#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c3n s LEU 3 N 0.00 4.37 -0.05 0.99 2.96 -1.26 -4.39 118.68 121.30 2c3n s LEU 3 Ca 0.00 2.61 0.06 0.00 -0.22 0.00 0.00 54.13 56.58 2c3n s LEU 3 Cb 0.00 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.09 2c3n s LEU 3 CO 0.00 -0.84 -0.24 -1.61 -1.32 0.00 0.00 176.35 172.34 2c3n s GLU 4 N 1.40 2.34 -0.18 1.98 2.02 0.71 -0.98 118.70 125.98 2c3n s GLU 4 Ca 0.71 -0.86 -0.01 0.00 0.02 0.00 0.00 54.97 54.83 2c3n s GLU 4 Cb -0.43 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 31.77 2c3n s GLU 4 CO 0.31 0.39 -0.12 -0.51 0.02 0.00 0.00 175.26 175.35 2c3n s LEU 5 N -0.21 2.54 -0.42 1.80 1.43 -0.57 -1.25 118.68 122.00 2c3n s LEU 5 Ca -0.01 -0.48 -0.17 0.00 -1.03 0.00 0.00 54.13 52.43 2c3n s LEU 5 Cb -0.13 -1.61 0.02 0.00 0.03 0.00 0.00 46.19 44.51 2c3n s LEU 5 CO 0.03 0.03 0.44 -0.31 0.23 0.00 0.00 176.35 176.76 2c3n s TYR 6 N 1.17 3.17 0.03 0.29 1.51 0.23 -0.47 117.35 123.26 2c3n s TYR 6 Ca 0.01 -0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 55.72 2c3n s TYR 6 Cb -0.14 -2.90 -0.02 0.00 -0.11 0.00 0.00 41.96 38.79 2c3n s TYR 6 CO -0.05 -0.69 0.01 -0.51 -1.11 0.00 0.00 175.55 173.21 2c3n s LEU 7 N 2.16 2.12 -0.08 -1.29 1.43 -0.59 -1.83 118.68 120.59 2c3n s LEU 7 Ca 0.12 -0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 52.66 2c3n s LEU 7 Cb -0.17 0.29 0.03 0.00 0.03 0.00 0.00 46.19 46.36 2c3n s LEU 7 CO 0.14 -0.40 -0.03 -0.62 0.23 0.00 0.00 176.35 175.66 2c3n s ASP 8 N -1.85 1.63 0.00 2.29 -1.08 -1.26 -1.45 116.67 114.95 2c3n s ASP 8 Ca -0.10 -0.15 0.13 0.00 -0.52 0.00 0.00 52.55 51.91 2c3n s ASP 8 Cb -0.05 -0.55 0.54 0.00 -1.46 0.00 0.00 42.92 41.40 2c3n s ASP 8 CO -0.03 -0.15 1.40 0.18 0.52 0.00 0.00 175.17 177.10 2c3n n LEU 9 N 4.88 0.00 -0.07 -1.34 4.77 -1.26 -1.21 117.00 122.77 2c3n n LEU 9 Ca -0.12 0.50 0.07 0.00 -0.03 0.00 0.00 56.01 56.43 2c3n n LEU 9 Cb 0.50 -0.50 0.43 0.00 -2.33 0.00 0.00 43.42 41.52 2c3n n LEU 9 CO 0.14 -0.28 1.18 0.25 -1.33 0.00 0.00 177.39 177.36 2c3n h LEU 10 N 0.00 0.49 -9.49 2.23 5.85 -1.92 -3.39 115.31 109.08 2c3n h LEU 10 Ca 0.00 -0.00 -0.54 0.00 0.84 0.00 0.00 57.88 58.18 2c3n h LEU 10 Cb 0.22 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 2c3n h LEU 10 CO 0.00 0.33 0.24 -0.55 -0.34 0.00 0.00 178.44 178.12 2c3n s SER 11 N -6.44 7.28 0.10 1.25 0.15 -0.35 -4.79 113.70 110.90 2c3n s SER 11 Ca -0.08 1.54 -0.34 0.00 0.70 0.00 0.00 55.95 57.76 2c3n s SER 11 Cb 0.19 -2.51 -0.15 0.00 -1.71 0.00 0.00 66.02 61.84 2c3n s SER 11 CO 0.75 -0.08 1.55 1.56 1.20 0.00 0.00 173.24 178.21 2c3n h GLN 12 N 6.03 -0.74 -0.21 5.44 4.20 -1.87 -2.03 115.11 125.94 2c3n h GLN 12 Ca -0.43 0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.31 2c3n h GLN 12 Cb 1.21 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 2c3n h GLN 12 CO 0.73 -0.49 0.02 -1.00 -0.67 0.00 0.00 178.83 177.42 2c3n h PRO 13 N -0.77 0.30 -0.77 1.46 0.13 -1.93 -2.27 132.00 128.16 2c3n h PRO 13 Ca -0.01 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 2c3n h PRO 13 Cb 0.76 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.80 2c3n h PRO 13 CO -0.27 0.31 0.26 0.00 -0.23 0.00 0.00 178.00 178.07 2c3n h ARG 15 N 1.14 0.87 -0.49 0.00 3.08 -0.80 0.11 114.38 118.29 2c3n h ARG 15 Ca 0.25 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 2c3n h ARG 15 Cb 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2c3n h ARG 15 CO -0.01 0.80 0.20 0.00 -1.07 0.00 0.00 179.97 179.89 2c3n h ALA 16 N 1.28 0.63 -0.16 0.04 0.00 -1.11 -0.87 119.26 119.08 2c3n h ALA 16 Ca 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2c3n h ALA 16 Cb 0.36 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2c3n h ALA 16 CO 0.01 0.24 -0.02 0.28 0.00 0.00 0.00 179.25 179.75 2c3n h VAL 17 N 0.64 1.27 -0.10 0.00 2.07 -1.16 -1.67 116.25 117.31 2c3n h VAL 17 Ca 0.16 -0.93 0.04 0.00 0.82 0.00 0.00 66.70 66.80 2c3n h VAL 17 Cb 0.19 1.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 2c3n h VAL 17 CO -0.01 0.27 -0.26 0.22 0.02 0.00 0.00 177.57 177.81 2c3n h TYR 18 N 0.01 -0.69 -0.21 1.57 3.20 -0.86 -0.53 116.97 119.47 2c3n h TYR 18 Ca 0.04 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.98 2c3n h TYR 18 Cb 0.43 0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 2c3n h TYR 18 CO 0.04 -0.34 0.00 0.82 -1.64 0.00 0.00 178.16 177.05 2c3n h ILE 19 N -0.34 0.86 -0.47 1.81 2.04 -1.16 -0.87 117.51 119.38 2c3n h ILE 19 Ca 0.09 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.98 2c3n h ILE 19 Cb 0.47 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 2c3n h ILE 19 CO -0.29 0.01 0.19 0.15 0.00 0.00 0.00 178.15 178.21 2c3n h PHE 20 N 0.07 0.34 -0.29 1.37 3.57 -0.99 0.11 116.94 121.12 2c3n h PHE 20 Ca 0.10 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2c3n h PHE 20 Cb 0.12 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 2c3n h PHE 20 CO -0.18 0.14 -0.11 0.00 -2.23 0.00 0.00 178.31 175.93 2c3n h ALA 21 N 1.29 0.40 -0.46 2.41 0.00 -0.89 -2.44 119.26 119.57 2c3n h ALA 21 Ca 0.22 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2c3n h ALA 21 Cb 0.19 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2c3n h ALA 21 CO -0.20 0.26 0.02 0.87 0.00 0.00 0.00 179.25 180.21 2c3n h LYS 22 N 0.34 0.80 -0.80 0.00 1.79 -0.94 -1.19 116.57 116.57 2c3n h LYS 22 Ca 0.07 -0.24 -0.01 0.00 -2.18 0.00 0.00 60.65 58.29 2c3n h LYS 22 Cb 0.61 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 31.15 2c3n h LYS 22 CO 0.04 0.84 0.47 -0.22 -1.08 0.00 0.00 179.45 179.50 2c3n h LYS 23 N 0.65 1.10 -0.17 3.15 1.63 -0.75 -2.18 116.57 120.00 2c3n h LYS 23 Ca 0.13 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 2c3n h LYS 23 Cb 0.47 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 2c3n h LYS 23 CO 0.02 0.78 0.00 0.09 -3.45 0.00 0.00 179.45 176.89 2c3n n ASN 24 N -4.37 1.49 -3.80 4.20 3.02 -0.92 -4.93 115.26 109.95 2c3n n ASN 24 Ca 0.08 -1.72 -0.26 0.00 -0.03 0.00 0.00 54.58 52.66 2c3n n ASN 24 Cb 0.08 -0.11 0.03 0.00 -0.61 0.00 0.00 39.78 39.17 2c3n n ASN 24 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2c3n n ASP 25 N 0.22 -3.53 -4.64 6.41 8.00 -0.82 -4.94 116.55 117.25 2c3n n ASP 25 Ca 0.15 -0.77 -0.41 0.00 0.71 0.00 0.00 54.79 54.46 2c3n n ASP 25 Cb 0.29 -4.07 -0.05 0.00 -0.02 0.00 0.00 41.12 37.28 2c3n n ASP 25 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2c3n s ILE 26 N -3.44 4.88 0.13 0.53 1.01 -0.51 -5.02 121.20 118.78 2c3n s ILE 26 Ca 0.40 1.45 -0.31 0.00 0.00 0.00 0.00 60.65 62.19 2c3n s ILE 26 Cb -0.20 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.12 2c3n s ILE 26 CO 0.81 -0.04 1.53 -2.84 0.00 0.00 0.00 174.94 174.40 2c3n s PRO 27 N 2.74 4.24 0.08 2.79 0.02 -1.26 -4.76 135.00 138.85 2c3n s PRO 27 Ca 0.33 2.27 -0.16 0.00 0.02 0.00 0.00 61.00 63.46 2c3n s PRO 27 Cb -0.15 -3.28 0.03 0.00 0.02 0.00 0.00 34.50 31.11 2c3n s PRO 27 CO 0.08 -0.59 0.37 -0.59 -0.33 0.00 0.00 177.00 175.93 2c3n s PHE 28 N 1.48 -0.17 -0.21 6.54 -0.12 -1.26 -4.64 117.98 119.60 2c3n s PHE 28 Ca 0.69 -0.04 -0.17 0.00 -0.05 0.00 0.00 56.93 57.36 2c3n s PHE 28 Cb -0.41 0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.14 2c3n s PHE 28 CO 0.31 -0.61 0.46 -1.83 -0.05 0.00 0.00 175.22 173.50 2c3n s GLU 29 N -3.19 4.16 -0.17 1.99 -1.05 -0.16 -4.96 118.70 115.31 2c3n s GLU 29 Ca -0.01 0.30 -0.28 0.00 -0.15 0.00 0.00 54.97 54.83 2c3n s GLU 29 Cb 0.01 -3.57 -0.00 0.00 -0.44 0.00 0.00 34.13 30.13 2c3n s GLU 29 CO -0.08 -0.14 0.96 -1.17 0.95 0.00 0.00 175.26 175.79 2c3n s LEU 30 N 1.63 4.17 -0.39 1.83 2.96 -1.26 -1.51 118.68 126.10 2c3n s LEU 30 Ca 0.21 1.36 -0.02 0.00 -0.22 0.00 0.00 54.13 55.46 2c3n s LEU 30 Cb -0.15 -3.45 0.10 0.00 0.50 0.00 0.00 46.19 43.19 2c3n s LEU 30 CO 0.09 -0.52 0.17 -0.13 -1.32 0.00 0.00 176.35 174.64 2c3n s ARG 31 N 2.51 2.04 0.07 1.98 1.81 0.37 -4.96 118.95 122.78 2c3n s ARG 31 Ca 0.43 -1.73 -0.31 0.00 -1.72 0.00 0.00 55.73 52.40 2c3n s ARG 31 Cb -0.17 -3.51 -0.06 0.00 -0.45 0.00 0.00 34.95 30.77 2c3n s ARG 31 CO 0.12 -0.99 1.26 0.42 -0.68 0.00 0.00 175.30 175.42 2c3n s ILE 32 N 1.15 3.83 -0.31 1.52 -1.09 -1.26 -1.55 121.20 123.49 2c3n s ILE 32 Ca 0.06 1.31 0.01 0.00 -2.23 0.00 0.00 60.65 59.80 2c3n s ILE 32 Cb -0.22 -3.84 0.07 0.00 -1.58 0.00 0.00 42.46 36.89 2c3n s ILE 32 CO -0.04 0.09 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.07 2c3n s VAL 33 N 1.16 2.63 -0.76 2.92 1.01 -0.53 -4.89 120.40 121.94 2c3n s VAL 33 Ca 0.60 -1.70 -0.26 0.00 0.00 0.00 0.00 61.98 60.62 2c3n s VAL 33 Cb -0.31 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.46 2c3n s VAL 33 CO 0.29 -0.23 1.39 -0.62 0.00 0.00 0.00 175.10 175.94 2c3n s ASP 34 N 1.21 6.05 0.21 3.32 -1.08 -1.26 -4.30 116.67 120.83 2c3n s ASP 34 Ca -0.02 -0.46 -0.09 0.00 -0.52 0.00 0.00 52.55 51.45 2c3n s ASP 34 Cb -0.20 -2.56 0.22 0.00 -1.46 0.00 0.00 42.92 38.93 2c3n s ASP 34 CO -0.04 -1.90 1.83 -0.07 0.52 0.00 0.00 175.17 175.52 2c3n h LEU 35 N 13.58 0.67 -0.73 -1.34 3.38 -1.96 -1.70 115.31 127.22 2c3n h LEU 35 Ca -0.21 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2c3n h LEU 35 Cb 1.06 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2c3n h LEU 35 CO 1.29 0.45 0.00 2.30 0.09 0.00 0.00 178.44 182.57 2c3n n ILE 36 N -4.70 0.87 1.00 1.22 -5.35 -1.26 -0.77 119.36 110.36 2c3n n ILE 36 Ca 0.08 0.28 0.12 0.00 -0.27 0.00 0.00 62.75 62.97 2c3n n ILE 36 Cb 0.13 -1.21 0.21 0.00 -1.74 0.00 0.00 39.64 37.03 2c3n n ILE 36 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2c3n n LYS 37 N -2.19 2.20 -1.54 6.28 5.02 -0.91 -4.97 118.16 122.06 2c3n n LYS 37 Ca 0.02 -1.76 -0.08 0.00 -2.02 0.00 0.00 58.31 54.46 2c3n n LYS 37 Cb 0.20 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.72 2c3n n LYS 37 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2c3n n GLY 38 N 1.33 0.68 0.23 0.72 0.00 0.05 -4.93 105.19 103.27 2c3n n GLY 38 Ca 0.16 -0.64 0.06 0.00 0.00 0.00 0.00 46.02 45.60 2c3n n GLY 38 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2c3n h GLN 39 N 0.00 0.00 0.00 1.61 4.15 -1.53 -0.15 115.11 119.19 2c3n h GLN 39 Ca -0.17 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.24 2c3n h GLN 39 Cb 0.73 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.42 2c3n h GLN 39 CO 0.24 0.17 -0.01 1.12 -1.93 0.00 0.00 178.83 178.42 2c3n h HIS 40 N 0.00 0.00 -0.02 3.99 2.07 -1.88 -2.62 115.15 116.69 2c3n h HIS 40 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2c3n h HIS 40 Cb 0.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.29 2c3n h HIS 40 CO 0.00 0.01 -0.18 1.28 -3.07 0.00 0.00 177.93 175.97 2c3n n LEU 41 N -3.13 2.24 -4.73 6.12 4.77 -0.08 -4.55 117.00 117.64 2c3n n LEU 41 Ca -0.01 -0.76 -0.31 0.00 -0.03 0.00 0.00 56.01 54.89 2c3n n LEU 41 Cb 0.19 -0.01 0.12 0.00 -2.33 0.00 0.00 43.42 41.38 2c3n n LEU 41 CO 0.24 0.39 0.70 -0.94 -1.33 0.00 0.00 177.39 176.44 2c3n s SER 42 N -2.20 3.94 0.24 -1.43 1.04 -0.99 -4.89 113.70 109.40 2c3n s SER 42 Ca 0.26 1.98 -0.03 0.00 0.48 0.00 0.00 55.95 58.64 2c3n s SER 42 Cb 0.19 -2.54 0.28 0.00 0.10 0.00 0.00 66.02 64.05 2c3n s SER 42 CO 0.41 -2.42 1.71 0.44 0.98 0.00 0.00 173.24 174.37 2c3n h ASP 43 N -1.33 0.77 -0.38 7.02 3.32 -1.93 -2.08 116.42 121.81 2c3n h ASP 43 Ca -0.44 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.38 2c3n h ASP 43 Cb 1.25 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 2c3n h ASP 43 CO 0.48 0.89 0.19 0.00 -1.72 0.00 0.00 179.24 179.07 2c3n h ALA 44 N 1.19 0.49 -0.16 3.45 0.00 -1.93 -2.82 119.26 119.48 2c3n h ALA 44 Ca 0.13 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2c3n h ALA 44 Cb 0.55 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2c3n h ALA 44 CO 0.03 0.05 -0.55 0.35 0.00 0.00 0.00 179.25 179.13 2c3n h PHE 45 N 0.48 0.58 -0.38 0.00 3.57 -1.77 -2.99 116.94 116.43 2c3n h PHE 45 Ca 0.13 -0.21 0.11 0.00 3.53 0.00 0.00 57.97 61.54 2c3n h PHE 45 Cb 0.11 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2c3n h PHE 45 CO -0.02 0.91 0.32 0.00 -2.23 0.00 0.00 178.31 177.30 2c3n h ALA 46 N 1.05 2.20 -0.06 2.41 0.00 -1.14 0.20 119.26 123.93 2c3n h ALA 46 Ca 0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 2c3n h ALA 46 Cb 1.07 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2c3n h ALA 46 CO 0.10 -0.52 -0.75 1.96 0.00 0.00 0.00 179.25 180.04 2c3n h GLN 47 N 0.00 0.36 0.26 0.00 1.08 -1.36 -2.15 115.11 113.30 2c3n h GLN 47 Ca 0.18 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 2c3n h GLN 47 Cb 0.83 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.33 2c3n h GLN 47 CO -0.00 0.96 -0.12 0.28 -0.95 0.00 0.00 178.83 178.99 2c3n h VAL 48 N 0.24 0.66 -3.21 -0.54 2.07 -1.13 -3.43 116.25 110.91 2c3n h VAL 48 Ca -0.03 -0.86 -0.57 0.00 0.82 0.00 0.00 66.70 66.05 2c3n h VAL 48 Cb 1.33 1.05 -0.40 0.00 -1.52 0.00 0.00 31.29 31.75 2c3n h VAL 48 CO 0.13 0.15 -0.76 0.21 0.02 0.00 0.00 177.57 177.31 2c3n s ASN 49 N -5.24 3.80 0.65 0.57 2.47 0.54 -4.99 114.94 112.74 2c3n s ASN 49 Ca -0.13 -1.44 0.35 0.00 0.42 0.00 0.00 52.86 52.06 2c3n s ASN 49 Cb 0.01 -0.83 1.92 0.00 -1.45 0.00 0.00 41.25 40.90 2c3n s ASN 49 CO 0.46 -0.38 2.11 -0.65 -3.72 0.00 0.00 177.10 174.92 2c3n h PRO 50 N 8.11 0.00 0.00 0.43 0.11 -1.62 0.56 132.00 139.59 2c3n h PRO 50 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 2c3n h PRO 50 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2c3n h PRO 50 CO 0.44 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.51 2c3n n LEU 51 N -3.11 0.65 -3.62 2.35 4.77 -1.26 -4.93 117.00 111.86 2c3n n LEU 51 Ca -0.02 0.60 -0.23 0.00 -0.03 0.00 0.00 56.01 56.33 2c3n n LEU 51 Cb 0.27 -0.44 0.07 0.00 -2.33 0.00 0.00 43.42 40.99 2c3n n LEU 51 CO 0.18 -0.31 0.18 0.29 -1.33 0.00 0.00 177.39 176.40 2c3n n LYS 52 N -2.15 -7.12 -4.14 3.23 5.02 0.19 -5.01 118.16 108.18 2c3n n LYS 52 Ca 0.04 0.79 -0.11 0.00 -2.02 0.00 0.00 58.31 57.00 2c3n n LYS 52 Cb 0.34 -5.78 -0.10 0.00 -0.02 0.00 0.00 35.03 29.46 2c3n n LYS 52 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2c3n s LYS 53 N -6.13 0.75 0.20 1.97 1.02 -1.26 -4.70 119.74 111.59 2c3n s LYS 53 Ca 0.43 -1.16 0.10 0.00 0.02 0.00 0.00 55.97 55.35 2c3n s LYS 53 Cb -0.20 -0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 2c3n s LYS 53 CO 0.75 0.01 -0.13 0.14 -0.92 0.00 0.00 175.35 175.20 2c3n s VAL 54 N -2.93 2.97 0.53 3.17 -7.23 -1.26 -4.42 120.40 111.23 2c3n s VAL 54 Ca 0.05 -1.83 -0.17 0.00 -1.81 0.00 0.00 61.98 58.22 2c3n s VAL 54 Cb 0.01 -2.48 -0.07 0.00 0.56 0.00 0.00 36.38 34.39 2c3n s VAL 54 CO -0.03 -0.17 1.01 -2.16 -0.31 0.00 0.00 175.10 173.45 2c3n s PRO 55 N -2.94 3.76 0.02 4.82 0.04 -1.26 -4.79 135.00 134.64 2c3n s PRO 55 Ca 0.25 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.43 2c3n s PRO 55 Cb -0.08 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 2c3n s PRO 55 CO 0.14 -0.44 -0.10 0.00 0.04 0.00 0.00 177.00 176.65 2c3n s ALA 56 N -2.44 0.79 -0.05 8.56 0.00 -0.76 -4.14 121.76 123.72 2c3n s ALA 56 Ca 0.62 -0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.00 2c3n s ALA 56 Cb -0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2c3n s ALA 56 CO 0.30 0.13 -0.17 -1.17 0.00 0.00 0.00 175.76 174.85 2c3n s LEU 57 N -0.91 2.58 -0.03 0.00 0.20 0.28 -0.61 118.68 120.20 2c3n s LEU 57 Ca -0.01 -0.26 0.01 0.00 0.69 0.00 0.00 54.13 54.55 2c3n s LEU 57 Cb -0.07 -1.51 0.02 0.00 -0.43 0.00 0.00 46.19 44.21 2c3n s LEU 57 CO 0.00 0.33 -0.01 -0.75 -0.29 0.00 0.00 176.35 175.63 2c3n s LYS 58 N -0.63 0.37 -0.30 1.98 2.20 -0.38 -0.94 119.74 122.04 2c3n s LYS 58 Ca 0.09 0.04 -0.03 0.00 -0.36 0.00 0.00 55.97 55.71 2c3n s LYS 58 Cb -0.11 -0.52 0.10 0.00 -1.51 0.00 0.00 37.83 35.80 2c3n s LYS 58 CO 0.01 -0.11 0.13 0.34 -0.36 0.00 0.00 175.35 175.35 2c3n s ASP 59 N 0.93 3.65 1.87 1.43 -1.08 0.08 -0.21 116.67 123.34 2c3n s ASP 59 Ca -0.10 -1.49 0.00 0.00 -0.52 0.00 0.00 52.55 50.44 2c3n s ASP 59 Cb -0.13 -0.53 0.00 0.00 -1.46 0.00 0.00 42.92 40.80 2c3n s ASP 59 CO -0.01 -0.42 0.00 0.61 0.52 0.00 0.00 175.17 175.87 2c3n n GLY 60 N 5.00 3.44 0.00 2.66 0.00 -1.26 -1.87 105.19 113.16 2c3n n GLY 60 Ca -0.03 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.02 2c3n n GLY 60 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2c3n n ASP 61 N 6.29 0.00 -4.69 1.61 8.00 -1.26 -4.79 116.55 121.71 2c3n n ASP 61 Ca 0.00 -0.18 -0.38 0.00 0.71 0.00 0.00 54.79 54.94 2c3n n ASP 61 Cb 0.00 -0.26 -0.07 0.00 -0.02 0.00 0.00 41.12 40.76 2c3n n ASP 61 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2c3n s PHE 62 N -2.53 3.40 -0.02 1.24 5.36 -0.78 -5.07 117.98 119.58 2c3n s PHE 62 Ca 0.28 0.63 0.05 0.00 -0.96 0.00 0.00 56.93 56.93 2c3n s PHE 62 Cb 0.19 -2.49 -0.01 0.00 -0.34 0.00 0.00 43.02 40.38 2c3n s PHE 62 CO 0.43 0.06 -0.16 0.99 -1.46 0.00 0.00 175.22 175.07 2c3n s THR 63 N 1.06 1.29 -0.02 0.12 2.01 -1.26 -0.74 115.64 118.11 2c3n s THR 63 Ca 0.19 -0.68 -0.00 0.00 0.31 0.00 0.00 61.69 61.51 2c3n s THR 63 Cb -0.14 -1.09 0.02 0.00 0.01 0.00 0.00 72.50 71.29 2c3n s THR 63 CO 0.07 0.37 0.03 -0.22 -0.69 0.00 0.00 174.62 174.18 2c3n s LEU 64 N -0.23 1.44 0.48 4.42 2.96 -0.12 -4.99 118.68 122.64 2c3n s LEU 64 Ca 0.03 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.03 2c3n s LEU 64 Cb -0.08 0.00 -0.02 0.00 0.50 0.00 0.00 46.19 46.59 2c3n s LEU 64 CO 0.00 -0.08 0.14 0.42 -1.32 0.00 0.00 176.35 175.52 2c3n s THR 65 N 0.62 1.68 0.02 3.68 -4.23 -1.26 -0.56 115.64 115.59 2c3n s THR 65 Ca -0.05 -1.80 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 2c3n s THR 65 Cb -0.07 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.28 2c3n s THR 65 CO -0.02 0.00 0.00 -0.62 -0.54 0.00 0.00 174.62 173.44 2c3n n GLU 66 N -1.34 -0.75 -0.23 3.99 -0.58 -1.26 -4.39 120.64 116.09 2c3n n GLU 66 Ca -0.09 0.96 0.04 0.00 -0.42 0.00 0.00 57.16 57.66 2c3n n GLU 66 Cb 0.66 -0.66 0.16 0.00 -0.57 0.00 0.00 31.44 31.03 2c3n n GLU 66 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2c3n h SER 67 N 0.58 0.07 -0.51 1.62 4.64 -1.90 0.32 113.55 118.37 2c3n h SER 67 Ca 0.00 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2c3n h SER 67 Cb 0.00 0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 2c3n h SER 67 CO 0.00 0.01 0.32 0.58 -0.87 0.00 0.00 176.83 176.87 2c3n h VAL 68 N 0.31 1.15 -0.66 0.95 2.07 -1.96 0.15 116.25 118.26 2c3n h VAL 68 Ca 0.38 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.51 2c3n h VAL 68 Cb 0.60 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2c3n h VAL 68 CO -0.45 0.15 0.10 0.00 0.02 0.00 0.00 177.57 177.39 2c3n h ALA 69 N 1.16 0.93 -0.28 1.67 0.00 -1.62 -1.61 119.26 119.51 2c3n h ALA 69 Ca 0.19 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2c3n h ALA 69 Cb -0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2c3n h ALA 69 CO -0.04 0.66 0.10 0.82 0.00 0.00 0.00 179.25 180.79 2c3n h ILE 70 N 1.02 1.19 -0.75 0.00 2.04 -0.54 -0.64 117.51 119.84 2c3n h ILE 70 Ca 0.20 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.46 2c3n h ILE 70 Cb 0.45 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2c3n h ILE 70 CO 0.01 0.20 0.49 -0.07 0.00 0.00 0.00 178.15 178.78 2c3n h LEU 71 N 0.29 0.87 -0.57 1.44 3.38 -0.58 -0.24 115.31 119.90 2c3n h LEU 71 Ca 0.09 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 2c3n h LEU 71 Cb 0.22 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2c3n h LEU 71 CO -0.00 0.64 -0.34 -0.07 0.09 0.00 0.00 178.44 178.75 2c3n h LEU 72 N 1.01 0.82 -0.18 1.67 3.38 -1.16 -0.68 115.31 120.17 2c3n h LEU 72 Ca 0.27 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2c3n h LEU 72 Cb -0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 2c3n h LEU 72 CO -0.06 1.08 0.08 0.22 0.09 0.00 0.00 178.44 179.85 2c3n h TYR 73 N 0.65 0.27 -0.87 1.13 5.03 -0.80 -1.87 116.97 120.52 2c3n h TYR 73 Ca 0.07 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.34 2c3n h TYR 73 Cb 0.88 -0.08 -0.04 0.00 1.55 0.00 0.00 36.73 39.04 2c3n h TYR 73 CO 0.05 0.31 0.49 -0.07 -1.32 0.00 0.00 178.16 177.61 2c3n h LEU 74 N 0.15 1.08 -0.59 2.82 3.38 -0.93 0.66 115.31 121.88 2c3n h LEU 74 Ca 0.06 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.02 2c3n h LEU 74 Cb 0.15 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 2c3n h LEU 74 CO -0.01 0.86 0.23 0.74 0.09 0.00 0.00 178.44 180.35 2c3n h THR 75 N 1.21 0.80 0.00 0.22 2.02 -0.84 -1.56 112.91 114.76 2c3n h THR 75 Ca 0.31 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.34 2c3n h THR 75 Cb 0.01 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 2c3n h THR 75 CO -0.05 0.08 -0.00 0.03 0.37 0.00 0.00 175.52 175.94 2c3n h ARG 76 N 0.42 0.00 -0.70 6.66 3.08 -0.95 -2.78 114.38 120.11 2c3n h ARG 76 Ca 0.29 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.29 2c3n h ARG 76 Cb 0.33 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 2c3n h ARG 76 CO -0.28 0.89 0.25 -0.22 -1.07 0.00 0.00 179.97 179.55 2c3n h LYS 77 N -0.89 1.05 -0.48 0.04 3.64 -0.84 -3.01 116.57 116.09 2c3n h LYS 77 Ca -0.00 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2c3n h LYS 77 Cb 0.89 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 2c3n h LYS 77 CO 0.00 0.88 0.00 0.66 -2.27 0.00 0.00 179.45 178.72 2c3n n TYR 78 N -4.28 0.63 -3.74 1.91 4.02 -0.59 -4.97 117.16 110.13 2c3n n TYR 78 Ca 0.06 -0.36 -0.22 0.00 -0.01 0.00 0.00 57.90 57.37 2c3n n TYR 78 Cb 0.20 -0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.54 2c3n n TYR 78 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2c3n n LYS 79 N 1.35 -4.40 -1.13 -0.72 5.02 -1.06 -4.94 118.16 112.29 2c3n n LYS 79 Ca 0.19 0.57 -0.30 0.00 -2.02 0.00 0.00 58.31 56.76 2c3n n LYS 79 Cb 0.57 -5.01 0.14 0.00 -0.02 0.00 0.00 35.03 30.71 2c3n n LYS 79 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2c3n s VAL 80 N -3.72 2.62 0.37 -0.18 -7.23 -1.13 -4.95 120.40 106.18 2c3n s VAL 80 Ca 0.03 0.20 -0.26 0.00 -1.81 0.00 0.00 61.98 60.14 2c3n s VAL 80 Cb -0.01 -2.63 -0.12 0.00 0.56 0.00 0.00 36.38 34.19 2c3n s VAL 80 CO 0.83 -0.26 0.98 -2.65 -0.31 0.00 0.00 175.10 173.68 2c3n n PRO 81 N -3.95 1.31 0.26 4.82 -0.02 -1.26 -4.87 135.00 131.28 2c3n n PRO 81 Ca 0.07 0.46 0.10 0.00 -2.02 0.00 0.00 63.50 62.12 2c3n n PRO 81 Cb 0.55 -1.92 0.69 0.00 -0.02 0.00 0.00 33.50 32.80 2c3n n PRO 81 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2c3n h ASP 82 N 1.69 0.00 -0.24 2.55 3.32 -1.92 -2.55 116.42 119.27 2c3n h ASP 82 Ca -0.42 0.00 0.07 0.00 0.02 0.00 0.00 57.03 56.70 2c3n h ASP 82 Cb 1.34 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.88 2c3n h ASP 82 CO 0.58 0.08 0.22 0.10 -1.72 0.00 0.00 179.24 178.49 2c3n h TYR 83 N 0.00 0.00 -0.26 4.55 -0.00 -1.90 -0.42 116.97 118.94 2c3n h TYR 83 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.67 2c3n h TYR 83 Cb 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.87 2c3n h TYR 83 CO 0.00 0.00 -0.11 -1.49 -0.00 0.00 0.00 178.16 176.56 2c3n h TRP 84 N 0.00 0.44 -1.55 0.10 4.06 -1.66 -3.38 115.95 113.96 2c3n h TRP 84 Ca 0.11 -0.06 -0.32 0.00 2.06 0.00 0.00 58.89 60.69 2c3n h TRP 84 Cb 0.54 -0.12 -0.25 0.00 -1.00 0.00 0.00 29.16 28.33 2c3n h TRP 84 CO 0.00 0.52 -0.68 -0.47 -3.56 0.00 0.00 178.44 174.26 2c3n s TYR 85 N -4.76 -0.58 0.76 0.49 5.04 -0.26 -1.50 117.35 116.54 2c3n s TYR 85 Ca -0.07 -1.17 -0.14 0.00 -2.44 0.00 0.00 57.07 53.25 2c3n s TYR 85 Cb 0.15 -0.17 0.06 0.00 0.35 0.00 0.00 41.96 42.35 2c3n s TYR 85 CO 0.76 -1.09 1.19 -2.14 -1.34 0.00 0.00 175.55 172.92 2c3n s PRO 86 N 0.67 1.99 0.28 4.97 0.02 -0.67 -4.87 135.00 137.38 2c3n s PRO 86 Ca 0.29 1.67 -0.01 0.00 0.02 0.00 0.00 61.00 62.98 2c3n s PRO 86 Cb -0.00 -1.83 0.39 0.00 0.02 0.00 0.00 34.50 33.08 2c3n s PRO 86 CO -0.10 -1.93 1.80 1.96 -0.33 0.00 0.00 177.00 178.40 2c3n h GLN 87 N -0.59 0.77 -6.62 5.54 4.20 -1.98 -3.34 115.11 113.09 2c3n h GLN 87 Ca -0.47 -0.18 -0.56 0.00 0.06 0.00 0.00 58.65 57.50 2c3n h GLN 87 Cb 1.28 -0.10 0.07 0.00 0.30 0.00 0.00 27.48 29.03 2c3n h GLN 87 CO 0.49 0.75 0.82 -3.47 -0.67 0.00 0.00 178.83 176.74 2c3n n ASP 88 N -4.24 3.36 -0.20 1.46 -0.08 -1.26 -4.84 116.55 110.75 2c3n n ASP 88 Ca 0.03 1.11 -0.06 0.00 -1.51 0.00 0.00 54.79 54.35 2c3n n ASP 88 Cb 0.27 -1.49 0.10 0.00 2.34 0.00 0.00 41.12 42.34 2c3n n ASP 88 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2c3n h LEU 89 N 5.46 0.95 -0.26 -2.67 3.38 -1.99 0.29 115.31 120.46 2c3n h LEU 89 Ca -0.45 -0.21 -0.21 0.00 0.09 0.00 0.00 57.88 57.10 2c3n h LEU 89 Cb 1.24 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2c3n h LEU 89 CO 0.85 0.94 -0.78 1.56 0.09 0.00 0.00 178.44 181.11 2c3n h GLN 90 N 0.94 0.59 -0.50 1.13 4.20 -1.95 -0.47 115.11 119.06 2c3n h GLN 90 Ca 0.19 -0.50 -0.07 0.00 0.06 0.00 0.00 58.65 58.33 2c3n h GLN 90 Cb 0.40 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 2c3n h GLN 90 CO 0.01 1.12 0.04 0.00 -0.67 0.00 0.00 178.83 179.33 2c3n h ALA 91 N 0.73 0.67 -0.61 3.87 0.00 -1.82 -1.41 119.26 120.70 2c3n h ALA 91 Ca -0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 2c3n h ALA 91 Cb 1.39 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 2c3n h ALA 91 CO 0.15 0.45 0.31 -0.09 0.00 0.00 0.00 179.25 180.07 2c3n h ARG 92 N 0.73 0.86 -0.92 0.00 2.43 -0.91 -2.75 114.38 113.82 2c3n h ARG 92 Ca 0.15 -0.11 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 2c3n h ARG 92 Cb 0.47 -0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 29.80 2c3n h ARG 92 CO 0.02 0.68 0.60 0.00 -1.51 0.00 0.00 179.97 179.76 2c3n h ALA 93 N 1.14 1.47 -0.65 2.80 0.00 -0.80 -0.74 119.26 122.48 2c3n h ALA 93 Ca 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2c3n h ALA 93 Cb 0.08 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2c3n h ALA 93 CO -0.03 0.40 0.32 0.00 0.00 0.00 0.00 179.25 179.94 2c3n h ARG 94 N 1.08 0.91 -0.11 0.00 3.08 -0.98 0.17 114.38 118.54 2c3n h ARG 94 Ca 0.39 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.31 2c3n h ARG 94 Cb 0.15 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 2c3n h ARG 94 CO -0.14 0.70 0.01 0.28 -1.07 0.00 0.00 179.97 179.75 2c3n h VAL 95 N 0.91 1.24 -0.91 2.04 2.07 -1.06 -2.23 116.25 118.31 2c3n h VAL 95 Ca 0.23 -0.76 0.06 0.00 0.82 0.00 0.00 66.70 67.04 2c3n h VAL 95 Cb 0.08 1.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 2c3n h VAL 95 CO -0.03 0.22 0.57 0.44 0.02 0.00 0.00 177.57 178.79 2c3n h ASP 96 N -0.07 0.92 -0.41 0.57 3.32 -0.78 -0.84 116.42 119.12 2c3n h ASP 96 Ca 0.03 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2c3n h ASP 96 Cb 0.33 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2c3n h ASP 96 CO 0.00 0.59 0.20 -0.08 -1.72 0.00 0.00 179.24 178.23 2c3n h GLU 97 N 1.06 0.60 -0.08 3.56 4.81 -0.61 0.72 114.58 124.64 2c3n h GLU 97 Ca 0.39 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2c3n h GLU 97 Cb 0.14 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 2c3n h GLU 97 CO -0.16 0.52 0.02 -0.92 -0.73 0.00 0.00 179.01 177.74 2c3n h TYR 98 N 0.53 0.12 -0.58 0.92 3.20 -0.98 -0.08 116.97 120.11 2c3n h TYR 98 Ca 0.14 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2c3n h TYR 98 Cb 0.13 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 2c3n h TYR 98 CO -0.01 0.27 0.37 -0.07 -1.64 0.00 0.00 178.16 177.08 2c3n h LEU 99 N -0.06 0.67 -0.01 2.82 3.38 -0.93 -1.14 115.31 120.03 2c3n h LEU 99 Ca 0.02 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2c3n h LEU 99 Cb 0.21 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.80 2c3n h LEU 99 CO -0.00 0.50 -0.59 0.00 0.09 0.00 0.00 178.44 178.44 2c3n h ALA 100 N 1.62 0.08 -0.79 1.53 0.00 -0.70 -3.33 119.26 117.68 2c3n h ALA 100 Ca 0.21 -0.56 0.01 0.00 0.00 0.00 0.00 54.91 54.57 2c3n h ALA 100 Cb -0.06 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2c3n h ALA 100 CO -0.04 0.35 0.52 2.35 0.00 0.00 0.00 179.25 182.43 2c3n h TRP 101 N -0.09 0.98 0.00 0.00 7.01 -0.55 -3.11 115.95 120.19 2c3n h TRP 101 Ca -0.07 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.93 2c3n h TRP 101 Cb 1.30 -0.33 -0.00 0.00 -2.10 0.00 0.00 29.16 28.02 2c3n h TRP 101 CO 0.14 0.60 -0.11 -0.56 -2.79 0.00 0.00 178.44 175.72 2c3n h GLN 102 N 1.05 0.00 -0.72 2.65 -0.00 -1.33 -3.24 115.11 113.52 2c3n h GLN 102 Ca 0.30 0.00 0.10 0.00 -0.00 0.00 0.00 58.65 59.04 2c3n h GLN 102 Cb -0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 27.48 27.32 2c3n h GLN 102 CO -0.08 0.11 0.37 0.45 -0.00 0.00 0.00 178.83 179.68 2c3n h HIS 103 N 0.00 0.65 -0.26 0.06 3.86 -1.70 -1.35 115.15 116.42 2c3n h HIS 103 Ca -0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2c3n h HIS 103 Cb 0.30 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.58 2c3n h HIS 103 CO 0.00 0.24 0.00 0.25 0.86 0.00 0.00 177.93 179.28 2c3n n THR 104 N -4.86 0.43 0.00 2.45 -2.24 -1.22 -4.15 114.28 104.69 2c3n n THR 104 Ca 0.11 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2c3n n THR 104 Cb 0.28 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 2c3n n THR 104 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2c3n n THR 105 N 1.11 0.00 -0.12 4.28 -2.24 -1.04 -4.72 114.28 111.55 2c3n n THR 105 Ca 0.14 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.88 2c3n n THR 105 Cb 0.50 -0.02 0.15 0.00 -2.10 0.00 0.00 70.33 68.86 2c3n n THR 105 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2c3n h LEU 106 N 0.00 0.79 -0.16 3.22 5.85 -1.81 -0.79 115.31 122.41 2c3n h LEU 106 Ca 0.00 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.55 2c3n h LEU 106 Cb 0.00 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 2c3n h LEU 106 CO 0.00 0.85 0.03 -0.09 -0.34 0.00 0.00 178.44 178.89 2c3n h ARG 107 N 0.77 0.10 -0.16 1.25 2.43 -1.49 -1.00 114.38 116.28 2c3n h ARG 107 Ca 0.15 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 2c3n h ARG 107 Cb 0.45 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 2c3n h ARG 107 CO 0.02 0.07 0.08 -0.09 -1.51 0.00 0.00 179.97 178.53 2c3n h ARG 108 N 0.10 0.23 -0.37 0.20 2.43 -1.64 -1.34 114.38 113.99 2c3n h ARG 108 Ca 0.07 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.09 2c3n h ARG 108 Cb 0.06 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2c3n h ARG 108 CO -0.10 0.26 -0.26 0.66 -1.51 0.00 0.00 179.97 179.02 2c3n h SER 109 N 0.13 0.79 -0.58 -3.80 4.64 -1.01 -0.53 113.55 113.20 2c3n h SER 109 Ca 0.05 -0.30 -0.07 0.00 -0.47 0.00 0.00 61.79 61.00 2c3n h SER 109 Cb 0.11 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 2c3n h SER 109 CO -0.01 1.02 0.08 0.00 -0.87 0.00 0.00 176.83 177.05 2c3n h LEU 111 N 0.85 -0.09 -1.28 0.00 5.85 -1.00 -2.43 115.31 117.21 2c3n h LEU 111 Ca 0.17 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2c3n h LEU 111 Cb 0.43 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2c3n h LEU 111 CO 0.01 0.10 0.49 0.03 -0.34 0.00 0.00 178.44 178.73 2c3n h ARG 112 N -0.28 0.94 -0.20 1.25 3.08 -1.07 -1.84 114.38 116.26 2c3n h ARG 112 Ca -0.01 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2c3n h ARG 112 Cb 0.24 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 2c3n h ARG 112 CO 0.02 0.62 0.11 0.00 -1.07 0.00 0.00 179.97 179.66 2c3n h ALA 113 N 1.55 0.26 -0.11 0.04 0.00 -1.02 0.88 119.26 120.86 2c3n h ALA 113 Ca 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2c3n h ALA 113 Cb -0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2c3n h ALA 113 CO -0.07 -0.21 0.06 1.25 0.00 0.00 0.00 179.25 180.27 2c3n h LEU 114 N 0.23 0.09 -0.18 0.00 5.85 -1.12 -1.46 115.31 118.72 2c3n h LEU 114 Ca 0.07 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.67 2c3n h LEU 114 Cb 0.06 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.07 2c3n h LEU 114 CO -0.01 0.07 -0.38 -0.50 -0.34 0.00 0.00 178.44 177.28 2c3n h TRP 115 N 0.13 0.72 -0.10 1.25 4.06 -1.20 -0.82 115.95 119.98 2c3n h TRP 115 Ca 0.04 -0.27 -0.12 0.00 2.06 0.00 0.00 58.89 60.61 2c3n h TRP 115 Cb 0.00 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.02 2c3n h TRP 115 CO -0.08 1.01 -0.48 0.45 -3.56 0.00 0.00 178.44 175.78 2c3n h HIS 116 N 0.22 0.31 0.10 0.49 3.86 -0.85 0.92 115.15 120.19 2c3n h HIS 116 Ca 0.00 -0.10 -0.31 0.00 -1.16 0.00 0.00 60.37 58.80 2c3n h HIS 116 Cb 0.98 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.37 2c3n h HIS 116 CO 0.09 0.69 -1.63 -0.22 0.86 0.00 0.00 177.93 177.73 2c3n h LYS 117 N 0.21 0.20 0.00 2.45 3.64 -1.28 -3.45 116.57 118.35 2c3n h LYS 117 Ca 0.01 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2c3n h LYS 117 Cb 0.92 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2c3n h LYS 117 CO 0.08 1.02 -0.14 0.28 -2.27 0.00 0.00 179.45 178.41 2c3n n VAL 118 N -3.38 0.48 -0.03 2.00 0.31 -0.40 -4.80 118.33 112.52 2c3n n VAL 118 Ca -0.19 0.16 -0.07 0.00 -0.01 0.00 0.00 64.34 64.23 2c3n n VAL 118 Cb 1.04 -1.07 0.11 0.00 -0.91 0.00 0.00 33.84 33.01 2c3n n VAL 118 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 2c3n h MET 119 N 0.00 0.61 0.72 5.55 2.86 -1.17 -0.06 114.93 123.44 2c3n h MET 119 Ca 0.00 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.32 2c3n h MET 119 Cb 0.14 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 31.81 2c3n h MET 119 CO 0.00 0.87 -0.35 0.74 1.06 0.00 0.00 176.91 179.24 2c3n h PHE 120 N 0.52 -0.90 -0.55 -0.22 0.05 -1.08 -0.83 116.94 113.93 2c3n h PHE 120 Ca 0.05 -0.02 -0.07 0.00 3.82 0.00 0.00 57.97 61.75 2c3n h PHE 120 Cb 0.85 0.30 -0.02 0.00 2.00 0.00 0.00 35.95 39.07 2c3n h PHE 120 CO 0.04 -0.56 0.06 -1.00 -0.18 0.00 0.00 178.31 176.67 2c3n h PRO 121 N -0.98 0.89 0.00 1.51 0.13 -1.33 0.37 132.00 132.60 2c3n h PRO 121 Ca -0.10 -0.22 -0.17 0.00 -0.87 0.00 0.00 66.00 64.64 2c3n h PRO 121 Cb 0.75 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.74 2c3n h PRO 121 CO 0.16 0.84 -1.03 0.28 -0.23 0.00 0.00 178.00 178.03 2c3n h VAL 122 N 0.84 0.74 0.13 1.56 2.07 -1.12 -3.24 116.25 117.22 2c3n h VAL 122 Ca 0.17 -1.91 -0.18 0.00 0.82 0.00 0.00 66.70 65.59 2c3n h VAL 122 Cb 0.41 1.75 0.02 0.00 -1.52 0.00 0.00 31.29 31.95 2c3n h VAL 122 CO 0.01 0.25 -0.83 0.15 0.02 0.00 0.00 177.57 177.18 2c3n h PHE 123 N -1.00 0.49 -0.01 1.57 3.57 -1.43 -3.36 116.94 116.77 2c3n h PHE 123 Ca -0.26 -0.36 0.00 0.00 3.53 0.00 0.00 57.97 60.88 2c3n h PHE 123 Cb 1.10 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.82 2c3n h PHE 123 CO 0.04 1.32 -0.34 1.28 -2.23 0.00 0.00 178.31 178.37 2c3n n LEU 124 N -4.14 1.48 -3.60 0.59 4.77 -0.40 -0.49 117.00 115.21 2c3n n LEU 124 Ca -0.15 -0.49 -0.25 0.00 -0.03 0.00 0.00 56.01 55.09 2c3n n LEU 124 Cb 0.81 -0.07 0.06 0.00 -2.33 0.00 0.00 43.42 41.89 2c3n n LEU 124 CO 0.47 0.28 0.18 0.61 -1.33 0.00 0.00 177.39 177.59 2c3n n GLY 125 N 1.37 -0.53 3.06 -0.72 0.00 -0.47 -4.94 105.19 102.95 2c3n n GLY 125 Ca 0.11 0.22 -0.32 0.00 0.00 0.00 0.00 46.02 46.04 2c3n n GLY 125 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2c3n s GLU 126 N -6.31 2.18 0.50 1.61 0.41 -0.00 -4.96 118.70 112.13 2c3n s GLU 126 Ca 0.57 -1.31 -0.23 0.00 -0.41 0.00 0.00 54.97 53.59 2c3n s GLU 126 Cb -0.26 -2.86 -0.07 0.00 -1.78 0.00 0.00 34.13 29.17 2c3n s GLU 126 CO 0.70 -0.57 1.38 -2.14 -0.49 0.00 0.00 175.26 174.14 2c3n s PRO 127 N 1.13 3.43 -0.10 0.39 0.02 -1.26 -2.16 135.00 136.46 2c3n s PRO 127 Ca -0.09 2.29 0.01 0.00 0.02 0.00 0.00 61.00 63.23 2c3n s PRO 127 Cb -0.20 -2.46 -0.02 0.00 0.02 0.00 0.00 34.50 31.84 2c3n s PRO 127 CO -0.05 -0.97 -0.11 0.08 -0.33 0.00 0.00 177.00 175.61 2c3n s VAL 128 N -1.27 3.30 -0.14 3.83 1.01 -1.26 -4.94 120.40 120.93 2c3n s VAL 128 Ca 0.66 -0.60 -0.40 0.00 0.00 0.00 0.00 61.98 61.64 2c3n s VAL 128 Cb -0.41 -2.36 -0.17 0.00 0.00 0.00 0.00 36.38 33.44 2c3n s VAL 128 CO 0.51 0.55 1.51 -0.24 0.00 0.00 0.00 175.10 177.44 2c3n n SER 129 N 2.91 1.73 -0.13 3.32 2.88 -1.26 -4.83 113.62 118.24 2c3n n SER 129 Ca -0.18 1.11 0.19 0.00 -1.33 0.00 0.00 58.87 58.67 2c3n n SER 129 Cb 0.53 -1.11 0.59 0.00 -0.75 0.00 0.00 64.21 63.47 2c3n n SER 129 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2c3n h PRO 130 N 5.57 0.23 -0.35 -1.46 0.11 -1.99 -0.65 132.00 133.45 2c3n h PRO 130 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 2c3n h PRO 130 Cb 1.34 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 2c3n h PRO 130 CO 0.86 0.15 0.08 0.37 -0.21 0.00 0.00 178.00 179.26 2c3n h GLN 131 N 0.24 0.57 -0.59 1.05 -0.00 -2.00 -1.31 115.11 113.07 2c3n h GLN 131 Ca 0.36 -0.14 0.02 0.00 -0.00 0.00 0.00 58.65 58.89 2c3n h GLN 131 Cb 1.07 -0.07 -0.03 0.00 0.00 0.00 0.00 27.48 28.44 2c3n h GLN 131 CO -0.08 0.62 0.38 1.15 0.00 0.00 0.00 178.83 180.90 2c3n h THR 132 N 0.42 1.11 -0.39 2.39 2.02 -1.63 -1.08 112.91 115.75 2c3n h THR 132 Ca 0.11 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 2c3n h THR 132 Cb 0.31 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 2c3n h THR 132 CO 0.00 0.14 0.24 0.25 0.37 0.00 0.00 175.52 176.52 2c3n h LEU 133 N 0.76 0.47 -0.69 2.58 5.85 -1.02 -0.70 115.31 122.55 2c3n h LEU 133 Ca 0.23 -0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 2c3n h LEU 133 Cb -0.03 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 2c3n h LEU 133 CO -0.07 0.37 0.23 0.00 -0.34 0.00 0.00 178.44 178.63 2c3n h ALA 134 N 1.11 0.91 -0.76 1.25 0.00 -0.85 -0.47 119.26 120.45 2c3n h ALA 134 Ca 0.14 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2c3n h ALA 134 Cb -0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 2c3n h ALA 134 CO -0.03 0.57 0.31 0.00 0.00 0.00 0.00 179.25 180.11 2c3n h ALA 135 N 1.11 1.12 -0.39 0.00 0.00 -0.97 -0.26 119.26 119.86 2c3n h ALA 135 Ca 0.23 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2c3n h ALA 135 Cb 0.28 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2c3n h ALA 135 CO -0.01 0.64 0.06 1.15 0.00 0.00 0.00 179.25 181.08 2c3n h THR 136 N 1.10 1.24 -0.15 0.00 2.02 -0.38 -0.98 112.91 115.76 2c3n h THR 136 Ca 0.26 -0.87 -0.10 0.00 0.77 0.00 0.00 66.41 66.47 2c3n h THR 136 Cb 0.19 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 2c3n h THR 136 CO -0.02 0.30 -0.34 -0.07 0.37 0.00 0.00 175.52 175.76 2c3n h LEU 137 N 0.49 0.31 -0.39 2.58 3.38 -0.84 -0.95 115.31 119.90 2c3n h LEU 137 Ca 0.12 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2c3n h LEU 137 Cb 0.38 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2c3n h LEU 137 CO 0.01 0.63 0.18 0.00 0.09 0.00 0.00 178.44 179.35 2c3n h ALA 138 N 1.39 0.50 -0.66 1.53 0.00 -0.78 -1.44 119.26 119.81 2c3n h ALA 138 Ca 0.03 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2c3n h ALA 138 Cb 0.73 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2c3n h ALA 138 CO 0.06 0.08 0.18 0.93 0.00 0.00 0.00 179.25 180.50 2c3n h GLU 139 N 0.49 1.04 -0.44 0.00 5.08 -0.93 -1.80 114.58 118.03 2c3n h GLU 139 Ca 0.13 -0.24 0.05 0.00 -1.00 0.00 0.00 59.36 58.31 2c3n h GLU 139 Cb 0.14 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 2c3n h GLU 139 CO -0.01 0.92 0.16 1.25 -1.00 0.00 0.00 179.01 180.33 2c3n h LEU 140 N 0.97 0.18 -0.84 1.33 5.85 -1.00 -1.39 115.31 120.40 2c3n h LEU 140 Ca 0.21 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.01 2c3n h LEU 140 Cb 0.33 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 2c3n h LEU 140 CO -0.00 0.14 0.54 0.44 -0.34 0.00 0.00 178.44 179.21 2c3n h ASP 141 N 0.33 0.89 -0.24 1.25 3.32 -0.70 -0.59 116.42 120.69 2c3n h ASP 141 Ca 0.20 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 2c3n h ASP 141 Cb 0.19 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2c3n h ASP 141 CO -0.20 0.61 0.14 0.58 -1.72 0.00 0.00 179.24 178.65 2c3n h VAL 142 N 1.05 1.11 -0.28 -1.35 2.07 -0.95 -1.39 116.25 116.51 2c3n h VAL 142 Ca 0.34 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.48 2c3n h VAL 142 Cb 0.02 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 2c3n h VAL 142 CO -0.12 0.11 -0.23 0.71 0.02 0.00 0.00 177.57 178.06 2c3n h THR 143 N 0.29 1.26 -0.56 2.57 1.35 -0.82 -1.05 112.91 115.96 2c3n h THR 143 Ca 0.09 -1.26 -0.08 0.00 -0.55 0.00 0.00 66.41 64.61 2c3n h THR 143 Cb 0.05 1.30 -0.02 0.00 -1.73 0.00 0.00 68.15 67.75 2c3n h THR 143 CO -0.01 0.40 0.05 -0.07 -0.25 0.00 0.00 175.52 175.63 2c3n h LEU 144 N 0.47 0.89 -0.86 3.87 3.38 -0.96 -0.65 115.31 121.44 2c3n h LEU 144 Ca 0.07 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2c3n h LEU 144 Cb 0.66 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2c3n h LEU 144 CO 0.05 0.92 0.12 -0.61 0.09 0.00 0.00 178.44 179.01 2c3n h GLN 145 N 0.86 0.97 -0.63 1.13 5.75 -0.58 -2.31 115.11 120.30 2c3n h GLN 145 Ca 0.17 -0.23 -0.06 0.00 -0.15 0.00 0.00 58.65 58.38 2c3n h GLN 145 Cb 0.45 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.84 2c3n h GLN 145 CO 0.02 0.88 0.16 -0.07 -2.65 0.00 0.00 178.83 177.17 2c3n h LEU 146 N 0.92 0.95 -0.60 -2.39 3.38 -1.00 0.12 115.31 116.69 2c3n h LEU 146 Ca 0.19 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 57.99 2c3n h LEU 146 Cb 0.36 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2c3n h LEU 146 CO 0.00 0.93 0.32 0.25 0.09 0.00 0.00 178.44 180.03 2c3n h LEU 147 N 0.93 0.46 -0.04 1.67 5.85 -0.82 0.12 115.31 123.48 2c3n h LEU 147 Ca 0.20 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 2c3n h LEU 147 Cb 0.35 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 2c3n h LEU 147 CO 0.00 0.30 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.07 2c3n h GLU 148 N 0.59 0.07 0.08 1.25 5.08 -1.19 -1.41 114.58 119.05 2c3n h GLU 148 Ca 0.27 -0.03 -0.28 0.00 -1.00 0.00 0.00 59.36 58.32 2c3n h GLU 148 Cb 0.17 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.44 2c3n h GLU 148 CO -0.18 0.41 -1.17 -0.44 -1.00 0.00 0.00 179.01 176.64 2c3n h ASP 149 N -0.28 0.78 0.15 1.42 3.32 -0.35 0.19 116.42 121.65 2c3n h ASP 149 Ca 0.01 -0.70 -0.33 0.00 0.02 0.00 0.00 57.03 56.03 2c3n h ASP 149 Cb 0.38 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 2c3n h ASP 149 CO 0.00 1.51 -1.69 0.50 -1.72 0.00 0.00 179.24 177.85 2c3n h LYS 150 N 0.27 0.31 0.00 3.56 1.63 -0.95 -3.42 116.57 117.96 2c3n h LYS 150 Ca -0.16 -0.52 0.00 0.00 -0.85 0.00 0.00 60.65 59.12 2c3n h LYS 150 Cb 1.83 0.20 0.00 0.00 -0.60 0.00 0.00 32.23 33.66 2c3n h LYS 150 CO 0.22 1.25 -0.16 1.19 -3.45 0.00 0.00 179.45 178.50 2c3n n PHE 151 N -3.70 0.00 0.06 1.91 3.72 -1.04 -4.77 117.46 113.64 2c3n n PHE 151 Ca -0.27 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.01 2c3n n PHE 151 Cb 1.00 -0.08 -0.08 0.00 -0.94 0.00 0.00 39.48 39.39 2c3n n PHE 151 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2c3n h LEU 152 N -0.16 -0.06 0.00 4.37 5.85 -1.32 -3.44 115.31 120.56 2c3n h LEU 152 Ca 0.00 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2c3n h LEU 152 Cb 0.16 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2c3n h LEU 152 CO 0.00 0.03 0.00 0.00 -0.34 0.00 0.00 178.44 178.13 2c3n n GLN 153 N -5.09 0.00 -0.74 1.25 6.02 0.66 -1.41 117.38 118.07 2c3n n GLN 153 Ca -0.08 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 56.99 2c3n n GLN 153 Cb 0.09 0.00 0.37 0.00 1.02 0.00 0.00 30.24 31.71 2c3n n GLN 153 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2c3n n ASN 154 N 2.98 5.14 -4.95 1.08 3.02 -1.26 -4.99 115.26 116.29 2c3n n ASN 154 Ca 0.00 -2.79 -0.24 0.00 -0.03 0.00 0.00 54.58 51.52 2c3n n ASN 154 Cb 0.00 -0.63 0.05 0.00 -0.61 0.00 0.00 39.78 38.60 2c3n n ASN 154 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2c3n s LYS 155 N -2.48 2.40 0.13 3.52 1.02 -0.50 -5.01 119.74 118.80 2c3n s LYS 155 Ca 0.51 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 56.01 2c3n s LYS 155 Cb 0.38 -2.31 -0.10 0.00 -0.52 0.00 0.00 37.83 35.27 2c3n s LYS 155 CO 0.17 -0.98 1.30 0.00 -0.92 0.00 0.00 175.35 174.92 2c3n h ALA 156 N -0.29 0.35 -2.20 5.17 0.00 -1.86 -3.47 119.26 116.97 2c3n h ALA 156 Ca -0.44 -0.72 -0.47 0.00 0.00 0.00 0.00 54.91 53.29 2c3n h ALA 156 Cb 1.30 -0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 2c3n h ALA 156 CO 0.57 0.83 -0.54 -0.06 0.00 0.00 0.00 179.25 180.05 2c3n s PHE 157 N -3.22 1.69 0.43 0.00 0.08 -0.72 -4.78 117.98 111.46 2c3n s PHE 157 Ca -0.05 -1.36 0.16 0.00 0.12 0.00 0.00 56.93 55.79 2c3n s PHE 157 Cb 0.09 -0.95 1.00 0.00 -0.57 0.00 0.00 43.02 42.59 2c3n s PHE 157 CO 0.87 -0.47 1.97 -0.07 -0.10 0.00 0.00 175.22 177.41 2c3n h LEU 158 N 2.08 0.00 -1.97 -0.37 3.38 -1.87 -3.18 115.31 113.37 2c3n h LEU 158 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2c3n h LEU 158 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2c3n h LEU 158 CO 0.52 0.21 0.00 0.35 0.09 0.00 0.00 178.44 179.61 2c3n n THR 159 N -4.19 0.49 -3.29 0.22 -2.24 -1.26 -4.29 114.28 99.71 2c3n n THR 159 Ca -0.02 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 2c3n n THR 159 Cb 0.28 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2c3n n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c3n n GLY 160 N -0.25 -0.46 0.12 3.38 0.00 -1.20 -4.97 105.19 101.81 2c3n n GLY 160 Ca 0.00 -1.08 0.15 0.00 0.00 0.00 0.00 46.02 45.09 2c3n n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2c3n n PRO 161 N 0.00 1.06 -4.17 1.61 -0.04 -1.26 -1.75 135.00 130.44 2c3n n PRO 161 Ca 0.00 -0.24 -0.12 0.00 -0.04 0.00 0.00 63.50 63.10 2c3n n PRO 161 Cb 0.00 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 31.86 2c3n n PRO 161 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2c3n s HIS 162 N -2.11 0.94 0.69 0.54 -3.43 -1.26 -4.78 115.29 105.88 2c3n s HIS 162 Ca 0.42 -0.81 -0.17 0.00 -0.80 0.00 0.00 55.06 53.70 2c3n s HIS 162 Cb 0.21 -0.53 0.01 0.00 -1.43 0.00 0.00 32.58 30.85 2c3n s HIS 162 CO 0.38 -0.09 1.25 -1.50 -2.00 0.00 0.00 174.74 172.78 2c3n s ILE 163 N -3.17 2.18 0.35 -5.38 2.07 -1.26 -4.75 121.20 111.24 2c3n s ILE 163 Ca 0.09 0.10 0.03 0.00 -1.41 0.00 0.00 60.65 59.46 2c3n s ILE 163 Cb 0.02 -2.86 -0.01 0.00 0.13 0.00 0.00 42.46 39.74 2c3n s ILE 163 CO -0.03 -0.04 0.39 -1.54 -1.91 0.00 0.00 174.94 171.82 2c3n n SER 164 N -2.30 -1.04 -0.11 4.50 3.41 -1.26 -4.39 113.62 112.43 2c3n n SER 164 Ca 0.15 -3.09 0.13 0.00 -0.26 0.00 0.00 58.87 55.80 2c3n n SER 164 Cb 0.49 2.13 0.51 0.00 -0.26 0.00 0.00 64.21 67.08 2c3n n SER 164 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2c3n h LEU 165 N 0.00 0.37 -0.51 1.04 3.38 -1.55 -2.31 115.31 115.73 2c3n h LEU 165 Ca -0.26 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.76 2c3n h LEU 165 Cb 1.22 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.86 2c3n h LEU 165 CO 0.36 0.21 0.27 0.00 0.09 0.00 0.00 178.44 179.38 2c3n h ALA 166 N 1.68 0.65 -0.27 1.53 0.00 -1.86 -2.07 119.26 118.93 2c3n h ALA 166 Ca 0.30 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 2c3n h ALA 166 Cb 0.64 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2c3n h ALA 166 CO -0.09 -0.06 -0.07 -0.44 0.00 0.00 0.00 179.25 178.59 2c3n h ASP 167 N 0.53 0.40 -0.26 0.00 5.19 -1.82 -1.21 116.42 119.26 2c3n h ASP 167 Ca 0.22 -0.08 -0.06 0.00 -0.62 0.00 0.00 57.03 56.48 2c3n h ASP 167 Cb 0.10 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 2c3n h ASP 167 CO -0.14 0.52 -0.08 0.25 -3.12 0.00 0.00 179.24 176.68 2c3n h LEU 168 N 0.40 0.52 -0.44 1.55 5.85 -1.36 0.02 115.31 121.86 2c3n h LEU 168 Ca 0.08 -0.37 -0.05 0.00 0.84 0.00 0.00 57.88 58.38 2c3n h LEU 168 Cb 0.38 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2c3n h LEU 168 CO 0.02 0.77 0.08 0.58 -0.34 0.00 0.00 178.44 179.55 2c3n h VAL 169 N 0.26 1.24 -0.19 1.05 2.07 -1.15 -2.54 116.25 116.98 2c3n h VAL 169 Ca 0.06 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 2c3n h VAL 169 Cb 0.55 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2c3n h VAL 169 CO 0.03 0.30 0.03 0.00 0.02 0.00 0.00 177.57 177.95 2c3n h ALA 170 N 0.95 0.25 -0.63 1.67 0.00 -1.14 -1.85 119.26 118.51 2c3n h ALA 170 Ca 0.13 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2c3n h ALA 170 Cb 0.36 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2c3n h ALA 170 CO 0.01 -0.07 0.21 0.97 0.00 0.00 0.00 179.25 180.36 2c3n h ILE 171 N 0.11 1.23 -0.19 0.00 6.09 -0.97 -1.24 117.51 122.54 2c3n h ILE 171 Ca 0.06 -0.78 -0.13 0.00 -1.37 0.00 0.00 64.86 62.63 2c3n h ILE 171 Cb 0.32 0.53 -0.01 0.00 0.47 0.00 0.00 36.82 38.12 2c3n h ILE 171 CO 0.00 0.30 -0.44 0.71 -3.07 0.00 0.00 178.15 175.66 2c3n h THR 172 N 0.92 1.31 -0.13 2.19 1.35 -1.34 -2.02 112.91 115.19 2c3n h THR 172 Ca 0.21 -1.62 0.03 0.00 -0.55 0.00 0.00 66.41 64.47 2c3n h THR 172 Cb 0.24 1.64 -0.03 0.00 -1.73 0.00 0.00 68.15 68.28 2c3n h THR 172 CO -0.01 0.50 -0.04 -0.33 -0.25 0.00 0.00 175.52 175.39 2c3n h GLU 173 N 0.38 -0.01 0.00 4.72 5.08 -1.03 -3.03 114.58 120.68 2c3n h GLU 173 Ca 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2c3n h GLU 173 Cb 0.93 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 2c3n h GLU 173 CO 0.08 -0.01 -0.10 -0.07 -1.00 0.00 0.00 179.01 177.91 2c3n h LEU 174 N -0.01 0.00 -1.37 1.33 3.38 -0.81 -2.32 115.31 115.51 2c3n h LEU 174 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2c3n h LEU 174 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2c3n h LEU 174 CO -0.14 0.10 0.00 0.24 0.09 0.00 0.00 178.44 178.73 2c3n h MET 175 N 0.00 0.00 0.57 1.13 2.86 -1.25 -2.83 114.93 115.41 2c3n h MET 175 Ca -0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2c3n h MET 175 Cb 0.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2c3n h MET 175 CO 0.01 0.00 -0.38 0.45 1.06 0.00 0.00 176.91 178.05 2c3n h HIS 176 N 0.00 -1.03 0.00 -0.22 3.86 -1.50 -0.28 115.15 115.98 2c3n h HIS 176 Ca 0.00 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 2c3n h HIS 176 Cb 0.49 0.37 -0.00 0.00 1.06 0.00 0.00 27.41 29.33 2c3n h HIS 176 CO 0.00 -0.56 -0.13 -1.00 0.86 0.00 0.00 177.93 177.11 2c3n h PRO 177 N -0.90 0.00 -0.52 2.45 0.13 -1.72 -1.71 132.00 129.73 2c3n h PRO 177 Ca -0.08 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2c3n h PRO 177 Cb 0.73 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.83 2c3n h PRO 177 CO 0.05 0.13 0.31 0.28 -0.23 0.00 0.00 178.00 178.55 2c3n h VAL 178 N 0.00 1.16 0.00 1.56 2.07 -1.35 -0.81 116.25 118.88 2c3n h VAL 178 Ca -0.00 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2c3n h VAL 178 Cb 0.28 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2c3n h VAL 178 CO 0.02 0.16 -0.13 1.23 0.02 0.00 0.00 177.57 178.87 2c3n h GLY 179 N 0.70 0.00 1.76 2.17 0.00 -0.43 -1.15 103.07 106.13 2c3n h GLY 179 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2c3n h GLY 179 CO -0.04 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.50 2c3n n ALA 180 N -2.50 2.37 -0.60 3.60 0.00 -0.70 -4.59 120.51 118.10 2c3n n ALA 180 Ca -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2c3n n ALA 180 Cb 0.20 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.19 2c3n n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2c3n n GLY 181 N 1.29 0.69 3.79 0.00 0.00 -0.43 -4.84 105.19 105.69 2c3n n GLY 181 Ca 0.11 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 2c3n n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3n n GLN 183 N -1.91 4.61 0.12 0.00 1.13 -1.26 -4.50 117.38 115.57 2c3n n GLN 183 Ca 0.10 -3.90 -0.13 0.00 -1.94 0.00 0.00 57.00 51.12 2c3n n GLN 183 Cb 0.52 -2.63 -0.08 0.00 0.11 0.00 0.00 30.24 28.16 2c3n n GLN 183 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2c3n h VAL 184 N 2.83 0.85 0.00 5.09 2.07 -1.92 -3.29 116.25 121.87 2c3n h VAL 184 Ca 0.54 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2c3n h VAL 184 Cb 0.41 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2c3n h VAL 184 CO 1.42 0.11 -1.01 0.49 0.02 0.00 0.00 177.57 178.60 2c3n n PHE 185 N -5.11 0.77 -2.19 1.57 3.01 -1.26 -4.64 117.46 109.61 2c3n n PHE 185 Ca -0.09 0.22 -0.42 0.00 1.01 0.00 0.00 57.45 58.17 2c3n n PHE 185 Cb 0.22 -0.82 -0.03 0.00 -0.01 0.00 0.00 39.48 38.84 2c3n n PHE 185 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2c3n s GLU 186 N -3.32 4.33 0.00 -1.08 0.41 -1.24 -2.17 118.70 115.63 2c3n s GLU 186 Ca 0.01 2.05 0.00 0.00 -0.41 0.00 0.00 54.97 56.62 2c3n s GLU 186 Cb 0.11 -3.25 0.00 0.00 -1.78 0.00 0.00 34.13 29.21 2c3n s GLU 186 CO 0.79 -0.41 0.00 0.41 -0.49 0.00 0.00 175.26 175.56 2c3n n GLY 187 N 3.35 1.20 2.48 -1.39 0.00 -1.26 -4.94 105.19 104.63 2c3n n GLY 187 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 2c3n n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c3n n ARG 188 N -2.00 1.83 -0.17 1.61 1.74 -0.92 -4.98 116.66 113.77 2c3n n ARG 188 Ca 0.00 -4.23 0.01 0.00 -0.77 0.00 0.00 57.85 52.86 2c3n n ARG 188 Cb 0.00 -2.02 0.28 0.00 -1.02 0.00 0.00 32.46 29.71 2c3n n ARG 188 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2c3n h PRO 189 N 4.54 0.90 -0.55 5.56 0.13 -1.92 -0.77 132.00 139.88 2c3n h PRO 189 Ca 0.17 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 65.19 2c3n h PRO 189 Cb 0.74 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.65 2c3n h PRO 189 CO 0.70 0.59 0.11 0.87 -0.23 0.00 0.00 178.00 180.04 2c3n h LYS 190 N 0.92 0.86 -0.34 0.86 1.57 -1.93 -1.54 116.57 116.96 2c3n h LYS 190 Ca 0.25 -0.19 -0.16 0.00 -1.87 0.00 0.00 60.65 58.68 2c3n h LYS 190 Cb -0.10 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2c3n h LYS 190 CO -0.06 0.79 -0.42 -0.07 -0.57 0.00 0.00 179.45 179.13 2c3n h LEU 191 N 0.82 0.92 -0.61 2.94 3.38 -1.69 -2.53 115.31 118.54 2c3n h LEU 191 Ca 0.17 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 2c3n h LEU 191 Cb 0.34 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2c3n h LEU 191 CO 0.00 1.21 0.34 0.00 0.09 0.00 0.00 178.44 180.08 2c3n h ALA 192 N 0.82 0.79 -0.31 1.53 0.00 -0.94 0.67 119.26 121.82 2c3n h ALA 192 Ca 0.05 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 2c3n h ALA 192 Cb 1.00 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2c3n h ALA 192 CO 0.10 0.31 -0.40 1.79 0.00 0.00 0.00 179.25 181.04 2c3n h THR 193 N 0.83 1.29 -0.50 0.00 1.35 -1.32 -2.07 112.91 112.49 2c3n h THR 193 Ca 0.22 -1.58 0.02 0.00 -0.55 0.00 0.00 66.41 64.52 2c3n h THR 193 Cb 0.05 1.48 -0.03 0.00 -1.73 0.00 0.00 68.15 67.91 2c3n h THR 193 CO -0.03 0.51 0.30 -0.25 -0.25 0.00 0.00 175.52 175.80 2c3n h TRP 194 N 0.62 0.56 -0.63 4.73 7.01 -1.22 -1.35 115.95 125.68 2c3n h TRP 194 Ca 0.05 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.10 2c3n h TRP 194 Cb 0.95 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 27.79 2c3n h TRP 194 CO 0.05 0.33 0.38 -0.09 -2.79 0.00 0.00 178.44 176.31 2c3n h ARG 195 N 0.60 0.72 -0.74 2.65 2.43 -0.47 0.17 114.38 119.74 2c3n h ARG 195 Ca 0.20 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2c3n h ARG 195 Cb 0.01 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.36 2c3n h ARG 195 CO -0.08 0.47 0.46 1.96 -1.51 0.00 0.00 179.97 181.27 2c3n h GLN 196 N 0.74 1.00 -0.93 0.20 1.08 -1.00 -0.23 115.11 115.97 2c3n h GLN 196 Ca 0.26 -0.08 -0.01 0.00 -1.45 0.00 0.00 58.65 57.36 2c3n h GLN 196 Cb 0.05 -0.21 -0.04 0.00 -0.05 0.00 0.00 27.48 27.22 2c3n h GLN 196 CO -0.12 0.70 0.54 0.00 -0.95 0.00 0.00 178.83 179.01 2c3n h ARG 197 N 1.02 1.27 -0.16 1.46 3.08 -0.54 -1.55 114.38 118.95 2c3n h ARG 197 Ca 0.27 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 2c3n h ARG 197 Cb -0.05 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 29.73 2c3n h ARG 197 CO -0.05 0.90 -0.08 0.28 -1.07 0.00 0.00 179.97 179.95 2c3n h VAL 198 N 1.28 1.31 -0.78 2.04 2.07 -0.43 -0.93 116.25 120.81 2c3n h VAL 198 Ca 0.33 -1.12 0.07 0.00 0.82 0.00 0.00 66.70 66.80 2c3n h VAL 198 Cb -0.03 1.70 -0.06 0.00 -1.52 0.00 0.00 31.29 31.38 2c3n h VAL 198 CO -0.06 0.33 0.46 -0.33 0.02 0.00 0.00 177.57 177.99 2c3n h GLU 199 N 0.02 0.80 -0.74 1.57 5.08 -0.95 -0.40 114.58 119.95 2c3n h GLU 199 Ca 0.04 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2c3n h GLU 199 Cb 0.55 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2c3n h GLU 199 CO 0.02 0.53 0.29 0.00 -1.00 0.00 0.00 179.01 178.85 2c3n h ALA 200 N 1.40 0.97 -0.16 3.43 0.00 -1.13 0.86 119.26 124.63 2c3n h ALA 200 Ca 0.35 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 2c3n h ALA 200 Cb 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2c3n h ALA 200 CO -0.20 0.60 -0.45 0.00 0.00 0.00 0.00 179.25 179.20 2c3n h ALA 201 N 1.14 0.92 0.00 0.00 0.00 -0.53 -3.03 119.26 117.76 2c3n h ALA 201 Ca 0.25 -0.45 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2c3n h ALA 201 Cb 0.23 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2c3n h ALA 201 CO -0.02 0.64 -0.87 0.28 0.00 0.00 0.00 179.25 179.28 2c3n h VAL 202 N 0.33 1.24 0.00 0.00 2.07 -0.96 -3.50 116.25 115.42 2c3n h VAL 202 Ca 0.02 -2.80 0.00 0.00 0.82 0.00 0.00 66.70 64.74 2c3n h VAL 202 Cb 0.93 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.29 2c3n h VAL 202 CO 0.08 0.70 0.00 0.61 0.02 0.00 0.00 177.57 178.98 2c3n n GLY 203 N 1.32 1.45 0.30 2.17 0.00 0.28 -4.75 105.19 105.95 2c3n n GLY 203 Ca -0.01 -1.18 -0.02 0.00 0.00 0.00 0.00 46.02 44.81 2c3n n GLY 203 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2c3n h GLU 204 N 0.00 0.92 -0.48 1.61 3.07 -1.78 -0.82 114.58 117.11 2c3n h GLU 204 Ca 0.00 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 2c3n h GLU 204 Cb 0.00 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.68 2c3n h GLU 204 CO 0.00 0.61 0.26 -0.44 -1.40 0.00 0.00 179.01 178.05 2c3n h ASP 205 N 0.95 0.59 -0.45 1.42 3.32 -1.93 -0.89 116.42 119.44 2c3n h ASP 205 Ca 0.32 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.22 2c3n h ASP 205 Cb 0.03 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 2c3n h ASP 205 CO -0.12 0.51 0.07 0.25 -1.72 0.00 0.00 179.24 178.23 2c3n h LEU 206 N 0.63 0.71 -0.25 1.55 5.85 -1.80 -1.23 115.31 120.78 2c3n h LEU 206 Ca 0.17 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.67 2c3n h LEU 206 Cb 0.05 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2c3n h LEU 206 CO -0.03 0.79 -0.02 0.15 -0.34 0.00 0.00 178.44 178.99 2c3n h PHE 207 N 0.60 -0.05 -0.24 1.25 3.57 -0.91 -1.29 116.94 119.87 2c3n h PHE 207 Ca 0.14 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 2c3n h PHE 207 Cb 0.38 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2c3n h PHE 207 CO 0.03 -0.06 0.14 0.37 -2.23 0.00 0.00 178.31 176.55 2c3n h GLN 208 N 0.05 0.33 -0.64 1.11 4.15 -1.07 -2.56 115.11 116.48 2c3n h GLN 208 Ca 0.12 -0.04 0.10 0.00 0.77 0.00 0.00 58.65 59.61 2c3n h GLN 208 Cb 0.16 -0.07 -0.08 0.00 0.21 0.00 0.00 27.48 27.71 2c3n h GLN 208 CO -0.22 0.29 0.24 1.49 -1.93 0.00 0.00 178.83 178.70 2c3n h GLU 209 N 0.29 0.40 0.00 1.69 4.81 -0.97 -1.86 114.58 118.93 2c3n h GLU 209 Ca 0.09 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2c3n h GLU 209 Cb 0.05 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2c3n h GLU 209 CO -0.01 0.26 -0.22 0.00 -0.73 0.00 0.00 179.01 178.31 2c3n h ALA 210 N 1.45 1.38 -0.70 2.92 0.00 -1.04 -3.02 119.26 120.26 2c3n h ALA 210 Ca 0.33 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2c3n h ALA 210 Cb 0.43 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2c3n h ALA 210 CO -0.33 0.28 0.00 0.72 0.00 0.00 0.00 179.25 179.91 2c3n n HIS 211 N -3.91 0.96 -0.25 0.00 8.25 -0.74 -4.53 115.22 115.00 2c3n n HIS 211 Ca -0.02 -0.51 -0.05 0.00 -0.26 0.00 0.00 57.72 56.88 2c3n n HIS 211 Cb 0.31 -0.02 0.05 0.00 1.12 0.00 0.00 29.99 31.45 2c3n n HIS 211 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2c3n h GLU 212 N 4.09 0.94 0.04 -0.41 5.08 -1.32 -2.66 114.58 120.34 2c3n h GLU 212 Ca 0.00 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2c3n h GLU 212 Cb 0.99 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2c3n h GLU 212 CO 0.01 0.65 -0.02 0.28 -1.00 0.00 0.00 179.01 178.93 2c3n h VAL 213 N 0.95 1.32 -0.24 3.13 2.07 -1.83 -3.19 116.25 118.46 2c3n h VAL 213 Ca 0.25 -1.33 0.03 0.00 0.82 0.00 0.00 66.70 66.47 2c3n h VAL 213 Cb -0.06 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 2c3n h VAL 213 CO -0.05 0.33 0.16 -0.29 0.02 0.00 0.00 177.57 177.74 2c3n h ILE 214 N -0.66 0.99 0.00 4.57 6.09 -1.74 -1.26 117.51 125.50 2c3n h ILE 214 Ca -0.01 -0.07 0.00 0.00 -1.37 0.00 0.00 64.86 63.41 2c3n h ILE 214 Cb 0.58 0.76 0.00 0.00 0.47 0.00 0.00 36.82 38.64 2c3n h ILE 214 CO 0.01 0.04 0.00 -0.07 -3.07 0.00 0.00 178.15 175.06 2c3n h LEU 215 N 0.21 0.00 -2.54 2.19 3.38 -1.47 -2.92 115.31 114.16 2c3n h LEU 215 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2c3n h LEU 215 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2c3n h LEU 215 CO -0.02 0.00 0.00 2.29 0.09 0.00 0.00 178.44 180.80 2c3n n LYS 216 N -2.68 2.38 -0.11 1.13 2.85 -0.51 -4.64 118.16 116.58 2c3n n LYS 216 Ca 0.02 -1.96 0.06 0.00 -1.05 0.00 0.00 58.31 55.39 2c3n n LYS 216 Cb 0.33 -1.31 0.39 0.00 -0.65 0.00 0.00 35.03 33.79 2c3n n LYS 216 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2c3n h ALA 217 N 2.48 1.74 0.00 0.58 0.00 -1.27 0.21 119.26 123.00 2c3n h ALA 217 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2c3n h ALA 217 Cb 0.73 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2c3n h ALA 217 CO 0.00 0.18 0.00 0.36 0.00 0.00 0.00 179.25 179.79 2c3n n LYS 218 N -4.47 0.15 -0.15 0.00 2.85 -1.26 -1.54 118.16 113.74 2c3n n LYS 218 Ca 0.08 0.56 0.10 0.00 -1.05 0.00 0.00 58.31 58.00 2c3n n LYS 218 Cb 0.18 -1.91 0.18 0.00 -0.65 0.00 0.00 35.03 32.82 2c3n n LYS 218 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2c3n n ASP 219 N -2.22 3.14 -4.72 -5.58 8.00 0.06 -4.99 116.55 110.23 2c3n n ASP 219 Ca -0.00 -1.91 -0.42 0.00 0.71 0.00 0.00 54.79 53.16 2c3n n ASP 219 Cb 0.10 -0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 40.98 2c3n n ASP 219 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2c3n n PHE 220 N 1.21 2.69 -2.11 1.24 0.99 -0.59 -4.95 117.46 115.94 2c3n n PHE 220 Ca 0.16 0.26 -0.38 0.00 -0.00 0.00 0.00 57.45 57.49 2c3n n PHE 220 Cb 0.53 -2.58 0.00 0.00 -1.00 0.00 0.00 39.48 36.43 2c3n n PHE 220 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.76 174.62 2c3n s PRO 221 N -0.22 3.67 0.59 -1.08 0.02 -1.26 -4.72 135.00 132.00 2c3n s PRO 221 Ca 0.67 1.96 -0.20 0.00 0.02 0.00 0.00 61.00 63.45 2c3n s PRO 221 Cb -0.53 -2.45 -0.03 0.00 0.02 0.00 0.00 34.50 31.50 2c3n s PRO 221 CO 0.46 -0.68 1.26 -1.25 -0.33 0.00 0.00 177.00 176.46 2c3n s PRO 222 N -2.63 2.96 0.38 5.54 0.04 -1.26 -4.87 135.00 135.15 2c3n s PRO 222 Ca 0.64 1.97 -0.27 0.00 0.04 0.00 0.00 61.00 63.38 2c3n s PRO 222 Cb -0.33 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 32.10 2c3n s PRO 222 CO 0.41 -1.26 1.37 0.00 0.04 0.00 0.00 177.00 177.56 2c3n s ALA 223 N -1.47 3.43 0.86 8.56 0.00 0.36 -5.01 121.76 128.49 2c3n s ALA 223 Ca 0.77 1.36 -0.11 0.00 0.00 0.00 0.00 51.96 53.98 2c3n s ALA 223 Cb -0.34 -3.53 0.11 0.00 0.00 0.00 0.00 23.12 19.36 2c3n s ALA 223 CO 0.38 -0.86 1.11 0.16 0.00 0.00 0.00 175.76 176.54 2c3n s ASP 224 N -0.46 3.65 0.37 0.00 1.47 -1.26 -4.70 116.67 115.75 2c3n s ASP 224 Ca 0.53 1.86 0.11 0.00 1.18 0.00 0.00 52.55 56.23 2c3n s ASP 224 Cb -0.42 -2.47 0.88 0.00 -0.34 0.00 0.00 42.92 40.58 2c3n s ASP 224 CO 0.55 -2.59 1.88 -0.65 0.68 0.00 0.00 175.17 175.05 2c3n h PRO 225 N -1.51 0.60 -0.03 2.11 0.11 -1.99 -0.68 132.00 130.61 2c3n h PRO 225 Ca -0.45 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 2c3n h PRO 225 Cb 1.26 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2c3n h PRO 225 CO 0.49 0.40 0.00 1.15 -0.21 0.00 0.00 178.00 179.83 2c3n h THR 226 N 0.62 1.23 -0.39 -1.15 2.02 -2.00 -1.92 112.91 111.33 2c3n h THR 226 Ca 0.42 -0.70 -0.10 0.00 0.77 0.00 0.00 66.41 66.80 2c3n h THR 226 Cb 0.74 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 2c3n h THR 226 CO -0.18 0.19 -0.15 0.40 0.37 0.00 0.00 175.52 176.15 2c3n h ILE 227 N -0.22 1.28 -0.49 3.11 2.04 -1.86 -2.47 117.51 118.90 2c3n h ILE 227 Ca 0.01 -1.27 0.09 0.00 1.00 0.00 0.00 64.86 64.69 2c3n h ILE 227 Cb 0.30 1.28 -0.08 0.00 -0.74 0.00 0.00 36.82 37.58 2c3n h ILE 227 CO 0.00 0.42 -0.00 0.50 0.00 0.00 0.00 178.15 179.07 2c3n h LYS 228 N 0.59 0.11 -0.57 2.37 3.64 -1.14 0.84 116.57 122.41 2c3n h LYS 228 Ca 0.09 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 2c3n h LYS 228 Cb 0.70 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2c3n h LYS 228 CO 0.05 0.07 0.09 0.37 -2.27 0.00 0.00 179.45 177.76 2c3n h GLN 229 N 0.11 0.92 -0.09 1.90 4.15 -1.15 -1.69 115.11 119.27 2c3n h GLN 229 Ca 0.25 -0.23 -0.14 0.00 0.77 0.00 0.00 58.65 59.30 2c3n h GLN 229 Cb 0.37 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 2c3n h GLN 229 CO -0.41 0.86 -0.55 -0.22 -1.93 0.00 0.00 178.83 176.58 2c3n h LYS 230 N 0.87 0.28 0.00 1.69 3.64 -0.93 -3.24 116.57 118.89 2c3n h LYS 230 Ca 0.18 -0.17 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 2c3n h LYS 230 Cb 0.39 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 2c3n h LYS 230 CO 0.01 0.76 -0.95 -0.07 -2.27 0.00 0.00 179.45 176.92 2c3n h LEU 231 N 0.21 0.02 -0.25 5.20 3.38 -0.57 -3.40 115.31 119.90 2c3n h LEU 231 Ca 0.00 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 57.98 2c3n h LEU 231 Cb 1.04 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 2c3n h LEU 231 CO 0.09 0.96 0.05 -0.03 0.09 0.00 0.00 178.44 179.60 2c3n h MET 232 N 0.01 0.13 -0.54 1.13 4.05 -1.34 0.11 114.93 118.48 2c3n h MET 232 Ca -0.01 -0.01 0.09 0.00 -0.28 0.00 0.00 59.70 59.49 2c3n h MET 232 Cb 1.68 -0.03 -0.07 0.00 -0.80 0.00 0.00 31.60 32.38 2c3n h MET 232 CO 0.13 0.09 0.15 -1.35 0.23 0.00 0.00 176.91 176.16 2c3n h PRO 233 N 0.14 0.30 -0.37 0.39 0.11 -1.77 0.24 132.00 131.04 2c3n h PRO 233 Ca 0.11 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.25 2c3n h PRO 233 Cb 0.12 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.12 2c3n h PRO 233 CO -0.15 0.20 0.12 2.35 -0.21 0.00 0.00 178.00 180.30 2c3n h TRP 234 N 0.31 0.21 0.20 0.65 7.01 -1.55 -1.81 115.95 120.96 2c3n h TRP 234 Ca 0.27 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.28 2c3n h TRP 234 Cb 0.36 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.38 2c3n h TRP 234 CO -0.20 0.08 -0.09 0.28 -2.79 0.00 0.00 178.44 175.71 2c3n h VAL 235 N 0.26 0.82 -0.44 2.65 2.07 0.11 -2.30 116.25 119.42 2c3n h VAL 235 Ca 0.17 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.66 2c3n h VAL 235 Cb 0.16 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2c3n h VAL 235 CO -0.19 0.01 0.25 -0.07 0.02 0.00 0.00 177.57 177.60 2c3n h LEU 236 N -0.29 0.40 -1.70 2.57 3.38 -0.38 -2.01 115.31 117.27 2c3n h LEU 236 Ca -0.03 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2c3n h LEU 236 Cb 0.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2c3n h LEU 236 CO 0.04 0.29 -0.18 0.00 0.09 0.00 0.00 178.44 178.68 2c3n h ALA 237 N 1.20 1.36 0.02 1.53 0.00 -1.31 -2.39 119.26 119.67 2c3n h ALA 237 Ca 0.18 -0.16 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 2c3n h ALA 237 Cb 0.03 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.80 2c3n h ALA 237 CO -0.09 0.22 -1.05 1.98 0.00 0.00 0.00 179.25 180.32 2c3n h MET 238 N 0.00 0.57 0.00 0.00 -1.53 -0.77 -3.40 114.93 109.80 2c3n h MET 238 Ca -0.00 -0.65 -0.29 0.00 -3.44 0.00 0.00 59.70 55.32 2c3n h MET 238 Cb 0.41 0.19 -0.05 0.00 -0.55 0.00 0.00 31.60 31.61 2c3n h MET 238 CO 0.02 1.26 -2.05 0.44 0.14 0.00 0.00 176.91 176.72 2c3n n ILE 239 N -3.79 1.05 -0.69 1.77 -5.35 -1.10 -5.04 119.36 106.21 2c3n n ILE 239 Ca -0.10 -0.36 0.00 0.00 -0.27 0.00 0.00 62.75 62.03 2c3n n ILE 239 Cb 0.89 -1.35 0.00 0.00 -1.74 0.00 0.00 39.64 37.44 2c3n n ILE 239 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33