#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 4.34 -0.04 0.99 2.96 -1.26 -4.16 118.68 121.51 2c3n s LEU 3 Ca 0.00 2.02 0.06 0.00 -0.22 0.00 0.00 54.13 55.99 2c3n s LEU 3 Cb 0.00 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.11 2c3n s LEU 3 CO 0.00 -0.56 -0.23 -1.61 -1.32 0.00 0.00 176.35 172.63 2c3n s GLU 4 N 1.57 2.21 -0.17 1.98 2.02 0.39 -0.25 118.70 126.45 2c3n s GLU 4 Ca 0.60 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.76 2c3n s GLU 4 Cb -0.29 -1.96 0.02 0.00 0.10 0.00 0.00 34.13 32.00 2c3n s GLU 4 CO 0.27 0.40 -0.20 -0.51 0.02 0.00 0.00 175.26 175.24 2c3n s LEU 5 N -0.27 2.10 -0.40 1.80 1.43 -0.58 -1.32 118.68 121.44 2c3n s LEU 5 Ca 0.01 -0.63 -0.18 0.00 -1.03 0.00 0.00 54.13 52.30 2c3n s LEU 5 Cb -0.12 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.66 2c3n s LEU 5 CO 0.02 0.02 0.48 -0.31 0.23 0.00 0.00 176.35 176.79 2c3n s TYR 6 N 1.14 3.16 0.03 0.29 1.51 0.36 -0.98 117.35 122.86 2c3n s TYR 6 Ca 0.01 -0.18 -0.00 0.00 -1.01 0.00 0.00 57.07 55.89 2c3n s TYR 6 Cb -0.14 -2.96 -0.03 0.00 -0.11 0.00 0.00 41.96 38.73 2c3n s TYR 6 CO -0.09 -0.67 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.13 2c3n s LEU 7 N 2.29 2.32 -0.08 -1.29 1.43 -0.54 -1.95 118.68 120.86 2c3n s LEU 7 Ca 0.15 -0.66 -0.01 0.00 -1.03 0.00 0.00 54.13 52.58 2c3n s LEU 7 Cb -0.16 0.10 0.03 0.00 0.03 0.00 0.00 46.19 46.19 2c3n s LEU 7 CO 0.14 -0.38 -0.00 -0.62 0.23 0.00 0.00 176.35 175.72 2c3n s ASP 8 N -1.93 1.64 0.12 2.29 -1.08 -1.26 -1.14 116.67 115.31 2c3n s ASP 8 Ca -0.08 -0.11 0.13 0.00 -0.52 0.00 0.00 52.55 51.97 2c3n s ASP 8 Cb -0.04 -0.46 0.60 0.00 -1.46 0.00 0.00 42.92 41.55 2c3n s ASP 8 CO -0.04 -0.19 1.40 0.18 0.52 0.00 0.00 175.17 177.04 2c3n n LEU 9 N 5.14 0.25 -0.07 -1.34 4.77 -1.26 -0.53 117.00 123.96 2c3n n LEU 9 Ca -0.07 0.59 0.03 0.00 -0.03 0.00 0.00 56.01 56.53 2c3n n LEU 9 Cb 0.50 -0.59 0.37 0.00 -2.33 0.00 0.00 43.42 41.37 2c3n n LEU 9 CO 0.11 -0.55 1.19 0.25 -1.33 0.00 0.00 177.39 177.05 2c3n h LEU 10 N 0.00 0.59 -9.53 2.23 5.85 -1.92 -3.39 115.31 109.14 2c3n h LEU 10 Ca 0.00 -0.01 -0.52 0.00 0.84 0.00 0.00 57.88 58.18 2c3n h LEU 10 Cb 0.13 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2c3n h LEU 10 CO 0.00 0.43 0.39 -0.55 -0.34 0.00 0.00 178.44 178.36 2c3n s SER 11 N -6.57 7.42 0.11 1.25 0.15 0.31 -4.82 113.70 111.55 2c3n s SER 11 Ca -0.09 1.80 -0.31 0.00 0.70 0.00 0.00 55.95 58.05 2c3n s SER 11 Cb 0.18 -2.58 -0.11 0.00 -1.71 0.00 0.00 66.02 61.79 2c3n s SER 11 CO 0.75 -0.15 1.59 1.56 1.20 0.00 0.00 173.24 178.19 2c3n h GLN 12 N 5.90 -0.65 -0.07 5.44 4.20 -1.86 -1.95 115.11 126.13 2c3n h GLN 12 Ca -0.42 0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.30 2c3n h GLN 12 Cb 1.21 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 29.13 2c3n h GLN 12 CO 0.73 -0.44 -0.11 -1.00 -0.67 0.00 0.00 178.83 177.35 2c3n h PRO 13 N -0.68 0.10 -0.61 1.46 0.13 -1.94 -2.49 132.00 127.98 2c3n h PRO 13 Ca 0.01 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 65.03 2c3n h PRO 13 Cb 0.68 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 2c3n h PRO 13 CO -0.20 0.21 0.03 0.00 -0.23 0.00 0.00 178.00 177.81 2c3n h ARG 15 N 0.96 1.01 -0.16 0.00 3.08 -0.91 0.46 114.38 118.82 2c3n h ARG 15 Ca 0.18 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2c3n h ARG 15 Cb 0.52 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2c3n h ARG 15 CO 0.03 0.76 0.05 0.00 -1.07 0.00 0.00 179.97 179.74 2c3n h ALA 16 N 1.39 0.21 -0.42 0.04 0.00 -1.25 -0.64 119.26 118.60 2c3n h ALA 16 Ca 0.25 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2c3n h ALA 16 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2c3n h ALA 16 CO -0.04 -0.18 0.12 0.28 0.00 0.00 0.00 179.25 179.44 2c3n h VAL 17 N 0.09 1.22 0.10 0.00 2.07 -1.12 -1.39 116.25 117.21 2c3n h VAL 17 Ca 0.05 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.83 2c3n h VAL 17 Cb 0.21 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2c3n h VAL 17 CO -0.00 0.27 -0.18 0.22 0.02 0.00 0.00 177.57 177.89 2c3n h TYR 18 N 0.54 -0.47 -0.40 1.57 3.20 -0.79 -0.64 116.97 119.98 2c3n h TYR 18 Ca 0.13 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2c3n h TYR 18 Cb 0.28 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 2c3n h TYR 18 CO 0.01 -0.26 0.25 0.82 -1.64 0.00 0.00 178.16 177.34 2c3n h ILE 19 N -0.35 1.07 -0.38 1.81 2.04 -1.04 -1.05 117.51 119.62 2c3n h ILE 19 Ca 0.03 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.74 2c3n h ILE 19 Cb 0.36 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2c3n h ILE 19 CO -0.10 0.09 0.18 0.15 0.00 0.00 0.00 178.15 178.47 2c3n h PHE 20 N 0.51 0.33 -0.35 1.37 3.57 -1.00 0.30 116.94 121.66 2c3n h PHE 20 Ca 0.15 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 2c3n h PHE 20 Cb -0.03 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2c3n h PHE 20 CO -0.06 0.17 -0.19 0.00 -2.23 0.00 0.00 178.31 176.00 2c3n h ALA 21 N 1.20 0.49 -0.16 2.41 0.00 -0.88 -2.52 119.26 119.80 2c3n h ALA 21 Ca 0.16 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2c3n h ALA 21 Cb 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2c3n h ALA 21 CO -0.12 0.43 -0.02 0.87 0.00 0.00 0.00 179.25 180.42 2c3n h LYS 22 N 0.52 0.30 -0.94 0.00 1.79 -1.02 -0.64 116.57 116.57 2c3n h LYS 22 Ca 0.08 -0.10 0.05 0.00 -2.18 0.00 0.00 60.65 58.50 2c3n h LYS 22 Cb 0.73 -0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.30 2c3n h LYS 22 CO 0.05 0.54 0.61 -0.22 -1.08 0.00 0.00 179.45 179.36 2c3n h LYS 23 N 0.02 1.09 -0.22 3.15 1.63 -0.96 -1.91 116.57 119.37 2c3n h LYS 23 Ca 0.04 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2c3n h LYS 23 Cb 0.42 -0.25 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 2c3n h LYS 23 CO 0.01 0.72 0.00 0.09 -3.45 0.00 0.00 179.45 176.82 2c3n n ASN 24 N -4.47 1.58 -3.89 4.20 3.02 -0.95 -4.93 115.26 109.82 2c3n n ASN 24 Ca 0.14 -1.81 -0.30 0.00 -0.03 0.00 0.00 54.58 52.58 2c3n n ASN 24 Cb 0.16 -0.14 0.03 0.00 -0.61 0.00 0.00 39.78 39.21 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 0.30 -4.88 -4.66 6.41 8.00 -0.72 -4.93 116.55 116.06 2c3n n ASP 25 Ca 0.14 -0.76 -0.42 0.00 0.71 0.00 0.00 54.79 54.45 2c3n n ASP 25 Cb 0.29 -3.96 -0.03 0.00 -0.02 0.00 0.00 41.12 37.39 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 -3.31 4.81 0.03 0.53 1.01 -0.29 -4.99 121.20 118.99 2c3n s ILE 26 Ca 0.65 1.76 -0.30 0.00 0.00 0.00 0.00 60.65 62.76 2c3n s ILE 26 Cb -0.32 -4.20 -0.07 0.00 0.01 0.00 0.00 42.46 37.88 2c3n s ILE 26 CO 0.82 -0.06 1.55 -2.84 0.00 0.00 0.00 174.94 174.42 2c3n s PRO 27 N 2.59 4.23 0.07 2.79 0.02 -1.26 -4.74 135.00 138.70 2c3n s PRO 27 Ca 0.40 2.17 -0.11 0.00 0.02 0.00 0.00 61.00 63.49 2c3n s PRO 27 Cb -0.16 -3.60 0.01 0.00 0.02 0.00 0.00 34.50 30.76 2c3n s PRO 27 CO 0.10 -0.67 0.24 -0.59 -0.33 0.00 0.00 177.00 175.74 2c3n s PHE 28 N 2.60 0.03 -0.30 6.54 -0.12 -1.26 -4.64 117.98 120.83 2c3n s PHE 28 Ca 0.70 -0.33 -0.18 0.00 -0.05 0.00 0.00 56.93 57.07 2c3n s PHE 28 Cb -0.36 0.02 -0.02 0.00 -0.63 0.00 0.00 43.02 42.03 2c3n s PHE 28 CO 0.30 -0.52 0.53 -2.00 -0.05 0.00 0.00 175.22 173.48 2c3n s GLU 29 N -3.21 3.87 -0.25 1.99 2.12 0.66 -4.97 118.70 118.91 2c3n s GLU 29 Ca -0.00 0.12 -0.29 0.00 0.36 0.00 0.00 54.97 55.16 2c3n s GLU 29 Cb 0.02 -3.72 0.01 0.00 0.26 0.00 0.00 34.13 30.69 2c3n s GLU 29 CO -0.07 -0.50 1.11 -1.17 -0.54 0.00 0.00 175.26 174.08 2c3n s LEU 30 N 2.39 4.05 -0.38 2.70 2.96 -1.26 -1.53 118.68 127.61 2c3n s LEU 30 Ca 0.21 1.33 -0.03 0.00 -0.22 0.00 0.00 54.13 55.42 2c3n s LEU 30 Cb -0.15 -3.54 0.09 0.00 0.50 0.00 0.00 46.19 43.09 2c3n s LEU 30 CO 0.11 -0.77 0.15 -0.13 -1.32 0.00 0.00 176.35 174.39 2c3n s ARG 31 N 3.45 2.15 0.12 1.98 1.81 -0.16 -4.97 118.95 123.34 2c3n s ARG 31 Ca 0.47 -1.64 -0.31 0.00 -1.72 0.00 0.00 55.73 52.53 2c3n s ARG 31 Cb -0.15 -3.49 -0.07 0.00 -0.45 0.00 0.00 34.95 30.78 2c3n s ARG 31 CO 0.11 -0.94 1.30 0.42 -0.68 0.00 0.00 175.30 175.52 2c3n s ILE 32 N 1.19 3.51 -0.33 1.52 1.01 -1.26 -1.46 121.20 125.38 2c3n s ILE 32 Ca 0.04 1.13 0.04 0.00 0.00 0.00 0.00 60.65 61.86 2c3n s ILE 32 Cb -0.22 -3.72 0.10 0.00 0.01 0.00 0.00 42.46 38.62 2c3n s ILE 32 CO -0.03 0.11 0.04 -0.69 0.00 0.00 0.00 174.94 174.37 2c3n s VAL 33 N 0.79 2.31 -0.66 2.92 1.01 -0.29 -4.88 120.40 121.60 2c3n s VAL 33 Ca 0.60 -2.25 -0.27 0.00 0.00 0.00 0.00 61.98 60.07 2c3n s VAL 33 Cb -0.34 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.38 2c3n s VAL 33 CO 0.32 -0.53 1.61 -0.62 0.00 0.00 0.00 175.10 175.88 2c3n s ASP 34 N 0.96 5.67 0.17 3.32 -1.08 -1.26 -4.34 116.67 120.11 2c3n s ASP 34 Ca 0.08 0.04 -0.13 0.00 -0.52 0.00 0.00 52.55 52.03 2c3n s ASP 34 Cb -0.19 -2.54 0.07 0.00 -1.46 0.00 0.00 42.92 38.80 2c3n s ASP 34 CO -0.07 -2.12 1.77 -0.07 0.52 0.00 0.00 175.17 175.19 2c3n h LEU 35 N 14.90 0.73 -2.46 -1.34 3.38 -1.95 -1.70 115.31 126.87 2c3n h LEU 35 Ca -0.27 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.60 2c3n h LEU 35 Cb 1.11 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 2c3n h LEU 35 CO 1.24 0.63 0.06 0.40 0.09 0.00 0.00 178.44 180.86 2c3n h ILE 36 N 0.77 0.44 -0.02 1.22 1.08 -2.03 0.85 117.51 119.82 2c3n h ILE 36 Ca 0.20 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.67 2c3n h ILE 36 Cb 0.08 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 34.78 2c3n h ILE 36 CO -0.03 0.00 -0.12 0.29 -0.69 0.00 0.00 178.15 177.60 2c3n n LYS 37 N -3.72 1.93 -1.46 2.37 5.02 -1.02 -4.97 118.16 116.31 2c3n n LYS 37 Ca -0.02 -1.54 -0.06 0.00 -2.02 0.00 0.00 58.31 54.68 2c3n n LYS 37 Cb 0.15 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.67 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 1.34 0.61 0.22 0.72 0.00 0.29 -4.95 105.19 103.42 2c3n n GLY 38 Ca 0.13 -0.76 0.06 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.52 -1.51 115.11 117.83 2c3n h GLN 39 Ca -0.12 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.30 2c3n h GLN 39 Cb 0.59 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.28 2c3n h GLN 39 CO 0.17 0.22 0.00 -2.39 -1.93 0.00 0.00 178.83 174.90 2c3n n HIS 40 N -4.14 0.46 0.58 3.99 1.44 -1.26 -2.25 115.22 114.04 2c3n n HIS 40 Ca -0.02 0.19 0.09 0.00 -2.01 0.00 0.00 57.72 55.97 2c3n n HIS 40 Cb 0.29 -0.80 0.11 0.00 0.12 0.00 0.00 29.99 29.70 2c3n n HIS 40 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2c3n n LEU 41 N -1.93 2.71 -4.77 2.39 4.77 -0.57 -4.60 117.00 114.99 2c3n n LEU 41 Ca 0.02 -1.17 -0.34 0.00 -0.03 0.00 0.00 56.01 54.49 2c3n n LEU 41 Cb 0.18 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2c3n n LEU 41 CO 0.15 0.52 0.75 -0.94 -1.33 0.00 0.00 177.39 176.55 2c3n s SER 42 N -1.44 5.38 0.41 -1.43 1.04 -0.95 -4.92 113.70 111.79 2c3n s SER 42 Ca 0.24 2.05 0.08 0.00 0.48 0.00 0.00 55.95 58.80 2c3n s SER 42 Cb 0.16 -2.56 0.86 0.00 0.10 0.00 0.00 66.02 64.58 2c3n s SER 42 CO 0.23 -1.45 2.04 0.44 0.98 0.00 0.00 173.24 175.49 2c3n h ASP 43 N 0.50 0.48 0.00 7.02 3.32 -1.94 -2.04 116.42 123.77 2c3n h ASP 43 Ca -0.48 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 56.56 2c3n h ASP 43 Cb 1.25 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.68 2c3n h ASP 43 CO 0.55 0.34 -0.00 0.00 -1.72 0.00 0.00 179.24 178.41 2c3n h ALA 44 N 1.72 -0.00 0.00 3.45 0.00 -1.92 -2.98 119.26 119.53 2c3n h ALA 44 Ca 0.18 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2c3n h ALA 44 Cb 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2c3n h ALA 44 CO -0.04 -0.42 -0.48 0.35 0.00 0.00 0.00 179.25 178.66 2c3n h PHE 45 N -0.17 0.00 0.00 0.00 3.57 -1.74 -2.54 116.94 116.05 2c3n h PHE 45 Ca -0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2c3n h PHE 45 Cb 0.17 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 2c3n h PHE 45 CO -0.02 0.48 -0.04 0.00 -2.23 0.00 0.00 178.31 176.51 2c3n h ALA 46 N 1.52 1.76 -0.14 2.41 0.00 -1.28 0.10 119.26 123.63 2c3n h ALA 46 Ca -0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 2c3n h ALA 46 Cb 0.97 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2c3n h ALA 46 CO 0.06 0.05 -0.53 1.96 0.00 0.00 0.00 179.25 180.79 2c3n h GLN 47 N 0.00 0.40 -0.02 0.00 1.08 -1.31 -2.08 115.11 113.18 2c3n h GLN 47 Ca -0.00 -0.25 -0.02 0.00 -1.45 0.00 0.00 58.65 56.93 2c3n h GLN 47 Cb 0.08 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2c3n h GLN 47 CO 0.00 0.84 -0.08 0.28 -0.95 0.00 0.00 178.83 178.92 2c3n h VAL 48 N 0.31 1.48 -2.71 -0.54 2.07 -1.19 -3.43 116.25 112.24 2c3n h VAL 48 Ca 0.01 -1.53 -0.52 0.00 0.82 0.00 0.00 66.70 65.48 2c3n h VAL 48 Cb 1.04 2.44 -0.39 0.00 -1.52 0.00 0.00 31.29 32.86 2c3n h VAL 48 CO 0.09 0.41 -0.78 0.21 0.02 0.00 0.00 177.57 177.52 2c3n s ASN 49 N -5.98 3.31 0.66 0.57 2.47 0.21 -5.01 114.94 111.18 2c3n s ASN 49 Ca -0.16 -1.36 0.32 0.00 0.42 0.00 0.00 52.86 52.08 2c3n s ASN 49 Cb 0.01 -0.28 1.74 0.00 -1.45 0.00 0.00 41.25 41.27 2c3n s ASN 49 CO 0.70 -0.42 2.00 -0.65 -3.72 0.00 0.00 177.10 175.01 2c3n h PRO 50 N 8.22 0.00 0.00 0.43 0.11 -1.60 0.17 132.00 139.33 2c3n h PRO 50 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 2c3n h PRO 50 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2c3n h PRO 50 CO 0.41 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.48 2c3n n LEU 51 N -3.02 0.70 -3.27 2.35 4.77 -1.26 -4.94 117.00 112.33 2c3n n LEU 51 Ca -0.01 0.60 -0.21 0.00 -0.03 0.00 0.00 56.01 56.36 2c3n n LEU 51 Cb 0.35 -0.43 0.07 0.00 -2.33 0.00 0.00 43.42 41.08 2c3n n LEU 51 CO 0.16 -0.32 0.22 0.29 -1.33 0.00 0.00 177.39 176.41 2c3n n LYS 52 N -2.20 -7.10 -4.17 3.23 5.02 0.59 -5.01 118.16 108.52 2c3n n LYS 52 Ca 0.04 0.74 -0.14 0.00 -2.02 0.00 0.00 58.31 56.94 2c3n n LYS 52 Cb 0.34 -5.53 -0.11 0.00 -0.02 0.00 0.00 35.03 29.71 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 -6.12 0.84 0.21 1.97 1.02 -1.26 -4.75 119.74 111.64 2c3n s LYS 53 Ca 0.50 -1.16 0.10 0.00 0.02 0.00 0.00 55.97 55.42 2c3n s LYS 53 Cb -0.22 -0.50 -0.04 0.00 -0.52 0.00 0.00 37.83 36.55 2c3n s LYS 53 CO 0.65 0.07 -0.12 0.14 -0.92 0.00 0.00 175.35 175.17 2c3n s VAL 54 N -2.51 2.99 0.54 3.17 -7.23 -1.26 -4.43 120.40 111.67 2c3n s VAL 54 Ca 0.06 -1.85 -0.17 0.00 -1.81 0.00 0.00 61.98 58.20 2c3n s VAL 54 Cb -0.02 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.36 2c3n s VAL 54 CO -0.00 -0.18 1.03 -2.16 -0.31 0.00 0.00 175.10 173.48 2c3n s PRO 55 N -3.00 3.60 0.04 4.82 0.04 -1.26 -4.79 135.00 134.44 2c3n s PRO 55 Ca 0.26 1.19 0.03 0.00 0.04 0.00 0.00 61.00 62.52 2c3n s PRO 55 Cb -0.08 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 2c3n s PRO 55 CO 0.15 -0.58 -0.10 0.00 0.04 0.00 0.00 177.00 176.51 2c3n s ALA 56 N -2.36 0.80 -0.05 8.56 0.00 -0.82 -4.17 121.76 123.72 2c3n s ALA 56 Ca 0.64 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.94 2c3n s ALA 56 Cb -0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 2c3n s ALA 56 CO 0.31 0.10 -0.22 -1.17 0.00 0.00 0.00 175.76 174.77 2c3n s LEU 57 N -1.21 2.26 -0.04 0.00 0.20 0.39 -0.48 118.68 119.79 2c3n s LEU 57 Ca -0.03 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.39 2c3n s LEU 57 Cb -0.08 -1.42 0.02 0.00 -0.43 0.00 0.00 46.19 44.28 2c3n s LEU 57 CO 0.01 0.29 -0.06 -0.75 -0.29 0.00 0.00 176.35 175.55 2c3n s LYS 58 N -0.44 0.95 -0.38 1.98 2.47 -0.43 -0.91 119.74 122.97 2c3n s LYS 58 Ca 0.05 -0.17 0.02 0.00 -1.56 0.00 0.00 55.97 54.32 2c3n s LYS 58 Cb -0.12 -0.90 0.16 0.00 -1.46 0.00 0.00 37.83 35.51 2c3n s LYS 58 CO 0.01 -0.04 0.31 0.34 0.16 0.00 0.00 175.35 176.13 2c3n s ASP 59 N 0.78 1.87 1.87 1.43 -1.08 0.26 -0.46 116.67 121.33 2c3n s ASP 59 Ca -0.11 -2.39 0.00 0.00 -0.52 0.00 0.00 52.55 49.53 2c3n s ASP 59 Cb -0.14 -0.13 0.00 0.00 -1.46 0.00 0.00 42.92 41.19 2c3n s ASP 59 CO 0.01 -0.24 0.00 0.61 0.52 0.00 0.00 175.17 176.07 2c3n n GLY 60 N 3.58 3.72 0.00 2.66 0.00 -1.26 -2.06 105.19 111.83 2c3n n GLY 60 Ca 0.19 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.31 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 7.39 0.00 -4.68 1.61 8.00 -1.26 -4.80 116.55 122.81 2c3n n ASP 61 Ca 0.00 -0.16 -0.37 0.00 0.71 0.00 0.00 54.79 54.96 2c3n n ASP 61 Cb 0.00 -0.27 -0.08 0.00 -0.02 0.00 0.00 41.12 40.75 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 3.37 -0.03 1.24 5.36 -0.87 -5.07 117.98 119.45 2c3n s PHE 62 Ca 0.28 0.50 0.06 0.00 -0.96 0.00 0.00 56.93 56.80 2c3n s PHE 62 Cb 0.19 -2.42 -0.01 0.00 -0.34 0.00 0.00 43.02 40.44 2c3n s PHE 62 CO 0.42 0.06 -0.20 0.99 -1.46 0.00 0.00 175.22 175.03 2c3n s THR 63 N 1.07 1.61 -0.01 0.12 2.01 -1.26 -0.58 115.64 118.61 2c3n s THR 63 Ca 0.15 -0.85 0.00 0.00 0.31 0.00 0.00 61.69 61.30 2c3n s THR 63 Cb -0.14 -1.36 0.01 0.00 0.01 0.00 0.00 72.50 71.02 2c3n s THR 63 CO 0.06 0.46 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.22 2c3n s LEU 64 N -0.30 1.75 0.47 4.42 2.96 -0.09 -5.00 118.68 122.90 2c3n s LEU 64 Ca 0.03 -0.01 0.04 0.00 -0.22 0.00 0.00 54.13 53.97 2c3n s LEU 64 Cb -0.10 -0.08 -0.03 0.00 0.50 0.00 0.00 46.19 46.49 2c3n s LEU 64 CO 0.01 -0.02 0.08 0.42 -1.32 0.00 0.00 176.35 175.52 2c3n s THR 65 N 0.28 1.64 0.02 3.68 -4.23 -1.26 -0.47 115.64 115.30 2c3n s THR 65 Ca -0.02 -1.89 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2c3n s THR 65 Cb -0.04 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.28 2c3n s THR 65 CO -0.01 0.00 0.00 -0.62 -0.54 0.00 0.00 174.62 173.45 2c3n n GLU 66 N -1.24 -0.86 -0.25 3.99 -0.58 -1.26 -4.34 120.64 116.10 2c3n n GLU 66 Ca -0.10 1.03 0.06 0.00 -0.42 0.00 0.00 57.16 57.73 2c3n n GLU 66 Cb 0.66 -0.89 0.19 0.00 -0.57 0.00 0.00 31.44 30.83 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 0.68 0.06 -0.41 1.62 4.64 -1.91 0.55 113.55 118.78 2c3n h SER 67 Ca 0.00 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2c3n h SER 67 Cb 0.00 0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 2c3n h SER 67 CO 0.00 -0.02 0.27 0.58 -0.87 0.00 0.00 176.83 176.80 2c3n h VAL 68 N 0.30 1.11 -0.55 0.95 2.07 -1.97 0.71 116.25 118.87 2c3n h VAL 68 Ca 0.42 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.70 2c3n h VAL 68 Cb 0.71 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2c3n h VAL 68 CO -0.49 0.10 0.16 0.00 0.02 0.00 0.00 177.57 177.36 2c3n h ALA 69 N 1.15 0.72 -0.14 1.67 0.00 -1.54 -1.80 119.26 119.32 2c3n h ALA 69 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2c3n h ALA 69 Cb -0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2c3n h ALA 69 CO -0.03 0.39 0.08 0.82 0.00 0.00 0.00 179.25 180.50 2c3n h ILE 70 N 0.76 1.01 -0.68 0.00 2.04 -0.59 0.34 117.51 120.39 2c3n h ILE 70 Ca 0.17 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2c3n h ILE 70 Cb 0.30 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2c3n h ILE 70 CO -0.00 0.03 0.42 -0.07 0.00 0.00 0.00 178.15 178.52 2c3n h LEU 71 N 0.16 0.82 -0.61 1.44 3.38 -0.72 -0.20 115.31 119.58 2c3n h LEU 71 Ca 0.05 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2c3n h LEU 71 Cb -0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2c3n h LEU 71 CO -0.03 0.64 -0.26 -0.07 0.09 0.00 0.00 178.44 178.81 2c3n h LEU 72 N 0.93 0.85 -0.33 1.67 3.38 -1.21 -1.17 115.31 119.43 2c3n h LEU 72 Ca 0.25 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2c3n h LEU 72 Cb -0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2c3n h LEU 72 CO -0.05 1.06 0.18 0.22 0.09 0.00 0.00 178.44 179.95 2c3n h TYR 73 N 0.71 0.45 -0.74 1.13 5.03 -0.60 -2.02 116.97 120.91 2c3n h TYR 73 Ca 0.09 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.32 2c3n h TYR 73 Cb 0.80 -0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.91 2c3n h TYR 73 CO 0.04 0.36 0.22 -0.07 -1.32 0.00 0.00 178.16 177.40 2c3n h LEU 74 N 0.41 1.09 -0.52 2.82 3.38 -0.92 0.41 115.31 121.97 2c3n h LEU 74 Ca 0.11 -0.21 0.08 0.00 0.09 0.00 0.00 57.88 57.95 2c3n h LEU 74 Cb 0.06 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.46 2c3n h LEU 74 CO -0.02 1.02 0.18 0.74 0.09 0.00 0.00 178.44 180.45 2c3n h THR 75 N 1.11 0.80 0.09 0.22 2.02 -1.06 -1.40 112.91 114.68 2c3n h THR 75 Ca 0.24 -0.12 -0.18 0.00 0.77 0.00 0.00 66.41 67.12 2c3n h THR 75 Cb 0.32 0.42 0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2c3n h THR 75 CO -0.01 0.06 -0.74 0.03 0.37 0.00 0.00 175.52 175.24 2c3n h ARG 76 N 0.35 0.35 -0.42 6.66 3.08 -1.04 -2.66 114.38 120.70 2c3n h ARG 76 Ca 0.26 -0.49 -0.13 0.00 0.07 0.00 0.00 59.98 59.68 2c3n h ARG 76 Cb 0.29 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2c3n h ARG 76 CO -0.27 1.19 -0.27 -0.22 -1.07 0.00 0.00 179.97 179.34 2c3n h LYS 77 N -0.25 0.90 -0.15 0.04 3.64 -0.89 -3.23 116.57 116.63 2c3n h LYS 77 Ca -0.12 -0.40 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2c3n h LYS 77 Cb 1.52 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.32 2c3n h LYS 77 CO 0.14 1.05 0.00 0.66 -2.27 0.00 0.00 179.45 179.03 2c3n n TYR 78 N -4.09 0.17 -3.65 1.91 4.02 -0.53 -4.97 117.16 110.01 2c3n n TYR 78 Ca -0.00 -0.08 -0.21 0.00 -0.01 0.00 0.00 57.90 57.59 2c3n n TYR 78 Cb 0.48 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.84 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 1.24 -5.37 -0.81 -0.72 5.02 -1.01 -4.95 118.16 111.56 2c3n n LYS 79 Ca 0.16 0.67 -0.28 0.00 -2.02 0.00 0.00 58.31 56.84 2c3n n LYS 79 Cb 0.57 -5.35 0.23 0.00 -0.02 0.00 0.00 35.03 30.45 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 -3.58 1.94 0.48 -0.18 -7.23 -1.19 -4.96 120.40 105.67 2c3n s VAL 80 Ca 0.05 0.00 -0.22 0.00 -1.81 0.00 0.00 61.98 60.00 2c3n s VAL 80 Cb -0.02 -2.26 -0.09 0.00 0.56 0.00 0.00 36.38 34.56 2c3n s VAL 80 CO 0.79 0.00 0.93 -2.65 -0.31 0.00 0.00 175.10 173.86 2c3n n PRO 81 N -4.69 1.13 0.08 4.82 -0.02 -1.26 -4.87 135.00 130.19 2c3n n PRO 81 Ca 0.05 0.41 0.11 0.00 -2.02 0.00 0.00 63.50 62.05 2c3n n PRO 81 Cb 0.56 -2.01 0.45 0.00 -0.02 0.00 0.00 33.50 32.48 2c3n n PRO 81 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2c3n n ASP 82 N 0.25 0.48 0.26 2.55 8.00 -1.26 -2.84 116.55 123.99 2c3n n ASP 82 Ca 0.11 0.59 0.13 0.00 0.71 0.00 0.00 54.79 56.33 2c3n n ASP 82 Cb 0.42 -0.70 0.69 0.00 -0.02 0.00 0.00 41.12 41.50 2c3n n ASP 82 CO 0.00 0.00 0.00 0.10 -0.39 0.00 0.00 177.20 176.91 2c3n h TYR 83 N 0.00 0.00 -0.71 1.24 -0.00 -1.89 -3.10 116.97 112.51 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 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.13 2c3n h TYR 83 CO 0.00 0.13 0.21 -1.49 -0.00 0.00 0.00 178.16 177.01 2c3n h TRP 84 N 0.00 1.16 -2.79 0.10 4.06 -1.70 -3.34 115.95 113.44 2c3n h TRP 84 Ca -0.00 -0.12 -0.60 0.00 2.06 0.00 0.00 58.89 60.23 2c3n h TRP 84 Cb 0.44 -0.33 -0.40 0.00 -1.00 0.00 0.00 29.16 27.87 2c3n h TRP 84 CO 0.00 0.92 -0.79 -0.47 -3.56 0.00 0.00 178.44 174.54 2c3n s TYR 85 N -5.39 1.66 0.58 0.49 5.04 -1.18 -0.75 117.35 117.81 2c3n s TYR 85 Ca -0.12 -2.30 -0.20 0.00 -2.44 0.00 0.00 57.07 52.01 2c3n s TYR 85 Cb 0.15 -1.56 -0.04 0.00 0.35 0.00 0.00 41.96 40.86 2c3n s TYR 85 CO 0.84 -0.78 1.32 -1.25 -1.34 0.00 0.00 175.55 174.34 2c3n s PRO 86 N 0.31 2.94 0.18 4.97 0.04 -1.19 -4.93 135.00 137.32 2c3n s PRO 86 Ca 0.21 2.13 0.07 0.00 0.04 0.00 0.00 61.00 63.45 2c3n s PRO 86 Cb -0.17 -2.09 0.04 0.00 0.04 0.00 0.00 34.50 32.31 2c3n s PRO 86 CO -0.05 -1.31 1.42 1.96 0.04 0.00 0.00 177.00 179.06 2c3n h GLN 87 N 1.11 0.04 -6.73 4.56 4.20 -1.95 -3.33 115.11 113.01 2c3n h GLN 87 Ca -0.51 -0.04 -0.53 0.00 0.06 0.00 0.00 58.65 57.63 2c3n h GLN 87 Cb 1.31 0.01 0.07 0.00 0.30 0.00 0.00 27.48 29.17 2c3n h GLN 87 CO 0.56 0.85 0.93 0.34 -0.67 0.00 0.00 178.83 180.84 2c3n s ASP 88 N -6.80 6.40 0.24 1.46 2.15 -1.26 -4.84 116.67 114.01 2c3n s ASP 88 Ca -0.01 2.88 -0.06 0.00 0.43 0.00 0.00 52.55 55.80 2c3n s ASP 88 Cb 0.11 -2.62 0.42 0.00 -0.30 0.00 0.00 42.92 40.53 2c3n s ASP 88 CO 0.80 -0.92 1.71 0.25 -0.17 0.00 0.00 175.17 176.84 2c3n h LEU 89 N 5.76 0.16 0.02 -1.34 5.85 -1.99 0.72 115.31 124.50 2c3n h LEU 89 Ca -0.45 0.12 -0.28 0.00 0.84 0.00 0.00 57.88 58.11 2c3n h LEU 89 Cb 1.21 0.12 0.02 0.00 0.37 0.00 0.00 40.66 42.39 2c3n h LEU 89 CO 0.87 0.05 -1.10 1.56 -0.34 0.00 0.00 178.44 179.48 2c3n h GLN 90 N 0.36 0.68 -0.56 1.25 4.20 -1.95 -1.18 115.11 117.90 2c3n h GLN 90 Ca 0.39 -0.77 -0.03 0.00 0.06 0.00 0.00 58.65 58.31 2c3n h GLN 90 Cb 0.61 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.59 2c3n h GLN 90 CO -0.42 1.34 0.25 0.00 -0.67 0.00 0.00 178.83 179.33 2c3n h ALA 91 N 0.38 0.73 -0.65 3.87 0.00 -1.80 -0.70 119.26 121.10 2c3n h ALA 91 Ca -0.14 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.65 2c3n h ALA 91 Cb 1.75 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 19.28 2c3n h ALA 91 CO 0.21 0.31 0.40 -0.09 0.00 0.00 0.00 179.25 180.09 2c3n h ARG 92 N 0.77 0.77 -0.96 0.00 2.43 -0.84 -1.79 114.38 114.77 2c3n h ARG 92 Ca 0.19 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.38 2c3n h ARG 92 Cb 0.15 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.46 2c3n h ARG 92 CO -0.02 0.51 0.62 0.00 -1.51 0.00 0.00 179.97 179.58 2c3n h ALA 93 N 1.28 1.45 -0.34 2.80 0.00 -0.80 -0.26 119.26 123.38 2c3n h ALA 93 Ca 0.26 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2c3n h ALA 93 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2c3n h ALA 93 CO -0.10 0.41 0.01 0.00 0.00 0.00 0.00 179.25 179.56 2c3n h ARG 94 N 1.11 0.53 -0.05 0.00 3.08 -0.33 0.14 114.38 118.86 2c3n h ARG 94 Ca 0.41 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.33 2c3n h ARG 94 Cb 0.18 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 2c3n h ARG 94 CO -0.16 0.55 -0.06 0.28 -1.07 0.00 0.00 179.97 179.50 2c3n h VAL 95 N 0.51 1.40 -0.97 2.04 2.07 -0.56 -1.85 116.25 118.88 2c3n h VAL 95 Ca 0.11 -1.28 0.09 0.00 0.82 0.00 0.00 66.70 66.43 2c3n h VAL 95 Cb 0.32 2.15 -0.07 0.00 -1.52 0.00 0.00 31.29 32.16 2c3n h VAL 95 CO 0.01 0.35 0.62 0.44 0.02 0.00 0.00 177.57 179.01 2c3n h ASP 96 N -0.35 0.95 -0.08 0.57 3.32 -0.76 -0.27 116.42 119.80 2c3n h ASP 96 Ca 0.01 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 2c3n h ASP 96 Cb 0.60 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 2c3n h ASP 96 CO 0.01 0.57 0.02 -0.08 -1.72 0.00 0.00 179.24 178.04 2c3n h GLU 97 N 1.05 0.12 -0.28 3.56 4.81 -0.65 -0.20 114.58 123.00 2c3n h GLU 97 Ca 0.44 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.64 2c3n h GLU 97 Cb 0.31 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2c3n h GLU 97 CO -0.20 0.32 0.17 -0.92 -0.73 0.00 0.00 179.01 177.65 2c3n h TYR 98 N -0.09 0.37 -0.62 0.92 3.20 -0.92 0.16 116.97 120.00 2c3n h TYR 98 Ca 0.02 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2c3n h TYR 98 Cb 0.25 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 2c3n h TYR 98 CO 0.01 0.28 0.35 -0.07 -1.64 0.00 0.00 178.16 177.09 2c3n h LEU 99 N 0.36 0.75 -0.06 2.82 3.38 -0.89 -0.55 115.31 121.12 2c3n h LEU 99 Ca 0.10 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2c3n h LEU 99 Cb 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2c3n h LEU 99 CO -0.02 0.60 -0.25 0.00 0.09 0.00 0.00 178.44 178.86 2c3n h ALA 100 N 1.52 0.12 -0.91 1.53 0.00 -0.75 -3.32 119.26 117.45 2c3n h ALA 100 Ca 0.22 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.74 2c3n h ALA 100 Cb 0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2c3n h ALA 100 CO -0.04 0.12 0.59 2.35 0.00 0.00 0.00 179.25 182.27 2c3n h TRP 101 N -0.23 1.12 0.00 0.00 7.01 -0.42 -3.09 115.95 120.34 2c3n h TRP 101 Ca -0.01 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.98 2c3n h TRP 101 Cb 0.89 -0.38 -0.00 0.00 -2.10 0.00 0.00 29.16 27.57 2c3n h TRP 101 CO 0.13 0.68 -0.14 -0.56 -2.79 0.00 0.00 178.44 175.76 2c3n h GLN 102 N 1.18 0.00 -0.89 2.65 -0.00 -1.21 -3.24 115.11 113.60 2c3n h GLN 102 Ca 0.35 0.00 0.09 0.00 -0.00 0.00 0.00 58.65 59.09 2c3n h GLN 102 Cb -0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 27.48 27.34 2c3n h GLN 102 CO -0.10 0.14 0.54 0.45 -0.00 0.00 0.00 178.83 179.87 2c3n h HIS 103 N 0.00 0.99 -0.30 0.06 3.86 -1.69 -1.53 115.15 116.55 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 0.47 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.63 2c3n h HIS 103 CO 0.00 0.44 0.00 0.25 0.86 0.00 0.00 177.93 179.48 2c3n n THR 104 N -4.66 0.58 0.00 2.45 -2.24 -1.22 -4.22 114.28 104.97 2c3n n THR 104 Ca 0.15 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 2c3n n THR 104 Cb 0.26 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 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 0.93 0.00 -0.21 4.28 -2.24 -1.02 -4.74 114.28 111.28 2c3n n THR 105 Ca 0.14 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.83 2c3n n THR 105 Cb 0.46 -0.01 0.03 0.00 -2.10 0.00 0.00 70.33 68.71 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 1.06 -0.31 3.22 5.85 -1.80 -0.82 115.31 122.52 2c3n h LEU 106 Ca 0.00 -0.30 0.06 0.00 0.84 0.00 0.00 57.88 58.47 2c3n h LEU 106 Cb 0.00 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 40.69 2c3n h LEU 106 CO 0.00 1.11 -0.04 -0.09 -0.34 0.00 0.00 178.44 179.08 2c3n h ARG 107 N 0.99 0.04 -0.53 1.25 2.43 -1.54 -0.65 114.38 116.37 2c3n h ARG 107 Ca 0.17 -0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.26 2c3n h ARG 107 Cb 0.57 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2c3n h ARG 107 CO 0.03 0.03 0.01 -0.09 -1.51 0.00 0.00 179.97 178.44 2c3n h ARG 108 N 0.04 0.93 -0.38 0.20 2.43 -1.62 -1.68 114.38 114.30 2c3n h ARG 108 Ca 0.15 -0.29 -0.15 0.00 -0.81 0.00 0.00 59.98 58.88 2c3n h ARG 108 Cb 0.21 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2c3n h ARG 108 CO -0.28 0.94 -0.36 0.66 -1.51 0.00 0.00 179.97 179.42 2c3n h SER 109 N 0.80 0.95 -0.48 -3.80 4.64 -0.94 -0.37 113.55 114.34 2c3n h SER 109 Ca 0.15 -0.42 -0.08 0.00 -0.47 0.00 0.00 61.79 60.97 2c3n h SER 109 Cb 0.52 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 2c3n h SER 109 CO 0.03 1.21 -0.00 0.00 -0.87 0.00 0.00 176.83 177.19 2c3n h LEU 111 N 0.72 0.12 -1.08 0.00 5.85 -1.14 -2.51 115.31 117.27 2c3n h LEU 111 Ca 0.14 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 2c3n h LEU 111 Cb 0.52 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 2c3n h LEU 111 CO 0.03 0.13 0.07 0.03 -0.34 0.00 0.00 178.44 178.36 2c3n h ARG 112 N 0.09 0.73 -0.39 1.25 3.08 -0.98 -2.16 114.38 116.01 2c3n h ARG 112 Ca 0.03 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2c3n h ARG 112 Cb 0.04 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2c3n h ARG 112 CO -0.01 0.69 0.21 0.00 -1.07 0.00 0.00 179.97 179.80 2c3n h ALA 113 N 1.38 0.50 -0.34 0.04 0.00 -1.09 0.23 119.26 119.98 2c3n h ALA 113 Ca 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2c3n h ALA 113 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2c3n h ALA 113 CO 0.00 0.03 0.12 1.25 0.00 0.00 0.00 179.25 180.66 2c3n h LEU 114 N 0.50 0.49 -0.21 0.00 5.85 -1.07 -1.31 115.31 119.55 2c3n h LEU 114 Ca 0.14 -0.18 -0.15 0.00 0.84 0.00 0.00 57.88 58.52 2c3n h LEU 114 Cb 0.06 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2c3n h LEU 114 CO -0.02 0.54 -0.46 -0.50 -0.34 0.00 0.00 178.44 177.66 2c3n h TRP 115 N 0.40 0.87 -0.04 1.25 4.06 -1.21 -0.96 115.95 120.32 2c3n h TRP 115 Ca 0.11 -0.32 -0.16 0.00 2.06 0.00 0.00 58.89 60.58 2c3n h TRP 115 Cb 0.21 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 2c3n h TRP 115 CO 0.00 1.10 -0.70 0.45 -3.56 0.00 0.00 178.44 175.73 2c3n h HIS 116 N 0.39 0.27 0.17 0.49 3.86 -0.53 0.25 115.15 120.05 2c3n h HIS 116 Ca 0.00 -0.12 -0.31 0.00 -1.16 0.00 0.00 60.37 58.79 2c3n h HIS 116 Cb 1.06 -0.04 0.01 0.00 1.06 0.00 0.00 27.41 29.50 2c3n h HIS 116 CO 0.09 0.83 -1.42 -0.22 0.86 0.00 0.00 177.93 178.06 2c3n h LYS 117 N 0.14 0.36 0.00 2.45 3.64 -1.25 -3.44 116.57 118.46 2c3n h LYS 117 Ca -0.02 -0.61 0.00 0.00 -1.27 0.00 0.00 60.65 58.75 2c3n h LYS 117 Cb 1.24 0.23 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 2c3n h LYS 117 CO 0.11 1.27 -0.31 0.28 -2.27 0.00 0.00 179.45 178.53 2c3n n VAL 118 N -3.57 0.22 0.04 2.00 0.31 -0.46 -4.77 118.33 112.09 2c3n n VAL 118 Ca -0.14 0.07 -0.06 0.00 -0.01 0.00 0.00 64.34 64.20 2c3n n VAL 118 Cb 1.06 -1.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.10 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 0.42 0.64 5.55 2.86 -1.18 -0.37 114.93 122.85 2c3n h MET 119 Ca 0.00 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.37 2c3n h MET 119 Cb 0.31 0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.00 2c3n h MET 119 CO 0.00 0.83 -0.31 0.74 1.06 0.00 0.00 176.91 179.23 2c3n h PHE 120 N 0.33 -0.79 -0.73 -0.22 0.05 -1.20 -1.20 116.94 113.18 2c3n h PHE 120 Ca 0.01 -0.02 -0.04 0.00 3.82 0.00 0.00 57.97 61.75 2c3n h PHE 120 Cb 1.00 0.26 -0.03 0.00 2.00 0.00 0.00 35.95 39.18 2c3n h PHE 120 CO 0.03 -0.49 0.31 -1.00 -0.18 0.00 0.00 178.31 176.98 2c3n h PRO 121 N -1.13 1.06 0.00 1.51 0.13 -1.39 0.18 132.00 132.35 2c3n h PRO 121 Ca -0.09 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2c3n h PRO 121 Cb 0.66 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.60 2c3n h PRO 121 CO 0.14 0.84 -0.15 0.28 -0.23 0.00 0.00 178.00 178.88 2c3n h VAL 122 N 1.04 0.00 -0.19 1.56 2.07 -1.20 -3.23 116.25 116.31 2c3n h VAL 122 Ca 0.25 -0.46 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 2c3n h VAL 122 Cb 0.16 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2c3n h VAL 122 CO -0.03 0.00 -0.07 0.15 0.02 0.00 0.00 177.57 177.64 2c3n h PHE 123 N -0.46 0.43 -0.01 1.57 3.57 -1.55 -3.27 116.94 117.22 2c3n h PHE 123 Ca 0.00 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.40 2c3n h PHE 123 Cb 0.15 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.79 2c3n h PHE 123 CO -0.07 0.67 -0.41 1.28 -2.23 0.00 0.00 178.31 177.55 2c3n n LEU 124 N -4.61 1.28 -2.75 0.59 4.77 -0.49 -0.68 117.00 115.11 2c3n n LEU 124 Ca -0.05 -0.41 -0.21 0.00 -0.03 0.00 0.00 56.01 55.31 2c3n n LEU 124 Cb 0.30 -0.09 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2c3n n LEU 124 CO 0.38 0.25 -0.12 0.61 -1.33 0.00 0.00 177.39 177.18 2c3n n GLY 125 N 1.39 -0.51 3.21 -0.72 0.00 -0.50 -4.96 105.19 103.09 2c3n n GLY 125 Ca 0.10 0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 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 -5.42 2.44 0.49 1.61 0.41 0.50 -4.94 118.70 113.80 2c3n s GLU 126 Ca 0.17 -1.33 -0.23 0.00 -0.41 0.00 0.00 54.97 53.17 2c3n s GLU 126 Cb -0.08 -3.38 -0.06 0.00 -1.78 0.00 0.00 34.13 28.83 2c3n s GLU 126 CO 0.21 -0.73 1.31 -2.14 -0.49 0.00 0.00 175.26 173.43 2c3n s PRO 127 N 1.30 3.47 -0.11 0.39 0.02 -1.26 -2.16 135.00 136.65 2c3n s PRO 127 Ca -0.01 2.14 0.01 0.00 0.02 0.00 0.00 61.00 63.16 2c3n s PRO 127 Cb -0.20 -2.41 -0.01 0.00 0.02 0.00 0.00 34.50 31.89 2c3n s PRO 127 CO 0.00 -0.90 -0.16 0.08 -0.33 0.00 0.00 177.00 175.70 2c3n s VAL 128 N -1.34 2.81 0.48 3.83 1.01 -1.26 -4.93 120.40 121.00 2c3n s VAL 128 Ca 0.66 -0.76 -0.24 0.00 0.00 0.00 0.00 61.98 61.64 2c3n s VAL 128 Cb -0.38 -2.15 -0.07 0.00 0.00 0.00 0.00 36.38 33.78 2c3n s VAL 128 CO 0.46 0.54 1.40 -0.94 0.00 0.00 0.00 175.10 176.56 2c3n s SER 129 N 0.24 5.71 0.43 3.32 1.04 -1.26 -4.85 113.70 118.33 2c3n s SER 129 Ca -0.11 2.87 0.17 0.00 0.48 0.00 0.00 55.95 59.36 2c3n s SER 129 Cb -0.16 -2.65 1.07 0.00 0.10 0.00 0.00 66.02 64.39 2c3n s SER 129 CO 0.06 -1.29 1.90 -0.65 0.98 0.00 0.00 173.24 174.24 2c3n h PRO 130 N 2.08 0.39 -0.11 4.02 0.11 -1.99 -1.91 132.00 134.59 2c3n h PRO 130 Ca -0.51 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.39 2c3n h PRO 130 Cb 1.28 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2c3n h PRO 130 CO 0.60 0.26 -0.70 1.96 -0.21 0.00 0.00 178.00 179.91 2c3n h GLN 131 N 0.40 0.50 0.16 1.05 4.20 -1.98 0.36 115.11 119.80 2c3n h GLN 131 Ca 0.40 -0.39 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 2c3n h GLN 131 Cb 0.98 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2c3n h GLN 131 CO -0.13 1.01 -0.08 1.15 -0.67 0.00 0.00 178.83 180.11 2c3n h THR 132 N 0.35 0.90 -0.58 -0.54 2.02 -1.82 -1.79 112.91 111.44 2c3n h THR 132 Ca -0.03 -0.28 0.02 0.00 0.77 0.00 0.00 66.41 66.89 2c3n h THR 132 Cb 1.28 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 2c3n h THR 132 CO 0.13 0.07 0.37 0.25 0.37 0.00 0.00 175.52 176.70 2c3n h LEU 133 N -0.35 0.61 -0.72 2.58 5.85 -1.33 -1.96 115.31 119.98 2c3n h LEU 133 Ca -0.02 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.71 2c3n h LEU 133 Cb 0.28 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2c3n h LEU 133 CO 0.04 0.43 0.47 0.00 -0.34 0.00 0.00 178.44 179.04 2c3n h ALA 134 N 1.24 0.93 -0.59 1.25 0.00 -0.87 0.08 119.26 121.31 2c3n h ALA 134 Ca 0.23 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2c3n h ALA 134 Cb -0.02 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 2c3n h ALA 134 CO -0.08 0.29 0.34 0.00 0.00 0.00 0.00 179.25 179.80 2c3n h ALA 135 N 1.29 0.76 -0.39 0.00 0.00 -1.14 0.85 119.26 120.63 2c3n h ALA 135 Ca 0.28 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 2c3n h ALA 135 Cb -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2c3n h ALA 135 CO -0.08 0.03 -0.03 1.15 0.00 0.00 0.00 179.25 180.32 2c3n h THR 136 N 0.65 1.27 -0.02 0.00 2.02 -0.71 -1.23 112.91 114.88 2c3n h THR 136 Ca 0.25 -1.06 -0.11 0.00 0.77 0.00 0.00 66.41 66.26 2c3n h THR 136 Cb 0.09 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 2c3n h THR 136 CO -0.13 0.36 -0.50 -0.07 0.37 0.00 0.00 175.52 175.55 2c3n h LEU 137 N 0.52 0.07 -0.63 2.58 3.38 -0.83 -0.90 115.31 119.50 2c3n h LEU 137 Ca 0.11 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 2c3n h LEU 137 Cb 0.52 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2c3n h LEU 137 CO 0.03 0.55 0.04 0.00 0.09 0.00 0.00 178.44 179.15 2c3n h ALA 138 N 1.45 0.84 -0.56 1.53 0.00 -0.57 -1.50 119.26 120.45 2c3n h ALA 138 Ca -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2c3n h ALA 138 Cb 0.89 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2c3n h ALA 138 CO 0.07 0.66 0.22 1.49 0.00 0.00 0.00 179.25 181.69 2c3n h GLU 139 N 0.99 0.83 -0.74 0.00 4.81 -0.99 -2.00 114.58 117.47 2c3n h GLU 139 Ca 0.18 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 2c3n h GLU 139 Cb 0.52 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 2c3n h GLU 139 CO 0.02 0.72 0.48 1.25 -0.73 0.00 0.00 179.01 180.75 2c3n h LEU 140 N 0.76 0.81 -0.75 1.64 5.85 -0.89 -2.34 115.31 120.38 2c3n h LEU 140 Ca 0.19 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.91 2c3n h LEU 140 Cb 0.20 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2c3n h LEU 140 CO -0.02 0.57 0.49 0.44 -0.34 0.00 0.00 178.44 179.59 2c3n h ASP 141 N 0.96 0.83 -0.46 1.25 5.19 -0.83 -0.42 116.42 122.94 2c3n h ASP 141 Ca 0.29 -0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.71 2c3n h ASP 141 Cb -0.04 -0.20 -0.03 0.00 0.18 0.00 0.00 39.33 39.23 2c3n h ASP 141 CO -0.09 0.59 0.25 0.58 -3.12 0.00 0.00 179.24 177.46 2c3n h VAL 142 N 0.98 1.01 -0.26 -1.35 2.07 -1.00 -0.92 116.25 116.79 2c3n h VAL 142 Ca 0.29 -0.17 -0.11 0.00 0.82 0.00 0.00 66.70 67.53 2c3n h VAL 142 Cb -0.06 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2c3n h VAL 142 CO -0.08 0.09 -0.29 0.71 0.02 0.00 0.00 177.57 178.02 2c3n h THR 143 N 0.51 1.28 -0.32 2.57 1.35 -0.98 -2.16 112.91 115.16 2c3n h THR 143 Ca 0.19 -1.35 -0.10 0.00 -0.55 0.00 0.00 66.41 64.60 2c3n h THR 143 Cb 0.05 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 67.85 2c3n h THR 143 CO -0.11 0.43 -0.21 -0.07 -0.25 0.00 0.00 175.52 175.32 2c3n h LEU 144 N 0.46 0.60 -0.65 3.87 3.38 -0.70 -0.34 115.31 121.93 2c3n h LEU 144 Ca 0.06 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 2c3n h LEU 144 Cb 0.73 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 2c3n h LEU 144 CO 0.06 0.81 0.11 -0.61 0.09 0.00 0.00 178.44 178.90 2c3n h GLN 145 N 0.54 1.07 -0.61 1.13 5.75 -0.85 -1.99 115.11 120.15 2c3n h GLN 145 Ca 0.08 -0.28 -0.06 0.00 -0.15 0.00 0.00 58.65 58.24 2c3n h GLN 145 Cb 0.65 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.05 2c3n h GLN 145 CO 0.05 0.99 0.14 -0.07 -2.65 0.00 0.00 178.83 177.28 2c3n h LEU 146 N 0.99 0.93 -0.65 -2.39 3.38 -1.15 0.20 115.31 116.62 2c3n h LEU 146 Ca 0.20 -0.24 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2c3n h LEU 146 Cb 0.43 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.86 2c3n h LEU 146 CO 0.01 0.93 0.27 0.25 0.09 0.00 0.00 178.44 179.98 2c3n h LEU 147 N 0.89 0.29 0.18 1.67 5.85 -0.81 0.83 115.31 124.20 2c3n h LEU 147 Ca 0.19 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 2c3n h LEU 147 Cb 0.37 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.44 2c3n h LEU 147 CO 0.00 0.16 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.85 2c3n h GLU 148 N 0.46 -0.23 0.17 1.25 5.08 -1.07 -0.98 114.58 119.25 2c3n h GLU 148 Ca 0.33 0.02 -0.30 0.00 -1.00 0.00 0.00 59.36 58.40 2c3n h GLU 148 Cb 0.41 0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.72 2c3n h GLU 148 CO -0.31 0.12 -1.40 -0.44 -1.00 0.00 0.00 179.01 175.98 2c3n h ASP 149 N -0.62 0.55 0.09 1.42 3.32 -0.35 0.45 116.42 121.28 2c3n h ASP 149 Ca -0.02 -0.62 -0.31 0.00 0.02 0.00 0.00 57.03 56.09 2c3n h ASP 149 Cb 0.46 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2c3n h ASP 149 CO 0.04 1.50 -1.66 0.50 -1.72 0.00 0.00 179.24 177.90 2c3n h LYS 150 N 0.10 0.19 0.00 3.56 1.63 -1.04 -3.43 116.57 117.58 2c3n h LYS 150 Ca -0.20 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 2c3n h LYS 150 Cb 2.04 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 33.79 2c3n h LYS 150 CO 0.21 1.15 -0.56 1.19 -3.45 0.00 0.00 179.45 178.00 2c3n n PHE 151 N -3.85 0.12 0.09 1.91 3.72 -1.13 -4.75 117.46 113.57 2c3n n PHE 151 Ca -0.30 0.05 -0.13 0.00 -0.05 0.00 0.00 57.45 57.02 2c3n n PHE 151 Cb 0.91 -0.36 -0.08 0.00 -0.94 0.00 0.00 39.48 39.01 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 -0.62 -0.22 0.00 4.37 5.85 -1.22 -3.43 115.31 120.04 2c3n h LEU 152 Ca 0.00 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2c3n h LEU 152 Cb 0.56 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2c3n h LEU 152 CO 0.00 0.16 0.00 0.00 -0.34 0.00 0.00 178.44 178.26 2c3n n GLN 153 N -5.04 0.00 -0.65 1.25 6.02 0.15 -1.83 117.38 117.28 2c3n n GLN 153 Ca -0.09 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 56.99 2c3n n GLN 153 Cb 0.24 0.00 0.36 0.00 1.02 0.00 0.00 30.24 31.86 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 3.63 4.87 -4.92 1.08 3.02 -1.26 -4.99 115.26 116.69 2c3n n ASN 154 Ca 0.00 -2.53 -0.26 0.00 -0.03 0.00 0.00 54.58 51.76 2c3n n ASN 154 Cb 0.00 -0.59 0.04 0.00 -0.61 0.00 0.00 39.78 38.63 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 -2.00 2.66 0.14 3.52 1.02 -0.76 -5.00 119.74 119.32 2c3n s LYS 155 Ca 0.51 -0.08 -0.12 0.00 0.02 0.00 0.00 55.97 56.30 2c3n s LYS 155 Cb 0.34 -2.23 -0.03 0.00 -0.52 0.00 0.00 37.83 35.39 2c3n s LYS 155 CO 0.23 -0.90 1.50 0.00 -0.92 0.00 0.00 175.35 175.26 2c3n h ALA 156 N -0.34 0.58 -1.97 5.17 0.00 -1.87 -3.47 119.26 117.36 2c3n h ALA 156 Ca -0.45 -0.40 -0.50 0.00 0.00 0.00 0.00 54.91 53.57 2c3n h ALA 156 Cb 1.28 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.80 2c3n h ALA 156 CO 0.61 0.58 -0.54 -0.06 0.00 0.00 0.00 179.25 179.84 2c3n s PHE 157 N -4.56 1.75 0.39 0.00 0.08 -0.82 -4.81 117.98 110.02 2c3n s PHE 157 Ca -0.12 -1.28 0.07 0.00 0.12 0.00 0.00 56.93 55.73 2c3n s PHE 157 Cb 0.11 -1.07 0.80 0.00 -0.57 0.00 0.00 43.02 42.30 2c3n s PHE 157 CO 0.86 -0.34 2.00 -0.07 -0.10 0.00 0.00 175.22 177.56 2c3n h LEU 158 N 1.98 0.42 -0.44 -0.37 3.38 -1.88 -3.27 115.31 115.13 2c3n h LEU 158 Ca -0.35 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2c3n h LEU 158 Cb 1.26 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2c3n h LEU 158 CO 0.56 0.39 0.00 0.35 0.09 0.00 0.00 178.44 179.83 2c3n n THR 159 N -4.40 0.00 -3.18 0.22 -2.24 -1.26 -4.31 114.28 99.11 2c3n n THR 159 Ca 0.02 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2c3n n THR 159 Cb 0.14 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 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 0.50 -0.84 0.00 3.38 0.00 -1.24 -4.87 105.19 102.13 2c3n n GLY 160 Ca 0.00 -0.76 0.13 0.00 0.00 0.00 0.00 46.02 45.39 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 0.16 -4.22 1.61 -0.04 -1.26 -1.94 135.00 129.31 2c3n n PRO 161 Ca 0.00 0.03 -0.16 0.00 -0.04 0.00 0.00 63.50 63.33 2c3n n PRO 161 Cb 0.00 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 2c3n n PRO 161 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2c3n s HIS 162 N -2.83 1.25 0.45 0.54 3.76 -1.26 -4.75 115.29 112.44 2c3n s HIS 162 Ca 0.18 -0.62 -0.23 0.00 -0.15 0.00 0.00 55.06 54.24 2c3n s HIS 162 Cb 0.18 -0.66 -0.10 0.00 1.11 0.00 0.00 32.58 33.11 2c3n s HIS 162 CO 0.47 0.08 0.98 1.51 -0.85 0.00 0.00 174.74 176.93 2c3n n ILE 163 N 0.44 2.56 -4.41 0.60 3.06 -1.26 -4.80 119.36 115.55 2c3n n ILE 163 Ca -0.15 -0.50 -0.23 0.00 -2.50 0.00 0.00 62.75 59.37 2c3n n ILE 163 Cb 0.58 -1.13 -0.08 0.00 0.54 0.00 0.00 39.64 39.55 2c3n n ILE 163 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 2c3n s SER 164 N -0.82 2.32 0.49 9.51 1.04 -1.26 -4.25 113.70 120.74 2c3n s SER 164 Ca 0.65 -1.73 0.20 0.00 0.48 0.00 0.00 55.95 55.55 2c3n s SER 164 Cb -0.54 0.56 1.26 0.00 0.10 0.00 0.00 66.02 67.40 2c3n s SER 164 CO 0.56 -1.01 2.00 -0.07 0.98 0.00 0.00 173.24 175.70 2c3n h LEU 165 N 1.93 0.13 -0.40 2.42 3.38 -1.19 -2.12 115.31 119.46 2c3n h LEU 165 Ca -0.30 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2c3n h LEU 165 Cb 1.26 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 2c3n h LEU 165 CO 0.47 0.08 0.23 0.00 0.09 0.00 0.00 178.44 179.31 2c3n h ALA 166 N 1.74 0.51 -0.48 1.53 0.00 -1.87 -1.72 119.26 118.97 2c3n h ALA 166 Ca 0.25 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2c3n h ALA 166 Cb 0.78 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2c3n h ALA 166 CO -0.03 0.01 0.06 -0.44 0.00 0.00 0.00 179.25 178.85 2c3n h ASP 167 N 0.52 0.71 -0.40 0.00 3.32 -1.79 -1.02 116.42 117.75 2c3n h ASP 167 Ca 0.14 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2c3n h ASP 167 Cb 0.02 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 2c3n h ASP 167 CO -0.03 0.74 0.05 0.25 -1.72 0.00 0.00 179.24 178.53 2c3n h LEU 168 N 0.71 0.65 -0.33 1.55 5.85 -1.26 0.18 115.31 122.66 2c3n h LEU 168 Ca 0.15 -0.27 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 2c3n h LEU 168 Cb 0.35 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2c3n h LEU 168 CO 0.01 0.76 0.01 0.58 -0.34 0.00 0.00 178.44 179.46 2c3n h VAL 169 N 0.52 1.25 -0.14 1.05 2.07 -1.05 -2.75 116.25 117.22 2c3n h VAL 169 Ca 0.12 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 2c3n h VAL 169 Cb 0.39 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2c3n h VAL 169 CO 0.01 0.31 0.07 0.00 0.02 0.00 0.00 177.57 177.98 2c3n h ALA 170 N 0.86 0.18 -0.80 1.67 0.00 -1.06 -1.79 119.26 118.32 2c3n h ALA 170 Ca 0.09 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2c3n h ALA 170 Cb 0.43 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2c3n h ALA 170 CO 0.02 -0.27 0.38 0.97 0.00 0.00 0.00 179.25 180.34 2c3n h ILE 171 N 0.11 1.25 -0.38 0.00 6.09 -0.99 -1.15 117.51 122.43 2c3n h ILE 171 Ca 0.05 -0.71 -0.11 0.00 -1.37 0.00 0.00 64.86 62.72 2c3n h ILE 171 Cb 0.10 0.25 -0.01 0.00 0.47 0.00 0.00 36.82 37.63 2c3n h ILE 171 CO -0.01 0.30 -0.20 0.71 -3.07 0.00 0.00 178.15 175.88 2c3n h THR 172 N 1.13 1.27 -0.23 2.19 1.35 -1.39 -2.16 112.91 115.07 2c3n h THR 172 Ca 0.27 -1.29 0.02 0.00 -0.55 0.00 0.00 66.41 64.86 2c3n h THR 172 Cb 0.13 1.19 -0.02 0.00 -1.73 0.00 0.00 68.15 67.71 2c3n h THR 172 CO -0.03 0.43 0.08 -0.33 -0.25 0.00 0.00 175.52 175.42 2c3n h GLU 173 N 0.65 0.19 0.00 4.72 5.08 -1.02 -2.95 114.58 121.24 2c3n h GLU 173 Ca 0.10 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2c3n h GLU 173 Cb 0.69 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.90 2c3n h GLU 173 CO 0.05 0.12 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.02 2c3n h LEU 174 N 0.19 0.00 -0.53 1.33 3.38 -0.85 -1.59 115.31 117.23 2c3n h LEU 174 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2c3n h LEU 174 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2c3n h LEU 174 CO -0.10 0.10 0.00 0.23 0.09 0.00 0.00 178.44 178.76 2c3n n MET 175 N -3.90 0.17 0.39 1.13 2.81 -0.84 -2.25 117.12 114.63 2c3n n MET 175 Ca -0.02 0.38 -0.16 0.00 -1.81 0.00 0.00 57.70 56.09 2c3n n MET 175 Cb 0.19 -1.81 -0.07 0.00 -0.71 0.00 0.00 33.22 30.82 2c3n n MET 175 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2c3n h HIS 176 N 0.00 -0.95 0.00 2.03 3.86 -1.38 0.51 115.15 119.22 2c3n h HIS 176 Ca 0.00 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.15 2c3n h HIS 176 Cb 0.38 0.31 -0.01 0.00 1.06 0.00 0.00 27.41 29.16 2c3n h HIS 176 CO 0.00 -0.59 -0.18 -1.00 0.86 0.00 0.00 177.93 177.02 2c3n h PRO 177 N -1.22 0.00 -0.08 2.45 0.13 -1.70 -1.83 132.00 129.75 2c3n h PRO 177 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2c3n h PRO 177 Cb 0.78 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 2c3n h PRO 177 CO 0.17 0.18 0.05 0.28 -0.23 0.00 0.00 178.00 178.45 2c3n h VAL 178 N 0.00 1.03 -0.30 1.56 2.07 -1.38 -0.74 116.25 118.50 2c3n h VAL 178 Ca -0.00 -0.08 0.09 0.00 0.82 0.00 0.00 66.70 67.52 2c3n h VAL 178 Cb 0.32 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2c3n h VAL 178 CO 0.02 0.03 0.23 1.23 0.02 0.00 0.00 177.57 179.11 2c3n h GLY 179 N 0.09 0.00 1.59 2.17 0.00 -0.41 -1.51 103.07 105.01 2c3n h GLY 179 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2c3n h GLY 179 CO -0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.53 2c3n n ALA 180 N -2.54 2.45 -0.70 3.60 0.00 -0.69 -4.52 120.51 118.11 2c3n n ALA 180 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2c3n n ALA 180 Cb 0.39 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 1.23 0.64 3.78 0.00 0.00 -0.57 -4.79 105.19 105.48 2c3n n GLY 181 Ca 0.14 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2c3n n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c3n s GLN 183 N -2.31 3.49 -0.24 0.00 -0.21 -1.26 -4.49 119.66 114.63 2c3n s GLN 183 Ca 0.55 0.14 -0.13 0.00 0.02 0.00 0.00 55.36 55.94 2c3n s GLN 183 Cb -0.23 -4.01 -0.10 0.00 1.00 0.00 0.00 33.01 29.67 2c3n s GLN 183 CO 0.29 -1.57 -0.32 0.28 -2.12 0.00 0.00 175.29 171.85 2c3n n VAL 184 N 6.55 1.38 0.67 1.09 0.31 -1.26 -4.68 118.33 122.38 2c3n n VAL 184 Ca 0.07 -0.29 0.12 0.00 -0.01 0.00 0.00 64.34 64.23 2c3n n VAL 184 Cb 0.49 -1.89 0.13 0.00 -0.91 0.00 0.00 33.84 31.65 2c3n n VAL 184 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2c3n n PHE 185 N -4.15 0.33 -1.92 3.52 3.01 -1.26 -4.77 117.46 112.21 2c3n n PHE 185 Ca -0.45 0.09 -0.42 0.00 1.01 0.00 0.00 57.45 57.69 2c3n n PHE 185 Cb 0.80 -0.48 -0.03 0.00 -0.01 0.00 0.00 39.48 39.76 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 -3.14 4.21 0.00 -1.08 2.02 -1.26 -1.65 118.70 117.80 2c3n s GLU 186 Ca 0.06 2.36 0.00 0.00 0.02 0.00 0.00 54.97 57.41 2c3n s GLU 186 Cb 0.15 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 31.03 2c3n s GLU 186 CO 0.75 -0.66 0.00 0.41 0.02 0.00 0.00 175.26 175.77 2c3n n GLY 187 N 3.86 0.68 2.36 -1.39 0.00 -1.26 -4.96 105.19 104.49 2c3n n GLY 187 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.53 2.05 -0.22 1.61 1.74 -0.66 -4.99 116.66 113.66 2c3n n ARG 188 Ca 0.00 -4.29 0.02 0.00 -0.77 0.00 0.00 57.85 52.81 2c3n n ARG 188 Cb 0.01 -1.98 0.26 0.00 -1.02 0.00 0.00 32.46 29.73 2c3n n ARG 188 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2c3n h PRO 189 N 4.11 0.96 -0.45 5.56 0.11 -1.93 -0.91 132.00 139.45 2c3n h PRO 189 Ca 0.16 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.12 2c3n h PRO 189 Cb 0.72 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.59 2c3n h PRO 189 CO 0.74 0.64 -0.09 0.87 -0.21 0.00 0.00 178.00 179.94 2c3n h LYS 190 N 0.99 0.80 -0.17 1.05 1.57 -1.94 -1.63 116.57 117.24 2c3n h LYS 190 Ca 0.29 -0.26 -0.15 0.00 -1.87 0.00 0.00 60.65 58.67 2c3n h LYS 190 Cb -0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2c3n h LYS 190 CO -0.08 0.86 -0.52 -0.07 -0.57 0.00 0.00 179.45 179.08 2c3n h LEU 191 N 0.72 0.53 -0.28 2.94 3.38 -1.69 -2.44 115.31 118.47 2c3n h LEU 191 Ca 0.12 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2c3n h LEU 191 Cb 0.57 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2c3n h LEU 191 CO 0.04 0.95 0.12 0.00 0.09 0.00 0.00 178.44 179.63 2c3n h ALA 192 N 1.07 0.36 -0.37 1.53 0.00 -0.73 0.39 119.26 121.51 2c3n h ALA 192 Ca 0.01 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2c3n h ALA 192 Cb 1.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2c3n h ALA 192 CO 0.09 -0.05 -0.20 1.79 0.00 0.00 0.00 179.25 180.89 2c3n h THR 193 N 0.30 1.27 -0.43 0.00 1.35 -1.35 -2.58 112.91 111.47 2c3n h THR 193 Ca 0.09 -1.27 0.02 0.00 -0.55 0.00 0.00 66.41 64.71 2c3n h THR 193 Cb 0.16 1.20 -0.03 0.00 -1.73 0.00 0.00 68.15 67.75 2c3n h THR 193 CO -0.01 0.42 0.25 -0.25 -0.25 0.00 0.00 175.52 175.68 2c3n h TRP 194 N 0.62 0.47 -0.74 4.73 7.01 -1.23 -1.69 115.95 125.11 2c3n h TRP 194 Ca 0.09 0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.22 2c3n h TRP 194 Cb 0.67 -0.15 -0.08 0.00 -2.10 0.00 0.00 29.16 27.50 2c3n h TRP 194 CO 0.03 0.27 0.35 -0.09 -2.79 0.00 0.00 178.44 176.20 2c3n h ARG 195 N 0.50 0.54 -0.43 2.65 2.43 -0.65 0.19 114.38 119.61 2c3n h ARG 195 Ca 0.18 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.20 2c3n h ARG 195 Cb 0.02 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 2c3n h ARG 195 CO -0.09 0.36 -0.19 1.96 -1.51 0.00 0.00 179.97 180.50 2c3n h GLN 196 N 0.55 0.85 -0.76 0.20 1.08 -1.06 -0.87 115.11 115.11 2c3n h GLN 196 Ca 0.38 -0.34 -0.06 0.00 -1.45 0.00 0.00 58.65 57.19 2c3n h GLN 196 Cb 0.48 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.84 2c3n h GLN 196 CO -0.32 0.97 0.26 0.00 -0.95 0.00 0.00 178.83 178.79 2c3n h ARG 197 N 0.75 1.17 -0.22 1.46 3.08 -0.68 -1.86 114.38 118.08 2c3n h ARG 197 Ca 0.11 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 2c3n h ARG 197 Cb 0.72 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2c3n h ARG 197 CO 0.06 0.98 -0.05 0.28 -1.07 0.00 0.00 179.97 180.16 2c3n h VAL 198 N 1.12 1.28 -0.82 2.04 2.07 -0.74 -0.42 116.25 120.78 2c3n h VAL 198 Ca 0.25 -1.04 0.05 0.00 0.82 0.00 0.00 66.70 66.78 2c3n h VAL 198 Cb 0.28 1.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.51 2c3n h VAL 198 CO -0.01 0.32 0.51 -0.33 0.02 0.00 0.00 177.57 178.08 2c3n h GLU 199 N 0.15 0.93 -0.57 1.57 5.08 -1.07 -0.28 114.58 120.39 2c3n h GLU 199 Ca 0.06 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2c3n h GLU 199 Cb 0.51 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2c3n h GLU 199 CO 0.02 0.61 -0.02 0.00 -1.00 0.00 0.00 179.01 178.63 2c3n h ALA 200 N 1.37 0.77 -0.26 3.43 0.00 -1.25 -0.17 119.26 123.15 2c3n h ALA 200 Ca 0.35 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 2c3n h ALA 200 Cb 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2c3n h ALA 200 CO -0.15 0.61 -0.33 0.00 0.00 0.00 0.00 179.25 179.38 2c3n h ALA 201 N 0.96 0.94 -0.17 0.00 0.00 -0.54 -3.03 119.26 117.42 2c3n h ALA 201 Ca 0.16 -0.40 -0.18 0.00 0.00 0.00 0.00 54.91 54.49 2c3n h ALA 201 Cb 0.57 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2c3n h ALA 201 CO 0.03 0.62 -0.62 0.28 0.00 0.00 0.00 179.25 179.56 2c3n h VAL 202 N 0.48 1.32 0.00 0.00 2.07 -0.92 -3.49 116.25 115.70 2c3n h VAL 202 Ca 0.05 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.69 2c3n h VAL 202 Cb 0.80 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2c3n h VAL 202 CO 0.07 0.59 0.00 0.61 0.02 0.00 0.00 177.57 178.85 2c3n n GLY 203 N 0.40 2.31 0.34 2.17 0.00 -0.09 -4.77 105.19 105.55 2c3n n GLY 203 Ca -0.04 -1.20 -0.00 0.00 0.00 0.00 0.00 46.02 44.77 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 1.10 -0.14 1.61 3.07 -1.81 0.18 114.58 118.60 2c3n h GLU 204 Ca 0.00 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.76 2c3n h GLU 204 Cb 0.00 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 27.66 2c3n h GLU 204 CO 0.00 0.73 -0.04 0.22 -1.40 0.00 0.00 179.01 178.52 2c3n h ASP 205 N 1.13 0.27 -0.82 1.42 3.58 -1.93 -1.58 116.42 118.49 2c3n h ASP 205 Ca 0.37 -0.37 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2c3n h ASP 205 Cb 0.04 -0.07 -0.04 0.00 1.72 0.00 0.00 39.33 40.97 2c3n h ASP 205 CO -0.13 0.58 0.51 0.25 -2.88 0.00 0.00 179.24 177.57 2c3n h LEU 206 N -0.04 0.96 -0.28 2.28 5.85 -1.81 -0.22 115.31 122.05 2c3n h LEU 206 Ca 0.03 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.73 2c3n h LEU 206 Cb 0.46 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2c3n h LEU 206 CO 0.01 0.72 0.12 0.15 -0.34 0.00 0.00 178.44 179.11 2c3n h PHE 207 N 1.11 0.23 -0.48 1.25 3.57 -0.84 -0.00 116.94 121.77 2c3n h PHE 207 Ca 0.30 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.75 2c3n h PHE 207 Cb -0.08 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 2c3n h PHE 207 CO -0.01 0.12 0.08 0.37 -2.23 0.00 0.00 178.31 176.64 2c3n h GLN 208 N 0.27 0.80 -0.45 1.11 4.15 -1.03 -2.62 115.11 117.33 2c3n h GLN 208 Ca 0.12 -0.21 0.03 0.00 0.77 0.00 0.00 58.65 59.35 2c3n h GLN 208 Cb 0.06 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 2c3n h GLN 208 CO -0.10 0.80 0.26 1.49 -1.93 0.00 0.00 178.83 179.35 2c3n h GLU 209 N 0.67 0.50 -0.08 1.69 4.81 -0.60 -2.11 114.58 119.45 2c3n h GLU 209 Ca 0.15 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.31 2c3n h GLU 209 Cb 0.39 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2c3n h GLU 209 CO 0.01 0.33 -0.13 0.00 -0.73 0.00 0.00 179.01 178.49 2c3n h ALA 210 N 1.21 1.64 -0.60 2.92 0.00 -0.86 -2.99 119.26 120.59 2c3n h ALA 210 Ca 0.19 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2c3n h ALA 210 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2c3n h ALA 210 CO -0.10 0.27 0.00 0.72 0.00 0.00 0.00 179.25 180.13 2c3n n HIS 211 N -4.32 0.79 -0.36 0.00 8.25 -0.87 -4.53 115.22 114.18 2c3n n HIS 211 Ca -0.02 -0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.05 2c3n n HIS 211 Cb 0.24 0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.48 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 4.26 1.16 0.01 -0.41 5.08 -1.25 -1.87 114.58 121.57 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 0.96 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2c3n h GLU 212 CO 0.00 0.77 -0.01 0.28 -1.00 0.00 0.00 179.01 179.05 2c3n h VAL 213 N 1.20 1.51 -0.43 3.13 2.07 -1.84 -3.09 116.25 118.79 2c3n h VAL 213 Ca 0.39 -1.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 2c3n h VAL 213 Cb 0.03 2.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.39 2c3n h VAL 213 CO -0.13 0.42 0.27 -0.29 0.02 0.00 0.00 177.57 177.85 2c3n h ILE 214 N -0.73 1.12 0.00 4.57 6.09 -1.74 -1.40 117.51 125.41 2c3n h ILE 214 Ca -0.00 -0.26 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 2c3n h ILE 214 Cb 0.70 0.50 0.00 0.00 0.47 0.00 0.00 36.82 38.49 2c3n h ILE 214 CO 0.00 0.12 0.00 0.18 -3.07 0.00 0.00 178.15 175.39 2c3n n LEU 215 N -4.45 0.67 -0.74 2.19 4.77 -0.71 -2.53 117.00 116.20 2c3n n LEU 215 Ca 0.03 0.63 0.07 0.00 -0.03 0.00 0.00 56.01 56.71 2c3n n LEU 215 Cb 0.07 -0.50 0.17 0.00 -2.33 0.00 0.00 43.42 40.84 2c3n n LEU 215 CO 0.36 -0.43 0.64 2.29 -1.33 0.00 0.00 177.39 178.92 2c3n n LYS 216 N -2.20 2.72 -0.33 3.23 2.85 -0.57 -4.67 118.16 119.19 2c3n n LYS 216 Ca 0.03 -2.10 0.08 0.00 -1.05 0.00 0.00 58.31 55.27 2c3n n LYS 216 Cb 0.29 -1.32 0.24 0.00 -0.65 0.00 0.00 35.03 33.59 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 2.42 1.42 0.00 0.58 0.00 -1.16 -0.93 119.26 121.59 2c3n h ALA 217 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2c3n h ALA 217 Cb 0.76 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2c3n h ALA 217 CO 0.00 0.06 0.14 1.57 0.00 0.00 0.00 179.25 181.02 2c3n h LYS 218 N 0.81 0.00 -0.07 0.00 2.10 -1.82 -1.15 116.57 116.44 2c3n h LYS 218 Ca 0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.14 2c3n h LYS 218 Cb 0.59 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 2c3n h LYS 218 CO -0.31 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.89 2c3n n ASP 219 N -2.83 2.72 -4.70 7.07 8.00 -0.36 -4.98 116.55 121.47 2c3n n ASP 219 Ca -0.02 -1.84 -0.44 0.00 0.71 0.00 0.00 54.79 53.20 2c3n n ASP 219 Cb 0.19 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 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 1.12 2.47 -1.74 1.24 0.99 -0.44 -4.95 117.46 116.15 2c3n n PHE 220 Ca 0.12 0.28 -0.40 0.00 -0.00 0.00 0.00 57.45 57.45 2c3n n PHE 220 Cb 0.50 -2.55 0.02 0.00 -1.00 0.00 0.00 39.48 36.45 2c3n n PHE 220 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 2c3n n PRO 221 N 2.71 2.09 -1.82 -1.08 -0.02 -1.26 -4.63 135.00 130.99 2c3n n PRO 221 Ca 0.13 0.75 -0.40 0.00 -2.02 0.00 0.00 63.50 61.95 2c3n n PRO 221 Cb 0.33 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 2c3n n PRO 221 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2c3n s PRO 222 N -2.38 3.96 0.38 0.52 0.02 -1.26 -4.81 135.00 131.43 2c3n s PRO 222 Ca 0.62 2.49 -0.27 0.00 0.02 0.00 0.00 61.00 63.86 2c3n s PRO 222 Cb -0.47 -2.85 -0.11 0.00 0.02 0.00 0.00 34.50 31.09 2c3n s PRO 222 CO 0.57 -0.63 1.24 0.00 -0.33 0.00 0.00 177.00 177.85 2c3n n ALA 223 N 0.22 1.09 -1.12 -1.55 0.00 0.15 -4.98 120.51 114.32 2c3n n ALA 223 Ca 0.02 0.31 -0.32 0.00 0.00 0.00 0.00 53.44 53.46 2c3n n ALA 223 Cb 0.40 -2.23 0.11 0.00 0.00 0.00 0.00 19.45 17.74 2c3n n ALA 223 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2c3n s ASP 224 N -0.45 4.00 0.29 0.00 1.47 -1.26 -4.71 116.67 116.01 2c3n s ASP 224 Ca 0.58 2.05 0.02 0.00 1.18 0.00 0.00 52.55 56.39 2c3n s ASP 224 Cb -0.55 -2.55 0.58 0.00 -0.34 0.00 0.00 42.92 40.06 2c3n s ASP 224 CO 0.60 -2.38 1.85 -0.65 0.68 0.00 0.00 175.17 175.27 2c3n h PRO 225 N -1.09 0.94 -0.42 2.11 0.11 -1.99 -0.02 132.00 131.64 2c3n h PRO 225 Ca -0.44 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 2c3n h PRO 225 Cb 1.26 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2c3n h PRO 225 CO 0.48 0.62 -0.20 1.15 -0.21 0.00 0.00 178.00 179.85 2c3n h THR 226 N 0.97 1.28 -0.31 -1.15 2.02 -2.00 -2.08 112.91 111.62 2c3n h THR 226 Ca 0.48 -1.34 -0.07 0.00 0.77 0.00 0.00 66.41 66.26 2c3n h THR 226 Cb 0.49 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2c3n h THR 226 CO -0.25 0.45 -0.06 0.40 0.37 0.00 0.00 175.52 176.43 2c3n h ILE 227 N 0.70 1.28 -0.39 3.11 2.04 -1.81 -2.35 117.51 120.09 2c3n h ILE 227 Ca 0.09 -1.09 0.07 0.00 1.00 0.00 0.00 64.86 64.93 2c3n h ILE 227 Cb 0.76 1.35 -0.06 0.00 -0.74 0.00 0.00 36.82 38.13 2c3n h ILE 227 CO 0.06 0.35 0.03 0.50 0.00 0.00 0.00 178.15 179.10 2c3n h LYS 228 N 0.37 0.14 -0.24 2.37 3.64 -0.95 -0.36 116.57 121.55 2c3n h LYS 228 Ca 0.08 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 2c3n h LYS 228 Cb 0.55 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 2c3n h LYS 228 CO 0.03 0.09 -0.19 -0.56 -2.27 0.00 0.00 179.45 176.55 2c3n h GLN 229 N 0.14 0.42 -0.77 1.90 3.07 -1.30 -1.82 115.11 116.77 2c3n h GLN 229 Ca 0.19 -0.13 -0.04 0.00 0.09 0.00 0.00 58.65 58.76 2c3n h GLN 229 Cb 0.25 -0.04 -0.03 0.00 0.08 0.00 0.00 27.48 27.74 2c3n h GLN 229 CO -0.29 0.60 0.32 -0.22 0.09 0.00 0.00 178.83 179.32 2c3n h LYS 230 N 0.39 1.14 0.00 0.06 3.64 -0.83 -3.22 116.57 117.73 2c3n h LYS 230 Ca 0.07 -0.19 -0.11 0.00 -1.27 0.00 0.00 60.65 59.14 2c3n h LYS 230 Cb 0.56 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 2c3n h LYS 230 CO 0.04 0.91 -0.76 -0.07 -2.27 0.00 0.00 179.45 177.30 2c3n h LEU 231 N 1.11 0.00 -0.24 5.20 3.38 -0.72 -3.40 115.31 120.63 2c3n h LEU 231 Ca 0.26 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.28 2c3n h LEU 231 Cb 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 2c3n h LEU 231 CO -0.02 0.48 -0.06 -0.03 0.09 0.00 0.00 178.44 178.90 2c3n h MET 232 N 0.00 -0.00 -0.87 1.13 4.05 -1.35 0.07 114.93 117.97 2c3n h MET 232 Ca -0.05 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.41 2c3n h MET 232 Cb 1.41 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 32.16 2c3n h MET 232 CO 0.06 -0.00 0.56 -1.35 0.23 0.00 0.00 176.91 176.40 2c3n h PRO 233 N -0.00 1.06 -0.30 0.39 0.11 -1.78 0.31 132.00 131.78 2c3n h PRO 233 Ca 0.12 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.18 2c3n h PRO 233 Cb 0.18 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 2c3n h PRO 233 CO -0.25 0.70 0.17 2.35 -0.21 0.00 0.00 178.00 180.76 2c3n h TRP 234 N 1.09 0.32 0.07 0.65 7.01 -1.58 -0.51 115.95 122.99 2c3n h TRP 234 Ca 0.35 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.36 2c3n h TRP 234 Cb 0.01 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 2c3n h TRP 234 CO -0.02 0.19 -0.07 0.28 -2.79 0.00 0.00 178.44 176.03 2c3n h VAL 235 N 0.36 0.84 -0.81 2.65 2.07 -0.47 -1.79 116.25 119.08 2c3n h VAL 235 Ca 0.12 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.62 2c3n h VAL 235 Cb -0.00 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 2c3n h VAL 235 CO -0.06 0.00 0.44 -0.07 0.02 0.00 0.00 177.57 177.90 2c3n h LEU 236 N -0.16 1.01 -0.95 2.57 3.38 -0.70 -2.20 115.31 118.27 2c3n h LEU 236 Ca 0.01 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 2c3n h LEU 236 Cb 0.16 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2c3n h LEU 236 CO -0.02 0.82 -0.33 0.00 0.09 0.00 0.00 178.44 178.99 2c3n h ALA 237 N 1.35 1.11 0.00 1.53 0.00 -0.97 -2.80 119.26 119.48 2c3n h ALA 237 Ca 0.29 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2c3n h ALA 237 Cb 0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2c3n h ALA 237 CO -0.05 0.57 -0.85 0.00 0.00 0.00 0.00 179.25 178.92 2c3n h MET 238 N 0.31 0.00 0.00 0.00 -0.00 -0.69 -3.39 114.93 111.16 2c3n h MET 238 Ca 0.04 0.00 -0.38 0.00 -0.00 0.00 0.00 59.70 59.36 2c3n h MET 238 Cb 0.74 0.00 -0.07 0.00 -0.00 0.00 0.00 31.60 32.27 2c3n h MET 238 CO 0.06 0.46 -2.40 0.44 -0.00 0.00 0.00 176.91 175.47 2c3n n ILE 239 N -3.11 1.40 -0.66 -0.10 -5.35 -1.09 -5.03 119.36 105.42 2c3n n ILE 239 Ca -0.02 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 2c3n n ILE 239 Cb 0.78 -1.48 0.00 0.00 -1.74 0.00 0.00 39.64 37.20 2c3n n ILE 239 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33