#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gmu s LEU 2 N 0.00 4.57 -0.18 3.17 2.96 -1.22 -4.96 118.68 123.02 1gmu s LEU 2 Ca 0.00 1.60 0.01 0.00 -0.22 0.00 0.00 54.13 55.52 1gmu s LEU 2 Cb 0.00 -3.29 0.03 0.00 0.50 0.00 0.00 46.19 43.43 1gmu s LEU 2 CO 0.00 0.20 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.80 1gmu s TYR 3 N -1.18 2.39 -0.39 5.38 1.51 -1.26 -0.70 117.35 123.10 1gmu s TYR 3 Ca 0.36 -1.49 -0.19 0.00 -1.01 0.00 0.00 57.07 54.73 1gmu s TYR 3 Cb -0.22 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 39.98 1gmu s TYR 3 CO 0.25 -0.73 0.58 -0.51 -1.11 0.00 0.00 175.55 174.03 1gmu s LEU 4 N 1.41 4.41 0.00 -1.29 1.43 -0.31 -4.21 118.68 120.13 1gmu s LEU 4 Ca 0.01 -0.14 0.10 0.00 -1.03 0.00 0.00 54.13 53.08 1gmu s LEU 4 Cb -0.15 -2.67 0.02 0.00 0.03 0.00 0.00 46.19 43.42 1gmu s LEU 4 CO -0.09 -0.61 0.68 0.35 0.23 0.00 0.00 176.35 176.91 1gmu n THR 5 N 5.61 0.00 -3.72 5.49 -2.24 -0.30 -0.74 114.28 118.38 1gmu n THR 5 Ca -0.03 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.22 1gmu n THR 5 Cb 0.48 1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 69.79 1gmu n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gmu s GLN 6 N -1.29 0.90 -0.16 -0.78 -2.07 -1.01 -4.44 119.66 110.82 1gmu s GLN 6 Ca 0.09 -0.58 -0.04 0.00 -1.82 0.00 0.00 55.36 53.02 1gmu s GLN 6 Cb 0.08 0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 32.37 1gmu s GLN 6 CO 0.23 -0.31 -0.04 0.50 -1.32 0.00 0.00 175.29 174.35 1gmu s ARG 7 N -3.00 3.63 0.48 9.60 3.52 -1.26 -0.80 118.95 131.13 1gmu s ARG 7 Ca -0.02 -0.54 -0.21 0.00 -0.13 0.00 0.00 55.73 54.83 1gmu s ARG 7 Cb 0.01 -2.91 -0.08 0.00 -1.56 0.00 0.00 34.95 30.41 1gmu s ARG 7 CO -0.06 0.21 1.09 -0.51 -0.81 0.00 0.00 175.30 175.22 1gmu s LEU 8 N 0.45 3.90 0.12 -0.88 1.43 0.31 -4.95 118.68 119.05 1gmu s LEU 8 Ca -0.04 2.10 -0.05 0.00 -1.03 0.00 0.00 54.13 55.11 1gmu s LEU 8 Cb -0.14 -4.44 -0.13 0.00 0.03 0.00 0.00 46.19 41.51 1gmu s LEU 8 CO 0.03 -0.89 1.27 -0.33 0.23 0.00 0.00 176.35 176.66 1gmu h GLU 9 N 1.72 0.42 -5.82 1.70 5.08 -1.99 -3.44 114.58 112.25 1gmu h GLU 9 Ca -0.49 -0.48 -0.67 0.00 -1.00 0.00 0.00 59.36 56.71 1gmu h GLU 9 Cb 1.24 0.14 -0.21 0.00 0.50 0.00 0.00 28.75 30.42 1gmu h GLU 9 CO 0.59 1.15 -0.70 0.42 -1.00 0.00 0.00 179.01 179.47 1gmu s ILE 10 N -3.18 3.63 0.40 3.13 1.09 -1.26 -5.08 121.20 119.94 1gmu s ILE 10 Ca -0.06 -0.48 -0.27 0.00 -1.10 0.00 0.00 60.65 58.74 1gmu s ILE 10 Cb 0.08 -2.52 -0.10 0.00 -1.06 0.00 0.00 42.46 38.87 1gmu s ILE 10 CO 0.88 0.56 1.46 -2.16 -0.10 0.00 0.00 174.94 175.57 1gmu s PRO 11 N -0.35 3.98 0.07 2.79 0.04 -1.26 -4.91 135.00 135.36 1gmu s PRO 11 Ca 0.05 2.50 0.04 0.00 0.04 0.00 0.00 61.00 63.63 1gmu s PRO 11 Cb -0.12 -2.87 -0.03 0.00 0.04 0.00 0.00 34.50 31.52 1gmu s PRO 11 CO 0.02 -0.61 -0.12 0.00 0.04 0.00 0.00 177.00 176.33 1gmu s ALA 12 N -1.15 1.02 0.40 8.56 0.00 -1.26 -5.10 121.76 124.23 1gmu s ALA 12 Ca 0.55 -0.96 -0.27 0.00 0.00 0.00 0.00 51.96 51.28 1gmu s ALA 12 Cb -0.45 -0.05 -0.10 0.00 0.00 0.00 0.00 23.12 22.52 1gmu s ALA 12 CO 0.60 0.10 1.43 0.00 0.00 0.00 0.00 175.76 177.89 1gmu s ALA 13 N -1.41 3.42 -0.08 0.00 0.00 -1.26 -4.94 121.76 117.49 1gmu s ALA 13 Ca -0.03 1.47 -0.07 0.00 0.00 0.00 0.00 51.96 53.32 1gmu s ALA 13 Cb -0.09 -3.57 0.02 0.00 0.00 0.00 0.00 23.12 19.47 1gmu s ALA 13 CO 0.02 -1.03 0.21 0.00 0.00 0.00 0.00 175.76 174.96 1gmu s ALA 14 N -1.16 -0.52 -0.70 0.00 0.00 -1.26 -4.92 121.76 113.20 1gmu s ALA 14 Ca 0.55 0.62 0.23 0.00 0.00 0.00 0.00 51.96 53.36 1gmu s ALA 14 Cb -0.44 -0.36 0.05 0.00 0.00 0.00 0.00 23.12 22.37 1gmu s ALA 14 CO 0.58 -0.11 1.04 -2.37 0.00 0.00 0.00 175.76 174.91 1gmu n THR 15 N 3.05 0.12 -4.07 0.00 5.66 -1.26 -4.85 114.28 112.93 1gmu n THR 15 Ca -0.13 -0.18 -0.29 0.00 -3.05 0.00 0.00 64.05 60.39 1gmu n THR 15 Cb 0.58 0.33 -0.06 0.00 -1.55 0.00 0.00 70.33 69.62 1gmu n THR 15 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gmu s ALA 16 N -3.15 3.53 0.16 1.79 0.00 -1.26 -4.99 121.76 117.84 1gmu s ALA 16 Ca 0.05 -1.08 -0.15 0.00 0.00 0.00 0.00 51.96 50.78 1gmu s ALA 16 Cb 0.15 -1.38 0.02 0.00 0.00 0.00 0.00 23.12 21.91 1gmu s ALA 16 CO 0.80 0.68 0.42 0.45 0.00 0.00 0.00 175.76 178.12 1gmu s SER 17 N -2.57 -0.18 -0.02 0.00 0.15 -1.26 -1.13 113.70 108.70 1gmu s SER 17 Ca 0.29 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.44 1gmu s SER 17 Cb -0.12 0.51 0.02 0.00 -1.71 0.00 0.00 66.02 64.72 1gmu s SER 17 CO 0.22 -0.94 0.01 0.54 1.20 0.00 0.00 173.24 174.27 1gmu s VAL 18 N -3.87 0.03 -0.31 4.45 0.11 -0.25 -0.87 120.40 119.69 1gmu s VAL 18 Ca 0.08 0.13 -0.10 0.00 -2.93 0.00 0.00 61.98 59.16 1gmu s VAL 18 Cb 0.01 -0.13 -0.01 0.00 -1.53 0.00 0.00 36.38 34.72 1gmu s VAL 18 CO -0.06 0.09 0.16 -0.89 -3.33 0.00 0.00 175.10 171.07 1gmu s THR 19 N 0.84 4.66 0.03 5.04 2.01 -1.26 -0.49 115.64 126.46 1gmu s THR 19 Ca -0.07 -0.39 0.03 0.00 0.31 0.00 0.00 61.69 61.57 1gmu s THR 19 Cb -0.11 -3.37 -0.02 0.00 0.01 0.00 0.00 72.50 69.02 1gmu s THR 19 CO -0.02 0.07 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.13 1gmu s LEU 20 N 1.62 2.16 0.72 4.42 1.43 -0.11 -4.81 118.68 124.11 1gmu s LEU 20 Ca 0.05 -0.39 -0.10 0.00 -1.03 0.00 0.00 54.13 52.66 1gmu s LEU 20 Cb -0.17 -0.34 0.04 0.00 0.03 0.00 0.00 46.19 45.75 1gmu s LEU 20 CO 0.07 -0.05 1.08 -2.16 0.23 0.00 0.00 176.35 175.51 1gmu s PRO 21 N -1.01 2.51 0.45 1.29 0.04 -1.26 -1.14 135.00 135.87 1gmu s PRO 21 Ca -0.03 0.18 0.12 0.00 0.04 0.00 0.00 61.00 61.31 1gmu s PRO 21 Cb -0.07 -2.06 1.03 0.00 0.04 0.00 0.00 34.50 33.43 1gmu s PRO 21 CO 0.00 -1.17 2.04 0.97 0.04 0.00 0.00 177.00 178.89 1gmu h ILE 22 N -0.68 0.99 -0.54 0.56 6.09 -1.90 -1.98 117.51 120.04 1gmu h ILE 22 Ca -0.45 -0.13 0.06 0.00 -1.37 0.00 0.00 64.86 62.97 1gmu h ILE 22 Cb 1.29 0.59 -0.03 0.00 0.47 0.00 0.00 36.82 39.13 1gmu h ILE 22 CO 0.63 0.07 0.36 -2.24 -3.07 0.00 0.00 178.15 173.91 1gmu h ASP 23 N 0.37 0.43 0.46 2.19 2.03 -1.97 -2.51 116.42 117.41 1gmu h ASP 23 Ca 0.18 0.00 -0.24 0.00 -0.73 0.00 0.00 57.03 56.24 1gmu h ASP 23 Cb 0.23 -0.09 -0.04 0.00 -0.83 0.00 0.00 39.33 38.60 1gmu h ASP 23 CO -0.04 0.28 -1.73 0.55 -1.03 0.00 0.00 179.24 177.27 1gmu n VAL 24 N -4.47 1.30 0.67 4.15 3.14 -0.81 -4.02 118.33 118.29 1gmu n VAL 24 Ca 0.08 -0.75 0.06 0.00 -2.96 0.00 0.00 64.34 60.77 1gmu n VAL 24 Cb 0.25 -0.75 0.33 0.00 -1.06 0.00 0.00 33.84 32.62 1gmu n VAL 24 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1gmu n ARG 25 N -2.88 0.27 -0.10 1.45 1.74 -0.82 -1.07 116.66 115.25 1gmu n ARG 25 Ca -0.16 0.10 0.08 0.00 -0.77 0.00 0.00 57.85 57.09 1gmu n ARG 25 Cb 0.96 -1.50 0.13 0.00 -1.02 0.00 0.00 32.46 31.03 1gmu n ARG 25 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1gmu n VAL 26 N -1.16 0.42 -3.60 1.55 0.24 -1.16 -0.88 118.33 113.74 1gmu n VAL 26 Ca 0.07 -0.71 -0.34 0.00 -2.04 0.00 0.00 64.34 61.32 1gmu n VAL 26 Cb 0.07 0.98 -0.05 0.00 -1.47 0.00 0.00 33.84 33.37 1gmu n VAL 26 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1gmu s LYS 27 N -1.18 3.73 -0.20 7.34 1.02 -0.23 -4.78 119.74 125.44 1gmu s LYS 27 Ca 0.24 0.13 0.06 0.00 0.02 0.00 0.00 55.97 56.42 1gmu s LYS 27 Cb 0.15 -2.99 -0.21 0.00 -0.52 0.00 0.00 37.83 34.25 1gmu s LYS 27 CO 0.21 0.56 0.02 -1.13 -0.92 0.00 0.00 175.35 174.09 1gmu n SER 28 N 0.86 1.39 -4.03 2.83 3.41 -1.26 -4.86 113.62 111.95 1gmu n SER 28 Ca -0.08 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.22 1gmu n SER 28 Cb 0.52 -0.08 -0.16 0.00 -0.26 0.00 0.00 64.21 64.23 1gmu n SER 28 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1gmu s ARG 29 N -2.53 2.25 -0.21 4.33 0.52 -1.25 -1.32 118.95 120.75 1gmu s ARG 29 Ca -0.24 -0.97 -0.28 0.00 -0.52 0.00 0.00 55.73 53.72 1gmu s ARG 29 Cb 0.08 -2.56 0.13 0.00 0.52 0.00 0.00 34.95 33.11 1gmu s ARG 29 CO 0.71 -0.43 1.02 0.54 0.02 0.00 0.00 175.30 177.16 1gmu s VAL 30 N 1.30 0.00 0.00 3.52 0.11 -1.05 -4.97 120.40 119.31 1gmu s VAL 30 Ca -0.02 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 58.80 1gmu s VAL 30 Cb -0.17 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.63 1gmu s VAL 30 CO -0.08 0.00 0.67 -0.75 -3.33 0.00 0.00 175.10 171.61 1gmu s LYS 31 N -0.59 4.40 0.29 1.54 2.20 -1.26 -0.55 119.74 125.77 1gmu s LYS 31 Ca 0.00 0.87 0.03 0.00 -0.36 0.00 0.00 55.97 56.52 1gmu s LYS 31 Cb -0.02 -3.37 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 1gmu s LYS 31 CO -0.02 0.29 0.17 0.14 -0.36 0.00 0.00 175.35 175.57 1gmu s VAL 32 N 0.02 0.26 -0.07 4.02 -7.23 0.67 -4.98 120.40 113.09 1gmu s VAL 32 Ca 0.35 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.53 1gmu s VAL 32 Cb -0.19 -2.51 0.02 0.00 0.56 0.00 0.00 36.38 34.26 1gmu s VAL 32 CO 0.19 0.00 -0.08 -0.89 -0.31 0.00 0.00 175.10 174.02 1gmu s THR 33 N -3.66 0.87 0.76 5.32 2.01 -1.26 -0.69 115.64 119.00 1gmu s THR 33 Ca 0.37 -0.28 -0.11 0.00 0.31 0.00 0.00 61.69 61.98 1gmu s THR 33 Cb 0.05 -0.86 0.05 0.00 0.01 0.00 0.00 72.50 71.75 1gmu s THR 33 CO 0.18 0.31 1.09 -0.76 -0.69 0.00 0.00 174.62 174.75 1gmu s LEU 34 N 1.11 3.05 0.37 4.42 1.43 0.98 -4.68 118.68 125.36 1gmu s LEU 34 Ca -0.07 1.81 0.28 0.00 -1.03 0.00 0.00 54.13 55.11 1gmu s LEU 34 Cb -0.14 -4.52 1.17 0.00 0.03 0.00 0.00 46.19 42.73 1gmu s LEU 34 CO -0.01 -1.97 1.82 0.78 0.23 0.00 0.00 176.35 177.20 1gmu h ASN 35 N -1.06 0.00 0.47 2.29 2.35 -1.32 -1.38 115.58 116.93 1gmu h ASN 35 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1gmu h ASN 35 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 1gmu h ASN 35 CO 0.52 0.00 -0.08 -0.90 -1.65 0.00 0.00 177.43 175.32 1gmu n ASP 36 N -2.55 0.27 0.00 5.81 5.68 -1.26 -4.90 116.55 119.59 1gmu n ASP 36 Ca 0.01 -0.36 0.00 0.00 -0.50 0.00 0.00 54.79 53.94 1gmu n ASP 36 Cb 0.24 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 1gmu n ASP 36 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gmu n GLY 37 N 1.29 0.33 3.73 6.12 0.00 -0.52 -5.08 105.19 111.06 1gmu n GLY 37 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1gmu n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gmu s ARG 38 N -0.81 4.67 0.34 1.61 0.52 -1.25 -4.79 118.95 119.24 1gmu s ARG 38 Ca 0.00 1.50 -0.24 0.00 -0.52 0.00 0.00 55.73 56.47 1gmu s ARG 38 Cb 0.00 -3.37 -0.10 0.00 0.52 0.00 0.00 34.95 32.00 1gmu s ARG 38 CO 0.00 0.16 0.92 -0.51 0.02 0.00 0.00 175.30 175.89 1gmu s ASP 39 N 0.08 7.20 0.11 0.23 1.01 -1.26 -0.01 116.67 124.02 1gmu s ASP 39 Ca 0.48 1.75 -0.12 0.00 0.71 0.00 0.00 52.55 55.37 1gmu s ASP 39 Cb -0.24 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.15 1gmu s ASP 39 CO 0.30 -0.14 0.29 0.00 0.21 0.00 0.00 175.17 175.83 1gmu s ALA 40 N -1.76 -0.52 -0.03 5.23 0.00 0.14 -3.39 121.76 121.42 1gmu s ALA 40 Ca 0.53 -0.38 0.06 0.00 0.00 0.00 0.00 51.96 52.17 1gmu s ALA 40 Cb -0.16 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.54 1gmu s ALA 40 CO 0.21 -0.57 -0.22 0.20 0.00 0.00 0.00 175.76 175.37 1gmu s GLY 41 N -2.84 1.10 -0.23 0.00 0.00 0.12 -0.24 107.32 105.24 1gmu s GLY 41 Ca 0.05 -0.93 -0.16 0.00 0.00 0.00 0.00 44.72 43.68 1gmu s GLY 41 CO -0.11 -0.69 0.40 1.08 0.00 0.00 0.00 173.10 173.77 1gmu s LEU 42 N -0.36 4.10 -0.46 0.66 1.43 0.28 -1.16 118.68 123.18 1gmu s LEU 42 Ca 0.04 0.43 0.09 0.00 -1.03 0.00 0.00 54.13 53.66 1gmu s LEU 42 Cb -0.10 -2.49 0.36 0.00 0.03 0.00 0.00 46.19 43.99 1gmu s LEU 42 CO 0.01 -0.14 0.88 0.18 0.23 0.00 0.00 176.35 177.51 1gmu n LEU 43 N 4.89 2.82 -4.93 1.79 4.77 0.08 -2.54 117.00 123.89 1gmu n LEU 43 Ca -0.08 -5.21 -0.25 0.00 -0.03 0.00 0.00 56.01 50.44 1gmu n LEU 43 Cb 0.51 0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.66 1gmu n LEU 43 CO 0.39 2.25 0.45 -0.76 -1.33 0.00 0.00 177.39 178.39 1gmu s LEU 44 N -3.04 3.37 0.67 2.23 2.01 -0.43 -4.34 118.68 119.14 1gmu s LEU 44 Ca 0.44 0.57 -0.16 0.00 0.01 0.00 0.00 54.13 54.99 1gmu s LEU 44 Cb 0.33 -3.42 0.01 0.00 0.01 0.00 0.00 46.19 43.12 1gmu s LEU 44 CO -0.11 -0.94 1.15 -2.84 1.01 0.00 0.00 176.35 174.62 1gmu s PRO 45 N -4.85 2.62 0.85 1.29 0.02 -1.26 -4.71 135.00 128.97 1gmu s PRO 45 Ca 0.52 1.55 -0.11 0.00 0.02 0.00 0.00 61.00 62.98 1gmu s PRO 45 Cb -0.10 -1.91 0.10 0.00 0.02 0.00 0.00 34.50 32.61 1gmu s PRO 45 CO 0.43 -1.42 1.09 1.03 -0.33 0.00 0.00 177.00 177.80 1gmu s ARG 46 N -3.93 1.59 -0.86 5.54 0.52 -1.26 -4.15 118.95 116.40 1gmu s ARG 46 Ca 0.70 0.97 0.00 0.00 -0.52 0.00 0.00 55.73 56.88 1gmu s ARG 46 Cb -0.24 -1.84 0.00 0.00 0.52 0.00 0.00 34.95 33.39 1gmu s ARG 46 CO 0.41 -2.05 0.00 0.41 0.02 0.00 0.00 175.30 174.09 1gmu n GLY 47 N -1.10 0.59 3.72 -3.53 0.00 -1.26 -5.04 105.19 98.57 1gmu n GLY 47 Ca 0.08 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1gmu n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gmu s LEU 48 N -2.26 3.63 -0.31 0.99 1.43 -1.26 -5.08 118.68 115.82 1gmu s LEU 48 Ca 0.00 0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1gmu s LEU 48 Cb 0.00 -2.14 0.08 0.00 0.03 0.00 0.00 46.19 44.16 1gmu s LEU 48 CO 0.00 0.26 -0.02 -0.22 0.23 0.00 0.00 176.35 176.60 1gmu s LEU 49 N -1.76 4.13 -0.15 1.79 1.98 -1.26 -4.49 118.68 118.92 1gmu s LEU 49 Ca 0.22 -1.73 -0.29 0.00 -2.89 0.00 0.00 54.13 49.44 1gmu s LEU 49 Cb -0.12 -1.62 -0.01 0.00 0.66 0.00 0.00 46.19 45.11 1gmu s LEU 49 CO 0.13 -0.30 1.06 -0.76 -1.89 0.00 0.00 176.35 174.59 1gmu s LEU 50 N 1.04 4.19 0.23 -0.68 1.43 -0.06 -5.03 118.68 119.80 1gmu s LEU 50 Ca 0.00 1.52 -0.01 0.00 -1.03 0.00 0.00 54.13 54.61 1gmu s LEU 50 Cb -0.20 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 1gmu s LEU 50 CO -0.06 -0.57 0.43 -0.13 0.23 0.00 0.00 176.35 176.26 1gmu s ARG 51 N 2.58 3.54 0.28 1.70 1.81 -1.26 -4.83 118.95 122.76 1gmu s ARG 51 Ca 0.48 -0.27 -0.30 0.00 -1.72 0.00 0.00 55.73 53.91 1gmu s ARG 51 Cb -0.18 -2.79 -0.11 0.00 -0.45 0.00 0.00 34.95 31.42 1gmu s ARG 51 CO 0.14 0.35 1.58 0.20 -0.68 0.00 0.00 175.30 176.89 1gmu s GLY 52 N -3.23 2.07 0.00 -3.53 0.00 -1.26 -1.03 107.32 100.34 1gmu s GLY 52 Ca 0.40 1.54 0.00 0.00 0.00 0.00 0.00 44.72 46.66 1gmu s GLY 52 CO 0.30 2.54 0.00 0.61 0.00 0.00 0.00 173.10 176.55 1gmu n GLY 53 N 2.31 2.39 3.76 0.20 0.00 0.16 -4.91 105.19 109.10 1gmu n GLY 53 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1gmu n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gmu s ASP 54 N -1.35 5.20 -0.10 1.61 1.01 -0.19 -4.73 116.67 118.11 1gmu s ASP 54 Ca 0.00 2.19 0.04 0.00 0.71 0.00 0.00 52.55 55.49 1gmu s ASP 54 Cb 0.00 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1gmu s ASP 54 CO 0.00 -1.58 -0.22 -0.69 0.21 0.00 0.00 175.17 172.89 1gmu s VAL 55 N -1.94 1.91 0.19 -1.27 1.01 -1.26 -0.11 120.40 118.92 1gmu s VAL 55 Ca 0.72 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.83 1gmu s VAL 55 Cb -0.25 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1gmu s VAL 55 CO 0.35 0.53 0.14 -0.76 0.00 0.00 0.00 175.10 175.36 1gmu s LEU 56 N 0.46 3.76 0.08 3.92 1.43 0.46 -0.53 118.68 128.25 1gmu s LEU 56 Ca -0.17 -0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1gmu s LEU 56 Cb -0.17 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 1gmu s LEU 56 CO 0.07 0.05 -0.01 -0.55 0.23 0.00 0.00 176.35 176.14 1gmu s SER 57 N -3.27 0.47 0.98 2.29 0.15 0.02 -0.29 113.70 114.06 1gmu s SER 57 Ca 0.31 -1.07 -0.16 0.00 0.70 0.00 0.00 55.95 55.74 1gmu s SER 57 Cb -0.09 0.22 0.22 0.00 -1.71 0.00 0.00 66.02 64.66 1gmu s SER 57 CO 0.23 -0.63 1.34 0.54 1.20 0.00 0.00 173.24 175.92 1gmu s ASN 58 N -2.97 2.86 0.12 5.45 4.22 -1.05 -1.15 114.94 122.42 1gmu s ASN 58 Ca 0.13 0.10 -0.21 0.00 -2.14 0.00 0.00 52.86 50.74 1gmu s ASN 58 Cb 0.08 -0.05 -0.05 0.00 1.28 0.00 0.00 41.25 42.51 1gmu s ASN 58 CO -0.06 -2.88 1.70 -0.08 -2.04 0.00 0.00 177.10 173.74 1gmu h GLU 59 N -1.71 -0.05 0.00 3.55 4.57 -1.95 -2.41 114.58 116.58 1gmu h GLU 59 Ca -0.43 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 1gmu h GLU 59 Cb 1.21 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 1gmu h GLU 59 CO 0.31 -0.03 0.00 -0.85 -1.18 0.00 0.00 179.01 177.26 1gmu n GLU 60 N -5.21 0.68 -2.92 1.92 0.28 -1.26 -4.89 120.64 109.24 1gmu n GLU 60 Ca -0.03 0.02 -0.20 0.00 -0.16 0.00 0.00 57.16 56.79 1gmu n GLU 60 Cb 0.13 -1.50 0.03 0.00 1.43 0.00 0.00 31.44 31.54 1gmu n GLU 60 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1gmu n GLY 61 N 0.68 -0.38 0.01 -1.84 0.00 -0.91 -4.90 105.19 97.86 1gmu n GLY 61 Ca 0.17 0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.32 1gmu n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gmu n THR 62 N -4.37 0.00 -4.42 2.61 -2.24 -1.26 -4.93 114.28 99.68 1gmu n THR 62 Ca -0.10 -0.46 -0.25 0.00 -2.27 0.00 0.00 64.05 60.97 1gmu n THR 62 Cb 0.61 0.05 -0.17 0.00 -2.10 0.00 0.00 70.33 68.72 1gmu n THR 62 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1gmu s GLU 63 N -3.43 1.59 0.03 -0.78 2.56 -1.26 -5.05 118.70 112.37 1gmu s GLU 63 Ca -0.07 -0.36 0.04 0.00 0.00 0.00 0.00 54.97 54.59 1gmu s GLU 63 Cb 0.13 -1.39 -0.04 0.00 2.00 0.00 0.00 34.13 34.84 1gmu s GLU 63 CO 0.87 -0.04 -0.08 -0.06 -0.56 0.00 0.00 175.26 175.39 1gmu s PHE 64 N 0.89 2.83 -0.06 5.30 2.99 -1.26 -2.53 117.98 126.14 1gmu s PHE 64 Ca -0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 56.93 56.74 1gmu s PHE 64 Cb -0.15 -1.55 0.03 0.00 0.00 0.00 0.00 43.02 41.34 1gmu s PHE 64 CO 0.01 0.38 -0.01 0.08 -0.00 0.00 0.00 175.22 175.68 1gmu s VAL 65 N -1.05 0.39 0.05 -0.44 1.01 0.60 -4.23 120.40 116.74 1gmu s VAL 65 Ca 0.18 0.05 -0.27 0.00 0.00 0.00 0.00 61.98 61.94 1gmu s VAL 65 Cb -0.11 -0.50 -0.05 0.00 0.00 0.00 0.00 36.38 35.72 1gmu s VAL 65 CO 0.09 0.23 0.85 -1.58 0.00 0.00 0.00 175.10 174.70 1gmu s GLN 66 N 1.53 4.57 -0.14 2.72 0.74 -0.28 -0.41 119.66 128.39 1gmu s GLN 66 Ca -0.02 1.22 -0.20 0.00 0.05 0.00 0.00 55.36 56.41 1gmu s GLN 66 Cb -0.13 -3.39 -0.03 0.00 1.10 0.00 0.00 33.01 30.56 1gmu s GLN 66 CO -0.03 0.21 0.58 0.08 -0.55 0.00 0.00 175.29 175.57 1gmu s VAL 67 N 0.15 5.09 -0.14 1.34 1.01 0.84 -1.09 120.40 127.61 1gmu s VAL 67 Ca 0.43 1.13 -0.01 0.00 0.00 0.00 0.00 61.98 63.54 1gmu s VAL 67 Cb -0.21 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 1gmu s VAL 67 CO 0.25 0.22 -0.12 -0.63 0.00 0.00 0.00 175.10 174.82 1gmu s ILE 68 N 1.21 3.10 -0.14 2.22 -1.09 0.36 0.36 121.20 127.20 1gmu s ILE 68 Ca 0.29 -0.64 -0.29 0.00 -2.23 0.00 0.00 60.65 57.78 1gmu s ILE 68 Cb -0.16 -2.31 -0.01 0.00 -1.58 0.00 0.00 42.46 38.40 1gmu s ILE 68 CO 0.12 0.52 1.15 0.00 -1.23 0.00 0.00 174.94 175.49 1gmu s ALA 69 N 0.43 3.58 0.62 9.38 0.00 -1.26 -0.93 121.76 133.58 1gmu s ALA 69 Ca -0.09 0.41 -0.17 0.00 0.00 0.00 0.00 51.96 52.11 1gmu s ALA 69 Cb -0.16 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 1gmu s ALA 69 CO 0.05 -0.94 1.13 0.00 0.00 0.00 0.00 175.76 175.99 1gmu s ALA 70 N 2.85 2.54 0.16 0.00 0.00 -0.29 -4.71 121.76 122.31 1gmu s ALA 70 Ca 0.51 0.69 -0.30 0.00 0.00 0.00 0.00 51.96 52.86 1gmu s ALA 70 Cb -0.20 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 1gmu s ALA 70 CO 0.15 -1.11 1.19 -0.51 0.00 0.00 0.00 175.76 175.48 1gmu s ASP 71 N -2.20 7.10 0.15 0.00 1.01 -1.26 -4.10 116.67 117.37 1gmu s ASP 71 Ca 0.70 2.17 0.05 0.00 0.71 0.00 0.00 52.55 56.18 1gmu s ASP 71 Cb -0.23 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.06 1gmu s ASP 71 CO 0.36 -0.38 -0.11 -1.61 0.21 0.00 0.00 175.17 173.64 1gmu s GLU 72 N 0.04 1.08 -0.44 8.23 2.02 -0.10 -4.81 118.70 124.72 1gmu s GLU 72 Ca 0.54 -1.42 -0.29 0.00 0.02 0.00 0.00 54.97 53.82 1gmu s GLU 72 Cb -0.32 -0.73 0.01 0.00 0.10 0.00 0.00 34.13 33.20 1gmu s GLU 72 CO 0.35 0.10 1.41 -1.21 0.02 0.00 0.00 175.26 175.93 1gmu s GLU 73 N -3.53 3.51 0.13 1.61 8.01 -1.26 -1.74 118.70 125.43 1gmu s GLU 73 Ca 0.16 0.83 0.07 0.00 0.01 0.00 0.00 54.97 56.04 1gmu s GLU 73 Cb 0.01 -4.05 -0.04 0.00 -4.31 0.00 0.00 34.13 25.74 1gmu s GLU 73 CO 0.02 -1.65 -0.16 0.14 0.01 0.00 0.00 175.26 173.62 1gmu s VAL 74 N 5.58 1.51 0.07 2.63 -7.23 -0.14 -1.63 120.40 121.18 1gmu s VAL 74 Ca 0.59 -1.75 -0.17 0.00 -1.81 0.00 0.00 61.98 58.84 1gmu s VAL 74 Cb -0.13 -1.62 -0.06 0.00 0.56 0.00 0.00 36.38 35.13 1gmu s VAL 74 CO 0.31 -0.35 0.52 -0.44 -0.31 0.00 0.00 175.10 174.83 1gmu s SER 75 N -2.46 6.95 -0.08 4.85 0.01 0.12 -1.62 113.70 121.48 1gmu s SER 75 Ca 0.10 1.15 0.05 0.00 1.31 0.00 0.00 55.95 58.56 1gmu s SER 75 Cb -0.06 -2.32 -0.01 0.00 0.21 0.00 0.00 66.02 63.85 1gmu s SER 75 CO 0.04 0.25 -0.23 -0.69 0.41 0.00 0.00 173.24 173.03 1gmu s VAL 76 N -1.17 2.24 -0.35 3.43 1.01 0.66 -2.46 120.40 123.76 1gmu s VAL 76 Ca 0.29 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1gmu s VAL 76 Cb -0.18 -1.85 0.10 0.00 0.00 0.00 0.00 36.38 34.46 1gmu s VAL 76 CO 0.18 0.56 0.09 -0.69 0.00 0.00 0.00 175.10 175.24 1gmu s VAL 77 N 0.02 1.82 -0.31 2.92 1.01 -0.00 -0.52 120.40 125.34 1gmu s VAL 77 Ca -0.08 -2.14 -0.12 0.00 0.00 0.00 0.00 61.98 59.64 1gmu s VAL 77 Cb -0.15 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 1gmu s VAL 77 CO 0.05 -0.65 0.21 -0.13 0.00 0.00 0.00 175.10 174.58 1gmu s ARG 78 N 1.00 3.71 -0.02 2.72 0.52 -1.25 -0.70 118.95 124.94 1gmu s ARG 78 Ca 0.11 -0.49 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 1gmu s ARG 78 Cb -0.19 -3.72 0.02 0.00 0.52 0.00 0.00 34.95 31.58 1gmu s ARG 78 CO -0.12 -0.31 -0.00 0.00 0.02 0.00 0.00 175.30 174.89 1gmu n ASP 80 N 3.72 0.60 -4.32 0.00 8.00 -1.26 -4.36 116.55 118.93 1gmu n ASP 80 Ca -0.22 -0.49 -0.46 0.00 0.71 0.00 0.00 54.79 54.33 1gmu n ASP 80 Cb 0.54 0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.61 1gmu n ASP 80 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1gmu s ASP 81 N -2.64 6.37 0.29 -2.24 -1.08 -1.26 -4.94 116.67 111.16 1gmu s ASP 81 Ca 0.22 -2.07 0.03 0.00 -0.52 0.00 0.00 52.55 50.21 1gmu s ASP 81 Cb 0.19 -2.21 0.70 0.00 -1.46 0.00 0.00 42.92 40.14 1gmu s ASP 81 CO 0.54 -0.77 1.71 -0.65 0.52 0.00 0.00 175.17 176.52 1gmu h PRO 82 N 8.54 0.45 -0.65 4.34 0.11 -2.01 -1.60 132.00 141.19 1gmu h PRO 82 Ca -0.17 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.96 1gmu h PRO 82 Cb 1.08 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.04 1gmu h PRO 82 CO 0.95 0.30 0.36 0.35 -0.21 0.00 0.00 178.00 179.75 1gmu h PHE 83 N 0.46 0.66 -0.58 0.65 -0.00 -1.98 -1.75 116.94 114.40 1gmu h PHE 83 Ca 0.55 0.02 -0.06 0.00 -0.00 0.00 0.00 57.97 58.48 1gmu h PHE 83 Cb 0.99 -0.20 -0.03 0.00 -0.00 0.00 0.00 35.95 36.71 1gmu h PHE 83 CO -0.12 0.33 0.13 0.52 -0.00 0.00 0.00 178.31 179.17 1gmu h MET 84 N 0.67 0.91 -0.13 1.11 2.86 -1.72 -2.68 114.93 115.96 1gmu h MET 84 Ca 0.29 -0.20 -0.11 0.00 -2.06 0.00 0.00 59.70 57.62 1gmu h MET 84 Cb 0.16 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1gmu h MET 84 CO -0.17 0.82 -0.41 -0.07 1.06 0.00 0.00 176.91 178.14 1gmu h LEU 85 N 0.87 0.29 -0.60 1.22 3.38 -1.19 -2.29 115.31 116.99 1gmu h LEU 85 Ca 0.19 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1gmu h LEU 85 Cb 0.33 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1gmu h LEU 85 CO 0.00 0.67 -0.00 0.00 0.09 0.00 0.00 178.44 179.20 1gmu h ALA 86 N 1.34 0.81 -0.19 1.53 0.00 -1.02 0.12 119.26 121.86 1gmu h ALA 86 Ca 0.02 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1gmu h ALA 86 Cb 0.82 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1gmu h ALA 86 CO 0.06 0.66 -0.27 0.87 0.00 0.00 0.00 179.25 180.57 1gmu h LYS 87 N 0.97 0.35 -0.39 0.00 1.57 -1.31 -1.72 116.57 116.04 1gmu h LYS 87 Ca 0.17 -0.13 -0.16 0.00 -1.87 0.00 0.00 60.65 58.66 1gmu h LYS 87 Cb 0.57 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1gmu h LYS 87 CO 0.03 0.60 -0.36 0.00 -0.57 0.00 0.00 179.45 179.15 1gmu h ALA 88 N 1.40 0.60 -0.77 3.86 0.00 -1.00 -2.32 119.26 121.02 1gmu h ALA 88 Ca 0.05 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1gmu h ALA 88 Cb 0.65 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1gmu h ALA 88 CO 0.05 0.68 0.33 0.00 0.00 0.00 0.00 179.25 180.30 1gmu h TYR 90 N 1.12 0.51 -0.70 0.00 3.20 -1.20 0.01 116.97 119.90 1gmu h TYR 90 Ca 0.26 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 1gmu h TYR 90 Cb 0.18 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.27 1gmu h TYR 90 CO 0.02 0.54 0.35 0.00 -1.64 0.00 0.00 178.16 177.43 1gmu h ALA 91 N 0.91 0.91 -0.18 1.82 0.00 -1.13 -0.40 119.26 121.18 1gmu h ALA 91 Ca 0.10 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1gmu h ALA 91 Cb 0.29 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1gmu h ALA 91 CO 0.00 0.46 -0.50 -0.07 0.00 0.00 0.00 179.25 179.14 1gmu h LEU 92 N 0.98 0.54 -0.58 0.00 3.38 -1.05 -2.86 115.31 115.71 1gmu h LEU 92 Ca 0.24 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1gmu h LEU 92 Cb 0.10 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1gmu h LEU 92 CO -0.03 0.95 0.07 1.23 0.09 0.00 0.00 178.44 180.74 1gmu h GLY 93 N 1.12 1.06 1.76 0.83 0.00 -0.64 -1.96 103.07 105.24 1gmu h GLY 93 Ca 0.02 -0.73 0.03 0.00 0.00 0.00 0.00 47.33 46.66 1gmu h GLY 93 CO 0.09 0.67 0.09 3.43 0.00 0.00 0.00 176.54 180.82 1gmu h ASN 94 N 0.88 0.00 -0.16 0.19 4.21 -0.90 -0.05 115.58 119.75 1gmu h ASN 94 Ca 0.17 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.68 1gmu h ASN 94 Cb 0.46 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.66 1gmu h ASN 94 CO 0.02 0.00 0.00 0.54 -1.29 0.00 0.00 177.43 176.70 1gmu n ARG 95 N -4.49 1.93 -3.68 0.81 1.74 -0.91 -4.95 116.66 107.12 1gmu n ARG 95 Ca -0.00 -1.39 -0.25 0.00 -0.77 0.00 0.00 57.85 55.44 1gmu n ARG 95 Cb 0.21 -1.44 0.06 0.00 -1.02 0.00 0.00 32.46 30.27 1gmu n ARG 95 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1gmu n HIS 96 N 0.63 -2.61 -3.21 -1.55 8.25 -0.03 -4.97 115.22 111.72 1gmu n HIS 96 Ca 0.17 0.97 -0.40 0.00 -0.26 0.00 0.00 57.72 58.21 1gmu n HIS 96 Cb 0.42 -4.72 -0.07 0.00 1.12 0.00 0.00 29.99 26.74 1gmu n HIS 96 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1gmu s VAL 97 N -3.34 5.07 0.17 1.59 1.01 -0.79 -5.02 120.40 119.10 1gmu s VAL 97 Ca 0.52 0.99 -0.33 0.00 0.00 0.00 0.00 61.98 63.16 1gmu s VAL 97 Cb -0.24 -3.86 -0.13 0.00 0.00 0.00 0.00 36.38 32.14 1gmu s VAL 97 CO 0.76 0.13 1.62 -2.65 0.00 0.00 0.00 175.10 174.96 1gmu n PRO 98 N 5.11 2.32 -4.03 2.72 -0.02 -1.26 -4.74 135.00 135.10 1gmu n PRO 98 Ca -0.04 0.84 -0.16 0.00 -2.02 0.00 0.00 63.50 62.12 1gmu n PRO 98 Cb 0.50 -2.63 -0.15 0.00 -0.02 0.00 0.00 33.50 31.20 1gmu n PRO 98 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1gmu s LEU 99 N 1.04 1.59 -0.24 2.45 2.96 -1.26 -4.52 118.68 120.70 1gmu s LEU 99 Ca 0.78 -0.06 -0.12 0.00 -0.22 0.00 0.00 54.13 54.51 1gmu s LEU 99 Cb -0.63 -0.23 -0.05 0.00 0.50 0.00 0.00 46.19 45.78 1gmu s LEU 99 CO 0.36 -0.02 0.25 -1.58 -1.32 0.00 0.00 176.35 174.04 1gmu s GLN 100 N 0.47 4.06 -0.14 1.98 0.74 0.31 -0.50 119.66 126.58 1gmu s GLN 100 Ca -0.05 -0.12 -0.00 0.00 0.05 0.00 0.00 55.36 55.23 1gmu s GLN 100 Cb -0.08 -3.58 -0.01 0.00 1.10 0.00 0.00 33.01 30.44 1gmu s GLN 100 CO -0.01 -0.06 -0.13 0.42 -0.55 0.00 0.00 175.29 174.96 1gmu s ILE 101 N 1.41 2.97 0.10 -2.34 1.01 -1.26 -1.43 121.20 121.66 1gmu s ILE 101 Ca 0.11 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.09 1gmu s ILE 101 Cb -0.15 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.03 1gmu s ILE 101 CO 0.07 0.51 -0.05 -0.04 0.00 0.00 0.00 174.94 175.43 1gmu s MET 102 N 0.56 0.82 -0.17 2.79 -1.94 -0.23 -5.04 119.30 116.10 1gmu s MET 102 Ca -0.08 -1.33 -0.29 0.00 -1.71 0.00 0.00 55.69 52.28 1gmu s MET 102 Cb -0.16 -0.14 -0.04 0.00 2.01 0.00 0.00 34.83 36.51 1gmu s MET 102 CO 0.03 -0.04 1.70 -1.25 -0.01 0.00 0.00 175.02 175.46 1gmu s PRO 103 N -3.86 3.84 0.00 2.03 0.04 -1.26 -2.17 135.00 133.63 1gmu s PRO 103 Ca 0.12 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1gmu s PRO 103 Cb 0.06 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.53 1gmu s PRO 103 CO -0.05 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.16 1gmu n GLY 104 N 4.63 0.82 3.48 0.56 0.00 -1.26 -5.03 105.19 108.39 1gmu n GLY 104 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 1gmu n GLY 104 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1gmu s GLU 105 N -0.31 0.64 0.15 1.61 2.12 -0.92 -1.42 118.70 120.57 1gmu s GLU 105 Ca 0.00 0.87 0.10 0.00 0.36 0.00 0.00 54.97 56.30 1gmu s GLU 105 Cb 0.00 0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.60 1gmu s GLU 105 CO 0.00 -0.10 -0.23 -0.51 -0.54 0.00 0.00 175.26 173.87 1gmu s LEU 106 N 0.67 2.37 -0.02 2.70 1.43 0.12 -1.07 118.68 124.88 1gmu s LEU 106 Ca -0.03 -0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 52.25 1gmu s LEU 106 Cb -0.05 -1.07 0.00 0.00 0.03 0.00 0.00 46.19 45.10 1gmu s LEU 106 CO -0.04 0.10 0.09 -0.13 0.23 0.00 0.00 176.35 176.60 1gmu s ARG 107 N -2.32 0.20 0.14 1.70 0.52 -0.51 -0.82 118.95 117.85 1gmu s ARG 107 Ca 0.15 -0.04 -0.18 0.00 -0.52 0.00 0.00 55.73 55.14 1gmu s ARG 107 Cb -0.09 0.09 0.05 0.00 0.52 0.00 0.00 34.95 35.52 1gmu s ARG 107 CO 0.07 -0.03 0.47 1.52 0.02 0.00 0.00 175.30 177.34 1gmu s TYR 108 N -0.36 -0.32 0.09 -0.53 -0.85 -1.03 -0.53 117.35 113.83 1gmu s TYR 108 Ca -0.04 0.03 -0.34 0.00 -0.52 0.00 0.00 57.07 56.20 1gmu s TYR 108 Cb -0.03 0.36 -0.14 0.00 0.38 0.00 0.00 41.96 42.54 1gmu s TYR 108 CO 0.00 -0.75 1.63 0.72 -1.52 0.00 0.00 175.55 175.62 1gmu n HIS 109 N -0.28 2.21 -1.65 -3.49 8.25 -1.26 0.14 115.22 119.13 1gmu n HIS 109 Ca -0.16 0.25 -0.58 0.00 -0.26 0.00 0.00 57.72 56.97 1gmu n HIS 109 Cb 0.64 -2.55 -0.07 0.00 1.12 0.00 0.00 29.99 29.13 1gmu n HIS 109 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1gmu n HIS 110 N 4.08 1.65 -3.49 4.41 -0.00 -0.65 -4.55 115.22 116.67 1gmu n HIS 110 Ca 0.19 0.74 -0.12 0.00 0.46 0.00 0.00 57.72 58.99 1gmu n HIS 110 Cb 0.28 -2.33 -0.10 0.00 -0.12 0.00 0.00 29.99 27.71 1gmu n HIS 110 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1gmu s ASP 111 N 2.06 0.44 0.22 0.26 -1.08 -1.26 -4.93 116.67 112.38 1gmu s ASP 111 Ca 0.94 0.32 -0.08 0.00 -0.52 0.00 0.00 52.55 53.21 1gmu s ASP 111 Cb -1.13 0.91 0.33 0.00 -1.46 0.00 0.00 42.92 41.57 1gmu s ASP 111 CO 0.62 -0.28 1.74 -0.74 0.52 0.00 0.00 175.17 177.03 1gmu h HIS 112 N 8.23 0.46 -0.04 -5.34 -0.00 -1.99 -0.78 115.15 115.68 1gmu h HIS 112 Ca -0.17 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.25 1gmu h HIS 112 Cb 1.14 -0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 28.42 1gmu h HIS 112 CO 0.20 0.11 -0.12 0.28 -0.00 0.00 0.00 177.93 178.40 1gmu h VAL 113 N 0.44 0.69 -0.65 5.26 2.07 -2.00 -2.03 116.25 120.03 1gmu h VAL 113 Ca 0.34 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.79 1gmu h VAL 113 Cb 0.44 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1gmu h VAL 113 CO -0.33 0.00 0.14 -0.07 0.02 0.00 0.00 177.57 177.33 1gmu h LEU 114 N -0.18 0.99 -0.07 2.57 3.38 -1.89 -2.37 115.31 117.75 1gmu h LEU 114 Ca 0.06 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.83 1gmu h LEU 114 Cb 0.26 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1gmu h LEU 114 CO -0.15 0.97 -0.02 0.44 0.09 0.00 0.00 178.44 179.77 1gmu h ASP 115 N 0.99 -0.08 -0.72 -0.43 3.32 -0.82 -1.27 116.42 117.41 1gmu h ASP 115 Ca 0.20 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.24 1gmu h ASP 115 Cb 0.38 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 1gmu h ASP 115 CO 0.01 -0.03 0.31 0.44 -1.72 0.00 0.00 179.24 178.24 1gmu h ASP 116 N -0.01 0.99 -0.56 6.45 3.32 -1.31 -0.84 116.42 124.46 1gmu h ASP 116 Ca 0.04 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 56.96 1gmu h ASP 116 Cb 0.06 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1gmu h ASP 116 CO -0.08 0.88 0.36 -0.03 -1.72 0.00 0.00 179.24 178.65 1gmu h MET 117 N 1.07 0.71 -0.10 3.56 4.05 -1.02 -2.50 114.93 120.69 1gmu h MET 117 Ca 0.25 -0.04 -0.15 0.00 -0.28 0.00 0.00 59.70 59.48 1gmu h MET 117 Cb 0.18 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 1gmu h MET 117 CO -0.02 0.47 -0.59 -0.07 0.23 0.00 0.00 176.91 176.92 1gmu h LEU 118 N 0.73 0.38 -2.01 3.39 3.38 -0.87 -2.89 115.31 117.42 1gmu h LEU 118 Ca 0.22 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1gmu h LEU 118 Cb -0.04 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1gmu h LEU 118 CO -0.07 0.89 -0.03 0.03 0.09 0.00 0.00 178.44 179.35 1gmu h ARG 119 N 0.25 0.00 0.00 1.13 3.08 -0.74 0.14 114.38 118.24 1gmu h ARG 119 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1gmu h ARG 119 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1gmu h ARG 119 CO 0.10 0.03 0.00 1.96 -1.07 0.00 0.00 179.97 180.98 1gmu h GLN 120 N 0.00 0.00 0.00 0.04 4.20 -1.24 0.30 115.11 118.41 1gmu h GLN 120 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1gmu h GLN 120 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1gmu h GLN 120 CO 0.00 0.00 -0.05 0.74 -0.67 0.00 0.00 178.83 178.86 1gmu h PHE 121 N 0.00 0.00 0.00 2.96 0.04 -0.81 -3.46 116.94 115.67 1gmu h PHE 121 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1gmu h PHE 121 Cb 0.37 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.52 1gmu h PHE 121 CO 0.00 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.12 1gmu n GLY 122 N 1.30 1.00 3.88 -1.45 0.00 0.09 -5.09 105.19 104.93 1gmu n GLY 122 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1gmu n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gmu s LEU 123 N 0.00 4.08 -0.29 0.99 1.43 -1.19 -5.03 118.68 118.67 1gmu s LEU 123 Ca 0.00 0.94 -0.14 0.00 -1.03 0.00 0.00 54.13 53.90 1gmu s LEU 123 Cb 0.00 -3.74 -0.03 0.00 0.03 0.00 0.00 46.19 42.45 1gmu s LEU 123 CO 0.00 -0.17 0.32 -0.89 0.23 0.00 0.00 176.35 175.85 1gmu s THR 124 N -1.98 5.21 -0.18 5.49 2.01 -1.26 -4.26 115.64 120.66 1gmu s THR 124 Ca 0.48 0.31 -0.02 0.00 0.31 0.00 0.00 61.69 62.77 1gmu s THR 124 Cb -0.11 -3.69 -0.01 0.00 0.01 0.00 0.00 72.50 68.70 1gmu s THR 124 CO 0.24 0.11 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.51 1gmu s VAL 125 N 1.97 3.24 0.46 3.82 1.01 -1.26 -3.81 120.40 125.84 1gmu s VAL 125 Ca 0.12 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.55 1gmu s VAL 125 Cb -0.16 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.81 1gmu s VAL 125 CO 0.11 0.48 0.10 0.35 0.00 0.00 0.00 175.10 176.14 1gmu n THR 126 N 4.14 0.00 -4.30 3.92 -2.24 0.32 -4.93 114.28 111.19 1gmu n THR 126 Ca -0.18 -2.09 -0.20 0.00 -2.27 0.00 0.00 64.05 59.31 1gmu n THR 126 Cb 0.52 0.29 -0.11 0.00 -2.10 0.00 0.00 70.33 68.92 1gmu n THR 126 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1gmu s PHE 127 N -2.58 1.65 -0.03 4.78 5.99 -1.26 -0.25 117.98 126.28 1gmu s PHE 127 Ca 0.08 -0.51 -0.30 0.00 0.00 0.00 0.00 56.93 56.19 1gmu s PHE 127 Cb -0.01 -0.83 0.11 0.00 0.00 0.00 0.00 43.02 42.29 1gmu s PHE 127 CO 0.05 0.25 1.17 0.20 -0.00 0.00 0.00 175.22 176.89 1gmu s GLY 128 N -2.62 -0.35 -0.45 13.12 0.00 -0.64 -4.89 107.32 111.50 1gmu s GLY 128 Ca 0.13 0.85 -0.05 0.00 0.00 0.00 0.00 44.72 45.66 1gmu s GLY 128 CO 0.05 0.23 0.27 1.20 0.00 0.00 0.00 173.10 174.85 1gmu s GLN 129 N -2.65 2.20 0.08 2.90 -1.52 -1.26 -0.96 119.66 118.46 1gmu s GLN 129 Ca 0.12 -1.86 -0.01 0.00 -1.95 0.00 0.00 55.36 51.66 1gmu s GLN 129 Cb 0.02 -3.71 -0.04 0.00 -0.22 0.00 0.00 33.01 29.05 1gmu s GLN 129 CO -0.03 -1.12 0.01 -0.51 -0.25 0.00 0.00 175.29 173.38 1gmu s LEU 130 N 1.12 2.18 0.40 2.90 1.43 -0.71 -4.71 118.68 121.29 1gmu s LEU 130 Ca 0.08 -1.09 -0.27 0.00 -1.03 0.00 0.00 54.13 51.83 1gmu s LEU 130 Cb -0.24 0.24 -0.09 0.00 0.03 0.00 0.00 46.19 46.13 1gmu s LEU 130 CO -0.03 -0.65 1.36 -2.84 0.23 0.00 0.00 176.35 174.42 1gmu s PRO 131 N -3.97 3.98 -0.21 1.29 0.02 -1.26 -0.92 135.00 133.93 1gmu s PRO 131 Ca 0.14 2.29 -0.01 0.00 0.02 0.00 0.00 61.00 63.45 1gmu s PRO 131 Cb 0.08 -2.81 0.01 0.00 0.02 0.00 0.00 34.50 31.80 1gmu s PRO 131 CO -0.05 -0.53 -0.13 0.12 -0.33 0.00 0.00 177.00 176.08 1gmu s PHE 132 N -1.21 2.90 -0.61 6.54 5.36 -1.26 -4.89 117.98 124.81 1gmu s PHE 132 Ca 0.56 -1.45 0.05 0.00 -0.96 0.00 0.00 56.93 55.13 1gmu s PHE 132 Cb -0.41 -2.00 0.19 0.00 -0.34 0.00 0.00 43.02 40.46 1gmu s PHE 132 CO 0.53 -0.72 0.51 0.39 -1.46 0.00 0.00 175.22 174.47 1gmu n GLU 133 N 4.67 1.53 -1.34 10.12 -0.58 -1.26 -4.66 120.64 129.12 1gmu n GLU 133 Ca -0.19 -4.15 -0.32 0.00 -0.42 0.00 0.00 57.16 52.07 1gmu n GLU 133 Cb 0.49 -2.07 0.09 0.00 -0.57 0.00 0.00 31.44 29.38 1gmu n GLU 133 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1gmu s PRO 134 N -1.31 2.17 0.34 3.49 0.04 -1.26 -4.45 135.00 134.02 1gmu s PRO 134 Ca 0.30 1.43 -0.29 0.00 0.04 0.00 0.00 61.00 62.48 1gmu s PRO 134 Cb 0.03 -1.87 -0.11 0.00 0.04 0.00 0.00 34.50 32.59 1gmu s PRO 134 CO -0.14 -1.75 1.53 -1.21 0.04 0.00 0.00 177.00 175.47 1gmu s GLU 135 N -4.40 4.12 0.32 4.56 0.41 0.35 -4.88 118.70 119.18 1gmu s GLU 135 Ca 0.67 2.57 0.02 0.00 -0.41 0.00 0.00 54.97 57.81 1gmu s GLU 135 Cb -0.22 -2.99 0.55 0.00 -1.78 0.00 0.00 34.13 29.69 1gmu s GLU 135 CO 0.50 -0.57 1.90 0.00 -0.49 0.00 0.00 175.26 176.60 1gmu h ALA 136 N 3.78 1.37 -0.57 5.21 0.00 -1.92 -3.40 119.26 123.73 1gmu h ALA 136 Ca -0.49 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.09 1gmu h ALA 136 Cb 1.23 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1gmu h ALA 136 CO 0.70 0.46 0.69 0.41 0.00 0.00 0.00 179.25 181.51 1gmu n GLY 137 N -1.03 -0.13 0.00 0.00 0.00 -1.26 -5.17 105.19 97.60 1gmu n GLY 137 Ca 0.04 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1gmu n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32