#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmo s LEU 2 N 0.00 3.31 0.53 -0.89 1.43 -1.26 -4.76 118.68 117.05 1xmo s LEU 2 Ca 0.00 -1.70 0.37 0.00 -1.03 0.00 0.00 54.13 51.77 1xmo s LEU 2 Cb 0.00 -2.58 1.55 0.00 0.03 0.00 0.00 46.19 45.19 1xmo s LEU 2 CO 0.00 -2.40 1.77 0.00 0.23 0.00 0.00 176.35 175.95 1xmo h THR 3 N 6.24 0.35 -1.66 5.49 1.03 -2.06 -3.31 112.91 118.99 1xmo h THR 3 Ca 0.26 -0.01 -0.29 0.00 -0.01 0.00 0.00 66.41 66.36 1xmo h THR 3 Cb 0.94 0.32 -0.27 0.00 -1.07 0.00 0.00 68.15 68.07 1xmo h THR 3 CO 1.30 0.00 -0.63 -0.62 -0.01 0.00 0.00 175.52 175.56 1xmo s ASP 4 N -4.97 0.28 0.21 0.00 -1.08 -1.26 -4.91 116.67 104.93 1xmo s ASP 4 Ca -0.05 -1.52 -0.19 0.00 -0.52 0.00 0.00 52.55 50.27 1xmo s ASP 4 Cb 0.24 0.96 0.19 0.00 -1.46 0.00 0.00 42.92 42.85 1xmo s ASP 4 CO 0.82 -0.21 1.56 -0.65 0.52 0.00 0.00 175.17 177.21 1xmo h PRO 5 N 6.74 -0.06 -0.03 4.34 0.11 -1.99 -0.95 132.00 140.16 1xmo h PRO 5 Ca 0.07 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 1xmo h PRO 5 Cb 1.08 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1xmo h PRO 5 CO 0.17 -0.04 -0.03 0.82 -0.21 0.00 0.00 178.00 178.70 1xmo h ILE 6 N -0.06 1.05 0.09 4.15 1.08 -1.97 -0.71 117.51 121.14 1xmo h ILE 6 Ca 0.30 -0.20 -0.13 0.00 -0.39 0.00 0.00 64.86 64.44 1xmo h ILE 6 Cb 0.58 1.06 0.01 0.00 -3.07 0.00 0.00 36.82 35.40 1xmo h ILE 6 CO -0.87 0.06 -0.57 0.00 -0.69 0.00 0.00 178.15 176.08 1xmo h ALA 7 N 1.93 -0.05 -0.66 1.87 0.00 -1.78 -2.10 119.26 118.46 1xmo h ALA 7 Ca 0.01 -0.65 0.12 0.00 0.00 0.00 0.00 54.91 54.40 1xmo h ALA 7 Cb 0.09 0.08 -0.13 0.00 0.00 0.00 0.00 17.79 17.84 1xmo h ALA 7 CO 0.00 0.27 -0.25 0.22 0.00 0.00 0.00 179.25 179.49 1xmo h ASP 8 N -0.58 -0.90 0.34 0.00 3.58 -0.44 0.48 116.42 118.89 1xmo h ASP 8 Ca -0.10 0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.55 1xmo h ASP 8 Cb 1.43 0.51 0.00 0.00 1.72 0.00 0.00 39.33 43.00 1xmo h ASP 8 CO 0.10 -0.27 -0.16 -0.03 -2.88 0.00 0.00 179.24 176.00 1xmo h MET 9 N -0.08 -0.43 -0.68 0.28 4.05 -1.22 -0.18 114.93 116.67 1xmo h MET 9 Ca 0.29 0.03 0.13 0.00 -0.28 0.00 0.00 59.70 59.87 1xmo h MET 9 Cb 0.54 0.10 -0.13 0.00 -0.80 0.00 0.00 31.60 31.31 1xmo h MET 9 CO -0.71 -0.24 -0.18 -0.07 0.23 0.00 0.00 176.91 175.93 1xmo h LEU 10 N -0.52 -0.68 0.21 3.39 3.38 -0.31 -1.11 115.31 119.68 1xmo h LEU 10 Ca -0.05 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1xmo h LEU 10 Cb 0.39 0.44 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1xmo h LEU 10 CO 0.08 -0.23 -0.10 0.74 0.09 0.00 0.00 178.44 179.01 1xmo h THR 11 N -0.01 0.84 -0.99 0.22 2.02 0.12 0.35 112.91 115.45 1xmo h THR 11 Ca 0.32 -0.24 0.34 0.00 0.77 0.00 0.00 66.41 67.60 1xmo h THR 11 Cb 0.50 0.98 -0.18 0.00 -1.74 0.00 0.00 68.15 67.72 1xmo h THR 11 CO -0.70 0.05 0.28 0.03 0.37 0.00 0.00 175.52 175.56 1xmo h ARG 12 N -0.40 0.03 -0.01 6.66 3.08 0.05 1.67 114.38 125.47 1xmo h ARG 12 Ca -0.03 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1xmo h ARG 12 Cb 0.31 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 1xmo h ARG 12 CO 0.05 0.02 -0.00 0.82 -1.07 0.00 0.00 179.97 179.78 1xmo h ILE 13 N 0.03 1.33 -0.85 2.04 2.04 -0.77 -0.09 117.51 121.24 1xmo h ILE 13 Ca 0.71 -0.96 0.16 0.00 1.00 0.00 0.00 64.86 65.77 1xmo h ILE 13 Cb 1.68 1.97 -0.06 0.00 -0.74 0.00 0.00 36.82 39.67 1xmo h ILE 13 CO -0.83 0.25 0.56 -0.09 0.00 0.00 0.00 178.15 178.04 1xmo h ARG 14 N -0.39 0.50 0.01 2.37 2.43 0.42 -1.14 114.38 118.58 1xmo h ARG 14 Ca 0.00 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1xmo h ARG 14 Cb 0.41 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1xmo h ARG 14 CO 0.00 0.33 -0.00 -0.91 -1.51 0.00 0.00 179.97 177.88 1xmo h ASN 15 N 0.52 -0.01 -0.98 -3.80 2.35 0.10 -3.09 115.58 110.67 1xmo h ASN 15 Ca 0.43 0.00 0.35 0.00 -0.55 0.00 0.00 56.30 56.53 1xmo h ASN 15 Cb 0.89 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 39.08 1xmo h ASN 15 CO -0.17 0.01 0.31 0.00 -1.65 0.00 0.00 177.43 175.94 1xmo n ALA 16 N -2.04 0.79 -0.16 -0.83 0.00 -0.06 0.10 120.51 118.31 1xmo n ALA 16 Ca -0.00 1.02 -0.10 0.00 0.00 0.00 0.00 53.44 54.36 1xmo n ALA 16 Cb 0.00 -0.90 -0.00 0.00 0.00 0.00 0.00 19.45 18.55 1xmo n ALA 16 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1xmo h THR 17 N 0.00 1.27 -0.06 0.00 1.35 -1.35 -0.56 112.91 113.57 1xmo h THR 17 Ca 0.73 -1.11 0.02 0.00 -0.55 0.00 0.00 66.41 65.50 1xmo h THR 17 Cb 1.79 1.03 -0.00 0.00 -1.73 0.00 0.00 68.15 69.24 1xmo h THR 17 CO -0.82 0.39 0.15 0.03 -0.25 0.00 0.00 175.52 175.01 1xmo h ARG 18 N 0.71 0.00 -0.22 4.72 -0.00 0.78 0.28 114.38 120.64 1xmo h ARG 18 Ca 0.13 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.56 1xmo h ARG 18 Cb 0.55 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.49 1xmo h ARG 18 CO 0.03 0.00 -0.04 1.33 0.00 0.00 0.00 179.97 181.29 1xmo n VAL 19 N -3.29 2.27 -4.09 2.04 0.24 -1.09 -4.99 118.33 109.42 1xmo n VAL 19 Ca -0.01 -2.25 -0.34 0.00 -2.04 0.00 0.00 64.34 59.70 1xmo n VAL 19 Cb 0.23 -0.27 -0.00 0.00 -1.47 0.00 0.00 33.84 32.32 1xmo n VAL 19 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1xmo n TYR 20 N -0.90 -1.97 -0.34 6.34 4.01 0.97 -4.97 117.16 120.31 1xmo n TYR 20 Ca 0.23 0.84 -0.23 0.00 -0.16 0.00 0.00 57.90 58.58 1xmo n TYR 20 Cb 0.87 -3.35 0.22 0.00 -0.31 0.00 0.00 39.34 36.77 1xmo n TYR 20 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1xmo n LYS 21 N -4.49 -3.87 -0.03 -0.72 4.76 -0.25 -4.99 118.16 108.57 1xmo n LYS 21 Ca 0.07 -1.16 -0.02 0.00 -2.87 0.00 0.00 58.31 54.33 1xmo n LYS 21 Cb 0.50 -1.40 -0.07 0.00 -1.84 0.00 0.00 35.03 32.22 1xmo n LYS 21 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1xmo n GLU 22 N -4.72 1.91 -3.58 1.97 4.07 -1.26 -4.84 120.64 114.19 1xmo n GLU 22 Ca 0.11 -0.03 -0.02 0.00 -0.06 0.00 0.00 57.16 57.16 1xmo n GLU 22 Cb 0.46 -1.23 -0.05 0.00 -0.06 0.00 0.00 31.44 30.55 1xmo n GLU 22 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 1xmo s SER 23 N -3.83 -0.83 -0.05 4.31 1.04 -1.26 -2.54 113.70 110.53 1xmo s SER 23 Ca -0.04 1.21 -0.08 0.00 0.48 0.00 0.00 55.95 57.52 1xmo s SER 23 Cb 0.04 1.72 -0.05 0.00 0.10 0.00 0.00 66.02 67.83 1xmo s SER 23 CO 0.38 -0.18 0.24 0.28 0.98 0.00 0.00 173.24 174.94 1xmo s THR 24 N 2.20 5.34 -0.21 2.02 -1.32 -1.09 -4.81 115.64 117.76 1xmo s THR 24 Ca -0.07 0.33 -0.10 0.00 -1.21 0.00 0.00 61.69 60.64 1xmo s THR 24 Cb -0.07 -3.52 -0.05 0.00 -1.51 0.00 0.00 72.50 67.35 1xmo s THR 24 CO -0.18 0.53 0.13 -1.81 -2.21 0.00 0.00 174.62 171.08 1xmo s ASP 25 N -1.26 6.03 0.08 8.08 1.11 -1.26 -1.30 116.67 128.16 1xmo s ASP 25 Ca 0.21 0.14 0.08 0.00 0.18 0.00 0.00 52.55 53.16 1xmo s ASP 25 Cb -0.13 -2.07 -0.03 0.00 1.07 0.00 0.00 42.92 41.76 1xmo s ASP 25 CO 0.10 0.13 -0.22 0.68 1.18 0.00 0.00 175.17 177.03 1xmo s VAL 26 N 0.68 1.81 0.24 -1.27 -7.23 -1.24 -4.89 120.40 108.50 1xmo s VAL 26 Ca 0.07 -1.46 -0.30 0.00 -1.81 0.00 0.00 61.98 58.47 1xmo s VAL 26 Cb -0.12 -1.61 -0.10 0.00 0.56 0.00 0.00 36.38 35.10 1xmo s VAL 26 CO 0.01 0.07 1.52 -2.84 -0.31 0.00 0.00 175.10 173.55 1xmo s PRO 27 N -1.66 4.21 0.23 4.82 0.02 -1.26 -0.29 135.00 141.07 1xmo s PRO 27 Ca 0.08 2.40 -0.30 0.00 0.02 0.00 0.00 61.00 63.20 1xmo s PRO 27 Cb -0.10 -3.10 -0.09 0.00 0.02 0.00 0.00 34.50 31.24 1xmo s PRO 27 CO 0.04 -0.53 1.14 0.00 -0.33 0.00 0.00 177.00 177.31 1xmo s ALA 28 N 0.30 3.41 -0.08 -1.55 0.00 -0.65 -4.78 121.76 118.41 1xmo s ALA 28 Ca 0.63 0.91 -0.11 0.00 0.00 0.00 0.00 51.96 53.39 1xmo s ALA 28 Cb -0.44 -3.36 0.03 0.00 0.00 0.00 0.00 23.12 19.34 1xmo s ALA 28 CO 0.41 -0.25 0.29 -1.54 0.00 0.00 0.00 175.76 174.67 1xmo s SER 29 N -0.40 -0.26 0.12 0.00 1.04 -1.26 -4.92 113.70 108.01 1xmo s SER 29 Ca 0.48 0.43 -0.32 0.00 0.48 0.00 0.00 55.95 57.01 1xmo s SER 29 Cb -0.32 0.51 -0.11 0.00 0.10 0.00 0.00 66.02 66.20 1xmo s SER 29 CO 0.39 -0.20 1.53 0.03 0.98 0.00 0.00 173.24 175.97 1xmo h ARG 30 N 5.15 -0.45 -0.65 4.02 2.47 -1.99 0.40 114.38 123.33 1xmo h ARG 30 Ca -0.27 0.03 0.14 0.00 -1.26 0.00 0.00 59.98 58.61 1xmo h ARG 30 Cb 1.19 0.10 -0.10 0.00 -1.65 0.00 0.00 29.97 29.51 1xmo h ARG 30 CO 0.34 -0.30 0.09 0.35 0.56 0.00 0.00 179.97 181.01 1xmo h PHE 31 N -0.46 0.12 -0.09 3.04 3.57 -1.99 0.10 116.94 121.22 1xmo h PHE 31 Ca 0.05 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1xmo h PHE 31 Cb 0.61 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 1xmo h PHE 31 CO -0.66 -0.11 -0.01 0.87 -2.23 0.00 0.00 178.31 176.17 1xmo h LYS 32 N 0.20 0.02 -0.58 1.11 1.57 -1.67 -1.97 116.57 115.23 1xmo h LYS 32 Ca 0.35 -0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.22 1xmo h LYS 32 Cb 0.58 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.81 1xmo h LYS 32 CO -0.50 0.01 0.21 1.49 -0.57 0.00 0.00 179.45 180.09 1xmo h GLU 33 N 0.02 0.37 -0.28 3.15 4.81 0.11 -0.62 114.58 122.13 1xmo h GLU 33 Ca 0.04 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1xmo h GLU 33 Cb 0.06 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.30 1xmo h GLU 33 CO -0.09 0.24 -0.36 0.93 -0.73 0.00 0.00 179.01 179.01 1xmo h GLU 34 N 0.38 -0.24 -0.16 1.92 4.39 -0.18 -0.35 114.58 120.34 1xmo h GLU 34 Ca 0.29 0.02 0.05 0.00 0.34 0.00 0.00 59.36 60.05 1xmo h GLU 34 Cb 0.36 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.99 1xmo h GLU 34 CO -0.30 -0.16 -0.42 0.82 -1.16 0.00 0.00 179.01 177.79 1xmo h ILE 35 N -0.25 0.14 -0.89 3.13 2.04 -0.78 -0.47 117.51 120.44 1xmo h ILE 35 Ca 0.05 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.07 1xmo h ILE 35 Cb 0.38 0.14 -0.16 0.00 -0.74 0.00 0.00 36.82 36.44 1xmo h ILE 35 CO -0.40 0.00 -0.28 -0.07 0.00 0.00 0.00 178.15 177.41 1xmo h LEU 36 N -0.47 -1.02 -0.85 1.44 3.38 -0.59 0.40 115.31 117.60 1xmo h LEU 36 Ca 0.08 0.28 0.20 0.00 0.09 0.00 0.00 57.88 58.52 1xmo h LEU 36 Cb 0.62 0.61 -0.15 0.00 0.09 0.00 0.00 40.66 41.82 1xmo h LEU 36 CO -0.41 -0.30 -0.06 0.03 0.09 0.00 0.00 178.44 177.79 1xmo h ARG 37 N -0.02 0.05 0.41 1.13 3.08 0.66 0.15 114.38 119.83 1xmo h ARG 37 Ca 0.39 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 1xmo h ARG 37 Cb 0.63 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1xmo h ARG 37 CO -0.91 0.03 -0.20 0.82 -1.07 0.00 0.00 179.97 178.64 1xmo h ILE 38 N 0.05 0.59 -0.47 2.04 5.03 -0.14 -0.45 117.51 124.16 1xmo h ILE 38 Ca 0.46 -0.26 0.05 0.00 -0.12 0.00 0.00 64.86 64.99 1xmo h ILE 38 Cb 0.82 0.72 -0.08 0.00 -3.03 0.00 0.00 36.82 35.24 1xmo h ILE 38 CO -0.80 0.05 -0.52 -0.07 -0.68 0.00 0.00 178.15 176.13 1xmo h LEU 39 N -0.70 -1.77 -0.74 1.44 -0.00 -0.14 0.24 115.31 113.64 1xmo h LEU 39 Ca -0.06 0.24 0.16 0.00 -0.00 0.00 0.00 57.88 58.22 1xmo h LEU 39 Cb 0.50 0.74 -0.14 0.00 -0.00 0.00 0.00 40.66 41.76 1xmo h LEU 39 CO 0.09 -0.34 -0.11 0.00 -0.00 0.00 0.00 178.44 178.08 1xmo h ALA 40 N -0.05 0.60 0.71 1.53 0.00 -0.72 -0.56 119.26 120.77 1xmo h ALA 40 Ca 0.08 0.27 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 1xmo h ALA 40 Cb 0.52 0.50 0.01 0.00 0.00 0.00 0.00 17.79 18.82 1xmo h ALA 40 CO -0.61 -0.42 -0.34 -0.09 0.00 0.00 0.00 179.25 177.79 1xmo h ARG 41 N 0.04 -0.92 0.00 0.00 2.43 0.96 -1.11 114.38 115.77 1xmo h ARG 41 Ca 0.37 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.61 1xmo h ARG 41 Cb 0.61 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 1xmo h ARG 41 CO -0.72 -0.60 0.00 0.39 -1.51 0.00 0.00 179.97 177.54 1xmo n GLU 42 N -5.47 0.17 -2.96 0.20 -0.58 0.57 -4.81 120.64 107.76 1xmo n GLU 42 Ca -0.14 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.48 1xmo n GLU 42 Cb 0.39 -1.35 0.06 0.00 -0.57 0.00 0.00 31.44 29.97 1xmo n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xmo n GLY 43 N -0.57 -0.38 0.31 0.62 0.00 -0.31 -4.94 105.19 99.92 1xmo n GLY 43 Ca 0.03 0.14 0.06 0.00 0.00 0.00 0.00 46.02 46.25 1xmo n GLY 43 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xmo n PHE 44 N -3.10 0.00 -3.72 1.61 3.72 -0.67 -4.99 117.46 110.31 1xmo n PHE 44 Ca -0.14 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.12 1xmo n PHE 44 Cb 0.61 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 39.07 1xmo n PHE 44 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 1xmo s ILE 45 N -1.63 0.04 -0.79 4.37 -4.36 -1.26 -4.26 121.20 113.32 1xmo s ILE 45 Ca 0.11 -0.36 0.00 0.00 -0.26 0.00 0.00 60.65 60.14 1xmo s ILE 45 Cb 0.11 -0.67 0.00 0.00 1.25 0.00 0.00 42.46 43.15 1xmo s ILE 45 CO 0.33 -0.20 0.28 0.29 0.24 0.00 0.00 174.94 175.88 1xmo n LYS 46 N 1.36 0.47 0.00 0.37 5.02 0.41 -4.64 118.16 121.14 1xmo n LYS 46 Ca -0.20 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 1xmo n LYS 46 Cb 0.56 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 1xmo n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xmo n GLY 47 N 0.37 -1.84 3.58 0.72 0.00 -1.23 -4.76 105.19 102.03 1xmo n GLY 47 Ca 0.00 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 1xmo n GLY 47 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xmo s TYR 48 N 0.00 -0.34 0.04 1.61 -0.85 -1.26 -1.44 117.35 115.11 1xmo s TYR 48 Ca 0.00 0.57 0.03 0.00 -0.52 0.00 0.00 57.07 57.14 1xmo s TYR 48 Cb 0.00 0.46 -0.02 0.00 0.38 0.00 0.00 41.96 42.77 1xmo s TYR 48 CO 0.00 -0.33 -0.09 -1.83 -1.52 0.00 0.00 175.55 171.78 1xmo s GLU 49 N -1.20 0.59 0.38 -3.49 -1.05 -0.48 -4.97 118.70 108.48 1xmo s GLU 49 Ca -0.01 -0.74 -0.26 0.00 -0.15 0.00 0.00 54.97 53.82 1xmo s GLU 49 Cb -0.01 -0.43 -0.09 0.00 -0.44 0.00 0.00 34.13 33.17 1xmo s GLU 49 CO 0.00 0.09 1.12 -0.98 0.95 0.00 0.00 175.26 176.44 1xmo s ARG 50 N -1.46 4.19 0.00 -4.83 1.70 -1.26 -0.84 118.95 116.46 1xmo s ARG 50 Ca -0.07 1.73 0.00 0.00 -0.47 0.00 0.00 55.73 56.92 1xmo s ARG 50 Cb -0.09 -2.72 0.00 0.00 -0.57 0.00 0.00 34.95 31.56 1xmo s ARG 50 CO 0.01 -0.17 0.00 0.28 -1.08 0.00 0.00 175.30 174.34 1xmo n VAL 51 N 0.22 0.00 -3.67 4.99 0.31 -1.12 -4.85 118.33 114.21 1xmo n VAL 51 Ca 0.04 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.24 1xmo n VAL 51 Cb 0.47 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.27 1xmo n VAL 51 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1xmo s ASP 52 N -0.67 0.17 -0.12 4.52 1.11 -1.26 -2.55 116.67 117.87 1xmo s ASP 52 Ca 0.00 0.64 0.03 0.00 0.18 0.00 0.00 52.55 53.40 1xmo s ASP 52 Cb 0.00 0.74 0.00 0.00 1.07 0.00 0.00 42.92 44.73 1xmo s ASP 52 CO 0.00 -0.23 -0.22 -0.69 1.18 0.00 0.00 175.17 175.21 1xmo s VAL 53 N 2.25 2.15 0.00 -1.27 1.01 -0.60 -4.61 120.40 119.33 1xmo s VAL 53 Ca -0.01 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1xmo s VAL 53 Cb -0.12 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.42 1xmo s VAL 53 CO -0.09 0.55 0.00 -0.67 0.00 0.00 0.00 175.10 174.89 1xmo n ASP 54 N 3.70 -3.72 0.00 3.32 2.03 -1.26 -0.98 116.55 119.64 1xmo n ASP 54 Ca -0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.12 1xmo n ASP 54 Cb 0.53 -2.90 0.00 0.00 -0.72 0.00 0.00 41.12 38.03 1xmo n ASP 54 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xmo n GLY 55 N 0.10 0.72 3.32 0.27 0.00 -1.26 -5.10 105.19 103.24 1xmo n GLY 55 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1xmo n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xmo s LYS 56 N -0.53 2.16 -0.13 1.61 3.01 -0.15 -5.07 119.74 120.64 1xmo s LYS 56 Ca 0.00 -0.91 -0.33 0.00 -1.01 0.00 0.00 55.97 53.72 1xmo s LYS 56 Cb 0.00 -2.07 -0.10 0.00 -1.01 0.00 0.00 37.83 34.65 1xmo s LYS 56 CO 0.00 0.55 2.00 -0.35 0.51 0.00 0.00 175.35 178.06 1xmo n PRO 57 N 2.46 2.09 -1.28 -1.68 -0.04 -1.26 -1.56 135.00 133.73 1xmo n PRO 57 Ca -0.16 0.72 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1xmo n PRO 57 Cb 0.51 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1xmo n PRO 57 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xmo n TYR 58 N 8.08 0.00 -3.36 0.54 4.02 -1.06 -1.64 117.16 123.74 1xmo n TYR 58 Ca 0.26 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.95 1xmo n TYR 58 Cb 0.33 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.56 1xmo n TYR 58 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1xmo s LEU 59 N 0.00 0.25 0.27 7.72 1.43 0.61 -2.81 118.68 126.16 1xmo s LEU 59 Ca 0.00 -1.88 -0.28 0.00 -1.03 0.00 0.00 54.13 50.94 1xmo s LEU 59 Cb 0.00 0.31 -0.14 0.00 0.03 0.00 0.00 46.19 46.38 1xmo s LEU 59 CO 0.00 -0.25 0.98 0.54 0.23 0.00 0.00 176.35 177.85 1xmo n ARG 60 N 4.00 1.23 -3.72 1.70 5.12 -0.02 -3.64 116.66 121.33 1xmo n ARG 60 Ca 0.14 0.43 -0.29 0.00 -1.93 0.00 0.00 57.85 56.19 1xmo n ARG 60 Cb 0.44 -1.78 -0.15 0.00 -1.16 0.00 0.00 32.46 29.80 1xmo n ARG 60 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1xmo s VAL 61 N -0.98 0.77 -0.10 1.55 1.01 -0.42 -1.38 120.40 120.85 1xmo s VAL 61 Ca 0.60 -1.22 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 1xmo s VAL 61 Cb -0.73 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1xmo s VAL 61 CO 0.59 -0.59 1.36 -0.31 0.00 0.00 0.00 175.10 176.14 1xmo s TYR 62 N 1.69 2.71 0.51 5.22 2.02 -0.52 -2.69 117.35 126.29 1xmo s TYR 62 Ca 0.08 0.83 -0.05 0.00 -0.37 0.00 0.00 57.07 57.56 1xmo s TYR 62 Cb -0.17 -3.60 -0.02 0.00 -0.40 0.00 0.00 41.96 37.76 1xmo s TYR 62 CO -0.23 -2.21 0.82 -0.51 -1.57 0.00 0.00 175.55 171.84 1xmo s LEU 63 N 3.27 3.52 0.09 -1.29 2.01 -1.05 -0.45 118.68 124.78 1xmo s LEU 63 Ca 0.60 0.85 0.09 0.00 0.01 0.00 0.00 54.13 55.68 1xmo s LEU 63 Cb -0.26 -3.78 -0.03 0.00 0.01 0.00 0.00 46.19 42.13 1xmo s LEU 63 CO 0.20 -0.72 -0.22 -0.54 1.01 0.00 0.00 176.35 176.08 1xmo s LYS 64 N -4.81 1.30 0.08 1.70 1.02 -1.26 -4.28 119.74 113.48 1xmo s LYS 64 Ca 0.49 -1.14 -0.07 0.00 0.02 0.00 0.00 55.97 55.28 1xmo s LYS 64 Cb -0.10 -1.57 -0.01 0.00 -0.52 0.00 0.00 37.83 35.63 1xmo s LYS 64 CO 0.45 0.38 0.13 0.71 -0.92 0.00 0.00 175.35 176.10 1xmo s TYR 65 N -1.02 0.24 0.00 3.18 1.51 -1.26 -3.86 117.35 116.14 1xmo s TYR 65 Ca 0.09 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.46 1xmo s TYR 65 Cb -0.10 -0.14 0.00 0.00 -0.11 0.00 0.00 41.96 41.61 1xmo s TYR 65 CO 0.04 -0.50 0.00 0.41 -1.11 0.00 0.00 175.55 174.39 1xmo n GLY 66 N 0.02 -1.81 3.89 0.71 0.00 0.16 -4.91 105.19 103.25 1xmo n GLY 66 Ca -0.15 -1.48 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 1xmo n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xmo s PRO 67 N -0.65 3.71 -0.06 1.61 0.04 -1.26 -4.58 135.00 133.81 1xmo s PRO 67 Ca 0.00 0.20 -0.37 0.00 0.04 0.00 0.00 61.00 60.86 1xmo s PRO 67 Cb 0.00 -2.57 -0.15 0.00 0.04 0.00 0.00 34.50 31.82 1xmo s PRO 67 CO 0.00 0.15 1.60 -2.13 0.04 0.00 0.00 177.00 176.66 1xmo n ARG 68 N -0.91 1.43 -2.11 4.56 0.63 -1.26 -4.30 116.66 114.70 1xmo n ARG 68 Ca -0.00 0.52 -0.28 0.00 -0.92 0.00 0.00 57.85 57.17 1xmo n ARG 68 Cb 0.54 -2.23 0.13 0.00 0.45 0.00 0.00 32.46 31.35 1xmo n ARG 68 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1xmo s ARG 69 N 2.18 1.42 0.42 -0.14 0.52 0.10 -4.97 118.95 118.48 1xmo s ARG 69 Ca 0.90 -0.41 0.02 0.00 -0.52 0.00 0.00 55.73 55.72 1xmo s ARG 69 Cb -0.92 -2.03 -0.01 0.00 0.52 0.00 0.00 34.95 32.52 1xmo s ARG 69 CO 0.53 -1.83 0.62 -0.65 0.02 0.00 0.00 175.30 174.00 1xmo s GLN 70 N -5.55 3.10 4.54 3.54 -1.52 -1.26 -4.50 119.66 118.01 1xmo s GLN 70 Ca 0.67 -0.59 0.00 0.00 -1.95 0.00 0.00 55.36 53.50 1xmo s GLN 70 Cb -0.07 -2.62 0.00 0.00 -0.22 0.00 0.00 33.01 30.10 1xmo s GLN 70 CO 0.49 -0.17 0.00 0.41 -0.25 0.00 0.00 175.29 175.76 1xmo n GLY 71 N -1.97 1.57 3.72 3.09 0.00 -1.26 -4.59 105.19 105.76 1xmo n GLY 71 Ca 0.01 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 1xmo n GLY 71 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xmo s PRO 72 N 0.00 4.21 -0.35 1.61 0.04 -1.26 -3.89 135.00 135.36 1xmo s PRO 72 Ca 0.00 2.38 -0.13 0.00 0.04 0.00 0.00 61.00 63.30 1xmo s PRO 72 Cb 0.00 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.42 1xmo s PRO 72 CO 0.00 -0.58 0.36 -3.47 0.04 0.00 0.00 177.00 173.35 1xmo n ASP 73 N 3.56 -7.54 -0.01 6.66 4.64 -1.26 -4.89 116.55 117.71 1xmo n ASP 73 Ca 0.12 0.73 0.14 0.00 -1.38 0.00 0.00 54.79 54.40 1xmo n ASP 73 Cb 0.38 -4.54 0.62 0.00 -1.04 0.00 0.00 41.12 36.54 1xmo n ASP 73 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1xmo n PRO 74 N 0.19 0.17 -0.96 -0.67 -0.04 -1.25 -4.82 135.00 127.62 1xmo n PRO 74 Ca 0.04 -0.02 -0.37 0.00 -0.04 0.00 0.00 63.50 63.11 1xmo n PRO 74 Cb 0.35 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.26 1xmo n PRO 74 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1xmo n ARG 75 N -1.40 0.00 -0.64 0.54 1.74 -1.26 0.02 116.66 115.67 1xmo n ARG 75 Ca 0.09 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.86 1xmo n ARG 75 Cb 0.31 -0.94 0.18 0.00 -1.02 0.00 0.00 32.46 30.98 1xmo n ARG 75 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1xmo n PRO 76 N 0.94 -1.79 -3.76 5.56 -0.02 -1.26 -4.35 135.00 130.32 1xmo n PRO 76 Ca 0.13 -0.51 -0.33 0.00 -2.02 0.00 0.00 63.50 60.77 1xmo n PRO 76 Cb 0.06 -1.70 -0.05 0.00 -0.02 0.00 0.00 33.50 31.79 1xmo n PRO 76 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1xmo s GLU 77 N -3.50 3.57 0.37 -0.52 2.12 -1.26 -4.88 118.70 114.59 1xmo s GLU 77 Ca 0.55 -0.14 -0.24 0.00 0.36 0.00 0.00 54.97 55.50 1xmo s GLU 77 Cb -0.12 -3.00 -0.10 0.00 0.26 0.00 0.00 34.13 31.17 1xmo s GLU 77 CO 0.64 0.59 0.97 -0.65 -0.54 0.00 0.00 175.26 176.26 1xmo s GLN 78 N -2.16 4.40 0.07 4.30 -1.52 -1.26 0.36 119.66 123.86 1xmo s GLN 78 Ca 0.33 1.32 0.12 0.00 -1.95 0.00 0.00 55.36 55.18 1xmo s GLN 78 Cb -0.13 -2.59 -0.17 0.00 -0.22 0.00 0.00 33.01 29.91 1xmo s GLN 78 CO 0.21 0.11 0.99 0.28 -0.25 0.00 0.00 175.29 176.62 1xmo h VAL 79 N 2.34 1.05 -3.32 1.09 2.07 -1.91 -3.38 116.25 114.19 1xmo h VAL 79 Ca -0.48 -2.73 -0.78 0.00 0.82 0.00 0.00 66.70 63.54 1xmo h VAL 79 Cb 1.19 2.48 -0.30 0.00 -1.52 0.00 0.00 31.29 33.14 1xmo h VAL 79 CO 0.63 0.60 0.39 -0.38 0.02 0.00 0.00 177.57 178.84 1xmo n ILE 80 N -3.13 4.38 0.00 4.57 5.41 -1.26 -4.90 119.36 124.42 1xmo n ILE 80 Ca -0.08 -5.46 0.00 0.00 1.00 0.00 0.00 62.75 58.22 1xmo n ILE 80 Cb 0.93 -2.42 0.00 0.00 -0.71 0.00 0.00 39.64 37.45 1xmo n ILE 80 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1xmo n HIS 81 N 2.22 0.00 -1.92 1.39 8.25 0.29 -4.83 115.22 120.63 1xmo n HIS 81 Ca 0.24 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.47 1xmo n HIS 81 Cb 0.37 -0.26 0.15 0.00 1.12 0.00 0.00 29.99 31.38 1xmo n HIS 81 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1xmo n HIS 82 N -1.28 -3.79 0.00 4.41 -0.00 -0.04 -4.94 115.22 109.58 1xmo n HIS 82 Ca 0.00 -1.06 0.00 0.00 -0.00 0.00 0.00 57.72 56.66 1xmo n HIS 82 Cb 0.00 -0.79 0.00 0.00 -0.00 0.00 0.00 29.99 29.20 1xmo n HIS 82 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.34 177.85 1xmo n ILE 83 N -3.31 0.00 -4.18 3.57 3.06 -1.26 -3.37 119.36 113.87 1xmo n ILE 83 Ca 0.14 0.00 -0.14 0.00 -2.50 0.00 0.00 62.75 60.25 1xmo n ILE 83 Cb 0.47 0.00 -0.11 0.00 0.54 0.00 0.00 39.64 40.55 1xmo n ILE 83 CO 0.00 0.00 0.00 -0.60 -2.50 0.00 0.00 176.55 173.45 1xmo s ARG 84 N 0.00 0.86 0.08 9.51 3.52 -1.05 -4.96 118.95 126.92 1xmo s ARG 84 Ca 0.00 -1.21 -0.21 0.00 -0.13 0.00 0.00 55.73 54.18 1xmo s ARG 84 Cb 0.00 -0.49 -0.07 0.00 -1.56 0.00 0.00 34.95 32.84 1xmo s ARG 84 CO 0.00 0.06 0.62 1.03 -0.81 0.00 0.00 175.30 176.20 1xmo s ARG 85 N -3.04 4.29 -0.02 5.12 0.52 -1.26 -2.60 118.95 121.97 1xmo s ARG 85 Ca 0.07 0.82 -0.02 0.00 -0.52 0.00 0.00 55.73 56.09 1xmo s ARG 85 Cb -0.01 -3.26 -0.01 0.00 0.52 0.00 0.00 34.95 32.19 1xmo s ARG 85 CO -0.01 0.57 -0.04 -0.89 0.02 0.00 0.00 175.30 174.96 1xmo n ILE 86 N 1.89 0.17 -1.79 1.52 2.08 -1.19 -4.94 119.36 117.10 1xmo n ILE 86 Ca -0.09 0.42 -0.33 0.00 0.56 0.00 0.00 62.75 63.31 1xmo n ILE 86 Cb 0.50 -1.54 0.04 0.00 -0.75 0.00 0.00 39.64 37.89 1xmo n ILE 86 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 1xmo s SER 87 N -4.31 5.18 -0.19 4.38 0.15 -0.86 -4.79 113.70 113.26 1xmo s SER 87 Ca -0.03 1.99 -0.28 0.00 0.70 0.00 0.00 55.95 58.33 1xmo s SER 87 Cb 0.00 -2.55 0.10 0.00 -1.71 0.00 0.00 66.02 61.86 1xmo s SER 87 CO 0.04 -1.58 0.87 -1.59 1.20 0.00 0.00 173.24 172.18 1xmo s LYS 88 N -4.07 0.74 0.47 5.44 -2.85 -0.64 -4.93 119.74 113.89 1xmo s LYS 88 Ca 0.67 0.49 -0.21 0.00 -1.00 0.00 0.00 55.97 55.92 1xmo s LYS 88 Cb -0.20 0.35 -0.10 0.00 -2.06 0.00 0.00 37.83 35.82 1xmo s LYS 88 CO 0.41 -0.17 0.67 -0.35 0.10 0.00 0.00 175.35 176.01 1xmo n PRO 89 N 1.63 0.74 -3.38 1.78 -0.04 -1.26 -1.48 135.00 132.99 1xmo n PRO 89 Ca -0.14 0.27 -0.19 0.00 -0.04 0.00 0.00 63.50 63.41 1xmo n PRO 89 Cb 0.56 -1.72 0.06 0.00 -0.04 0.00 0.00 33.50 32.37 1xmo n PRO 89 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1xmo n GLY 90 N 1.62 -1.02 0.00 0.55 0.00 -1.26 -4.79 105.19 100.29 1xmo n GLY 90 Ca 0.11 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.63 1xmo n GLY 90 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xmo n ARG 91 N -3.55 0.00 -1.59 1.61 0.00 -0.55 -5.16 116.66 107.42 1xmo n ARG 91 Ca -0.10 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.44 1xmo n ARG 91 Cb 0.62 0.00 0.07 0.00 0.00 0.00 0.00 32.46 33.15 1xmo n ARG 91 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1xmo s ARG 92 N 0.00 2.49 -0.30 -0.14 1.81 -1.12 -1.63 118.95 120.06 1xmo s ARG 92 Ca 0.00 0.75 -0.03 0.00 -1.72 0.00 0.00 55.73 54.73 1xmo s ARG 92 Cb 0.00 -1.96 0.11 0.00 -0.45 0.00 0.00 34.95 32.65 1xmo s ARG 92 CO 0.00 -1.36 0.16 0.08 -0.68 0.00 0.00 175.30 173.50 1xmo s VAL 93 N -3.13 -0.06 -0.05 3.52 1.01 -1.26 -4.83 120.40 115.60 1xmo s VAL 93 Ca 0.59 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.64 1xmo s VAL 93 Cb -0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1xmo s VAL 93 CO 0.54 -0.75 0.16 -0.31 0.00 0.00 0.00 175.10 174.74 1xmo s TYR 94 N 1.94 3.55 0.04 5.22 1.51 -1.26 -0.13 117.35 128.21 1xmo s TYR 94 Ca 0.11 0.41 0.02 0.00 -1.01 0.00 0.00 57.07 56.59 1xmo s TYR 94 Cb -0.17 -1.86 -0.02 0.00 -0.11 0.00 0.00 41.96 39.80 1xmo s TYR 94 CO -0.30 0.67 -0.07 0.14 -1.11 0.00 0.00 175.55 174.88 1xmo s VAL 95 N -1.22 0.48 0.38 0.71 -7.23 0.15 -4.91 120.40 108.76 1xmo s VAL 95 Ca 0.23 -0.98 -0.06 0.00 -1.81 0.00 0.00 61.98 59.36 1xmo s VAL 95 Cb -0.12 -0.54 -0.05 0.00 0.56 0.00 0.00 36.38 36.22 1xmo s VAL 95 CO 0.14 -0.35 0.68 -0.83 -0.31 0.00 0.00 175.10 174.42 1xmo s GLY 96 N -1.43 1.73 0.36 2.32 0.00 -1.26 -0.24 107.32 108.80 1xmo s GLY 96 Ca -0.09 -0.48 0.18 0.00 0.00 0.00 0.00 44.72 44.32 1xmo s GLY 96 CO 0.00 -0.34 1.67 -0.24 0.00 0.00 0.00 173.10 174.19 1xmo h VAL 97 N 0.92 0.29 0.00 1.40 3.04 -1.91 1.93 116.25 121.93 1xmo h VAL 97 Ca -0.48 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.11 1xmo h VAL 97 Cb 1.20 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.45 1xmo h VAL 97 CO 0.64 0.05 0.00 2.29 -1.01 0.00 0.00 177.57 179.54 1xmo n LYS 98 N -4.94 0.54 0.00 4.17 2.85 -1.26 -3.05 118.16 116.47 1xmo n LYS 98 Ca 0.32 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.61 1xmo n LYS 98 Cb 1.05 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.93 1xmo n LYS 98 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1xmo n GLU 99 N -1.07 1.41 -2.31 -1.58 1.02 0.65 -5.00 120.64 113.75 1xmo n GLU 99 Ca 0.14 -0.98 -0.42 0.00 -0.02 0.00 0.00 57.16 55.88 1xmo n GLU 99 Cb 0.09 -0.83 -0.03 0.00 -0.02 0.00 0.00 31.44 30.66 1xmo n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1xmo s ILE 100 N -0.51 3.73 0.52 -3.67 1.01 -0.96 -4.76 121.20 116.55 1xmo s ILE 100 Ca 0.00 0.64 -0.20 0.00 0.00 0.00 0.00 60.65 61.09 1xmo s ILE 100 Cb 0.00 -4.28 -0.09 0.00 0.01 0.00 0.00 42.46 38.10 1xmo s ILE 100 CO 0.00 -1.02 0.72 -0.81 0.00 0.00 0.00 174.94 173.83 1xmo n PRO 101 N 8.62 0.76 -3.13 2.79 -0.04 -1.26 -4.97 135.00 137.77 1xmo n PRO 101 Ca 0.15 0.29 -0.45 0.00 -0.04 0.00 0.00 63.50 63.44 1xmo n PRO 101 Cb 0.49 -1.84 -0.04 0.00 -0.04 0.00 0.00 33.50 32.08 1xmo n PRO 101 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1xmo s ARG 102 N -2.14 3.27 -0.01 0.54 1.70 -1.26 -4.93 118.95 116.12 1xmo s ARG 102 Ca 0.68 -1.67 -0.30 0.00 -0.47 0.00 0.00 55.73 53.97 1xmo s ARG 102 Cb -0.48 -4.43 -0.08 0.00 -0.57 0.00 0.00 34.95 29.38 1xmo s ARG 102 CO 0.54 -1.53 2.02 0.28 -1.08 0.00 0.00 175.30 175.53 1xmo n VAL 103 N 5.18 0.69 -3.93 4.99 0.31 -1.26 -3.31 118.33 121.00 1xmo n VAL 103 Ca 0.02 -0.20 -0.27 0.00 -0.01 0.00 0.00 64.34 63.89 1xmo n VAL 103 Cb 0.45 -2.36 -0.00 0.00 -0.91 0.00 0.00 33.84 31.01 1xmo n VAL 103 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1xmo n ARG 104 N 7.75 -3.94 -4.19 5.55 5.12 -1.26 0.23 116.66 125.92 1xmo n ARG 104 Ca 0.22 0.47 -0.35 0.00 -1.93 0.00 0.00 57.85 56.26 1xmo n ARG 104 Cb 0.41 -4.88 -0.02 0.00 -1.16 0.00 0.00 32.46 26.81 1xmo n ARG 104 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1xmo n ARG 105 N -4.41 -3.29 -0.32 5.56 3.00 -1.21 -1.01 116.66 114.98 1xmo n ARG 105 Ca -0.21 0.38 0.00 0.00 -0.01 0.00 0.00 57.85 58.02 1xmo n ARG 105 Cb 0.64 -5.08 0.00 0.00 0.00 0.00 0.00 32.46 28.01 1xmo n ARG 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1xmo n GLY 106 N -1.45 1.88 0.01 -0.13 0.00 0.14 -4.87 105.19 100.76 1xmo n GLY 106 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 1xmo n GLY 106 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xmo n LEU 107 N 0.00 0.07 -4.51 0.99 4.77 -0.18 -4.85 117.00 113.29 1xmo n LEU 107 Ca 0.00 0.36 -0.24 0.00 -0.03 0.00 0.00 56.01 56.10 1xmo n LEU 107 Cb 0.00 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 40.61 1xmo n LEU 107 CO 0.00 0.01 -0.23 -0.83 -1.33 0.00 0.00 177.39 175.01 1xmo s GLY 108 N -2.82 2.41 0.48 -0.72 0.00 -1.08 -4.98 107.32 100.60 1xmo s GLY 108 Ca 0.20 -1.53 0.02 0.00 0.00 0.00 0.00 44.72 43.41 1xmo s GLY 108 CO 0.51 -1.86 0.06 -0.26 0.00 0.00 0.00 173.10 171.56 1xmo s ILE 109 N -3.22 0.87 -0.44 0.90 -4.36 -0.61 -4.50 121.20 109.83 1xmo s ILE 109 Ca 0.28 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.72 1xmo s ILE 109 Cb 0.05 -2.19 0.17 0.00 1.25 0.00 0.00 42.46 41.75 1xmo s ILE 109 CO 0.14 0.00 0.45 0.00 0.24 0.00 0.00 174.94 175.77 1xmo s ALA 110 N -3.01 0.17 0.44 2.27 0.00 -1.26 -0.97 121.76 119.40 1xmo s ALA 110 Ca 0.11 -1.69 -0.21 0.00 0.00 0.00 0.00 51.96 50.17 1xmo s ALA 110 Cb 0.01 -1.97 -0.13 0.00 0.00 0.00 0.00 23.12 21.04 1xmo s ALA 110 CO 0.07 -2.07 0.38 -0.89 0.00 0.00 0.00 175.76 173.25 1xmo n ILE 111 N 3.05 1.43 -3.40 0.00 5.41 -0.91 -3.05 119.36 121.89 1xmo n ILE 111 Ca 0.24 -0.50 0.01 0.00 1.00 0.00 0.00 62.75 63.50 1xmo n ILE 111 Cb 0.50 -0.39 -0.04 0.00 -0.71 0.00 0.00 39.64 39.00 1xmo n ILE 111 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 1xmo s LEU 112 N 2.50 -0.54 0.40 1.39 2.34 -0.85 -2.67 118.68 121.25 1xmo s LEU 112 Ca 0.63 0.75 -0.27 0.00 0.06 0.00 0.00 54.13 55.29 1xmo s LEU 112 Cb -0.58 1.62 -0.10 0.00 -0.56 0.00 0.00 46.19 46.58 1xmo s LEU 112 CO 0.59 -0.10 1.42 -0.55 -1.06 0.00 0.00 176.35 176.65 1xmo s SER 113 N 2.35 6.23 0.20 1.48 0.15 -0.96 -2.85 113.70 120.29 1xmo s SER 113 Ca -0.03 2.91 -0.05 0.00 0.70 0.00 0.00 55.95 59.48 1xmo s SER 113 Cb -0.06 -2.66 -0.03 0.00 -1.71 0.00 0.00 66.02 61.57 1xmo s SER 113 CO -0.17 -0.94 0.24 0.42 1.20 0.00 0.00 173.24 173.99 1xmo s THR 114 N -1.17 0.02 0.41 6.45 -4.23 0.32 -2.04 115.64 115.40 1xmo s THR 114 Ca 0.56 -1.75 0.28 0.00 -1.18 0.00 0.00 61.69 59.60 1xmo s THR 114 Cb -0.44 -2.29 0.30 0.00 1.34 0.00 0.00 72.50 71.42 1xmo s THR 114 CO 0.58 -0.09 2.08 0.77 -0.54 0.00 0.00 174.62 177.42 1xmo h SER 115 N 2.54 0.00 0.16 3.99 4.64 -1.97 -2.48 113.55 120.43 1xmo h SER 115 Ca -0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.99 1xmo h SER 115 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1xmo h SER 115 CO 0.48 0.11 -0.07 0.11 -0.87 0.00 0.00 176.83 176.59 1xmo h LYS 116 N 0.00 -0.20 0.00 4.77 1.57 -1.95 -3.50 116.57 117.26 1xmo h LYS 116 Ca -0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1xmo h LYS 116 Cb 0.32 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1xmo h LYS 116 CO 0.01 0.24 0.00 0.41 -0.57 0.00 0.00 179.45 179.54 1xmo n GLY 117 N 0.57 -1.22 3.67 3.86 0.00 -0.93 -5.11 105.19 106.02 1xmo n GLY 117 Ca -0.08 -0.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.72 1xmo n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xmo s VAL 118 N -3.00 5.17 0.13 1.61 1.01 -1.26 -0.52 120.40 123.53 1xmo s VAL 118 Ca 0.00 0.79 -0.17 0.00 0.00 0.00 0.00 61.98 62.61 1xmo s VAL 118 Cb 0.00 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.65 1xmo s VAL 118 CO 0.00 0.23 0.42 -1.48 0.00 0.00 0.00 175.10 174.27 1xmo s LEU 119 N 1.39 0.31 0.70 3.92 2.34 -1.13 -4.95 118.68 121.26 1xmo s LEU 119 Ca 0.21 -0.29 -0.13 0.00 0.06 0.00 0.00 54.13 53.97 1xmo s LEU 119 Cb -0.15 1.91 0.02 0.00 -0.56 0.00 0.00 46.19 47.41 1xmo s LEU 119 CO 0.09 -0.87 1.11 0.42 -1.06 0.00 0.00 176.35 176.03 1xmo s THR 120 N -3.80 3.24 0.21 5.48 -4.23 -1.26 -2.02 115.64 113.26 1xmo s THR 120 Ca 0.03 0.51 -0.18 0.00 -1.18 0.00 0.00 61.69 60.87 1xmo s THR 120 Cb 0.02 -3.01 0.20 0.00 1.34 0.00 0.00 72.50 71.04 1xmo s THR 120 CO -0.12 -0.42 1.58 -2.24 -0.54 0.00 0.00 174.62 172.88 1xmo h ASP 121 N -0.42 -1.14 0.00 3.99 2.03 -1.88 0.21 116.42 119.21 1xmo h ASP 121 Ca -0.46 0.25 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 1xmo h ASP 121 Cb 1.24 0.60 0.00 0.00 -0.83 0.00 0.00 39.33 40.34 1xmo h ASP 121 CO 0.53 -0.29 0.00 0.54 -1.03 0.00 0.00 179.24 178.99 1xmo n ARG 122 N -5.46 0.00 -0.21 4.15 5.12 -1.26 -0.03 116.66 118.97 1xmo n ARG 122 Ca 0.07 0.45 0.02 0.00 -1.93 0.00 0.00 57.85 56.46 1xmo n ARG 122 Cb 0.38 -1.18 0.05 0.00 -1.16 0.00 0.00 32.46 30.55 1xmo n ARG 122 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1xmo n GLU 123 N -1.41 -0.09 0.20 5.56 1.02 -0.64 0.74 120.64 126.02 1xmo n GLU 123 Ca 0.00 0.87 -0.15 0.00 -0.02 0.00 0.00 57.16 57.86 1xmo n GLU 123 Cb 0.00 -1.29 -0.08 0.00 -0.02 0.00 0.00 31.44 30.05 1xmo n GLU 123 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xmo h ALA 124 N 0.96 -0.46 -0.39 0.62 0.00 -0.06 -1.72 119.26 118.21 1xmo h ALA 124 Ca 0.24 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.10 1xmo h ALA 124 Cb 0.37 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.26 1xmo h ALA 124 CO -0.57 -0.72 -0.21 -0.09 0.00 0.00 0.00 179.25 177.66 1xmo h ARG 125 N -0.54 -0.14 -0.41 0.00 2.43 0.41 0.28 114.38 116.40 1xmo h ARG 125 Ca -0.05 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.22 1xmo h ARG 125 Cb 0.40 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.90 1xmo h ARG 125 CO 0.08 -0.09 -0.19 -0.22 -1.51 0.00 0.00 179.97 178.03 1xmo h LYS 126 N -0.15 -0.11 0.00 0.20 3.64 -0.69 1.06 116.57 120.52 1xmo h LYS 126 Ca 0.19 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1xmo h LYS 126 Cb 0.44 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1xmo h LYS 126 CO -0.48 -0.07 0.00 1.28 -2.27 0.00 0.00 179.45 177.91 1xmo n LEU 127 N -5.37 0.00 -3.54 5.20 4.77 -0.54 -4.92 117.00 112.60 1xmo n LEU 127 Ca 0.02 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.78 1xmo n LEU 127 Cb 0.28 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.40 1xmo n LEU 127 CO 0.11 0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 176.78 1xmo n GLY 128 N 0.69 -1.12 3.13 -0.72 0.00 0.37 -5.01 105.19 102.53 1xmo n GLY 128 Ca 0.14 0.50 -0.10 0.00 0.00 0.00 0.00 46.02 46.56 1xmo n GLY 128 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xmo s VAL 129 N -3.27 0.12 0.00 1.61 -7.23 -0.92 -4.91 120.40 105.80 1xmo s VAL 129 Ca 0.29 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 1xmo s VAL 129 Cb -0.10 -0.84 0.00 0.00 0.56 0.00 0.00 36.38 36.00 1xmo s VAL 129 CO 0.84 -0.55 0.00 0.61 -0.31 0.00 0.00 175.10 175.69 1xmo n GLY 130 N 0.83 4.93 0.00 2.32 0.00 -1.26 -4.22 105.19 107.79 1xmo n GLY 130 Ca -0.19 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.68 1xmo n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xmo n GLY 131 N 5.00 -0.80 3.63 -0.02 0.00 0.66 -4.51 105.19 109.16 1xmo n GLY 131 Ca 0.00 -1.18 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 1xmo n GLY 131 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xmo s GLU 132 N -2.00 3.88 -0.45 1.61 2.12 -0.87 -0.67 118.70 122.33 1xmo s GLU 132 Ca 0.00 1.65 -0.28 0.00 0.36 0.00 0.00 54.97 56.70 1xmo s GLU 132 Cb 0.00 -3.99 -0.01 0.00 0.26 0.00 0.00 34.13 30.39 1xmo s GLU 132 CO 0.00 -1.18 1.75 -1.17 -0.54 0.00 0.00 175.26 174.11 1xmo s LEU 133 N 4.85 3.44 0.08 2.70 0.20 0.81 -2.27 118.68 128.48 1xmo s LEU 133 Ca 0.68 0.86 -0.16 0.00 0.69 0.00 0.00 54.13 56.21 1xmo s LEU 133 Cb -0.24 -3.17 -0.13 0.00 -0.43 0.00 0.00 46.19 42.22 1xmo s LEU 133 CO 0.27 -1.89 1.34 0.40 -0.29 0.00 0.00 176.35 176.17 1xmo h ILE 134 N 6.77 1.32 0.00 6.68 5.03 -1.84 -2.28 117.51 133.18 1xmo h ILE 134 Ca -0.30 -1.65 0.00 0.00 -0.12 0.00 0.00 64.86 62.79 1xmo h ILE 134 Cb 1.15 1.86 0.00 0.00 -3.03 0.00 0.00 36.82 36.80 1xmo h ILE 134 CO 1.11 0.52 0.00 0.00 -0.68 0.00 0.00 178.15 179.09 1xmo s GLU 136 N -1.61 3.20 -0.08 0.00 -1.05 -1.07 -2.13 118.70 115.96 1xmo s GLU 136 Ca 0.00 -0.25 -0.30 0.00 -0.15 0.00 0.00 54.97 54.27 1xmo s GLU 136 Cb 0.00 -2.49 0.07 0.00 -0.44 0.00 0.00 34.13 31.27 1xmo s GLU 136 CO 0.00 -0.26 0.69 0.08 0.95 0.00 0.00 175.26 176.72 1xmo s VAL 137 N -2.63 0.00 0.00 1.83 1.01 -0.15 -2.52 120.40 117.95 1xmo s VAL 137 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.46 1xmo s VAL 137 Cb -0.10 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.28 1xmo s VAL 137 CO 0.40 0.00 0.00 -2.67 0.00 0.00 0.00 175.10 172.83