83 -3.41 114.58 120.86 2gov h GLU 37 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.92 2gov h GLU 37 Cb 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.37 2gov h GLU 37 CO 0.62 0.00 0.00 0.41 0.05 0.00 0.00 179.01 180.09 2gov n GLY 38 N 0.04 0.68 3.77 1.06 0.00 -0.89 -4.03 105.19 105.83 2gov n GLY 38 Ca 0.02 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 2gov n GLY 38 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gov s GLY 39 N -2.12 2.79 -0.30 -0.02 0.00 -1.26 -4.41 107.32 102.00 2gov s GLY 39 Ca 0.00 0.93 -0.15 0.00 0.00 0.00 0.00 44.72 45.50 2gov s GLY 39 CO 0.00 1.40 0.37 -1.59 0.00 0.00 0.00 173.10 173.28 2gov s LYS 40 N -2.62 3.83 0.30 2.90 -2.85 -1.26 -3.01 119.74 117.02 2gov s LYS 40 Ca 0.62 -0.16 0.09 0.00 -1.00 0.00 0.00 55.97 55.52 2gov s LYS 40 Cb -0.29 -3.72 -0.06 0.00 -2.06 0.00 0.00 37.83 31.71 2gov s LYS 40 CO 0.35 -0.38 -0.10 -0.06 0.10 0.00 0.00 175.35 175.26 2gov s PHE 41 N 2.06 2.16 -0.33 1.78 0.08 0.11 -4.60 117.98 119.25 2gov s PHE 41 Ca 0.14 -0.56 -0.13 0.00 0.12 0.00 0.00 56.93 56.50 2gov s PHE 41 Cb -0.16 -1.18 -0.02 0.00 -0.57 0.00 0.00 43.02 41.08 2gov s PHE 41 CO 0.11 0.47 0.26 0.00 -0.10 0.00 0.00 175.22 175.96 2gov s ALA 42 N -2.78 3.51 0.06 5.36 0.00 -0.40 -0.01 121.76 127.50 2gov s ALA 42 Ca 0.30 -1.26 0.09 0.00 0.00 0.00 0.00 51.96 51.09 2gov s ALA 42 Cb 0.02 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.44 2gov s ALA 42 CO 0.14 -0.89 -0.24 -0.08 0.00 0.00 0.00 175.76 174.68 2gov s THR 43 N 1.81 1.95 -0.00 0.00 -1.32 0.11 0.82 115.64 119.00 2gov s THR 43 Ca 0.08 -1.39 0.04 0.00 -1.21 0.00 0.00 61.69 59.21 2gov s THR 43 Cb -0.17 -1.69 -0.01 0.00 -1.51 0.00 0.00 72.50 69.12 2gov s THR 43 CO 0.11 0.23 -0.13 0.68 -2.21 0.00 0.00 174.62 173.29 2gov s VAL 44 N -0.88 1.04 -0.04 5.08 -7.23 0.12 -0.59 120.40 117.91 2gov s VAL 44 Ca 0.10 -0.63 0.04 0.00 -1.81 0.00 0.00 61.98 59.68 2gov s VAL 44 Cb -0.10 -0.88 -0.00 0.00 0.56 0.00 0.00 36.38 35.96 2gov s VAL 44 CO 0.03 0.25 -0.15 -1.83 -0.31 0.00 0.00 175.10 173.09 2gov s GLU 45 N -0.44 1.50 -0.02 4.82 -1.05 -1.25 0.07 118.70 122.33 2gov s GLU 45 Ca 0.04 -0.51 0.07 0.00 -0.15 0.00 0.00 54.97 54.42 2gov s GLU 45 Cb -0.05 -1.33 -0.02 0.00 -0.44 0.00 0.00 34.13 32.28 2gov s GLU 45 CO -0.00 0.21 -0.23 0.08 0.95 0.00 0.00 175.26 176.27 2gov s VAL 46 N 0.06 2.34 0.31 1.83 1.01 -0.09 -4.99 120.40 120.86 2gov s VAL 46 Ca -0.03 -1.06 0.05 0.00 0.00 0.00 0.00 61.98 60.95 2gov s VAL 46 Cb -0.10 -1.86 -0.06 0.00 0.00 0.00 0.00 36.38 34.36 2gov s VAL 46 CO 0.01 0.54 -0.01 0.42 0.00 0.00 0.00 175.10 176.07 2gov s THR 47 N -0.68 1.49 0.00 3.92 -4.23 -1.26 -1.04 115.64 113.84 2gov s THR 47 Ca 0.11 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2gov s THR 47 Cb -0.10 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.12 2gov s THR 47 CO 0.00 -0.17 0.00 -0.67 -0.54 0.00 0.00 174.62 173.24 2gov n ASP 48 N -0.65 0.00 -4.77 3.99 2.03 -1.11 -4.91 116.55 111.13 2gov n ASP 48 Ca -0.04 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.87 2gov n ASP 48 Cb 0.65 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.99 2gov n ASP 48 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2gov s LYS 49 N 0.00 4.45 0.84 -0.67 1.02 -1.26 -4.83 119.74 119.30 2gov s LYS 49 Ca 0.00 1.01 -0.13 0.00 0.02 0.00 0.00 55.97 56.87 2gov s LYS 49 Cb 0.00 -3.29 0.08 0.00 -0.52 0.00 0.00 37.83 34.10 2gov s LYS 49 CO 0.00 0.49 1.01 -2.30 -0.92 0.00 0.00 175.35 173.63 2gov n PRO 50 N 2.03 -0.01 -0.29 -1.68 -0.02 -1.26 -4.47 135.00 129.29 2gov n PRO 50 Ca -0.06 0.07 0.11 0.00 -2.02 0.00 0.00 63.50 61.60 2gov n PRO 50 Cb 0.50 -2.28 0.27 0.00 -0.02 0.00 0.00 33.50 31.97 2gov n PRO 50 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2gov h VAL 51 N -1.16 0.44 -0.16 -1.45 2.07 -1.74 0.25 116.25 114.50 2gov h VAL 51 Ca -0.45 -0.11 -0.10 0.00 0.82 0.00 0.00 66.70 66.86 2gov h VAL 51 Cb 1.30 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2gov h VAL 51 CO 0.43 0.06 -0.33 -0.78 0.02 0.00 0.00 177.57 176.96 2gov h ASP 52 N 0.32 0.32 -0.04 0.57 1.82 -1.91 0.21 116.42 117.72 2gov h ASP 52 Ca 0.52 -0.12 -0.15 0.00 -0.39 0.00 0.00 57.03 56.90 2gov h ASP 52 Cb 0.99 -0.09 0.01 0.00 0.68 0.00 0.00 39.33 40.92 2gov h ASP 52 CO -0.56 0.64 -0.55 -0.33 -1.61 0.00 0.00 179.24 176.83 2gov h GLU 53 N 0.27 0.45 -0.44 0.28 4.39 -1.34 -2.81 114.58 115.39 2gov h GLU 53 Ca 0.03 -0.43 -0.05 0.00 0.34 0.00 0.00 59.36 59.26 2gov h GLU 53 Cb 0.72 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 2gov h GLU 53 CO 0.06 1.08 0.07 0.00 -1.16 0.00 0.00 179.01 179.05 2gov h ALA 54 N 0.38 0.58 -0.49 3.43 0.00 -0.36 -2.78 119.26 120.02 2gov h ALA 54 Ca -0.06 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.50 2gov h ALA 54 Cb 1.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2gov h ALA 54 CO 0.11 0.30 -0.19 1.25 0.00 0.00 0.00 179.25 180.72 2gov h LEU 55 N 0.58 1.03 -1.77 0.00 5.85 -0.68 0.73 115.31 121.04 2gov h LEU 55 Ca 0.13 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.43 2gov h LEU 55 Cb 0.38 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 2gov h LEU 55 CO 0.01 1.18 -0.14 0.08 -0.34 0.00 0.00 178.44 179.23 2gov h ARG 56 N 0.86 0.00 0.11 1.25 0.11 -1.44 0.44 114.38 115.71 2gov h ARG 56 Ca 0.12 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.96 2gov h ARG 56 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 2gov h ARG 56 CO 0.06 0.14 -1.17 1.49 0.10 0.00 0.00 179.97 180.59 2gov h GLU 57 N 0.00 0.23 -0.27 0.08 4.81 -1.20 -3.40 114.58 114.82 2gov h GLU 57 Ca -0.00 -0.39 -0.18 0.00 -0.13 0.00 0.00 59.36 58.66 2gov h GLU 57 Cb 0.40 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.93 2gov h GLU 57 CO 0.02 1.18 -0.55 0.00 -0.73 0.00 0.00 179.01 178.94 2gov h ALA 58 N -0.04 0.43 -0.47 2.92 0.00 -0.41 -3.21 119.26 118.47 2gov h ALA 58 Ca -0.25 -0.51 0.03 0.00 0.00 0.00 0.00 54.91 54.18 2gov h ALA 58 Cb 1.65 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.34 2gov h ALA 58 CO 0.06 0.64 0.24 1.98 0.00 0.00 0.00 179.25 182.18 2gov h MET 59 N 0.61 0.47 -0.97 0.00 1.85 -1.15 -0.12 114.93 115.63 2gov h MET 59 Ca 0.01 -0.03 0.20 0.00 -0.61 0.00 0.00 59.70 59.27 2gov h MET 59 Cb 1.16 -0.11 -0.11 0.00 0.43 0.00 0.00 31.60 32.97 2gov h MET 59 CO 0.12 0.31 0.55 -1.35 -0.40 0.00 0.00 176.91 176.15 2gov h PRO 60 N 0.49 0.64 -0.19 0.39 0.11 -1.77 0.26 132.00 131.93 2gov h PRO 60 Ca 0.20 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.15 2gov h PRO 60 Cb 0.09 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 2gov h PRO 60 CO -0.13 0.42 -0.39 0.87 -0.21 0.00 0.00 178.00 178.56 2gov h LYS 61 N 0.66 0.44 -0.04 1.05 1.57 -1.25 0.27 116.57 119.26 2gov h LYS 61 Ca 0.57 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 59.12 2gov h LYS 61 Cb 0.95 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 2gov h LYS 61 CO -0.42 0.76 -0.06 0.82 -0.57 0.00 0.00 179.45 179.99 2gov h ILE 62 N 0.37 1.42 -0.01 1.86 1.08 -0.05 -3.17 117.51 119.01 2gov h ILE 62 Ca 0.03 -1.33 -0.10 0.00 -0.39 0.00 0.00 64.86 63.08 2gov h ILE 62 Cb 0.85 2.23 -0.01 0.00 -3.07 0.00 0.00 36.82 36.82 2gov h ILE 62 CO 0.07 0.36 -0.44 0.00 -0.69 0.00 0.00 178.15 177.45 2gov h MET 63 N -0.41 0.03 0.00 2.37 -0.00 -0.36 -2.38 114.93 114.19 2gov h MET 63 Ca 0.00 -0.01 -0.10 0.00 -0.00 0.00 0.00 59.70 59.59 2gov h MET 63 Cb 0.61 -0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.20 2gov h MET 63 CO 0.01 0.47 -0.49 1.57 -0.00 0.00 0.00 176.91 178.47 2gov h LYS 64 N 0.02 0.00 0.69 -0.10 5.09 -1.04 0.44 116.57 121.67 2gov h LYS 64 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 60.65 60.70 2gov h LYS 64 Cb 0.80 0.00 0.01 0.00 0.10 0.00 0.00 32.23 33.13 2gov h LYS 64 CO 0.06 0.49 -0.33 -0.92 -2.09 0.00 0.00 179.45 176.66 2gov h TYR 65 N 0.00 -0.85 0.00 0.07 3.20 -1.40 -1.44 116.97 116.55 2gov h TYR 65 Ca -0.00 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 2gov h TYR 65 Cb 1.00 0.28 -0.00 0.00 1.54 0.00 0.00 36.73 39.55 2gov h TYR 65 CO 0.00 -0.50 -0.05 -0.39 -1.64 0.00 0.00 178.16 175.58 2gov h VAL 66 N -1.07 0.12 0.00 1.81 -1.51 -1.53 -2.88 116.25 111.19 2gov h VAL 66 Ca -0.09 -0.79 -0.02 0.00 -1.23 0.00 0.00 66.70 64.57 2gov h VAL 66 Cb 0.74 1.70 -0.00 0.00 -2.13 0.00 0.00 31.29 31.60 2gov h VAL 66 CO 0.15 0.05 -0.11 1.23 -1.23 0.00 0.00 177.57 177.67 2gov h GLY 67 N 2.58 0.00 0.00 5.19 0.00 -0.69 -0.51 103.07 109.65 2gov h GLY 67 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2gov h GLY 67 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.16 2gov n GLY 68 N -0.85 0.43 1.49 4.60 0.00 -1.10 -4.38 105.19 105.37 2gov n GLY 68 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 2gov n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gov n THR 69 N 0.00 1.88 -2.63 2.61 -1.04 -0.56 -4.41 114.28 110.13 2gov n THR 69 Ca 0.00 -0.86 -0.22 0.00 -2.04 0.00 0.00 64.05 60.93 2gov n THR 69 Cb 0.00 -0.66 0.04 0.00 -1.82 0.00 0.00 70.33 67.88 2gov n THR 69 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2gov s ASN 70 N -0.16 5.30 0.41 8.00 2.20 -1.10 -4.69 114.94 124.89 2gov s ASN 70 Ca 0.27 0.08 0.09 0.00 -0.94 0.00 0.00 52.86 52.36 2gov s ASN 70 Cb 0.22 -0.99 0.87 0.00 -2.00 0.00 0.00 41.25 39.35 2gov s ASN 70 CO 0.06 -1.14 2.01 -0.78 -2.94 0.00 0.00 177.10 174.31 2gov h ASP 71 N 0.03 0.32 0.33 3.54 3.58 -1.80 -1.43 116.42 121.00 2gov h ASP 71 Ca -0.43 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 56.99 2gov h ASP 71 Cb 1.29 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 42.26 2gov h ASP 71 CO 0.54 0.33 -0.43 0.29 -2.88 0.00 0.00 179.24 177.08 2gov n LYS 72 N -4.40 0.40 -2.03 0.28 5.02 -1.26 -4.90 118.16 111.27 2gov n LYS 72 Ca 0.01 -0.25 -0.12 0.00 -2.02 0.00 0.00 58.31 55.93 2gov n LYS 72 Cb 0.15 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.65 2gov n LYS 72 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gov n GLY 73 N 1.43 0.20 3.87 0.72 0.00 -0.54 -4.99 105.19 105.88 2gov n GLY 73 Ca 0.08 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 2gov n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gov s VAL 74 N -2.57 4.73 0.70 1.61 -7.23 -1.26 -4.92 120.40 111.46 2gov s VAL 74 Ca 0.00 0.77 -0.03 0.00 -1.81 0.00 0.00 61.98 60.90 2gov s VAL 74 Cb 0.00 -3.83 0.09 0.00 0.56 0.00 0.00 36.38 33.21 2gov s VAL 74 CO 0.00 -0.93 0.98 -0.83 -0.31 0.00 0.00 175.10 174.01 2gov s GLY 75 N -3.85 1.76 -0.80 2.32 0.00 -1.26 -3.48 107.32 102.02 2gov s GLY 75 Ca 0.54 -1.36 -0.26 0.00 0.00 0.00 0.00 44.72 43.65 2gov s GLY 75 CO 0.45 -0.88 1.61 -0.29 0.00 0.00 0.00 173.10 173.99 2gov s MET 76 N -5.15 3.00 -0.00 2.90 1.75 -0.20 -4.68 119.30 116.91 2gov s MET 76 Ca 0.63 -0.20 0.01 0.00 -1.25 0.00 0.00 55.69 54.88 2gov s MET 76 Cb -0.08 -4.66 0.01 0.00 2.84 0.00 0.00 34.83 32.94 2gov s MET 76 CO 0.44 -2.56 0.96 0.41 -0.65 0.00 0.00 175.02 173.62 2gov n GLY 77 N 6.08 2.57 3.18 2.11 0.00 -1.26 -4.99 105.19 112.87 2gov n GLY 77 Ca 0.21 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2gov n GLY 77 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2gov s MET 78 N -0.97 3.07 -0.15 1.61 0.00 -1.26 -5.03 119.30 116.57 2gov s MET 78 Ca 0.01 -0.81 -0.00 0.00 0.00 0.00 0.00 55.69 54.88 2gov s MET 78 Cb 0.01 -2.54 0.03 0.00 0.00 0.00 0.00 34.83 32.33 2gov s MET 78 CO 0.00 -0.07 -0.09 0.95 0.00 0.00 0.00 175.02 175.81 2gov s THR 79 N 0.98 1.26 0.29 3.16 -4.23 -1.26 -5.04 115.64 110.80 2gov s THR 79 Ca -0.03 -0.59 -0.12 0.00 -1.18 0.00 0.00 61.69 59.78 2gov s THR 79 Cb -0.15 -1.32 0.01 0.00 1.34 0.00 0.00 72.50 72.38 2gov s THR 79 CO -0.05 0.27 0.54 0.68 -0.54 0.00 0.00 174.62 175.53 2gov s VAL 80 N 1.59 0.00 0.28 2.29 -7.23 -1.26 -4.95 120.40 111.12 2gov s VAL 80 Ca 0.03 -1.35 -0.29 0.00 -1.81 0.00 0.00 61.98 58.55 2gov s VAL 80 Cb -0.14 -2.36 -0.09 0.00 0.56 0.00 0.00 36.38 34.35 2gov s VAL 80 CO -0.09 0.00 1.09 -2.84 -0.31 0.00 0.00 175.10 172.95 2gov s PRO 81 N -3.59 4.66 0.14 4.82 0.02 -1.26 -4.79 135.00 135.00 2gov s PRO 81 Ca 0.22 1.78 -0.21 0.00 0.02 0.00 0.00 61.00 62.81 2gov s PRO 81 Cb -0.02 -3.20 -0.07 0.00 0.02 0.00 0.00 34.50 31.23 2gov s PRO 81 CO 0.11 0.23 0.67 0.08 -0.33 0.00 0.00 177.00 177.77 2gov s VAL 82 N -1.15 4.59 0.06 3.83 1.01 0.56 -4.55 120.40 124.74 2gov s VAL 82 Ca 0.44 1.36 0.09 0.00 0.00 0.00 0.00 61.98 63.87 2gov s VAL 82 Cb -0.31 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2gov s VAL 82 CO 0.40 0.44 -0.25 -0.94 0.00 0.00 0.00 175.10 174.75 2gov s SER 83 N -1.29 3.28 -0.06 3.32 1.04 -0.76 -0.86 113.70 118.37 2gov s SER 83 Ca 0.35 -0.59 -0.06 0.00 0.48 0.00 0.00 55.95 56.13 2gov s SER 83 Cb -0.20 -0.32 0.01 0.00 0.10 0.00 0.00 66.02 65.62 2gov s SER 83 CO 0.22 0.25 0.16 0.72 0.98 0.00 0.00 173.24 175.56 2gov s PHE 84 N -0.87 -0.16 -0.06 5.02 -0.71 0.05 0.58 117.98 121.83 2gov s PHE 84 Ca 0.13 0.39 -0.16 0.00 -1.04 0.00 0.00 56.93 56.24 2gov s PHE 84 Cb -0.10 0.05 -0.05 0.00 -1.21 0.00 0.00 43.02 41.71 2gov s PHE 84 CO 0.03 -0.10 0.44 0.00 -1.34 0.00 0.00 175.22 174.25 2gov s ALA 85 N -0.01 3.58 0.22 1.99 0.00 0.23 -0.33 121.76 127.45 2gov s ALA 85 Ca -0.01 -0.21 0.09 0.00 0.00 0.00 0.00 51.96 51.83 2gov s ALA 85 Cb -0.02 -2.52 -0.05 0.00 0.00 0.00 0.00 23.12 20.54 2gov s ALA 85 CO 0.00 0.22 -0.17 0.14 0.00 0.00 0.00 175.76 175.96 2gov s VAL 86 N -0.17 1.98 -0.27 0.00 -7.23 0.59 -1.54 120.40 113.76 2gov s VAL 86 Ca 0.24 -2.23 0.01 0.00 -1.81 0.00 0.00 61.98 58.20 2gov s VAL 86 Cb -0.16 -2.09 0.08 0.00 0.56 0.00 0.00 36.38 34.76 2gov s VAL 86 CO 0.11 -0.49 -0.01 -0.36 -0.31 0.00 0.00 175.10 174.05 2gov s PHE 87 N -2.68 2.62 0.15 2.82 0.08 -1.25 -2.50 117.98 117.22 2gov s PHE 87 Ca 0.24 -2.05 -0.30 0.00 0.12 0.00 0.00 56.93 54.94 2gov s PHE 87 Cb -0.03 -1.91 -0.07 0.00 -0.57 0.00 0.00 43.02 40.44 2gov s PHE 87 CO 0.09 -0.84 0.95 -1.25 -0.10 0.00 0.00 175.22 174.08 2gov s PRO 88 N 1.31 4.74 0.36 0.24 0.04 -1.26 -2.42 135.00 138.00 2gov s PRO 88 Ca 0.00 1.46 0.02 0.00 0.04 0.00 0.00 61.00 62.52 2gov s PRO 88 Cb -0.19 -3.35 -0.02 0.00 0.04 0.00 0.00 34.50 30.98 2gov s PRO 88 CO -0.10 0.30 0.55 -0.80 0.04 0.00 0.00 177.00 176.99 2gov s ASN 89 N -0.34 6.16 0.20 6.66 0.01 -0.46 -4.94 114.94 122.24 2gov s ASN 89 Ca 0.45 0.31 0.18 0.00 -0.71 0.00 0.00 52.86 53.09 2gov s ASN 89 Cb -0.24 -1.82 0.85 0.00 0.41 0.00 0.00 41.25 40.45 2gov s ASN 89 CO 0.30 -0.37 1.56 -1.84 -1.51 0.00 0.00 177.10 175.24 2gov n GLU 90 N -1.80 0.12 0.00 -0.60 0.28 -1.26 -0.63 120.64 116.76 2gov n GLU 90 Ca -0.03 0.47 0.13 0.00 -0.16 0.00 0.00 57.16 57.57 2gov n GLU 90 Cb 0.57 -1.79 0.68 0.00 1.43 0.00 0.00 31.44 32.32 2gov n GLU 90 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2gov n ASP 91 N -2.03 0.00 0.00 -1.84 2.03 -1.26 -4.88 116.55 108.56 2gov n ASP 91 Ca 0.01 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.30 2gov n ASP 91 Cb 0.13 -0.32 0.00 0.00 -0.72 0.00 0.00 41.12 40.21 2gov n ASP 91 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2gov n GLY 92 N 1.08 1.99 3.75 0.27 0.00 0.20 -5.01 105.19 107.47 2gov n GLY 92 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 2gov n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gov s SER 93 N -3.34 6.84 -0.77 1.61 0.01 -1.26 -4.80 113.70 111.99 2gov s SER 93 Ca 0.00 1.00 -0.21 0.00 1.31 0.00 0.00 55.95 58.05 2gov s SER 93 Cb 0.00 -2.33 0.09 0.00 0.21 0.00 0.00 66.02 63.99 2gov s SER 93 CO 0.00 0.05 1.05 -0.76 0.41 0.00 0.00 173.24 173.99 2gov s LEU 94 N 0.21 4.52 -0.18 2.44 2.01 -1.26 -1.35 118.68 125.07 2gov s LEU 94 Ca 0.29 -1.35 -0.04 0.00 0.01 0.00 0.00 54.13 53.04 2gov s LEU 94 Cb -0.17 -2.42 0.09 0.00 0.01 0.00 0.00 46.19 43.70 2gov s LEU 94 CO 0.14 -1.33 0.28 -1.58 1.01 0.00 0.00 176.35 174.87 2gov s GLN 95 N 3.71 0.21 0.00 1.70 -0.44 -1.02 -1.97 119.66 121.86 2gov s GLN 95 Ca 0.27 0.52 0.00 0.00 -2.50 0.00 0.00 55.36 53.66 2gov s GLN 95 Cb -0.12 -0.53 0.00 0.00 -1.64 0.00 0.00 33.01 30.72 2gov s GLN 95 CO 0.03 -0.49 0.00 1.63 0.50 0.00 0.00 175.29 176.95 2gov n LYS 96 N 5.34 0.00 -3.65 1.67 4.76 -1.26 -4.78 118.16 120.24 2gov n LYS 96 Ca -0.05 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.28 2gov n LYS 96 Cb 0.50 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.64 2gov n LYS 96 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2gov s LYS 97 N -0.99 1.03 -0.07 1.97 1.02 -1.26 -2.75 119.74 118.69 2gov s LYS 97 Ca 0.00 -0.68 -0.03 0.00 0.02 0.00 0.00 55.97 55.28 2gov s LYS 97 Cb 0.00 0.45 0.04 0.00 -0.52 0.00 0.00 37.83 37.80 2gov s LYS 97 CO 0.00 -0.39 0.16 -1.17 -0.92 0.00 0.00 175.35 173.02 2gov s LEU 98 N -2.71 0.57 -0.23 3.17 0.20 -0.21 -3.79 118.68 115.68 2gov s LEU 98 Ca 0.02 0.33 0.00 0.00 0.69 0.00 0.00 54.13 55.17 2gov s LEU 98 Cb 0.02 0.38 0.03 0.00 -0.43 0.00 0.00 46.19 46.19 2gov s LEU 98 CO -0.11 -0.17 -0.11 -0.54 -0.29 0.00 0.00 176.35 175.14 2gov s LYS 99 N 1.36 2.76 -0.14 1.98 1.02 -0.59 -0.91 119.74 125.22 2gov s LYS 99 Ca -0.07 -1.01 -0.21 0.00 0.02 0.00 0.00 55.97 54.70 2gov s LYS 99 Cb -0.12 -2.85 -0.03 0.00 -0.52 0.00 0.00 37.83 34.32 2gov s LYS 99 CO -0.06 -0.38 0.61 0.08 -0.92 0.00 0.00 175.35 174.68 2gov s VAL 100 N 1.27 5.07 -0.21 3.17 1.01 0.11 0.78 120.40 131.60 2gov s VAL 100 Ca -0.00 1.20 -0.02 0.00 0.00 0.00 0.00 61.98 63.15 2gov s VAL 100 Cb -0.16 -3.94 -0.00 0.00 0.00 0.00 0.00 36.38 32.28 2gov s VAL 100 CO -0.07 0.21 -0.09 0.26 0.00 0.00 0.00 175.10 175.41 2gov s TRP 101 N 1.26 2.91 -0.35 5.22 0.52 0.20 -0.70 118.94 127.99 2gov s TRP 101 Ca 0.31 -1.09 -0.11 0.00 0.02 0.00 0.00 56.10 55.22 2gov s TRP 101 Cb -0.16 -2.05 0.00 0.00 -1.15 0.00 0.00 33.47 30.12 2gov s TRP 101 CO 0.13 -0.59 0.21 0.12 0.02 0.00 0.00 176.95 176.83 2gov s PHE 102 N 1.37 3.22 0.23 -1.98 5.36 0.24 -1.83 117.98 124.58 2gov s PHE 102 Ca 0.05 -0.60 -0.30 0.00 -0.96 0.00 0.00 56.93 55.12 2gov s PHE 102 Cb -0.14 -2.44 -0.09 0.00 -0.34 0.00 0.00 43.02 40.02 2gov s PHE 102 CO -0.05 -0.51 1.09 1.03 -1.46 0.00 0.00 175.22 175.33 2gov s ARG 103 N 1.63 4.63 -0.13 10.12 0.52 -1.26 -1.28 118.95 133.18 2gov s ARG 103 Ca 0.04 1.75 -0.01 0.00 -0.52 0.00 0.00 55.73 57.00 2gov s ARG 103 Cb -0.18 -3.24 -0.02 0.00 0.52 0.00 0.00 34.95 32.04 2gov s ARG 103 CO 0.08 0.16 -0.12 0.42 0.02 0.00 0.00 175.30 175.86 2gov s ILE 104 N -0.70 3.19 0.86 1.52 1.01 -1.26 -4.74 121.20 121.08 2gov s ILE 104 Ca 0.47 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 60.39 2gov s ILE 104 Cb -0.30 -2.35 0.11 0.00 0.01 0.00 0.00 42.46 39.93 2gov s ILE 104 CO 0.38 0.52 1.09 -2.16 0.00 0.00 0.00 174.94 174.77 2gov s PRO 105 N 0.30 1.53 0.43 2.79 0.04 -1.26 -4.70 135.00 134.14 2gov s PRO 105 Ca -0.09 0.88 0.25 0.00 0.04 0.00 0.00 61.00 62.07 2gov s PRO 105 Cb -0.15 -1.84 1.27 0.00 0.04 0.00 0.00 34.50 33.82 2gov s PRO 105 CO 0.05 -2.07 1.72 -0.97 0.04 0.00 0.00 177.00 175.78 2gov h ASN 106 N -1.42 0.33 -0.40 6.66 -0.00 -1.99 -0.81 115.58 117.94 2gov h ASN 106 Ca -0.48 0.09 0.02 0.00 -0.00 0.00 0.00 56.30 55.94 2gov h ASN 106 Cb 1.27 0.05 -0.03 0.00 -0.00 0.00 0.00 38.32 39.61 2gov h ASN 106 CO 0.54 -0.01 0.22 1.56 -0.00 0.00 0.00 177.43 179.74 2gov h GLN 107 N 0.24 0.43 -0.02 6.67 7.50 -1.99 -2.73 115.11 125.22 2gov h GLN 107 Ca 0.67 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.80 2gov h GLN 107 Cb 1.97 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 29.40 2gov h GLN 107 CO -0.31 0.28 -0.43 1.19 -1.50 0.00 0.00 178.83 178.07 2gov n PHE 108 N -4.89 0.00 0.10 2.96 3.72 -0.42 -3.90 117.46 115.03 2gov n PHE 108 Ca 0.01 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.38 2gov n PHE 108 Cb 0.08 -0.01 0.17 0.00 -0.94 0.00 0.00 39.48 38.78 2gov n PHE 108 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2gov h GLN 109 N 2.48 0.20 -0.54 -1.08 1.08 -0.95 -0.75 115.11 115.55 2gov h GLN 109 Ca 0.00 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 2gov h GLN 109 Cb 0.75 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.17 2gov h GLN 109 CO 0.00 0.68 0.31 0.78 -0.95 0.00 0.00 178.83 179.65 2gov h GLY 110 N 1.42 0.79 -5.96 3.46 0.00 -1.64 -3.40 103.07 97.74 2gov h GLY 110 Ca 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 2gov h GLY 110 CO 0.08 0.32 -0.41 -1.35 0.00 0.00 0.00 176.54 175.18 2gov s SER 111 N -6.56 -1.48 0.53 0.19 1.04 -1.17 -4.99 113.70 101.26 2gov s SER 111 Ca -0.09 -0.54 -0.05 0.00 0.48 0.00 0.00 55.95 55.75 2gov s SER 111 Cb 0.17 1.90 -0.02 0.00 0.10 0.00 0.00 66.02 68.17 2gov s SER 111 CO 0.76 -0.19 0.84 -2.16 0.98 0.00 0.00 173.24 173.47 2gov s PRO 112 N 2.08 3.25 0.71 4.02 0.04 -0.30 -4.76 135.00 140.04 2gov s PRO 112 Ca 0.15 0.09 -0.14 0.00 0.04 0.00 0.00 61.00 61.14 2gov s PRO 112 Cb -0.05 -2.33 0.03 0.00 0.04 0.00 0.00 34.50 32.19 2gov s PRO 112 CO -0.12 -0.43 1.12 -1.25 0.04 0.00 0.00 177.00 176.36 2gov s PRO 113 N -4.85 2.46 0.33 0.56 0.04 -1.26 -5.02 135.00 127.25 2gov s PRO 113 Ca 0.50 1.40 -0.06 0.00 0.04 0.00 0.00 61.00 62.88 2gov s PRO 113 Cb -0.10 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 2gov s PRO 113 CO 0.45 -1.52 0.61 0.00 0.04 0.00 0.00 177.00 176.59 2gov s ALA 114 N -2.45 3.55 -0.19 8.56 0.00 -1.26 -4.93 121.76 125.04 2gov s ALA 114 Ca 0.66 -0.48 -0.28 0.00 0.00 0.00 0.00 51.96 51.86 2gov s ALA 114 Cb -0.21 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.46 2gov s ALA 114 CO 0.47 0.15 2.17 -2.14 0.00 0.00 0.00 175.76 176.40 2gov s PRO 115 N -3.69 3.28 -0.10 0.00 0.02 -1.26 -2.50 135.00 130.75 2gov s PRO 115 Ca 0.46 2.09 -0.11 0.00 0.02 0.00 0.00 61.00 63.46 2gov s PRO 115 Cb -0.11 -4.34 -0.27 0.00 0.02 0.00 0.00 34.50 29.81 2gov s PRO 115 CO 0.31 -1.93 0.48 0.66 -0.33 0.00 0.00 177.00 176.19 2gov h SER 116 N 14.34 0.45 -3.14 2.53 4.64 -1.85 -3.45 113.55 127.06 2gov h SER 116 Ca -0.42 -0.91 -0.51 0.00 -0.47 0.00 0.00 61.79 59.49 2gov h SER 116 Cb 1.24 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2gov h SER 116 CO 0.96 1.78 -0.14 -0.62 -0.87 0.00 0.00 176.83 177.94 2gov s ASP 117 N -7.11 6.40 0.44 4.97 -1.08 -1.26 -4.98 116.67 114.05 2gov s ASP 117 Ca -0.20 0.67 0.23 0.00 -0.52 0.00 0.00 52.55 52.73 2gov s ASP 117 Cb 0.06 -2.13 0.39 0.00 -1.46 0.00 0.00 42.92 39.78 2gov s ASP 117 CO 0.78 -0.24 1.62 -0.33 0.52 0.00 0.00 175.17 177.53 2gov h GLU 118 N 1.42 0.00 -0.08 4.34 5.08 -2.01 -3.24 114.58 120.08 2gov h GLU 118 Ca -0.48 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.64 2gov h GLU 118 Cb 1.20 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.46 2gov h GLU 118 CO 0.65 0.03 -0.89 0.77 -1.00 0.00 0.00 179.01 178.56 2gov h SER 119 N 0.00 0.91 -3.61 1.42 0.02 -1.94 -3.43 113.55 106.93 2gov h SER 119 Ca -0.00 -0.66 -0.67 0.00 -0.84 0.00 0.00 61.79 59.62 2gov h SER 119 Cb 0.99 -0.27 -0.25 0.00 0.14 0.00 0.00 62.40 63.01 2gov h SER 119 CO 0.00 1.46 -0.61 0.54 -1.14 0.00 0.00 176.83 177.08 2gov s VAL 120 N -3.56 4.15 0.10 2.27 0.11 -1.22 -3.84 120.40 118.42 2gov s VAL 120 Ca -0.10 -0.51 0.10 0.00 -2.93 0.00 0.00 61.98 58.54 2gov s VAL 120 Cb 0.08 -3.08 -0.04 0.00 -1.53 0.00 0.00 36.38 31.81 2gov s VAL 120 CO 0.91 0.15 -0.26 -0.54 -3.33 0.00 0.00 175.10 172.03 2gov s LYS 121 N 1.55 1.47 -0.42 1.54 -0.14 0.24 -4.45 119.74 119.53 2gov s LYS 121 Ca 0.04 -1.25 -0.20 0.00 -1.36 0.00 0.00 55.97 53.21 2gov s LYS 121 Cb -0.17 -1.84 0.02 0.00 -1.68 0.00 0.00 37.83 34.16 2gov s LYS 121 CO 0.03 0.45 0.59 0.42 -0.76 0.00 0.00 175.35 176.08 2gov s ILE 122 N -0.99 4.90 0.02 2.17 -1.09 -1.26 0.04 121.20 124.99 2gov s ILE 122 Ca 0.12 0.11 0.08 0.00 -2.23 0.00 0.00 60.65 58.73 2gov s ILE 122 Cb -0.10 -4.13 -0.02 0.00 -1.58 0.00 0.00 42.46 36.62 2gov s ILE 122 CO 0.05 -0.49 -0.24 -1.61 -1.23 0.00 0.00 174.94 171.41 2gov s GLU 123 N 2.64 1.77 -0.05 2.79 0.41 0.98 -4.84 118.70 122.41 2gov s GLU 123 Ca 0.20 -0.96 0.02 0.00 -0.41 0.00 0.00 54.97 53.82 2gov s GLU 123 Cb -0.15 -1.83 -0.03 0.00 -1.78 0.00 0.00 34.13 30.34 2gov s GLU 123 CO 0.17 0.49 -0.09 -1.83 -0.49 0.00 0.00 175.26 173.50 2gov s GLU 124 N -0.93 2.62 -0.14 1.61 -1.05 -1.26 0.07 118.70 119.62 2gov s GLU 124 Ca 0.10 -0.64 0.02 0.00 -0.15 0.00 0.00 54.97 54.30 2gov s GLU 124 Cb -0.09 -2.50 0.02 0.00 -0.44 0.00 0.00 34.13 31.11 2gov s GLU 124 CO 0.01 0.64 -0.18 1.03 0.95 0.00 0.00 175.26 177.71 2gov s ARG 125 N -0.92 2.58 0.15 -4.83 0.52 -1.16 -4.98 118.95 110.31 2gov s ARG 125 Ca 0.13 -0.68 -0.05 0.00 -0.52 0.00 0.00 55.73 54.61 2gov s ARG 125 Cb -0.11 -2.19 -0.02 0.00 0.52 0.00 0.00 34.95 33.14 2gov s ARG 125 CO 0.02 -0.11 0.18 -1.83 0.02 0.00 0.00 175.30 173.58 2gov s GLU 126 N 1.09 1.07 0.00 3.54 4.04 -1.26 -2.09 118.70 125.09 2gov s GLU 126 Ca -0.03 -1.33 0.00 0.00 0.04 0.00 0.00 54.97 53.66 2gov s GLU 126 Cb -0.14 0.31 0.00 0.00 0.02 0.00 0.00 34.13 34.32 2gov s GLU 126 CO -0.05 -0.35 0.00 0.41 -1.84 0.00 0.00 175.26 173.42 2gov n GLY 127 N -0.17 1.10 3.55 -3.83 0.00 -1.26 -4.98 105.19 99.60 2gov n GLY 127 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 2gov n GLY 127 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gov s ILE 128 N -3.59 2.08 -0.03 -0.61 -5.25 -1.26 -5.00 121.20 107.54 2gov s ILE 128 Ca 0.00 -2.14 0.07 0.00 -0.99 0.00 0.00 60.65 57.59 2gov s ILE 128 Cb 0.00 -2.72 -0.02 0.00 2.95 0.00 0.00 42.46 42.67 2gov s ILE 128 CO 0.00 -0.15 -0.25 -0.89 -1.79 0.00 0.00 174.94 171.86 2gov s THR 129 N -2.70 1.99 0.15 8.37 2.01 -1.26 -1.46 115.64 122.73 2gov s THR 129 Ca 0.33 -1.06 0.09 0.00 0.31 0.00 0.00 61.69 61.36 2gov s THR 129 Cb 0.05 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 2gov s THR 129 CO 0.16 0.56 -0.20 0.68 -0.69 0.00 0.00 174.62 175.14 2gov s VAL 130 N -0.44 1.83 -0.20 3.82 -7.23 -1.00 -1.91 120.40 115.27 2gov s VAL 130 Ca 0.05 -1.81 -0.03 0.00 -1.81 0.00 0.00 61.98 58.38 2gov s VAL 130 Cb -0.11 -1.78 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 2gov s VAL 130 CO 0.01 -0.22 -0.07 -0.31 -0.31 0.00 0.00 175.10 174.19 2gov s TYR 131 N -1.75 2.92 -0.11 2.82 2.02 0.50 -2.17 117.35 121.58 2gov s TYR 131 Ca 0.13 -0.96 0.03 0.00 -0.37 0.00 0.00 57.07 55.90 2gov s TYR 131 Cb -0.07 -2.05 -0.01 0.00 -0.40 0.00 0.00 41.96 39.44 2gov s TYR 131 CO 0.06 -0.52 -0.20 -1.54 -1.57 0.00 0.00 175.55 171.78 2gov s SER 132 N 1.28 3.42 -0.15 2.29 1.04 0.77 0.48 113.70 122.82 2gov s SER 132 Ca 0.03 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.99 2gov s SER 132 Cb -0.14 -1.48 -0.00 0.00 0.10 0.00 0.00 66.02 64.49 2gov s SER 132 CO -0.03 0.16 -0.15 0.28 0.98 0.00 0.00 173.24 174.48 2gov s THR 133 N 0.34 2.71 -0.14 2.02 -1.32 0.58 -1.34 115.64 118.48 2gov s THR 133 Ca -0.16 -0.76 -0.02 0.00 -1.21 0.00 0.00 61.69 59.54 2gov s THR 133 Cb -0.17 -2.14 -0.02 0.00 -1.51 0.00 0.00 72.50 68.65 2gov s THR 133 CO 0.08 0.52 -0.08 0.00 -2.21 0.00 0.00 174.62 172.93 2gov s GLN 134 N 0.75 3.51 0.02 7.08 -2.07 -1.23 -0.90 119.66 126.82 2gov s GLN 134 Ca -0.06 -0.59 0.01 0.00 -1.82 0.00 0.00 55.36 52.91 2gov s GLN 134 Cb -0.15 -2.79 -0.02 0.00 -1.09 0.00 0.00 33.01 28.97 2gov s GLN 134 CO 0.01 0.26 -0.06 -0.59 -1.32 0.00 0.00 175.29 173.59 2gov s PHE 135 N 0.29 0.49 -0.09 9.60 -0.71 -1.20 -4.47 117.98 121.89 2gov s PHE 135 Ca -0.06 -0.33 0.02 0.00 -1.04 0.00 0.00 56.93 55.52 2gov s PHE 135 Cb -0.15 -0.30 0.01 0.00 -1.21 0.00 0.00 43.02 41.37 2gov s PHE 135 CO 0.04 -0.07 -0.15 0.20 -1.34 0.00 0.00 175.22 173.90 2gov s GLY 136 N -0.98 0.98 0.00 1.99 0.00 -1.25 -3.09 107.32 104.98 2gov s GLY 136 Ca -0.06 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.03 2gov s GLY 136 CO -0.00 0.08 0.00 0.61 0.00 0.00 0.00 173.10 173.79 2gov n GLY 137 N 3.89 -0.71 3.31 0.20 0.00 -1.22 -5.06 105.19 105.61 2gov n GLY 137 Ca -0.21 -0.16 -0.45 0.00 0.00 0.00 0.00 46.02 45.20 2gov n GLY 137 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2gov s TYR 138 N -3.25 3.26 -0.01 1.61 5.04 -1.26 -3.93 117.35 118.81 2gov s TYR 138 Ca 0.00 -1.29 0.06 0.00 -2.44 0.00 0.00 57.07 53.41 2gov s TYR 138 Cb 0.00 -3.70 -0.02 0.00 0.35 0.00 0.00 41.96 38.59 2gov s TYR 138 CO 0.00 -0.99 -0.21 0.00 -1.34 0.00 0.00 175.55 173.01 2gov s ALA 139 N 1.59 1.73 0.50 3.97 0.00 0.11 -4.97 121.76 124.68 2gov s ALA 139 Ca 0.03 -0.90 0.04 0.00 0.00 0.00 0.00 51.96 51.13 2gov s ALA 139 Cb -0.29 -0.44 -0.00 0.00 0.00 0.00 0.00 23.12 22.39 2gov s ALA 139 CO 0.03 0.42 0.16 0.15 0.00 0.00 0.00 175.76 176.53 2gov s LYS 140 N -0.50 2.21 0.25 0.00 1.02 -1.26 -3.86 119.74 117.59 2gov s LYS 140 Ca 0.08 -2.18 -0.02 0.00 0.02 0.00 0.00 55.97 53.87 2gov s LYS 140 Cb -0.08 -1.79 0.31 0.00 -0.52 0.00 0.00 37.83 35.75 2gov s LYS 140 CO -0.01 -0.40 1.73 1.05 -0.92 0.00 0.00 175.35 176.81 2gov h GLU 141 N 1.18 0.78 0.00 1.68 4.11 -1.74 -2.16 114.58 118.43 2gov h GLU 141 Ca -0.41 -0.23 -0.07 0.00 0.07 0.00 0.00 59.36 58.72 2gov h GLU 141 Cb 1.30 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2gov h GLU 141 CO 0.68 0.82 -0.32 0.00 0.07 0.00 0.00 179.01 180.26 2gov h ALA 142 N 1.23 1.28 -0.05 1.06 0.00 -1.97 -2.69 119.26 118.12 2gov h ALA 142 Ca 0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2gov h ALA 142 Cb 0.51 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2gov h ALA 142 CO 0.03 0.40 -0.08 0.22 0.00 0.00 0.00 179.25 179.81 2gov h ASP 143 N 0.00 0.06 -0.76 0.00 1.82 -1.78 0.16 116.42 115.92 2gov h ASP 143 Ca -0.00 -0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 2gov h ASP 143 Cb 0.64 -0.02 -0.04 0.00 0.68 0.00 0.00 39.33 40.60 2gov h ASP 143 CO 0.04 0.16 0.44 1.88 -1.61 0.00 0.00 179.24 180.15 2gov h TYR 144 N 0.06 1.02 -0.32 0.28 -1.99 -1.46 0.18 116.97 114.74 2gov h TYR 144 Ca 0.01 -0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.66 2gov h TYR 144 Cb 0.20 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 38.58 2gov h TYR 144 CO 0.00 0.69 -0.09 0.28 -0.00 0.00 0.00 178.16 179.04 2gov h VAL 145 N 1.06 1.28 -0.19 -2.88 2.07 -1.11 1.00 116.25 117.48 2gov h VAL 145 Ca 0.27 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 2gov h VAL 145 Cb -0.02 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2gov h VAL 145 CO -0.05 0.37 0.09 0.00 0.02 0.00 0.00 177.57 178.01 2gov h ALA 146 N 0.79 0.25 -0.18 1.67 0.00 -0.91 -2.54 119.26 118.35 2gov h ALA 146 Ca 0.08 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2gov h ALA 146 Cb 0.60 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2gov h ALA 146 CO 0.04 -0.20 -0.26 0.45 0.00 0.00 0.00 179.25 179.28 2gov h HIS 147 N 0.19 0.36 -0.97 0.00 -0.00 -0.55 0.14 115.15 114.33 2gov h HIS 147 Ca 0.07 -0.07 0.04 0.00 -0.00 0.00 0.00 60.37 60.40 2gov h HIS 147 Cb 0.11 -0.09 -0.06 0.00 -0.00 0.00 0.00 27.41 27.37 2gov h HIS 147 CO -0.03 0.56 0.63 0.00 -0.00 0.00 0.00 177.93 179.10 2gov h ALA 148 N 1.44 1.38 -0.02 2.45 0.00 -0.58 0.55 119.26 124.48 2gov h ALA 148 Ca 0.05 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2gov h ALA 148 Cb 0.62 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2gov h ALA 148 CO 0.04 0.53 -0.53 1.15 0.00 0.00 0.00 179.25 180.44 2gov h THR 149 N 1.22 1.43 0.00 0.00 2.02 -0.97 -3.15 112.91 113.46 2gov h THR 149 Ca 0.38 -2.00 -0.03 0.00 0.77 0.00 0.00 66.41 65.53 2gov h THR 149 Cb 0.01 2.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.95 2gov h THR 149 CO -0.12 0.58 -0.15 1.56 0.37 0.00 0.00 175.52 177.76 2gov h GLN 150 N -0.12 0.00 -0.49 6.66 4.20 -0.32 -0.89 115.11 124.16 2gov h GLN 150 Ca -0.06 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 2gov h GLN 150 Cb 1.23 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.99 2gov h GLN 150 CO 0.11 0.15 0.03 1.25 -0.67 0.00 0.00 178.83 179.69 2gov h LEU 151 N 0.00 0.77 -0.60 1.46 7.12 0.10 0.17 115.31 124.33 2gov h LEU 151 Ca -0.00 -0.17 -0.15 0.00 0.13 0.00 0.00 57.88 57.68 2gov h LEU 151 Cb 0.31 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.22 2gov h LEU 151 CO 0.02 0.82 -0.63 0.03 -0.13 0.00 0.00 178.44 178.54 2gov h ARG 152 N 0.76 0.27 -0.38 1.25 3.08 -1.17 -1.09 114.38 117.09 2gov h ARG 152 Ca 0.15 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 2gov h ARG 152 Cb 0.42 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2gov h ARG 152 CO 0.01 0.81 -0.00 1.15 -1.07 0.00 0.00 179.97 180.87 2gov h THR 153 N 0.19 1.21 0.04 2.04 2.02 -0.18 -2.45 112.91 115.78 2gov h THR 153 Ca -0.01 -0.85 -0.22 0.00 0.77 0.00 0.00 66.41 66.10 2gov h THR 153 Cb 1.15 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.48 2gov h THR 153 CO 0.10 0.29 -1.00 0.00 0.37 0.00 0.00 175.52 175.28 2gov h THR 154 N 0.56 1.54 0.00 3.16 1.03 -0.51 -3.14 112.91 115.56 2gov h THR 154 Ca 0.12 -2.89 0.00 0.00 -0.01 0.00 0.00 66.41 63.63 2gov h THR 154 Cb 0.36 2.67 0.00 0.00 -1.07 0.00 0.00 68.15 70.11 2gov h THR 154 CO 0.01 0.84 0.00 0.18 -0.01 0.00 0.00 175.52 176.54 2gov n LEU 155 N -3.57 0.00 -4.68 0.00 4.77 -0.43 -4.76 117.00 108.33 2gov n LEU 155 Ca -0.04 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.51 2gov n LEU 155 Cb 0.89 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.95 2gov n LEU 155 CO 0.49 0.00 1.12 -0.70 -1.33 0.00 0.00 177.39 176.97 2gov s GLU 156 N -2.00 4.28 0.00 3.23 -6.30 -0.97 -1.95 118.70 114.99 2gov s GLU 156 Ca 0.03 1.93 0.00 0.00 -2.50 0.00 0.00 54.97 54.42 2gov s GLU 156 Cb 0.01 -3.61 0.00 0.00 0.00 0.00 0.00 34.13 30.53 2gov s GLU 156 CO 0.02 -0.59 0.00 0.41 0.02 0.00 0.00 175.26 175.12 2gov n GLY 157 N 3.65 0.94 3.49 -1.50 0.00 -1.26 -5.08 105.19 105.41 2gov n GLY 157 Ca 0.13 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 2gov n GLY 157 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gov s THR 158 N -2.00 2.61 -0.86 2.61 -4.23 -0.82 -5.02 115.64 107.93 2gov s THR 158 Ca 0.00 -2.21 0.02 0.00 -1.18 0.00 0.00 61.69 58.32 2gov s THR 158 Cb 0.00 -2.34 0.12 0.00 1.34 0.00 0.00 72.50 71.62 2gov s THR 158 CO 0.00 -0.31 0.70 -0.81 -0.54 0.00 0.00 174.62 173.66 2gov n PRO 159 N -0.38 1.57 -1.74 3.99 -0.04 -1.26 -4.91 135.00 132.22 2gov n PRO 159 Ca -0.07 -0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 62.50 2gov n PRO 159 Cb 0.59 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 2gov n PRO 159 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gov s ALA 160 N -1.24 3.84 0.19 0.55 0.00 -1.26 -5.00 121.76 118.83 2gov s ALA 160 Ca 0.08 1.50 0.05 0.00 0.00 0.00 0.00 51.96 53.59 2gov s ALA 160 Cb 0.06 -3.73 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 2gov s ALA 160 CO 0.02 -1.07 0.18 0.95 0.00 0.00 0.00 175.76 175.85 2gov s THR 161 N 2.00 4.65 0.08 0.00 -4.23 -1.26 -5.01 115.64 111.86 2gov s THR 161 Ca 0.78 -1.09 0.01 0.00 -1.18 0.00 0.00 61.69 60.21 2gov s THR 161 Cb -0.47 -3.41 -0.04 0.00 1.34 0.00 0.00 72.50 69.92 2gov s THR 161 CO 0.34 -0.17 -0.06 -0.31 -0.54 0.00 0.00 174.62 173.88 2gov s TYR 162 N -1.85 0.77 -0.07 3.99 2.02 -1.26 -1.01 117.35 119.94 2gov s TYR 162 Ca 0.32 -0.84 -0.03 0.00 -0.37 0.00 0.00 57.07 56.16 2gov s TYR 162 Cb -0.10 -0.46 0.04 0.00 -0.40 0.00 0.00 41.96 41.04 2gov s TYR 162 CO 0.25 -0.17 0.14 1.14 -1.57 0.00 0.00 175.55 175.34 2gov s GLN 163 N -3.29 0.04 0.00 -0.62 1.03 -1.24 -4.30 119.66 111.29 2gov s GLN 163 Ca 0.06 0.47 0.00 0.00 0.04 0.00 0.00 55.36 55.92 2gov s GLN 163 Cb 0.02 -0.26 0.00 0.00 0.03 0.00 0.00 33.01 32.80 2gov s GLN 163 CO -0.04 -0.25 0.00 0.41 -2.54 0.00 0.00 175.29 172.86 2gov n GLY 164 N 4.89 0.56 2.92 2.60 0.00 -1.26 -3.19 105.19 111.70 2gov n GLY 164 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2gov n GLY 164 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gov n ASP 165 N 0.00 -4.54 -4.77 1.61 8.00 -1.26 -4.72 116.55 110.88 2gov n ASP 165 Ca 0.00 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 2gov n ASP 165 Cb 0.00 -2.69 -0.02 0.00 -0.02 0.00 0.00 41.12 38.40 2gov n ASP 165 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2gov s VAL 166 N -1.30 2.65 0.19 2.53 0.11 -1.19 -4.49 120.40 118.91 2gov s VAL 166 Ca 0.00 0.64 -0.05 0.00 -2.93 0.00 0.00 61.98 59.65 2gov s VAL 166 Cb 0.00 -3.41 -0.03 0.00 -1.53 0.00 0.00 36.38 31.41 2gov s VAL 166 CO 0.00 0.15 0.21 -0.72 -3.33 0.00 0.00 175.10 171.41 2gov s TYR 167 N -1.01 0.84 0.07 1.54 1.13 -1.04 -3.07 117.35 115.81 2gov s TYR 167 Ca 0.50 -1.13 0.07 0.00 -1.41 0.00 0.00 57.07 55.11 2gov s TYR 167 Cb -0.41 -0.32 -0.04 0.00 -1.10 0.00 0.00 41.96 40.10 2gov s TYR 167 CO 0.53 -0.71 -0.15 0.71 -2.51 0.00 0.00 175.55 173.42 2gov s TYR 168 N -4.08 2.63 -0.18 -3.49 1.51 0.15 -0.30 117.35 113.59 2gov s TYR 168 Ca 0.30 -0.21 -0.01 0.00 -1.01 0.00 0.00 57.07 56.13 2gov s TYR 168 Cb 0.05 -1.43 -0.00 0.00 -0.11 0.00 0.00 41.96 40.46 2gov s TYR 168 CO 0.08 0.34 -0.12 0.00 -1.11 0.00 0.00 175.55 174.75 2gov s ALA 170 N 1.01 1.23 -0.02 0.00 0.00 0.08 -0.77 121.76 123.28 2gov s ALA 170 Ca -0.01 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 2gov s ALA 170 Cb -0.15 -0.52 0.11 0.00 0.00 0.00 0.00 23.12 22.56 2gov s ALA 170 CO -0.02 0.14 1.11 0.20 0.00 0.00 0.00 175.76 177.18 2gov s GLY 171 N 0.53 -0.35 0.43 0.00 0.00 -0.04 -1.74 107.32 106.16 2gov s GLY 171 Ca -0.12 0.89 0.18 0.00 0.00 0.00 0.00 44.72 45.67 2gov s GLY 171 CO 0.03 0.26 1.92 -0.97 0.00 0.00 0.00 173.10 174.34 2gov h TYR 172 N 2.00 0.00 -2.34 1.90 0.05 -1.87 0.16 116.97 116.87 2gov h TYR 172 Ca -0.21 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.49 2gov h TYR 172 Cb 1.21 0.00 -0.22 0.00 1.01 0.00 0.00 36.73 38.73 2gov h TYR 172 CO 0.31 0.26 -0.02 0.16 -1.05 0.00 0.00 178.16 177.82 2gov s ASP 173 N -6.69 -0.58 -0.22 3.88 -4.77 -1.26 -4.65 116.67 102.37 2gov s ASP 173 Ca -0.03 1.05 -0.29 0.00 -3.30 0.00 0.00 52.55 49.98 2gov s ASP 173 Cb 0.14 1.05 0.01 0.00 -1.09 0.00 0.00 42.92 43.03 2gov s ASP 173 CO 0.68 -0.27 1.06 -2.16 0.70 0.00 0.00 175.17 175.18 2gov s PRO 174 N 0.02 4.26 0.07 2.11 0.05 -1.26 -4.99 135.00 135.27 2gov s PRO 174 Ca -0.02 1.39 -0.31 0.00 0.05 0.00 0.00 61.00 62.11 2gov s PRO 174 Cb -0.04 -3.65 -0.07 0.00 0.05 0.00 0.00 34.50 30.79 2gov s PRO 174 CO 0.02 -0.63 1.46 -1.25 0.05 0.00 0.00 177.00 176.65 2gov s PRO 175 N 3.21 4.28 -0.09 0.56 0.04 -1.26 -4.83 135.00 136.91 2gov s PRO 175 Ca 0.45 2.11 0.18 0.00 0.04 0.00 0.00 61.00 63.78 2gov s PRO 175 Cb -0.16 -3.41 -0.24 0.00 0.04 0.00 0.00 34.50 30.73 2gov s PRO 175 CO 0.07 -0.55 0.39 -1.33 0.04 0.00 0.00 177.00 175.62 2gov n MET 176 N 4.71 0.66 -2.97 4.56 2.81 -1.26 -2.16 117.12 123.47 2gov n MET 176 Ca 0.13 0.04 -0.40 0.00 -1.81 0.00 0.00 57.70 55.66 2gov n MET 176 Cb 0.42 -1.61 -0.05 0.00 -0.71 0.00 0.00 33.22 31.26 2gov n MET 176 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2gov s LYS 177 N -2.81 4.52 0.19 0.03 2.20 -1.26 -4.79 119.74 117.82 2gov s LYS 177 Ca -0.07 1.10 0.12 0.00 -0.36 0.00 0.00 55.97 56.76 2gov s LYS 177 Cb 0.08 -3.34 0.65 0.00 -1.51 0.00 0.00 37.83 33.72 2gov s LYS 177 CO 0.84 0.34 1.34 -0.35 -0.36 0.00 0.00 175.35 177.17 2gov n PRO 178 N 2.54 0.08 0.00 4.03 -0.04 -1.26 -3.98 135.00 136.36 2gov n PRO 178 Ca -0.03 0.56 0.00 0.00 -0.04 0.00 0.00 63.50 63.99 2gov n PRO 178 Cb 0.50 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 2gov n PRO 178 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2gov n TYR 179 N -1.92 0.00 -3.39 0.54 4.01 -1.25 -2.32 117.16 112.83 2gov n TYR 179 Ca -0.01 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.49 2gov n TYR 179 Cb 0.06 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.11 2gov n TYR 179 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2gov n GLY 180 N 1.13 -0.71 0.17 2.72 0.00 -1.25 0.04 105.19 107.30 2gov n GLY 180 Ca 0.00 0.95 -0.14 0.00 0.00 0.00 0.00 46.02 46.83 2gov n GLY 180 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2gov h ARG 181 N 1.23 0.46 -5.26 1.61 2.43 -1.91 -3.29 114.38 109.65 2gov h ARG 181 Ca -0.40 -0.47 -0.61 0.00 -0.81 0.00 0.00 59.98 57.69 2gov h ARG 181 Cb 1.27 0.13 -0.15 0.00 -0.42 0.00 0.00 29.97 30.80 2gov h ARG 181 CO 0.27 1.12 -0.54 -0.98 -1.51 0.00 0.00 179.97 178.32 2gov s ARG 182 N -3.34 4.02 0.03 0.20 1.04 -1.26 -3.42 118.95 116.21 2gov s ARG 182 Ca -0.06 -0.32 -0.07 0.00 -1.04 0.00 0.00 55.73 54.24 2gov s ARG 182 Cb 0.09 -3.28 -0.00 0.00 -2.04 0.00 0.00 34.95 29.71 2gov s ARG 182 CO 0.87 0.26 0.14 -0.80 -0.04 0.00 0.00 175.30 175.73 2gov s ASN 183 N 0.44 0.09 -0.02 -2.89 0.01 -1.18 -4.94 114.94 106.45 2gov s ASN 183 Ca 0.04 -0.40 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 2gov s ASN 183 Cb -0.12 0.24 0.02 0.00 0.41 0.00 0.00 41.25 41.80 2gov s ASN 183 CO -0.00 -0.50 -0.00 -1.61 -1.51 0.00 0.00 177.10 173.48 2gov s GLU 184 N -2.33 0.24 -0.13 -0.60 2.02 -0.71 -3.23 118.70 113.97 2gov s GLU 184 Ca -0.07 0.05 -0.00 0.00 0.02 0.00 0.00 54.97 54.97 2gov s GLU 184 Cb -0.03 -0.39 0.03 0.00 0.10 0.00 0.00 34.13 33.84 2gov s GLU 184 CO -0.03 -0.10 -0.08 0.08 0.02 0.00 0.00 175.26 175.16 2gov s VAL 185 N 0.79 1.10 -0.23 2.63 1.01 -0.08 -0.74 120.40 124.87 2gov s VAL 185 Ca -0.08 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.44 2gov s VAL 185 Cb -0.11 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 2gov s VAL 185 CO -0.02 0.32 0.04 0.26 0.00 0.00 0.00 175.10 175.70 2gov s TRP 186 N 1.67 3.05 -0.16 5.22 0.52 -0.35 -0.31 118.94 128.59 2gov s TRP 186 Ca 0.04 -0.52 -0.08 0.00 0.02 0.00 0.00 56.10 55.56 2gov s TRP 186 Cb -0.13 -2.18 -0.04 0.00 -1.15 0.00 0.00 33.47 29.96 2gov s TRP 186 CO -0.08 -0.36 0.12 -1.17 0.02 0.00 0.00 176.95 175.48 2gov s LEU 187 N 1.45 4.23 -0.20 2.99 1.98 0.18 0.34 118.68 129.65 2gov s LEU 187 Ca 0.05 0.32 -0.17 0.00 -2.89 0.00 0.00 54.13 51.44 2gov s LEU 187 Cb -0.15 -2.06 -0.04 0.00 0.66 0.00 0.00 46.19 44.61 2gov s LEU 187 CO 0.02 0.29 0.46 -0.69 -1.89 0.00 0.00 176.35 174.54 2gov s VAL 188 N -0.30 5.15 0.12 1.68 1.01 -1.17 -0.37 120.40 126.52 2gov s VAL 188 Ca 0.11 0.83 -0.30 0.00 0.00 0.00 0.00 61.98 62.62 2gov s VAL 188 Cb -0.12 -3.78 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 2gov s VAL 188 CO 0.01 0.22 1.12 -0.75 0.00 0.00 0.00 175.10 175.70 2gov s LYS 189 N 1.46 4.53 0.00 2.72 2.20 -0.80 -3.67 119.74 126.18 2gov s LYS 189 Ca 0.22 1.71 0.07 0.00 -0.36 0.00 0.00 55.97 57.61 2gov s LYS 189 Cb -0.15 -3.32 0.43 0.00 -1.51 0.00 0.00 37.83 33.28 2gov s LYS 189 CO 0.09 -0.05 0.89 0.00 -0.36 0.00 0.00 175.35 175.91