#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b12 n THR 2 N 0.00 0.00 -2.07 1.09 5.66 -1.26 -5.08 114.28 112.63 2b12 n THR 2 Ca 0.00 -0.07 -0.27 0.00 -3.05 0.00 0.00 64.05 60.66 2b12 n THR 2 Cb 0.00 0.00 0.09 0.00 -1.55 0.00 0.00 70.33 68.87 2b12 n THR 2 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2b12 s PRO 3 N -0.21 1.87 -0.31 1.09 0.04 -1.26 -5.00 135.00 131.22 2b12 s PRO 3 Ca 0.06 -0.18 -0.29 0.00 0.04 0.00 0.00 61.00 60.64 2b12 s PRO 3 Cb -0.04 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.46 2b12 s PRO 3 CO 0.10 -1.54 1.17 -0.51 0.04 0.00 0.00 177.00 176.26 2b12 s LEU 4 N -5.45 3.91 -0.53 -3.56 1.02 -1.24 -4.97 118.68 107.85 2b12 s LEU 4 Ca 0.63 1.10 -0.24 0.00 0.02 0.00 0.00 54.13 55.65 2b12 s LEU 4 Cb -0.10 -3.54 0.04 0.00 0.02 0.00 0.00 46.19 42.61 2b12 s LEU 4 CO 0.47 -0.97 0.90 0.54 0.02 0.00 0.00 176.35 177.31 2b12 s VAL 5 N 3.97 4.46 -0.63 -1.59 0.11 -1.26 -4.82 120.40 120.64 2b12 s VAL 5 Ca 0.50 0.30 -0.25 0.00 -2.93 0.00 0.00 61.98 59.60 2b12 s VAL 5 Cb -0.14 -4.49 0.04 0.00 -1.53 0.00 0.00 36.38 30.27 2b12 s VAL 5 CO 0.19 -1.01 1.09 -1.00 -3.33 0.00 0.00 175.10 171.04 2b12 s HIS 6 N 3.76 2.60 -0.03 1.54 3.76 -1.26 -5.01 115.29 120.65 2b12 s HIS 6 Ca 0.30 -0.04 -0.27 0.00 -0.15 0.00 0.00 55.06 54.90 2b12 s HIS 6 Cb -0.13 -4.36 -0.03 0.00 1.11 0.00 0.00 32.58 29.17 2b12 s HIS 6 CO 0.20 -1.65 0.87 0.14 -0.85 0.00 0.00 174.74 173.45 2b12 s VAL 7 N 4.65 4.94 -0.08 -0.90 -7.23 -1.26 -1.31 120.40 119.21 2b12 s VAL 7 Ca 0.33 1.81 -0.23 0.00 -1.81 0.00 0.00 61.98 62.08 2b12 s VAL 7 Cb -0.11 -4.21 -0.04 0.00 0.56 0.00 0.00 36.38 32.58 2b12 s VAL 7 CO 0.18 0.20 0.68 0.00 -0.31 0.00 0.00 175.10 175.85 2b12 s ALA 8 N 0.92 3.37 -0.08 1.32 0.00 -1.09 -4.90 121.76 121.30 2b12 s ALA 8 Ca 0.46 0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.51 2b12 s ALA 8 Cb -0.20 -2.94 0.02 0.00 0.00 0.00 0.00 23.12 20.00 2b12 s ALA 8 CO 0.24 -0.15 -0.11 -1.12 0.00 0.00 0.00 175.76 174.62 2b12 s SER 9 N 0.82 1.94 0.55 0.00 0.01 -1.20 -4.46 113.70 111.36 2b12 s SER 9 Ca 0.36 -0.31 -0.21 0.00 1.31 0.00 0.00 55.95 57.10 2b12 s SER 9 Cb -0.17 -0.86 -0.05 0.00 0.21 0.00 0.00 66.02 65.15 2b12 s SER 9 CO 0.17 -0.01 1.28 -0.69 0.41 0.00 0.00 173.24 174.40 2b12 s VAL 10 N 0.95 2.39 -0.14 3.43 1.01 -1.26 -4.54 120.40 122.25 2b12 s VAL 10 Ca -0.09 0.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 2b12 s VAL 10 Cb -0.15 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 2b12 s VAL 10 CO 0.00 -0.02 1.30 -1.61 0.00 0.00 0.00 175.10 174.77 2b12 s GLU 11 N -2.99 4.24 0.00 2.72 8.01 -1.26 -4.76 118.70 124.66 2b12 s GLU 11 Ca 0.72 1.72 0.00 0.00 0.01 0.00 0.00 54.97 57.43 2b12 s GLU 11 Cb -0.36 -3.76 0.00 0.00 -4.31 0.00 0.00 34.13 25.70 2b12 s GLU 11 CO 0.41 -0.69 0.00 1.17 0.01 0.00 0.00 175.26 176.16 2b12 n LYS 12 N 6.48 0.00 -2.28 1.61 3.00 -1.26 -1.64 118.16 124.07 2b12 n LYS 12 Ca 0.14 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.35 2b12 n LYS 12 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.48 2b12 n LYS 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b12 n GLY 13 N 0.00 0.01 3.60 3.14 0.00 -1.26 -5.05 105.19 105.63 2b12 n GLY 13 Ca 0.00 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 2b12 n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b12 s ARG 14 N -4.62 2.79 0.00 1.61 0.52 -0.65 -5.13 118.95 113.47 2b12 s ARG 14 Ca 0.03 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 2b12 s ARG 14 Cb -0.01 -2.63 0.00 0.00 0.52 0.00 0.00 34.95 32.83 2b12 s ARG 14 CO 0.04 0.67 0.00 -1.13 0.02 0.00 0.00 175.30 174.90 2b12 n SER 15 N 2.19 1.54 0.00 0.23 3.41 -1.26 -4.85 113.62 114.88 2b12 n SER 15 Ca -0.18 -0.61 -0.15 0.00 -0.26 0.00 0.00 58.87 57.67 2b12 n SER 15 Cb 0.53 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.38 2b12 n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2b12 h TYR 16 N 0.47 -1.58 0.00 7.33 3.20 -2.00 -2.75 116.97 121.64 2b12 h TYR 16 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2b12 h TYR 16 Cb 0.00 0.70 0.00 0.00 1.54 0.00 0.00 36.73 38.97 2b12 h TYR 16 CO 0.00 -0.54 0.19 1.49 -1.64 0.00 0.00 178.16 177.66 2b12 h GLU 17 N -0.58 0.00 0.17 1.82 4.22 -1.98 -0.14 114.58 118.09 2b12 h GLU 17 Ca 0.03 0.00 -0.28 0.00 0.08 0.00 0.00 59.36 59.19 2b12 h GLU 17 Cb 0.67 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.94 2b12 h GLU 17 CO -0.41 0.00 -1.31 -0.44 -2.18 0.00 0.00 179.01 174.66 2b12 h ASP 18 N 0.00 0.56 1.07 1.04 3.45 -1.90 -3.04 116.42 117.61 2b12 h ASP 18 Ca 0.00 -0.91 -0.04 0.00 0.43 0.00 0.00 57.03 56.51 2b12 h ASP 18 Cb 0.38 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.97 2b12 h ASP 18 CO 0.00 1.61 -0.18 -0.26 -1.57 0.00 0.00 179.24 178.83 2b12 h PHE 19 N -0.15 0.00 -0.36 4.55 0.04 -1.19 -2.44 116.94 117.39 2b12 h PHE 19 Ca -0.25 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.43 2b12 h PHE 19 Cb 1.88 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 40.02 2b12 h PHE 19 CO 0.14 0.18 -0.14 1.96 -0.60 0.00 0.00 178.31 179.86 2b12 h GLN 20 N 0.00 0.65 0.00 1.51 1.08 -1.09 -0.36 115.11 116.90 2b12 h GLN 20 Ca -0.00 -0.21 -0.14 0.00 -1.45 0.00 0.00 58.65 56.85 2b12 h GLN 20 Cb 0.77 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 28.13 2b12 h GLN 20 CO 0.02 0.76 -0.64 0.87 -0.95 0.00 0.00 178.83 178.89 2b12 h LYS 21 N 0.59 0.00 0.01 1.46 1.57 -1.33 -1.31 116.57 117.55 2b12 h LYS 21 Ca 0.10 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.69 2b12 h LYS 21 Cb 0.58 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 2b12 h LYS 21 CO 0.04 0.64 -0.88 0.28 -0.57 0.00 0.00 179.45 178.96 2b12 h VAL 22 N 0.00 1.56 0.16 0.50 2.07 -1.00 -1.30 116.25 118.24 2b12 h VAL 22 Ca -0.01 -2.80 -0.01 0.00 0.82 0.00 0.00 66.70 64.71 2b12 h VAL 22 Cb 1.30 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 33.62 2b12 h VAL 22 CO 0.08 0.81 -0.08 0.22 0.02 0.00 0.00 177.57 178.62 2b12 h TYR 23 N 0.05 -0.20 -0.03 1.57 5.03 -1.05 -2.65 116.97 119.69 2b12 h TYR 23 Ca -0.03 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.29 2b12 h TYR 23 Cb 1.52 0.07 -0.00 0.00 1.55 0.00 0.00 36.73 39.87 2b12 h TYR 23 CO 0.01 0.19 0.02 -0.91 -1.32 0.00 0.00 178.16 176.16 2b12 h ASN 24 N -0.66 0.00 0.15 -2.11 2.35 -1.24 -1.76 115.58 112.31 2b12 h ASN 24 Ca -0.02 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 2b12 h ASN 24 Cb 0.48 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.85 2b12 h ASN 24 CO 0.04 0.00 -0.07 0.00 -1.65 0.00 0.00 177.43 175.74 2b12 h ALA 25 N 1.98 -0.21 0.00 -0.83 0.00 -1.18 -2.74 119.26 116.28 2b12 h ALA 25 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2b12 h ALA 25 Cb 0.06 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2b12 h ALA 25 CO -0.00 -0.28 0.00 1.51 0.00 0.00 0.00 179.25 180.48 2b12 n ILE 26 N -4.91 0.85 0.04 0.00 3.06 -1.00 -1.61 119.36 115.79 2b12 n ILE 26 Ca -0.07 0.21 -0.04 0.00 -2.50 0.00 0.00 62.75 60.35 2b12 n ILE 26 Cb 0.26 -1.10 -0.09 0.00 0.54 0.00 0.00 39.64 39.25 2b12 n ILE 26 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2b12 h ALA 27 N 2.33 0.62 0.04 1.51 0.00 -1.36 -2.44 119.26 119.96 2b12 h ALA 27 Ca 0.00 -0.96 -0.25 0.00 0.00 0.00 0.00 54.91 53.70 2b12 h ALA 27 Cb 0.36 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2b12 h ALA 27 CO 0.00 1.13 -1.04 -0.07 0.00 0.00 0.00 179.25 179.27 2b12 h LEU 28 N 0.00 0.58 -0.49 0.00 3.38 -0.98 -2.60 115.31 115.21 2b12 h LEU 28 Ca -0.13 -0.50 -0.09 0.00 0.09 0.00 0.00 57.88 57.25 2b12 h LEU 28 Cb 1.71 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 2b12 h LEU 28 CO 0.08 1.32 -0.42 0.50 0.09 0.00 0.00 178.44 180.01 2b12 h LYS 29 N 0.22 0.00 -0.30 1.13 3.64 -1.54 -1.57 116.57 118.15 2b12 h LYS 29 Ca -0.11 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.18 2b12 h LYS 29 Cb 1.70 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.51 2b12 h LYS 29 CO 0.18 0.42 -0.17 1.25 -2.27 0.00 0.00 179.45 178.86 2b12 h LEU 30 N 0.00 0.68 -0.34 5.20 6.46 -1.40 -2.03 115.31 123.87 2b12 h LEU 30 Ca -0.00 -0.42 -0.05 0.00 -0.12 0.00 0.00 57.88 57.28 2b12 h LEU 30 Cb 1.13 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.86 2b12 h LEU 30 CO 0.05 0.95 -0.00 -0.09 -0.62 0.00 0.00 178.44 178.74 2b12 h ARG 31 N 0.40 0.60 0.03 1.25 2.43 -1.33 -3.32 114.38 114.44 2b12 h ARG 31 Ca 0.06 -0.19 -0.26 0.00 -0.81 0.00 0.00 59.98 58.78 2b12 h ARG 31 Cb 0.71 -0.05 0.02 0.00 -0.42 0.00 0.00 29.97 30.23 2b12 h ARG 31 CO 0.05 0.73 -1.04 1.49 -1.51 0.00 0.00 179.97 179.69 2b12 h GLU 32 N 0.41 0.65 -2.70 0.20 4.57 -1.30 -3.36 114.58 113.05 2b12 h GLU 32 Ca 0.10 -0.74 -0.77 0.00 -1.18 0.00 0.00 59.36 56.77 2b12 h GLU 32 Cb 0.45 0.22 -0.19 0.00 -0.16 0.00 0.00 28.75 29.08 2b12 h GLU 32 CO 0.02 1.32 1.79 -0.25 -1.18 0.00 0.00 179.01 180.70 2b12 n ASP 33 N -3.89 7.18 -0.07 1.04 10.43 -0.77 -4.67 116.55 125.81 2b12 n ASP 33 Ca -0.12 -3.32 0.15 0.00 2.57 0.00 0.00 54.79 54.07 2b12 n ASP 33 Cb 0.88 -1.32 0.72 0.00 1.84 0.00 0.00 41.12 43.24 2b12 n ASP 33 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 2b12 n ASP 34 N 1.55 0.26 -0.05 -2.24 5.75 -1.26 -4.12 116.55 116.44 2b12 n ASP 34 Ca 0.50 -0.53 -0.16 0.00 -0.01 0.00 0.00 54.79 54.59 2b12 n ASP 34 Cb 0.28 -0.13 -0.06 0.00 -1.03 0.00 0.00 41.12 40.18 2b12 n ASP 34 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2b12 h GLU 35 N 0.34 0.75 -4.75 0.11 5.08 -1.90 -3.39 114.58 110.82 2b12 h GLU 35 Ca 0.00 -0.53 -0.58 0.00 -1.00 0.00 0.00 59.36 57.25 2b12 h GLU 35 Cb 0.28 0.08 0.06 0.00 0.50 0.00 0.00 28.75 29.67 2b12 h GLU 35 CO 0.00 1.15 -0.17 0.98 -1.00 0.00 0.00 179.01 179.97 2b12 n TYR 36 N -4.08 0.10 -3.78 4.33 9.36 -1.26 -1.65 117.16 120.17 2b12 n TYR 36 Ca -0.06 0.81 -0.33 0.00 3.32 0.00 0.00 57.90 61.64 2b12 n TYR 36 Cb 0.63 -1.61 0.03 0.00 -0.63 0.00 0.00 39.34 37.76 2b12 n TYR 36 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2b12 n ASP 37 N 1.37 -4.36 -3.79 2.98 2.03 -1.26 -2.17 116.55 111.34 2b12 n ASP 37 Ca 0.15 -1.06 -0.24 0.00 0.52 0.00 0.00 54.79 54.16 2b12 n ASP 37 Cb 0.12 -3.07 0.01 0.00 -0.72 0.00 0.00 41.12 37.47 2b12 n ASP 37 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2b12 n ASN 38 N -2.64 -1.48 -0.16 1.67 3.02 -1.23 -2.78 115.26 111.66 2b12 n ASN 38 Ca -0.13 -0.92 -0.02 0.00 -0.03 0.00 0.00 54.58 53.48 2b12 n ASN 38 Cb 0.60 -3.57 -0.01 0.00 -0.61 0.00 0.00 39.78 36.19 2b12 n ASN 38 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2b12 n TYR 39 N -4.29 0.00 0.01 3.10 4.01 -0.66 -4.94 117.16 114.39 2b12 n TYR 39 Ca -0.27 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.28 2b12 n TYR 39 Cb 0.67 -0.89 -0.09 0.00 -0.31 0.00 0.00 39.34 38.72 2b12 n TYR 39 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2b12 h ILE 40 N 0.00 1.28 0.00 -0.72 2.04 -1.26 -3.47 117.51 115.38 2b12 h ILE 40 Ca -0.04 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.73 2b12 h ILE 40 Cb 0.36 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 2b12 h ILE 40 CO 0.06 0.66 0.00 0.61 0.00 0.00 0.00 178.15 179.48 2b12 n GLY 41 N 0.88 2.11 0.00 5.37 0.00 -0.95 -4.50 105.19 108.11 2b12 n GLY 41 Ca -0.09 -1.89 0.08 0.00 0.00 0.00 0.00 46.02 44.12 2b12 n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2b12 n TYR 42 N 1.90 0.00 0.36 1.61 4.01 -1.26 -4.08 117.16 119.69 2b12 n TYR 42 Ca 0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.60 2b12 n TYR 42 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 2b12 n TYR 42 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2b12 h GLY 43 N 4.02 -0.97 1.87 2.72 0.00 -1.90 -3.20 103.07 105.61 2b12 h GLY 43 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2b12 h GLY 43 CO 0.00 -0.35 0.05 -2.55 0.00 0.00 0.00 176.54 173.69 2b12 h PRO 44 N -1.14 0.00 0.00 4.80 0.11 -1.88 -2.37 132.00 131.51 2b12 h PRO 44 Ca -0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.02 2b12 h PRO 44 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 2b12 h PRO 44 CO 0.16 0.00 -0.98 1.55 -0.21 0.00 0.00 178.00 178.51 2b12 n VAL 45 N -2.47 0.17 0.08 3.15 3.14 -1.22 -3.58 118.33 117.59 2b12 n VAL 45 Ca -0.02 -0.23 -0.10 0.00 -2.96 0.00 0.00 64.34 61.04 2b12 n VAL 45 Cb 0.09 0.21 -0.10 0.00 -1.06 0.00 0.00 33.84 32.98 2b12 n VAL 45 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2b12 h LEU 46 N 0.00 0.15 -0.17 6.55 4.07 -1.42 -1.63 115.31 122.86 2b12 h LEU 46 Ca 0.00 -0.16 -0.22 0.00 0.08 0.00 0.00 57.88 57.58 2b12 h LEU 46 Cb 0.72 -0.05 0.01 0.00 1.08 0.00 0.00 40.66 42.42 2b12 h LEU 46 CO 0.00 1.09 -0.78 -0.37 -1.08 0.00 0.00 178.44 177.30 2b12 h VAL 47 N 0.03 1.28 0.00 1.22 -1.51 -1.69 -0.81 116.25 114.77 2b12 h VAL 47 Ca -0.05 -1.98 -0.05 0.00 -1.23 0.00 0.00 66.70 63.39 2b12 h VAL 47 Cb 1.77 1.98 -0.01 0.00 -2.13 0.00 0.00 31.29 32.90 2b12 h VAL 47 CO 0.15 0.63 -0.24 -0.09 -1.23 0.00 0.00 177.57 176.79 2b12 h ARG 48 N 0.53 0.00 0.04 5.19 9.65 -1.60 -0.54 114.38 127.65 2b12 h ARG 48 Ca -0.05 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.72 2b12 h ARG 48 Cb 1.41 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 30.00 2b12 h ARG 48 CO 0.16 0.24 -0.45 1.25 2.80 0.00 0.00 179.97 183.97 2b12 h LEU 49 N 0.00 0.32 -2.21 3.80 5.85 -1.18 -1.30 115.31 120.59 2b12 h LEU 49 Ca -0.00 -0.86 0.00 0.00 0.84 0.00 0.00 57.88 57.85 2b12 h LEU 49 Cb 0.56 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2b12 h LEU 49 CO 0.03 1.15 0.00 0.00 -0.34 0.00 0.00 178.44 179.28 2b12 h ALA 50 N 0.17 1.00 0.03 1.25 0.00 -0.63 -2.59 119.26 118.50 2b12 h ALA 50 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.51 2b12 h ALA 50 Cb 1.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 2b12 h ALA 50 CO 0.09 0.00 -1.84 1.87 0.00 0.00 0.00 179.25 179.37 2b12 n TRP 51 N -2.99 0.74 0.54 0.00 -0.00 -0.26 -3.96 117.44 111.51 2b12 n TRP 51 Ca -0.01 0.26 0.05 0.00 -0.00 0.00 0.00 57.50 57.80 2b12 n TRP 51 Cb 0.16 -1.08 0.28 0.00 -0.00 0.00 0.00 31.31 30.67 2b12 n TRP 51 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 2b12 n HIS 52 N -4.06 0.00 0.01 5.87 8.25 -0.49 -0.36 115.22 124.44 2b12 n HIS 52 Ca -0.39 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.10 2b12 n HIS 52 Cb 0.84 -0.21 0.06 0.00 1.12 0.00 0.00 29.99 31.80 2b12 n HIS 52 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2b12 n THR 53 N -1.21 0.68 0.00 1.59 -2.24 -1.00 -4.43 114.28 107.67 2b12 n THR 53 Ca 0.06 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 2b12 n THR 53 Cb 0.07 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 2b12 n THR 53 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2b12 n SER 54 N 0.13 2.60 -0.60 3.42 7.64 -0.50 -3.04 113.62 123.27 2b12 n SER 54 Ca 0.05 -0.15 0.07 0.00 1.01 0.00 0.00 58.87 59.86 2b12 n SER 54 Cb 0.28 0.81 0.23 0.00 -1.01 0.00 0.00 64.21 64.53 2b12 n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b12 n GLY 55 N 1.59 0.47 0.16 0.23 0.00 0.51 -3.20 105.19 104.96 2b12 n GLY 55 Ca 0.00 -0.38 0.11 0.00 0.00 0.00 0.00 46.02 45.75 2b12 n GLY 55 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2b12 h THR 56 N 2.04 0.02 -4.00 2.61 1.35 -1.80 -3.39 112.91 109.74 2b12 h THR 56 Ca 0.00 -1.03 -0.56 0.00 -0.55 0.00 0.00 66.41 64.27 2b12 h THR 56 Cb 0.46 1.75 0.15 0.00 -1.73 0.00 0.00 68.15 68.78 2b12 h THR 56 CO 0.00 0.01 0.52 1.87 -0.25 0.00 0.00 175.52 177.67 2b12 n TRP 57 N -2.89 2.00 -4.25 4.73 -0.00 -1.19 -4.42 117.44 111.43 2b12 n TRP 57 Ca 0.02 0.43 -0.18 0.00 -0.00 0.00 0.00 57.50 57.77 2b12 n TRP 57 Cb 0.55 -2.30 -0.15 0.00 -0.00 0.00 0.00 31.31 29.41 2b12 n TRP 57 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 2b12 s ASP 58 N -1.12 0.85 0.10 5.87 -1.08 -0.83 -4.69 116.67 115.77 2b12 s ASP 58 Ca 0.76 -0.13 0.04 0.00 -0.52 0.00 0.00 52.55 52.70 2b12 s ASP 58 Cb -0.40 -0.17 -0.23 0.00 -1.46 0.00 0.00 42.92 40.65 2b12 s ASP 58 CO 0.45 0.06 1.21 0.07 0.52 0.00 0.00 175.17 177.49 2b12 h LYS 59 N 6.22 0.08 0.00 4.34 2.10 -1.86 -2.99 116.57 124.46 2b12 h LYS 59 Ca -0.31 -0.14 -0.06 0.00 -2.00 0.00 0.00 60.65 58.14 2b12 h LYS 59 Cb 1.18 0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 32.55 2b12 h LYS 59 CO 0.49 1.05 -0.28 0.45 -2.00 0.00 0.00 179.45 179.16 2b12 h HIS 60 N 0.02 0.00 0.00 0.07 3.86 -1.97 -3.35 115.15 113.78 2b12 h HIS 60 Ca -0.06 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 2b12 h HIS 60 Cb 1.84 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 30.26 2b12 h HIS 60 CO 0.02 0.28 -0.55 -0.40 0.86 0.00 0.00 177.93 178.14 2b12 n ASP 61 N -4.16 0.17 -2.78 2.45 3.85 -1.26 -4.86 116.55 109.96 2b12 n ASP 61 Ca -0.02 -2.03 -0.07 0.00 -0.71 0.00 0.00 54.79 51.97 2b12 n ASP 61 Cb 0.34 -0.22 -0.01 0.00 -1.35 0.00 0.00 41.12 39.88 2b12 n ASP 61 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 2b12 n ASN 62 N 0.03 -1.33 -4.58 -1.12 2.85 -1.13 -3.71 115.26 106.28 2b12 n ASN 62 Ca 0.01 0.24 -0.35 0.00 -0.11 0.00 0.00 54.58 54.38 2b12 n ASN 62 Cb 0.75 -1.25 -0.11 0.00 1.24 0.00 0.00 39.78 40.42 2b12 n ASN 62 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2b12 s THR 63 N -2.21 4.54 0.00 -0.44 -1.32 -1.25 -4.68 115.64 110.28 2b12 s THR 63 Ca 0.12 -0.12 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 2b12 s THR 63 Cb -0.07 -3.05 0.00 0.00 -1.51 0.00 0.00 72.50 67.87 2b12 s THR 63 CO 0.14 0.45 0.00 0.61 -2.21 0.00 0.00 174.62 173.61 2b12 n GLY 64 N 3.73 0.32 2.03 6.08 0.00 -1.26 -1.97 105.19 114.13 2b12 n GLY 64 Ca -0.17 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.01 2b12 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b12 n GLY 65 N 0.00 -2.54 1.04 -0.02 0.00 -1.26 -4.64 105.19 97.77 2b12 n GLY 65 Ca 0.00 -1.76 0.12 0.00 0.00 0.00 0.00 46.02 44.38 2b12 n GLY 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b12 n SER 66 N 0.03 3.16 0.00 1.61 3.41 -1.17 -4.51 113.62 116.15 2b12 n SER 66 Ca 0.00 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.64 2b12 n SER 66 Cb 0.00 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 2b12 n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b12 n TYR 67 N 1.35 0.00 0.12 7.33 4.19 -1.26 -3.93 117.16 124.97 2b12 n TYR 67 Ca 0.17 0.00 0.01 0.00 3.31 0.00 0.00 57.90 61.40 2b12 n TYR 67 Cb 0.59 -0.10 0.07 0.00 0.49 0.00 0.00 39.34 40.38 2b12 n TYR 67 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2b12 n GLY 68 N -0.36 -0.38 3.51 2.98 0.00 -1.21 -4.07 105.19 105.65 2b12 n GLY 68 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 2b12 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b12 n GLY 69 N -1.07 -0.46 1.62 -0.02 0.00 -1.25 -2.51 105.19 101.50 2b12 n GLY 69 Ca 0.01 0.18 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2b12 n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b12 n THR 70 N -4.07 2.20 -0.05 2.61 -2.24 -1.26 -3.72 114.28 107.75 2b12 n THR 70 Ca -0.26 -0.99 -0.10 0.00 -2.27 0.00 0.00 64.05 60.43 2b12 n THR 70 Cb 0.66 -1.23 -0.15 0.00 -2.10 0.00 0.00 70.33 67.52 2b12 n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b12 n TYR 71 N 0.57 0.65 0.29 4.78 9.36 -1.26 -4.15 117.16 127.40 2b12 n TYR 71 Ca 0.18 0.22 0.16 0.00 3.32 0.00 0.00 57.90 61.78 2b12 n TYR 71 Cb 0.64 -1.12 0.89 0.00 -0.63 0.00 0.00 39.34 39.12 2b12 n TYR 71 CO 0.00 0.00 0.00 0.07 0.22 0.00 0.00 176.86 177.15 2b12 h ARG 72 N 0.00 0.00 -5.61 2.98 0.11 -1.97 -3.34 114.38 106.55 2b12 h ARG 72 Ca -0.39 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.08 2b12 h ARG 72 Cb 2.09 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 33.06 2b12 h ARG 72 CO 0.06 0.05 0.27 -0.06 0.10 0.00 0.00 179.97 180.38 2b12 s PHE 73 N -4.30 3.26 0.11 4.08 0.08 -1.26 -4.98 117.98 114.97 2b12 s PHE 73 Ca -0.04 0.84 0.06 0.00 0.12 0.00 0.00 56.93 57.91 2b12 s PHE 73 Cb 0.13 -2.98 0.39 0.00 -0.57 0.00 0.00 43.02 39.99 2b12 s PHE 73 CO 0.53 -0.41 0.47 1.17 -0.10 0.00 0.00 175.22 176.88 2b12 n LYS 74 N 5.90 -0.02 -0.13 0.44 0.00 -1.26 -2.52 118.16 120.57 2b12 n LYS 74 Ca 0.01 0.41 -0.05 0.00 0.00 0.00 0.00 58.31 58.68 2b12 n LYS 74 Cb 0.48 -0.73 0.03 0.00 0.00 0.00 0.00 35.03 34.82 2b12 n LYS 74 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2b12 h LYS 75 N 0.00 0.30 -0.00 1.64 3.64 -1.93 -2.88 116.57 117.34 2b12 h LYS 75 Ca 0.25 -0.02 -0.22 0.00 -1.27 0.00 0.00 60.65 59.39 2b12 h LYS 75 Cb 0.65 -0.07 0.02 0.00 -0.41 0.00 0.00 32.23 32.42 2b12 h LYS 75 CO -0.23 0.20 -0.85 0.93 -2.27 0.00 0.00 179.45 177.23 2b12 h GLU 76 N 0.30 0.57 -0.84 1.90 4.39 -1.75 -3.35 114.58 115.81 2b12 h GLU 76 Ca 0.19 -0.62 0.12 0.00 0.34 0.00 0.00 59.36 59.40 2b12 h GLU 76 Cb 0.19 0.17 -0.08 0.00 -0.10 0.00 0.00 28.75 28.93 2b12 h GLU 76 CO -0.20 1.23 0.45 0.35 -1.16 0.00 0.00 179.01 179.68 2b12 h PHE 77 N 0.17 0.80 -0.92 4.33 3.04 -1.63 -2.70 116.94 120.03 2b12 h PHE 77 Ca -0.11 0.03 -0.53 0.00 3.98 0.00 0.00 57.97 61.34 2b12 h PHE 77 Cb 1.53 -0.23 -0.29 0.00 2.56 0.00 0.00 35.95 39.52 2b12 h PHE 77 CO 0.12 0.25 0.60 0.09 -2.02 0.00 0.00 178.31 177.35 2b12 n ASN 78 N -4.82 4.80 -4.72 0.41 3.02 -1.09 -4.77 115.26 108.09 2b12 n ASN 78 Ca 0.16 -3.69 -0.42 0.00 -0.03 0.00 0.00 54.58 50.60 2b12 n ASN 78 Cb 0.37 -0.84 -0.04 0.00 -0.61 0.00 0.00 39.78 38.66 2b12 n ASN 78 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2b12 s ASP 79 N -1.66 7.34 0.25 6.41 3.68 -1.02 -4.96 116.67 126.72 2b12 s ASP 79 Ca 0.58 1.83 -0.04 0.00 2.13 0.00 0.00 52.55 57.05 2b12 s ASP 79 Cb 0.48 -2.58 0.51 0.00 -1.45 0.00 0.00 42.92 39.87 2b12 s ASP 79 CO 0.06 -0.23 1.66 -0.65 0.13 0.00 0.00 175.17 176.14 2b12 h PRO 80 N 6.14 0.19 0.00 4.34 0.11 -1.92 -1.16 132.00 139.70 2b12 h PRO 80 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2b12 h PRO 80 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2b12 h PRO 80 CO 0.75 0.13 0.00 -1.13 -0.21 0.00 0.00 178.00 177.53 2b12 n SER 81 N -5.24 0.36 -0.81 -2.05 3.41 -1.26 -2.63 113.62 105.41 2b12 n SER 81 Ca 0.15 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.44 2b12 n SER 81 Cb 0.51 -0.65 0.30 0.00 -0.26 0.00 0.00 64.21 64.12 2b12 n SER 81 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2b12 n ASN 82 N -1.86 2.44 -4.72 4.04 4.13 -0.45 -4.96 115.26 113.87 2b12 n ASN 82 Ca 0.05 -1.82 -0.42 0.00 1.68 0.00 0.00 54.58 54.06 2b12 n ASN 82 Cb 0.29 -0.13 -0.03 0.00 -1.54 0.00 0.00 39.78 38.38 2b12 n ASN 82 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b12 s ALA 83 N -1.74 3.70 0.00 5.41 0.00 -1.08 -3.22 121.76 124.83 2b12 s ALA 83 Ca 0.34 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2b12 s ALA 83 Cb 0.20 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2b12 s ALA 83 CO 0.29 -0.72 0.00 0.41 0.00 0.00 0.00 175.76 175.74 2b12 n GLY 84 N 3.37 1.81 0.32 0.00 0.00 -1.26 -4.77 105.19 104.66 2b12 n GLY 84 Ca 0.12 -0.36 0.22 0.00 0.00 0.00 0.00 46.02 45.99 2b12 n GLY 84 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2b12 h LEU 85 N 0.00 0.00 -1.67 0.99 -0.00 -1.93 -2.91 115.31 109.79 2b12 h LEU 85 Ca 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 57.88 58.15 2b12 h LEU 85 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.59 2b12 h LEU 85 CO 0.00 0.00 0.69 -0.61 -0.00 0.00 0.00 178.44 178.52 2b12 h GLN 86 N 0.00 0.22 -0.43 1.13 4.15 -1.92 0.24 115.11 118.49 2b12 h GLN 86 Ca 0.00 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 2b12 h GLN 86 Cb 0.03 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 2b12 h GLN 86 CO 0.00 0.14 -0.19 -0.91 -1.93 0.00 0.00 178.83 175.95 2b12 h ASN 87 N 0.22 0.85 0.53 -0.69 2.35 -1.94 0.84 115.58 117.75 2b12 h ASN 87 Ca 0.52 -0.30 -0.09 0.00 -0.55 0.00 0.00 56.30 55.88 2b12 h ASN 87 Cb 1.64 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.77 2b12 h ASN 87 CO -0.14 1.02 -0.44 1.23 -1.65 0.00 0.00 177.43 177.45 2b12 h GLY 88 N 0.95 0.00 0.37 2.83 0.00 -0.77 -1.69 103.07 104.77 2b12 h GLY 88 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.39 2b12 h GLY 88 CO 0.05 0.00 -0.17 -2.75 0.00 0.00 0.00 176.54 173.67 2b12 h PHE 89 N 0.00 0.18 -0.48 5.60 3.04 -0.82 -2.47 116.94 121.98 2b12 h PHE 89 Ca -0.00 -0.10 0.07 0.00 3.98 0.00 0.00 57.97 61.92 2b12 h PHE 89 Cb 0.82 -0.02 -0.03 0.00 2.56 0.00 0.00 35.95 39.29 2b12 h PHE 89 CO 0.00 0.90 0.32 0.87 -2.02 0.00 0.00 178.31 178.38 2b12 h LYS 90 N -0.60 0.36 -0.17 1.11 6.56 -0.77 0.08 116.57 123.15 2b12 h LYS 90 Ca -0.02 -0.02 -0.12 0.00 -1.06 0.00 0.00 60.65 59.43 2b12 h LYS 90 Cb 0.94 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.52 2b12 h LYS 90 CO 0.03 0.24 -0.36 0.35 -2.06 0.00 0.00 179.45 177.66 2b12 h PHE 91 N 0.37 0.68 0.00 -1.35 3.57 -1.34 -3.31 116.94 115.57 2b12 h PHE 91 Ca 0.21 -0.25 -0.14 0.00 3.53 0.00 0.00 57.97 61.32 2b12 h PHE 91 Cb 0.36 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 2b12 h PHE 91 CO -0.00 0.99 -0.64 -0.07 -2.23 0.00 0.00 178.31 176.35 2b12 h LEU 92 N 0.19 0.00 -1.94 0.59 -0.00 -0.63 -3.37 115.31 110.14 2b12 h LEU 92 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 2b12 h LEU 92 Cb 0.96 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.61 2b12 h LEU 92 CO 0.08 0.64 -0.06 1.05 -0.00 0.00 0.00 178.44 180.15 2b12 h GLU 93 N 0.00 0.00 0.00 1.13 4.11 -1.14 -1.83 114.58 116.84 2b12 h GLU 93 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2b12 h GLU 93 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2b12 h GLU 93 CO 0.08 0.06 0.00 -2.30 0.07 0.00 0.00 179.01 176.93 2b12 n PRO 94 N -4.35 0.05 0.05 1.06 -0.02 -1.26 -2.19 135.00 128.34 2b12 n PRO 94 Ca -0.03 0.09 0.11 0.00 -2.02 0.00 0.00 63.50 61.66 2b12 n PRO 94 Cb 0.14 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.07 2b12 n PRO 94 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2b12 n ILE 95 N -1.47 0.30 1.14 4.25 5.41 -0.71 -3.36 119.36 124.93 2b12 n ILE 95 Ca 0.06 -0.46 0.13 0.00 1.00 0.00 0.00 62.75 63.49 2b12 n ILE 95 Cb 0.26 -0.09 0.48 0.00 -0.71 0.00 0.00 39.64 39.58 2b12 n ILE 95 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 2b12 n HIS 96 N -2.36 0.00 0.80 1.39 -0.00 -0.93 -1.34 115.22 112.79 2b12 n HIS 96 Ca -0.01 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.25 2b12 n HIS 96 Cb 0.53 -0.29 -0.09 0.00 -0.12 0.00 0.00 29.99 30.01 2b12 n HIS 96 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 2b12 n LYS 97 N -1.28 1.38 -0.08 1.57 0.00 -1.14 -3.43 118.16 115.18 2b12 n LYS 97 Ca 0.09 -0.06 -0.06 0.00 0.00 0.00 0.00 58.31 58.28 2b12 n LYS 97 Cb 0.32 -1.31 -0.16 0.00 0.00 0.00 0.00 35.03 33.88 2b12 n LYS 97 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2b12 n GLU 98 N -1.32 0.68 -3.60 1.64 2.13 -1.13 -4.67 120.64 114.37 2b12 n GLU 98 Ca 0.03 -0.02 -0.28 0.00 0.66 0.00 0.00 57.16 57.55 2b12 n GLU 98 Cb 0.27 -1.54 -0.11 0.00 0.27 0.00 0.00 31.44 30.33 2b12 n GLU 98 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2b12 s PHE 99 N -2.67 1.85 -0.35 4.31 0.08 -0.45 -4.97 117.98 115.78 2b12 s PHE 99 Ca -0.09 -2.51 0.25 0.00 0.12 0.00 0.00 56.93 54.70 2b12 s PHE 99 Cb 0.07 -1.58 0.55 0.00 -0.57 0.00 0.00 43.02 41.49 2b12 s PHE 99 CO 0.84 -0.75 1.69 -1.00 -0.10 0.00 0.00 175.22 175.90 2b12 h PRO 100 N 6.03 0.00 -0.21 0.24 0.13 -1.83 -3.31 132.00 133.06 2b12 h PRO 100 Ca 0.14 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.15 2b12 h PRO 100 Cb 0.89 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 2b12 h PRO 100 CO 0.47 0.00 -0.39 0.11 -0.23 0.00 0.00 178.00 177.95 2b12 h TRP 101 N 0.00 0.55 -3.91 1.56 5.08 -1.93 -3.45 115.95 113.85 2b12 h TRP 101 Ca 0.00 -0.15 -0.53 0.00 1.08 0.00 0.00 58.89 59.29 2b12 h TRP 101 Cb 0.90 -0.12 0.08 0.00 -3.00 0.00 0.00 29.16 27.01 2b12 h TRP 101 CO 0.00 0.80 0.67 -1.50 -1.28 0.00 0.00 178.44 177.13 2b12 s ILE 102 N -4.23 2.51 0.50 0.12 2.07 -1.25 -5.00 121.20 115.92 2b12 s ILE 102 Ca -0.07 0.51 -0.19 0.00 -1.41 0.00 0.00 60.65 59.50 2b12 s ILE 102 Cb 0.13 -3.32 -0.08 0.00 0.13 0.00 0.00 42.46 39.32 2b12 s ILE 102 CO 0.81 0.11 1.00 -0.94 -1.91 0.00 0.00 174.94 174.02 2b12 s SER 103 N -0.43 6.47 0.16 4.50 1.04 -1.26 -4.98 113.70 119.20 2b12 s SER 103 Ca 0.51 1.76 -0.16 0.00 0.48 0.00 0.00 55.95 58.54 2b12 s SER 103 Cb -0.41 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.22 2b12 s SER 103 CO 0.55 -0.69 1.77 0.28 0.98 0.00 0.00 173.24 176.13 2b12 h SER 104 N 1.31 0.24 -0.54 7.02 0.02 -1.88 -2.82 113.55 116.90 2b12 h SER 104 Ca -0.48 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.43 2b12 h SER 104 Cb 1.20 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.70 2b12 h SER 104 CO 0.60 0.18 0.10 1.23 -1.14 0.00 0.00 176.83 177.80 2b12 h GLY 105 N 0.36 0.95 2.00 -3.77 0.00 -1.72 -2.66 103.07 98.23 2b12 h GLY 105 Ca 0.16 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 2b12 h GLY 105 CO -0.13 0.58 -0.01 -0.55 0.00 0.00 0.00 176.54 176.43 2b12 h ASP 106 N 0.78 0.00 0.25 0.19 3.45 -1.71 -2.50 116.42 116.88 2b12 h ASP 106 Ca 0.17 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 57.29 2b12 h ASP 106 Cb 0.38 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.13 2b12 h ASP 106 CO 0.01 0.01 -1.87 0.25 -1.57 0.00 0.00 179.24 176.06 2b12 h LEU 107 N 0.00 0.31 -0.27 1.55 5.85 -1.23 -2.98 115.31 118.54 2b12 h LEU 107 Ca -0.00 -0.66 -0.20 0.00 0.84 0.00 0.00 57.88 57.86 2b12 h LEU 107 Cb 0.15 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2b12 h LEU 107 CO 0.00 1.59 -0.62 -0.26 -0.34 0.00 0.00 178.44 178.81 2b12 h PHE 108 N 0.05 1.07 -0.19 1.25 0.05 -1.29 0.80 116.94 118.68 2b12 h PHE 108 Ca -0.37 -0.41 -0.05 0.00 3.82 0.00 0.00 57.97 60.96 2b12 h PHE 108 Cb 2.03 -0.19 -0.01 0.00 2.00 0.00 0.00 35.95 39.79 2b12 h PHE 108 CO 0.06 1.24 -0.06 0.66 -0.18 0.00 0.00 178.31 180.03 2b12 h SER 109 N 0.62 0.38 0.73 2.17 4.64 -1.63 -2.92 113.55 117.54 2b12 h SER 109 Ca -0.01 -0.38 -0.03 0.00 -0.47 0.00 0.00 61.79 60.91 2b12 h SER 109 Cb 1.24 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2b12 h SER 109 CO 0.13 0.67 -0.15 0.25 -0.87 0.00 0.00 176.83 176.87 2b12 h LEU 110 N 0.09 0.00 -0.32 5.97 5.85 -1.51 -2.49 115.31 122.91 2b12 h LEU 110 Ca 0.05 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 2b12 h LEU 110 Cb 0.51 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2b12 h LEU 110 CO 0.02 0.15 0.13 1.23 -0.34 0.00 0.00 178.44 179.63 2b12 h GLY 111 N 1.61 0.52 2.00 3.75 0.00 -0.67 -0.75 103.07 109.53 2b12 h GLY 111 Ca -0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 2b12 h GLY 111 CO 0.02 0.26 -0.51 -1.33 0.00 0.00 0.00 176.54 174.98 2b12 h GLY 112 N 0.37 0.00 0.66 4.60 0.00 -1.28 -2.74 103.07 104.68 2b12 h GLY 112 Ca 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 2b12 h GLY 112 CO -0.01 0.00 -0.34 -2.08 0.00 0.00 0.00 176.54 174.11 2b12 h VAL 113 N 0.00 1.44 0.00 4.60 2.07 -1.25 -2.85 116.25 120.26 2b12 h VAL 113 Ca -0.01 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.72 2b12 h VAL 113 Cb 1.12 2.43 0.00 0.00 -1.52 0.00 0.00 31.29 33.32 2b12 h VAL 113 CO 0.07 0.51 0.00 1.07 0.02 0.00 0.00 177.57 179.24 2b12 n THR 114 N -4.42 0.86 -0.07 2.57 5.66 -0.31 -2.59 114.28 115.98 2b12 n THR 114 Ca -0.09 0.22 -0.16 0.00 -3.05 0.00 0.00 64.05 60.98 2b12 n THR 114 Cb 0.52 -1.10 -0.13 0.00 -1.55 0.00 0.00 70.33 68.07 2b12 n THR 114 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b12 h ALA 115 N 2.33 0.04 -0.20 1.79 0.00 -1.42 -3.22 119.26 118.58 2b12 h ALA 115 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 2b12 h ALA 115 Cb 0.35 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2b12 h ALA 115 CO 0.00 0.14 0.10 0.28 0.00 0.00 0.00 179.25 179.77 2b12 h VAL 116 N -0.96 1.12 -0.57 0.00 2.07 -1.33 -2.42 116.25 114.16 2b12 h VAL 116 Ca -0.06 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 2b12 h VAL 116 Cb 1.08 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 2b12 h VAL 116 CO -0.03 0.12 0.30 1.56 0.02 0.00 0.00 177.57 179.54 2b12 h GLN 117 N 0.21 0.80 0.00 1.57 4.20 -1.68 0.62 115.11 120.83 2b12 h GLN 117 Ca 0.07 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 2b12 h GLN 117 Cb 0.09 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 2b12 h GLN 117 CO -0.01 0.63 -0.25 1.49 -0.67 0.00 0.00 178.83 180.02 2b12 h GLU 118 N 0.77 0.00 -0.77 1.46 4.57 -1.55 -0.95 114.58 118.10 2b12 h GLU 118 Ca 0.20 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.37 2b12 h GLU 118 Cb 0.07 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 2b12 h GLU 118 CO -0.03 0.25 0.01 -1.33 -1.18 0.00 0.00 179.01 176.73 2b12 n MET 119 N -3.98 3.14 -3.02 1.92 2.81 -0.92 -4.88 117.12 112.19 2b12 n MET 119 Ca -0.02 -1.75 -0.19 0.00 -1.81 0.00 0.00 57.70 53.93 2b12 n MET 119 Cb 0.32 -1.92 0.04 0.00 -0.71 0.00 0.00 33.22 30.95 2b12 n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2b12 n GLN 120 N 0.33 -4.77 -0.37 0.03 3.00 -0.36 -1.41 117.38 113.83 2b12 n GLN 120 Ca 0.16 0.76 0.00 0.00 -0.01 0.00 0.00 57.00 57.91 2b12 n GLN 120 Cb 0.79 -5.35 0.00 0.00 0.00 0.00 0.00 30.24 25.68 2b12 n GLN 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2b12 n GLY 121 N -1.50 0.59 3.79 1.08 0.00 0.17 -4.84 105.19 104.48 2b12 n GLY 121 Ca -0.07 -1.90 -0.33 0.00 0.00 0.00 0.00 46.02 43.72 2b12 n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b12 s PRO 122 N -1.17 3.14 -0.91 1.61 0.04 -1.26 -4.66 135.00 131.78 2b12 s PRO 122 Ca 0.00 1.30 -0.24 0.00 0.04 0.00 0.00 61.00 62.10 2b12 s PRO 122 Cb 0.00 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.57 2b12 s PRO 122 CO 0.00 -0.97 1.47 0.15 0.04 0.00 0.00 177.00 177.69 2b12 s LYS 123 N -4.01 3.34 -0.47 4.56 1.02 -1.26 -4.40 119.74 118.51 2b12 s LYS 123 Ca 0.66 -0.72 -0.29 0.00 0.02 0.00 0.00 55.97 55.64 2b12 s LYS 123 Cb -0.18 -4.96 0.03 0.00 -0.52 0.00 0.00 37.83 32.20 2b12 s LYS 123 CO 0.38 -2.33 1.11 0.42 -0.92 0.00 0.00 175.35 174.01 2b12 s ILE 124 N 5.86 4.25 0.61 2.17 1.01 -1.26 -4.98 121.20 128.87 2b12 s ILE 124 Ca 0.46 1.19 -0.19 0.00 0.00 0.00 0.00 60.65 62.11 2b12 s ILE 124 Cb -0.03 -4.58 -0.03 0.00 0.01 0.00 0.00 42.46 37.83 2b12 s ILE 124 CO -0.01 -0.96 1.28 -2.65 0.00 0.00 0.00 174.94 172.60 2b12 n PRO 125 N 7.72 1.26 -3.81 2.79 -0.02 -1.26 -4.83 135.00 136.84 2b12 n PRO 125 Ca 0.11 0.48 -0.12 0.00 -2.02 0.00 0.00 63.50 61.95 2b12 n PRO 125 Cb 0.49 -2.51 -0.13 0.00 -0.02 0.00 0.00 33.50 31.34 2b12 n PRO 125 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 2b12 s TRP 126 N -1.37 -0.17 0.08 6.00 -0.00 0.16 -4.80 118.94 118.83 2b12 s TRP 126 Ca 0.79 0.42 0.05 0.00 -0.00 0.00 0.00 56.10 57.36 2b12 s TRP 126 Cb -0.40 0.05 -0.04 0.00 -0.00 0.00 0.00 33.47 33.09 2b12 s TRP 126 CO 0.44 -0.09 -0.05 1.03 -0.00 0.00 0.00 176.95 178.28 2b12 s ARG 127 N 0.15 2.40 0.47 5.86 0.52 -1.26 -0.50 118.95 126.59 2b12 s ARG 127 Ca -0.01 -0.88 0.07 0.00 -0.52 0.00 0.00 55.73 54.39 2b12 s ARG 127 Cb -0.02 -2.45 -0.00 0.00 0.52 0.00 0.00 34.95 33.00 2b12 s ARG 127 CO -0.00 0.54 0.34 0.00 0.02 0.00 0.00 175.30 176.20 2b12 n GLY 129 N -1.56 1.99 2.80 0.00 0.00 -1.26 -4.84 105.19 102.32 2b12 n GLY 129 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2b12 n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b12 n ARG 130 N -0.68 3.18 -1.70 1.61 1.74 -1.26 -3.27 116.66 116.27 2b12 n ARG 130 Ca 0.00 -3.00 -0.43 0.00 -0.77 0.00 0.00 57.85 53.65 2b12 n ARG 130 Cb 0.00 -3.14 -0.02 0.00 -1.02 0.00 0.00 32.46 28.28 2b12 n ARG 130 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2b12 n VAL 131 N 4.40 1.20 -1.83 1.55 0.31 -1.26 -4.10 118.33 118.61 2b12 n VAL 131 Ca 0.47 -0.30 -0.42 0.00 -0.01 0.00 0.00 64.34 64.08 2b12 n VAL 131 Cb 0.38 -1.65 -0.02 0.00 -0.91 0.00 0.00 33.84 31.64 2b12 n VAL 131 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2b12 s ASP 132 N 0.23 6.45 0.17 4.52 1.11 -1.26 -3.36 116.67 124.52 2b12 s ASP 132 Ca 0.64 2.84 0.11 0.00 0.18 0.00 0.00 52.55 56.31 2b12 s ASP 132 Cb -0.58 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 40.75 2b12 s ASP 132 CO 0.52 -0.88 -0.22 0.42 1.18 0.00 0.00 175.17 176.19 2b12 s THR 133 N 0.44 2.52 1.04 -1.27 -4.23 -1.04 -4.92 115.64 108.18 2b12 s THR 133 Ca 0.66 -1.85 -0.18 0.00 -1.18 0.00 0.00 61.69 59.15 2b12 s THR 133 Cb -0.47 -2.19 0.03 0.00 1.34 0.00 0.00 72.50 71.21 2b12 s THR 133 CO 0.41 -0.04 -0.11 -2.65 -0.54 0.00 0.00 174.62 171.69 2b12 n PRO 134 N 0.45 -0.87 0.05 3.99 -0.02 -1.26 -4.90 135.00 132.44 2b12 n PRO 134 Ca -0.14 -0.23 0.11 0.00 -2.02 0.00 0.00 63.50 61.22 2b12 n PRO 134 Cb 0.55 -1.61 0.45 0.00 -0.02 0.00 0.00 33.50 32.87 2b12 n PRO 134 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2b12 n GLU 135 N -1.04 0.10 0.18 -0.52 0.00 -1.26 -3.07 120.64 115.03 2b12 n GLU 135 Ca 0.02 0.23 0.13 0.00 0.00 0.00 0.00 57.16 57.54 2b12 n GLU 135 Cb 0.60 -1.65 0.33 0.00 0.00 0.00 0.00 31.44 30.72 2b12 n GLU 135 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.13 177.51 2b12 h ASP 136 N 0.00 0.00 -0.92 -1.84 3.04 -2.05 -3.13 116.42 111.52 2b12 h ASP 136 Ca 0.00 0.00 -0.62 0.00 -3.24 0.00 0.00 57.03 53.17 2b12 h ASP 136 Cb 0.43 0.00 -0.31 0.00 -1.04 0.00 0.00 39.33 38.41 2b12 h ASP 136 CO 0.00 0.00 0.49 0.35 -2.04 0.00 0.00 179.24 178.04 2b12 n THR 137 N -2.77 3.34 -3.23 1.15 -2.24 -1.17 -4.90 114.28 104.45 2b12 n THR 137 Ca 0.04 -3.07 -0.40 0.00 -2.27 0.00 0.00 64.05 58.35 2b12 n THR 137 Cb 0.45 -1.05 -0.07 0.00 -2.10 0.00 0.00 70.33 67.56 2b12 n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2b12 s THR 138 N -4.57 5.08 -0.15 4.28 2.01 -1.19 -4.87 115.64 116.24 2b12 s THR 138 Ca 0.61 0.92 -0.29 0.00 0.31 0.00 0.00 61.69 63.24 2b12 s THR 138 Cb 0.48 -3.84 -0.00 0.00 0.01 0.00 0.00 72.50 69.15 2b12 s THR 138 CO 0.01 0.12 1.01 -2.84 -0.69 0.00 0.00 174.62 172.23 2b12 s PRO 139 N 2.06 4.36 0.19 4.92 0.02 -1.26 -4.98 135.00 140.31 2b12 s PRO 139 Ca 0.22 1.37 -0.17 0.00 0.02 0.00 0.00 61.00 62.44 2b12 s PRO 139 Cb -0.16 -3.58 -0.11 0.00 0.02 0.00 0.00 34.50 30.68 2b12 s PRO 139 CO 0.09 -0.43 0.23 -0.25 -0.33 0.00 0.00 177.00 176.31 2b12 n ASP 140 N 5.47 -1.32 -4.14 2.53 10.43 -1.26 -4.63 116.55 123.64 2b12 n ASP 140 Ca 0.10 0.67 -0.30 0.00 2.57 0.00 0.00 54.79 57.84 2b12 n ASP 140 Cb 0.48 -0.62 0.21 0.00 1.84 0.00 0.00 41.12 43.03 2b12 n ASP 140 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 2b12 s ASN 141 N -0.68 1.68 0.00 -2.24 0.02 -1.26 -4.57 114.94 107.89 2b12 s ASN 141 Ca 0.42 0.78 0.00 0.00 -1.02 0.00 0.00 52.86 53.04 2b12 s ASN 141 Cb -0.55 -1.15 0.00 0.00 0.02 0.00 0.00 41.25 39.58 2b12 s ASN 141 CO 0.40 -3.67 0.00 0.61 0.02 0.00 0.00 177.10 174.46 2b12 n GLY 142 N -1.26 1.02 0.11 0.66 0.00 -1.26 -4.90 105.19 99.56 2b12 n GLY 142 Ca 0.11 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.28 2b12 n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b12 n ARG 143 N -2.00 1.03 -3.11 1.61 1.74 -1.26 -4.81 116.66 109.86 2b12 n ARG 143 Ca 0.00 -0.22 -0.19 0.00 -0.77 0.00 0.00 57.85 56.67 2b12 n ARG 143 Cb 0.00 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 29.95 2b12 n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2b12 s LEU 144 N -2.12 3.71 0.53 0.55 2.01 -1.26 -4.56 118.68 117.54 2b12 s LEU 144 Ca 0.42 -0.17 -0.05 0.00 0.01 0.00 0.00 54.13 54.33 2b12 s LEU 144 Cb 0.21 -2.80 -0.01 0.00 0.01 0.00 0.00 46.19 43.60 2b12 s LEU 144 CO 0.39 -0.69 0.83 -2.16 1.01 0.00 0.00 176.35 175.72 2b12 s PRO 145 N -4.38 3.20 -0.16 1.29 0.04 -1.26 -5.08 135.00 128.65 2b12 s PRO 145 Ca 0.51 0.04 -0.07 0.00 0.04 0.00 0.00 61.00 61.52 2b12 s PRO 145 Cb -0.10 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 2b12 s PRO 145 CO 0.34 -0.45 0.09 -0.51 0.04 0.00 0.00 177.00 176.51 2b12 s ASP 146 N -4.21 5.90 0.21 6.66 1.11 -1.26 -5.02 116.67 120.05 2b12 s ASP 146 Ca 0.51 0.21 0.09 0.00 0.18 0.00 0.00 52.55 53.54 2b12 s ASP 146 Cb -0.10 -1.96 0.13 0.00 1.07 0.00 0.00 42.92 42.06 2b12 s ASP 146 CO 0.44 0.25 1.48 0.00 1.18 0.00 0.00 175.17 178.53 2b12 h ALA 147 N 6.11 0.73 0.00 5.23 0.00 -2.00 -3.35 119.26 125.99 2b12 h ALA 147 Ca -0.44 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 53.77 2b12 h ALA 147 Cb 1.18 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2b12 h ALA 147 CO 0.67 0.96 0.00 -0.40 0.00 0.00 0.00 179.25 180.48 2b12 n ASP 148 N -3.63 0.00 -1.93 0.00 5.68 -1.26 -3.05 116.55 112.37 2b12 n ASP 148 Ca -0.01 -0.10 0.00 0.00 -0.50 0.00 0.00 54.79 54.18 2b12 n ASP 148 Cb 0.74 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.56 2b12 n ASP 148 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2b12 n LYS 149 N -1.16 0.72 -0.47 0.11 5.02 -1.26 -4.88 118.16 116.25 2b12 n LYS 149 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2b12 n LYS 149 Cb 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.08 2b12 n LYS 149 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2b12 n ASP 150 N -2.50 1.69 -0.03 4.39 5.75 -1.26 -3.95 116.55 120.64 2b12 n ASP 150 Ca 0.00 -0.25 -0.10 0.00 -0.01 0.00 0.00 54.79 54.43 2b12 n ASP 150 Cb 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 2b12 n ASP 150 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b12 h ALA 151 N 0.75 -0.32 -0.09 2.12 0.00 -1.87 -2.84 119.26 117.01 2b12 h ALA 151 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2b12 h ALA 151 Cb 0.00 0.62 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2b12 h ALA 151 CO 0.00 -0.77 0.08 0.38 0.00 0.00 0.00 179.25 178.93 2b12 h ASP 152 N -0.36 0.00 -0.06 0.00 -0.00 -1.98 -1.72 116.42 112.31 2b12 h ASP 152 Ca 0.11 0.00 -0.18 0.00 -0.00 0.00 0.00 57.03 56.97 2b12 h ASP 152 Cb 0.54 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 39.88 2b12 h ASP 152 CO -0.39 0.00 -0.65 0.22 -0.00 0.00 0.00 179.24 178.42 2b12 h TYR 153 N 0.00 0.76 0.00 4.15 5.03 -1.92 -2.57 116.97 122.42 2b12 h TYR 153 Ca 0.04 -0.38 -0.05 0.00 2.58 0.00 0.00 58.73 60.93 2b12 h TYR 153 Cb 0.20 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.37 2b12 h TYR 153 CO 0.00 1.18 -0.23 0.28 -1.32 0.00 0.00 178.16 178.07 2b12 h VAL 154 N 0.13 0.75 0.02 1.81 2.07 -1.11 0.28 116.25 120.19 2b12 h VAL 154 Ca -0.07 -0.97 -0.08 0.00 0.82 0.00 0.00 66.70 66.40 2b12 h VAL 154 Cb 1.32 1.60 0.01 0.00 -1.52 0.00 0.00 31.29 32.70 2b12 h VAL 154 CO 0.13 0.23 -0.33 -0.09 0.02 0.00 0.00 177.57 177.53 2b12 h ARG 155 N 0.00 0.19 0.00 1.57 2.43 -1.43 -2.85 114.38 114.30 2b12 h ARG 155 Ca -0.00 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2b12 h ARG 155 Cb 0.58 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2b12 h ARG 155 CO 0.03 0.99 -0.09 1.15 -1.51 0.00 0.00 179.97 180.55 2b12 h THR 156 N -0.50 0.00 0.08 0.20 2.02 -1.27 -2.64 112.91 110.80 2b12 h THR 156 Ca -0.05 -0.69 -0.12 0.00 0.77 0.00 0.00 66.41 66.32 2b12 h THR 156 Cb 1.12 1.64 0.01 0.00 -1.74 0.00 0.00 68.15 69.18 2b12 h THR 156 CO 0.06 0.00 -0.55 0.15 0.37 0.00 0.00 175.52 175.55 2b12 h PHE 157 N 0.00 0.32 0.00 3.16 3.04 -0.54 -3.29 116.94 119.63 2b12 h PHE 157 Ca 0.00 -0.23 0.00 0.00 3.98 0.00 0.00 57.97 61.72 2b12 h PHE 157 Cb 0.84 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.34 2b12 h PHE 157 CO 0.00 1.21 0.00 1.19 -2.02 0.00 0.00 178.31 178.69 2b12 n PHE 158 N -4.31 0.00 0.22 0.41 3.01 -1.08 -2.29 117.46 113.42 2b12 n PHE 158 Ca -0.13 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.41 2b12 n PHE 158 Cb 0.69 -0.46 0.47 0.00 -0.01 0.00 0.00 39.48 40.17 2b12 n PHE 158 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 2b12 h GLN 159 N 0.00 0.00 0.00 -1.08 4.20 -1.54 -2.56 115.11 114.14 2b12 h GLN 159 Ca 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2b12 h GLN 159 Cb 0.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2b12 h GLN 159 CO 0.00 0.26 -0.43 -0.09 -0.67 0.00 0.00 178.83 177.89 2b12 h ARG 160 N 0.00 0.00 -0.02 1.46 2.43 -1.63 -3.02 114.38 113.61 2b12 h ARG 160 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2b12 h ARG 160 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2b12 h ARG 160 CO 0.03 0.43 -0.04 1.28 -1.51 0.00 0.00 179.97 180.16 2b12 n LEU 161 N -3.33 1.63 -2.91 3.80 4.77 -0.99 -2.83 117.00 117.15 2b12 n LEU 161 Ca 0.01 -0.53 -0.14 0.00 -0.03 0.00 0.00 56.01 55.31 2b12 n LEU 161 Cb 0.63 -0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.78 2b12 n LEU 161 CO 0.39 0.27 0.11 -3.20 -1.33 0.00 0.00 177.39 173.63 2b12 n ASN 162 N 0.20 -2.70 -4.26 -1.43 5.15 -1.14 -4.97 115.26 106.11 2b12 n ASN 162 Ca 0.17 -0.47 -0.31 0.00 -0.60 0.00 0.00 54.58 53.37 2b12 n ASN 162 Cb 0.39 -4.12 -0.16 0.00 -0.53 0.00 0.00 39.78 35.36 2b12 n ASN 162 CO 0.00 0.00 0.00 -0.32 1.40 0.00 0.00 177.26 178.34 2b12 s MET 163 N -5.26 2.32 0.18 1.20 1.75 -1.08 -5.06 119.30 113.36 2b12 s MET 163 Ca 0.09 -0.88 0.03 0.00 -1.25 0.00 0.00 55.69 53.68 2b12 s MET 163 Cb -0.04 -2.04 0.03 0.00 2.84 0.00 0.00 34.83 35.62 2b12 s MET 163 CO 0.57 0.42 0.25 0.27 -0.65 0.00 0.00 175.02 175.88 2b12 n ASN 164 N 2.82 0.62 -0.09 1.11 6.94 -1.26 -4.38 115.26 121.01 2b12 n ASN 164 Ca -0.17 -1.46 -0.14 0.00 -0.02 0.00 0.00 54.58 52.79 2b12 n ASN 164 Cb 0.52 -0.14 -0.10 0.00 -2.36 0.00 0.00 39.78 37.70 2b12 n ASN 164 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2b12 h ASP 165 N 0.00 -1.80 -0.67 0.53 3.45 -1.99 0.05 116.42 115.99 2b12 h ASP 165 Ca -0.09 0.23 0.08 0.00 0.43 0.00 0.00 57.03 57.68 2b12 h ASP 165 Cb 0.38 0.73 -0.04 0.00 -0.56 0.00 0.00 39.33 39.84 2b12 h ASP 165 CO 0.12 -0.43 0.44 -0.09 -1.57 0.00 0.00 179.24 177.71 2b12 h ARG 166 N -0.47 0.59 0.05 3.56 2.43 -1.95 -2.29 114.38 116.30 2b12 h ARG 166 Ca 0.06 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 58.96 2b12 h ARG 166 Cb 0.62 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 2b12 h ARG 166 CO -0.53 0.39 -1.04 0.93 -1.51 0.00 0.00 179.97 178.21 2b12 h GLU 167 N 0.61 0.19 0.00 0.20 5.08 -1.74 -3.07 114.58 115.86 2b12 h GLU 167 Ca 0.30 -0.27 -0.21 0.00 -1.00 0.00 0.00 59.36 58.17 2b12 h GLU 167 Cb 0.37 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2b12 h GLU 167 CO -0.10 1.07 -1.03 -0.39 -1.00 0.00 0.00 179.01 177.56 2b12 h VAL 168 N 0.08 1.66 -0.26 3.13 -1.51 -0.48 -2.56 116.25 116.31 2b12 h VAL 168 Ca -0.07 -3.37 -0.14 0.00 -1.23 0.00 0.00 66.70 61.89 2b12 h VAL 168 Cb 1.73 2.82 -0.01 0.00 -2.13 0.00 0.00 31.29 33.70 2b12 h VAL 168 CO 0.16 0.95 -0.40 0.58 -1.23 0.00 0.00 177.57 177.63 2b12 h VAL 169 N 0.00 1.30 -0.10 7.19 2.07 -1.54 -1.79 116.25 123.38 2b12 h VAL 169 Ca -0.02 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 65.92 2b12 h VAL 169 Cb 1.78 1.52 -0.00 0.00 -1.52 0.00 0.00 31.29 33.07 2b12 h VAL 169 CO 0.13 0.50 0.01 0.00 0.02 0.00 0.00 177.57 178.22 2b12 h ALA 170 N 1.06 0.13 0.00 1.67 0.00 -1.53 -2.90 119.26 117.69 2b12 h ALA 170 Ca 0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2b12 h ALA 170 Cb 0.91 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2b12 h ALA 170 CO 0.08 -0.21 -0.21 -0.07 0.00 0.00 0.00 179.25 178.84 2b12 h LEU 171 N -0.09 0.00 -1.28 0.00 3.38 -1.40 -2.77 115.31 113.15 2b12 h LEU 171 Ca 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2b12 h LEU 171 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2b12 h LEU 171 CO 0.00 0.21 -0.15 -0.03 0.09 0.00 0.00 178.44 178.57 2b12 h MET 172 N 0.00 0.00 0.00 1.13 4.05 -1.12 -2.96 114.93 116.03 2b12 h MET 172 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2b12 h MET 172 Cb 0.38 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 2b12 h MET 172 CO 0.03 0.15 0.00 0.41 0.23 0.00 0.00 176.91 177.72 2b12 n GLY 173 N 0.05 -0.70 0.00 1.39 0.00 -1.04 -1.89 105.19 103.00 2b12 n GLY 173 Ca 0.00 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.08 2b12 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b12 n ALA 174 N -1.22 2.42 1.66 4.61 0.00 -1.12 -2.84 120.51 124.03 2b12 n ALA 174 Ca 0.08 -0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.52 2b12 n ALA 174 Cb 0.10 -1.45 0.81 0.00 0.00 0.00 0.00 19.45 18.92 2b12 n ALA 174 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2b12 n HIS 175 N -1.19 0.00 0.26 0.00 8.25 -0.79 -2.26 115.22 119.49 2b12 n HIS 175 Ca 0.16 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.76 2b12 n HIS 175 Cb 0.17 -0.09 0.66 0.00 1.12 0.00 0.00 29.99 31.85 2b12 n HIS 175 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b12 h ALA 176 N 3.66 1.05 -2.73 -1.41 0.00 -1.79 -3.40 119.26 114.64 2b12 h ALA 176 Ca 0.00 -0.08 -0.58 0.00 0.00 0.00 0.00 54.91 54.24 2b12 h ALA 176 Cb 0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2b12 h ALA 176 CO 0.00 0.11 -0.09 -0.51 0.00 0.00 0.00 179.25 178.76 2b12 s LEU 177 N -6.54 4.46 0.00 0.00 1.43 -0.96 -4.29 118.68 112.77 2b12 s LEU 177 Ca -0.00 1.09 0.00 0.00 -1.03 0.00 0.00 54.13 54.19 2b12 s LEU 177 Cb 0.10 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.54 2b12 s LEU 177 CO 0.57 0.22 0.00 0.61 0.23 0.00 0.00 176.35 177.98 2b12 n GLY 178 N 2.11 0.88 3.33 -3.19 0.00 -0.90 -4.93 105.19 102.49 2b12 n GLY 178 Ca -0.10 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.01 2b12 n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b12 s LYS 179 N 0.00 1.26 -0.14 1.61 0.00 -1.26 -4.11 119.74 117.09 2b12 s LYS 179 Ca 0.00 -1.42 -0.17 0.00 0.00 0.00 0.00 55.97 54.37 2b12 s LYS 179 Cb 0.00 0.34 -0.04 0.00 0.00 0.00 0.00 37.83 38.13 2b12 s LYS 179 CO 0.00 -0.45 0.45 -0.08 0.00 0.00 0.00 175.35 175.27 2b12 s THR 180 N -4.07 5.20 -0.17 3.79 -1.32 -1.17 -4.98 115.64 112.92 2b12 s THR 180 Ca 0.29 0.87 -0.06 0.00 -1.21 0.00 0.00 61.69 61.58 2b12 s THR 180 Cb 0.04 -3.79 -0.04 0.00 -1.51 0.00 0.00 72.50 67.21 2b12 s THR 180 CO 0.08 0.31 0.03 -1.00 -2.21 0.00 0.00 174.62 171.82 2b12 s HIS 181 N 0.80 3.18 -0.26 9.09 0.09 -1.08 -2.42 115.29 124.68 2b12 s HIS 181 Ca 0.24 -0.03 0.27 0.00 -0.00 0.00 0.00 55.06 55.53 2b12 s HIS 181 Cb -0.15 -2.02 1.15 0.00 -0.00 0.00 0.00 32.58 31.57 2b12 s HIS 181 CO 0.09 0.13 1.81 1.25 -0.00 0.00 0.00 174.74 178.01 2b12 h LEU 182 N 6.55 0.00 -0.02 0.89 6.46 -1.43 -2.79 115.31 124.97 2b12 h LEU 182 Ca -0.36 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.14 2b12 h LEU 182 Cb 1.18 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 41.12 2b12 h LEU 182 CO 0.67 0.00 -1.10 0.11 -0.62 0.00 0.00 178.44 177.49 2b12 h LYS 183 N 0.00 0.39 0.00 1.25 1.57 -1.95 -3.09 116.57 114.74 2b12 h LYS 183 Ca 0.00 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 2b12 h LYS 183 Cb 0.37 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2b12 h LYS 183 CO 0.00 1.19 -0.24 -0.91 -0.57 0.00 0.00 179.45 178.92 2b12 h ASN 184 N 0.18 0.00 -0.01 0.86 -0.26 -1.88 -3.44 115.58 111.03 2b12 h ASN 184 Ca -0.12 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.62 2b12 h ASN 184 Cb 1.78 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.04 2b12 h ASN 184 CO 0.19 0.50 -0.03 -1.54 -1.06 0.00 0.00 177.43 175.50 2b12 n SER 185 N -4.09 1.38 -1.24 5.81 3.41 -1.06 -4.70 113.62 113.13 2b12 n SER 185 Ca -0.03 -1.19 -0.06 0.00 -0.26 0.00 0.00 58.87 57.33 2b12 n SER 185 Cb 0.13 0.11 0.02 0.00 -0.26 0.00 0.00 64.21 64.20 2b12 n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b12 n GLY 186 N 0.43 0.59 3.05 5.00 0.00 -1.17 -5.01 105.19 108.08 2b12 n GLY 186 Ca 0.03 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 2b12 n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b12 s TYR 187 N -3.07 -0.03 0.00 1.61 2.02 -1.25 -4.70 117.35 111.93 2b12 s TYR 187 Ca 0.13 0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.91 2b12 s TYR 187 Cb -0.06 -0.01 -0.01 0.00 -0.40 0.00 0.00 41.96 41.48 2b12 s TYR 187 CO 0.17 -0.17 -0.05 -2.00 -1.57 0.00 0.00 175.55 171.93 2b12 s GLU 188 N -0.68 0.42 0.00 -0.62 2.56 -1.26 -1.02 118.70 118.10 2b12 s GLU 188 Ca -0.08 -0.24 0.00 0.00 0.00 0.00 0.00 54.97 54.66 2b12 s GLU 188 Cb -0.05 -0.38 0.00 0.00 2.00 0.00 0.00 34.13 35.70 2b12 s GLU 188 CO 0.01 0.10 0.00 0.41 -0.56 0.00 0.00 175.26 175.22 2b12 n GLY 189 N 2.81 3.22 3.83 -1.50 0.00 -1.02 -4.93 105.19 107.59 2b12 n GLY 189 Ca -0.14 -1.58 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 2b12 n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b12 s PRO 190 N -4.79 2.80 0.14 1.61 0.04 -1.26 -3.02 135.00 130.51 2b12 s PRO 190 Ca 0.00 0.83 0.16 0.00 0.04 0.00 0.00 61.00 62.02 2b12 s PRO 190 Cb 0.00 -1.98 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 2b12 s PRO 190 CO 0.00 -1.16 1.07 -1.49 0.04 0.00 0.00 177.00 175.45 2b12 h TRP 191 N -0.76 0.00 -1.86 0.56 6.55 -1.71 0.45 115.95 119.18 2b12 h TRP 191 Ca -0.45 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.39 2b12 h TRP 191 Cb 1.22 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.52 2b12 h TRP 191 CO 0.58 0.57 0.00 0.41 -1.05 0.00 0.00 178.44 178.95 2b12 n GLY 192 N 1.33 3.30 0.08 1.49 0.00 -1.26 -4.38 105.19 105.75 2b12 n GLY 192 Ca -0.05 -1.35 -0.05 0.00 0.00 0.00 0.00 46.02 44.58 2b12 n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b12 n ALA 193 N -3.00 1.80 -3.42 4.61 0.00 -1.26 -4.66 120.51 114.58 2b12 n ALA 193 Ca 0.00 -1.07 -0.41 0.00 0.00 0.00 0.00 53.44 51.96 2b12 n ALA 193 Cb 0.00 -0.40 -0.03 0.00 0.00 0.00 0.00 19.45 19.02 2b12 n ALA 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b12 n ALA 194 N -2.61 4.18 0.01 0.00 0.00 -1.26 -4.86 120.51 115.97 2b12 n ALA 194 Ca -0.24 -4.66 -0.05 0.00 0.00 0.00 0.00 53.44 48.49 2b12 n ALA 194 Cb 1.01 -2.11 0.16 0.00 0.00 0.00 0.00 19.45 18.51 2b12 n ALA 194 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2b12 h ASN 195 N 6.17 0.50 -0.54 0.00 2.35 -1.83 -3.24 115.58 118.99 2b12 h ASN 195 Ca 0.18 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 2b12 h ASN 195 Cb 0.81 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.04 2b12 h ASN 195 CO 0.99 0.80 0.00 -0.46 -1.65 0.00 0.00 177.43 177.11 2b12 n ASN 196 N -4.07 2.95 -3.88 5.81 6.94 -1.26 -2.13 115.26 119.62 2b12 n ASN 196 Ca -0.01 -1.99 -0.24 0.00 -0.02 0.00 0.00 54.58 52.32 2b12 n ASN 196 Cb 0.46 -0.36 -0.17 0.00 -2.36 0.00 0.00 39.78 37.35 2b12 n ASN 196 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2b12 s VAL 197 N -1.28 0.73 -0.35 3.53 0.11 -1.22 -4.72 120.40 117.20 2b12 s VAL 197 Ca 0.37 -0.16 -0.29 0.00 -2.93 0.00 0.00 61.98 58.98 2b12 s VAL 197 Cb 0.19 -0.78 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 2b12 s VAL 197 CO 0.25 0.30 1.34 0.12 -3.33 0.00 0.00 175.10 173.79 2b12 s PHE 198 N 1.44 2.57 0.21 1.54 2.19 -0.50 -4.82 117.98 120.61 2b12 s PHE 198 Ca -0.02 0.78 0.05 0.00 0.33 0.00 0.00 56.93 58.07 2b12 s PHE 198 Cb -0.13 -4.08 -0.02 0.00 -1.31 0.00 0.00 43.02 37.48 2b12 s PHE 198 CO -0.04 -1.82 0.18 0.25 1.83 0.00 0.00 175.22 175.63 2b12 n THR 199 N 6.56 0.00 -0.15 0.12 -2.24 -1.26 -4.38 114.28 112.93 2b12 n THR 199 Ca 0.15 -1.50 -0.04 0.00 -2.27 0.00 0.00 64.05 60.39 2b12 n THR 199 Cb 0.47 0.75 0.18 0.00 -2.10 0.00 0.00 70.33 69.63 2b12 n THR 199 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2b12 n ASN 200 N -2.17 3.58 -0.27 3.42 2.04 -1.26 -4.51 115.26 116.08 2b12 n ASN 200 Ca 0.05 -2.69 0.01 0.00 -0.44 0.00 0.00 54.58 51.51 2b12 n ASN 200 Cb 0.37 -0.64 0.14 0.00 -2.53 0.00 0.00 39.78 37.12 2b12 n ASN 200 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 2b12 h GLU 201 N 1.53 0.72 -1.03 -3.83 4.81 -1.95 -2.57 114.58 112.27 2b12 h GLU 201 Ca 0.16 -0.04 0.27 0.00 -0.13 0.00 0.00 59.36 59.61 2b12 h GLU 201 Cb 1.65 -0.16 -0.08 0.00 0.63 0.00 0.00 28.75 30.79 2b12 h GLU 201 CO 0.43 0.48 0.68 0.35 -0.73 0.00 0.00 179.01 180.22 2b12 h PHE 202 N 0.74 0.50 0.19 0.92 3.57 -1.83 -1.01 116.94 120.03 2b12 h PHE 202 Ca 0.36 0.02 -0.33 0.00 3.53 0.00 0.00 57.97 61.56 2b12 h PHE 202 Cb 0.31 -0.15 0.02 0.00 2.79 0.00 0.00 35.95 38.92 2b12 h PHE 202 CO -0.07 0.06 -1.53 1.88 -2.23 0.00 0.00 178.31 176.42 2b12 h TYR 203 N 0.31 0.72 0.00 0.41 0.05 -1.81 -2.80 116.97 113.85 2b12 h TYR 203 Ca 0.56 -0.53 0.00 0.00 0.05 0.00 0.00 58.73 58.82 2b12 h TYR 203 Cb 1.58 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 39.29 2b12 h TYR 203 CO -0.00 1.51 0.00 -0.07 -1.05 0.00 0.00 178.16 178.55 2b12 h LEU 204 N 0.11 0.00 0.06 3.88 3.38 -1.18 -2.70 115.31 118.85 2b12 h LEU 204 Ca -0.26 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.35 2b12 h LEU 204 Cb 2.09 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.80 2b12 h LEU 204 CO 0.21 0.00 -2.13 0.59 0.09 0.00 0.00 178.44 177.20 2b12 n ASN 205 N -2.56 1.71 -0.23 -0.43 5.03 -0.50 -3.32 115.26 114.95 2b12 n ASN 205 Ca 0.02 0.12 0.13 0.00 0.87 0.00 0.00 54.58 55.72 2b12 n ASN 205 Cb 0.29 -0.45 0.42 0.00 -1.02 0.00 0.00 39.78 39.03 2b12 n ASN 205 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2b12 h LEU 206 N 0.03 0.56 0.00 3.41 5.85 -1.20 -3.03 115.31 120.94 2b12 h LEU 206 Ca -0.46 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2b12 h LEU 206 Cb 2.01 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.97 2b12 h LEU 206 CO 0.03 0.28 -0.47 0.00 -0.34 0.00 0.00 178.44 177.95 2b12 n LEU 207 N -4.53 0.07 -0.59 2.25 -0.00 -1.14 -4.71 117.00 108.34 2b12 n LEU 207 Ca 0.16 -0.32 0.12 0.00 -0.00 0.00 0.00 56.01 55.97 2b12 n LEU 207 Cb 0.49 0.00 0.13 0.00 -0.00 0.00 0.00 43.42 44.04 2b12 n LEU 207 CO 0.31 0.02 0.50 0.59 -0.00 0.00 0.00 177.39 178.80 2b12 n ASN 208 N -1.24 2.11 -4.94 1.45 5.03 -1.21 -4.92 115.26 111.54 2b12 n ASN 208 Ca 0.00 -1.56 -0.21 0.00 0.87 0.00 0.00 54.58 53.68 2b12 n ASN 208 Cb 0.05 0.25 -0.02 0.00 -1.02 0.00 0.00 39.78 39.04 2b12 n ASN 208 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2b12 s GLU 209 N -2.31 3.23 -0.32 3.52 0.41 -1.15 -5.04 118.70 117.04 2b12 s GLU 209 Ca 0.24 -0.91 -0.09 0.00 -0.41 0.00 0.00 54.97 53.80 2b12 s GLU 209 Cb 0.19 -2.79 0.01 0.00 -1.78 0.00 0.00 34.13 29.76 2b12 s GLU 209 CO 0.47 0.31 0.15 0.34 -0.49 0.00 0.00 175.26 176.03 2b12 s ASP 210 N -4.01 5.48 -0.06 -0.19 3.68 -1.26 -5.00 116.67 115.31 2b12 s ASP 210 Ca 0.37 -0.72 -0.06 0.00 2.13 0.00 0.00 52.55 54.27 2b12 s ASP 210 Cb -0.09 -1.97 -0.04 0.00 -1.45 0.00 0.00 42.92 39.37 2b12 s ASP 210 CO 0.29 -0.25 0.19 0.26 0.13 0.00 0.00 175.17 175.78 2b12 s TRP 211 N 1.56 3.59 -0.02 -5.34 0.52 -1.26 -4.53 118.94 113.46 2b12 s TRP 211 Ca 0.03 0.51 0.01 0.00 0.02 0.00 0.00 56.10 56.67 2b12 s TRP 211 Cb -0.18 -1.94 0.02 0.00 -1.15 0.00 0.00 33.47 30.22 2b12 s TRP 211 CO 0.05 0.69 -0.01 0.21 0.02 0.00 0.00 176.95 177.91 2b12 s LYS 212 N -1.39 0.26 -0.03 4.98 2.20 -0.84 -5.00 119.74 119.92 2b12 s LYS 212 Ca 0.21 0.01 -0.30 0.00 -0.36 0.00 0.00 55.97 55.52 2b12 s LYS 212 Cb -0.13 -0.37 -0.03 0.00 -1.51 0.00 0.00 37.83 35.79 2b12 s LYS 212 CO 0.10 -0.06 1.14 -1.17 -0.36 0.00 0.00 175.35 175.01 2b12 s LEU 213 N 0.58 4.31 0.19 5.43 0.20 -1.26 -1.86 118.68 126.27 2b12 s LEU 213 Ca -0.06 1.79 0.00 0.00 0.69 0.00 0.00 54.13 56.56 2b12 s LEU 213 Cb -0.09 -3.56 -0.04 0.00 -0.43 0.00 0.00 46.19 42.07 2b12 s LEU 213 CO -0.01 -0.49 0.07 -0.70 -0.29 0.00 0.00 176.35 174.93 2b12 s GLU 214 N 1.75 1.17 -0.12 1.98 2.56 -0.29 -4.98 118.70 120.78 2b12 s GLU 214 Ca 0.55 -1.60 -0.02 0.00 0.00 0.00 0.00 54.97 53.90 2b12 s GLU 214 Cb -0.24 -0.01 -0.03 0.00 2.00 0.00 0.00 34.13 35.85 2b12 s GLU 214 CO 0.24 -0.27 -0.03 0.21 -0.56 0.00 0.00 175.26 174.84 2b12 s LYS 215 N -4.04 3.32 0.32 4.30 2.20 -1.26 -1.00 119.74 123.57 2b12 s LYS 215 Ca 0.32 -0.50 0.01 0.00 -0.36 0.00 0.00 55.97 55.44 2b12 s LYS 215 Cb 0.07 -2.82 0.06 0.00 -1.51 0.00 0.00 37.83 33.63 2b12 s LYS 215 CO 0.08 0.44 0.43 0.27 -0.36 0.00 0.00 175.35 176.21 2b12 n ASN 216 N 2.93 0.73 -0.27 1.43 2.04 -0.21 -4.94 115.26 116.96 2b12 n ASN 216 Ca -0.18 -1.58 0.00 0.00 -0.44 0.00 0.00 54.58 52.38 2b12 n ASN 216 Cb 0.53 -0.27 0.00 0.00 -2.53 0.00 0.00 39.78 37.51 2b12 n ASN 216 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 2b12 n ASP 217 N -2.88 0.47 -0.12 0.53 8.00 -1.26 -1.75 116.55 119.54 2b12 n ASP 217 Ca 0.08 -1.72 0.03 0.00 0.71 0.00 0.00 54.79 53.88 2b12 n ASP 217 Cb 0.27 -0.24 0.04 0.00 -0.02 0.00 0.00 41.12 41.17 2b12 n ASP 217 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b12 n ALA 218 N -0.19 1.82 -3.34 2.24 0.00 -1.26 -5.01 120.51 114.77 2b12 n ALA 218 Ca 0.00 -1.29 -0.24 0.00 0.00 0.00 0.00 53.44 51.91 2b12 n ALA 218 Cb 0.12 -0.20 0.01 0.00 0.00 0.00 0.00 19.45 19.38 2b12 n ALA 218 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2b12 n ASN 219 N -0.51 -4.66 -4.53 0.00 5.15 -0.72 -4.99 115.26 105.00 2b12 n ASN 219 Ca 0.04 -0.41 -0.30 0.00 -0.60 0.00 0.00 54.58 53.31 2b12 n ASN 219 Cb 0.50 -3.79 -0.11 0.00 -0.53 0.00 0.00 39.78 35.85 2b12 n ASN 219 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2b12 s ASN 220 N -2.80 4.15 -0.10 1.20 0.01 -1.26 -4.91 114.94 111.23 2b12 s ASN 220 Ca 0.41 -0.45 -0.11 0.00 -0.71 0.00 0.00 52.86 52.01 2b12 s ASN 220 Cb -0.21 -0.71 -0.05 0.00 0.41 0.00 0.00 41.25 40.69 2b12 s ASN 220 CO 0.51 0.19 0.24 -1.61 -1.51 0.00 0.00 177.10 174.92 2b12 s GLU 221 N -2.07 3.78 0.11 -0.60 2.02 -1.26 -1.05 118.70 119.64 2b12 s GLU 221 Ca 0.19 0.05 -0.12 0.00 0.02 0.00 0.00 54.97 55.11 2b12 s GLU 221 Cb -0.11 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.88 2b12 s GLU 221 CO 0.11 0.62 0.30 1.14 0.02 0.00 0.00 175.26 177.45 2b12 s GLN 222 N -0.65 0.97 -0.40 1.61 -2.07 -0.17 -4.76 119.66 114.19 2b12 s GLN 222 Ca 0.17 -0.84 -0.19 0.00 -1.82 0.00 0.00 55.36 52.68 2b12 s GLN 222 Cb -0.13 0.41 0.01 0.00 -1.09 0.00 0.00 33.01 32.21 2b12 s GLN 222 CO 0.06 -0.35 0.56 -1.58 -1.32 0.00 0.00 175.29 172.66 2b12 s TRP 223 N -3.84 3.13 0.24 9.60 0.52 -0.54 -1.14 118.94 126.91 2b12 s TRP 223 Ca 0.04 0.01 0.08 0.00 0.02 0.00 0.00 56.10 56.25 2b12 s TRP 223 Cb 0.03 -3.10 -0.04 0.00 -1.15 0.00 0.00 33.47 29.21 2b12 s TRP 223 CO -0.11 -0.70 0.05 -0.51 0.02 0.00 0.00 176.95 175.70 2b12 s ASP 224 N 1.87 4.89 0.22 2.95 1.01 -0.78 -0.45 116.67 126.38 2b12 s ASP 224 Ca 0.20 -0.47 0.08 0.00 0.71 0.00 0.00 52.55 53.07 2b12 s ASP 224 Cb -0.15 -1.05 -0.05 0.00 1.01 0.00 0.00 42.92 42.68 2b12 s ASP 224 CO 0.16 0.01 -0.13 -0.94 0.21 0.00 0.00 175.17 174.48 2b12 s SER 225 N -3.53 2.64 0.22 0.27 1.04 -1.02 -1.99 113.70 111.34 2b12 s SER 225 Ca 0.31 -1.04 0.22 0.00 0.48 0.00 0.00 55.95 55.92 2b12 s SER 225 Cb -0.08 -0.15 0.93 0.00 0.10 0.00 0.00 66.02 66.83 2b12 s SER 225 CO 0.21 -0.18 1.68 0.29 0.98 0.00 0.00 173.24 176.21 2b12 n LYS 226 N -0.42 0.17 0.00 4.02 4.76 -1.26 -2.35 118.16 123.08 2b12 n LYS 226 Ca -0.07 0.40 0.12 0.00 -2.87 0.00 0.00 58.31 55.89 2b12 n LYS 226 Cb 0.61 -1.82 0.55 0.00 -1.84 0.00 0.00 35.03 32.53 2b12 n LYS 226 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2b12 n SER 227 N -2.14 0.00 0.00 4.39 7.64 -1.26 -4.86 113.62 117.39 2b12 n SER 227 Ca 0.02 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.21 2b12 n SER 227 Cb 0.22 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 2b12 n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b12 n GLY 228 N 0.94 0.77 3.93 0.23 0.00 -0.99 -5.08 105.19 104.98 2b12 n GLY 228 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2b12 n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b12 s TYR 229 N -2.18 2.79 0.08 1.61 4.12 -1.25 -4.29 117.35 118.22 2b12 s TYR 229 Ca 0.00 0.45 -0.20 0.00 0.02 0.00 0.00 57.07 57.33 2b12 s TYR 229 Cb 0.00 -3.28 0.05 0.00 -1.52 0.00 0.00 41.96 37.20 2b12 s TYR 229 CO 0.00 -1.54 0.48 1.41 0.02 0.00 0.00 175.55 175.92 2b12 s MET 230 N -5.32 1.06 -0.01 -0.62 -2.45 0.16 -2.42 119.30 109.68 2b12 s MET 230 Ca 0.61 -0.41 -0.04 0.00 -1.25 0.00 0.00 55.69 54.60 2b12 s MET 230 Cb -0.10 0.48 0.00 0.00 1.25 0.00 0.00 34.83 36.46 2b12 s MET 230 CO 0.46 -0.40 0.09 -1.64 1.05 0.00 0.00 175.02 174.58 2b12 s MET 231 N -2.97 0.28 0.67 4.11 -1.94 0.41 -4.08 119.30 115.78 2b12 s MET 231 Ca -0.02 -0.19 -0.10 0.00 -1.71 0.00 0.00 55.69 53.67 2b12 s MET 231 Cb -0.00 0.12 0.01 0.00 2.01 0.00 0.00 34.83 36.97 2b12 s MET 231 CO -0.06 -0.06 1.04 -0.51 -0.01 0.00 0.00 175.02 175.43 2b12 s LEU 232 N -0.73 2.99 0.55 -0.03 1.02 -1.26 -1.47 118.68 119.75 2b12 s LEU 232 Ca -0.08 1.00 0.34 0.00 0.02 0.00 0.00 54.13 55.40 2b12 s LEU 232 Cb -0.05 -3.79 1.52 0.00 0.02 0.00 0.00 46.19 43.89 2b12 s LEU 232 CO 0.00 -1.27 2.05 -0.65 0.02 0.00 0.00 176.35 176.50 2b12 h PRO 233 N -0.52 0.00 0.00 1.29 0.11 -1.84 0.49 132.00 131.53 2b12 h PRO 233 Ca -0.45 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.50 2b12 h PRO 233 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2b12 h PRO 233 CO 0.63 0.05 -0.93 1.79 -0.21 0.00 0.00 178.00 179.33 2b12 h THR 234 N 0.00 1.01 0.07 -1.15 1.35 -1.66 -2.26 112.91 110.26 2b12 h THR 234 Ca -0.00 -2.53 -0.25 0.00 -0.55 0.00 0.00 66.41 63.08 2b12 h THR 234 Cb 0.42 2.45 -0.01 0.00 -1.73 0.00 0.00 68.15 69.28 2b12 h THR 234 CO 0.01 0.57 -1.19 0.44 -0.25 0.00 0.00 175.52 175.10 2b12 h ASP 235 N 0.00 0.22 1.10 5.36 3.45 -1.73 -3.05 116.42 121.77 2b12 h ASP 235 Ca -0.06 -0.25 0.00 0.00 0.43 0.00 0.00 57.03 57.15 2b12 h ASP 235 Cb 1.58 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 40.28 2b12 h ASP 235 CO 0.08 1.19 -0.22 0.00 -1.57 0.00 0.00 179.24 178.72 2b12 n TYR 236 N -3.42 0.53 0.21 4.55 9.36 0.10 -3.27 117.16 125.22 2b12 n TYR 236 Ca -0.06 0.15 0.09 0.00 3.32 0.00 0.00 57.90 61.40 2b12 n TYR 236 Cb 0.99 -0.69 0.40 0.00 -0.63 0.00 0.00 39.34 39.41 2b12 n TYR 236 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2b12 h SER 237 N 0.00 0.00 0.02 2.98 4.64 -1.28 -2.91 113.55 117.00 2b12 h SER 237 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b12 h SER 237 Cb 0.66 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2b12 h SER 237 CO 0.00 0.25 -0.00 -0.07 -0.87 0.00 0.00 176.83 176.14 2b12 h LEU 238 N 0.00 0.00 0.00 5.97 3.38 -1.63 -2.31 115.31 120.72 2b12 h LEU 238 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2b12 h LEU 238 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 2b12 h LEU 238 CO 0.03 0.00 -0.85 2.30 0.09 0.00 0.00 178.44 180.01 2b12 n ILE 239 N -3.26 0.00 -0.03 1.22 -0.00 -1.11 -1.95 119.36 114.23 2b12 n ILE 239 Ca -0.03 -0.26 -0.14 0.00 -0.00 0.00 0.00 62.75 62.33 2b12 n ILE 239 Cb 0.08 0.69 -0.09 0.00 -0.00 0.00 0.00 39.64 40.31 2b12 n ILE 239 CO 0.00 0.00 0.00 1.56 -0.00 0.00 0.00 176.55 178.11 2b12 h GLN 240 N 0.00 0.20 -6.36 6.28 4.20 -1.38 -3.43 115.11 114.62 2b12 h GLN 240 Ca 0.00 -0.14 -0.54 0.00 0.06 0.00 0.00 58.65 58.02 2b12 h GLN 240 Cb 0.30 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 2b12 h GLN 240 CO 0.00 0.76 0.85 0.34 -0.67 0.00 0.00 178.83 180.11 2b12 s ASP 241 N -6.10 6.84 0.38 1.46 -1.08 -0.91 -4.95 116.67 112.31 2b12 s ASP 241 Ca -0.15 2.11 0.09 0.00 -0.52 0.00 0.00 52.55 54.07 2b12 s ASP 241 Cb 0.03 -2.56 0.84 0.00 -1.46 0.00 0.00 42.92 39.77 2b12 s ASP 241 CO 0.73 -0.73 1.96 1.55 0.52 0.00 0.00 175.17 179.20 2b12 h PRO 242 N 7.94 0.62 0.11 4.34 0.13 -1.92 -2.08 132.00 141.14 2b12 h PRO 242 Ca -0.37 -0.04 -0.28 0.00 -0.87 0.00 0.00 66.00 64.44 2b12 h PRO 242 Cb 1.18 -0.14 0.02 0.00 0.13 0.00 0.00 31.00 32.18 2b12 h PRO 242 CO 0.91 0.41 -1.21 0.87 -0.23 0.00 0.00 178.00 178.75 2b12 h LYS 243 N 0.64 0.45 -0.42 0.86 1.79 -1.94 -3.24 116.57 114.71 2b12 h LYS 243 Ca 0.31 -0.63 -0.13 0.00 -2.18 0.00 0.00 60.65 58.01 2b12 h LYS 243 Cb 0.37 0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 31.22 2b12 h LYS 243 CO -0.10 1.27 -0.25 1.88 -1.08 0.00 0.00 179.45 181.17 2b12 h TYR 244 N 0.18 1.05 -0.21 -1.35 0.05 -1.77 -3.27 116.97 111.65 2b12 h TYR 244 Ca -0.15 -0.27 -0.00 0.00 0.05 0.00 0.00 58.73 58.35 2b12 h TYR 244 Cb 1.89 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 39.38 2b12 h TYR 244 CO 0.09 1.07 0.12 1.25 -1.05 0.00 0.00 178.16 179.64 2b12 h LEU 245 N 0.72 0.25 -1.09 3.88 7.12 -0.70 -2.20 115.31 123.28 2b12 h LEU 245 Ca 0.09 -0.01 -0.09 0.00 0.13 0.00 0.00 57.88 58.00 2b12 h LEU 245 Cb 0.82 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.88 2b12 h LEU 245 CO 0.07 0.19 -0.34 0.77 -0.13 0.00 0.00 178.44 179.00 2b12 h SER 246 N 0.29 0.20 0.97 1.25 4.64 -1.60 -1.12 113.55 118.18 2b12 h SER 246 Ca 0.08 -0.07 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 2b12 h SER 246 Cb -0.01 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 2b12 h SER 246 CO -0.01 0.54 -1.02 0.40 -0.87 0.00 0.00 176.83 175.86 2b12 h ILE 247 N 0.17 1.70 -0.16 0.95 2.04 -1.55 -2.29 117.51 118.37 2b12 h ILE 247 Ca 0.02 -3.39 -0.17 0.00 1.00 0.00 0.00 64.86 62.32 2b12 h ILE 247 Cb 0.69 2.86 -0.00 0.00 -0.74 0.00 0.00 36.82 39.62 2b12 h ILE 247 CO 0.05 0.97 -0.60 0.58 0.00 0.00 0.00 178.15 179.15 2b12 h VAL 248 N 0.01 1.33 -0.20 1.67 2.07 -1.18 -2.17 116.25 117.77 2b12 h VAL 248 Ca -0.02 -1.88 -0.11 0.00 0.82 0.00 0.00 66.70 65.51 2b12 h VAL 248 Cb 1.78 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 33.39 2b12 h VAL 248 CO 0.14 0.58 -0.35 0.11 0.02 0.00 0.00 177.57 178.06 2b12 h LYS 249 N 0.41 0.43 0.02 1.57 1.57 -1.20 -2.47 116.57 116.89 2b12 h LYS 249 Ca -0.00 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2b12 h LYS 249 Cb 1.16 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2b12 h LYS 249 CO 0.11 0.72 -0.01 1.49 -0.57 0.00 0.00 179.45 181.20 2b12 h GLU 250 N 0.36 -0.02 0.00 3.15 4.81 -1.23 -3.11 114.58 118.54 2b12 h GLU 250 Ca 0.04 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2b12 h GLU 250 Cb 0.79 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.17 2b12 h GLU 250 CO 0.06 0.59 -0.10 1.88 -0.73 0.00 0.00 179.01 180.71 2b12 h TYR 251 N -0.65 0.00 -0.04 0.92 0.05 -1.43 -0.11 116.97 115.71 2b12 h TYR 251 Ca -0.00 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.56 2b12 h TYR 251 Cb 0.62 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.36 2b12 h TYR 251 CO 0.14 0.10 -0.86 0.00 -1.05 0.00 0.00 178.16 176.49 2b12 h ALA 252 N 1.90 0.43 0.00 3.88 0.00 -1.52 -3.31 119.26 120.64 2b12 h ALA 252 Ca -0.00 -0.67 -0.08 0.00 0.00 0.00 0.00 54.91 54.16 2b12 h ALA 252 Cb 0.44 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2b12 h ALA 252 CO 0.01 0.79 -0.84 -0.91 0.00 0.00 0.00 179.25 178.30 2b12 h ASN 253 N 0.27 0.00 -3.06 0.00 4.21 -1.29 -3.43 115.58 112.28 2b12 h ASN 253 Ca -0.06 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.90 2b12 h ASN 253 Cb 1.48 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 38.28 2b12 h ASN 253 CO 0.15 0.33 -0.77 -0.62 -1.29 0.00 0.00 177.43 175.23 2b12 s ASP 254 N -5.94 3.53 0.22 5.81 2.15 -0.12 -5.00 116.67 117.32 2b12 s ASP 254 Ca 0.01 -1.29 0.10 0.00 0.43 0.00 0.00 52.55 51.80 2b12 s ASP 254 Cb 0.08 -0.60 0.16 0.00 -0.30 0.00 0.00 42.92 42.26 2b12 s ASP 254 CO 0.77 -0.40 1.49 -0.61 -0.17 0.00 0.00 175.17 176.25 2b12 h GLN 255 N 8.25 0.00 0.00 4.34 4.15 -1.84 -3.23 115.11 126.77 2b12 h GLN 255 Ca -0.16 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.20 2b12 h GLN 255 Cb 1.04 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 2b12 h GLN 255 CO 0.42 0.74 -0.25 -0.44 -1.93 0.00 0.00 178.83 177.37 2b12 h ASP 256 N 0.00 0.00 0.21 -0.69 3.45 -1.94 -2.00 116.42 115.45 2b12 h ASP 256 Ca -0.01 0.00 -0.24 0.00 0.43 0.00 0.00 57.03 57.22 2b12 h ASP 256 Cb 1.34 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 40.11 2b12 h ASP 256 CO 0.10 0.25 -0.95 0.50 -1.57 0.00 0.00 179.24 177.56 2b12 h LYS 257 N 0.00 0.51 -0.37 3.56 1.63 -1.94 -2.64 116.57 117.32 2b12 h LYS 257 Ca -0.00 -0.54 -0.05 0.00 -0.85 0.00 0.00 60.65 59.21 2b12 h LYS 257 Cb 0.72 0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.48 2b12 h LYS 257 CO 0.03 1.17 0.04 0.35 -3.45 0.00 0.00 179.45 177.59 2b12 h PHE 258 N 0.30 0.68 -0.14 1.91 3.57 -1.51 -1.33 116.94 120.41 2b12 h PHE 258 Ca -0.09 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.31 2b12 h PHE 258 Cb 1.59 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 40.14 2b12 h PHE 258 CO 0.07 0.69 0.07 0.74 -2.23 0.00 0.00 178.31 177.66 2b12 h PHE 259 N 0.46 0.14 -0.70 0.41 -1.00 -1.40 0.45 116.94 115.31 2b12 h PHE 259 Ca 0.11 0.01 -0.06 0.00 2.81 0.00 0.00 57.97 60.84 2b12 h PHE 259 Cb 0.40 -0.04 -0.03 0.00 3.61 0.00 0.00 35.95 39.88 2b12 h PHE 259 CO 0.03 0.08 0.20 -0.22 -1.61 0.00 0.00 178.31 176.79 2b12 h LYS 260 N 0.16 1.09 -0.05 1.51 1.63 -1.40 -1.61 116.57 117.90 2b12 h LYS 260 Ca 0.06 -0.24 -0.17 0.00 -0.85 0.00 0.00 60.65 59.45 2b12 h LYS 260 Cb 0.00 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.47 2b12 h LYS 260 CO -0.03 0.94 -0.70 -0.44 -3.45 0.00 0.00 179.45 175.77 2b12 h ASP 261 N 1.04 0.30 -0.24 4.20 3.32 -0.92 -2.82 116.42 121.30 2b12 h ASP 261 Ca 0.22 -0.19 -0.16 0.00 0.02 0.00 0.00 57.03 56.92 2b12 h ASP 261 Cb 0.32 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2b12 h ASP 261 CO -0.00 0.90 -0.49 0.15 -1.72 0.00 0.00 179.24 178.08 2b12 h PHE 262 N 0.17 0.94 0.06 4.55 3.04 0.13 -2.44 116.94 123.39 2b12 h PHE 262 Ca -0.02 -0.35 -0.00 0.00 3.98 0.00 0.00 57.97 61.58 2b12 h PHE 262 Cb 1.25 -0.17 0.00 0.00 2.56 0.00 0.00 35.95 39.59 2b12 h PHE 262 CO 0.03 1.14 -0.03 1.03 -2.02 0.00 0.00 178.31 178.46 2b12 h SER 263 N 0.48 -0.07 -0.82 0.41 0.87 -1.26 0.28 113.55 113.45 2b12 h SER 263 Ca 0.01 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2b12 h SER 263 Cb 1.09 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 63.03 2b12 h SER 263 CO 0.11 -0.04 0.51 0.11 -0.53 0.00 0.00 176.83 176.99 2b12 h LYS 264 N -0.09 1.10 0.09 2.24 1.57 -1.58 -1.74 116.57 118.16 2b12 h LYS 264 Ca -0.01 -0.08 -0.14 0.00 -1.87 0.00 0.00 60.65 58.54 2b12 h LYS 264 Cb 0.07 -0.24 0.02 0.00 0.08 0.00 0.00 32.23 32.16 2b12 h LYS 264 CO 0.01 0.75 -0.62 0.00 -0.57 0.00 0.00 179.45 179.02 2b12 h ALA 265 N 1.44 -0.05 -0.45 3.86 0.00 -1.30 -3.03 119.26 119.74 2b12 h ALA 265 Ca 0.30 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2b12 h ALA 265 Cb -0.08 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2b12 h ALA 265 CO -0.06 0.29 -0.10 0.35 0.00 0.00 0.00 179.25 179.74 2b12 h PHE 266 N -0.45 0.87 -0.37 0.00 3.04 -0.34 0.34 116.94 120.04 2b12 h PHE 266 Ca -0.10 -0.16 -0.12 0.00 3.98 0.00 0.00 57.97 61.57 2b12 h PHE 266 Cb 1.46 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 39.73 2b12 h PHE 266 CO 0.20 0.85 -0.27 1.49 -2.02 0.00 0.00 178.31 178.57 2b12 h GLU 267 N 0.72 0.77 -0.12 1.11 4.81 -1.46 -1.77 114.58 118.64 2b12 h GLU 267 Ca 0.12 -0.33 -0.18 0.00 -0.13 0.00 0.00 59.36 58.85 2b12 h GLU 267 Cb 0.58 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 2b12 h GLU 267 CO 0.04 0.95 -0.66 -0.22 -0.73 0.00 0.00 179.01 178.39 2b12 h LYS 268 N 0.66 0.49 -0.44 1.92 3.64 -1.35 -0.70 116.57 120.79 2b12 h LYS 268 Ca 0.08 -0.36 -0.05 0.00 -1.27 0.00 0.00 60.65 59.05 2b12 h LYS 268 Cb 0.79 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 2b12 h LYS 268 CO 0.07 0.98 0.06 1.25 -2.27 0.00 0.00 179.45 179.53 2b12 h LEU 269 N 0.35 0.64 -0.37 5.20 7.12 -0.73 -2.21 115.31 125.31 2b12 h LEU 269 Ca -0.02 -0.12 -0.11 0.00 0.13 0.00 0.00 57.88 57.76 2b12 h LEU 269 Cb 1.22 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 41.17 2b12 h LEU 269 CO 0.12 0.67 -0.54 -0.07 -0.13 0.00 0.00 178.44 178.49 2b12 h LEU 270 N 0.66 0.00 -1.21 2.25 3.38 -1.00 -3.27 115.31 116.11 2b12 h LEU 270 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2b12 h LEU 270 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2b12 h LEU 270 CO 0.01 0.54 -0.12 -0.62 0.09 0.00 0.00 178.44 178.34 2b12 n GLU 271 N -3.38 1.68 -1.60 1.13 1.02 -0.30 -4.60 120.64 114.58 2b12 n GLU 271 Ca 0.01 -1.21 -0.48 0.00 -0.02 0.00 0.00 57.16 55.45 2b12 n GLU 271 Cb 0.68 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 30.58 2b12 n GLU 271 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2b12 n ASN 272 N 0.40 3.03 0.00 1.62 3.02 -0.86 -2.25 115.26 120.22 2b12 n ASN 272 Ca 0.15 0.68 0.00 0.00 -0.03 0.00 0.00 54.58 55.38 2b12 n ASN 272 Cb 0.45 -1.37 0.00 0.00 -0.61 0.00 0.00 39.78 38.26 2b12 n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b12 n GLY 273 N 5.23 3.31 3.69 7.41 0.00 -1.26 -4.43 105.19 119.13 2b12 n GLY 273 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 2b12 n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b12 s ILE 274 N -2.96 4.90 -0.34 -0.61 1.09 -0.95 -4.28 121.20 118.05 2b12 s ILE 274 Ca 0.00 1.71 -0.13 0.00 -1.10 0.00 0.00 60.65 61.13 2b12 s ILE 274 Cb 0.00 -4.17 -0.02 0.00 -1.06 0.00 0.00 42.46 37.22 2b12 s ILE 274 CO 0.00 0.09 0.25 -0.89 -0.10 0.00 0.00 174.94 174.29 2b12 s THR 275 N 1.66 5.28 0.12 2.92 2.01 -0.42 -5.03 115.64 122.18 2b12 s THR 275 Ca 0.41 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.96 2b12 s THR 275 Cb -0.18 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 68.55 2b12 s THR 275 CO 0.17 -0.01 0.79 -0.36 -0.69 0.00 0.00 174.62 174.51 2b12 s PHE 276 N 1.74 3.84 0.94 4.92 2.99 -1.26 -2.68 117.98 128.46 2b12 s PHE 276 Ca 0.06 1.59 -0.11 0.00 0.00 0.00 0.00 56.93 58.47 2b12 s PHE 276 Cb -0.17 -2.81 0.16 0.00 0.00 0.00 0.00 43.02 40.20 2b12 s PHE 276 CO 0.11 0.40 1.11 -2.14 -0.00 0.00 0.00 175.22 174.70 2b12 s PRO 277 N -0.64 0.83 -0.05 0.24 0.02 -1.26 -4.91 135.00 129.23 2b12 s PRO 277 Ca 0.38 1.32 0.19 0.00 0.02 0.00 0.00 61.00 62.90 2b12 s PRO 277 Cb -0.22 -1.72 0.60 0.00 0.02 0.00 0.00 34.50 33.18 2b12 s PRO 277 CO 0.25 -2.68 1.51 0.36 -0.33 0.00 0.00 177.00 176.11 2b12 n LYS 278 N -4.25 3.13 0.00 5.54 0.00 -1.26 -3.15 118.16 118.17 2b12 n LYS 278 Ca 0.09 -2.64 0.00 0.00 -0.00 0.00 0.00 58.31 55.76 2b12 n LYS 278 Cb 0.53 -1.64 0.00 0.00 -0.00 0.00 0.00 35.03 33.92 2b12 n LYS 278 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2b12 n ASP 279 N 1.14 0.00 -4.81 -5.58 5.75 -1.26 -5.11 116.55 106.68 2b12 n ASP 279 Ca 0.22 -1.00 -0.31 0.00 -0.01 0.00 0.00 54.79 53.70 2b12 n ASP 279 Cb 0.70 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.85 2b12 n ASP 279 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b12 s ALA 280 N 0.00 2.48 0.52 2.12 0.00 -1.19 -5.04 121.76 120.66 2b12 s ALA 280 Ca 0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 51.96 51.74 2b12 s ALA 280 Cb 0.00 -3.15 -0.07 0.00 0.00 0.00 0.00 23.12 19.90 2b12 s ALA 280 CO 0.00 -1.46 1.08 -1.25 0.00 0.00 0.00 175.76 174.14 2b12 s PRO 281 N -5.08 3.54 0.44 0.00 0.04 -1.26 -4.98 135.00 127.69 2b12 s PRO 281 Ca 0.59 1.47 -0.24 0.00 0.04 0.00 0.00 61.00 62.87 2b12 s PRO 281 Cb -0.14 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.27 2b12 s PRO 281 CO 0.55 -0.67 1.19 -1.54 0.04 0.00 0.00 177.00 176.57 2b12 s SER 282 N -1.93 6.25 0.38 6.66 1.04 -1.26 -4.93 113.70 119.90 2b12 s SER 282 Ca 0.70 2.38 -0.26 0.00 0.48 0.00 0.00 55.95 59.24 2b12 s SER 282 Cb -0.20 -2.61 -0.11 0.00 0.10 0.00 0.00 66.02 63.20 2b12 s SER 282 CO 0.25 -0.87 1.21 -0.81 0.98 0.00 0.00 173.24 173.99 2b12 n PRO 283 N -0.27 1.84 -3.25 4.02 -0.04 -1.26 -4.99 135.00 131.05 2b12 n PRO 283 Ca 0.06 0.65 -0.39 0.00 -0.04 0.00 0.00 63.50 63.79 2b12 n PRO 283 Cb 0.47 -2.25 -0.06 0.00 -0.04 0.00 0.00 33.50 31.62 2b12 n PRO 283 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2b12 s PHE 284 N -1.16 3.64 -0.50 0.54 0.08 0.35 -4.81 117.98 116.12 2b12 s PHE 284 Ca 0.59 1.11 0.02 0.00 0.12 0.00 0.00 56.93 58.76 2b12 s PHE 284 Cb -0.56 -2.57 0.13 0.00 -0.57 0.00 0.00 43.02 39.45 2b12 s PHE 284 CO 0.60 0.33 0.26 0.42 -0.10 0.00 0.00 175.22 176.72 2b12 s ILE 285 N -0.04 2.87 0.55 0.64 1.01 -1.26 -0.67 121.20 124.30 2b12 s ILE 285 Ca 0.29 -2.93 -0.20 0.00 0.00 0.00 0.00 60.65 57.81 2b12 s ILE 285 Cb -0.17 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 2b12 s ILE 285 CO 0.15 -0.77 1.21 -0.36 0.00 0.00 0.00 174.94 175.17 2b12 s PHE 286 N 0.12 2.51 0.16 3.97 2.99 -1.26 -5.04 117.98 121.43 2b12 s PHE 286 Ca 0.15 1.50 -0.14 0.00 0.00 0.00 0.00 56.93 58.45 2b12 s PHE 286 Cb -0.23 -3.48 -0.07 0.00 0.00 0.00 0.00 43.02 39.24 2b12 s PHE 286 CO -0.03 -2.08 0.56 0.15 -0.00 0.00 0.00 175.22 173.81 2b12 s LYS 287 N -3.14 3.96 0.70 0.44 1.02 -1.26 -5.01 119.74 116.45 2b12 s LYS 287 Ca 0.73 0.47 -0.09 0.00 0.02 0.00 0.00 55.97 57.11 2b12 s LYS 287 Cb -0.30 -2.88 0.05 0.00 -0.52 0.00 0.00 37.83 34.17 2b12 s LYS 287 CO 0.34 0.45 1.04 -0.08 -0.92 0.00 0.00 175.35 176.18 2b12 s THR 288 N -1.53 2.71 0.26 2.17 -1.32 -1.26 -4.92 115.64 111.75 2b12 s THR 288 Ca 0.40 -0.02 -0.04 0.00 -1.21 0.00 0.00 61.69 60.81 2b12 s THR 288 Cb -0.14 -3.18 0.26 0.00 -1.51 0.00 0.00 72.50 67.92 2b12 s THR 288 CO 0.19 -0.21 1.90 -0.07 -2.21 0.00 0.00 174.62 174.22 2b12 h LEU 289 N -0.63 1.05 -1.03 9.08 4.07 -1.96 -1.69 115.31 124.21 2b12 h LEU 289 Ca -0.45 -0.00 0.06 0.00 0.08 0.00 0.00 57.88 57.56 2b12 h LEU 289 Cb 1.30 -0.23 -0.06 0.00 1.08 0.00 0.00 40.66 42.74 2b12 h LEU 289 CO 0.62 0.71 0.64 -0.08 -1.08 0.00 0.00 178.44 179.26 2b12 h GLU 290 N 1.22 1.15 0.04 1.13 4.57 -1.95 -1.93 114.58 118.80 2b12 h GLU 290 Ca 0.40 -0.07 -0.22 0.00 -1.18 0.00 0.00 59.36 58.29 2b12 h GLU 290 Cb 0.04 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 2b12 h GLU 290 CO -0.14 0.76 -1.03 0.93 -1.18 0.00 0.00 179.01 178.35 2b12 h GLU 291 N 1.18 0.14 -0.49 1.92 5.08 -1.81 -3.35 114.58 117.25 2b12 h GLU 291 Ca 0.42 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2b12 h GLU 291 Cb 0.13 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2b12 h GLU 291 CO -0.16 1.04 0.00 1.04 -1.00 0.00 0.00 179.01 179.94 2b12 n GLN 292 N -3.51 1.76 -0.67 2.33 6.02 -0.67 -4.92 117.38 117.72 2b12 n GLN 292 Ca -0.04 -0.82 0.00 0.00 -0.01 0.00 0.00 57.00 56.13 2b12 n GLN 292 Cb 0.92 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 30.78 2b12 n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2b12 n GLY 293 N 0.56 0.82 0.53 1.08 0.00 -1.17 -5.05 105.19 101.97 2b12 n GLY 293 Ca 0.07 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.23 2b12 n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36