#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a0r n GLU 14 N 0.00 -4.08 0.00 -1.08 2.13 -1.26 -4.92 120.64 111.43 1a0r n GLU 14 Ca 0.00 3.01 0.00 0.00 0.66 0.00 0.00 57.16 60.83 1a0r n GLU 14 Cb 0.00 -3.98 0.00 0.00 0.27 0.00 0.00 31.44 27.73 1a0r n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1a0r n GLY 15 N 1.90 0.28 3.81 8.31 0.00 -1.26 -5.05 105.19 113.18 1a0r n GLY 15 Ca -0.12 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.40 1a0r n GLY 15 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1a0r s GLN 16 N 0.00 4.27 0.25 1.61 0.74 -1.26 -5.01 119.66 120.26 1a0r s GLN 16 Ca 0.00 0.83 -0.31 0.00 0.05 0.00 0.00 55.36 55.93 1a0r s GLN 16 Cb 0.00 -3.18 -0.12 0.00 1.10 0.00 0.00 33.01 30.81 1a0r s GLN 16 CO 0.00 0.59 1.63 0.00 -0.55 0.00 0.00 175.29 176.95 1a0r n ALA 17 N 1.51 2.44 -1.89 1.58 0.00 -1.26 -4.83 120.51 118.06 1a0r n ALA 17 Ca -0.08 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1a0r n ALA 17 Cb 0.50 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.49 1a0r n ALA 17 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1a0r n SER 18 N 2.95 0.00 0.00 0.00 3.41 -1.26 -4.68 113.62 114.04 1a0r n SER 18 Ca 0.12 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.62 1a0r n SER 18 Cb 0.35 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 1a0r n SER 18 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1a0r n HIS 19 N 0.00 0.00 -4.27 7.33 8.25 -1.26 -4.39 115.22 120.87 1a0r n HIS 19 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1a0r n HIS 19 Cb 0.52 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.53 1a0r n HIS 19 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1a0r s THR 20 N -1.43 1.30 0.00 1.59 -4.23 -1.26 -4.64 115.64 106.97 1a0r s THR 20 Ca 0.00 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 1a0r s THR 20 Cb 0.00 -1.90 0.00 0.00 1.34 0.00 0.00 72.50 71.94 1a0r s THR 20 CO 0.00 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 173.98 1a0r n GLY 21 N -0.24 0.90 0.24 3.99 0.00 -1.26 -1.31 105.19 107.50 1a0r n GLY 21 Ca -0.10 -0.78 -0.06 0.00 0.00 0.00 0.00 46.02 45.09 1a0r n GLY 21 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a0r h PRO 22 N 0.00 -0.13 -0.37 1.61 0.11 -1.99 -0.72 132.00 130.50 1a0r h PRO 22 Ca 0.00 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1a0r h PRO 22 Cb 0.00 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.12 1a0r h PRO 22 CO 0.00 -0.09 0.18 0.87 -0.21 0.00 0.00 178.00 178.76 1a0r h LYS 23 N -0.13 0.51 -0.57 1.05 1.57 -1.87 -0.64 116.57 116.49 1a0r h LYS 23 Ca 0.18 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1a0r h LYS 23 Cb 0.41 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1a0r h LYS 23 CO -0.44 0.40 0.24 0.78 -0.57 0.00 0.00 179.45 179.86 1a0r h GLY 24 N 0.62 0.90 0.96 3.86 0.00 0.17 -1.09 103.07 108.49 1a0r h GLY 24 Ca 0.13 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1a0r h GLY 24 CO -0.02 0.45 0.19 -2.08 0.00 0.00 0.00 176.54 175.08 1a0r h VAL 25 N 0.77 1.15 0.09 4.60 2.07 -0.36 -0.34 116.25 124.24 1a0r h VAL 25 Ca 0.19 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.31 1a0r h VAL 25 Cb 0.17 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1a0r h VAL 25 CO -0.02 0.16 -0.22 0.40 0.02 0.00 0.00 177.57 177.92 1a0r h ILE 26 N 0.46 0.51 -0.68 4.57 2.04 -0.81 -0.53 117.51 123.08 1a0r h ILE 26 Ca 0.13 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.93 1a0r h ILE 26 Cb 0.08 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1a0r h ILE 26 CO -0.02 0.00 0.19 -1.13 0.00 0.00 0.00 178.15 177.19 1a0r h ASN 27 N -0.39 0.99 -0.59 1.72 -1.24 -1.07 -1.79 115.58 113.21 1a0r h ASN 27 Ca 0.03 -0.19 -0.01 0.00 0.71 0.00 0.00 56.30 56.85 1a0r h ASN 27 Cb 0.42 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 39.19 1a0r h ASN 27 CO -0.13 0.93 0.33 0.44 -1.29 0.00 0.00 177.43 177.71 1a0r h ASP 28 N 1.01 0.72 -0.61 1.15 3.32 -0.75 -0.47 116.42 120.79 1a0r h ASP 28 Ca 0.22 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.19 1a0r h ASP 28 Cb 0.32 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1a0r h ASP 28 CO -0.00 0.59 0.40 -0.25 -1.72 0.00 0.00 179.24 178.26 1a0r h TRP 29 N 0.79 0.77 0.05 4.55 7.01 -0.76 -0.67 115.95 127.69 1a0r h TRP 29 Ca 0.21 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.22 1a0r h TRP 29 Cb 0.02 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 26.82 1a0r h TRP 29 CO -0.02 0.49 -0.03 0.00 -2.79 0.00 0.00 178.44 176.09 1a0r h ARG 30 N 0.83 -0.08 -0.41 2.65 3.08 -0.78 -1.72 114.38 117.96 1a0r h ARG 30 Ca 0.22 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.30 1a0r h ARG 30 Cb -0.09 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1a0r h ARG 30 CO -0.05 -0.05 0.27 0.87 -1.07 0.00 0.00 179.97 179.94 1a0r h LYS 31 N -0.08 0.46 0.49 0.04 1.57 -0.83 -1.79 116.57 116.42 1a0r h LYS 31 Ca -0.00 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1a0r h LYS 31 Cb 0.07 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1a0r h LYS 31 CO -0.00 0.30 -0.23 0.35 -0.57 0.00 0.00 179.45 179.30 1a0r h PHE 32 N 0.47 -0.61 0.00 -1.35 3.57 -0.56 0.06 116.94 118.52 1a0r h PHE 32 Ca 0.16 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1a0r h PHE 32 Cb 0.06 0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1a0r h PHE 32 CO -0.00 -0.32 0.00 1.63 -2.23 0.00 0.00 178.31 177.39 1a0r n LYS 33 N -5.32 0.77 0.00 1.11 5.02 -0.70 -2.22 118.16 116.82 1a0r n LYS 33 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 1a0r n LYS 33 Cb 0.30 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 1a0r n LYS 33 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1a0r n LEU 34 N -0.14 0.00 -0.06 -0.35 4.77 -0.73 -4.37 117.00 116.11 1a0r n LEU 34 Ca 0.00 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.80 1a0r n LEU 34 Cb 0.11 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.07 1a0r n LEU 34 CO 0.00 0.00 -1.05 -0.62 -1.33 0.00 0.00 177.39 174.39 1a0r n GLU 35 N -1.19 0.70 -0.09 3.23 1.02 -0.03 -4.66 120.64 119.62 1a0r n GLU 35 Ca 0.00 0.19 -0.19 0.00 -0.02 0.00 0.00 57.16 57.14 1a0r n GLU 35 Cb 0.02 -1.62 -0.13 0.00 -0.02 0.00 0.00 31.44 29.69 1a0r n GLU 35 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1a0r n SER 36 N -3.29 1.98 0.00 1.62 3.41 -0.94 -5.11 113.62 111.29 1a0r n SER 36 Ca -0.37 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.22 1a0r n SER 36 Cb 1.03 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1a0r n SER 36 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1a0r n GLU 37 N -3.32 0.00 0.00 4.33 1.02 -1.26 -5.10 120.64 116.32 1a0r n GLU 37 Ca -0.41 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.73 1a0r n GLU 37 Cb 1.01 -0.04 0.00 0.00 -0.02 0.00 0.00 31.44 32.39 1a0r n GLU 37 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1a0r n PHE 68 N -1.46 0.00 -0.03 -0.32 3.01 -1.26 -4.88 117.46 112.52 1a0r n PHE 68 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.32 1a0r n PHE 68 Cb 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.33 1a0r n PHE 68 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1a0r n SER 69 N 0.00 1.33 -4.79 4.37 7.64 -1.26 -4.86 113.62 116.06 1a0r n SER 69 Ca 0.00 0.23 -0.33 0.00 1.01 0.00 0.00 58.87 59.78 1a0r n SER 69 Cb 0.00 -0.26 -0.07 0.00 -1.01 0.00 0.00 64.21 62.87 1a0r n SER 69 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1a0r s ARG 70 N -2.56 3.11 -0.19 1.43 1.81 -1.26 -5.03 118.95 116.25 1a0r s ARG 70 Ca -0.15 -0.44 0.13 0.00 -1.72 0.00 0.00 55.73 53.55 1a0r s ARG 70 Cb 0.07 -2.89 -0.20 0.00 -0.45 0.00 0.00 34.95 31.48 1a0r s ARG 70 CO 0.78 0.67 -0.00 1.63 -0.68 0.00 0.00 175.30 177.70 1a0r n LYS 71 N 1.33 0.96 -4.39 3.54 4.76 -1.26 -4.99 118.16 118.11 1a0r n LYS 71 Ca -0.14 0.02 -0.32 0.00 -2.87 0.00 0.00 58.31 55.01 1a0r n LYS 71 Cb 0.53 -1.46 -0.10 0.00 -1.84 0.00 0.00 35.03 32.16 1a0r n LYS 71 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1a0r s MET 72 N -2.44 2.56 0.44 1.97 -1.94 -1.26 -4.97 119.30 113.67 1a0r s MET 72 Ca -0.14 -0.73 -0.10 0.00 -1.71 0.00 0.00 55.69 53.00 1a0r s MET 72 Cb 0.06 -2.52 -0.06 0.00 2.01 0.00 0.00 34.83 34.32 1a0r s MET 72 CO 0.69 0.59 0.81 -1.54 -0.01 0.00 0.00 175.02 175.56 1a0r s SER 73 N -1.56 6.48 0.32 3.03 1.04 -1.26 -4.94 113.70 116.80 1a0r s SER 73 Ca 0.18 1.17 0.02 0.00 0.48 0.00 0.00 55.95 57.81 1a0r s SER 73 Cb -0.11 -2.34 0.60 0.00 0.10 0.00 0.00 66.02 64.27 1a0r s SER 73 CO 0.09 -0.47 1.94 0.58 0.98 0.00 0.00 173.24 176.36 1a0r h VAL 74 N 0.86 1.07 -0.32 5.02 2.07 -1.99 -1.24 116.25 121.72 1a0r h VAL 74 Ca -0.47 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1a0r h VAL 74 Cb 1.19 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1a0r h VAL 74 CO 0.63 0.17 0.21 -0.61 0.02 0.00 0.00 177.57 177.99 1a0r h GLN 75 N 0.93 0.42 -0.81 1.57 4.15 -1.99 -1.05 115.11 118.34 1a0r h GLN 75 Ca 0.34 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.71 1a0r h GLN 75 Cb 0.16 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.72 1a0r h GLN 75 CO -0.12 0.29 0.41 0.93 -1.93 0.00 0.00 178.83 178.41 1a0r h GLU 76 N 0.43 1.14 -0.01 1.69 5.08 -1.65 -1.23 114.58 120.03 1a0r h GLU 76 Ca 0.12 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1a0r h GLU 76 Cb -0.04 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 28.99 1a0r h GLU 76 CO -0.02 0.86 0.00 1.88 -1.00 0.00 0.00 179.01 180.72 1a0r h TYR 77 N 1.14 0.01 -0.99 4.33 0.05 -0.78 -2.07 116.97 118.66 1a0r h TYR 77 Ca 0.28 -0.00 0.07 0.00 0.05 0.00 0.00 58.73 59.13 1a0r h TYR 77 Cb 0.07 -0.00 -0.07 0.00 1.01 0.00 0.00 36.73 37.74 1a0r h TYR 77 CO 0.01 0.13 0.64 0.93 -1.05 0.00 0.00 178.16 178.82 1a0r h GLU 78 N -0.11 1.11 -0.50 4.88 5.08 -0.95 -2.16 114.58 121.93 1a0r h GLU 78 Ca 0.00 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1a0r h GLU 78 Cb 0.13 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 1a0r h GLU 78 CO -0.00 0.74 0.33 -0.07 -1.00 0.00 0.00 179.01 179.01 1a0r h LEU 79 N 1.15 0.56 -1.54 1.33 3.38 -0.85 -1.63 115.31 117.71 1a0r h LEU 79 Ca 0.43 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.37 1a0r h LEU 79 Cb 0.18 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1a0r h LEU 79 CO -0.17 0.41 0.16 0.40 0.09 0.00 0.00 178.44 179.33 1a0r h ILE 80 N 0.67 1.12 -0.34 1.22 2.04 -0.74 0.45 117.51 121.93 1a0r h ILE 80 Ca 0.19 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1a0r h ILE 80 Cb -0.06 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1a0r h ILE 80 CO -0.05 0.14 0.00 1.57 0.00 0.00 0.00 178.15 179.81 1a0r n HIS 81 N -4.42 0.96 0.00 1.37 -0.00 -0.68 -4.12 115.22 108.32 1a0r n HIS 81 Ca 0.02 -0.36 0.00 0.00 0.46 0.00 0.00 57.72 57.84 1a0r n HIS 81 Cb 0.12 -0.23 0.00 0.00 -0.12 0.00 0.00 29.99 29.76 1a0r n HIS 81 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 1a0r n LYS 82 N 0.43 2.54 -3.21 1.57 4.81 -0.10 -5.04 118.16 119.17 1a0r n LYS 82 Ca 0.15 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.20 1a0r n LYS 82 Cb 0.64 -0.50 -0.05 0.00 0.02 0.00 0.00 35.03 35.14 1a0r n LYS 82 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1a0r s ASP 83 N -0.58 6.82 -0.62 3.14 1.01 0.14 -5.03 116.67 121.56 1a0r s ASP 83 Ca 0.00 0.99 -0.16 0.00 0.71 0.00 0.00 52.55 54.09 1a0r s ASP 83 Cb 0.00 -2.34 0.15 0.00 1.01 0.00 0.00 42.92 41.74 1a0r s ASP 83 CO 0.00 -0.02 0.60 -0.54 0.21 0.00 0.00 175.17 175.42 1a0r s LYS 84 N 0.57 3.15 0.08 8.23 1.02 -1.26 -4.91 119.74 126.63 1a0r s LYS 84 Ca 0.31 -1.85 -0.31 0.00 0.02 0.00 0.00 55.97 54.14 1a0r s LYS 84 Cb -0.16 -4.34 -0.09 0.00 -0.52 0.00 0.00 37.83 32.72 1a0r s LYS 84 CO 0.14 -1.35 1.71 -1.21 -0.92 0.00 0.00 175.35 173.72 1a0r s GLU 85 N 1.41 4.18 -0.20 1.68 2.02 -1.26 -4.95 118.70 121.57 1a0r s GLU 85 Ca 0.08 2.42 -0.29 0.00 0.02 0.00 0.00 54.97 57.19 1a0r s GLU 85 Cb -0.24 -3.61 -0.02 0.00 0.10 0.00 0.00 34.13 30.36 1a0r s GLU 85 CO 0.00 -0.77 1.37 0.34 0.02 0.00 0.00 175.26 176.22 1a0r s ASP 86 N 2.54 6.75 0.30 -0.19 2.15 -1.26 -4.92 116.67 122.05 1a0r s ASP 86 Ca 0.76 1.60 0.06 0.00 0.43 0.00 0.00 52.55 55.40 1a0r s ASP 86 Cb -0.42 -2.54 0.79 0.00 -0.30 0.00 0.00 42.92 40.45 1a0r s ASP 86 CO 0.34 -0.94 1.70 -0.33 -0.17 0.00 0.00 175.17 175.76 1a0r h GLU 87 N 9.03 0.42 -0.44 4.34 4.39 -2.00 -0.58 114.58 129.74 1a0r h GLU 87 Ca -0.29 -0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.40 1a0r h GLU 87 Cb 1.12 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.64 1a0r h GLU 87 CO 0.99 0.28 0.27 -0.97 -1.16 0.00 0.00 179.01 178.41 1a0r h ASN 88 N 0.43 0.44 -0.38 1.42 -1.24 -2.00 -1.21 115.58 113.03 1a0r h ASN 88 Ca 0.59 -0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.58 1a0r h ASN 88 Cb 1.14 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 40.08 1a0r h ASN 88 CO -0.53 0.31 0.17 0.00 -1.29 0.00 0.00 177.43 176.09 1a0r h LEU 90 N 0.61 0.52 0.33 0.00 3.38 -0.69 0.43 115.31 119.89 1a0r h LEU 90 Ca 0.15 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1a0r h LEU 90 Cb 0.14 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1a0r h LEU 90 CO -0.01 0.47 -0.21 0.03 0.09 0.00 0.00 178.44 178.81 1a0r h ARG 91 N 0.53 -0.50 -0.92 1.13 3.08 -0.55 -0.93 114.38 116.20 1a0r h ARG 91 Ca 0.14 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.32 1a0r h ARG 91 Cb 0.07 0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.17 1a0r h ARG 91 CO -0.02 -0.33 0.59 0.87 -1.07 0.00 0.00 179.97 180.01 1a0r h LYS 92 N -0.52 0.93 0.36 0.04 1.57 -1.17 -1.61 116.57 116.17 1a0r h LYS 92 Ca -0.03 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1a0r h LYS 92 Cb 0.43 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1a0r h LYS 92 CO 0.03 0.62 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.43 1a0r h TYR 93 N 0.96 -0.45 -0.72 -1.35 3.20 -0.47 0.31 116.97 118.45 1a0r h TYR 93 Ca 0.42 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.41 1a0r h TYR 93 Cb 0.35 0.15 -0.09 0.00 1.54 0.00 0.00 36.73 38.68 1a0r h TYR 93 CO -0.00 -0.16 0.29 0.00 -1.64 0.00 0.00 178.16 176.65 1a0r h ARG 94 N -0.70 0.43 0.25 1.82 3.08 -0.87 0.12 114.38 118.50 1a0r h ARG 94 Ca -0.05 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1a0r h ARG 94 Cb 0.49 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1a0r h ARG 94 CO 0.08 0.28 -0.12 -0.09 -1.07 0.00 0.00 179.97 179.05 1a0r h ARG 95 N 0.44 -0.32 -0.91 0.04 2.43 -1.21 -2.98 114.38 111.86 1a0r h ARG 95 Ca 0.39 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1a0r h ARG 95 Cb 0.56 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 1a0r h ARG 95 CO -0.38 -0.08 0.57 0.37 -1.51 0.00 0.00 179.97 178.94 1a0r h GLN 96 N -0.53 1.22 -0.18 0.20 4.15 -0.27 -2.34 115.11 117.37 1a0r h GLN 96 Ca -0.03 -0.10 0.01 0.00 0.77 0.00 0.00 58.65 59.31 1a0r h GLN 96 Cb 0.39 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 1a0r h GLN 96 CO 0.06 0.84 0.07 0.00 -1.93 0.00 0.00 178.83 177.86 1a0r h MET 98 N 0.16 0.68 -0.40 0.00 2.86 -1.35 -2.21 114.93 114.67 1a0r h MET 98 Ca 0.07 -0.13 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 1a0r h MET 98 Cb 0.04 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1a0r h MET 98 CO -0.07 0.63 -0.29 1.96 1.06 0.00 0.00 176.91 180.20 1a0r h GLN 99 N 0.66 0.86 -0.35 1.72 4.20 -0.84 -0.39 115.11 120.96 1a0r h GLN 99 Ca 0.15 -0.39 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 1a0r h GLN 99 Cb 0.27 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1a0r h GLN 99 CO -0.00 1.03 0.21 -0.44 -0.67 0.00 0.00 178.83 178.96 1a0r h ASP 100 N 0.73 0.43 -0.39 1.46 3.32 -0.26 0.15 116.42 121.87 1a0r h ASP 100 Ca 0.08 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.02 1a0r h ASP 100 Cb 0.85 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.27 1a0r h ASP 100 CO 0.07 0.38 0.08 0.24 -1.72 0.00 0.00 179.24 178.29 1a0r h MET 101 N 0.45 0.63 -0.72 3.56 2.86 -1.34 0.16 114.93 120.54 1a0r h MET 101 Ca 0.13 -0.16 0.09 0.00 -2.06 0.00 0.00 59.70 57.70 1a0r h MET 101 Cb 0.03 -0.08 -0.07 0.00 0.06 0.00 0.00 31.60 31.54 1a0r h MET 101 CO -0.02 0.68 0.37 0.45 1.06 0.00 0.00 176.91 179.44 1a0r h HIS 102 N 0.49 0.66 -0.19 -0.22 3.86 -0.68 -0.82 115.15 118.25 1a0r h HIS 102 Ca 0.12 0.03 -0.17 0.00 -1.16 0.00 0.00 60.37 59.19 1a0r h HIS 102 Cb 0.34 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.62 1a0r h HIS 102 CO 0.02 0.24 -0.57 0.37 0.86 0.00 0.00 177.93 178.85 1a0r h GLN 103 N 0.62 0.58 0.00 2.45 4.15 -0.32 -2.29 115.11 120.31 1a0r h GLN 103 Ca 0.36 -0.38 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 1a0r h GLN 103 Cb 0.37 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.10 1a0r h GLN 103 CO -0.27 0.99 -0.09 0.87 -1.93 0.00 0.00 178.83 178.41 1a0r h LYS 104 N 0.44 0.00 0.00 1.69 1.57 0.01 -3.09 116.57 117.19 1a0r h LYS 104 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a0r h LYS 104 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1a0r h LYS 104 CO 0.11 0.09 -1.25 1.28 -0.57 0.00 0.00 179.45 179.11 1a0r n LEU 105 N -3.16 0.55 -4.56 2.94 4.77 -0.38 -4.79 117.00 112.37 1a0r n LEU 105 Ca 0.02 0.09 -0.41 0.00 -0.03 0.00 0.00 56.01 55.68 1a0r n LEU 105 Cb 0.45 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 1a0r n LEU 105 CO 0.32 -0.04 1.15 -0.55 -1.33 0.00 0.00 177.39 176.94 1a0r s SER 106 N -4.51 6.22 -0.09 -1.43 0.15 -0.87 -4.92 113.70 108.26 1a0r s SER 106 Ca -0.00 -0.33 -0.14 0.00 0.70 0.00 0.00 55.95 56.18 1a0r s SER 106 Cb 0.13 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.83 1a0r s SER 106 CO 0.82 -1.76 0.35 -0.36 1.20 0.00 0.00 173.24 173.49 1a0r s PHE 107 N 5.56 3.59 0.27 3.44 0.08 -1.26 -4.96 117.98 124.70 1a0r s PHE 107 Ca 0.37 0.79 -0.27 0.00 0.12 0.00 0.00 56.93 57.94 1a0r s PHE 107 Cb -0.08 -2.30 -0.15 0.00 -0.57 0.00 0.00 43.02 39.92 1a0r s PHE 107 CO 0.17 0.45 0.69 0.41 -0.10 0.00 0.00 175.22 176.85 1a0r n GLY 108 N 2.57 -1.18 3.61 4.36 0.00 -1.26 -4.65 105.19 108.64 1a0r n GLY 108 Ca -0.13 0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1a0r n GLY 108 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1a0r s PRO 109 N -1.29 3.39 -0.01 1.61 0.02 -1.26 -4.59 135.00 132.86 1a0r s PRO 109 Ca 0.62 2.07 0.05 0.00 0.02 0.00 0.00 61.00 63.75 1a0r s PRO 109 Cb -0.79 -4.30 -0.08 0.00 0.02 0.00 0.00 34.50 29.36 1a0r s PRO 109 CO 0.58 -1.81 0.11 -2.13 -0.33 0.00 0.00 177.00 173.43 1a0r n ARG 110 N 8.42 0.25 0.00 5.54 3.00 -0.78 -4.96 116.66 128.14 1a0r n ARG 110 Ca 0.27 -0.05 0.00 0.00 -0.00 0.00 0.00 57.85 58.07 1a0r n ARG 110 Cb 0.44 -1.11 0.00 0.00 0.00 0.00 0.00 32.46 31.79 1a0r n ARG 110 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1a0r n TYR 111 N -1.66 0.00 0.00 -0.14 4.01 0.27 -5.05 117.16 114.59 1a0r n TYR 111 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1a0r n TYR 111 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 1a0r n TYR 111 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1a0r n GLY 112 N 5.00 -0.12 3.22 2.72 0.00 -1.25 -4.80 105.19 109.96 1a0r n GLY 112 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1a0r n GLY 112 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a0r s PHE 113 N -0.57 1.17 -0.54 1.61 0.08 -1.26 -3.24 117.98 115.24 1a0r s PHE 113 Ca 0.00 -0.73 -0.22 0.00 0.12 0.00 0.00 56.93 56.11 1a0r s PHE 113 Cb 0.00 -0.62 0.05 0.00 -0.57 0.00 0.00 43.02 41.88 1a0r s PHE 113 CO 0.00 0.04 0.79 0.08 -0.10 0.00 0.00 175.22 176.03 1a0r s VAL 114 N -3.00 4.62 0.13 -0.44 1.01 -1.26 -4.33 120.40 117.13 1a0r s VAL 114 Ca 0.12 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 1a0r s VAL 114 Cb 0.01 -4.44 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 1a0r s VAL 114 CO 0.00 -0.99 1.03 -0.31 0.00 0.00 0.00 175.10 174.83 1a0r s TYR 115 N 3.32 3.71 -0.13 5.22 2.02 0.20 -4.83 117.35 126.87 1a0r s TYR 115 Ca 0.23 1.69 -0.20 0.00 -0.37 0.00 0.00 57.07 58.42 1a0r s TYR 115 Cb -0.16 -3.16 -0.04 0.00 -0.40 0.00 0.00 41.96 38.20 1a0r s TYR 115 CO 0.15 -0.18 0.55 -2.00 -1.57 0.00 0.00 175.55 172.50 1a0r s GLU 116 N -0.03 4.33 -0.31 -0.62 2.12 -1.26 -0.74 118.70 122.19 1a0r s GLU 116 Ca 0.49 0.57 -0.10 0.00 0.36 0.00 0.00 54.97 56.28 1a0r s GLU 116 Cb -0.26 -3.47 -0.01 0.00 0.26 0.00 0.00 34.13 30.65 1a0r s GLU 116 CO 0.31 0.04 0.17 -0.51 -0.54 0.00 0.00 175.26 174.73 1a0r s LEU 117 N 0.97 4.15 0.02 2.70 1.43 0.17 -4.94 118.68 123.18 1a0r s LEU 117 Ca 0.29 -0.47 -0.19 0.00 -1.03 0.00 0.00 54.13 52.73 1a0r s LEU 117 Cb -0.16 -2.03 -0.23 0.00 0.03 0.00 0.00 46.19 43.80 1a0r s LEU 117 CO 0.12 -0.19 1.12 -0.33 0.23 0.00 0.00 176.35 177.30 1a0r h GLU 118 N 8.37 0.46 -5.80 1.70 5.08 -1.93 -3.41 114.58 119.05 1a0r h GLU 118 Ca -0.32 -0.49 -0.50 0.00 -1.00 0.00 0.00 59.36 57.05 1a0r h GLU 118 Cb 1.15 0.14 -0.17 0.00 0.50 0.00 0.00 28.75 30.37 1a0r h GLU 118 CO 0.61 1.14 -0.77 0.45 -1.00 0.00 0.00 179.01 179.44 1a0r s SER 119 N -6.83 2.62 0.62 1.42 0.15 -1.26 -4.73 113.70 105.69 1a0r s SER 119 Ca -0.13 -0.90 0.32 0.00 0.70 0.00 0.00 55.95 55.95 1a0r s SER 119 Cb 0.04 -0.15 1.84 0.00 -1.71 0.00 0.00 66.02 66.04 1a0r s SER 119 CO 0.84 -0.08 2.15 1.23 1.20 0.00 0.00 173.24 178.58 1a0r h GLY 120 N 3.07 0.00 0.86 9.45 0.00 -1.56 -0.33 103.07 114.57 1a0r h GLY 120 Ca -0.41 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 1a0r h GLY 120 CO 0.54 0.00 0.02 -2.09 0.00 0.00 0.00 176.54 175.01 1a0r h GLU 121 N 0.00 0.44 -0.22 4.80 4.81 -1.89 -1.50 114.58 121.02 1a0r h GLU 121 Ca 0.05 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1a0r h GLU 121 Cb 0.35 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1a0r h GLU 121 CO -0.00 0.58 0.15 1.96 -0.73 0.00 0.00 179.01 180.97 1a0r h GLN 122 N 0.23 0.12 0.27 1.92 4.20 -1.47 0.96 115.11 121.35 1a0r h GLN 122 Ca 0.08 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1a0r h GLN 122 Cb 0.37 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1a0r h GLN 122 CO 0.01 0.08 -0.13 0.35 -0.67 0.00 0.00 178.83 178.47 1a0r h PHE 123 N 0.12 -0.34 -0.69 2.96 3.04 -1.24 -1.29 116.94 119.51 1a0r h PHE 123 Ca 0.10 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.07 1a0r h PHE 123 Cb 0.23 0.11 -0.04 0.00 2.56 0.00 0.00 35.95 38.81 1a0r h PHE 123 CO -0.00 -0.01 0.44 -0.07 -2.02 0.00 0.00 178.31 176.65 1a0r h LEU 124 N -0.70 0.72 -0.88 0.59 3.38 -0.37 -2.27 115.31 115.78 1a0r h LEU 124 Ca -0.04 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1a0r h LEU 124 Cb 0.48 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1a0r h LEU 124 CO 0.06 0.50 0.14 -0.33 0.09 0.00 0.00 178.44 178.90 1a0r h GLU 125 N 0.86 0.97 -0.24 1.13 4.39 -0.83 -1.95 114.58 118.91 1a0r h GLU 125 Ca 0.27 -0.22 -0.16 0.00 0.34 0.00 0.00 59.36 59.60 1a0r h GLU 125 Cb 0.00 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1a0r h GLU 125 CO -0.10 0.87 -0.50 0.00 -1.16 0.00 0.00 179.01 178.12 1a0r h THR 126 N 0.92 1.30 0.00 1.13 1.03 -0.84 0.14 112.91 116.60 1a0r h THR 126 Ca 0.20 -1.71 -0.11 0.00 -0.01 0.00 0.00 66.41 64.78 1a0r h THR 126 Cb 0.35 1.65 -0.02 0.00 -1.07 0.00 0.00 68.15 69.07 1a0r h THR 126 CO 0.00 0.54 -0.52 0.16 -0.01 0.00 0.00 175.52 175.69 1a0r h ILE 127 N 0.51 0.97 0.01 0.00 3.07 -1.29 -3.36 117.51 117.41 1a0r h ILE 127 Ca 0.02 -2.14 -0.28 0.00 1.55 0.00 0.00 64.86 64.02 1a0r h ILE 127 Cb 1.04 2.32 -0.04 0.00 -0.27 0.00 0.00 36.82 39.87 1a0r h ILE 127 CO 0.10 0.51 -1.51 -0.62 -1.05 0.00 0.00 178.15 175.58 1a0r n GLU 128 N -3.33 0.58 -2.61 0.16 1.02 -0.74 -3.77 120.64 111.94 1a0r n GLU 128 Ca 0.01 0.51 -0.43 0.00 -0.02 0.00 0.00 57.16 57.23 1a0r n GLU 128 Cb 0.69 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1a0r n GLU 128 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1a0r n LYS 129 N -4.34 3.35 -3.55 3.49 3.00 0.48 -4.86 118.16 115.73 1a0r n LYS 129 Ca -0.36 -3.54 -0.16 0.00 -0.00 0.00 0.00 58.31 54.25 1a0r n LYS 129 Cb 0.74 -3.12 -0.06 0.00 0.00 0.00 0.00 35.03 32.58 1a0r n LYS 129 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1a0r s GLU 130 N 1.94 0.91 0.29 1.64 2.56 -1.26 -4.69 118.70 120.09 1a0r s GLU 130 Ca 0.45 0.36 -0.30 0.00 0.00 0.00 0.00 54.97 55.47 1a0r s GLU 130 Cb 0.03 0.43 -0.11 0.00 2.00 0.00 0.00 34.13 36.48 1a0r s GLU 130 CO 0.01 -0.26 1.62 -0.65 -0.56 0.00 0.00 175.26 175.42 1a0r s GLN 131 N -0.88 4.11 0.64 4.30 -0.21 -1.26 -4.85 119.66 121.50 1a0r s GLN 131 Ca -0.07 2.60 0.43 0.00 0.02 0.00 0.00 55.36 58.34 1a0r s GLN 131 Cb -0.01 -3.02 2.31 0.00 1.00 0.00 0.00 33.01 33.29 1a0r s GLN 131 CO 0.06 -0.66 2.31 0.87 -2.12 0.00 0.00 175.29 175.75 1a0r h LYS 132 N 5.02 0.00 0.00 2.91 1.57 -1.95 -1.11 116.57 123.01 1a0r h LYS 132 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1a0r h LYS 132 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1a0r h LYS 132 CO 0.81 0.00 -0.31 0.44 -0.57 0.00 0.00 179.45 179.82 1a0r n ILE 133 N -3.01 0.25 -3.12 1.86 -5.35 -1.26 -2.90 119.36 105.84 1a0r n ILE 133 Ca -0.03 -0.15 -0.40 0.00 -0.27 0.00 0.00 62.75 61.90 1a0r n ILE 133 Cb 0.07 -0.24 -0.06 0.00 -1.74 0.00 0.00 39.64 37.68 1a0r n ILE 133 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1a0r s THR 134 N -3.08 5.03 0.11 7.28 2.01 -0.42 -5.00 115.64 121.58 1a0r s THR 134 Ca 0.10 1.19 -0.28 0.00 0.31 0.00 0.00 61.69 63.01 1a0r s THR 134 Cb 0.15 -3.95 -0.06 0.00 0.01 0.00 0.00 72.50 68.66 1a0r s THR 134 CO 0.64 0.13 0.89 -0.89 -0.69 0.00 0.00 174.62 174.70 1a0r s THR 135 N 1.81 4.50 -0.13 -0.82 2.01 -1.26 -4.24 115.64 117.52 1a0r s THR 135 Ca 0.29 1.93 0.03 0.00 0.31 0.00 0.00 61.69 64.25 1a0r s THR 135 Cb -0.16 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.10 1a0r s THR 135 CO 0.11 0.37 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.55 1a0r s ILE 136 N -0.23 2.12 -0.31 1.82 1.01 0.31 -1.26 121.20 124.66 1a0r s ILE 136 Ca 0.43 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 60.12 1a0r s ILE 136 Cb -0.23 -1.84 0.07 0.00 0.01 0.00 0.00 42.46 40.48 1a0r s ILE 136 CO 0.28 0.55 0.01 -0.69 0.00 0.00 0.00 174.94 175.09 1a0r s VAL 137 N 0.62 2.61 -0.12 2.92 1.01 -0.21 -0.09 120.40 127.14 1a0r s VAL 137 Ca -0.12 -1.81 -0.10 0.00 0.00 0.00 0.00 61.98 59.96 1a0r s VAL 137 Cb -0.16 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 1a0r s VAL 137 CO 0.03 -0.30 0.21 -0.69 0.00 0.00 0.00 175.10 174.34 1a0r s VAL 138 N 1.10 5.38 -0.35 2.92 1.01 0.11 -0.67 120.40 129.89 1a0r s VAL 138 Ca -0.00 0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.35 1a0r s VAL 138 Cb -0.20 -3.50 0.10 0.00 0.00 0.00 0.00 36.38 32.78 1a0r s VAL 138 CO -0.04 0.55 0.08 -2.28 0.00 0.00 0.00 175.10 173.41 1a0r s HIS 139 N -0.58 3.65 -0.09 5.22 2.46 0.11 -0.52 115.29 125.55 1a0r s HIS 139 Ca 0.15 -2.71 -0.30 0.00 0.47 0.00 0.00 55.06 52.68 1a0r s HIS 139 Cb -0.13 -2.90 -0.02 0.00 -0.13 0.00 0.00 32.58 29.40 1a0r s HIS 139 CO 0.05 -0.94 1.08 0.42 -2.47 0.00 0.00 174.74 172.87 1a0r s ILE 140 N 1.01 4.59 0.23 0.89 1.09 -0.46 -1.51 121.20 127.04 1a0r s ILE 140 Ca 0.08 1.88 0.03 0.00 -1.10 0.00 0.00 60.65 61.53 1a0r s ILE 140 Cb -0.20 -4.21 -0.01 0.00 -1.06 0.00 0.00 42.46 36.98 1a0r s ILE 140 CO -0.06 -0.00 0.25 0.00 -0.10 0.00 0.00 174.94 175.02 1a0r n TYR 141 N 5.12 -0.78 -3.65 3.97 4.11 -0.25 -2.61 117.16 123.07 1a0r n TYR 141 Ca 0.10 -1.80 -0.02 0.00 -0.00 0.00 0.00 57.90 56.18 1a0r n TYR 141 Cb 0.48 0.27 -0.05 0.00 -0.00 0.00 0.00 39.34 40.04 1a0r n TYR 141 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.86 174.86 1a0r s GLU 142 N -2.78 0.59 0.31 -3.48 2.56 -1.26 -0.74 118.70 113.90 1a0r s GLU 142 Ca 0.24 1.42 -0.29 0.00 0.00 0.00 0.00 54.97 56.34 1a0r s GLU 142 Cb 0.01 0.77 -0.12 0.00 2.00 0.00 0.00 34.13 36.78 1a0r s GLU 142 CO 0.17 -0.19 1.37 -0.25 -0.56 0.00 0.00 175.26 175.80 1a0r n ASP 143 N 5.30 2.95 0.00 -1.70 8.00 -1.26 -2.53 116.55 127.31 1a0r n ASP 143 Ca -0.13 1.18 0.00 0.00 0.71 0.00 0.00 54.79 56.55 1a0r n ASP 143 Cb 0.50 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.12 1a0r n ASP 143 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a0r n GLY 144 N 1.34 2.05 3.75 0.44 0.00 -1.26 -5.05 105.19 106.46 1a0r n GLY 144 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1a0r n GLY 144 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a0r s ILE 145 N -2.37 4.78 -0.30 -0.61 1.01 -1.05 -4.97 121.20 117.68 1a0r s ILE 145 Ca 0.00 1.54 -0.40 0.00 0.00 0.00 0.00 60.65 61.79 1a0r s ILE 145 Cb 0.00 -4.07 -0.15 0.00 0.01 0.00 0.00 42.46 38.25 1a0r s ILE 145 CO 0.00 0.37 1.83 1.17 0.00 0.00 0.00 174.94 178.31 1a0r n LYS 146 N 2.80 1.10 0.00 2.79 4.81 -1.26 -1.24 118.16 127.16 1a0r n LYS 146 Ca -0.03 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1a0r n LYS 146 Cb 0.50 -2.13 0.00 0.00 0.02 0.00 0.00 35.03 33.43 1a0r n LYS 146 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1a0r n GLY 147 N 4.67 2.84 0.23 3.14 0.00 -1.26 -4.56 105.19 110.25 1a0r n GLY 147 Ca 0.30 -0.58 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 1a0r n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a0r h ASP 149 N 0.38 0.30 -0.62 0.00 3.32 -1.86 -2.43 116.42 115.50 1a0r h ASP 149 Ca 0.29 -0.51 0.02 0.00 0.02 0.00 0.00 57.03 56.85 1a0r h ASP 149 Cb 0.36 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 1a0r h ASP 149 CO -0.30 0.74 0.40 0.00 -1.72 0.00 0.00 179.24 178.36 1a0r h ALA 150 N 0.56 0.80 -0.30 3.45 0.00 -1.82 -1.72 119.26 120.24 1a0r h ALA 150 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1a0r h ALA 150 Cb 0.67 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1a0r h ALA 150 CO 0.03 0.18 0.17 1.25 0.00 0.00 0.00 179.25 180.88 1a0r h LEU 151 N 0.80 0.36 -0.99 0.00 6.46 -0.76 -1.65 115.31 119.53 1a0r h LEU 151 Ca 0.24 -0.07 0.08 0.00 -0.12 0.00 0.00 57.88 58.01 1a0r h LEU 151 Cb -0.04 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 39.73 1a0r h LEU 151 CO -0.08 0.32 0.64 0.78 -0.62 0.00 0.00 178.44 179.49 1a0r h ASN 152 N 0.37 1.00 -0.12 1.25 2.35 -0.96 0.93 115.58 120.40 1a0r h ASN 152 Ca 0.11 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1a0r h ASN 152 Cb 0.03 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 1a0r h ASN 152 CO -0.02 0.61 0.02 -1.28 -1.65 0.00 0.00 177.43 175.11 1a0r h SER 153 N 1.12 0.18 -0.67 5.81 0.87 -0.89 -2.37 113.55 117.60 1a0r h SER 153 Ca 0.45 -0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1a0r h SER 153 Cb 0.25 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.12 1a0r h SER 153 CO -0.20 0.39 0.43 0.28 -0.53 0.00 0.00 176.83 177.21 1a0r h SER 154 N -0.04 0.73 -0.49 6.23 0.02 -0.63 -2.32 113.55 117.05 1a0r h SER 154 Ca 0.04 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1a0r h SER 154 Cb 0.29 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 1a0r h SER 154 CO 0.00 0.52 0.33 -0.07 -1.14 0.00 0.00 176.83 176.47 1a0r h LEU 155 N 0.87 0.49 -0.39 5.07 3.38 -0.68 -0.65 115.31 123.40 1a0r h LEU 155 Ca 0.25 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.28 1a0r h LEU 155 Cb -0.06 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.52 1a0r h LEU 155 CO -0.07 0.34 0.04 0.40 0.09 0.00 0.00 178.44 179.24 1a0r h ILE 156 N 0.57 0.75 0.06 1.22 2.04 -0.88 0.21 117.51 121.48 1a0r h ILE 156 Ca 0.20 -0.05 -0.25 0.00 1.00 0.00 0.00 64.86 65.75 1a0r h ILE 156 Cb 0.08 0.59 0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1a0r h ILE 156 CO -0.05 0.03 -1.08 0.00 0.00 0.00 0.00 178.15 177.05 1a0r h LEU 158 N 0.21 0.81 -0.97 0.00 5.85 -0.67 -0.14 115.31 120.40 1a0r h LEU 158 Ca -0.12 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.48 1a0r h LEU 158 Cb 1.75 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 1a0r h LEU 158 CO 0.19 0.63 -0.02 0.00 -0.34 0.00 0.00 178.44 178.90 1a0r h ALA 159 N 1.51 1.14 -0.08 1.25 0.00 -0.60 -0.43 119.26 122.04 1a0r h ALA 159 Ca 0.24 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 1a0r h ALA 159 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1a0r h ALA 159 CO -0.04 0.55 -0.66 0.00 0.00 0.00 0.00 179.25 179.10 1a0r h ALA 160 N 1.30 0.72 -0.02 0.00 0.00 -1.22 -3.09 119.26 116.95 1a0r h ALA 160 Ca 0.13 -0.57 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1a0r h ALA 160 Cb 0.45 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1a0r h ALA 160 CO 0.02 0.75 -0.63 0.93 0.00 0.00 0.00 179.25 180.32 1a0r h GLU 161 N 0.24 0.08 -2.16 0.00 5.08 -0.55 -3.36 114.58 113.92 1a0r h GLU 161 Ca -0.02 -0.06 -0.59 0.00 -1.00 0.00 0.00 59.36 57.69 1a0r h GLU 161 Cb 1.20 0.01 -0.42 0.00 0.50 0.00 0.00 28.75 30.05 1a0r h GLU 161 CO 0.11 0.68 -0.67 0.66 -1.00 0.00 0.00 179.01 178.79 1a0r n TYR 162 N -3.82 3.03 0.09 4.33 4.02 -0.22 -4.92 117.16 119.69 1a0r n TYR 162 Ca -0.02 -4.06 0.05 0.00 -0.01 0.00 0.00 57.90 53.86 1a0r n TYR 162 Cb 0.63 -0.52 0.24 0.00 -0.02 0.00 0.00 39.34 39.66 1a0r n TYR 162 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1a0r n PRO 163 N 0.90 0.06 0.06 -0.72 -0.02 -1.17 -0.66 135.00 133.44 1a0r n PRO 163 Ca 0.29 0.54 0.13 0.00 -2.02 0.00 0.00 63.50 62.43 1a0r n PRO 163 Cb 0.43 -1.68 0.34 0.00 -0.02 0.00 0.00 33.50 32.57 1a0r n PRO 163 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1a0r n MET 164 N -1.80 0.19 -4.22 -0.52 0.00 -1.26 -0.56 117.12 108.95 1a0r n MET 164 Ca -0.00 0.10 -0.35 0.00 0.00 0.00 0.00 57.70 57.45 1a0r n MET 164 Cb 0.03 -1.67 -0.09 0.00 0.00 0.00 0.00 33.22 31.48 1a0r n MET 164 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1a0r s VAL 165 N -3.09 4.53 -0.45 3.17 1.01 0.16 -4.38 120.40 121.35 1a0r s VAL 165 Ca 0.10 -0.15 -0.18 0.00 0.00 0.00 0.00 61.98 61.74 1a0r s VAL 165 Cb 0.15 -2.96 0.03 0.00 0.00 0.00 0.00 36.38 33.60 1a0r s VAL 165 CO 0.64 0.55 0.53 -0.75 0.00 0.00 0.00 175.10 176.08 1a0r s LYS 166 N -0.39 3.13 -0.17 2.72 2.20 -0.39 -4.68 119.74 122.17 1a0r s LYS 166 Ca 0.08 -0.75 -0.16 0.00 -0.36 0.00 0.00 55.97 54.79 1a0r s LYS 166 Cb -0.12 -4.01 -0.04 0.00 -1.51 0.00 0.00 37.83 32.15 1a0r s LYS 166 CO 0.02 -1.00 0.39 -0.06 -0.36 0.00 0.00 175.35 174.34 1a0r s PHE 167 N 2.39 3.44 0.12 4.03 0.40 -1.26 -1.05 117.98 126.04 1a0r s PHE 167 Ca 0.15 0.68 0.05 0.00 -0.60 0.00 0.00 56.93 57.21 1a0r s PHE 167 Cb -0.17 -2.47 -0.04 0.00 0.51 0.00 0.00 43.02 40.85 1a0r s PHE 167 CO 0.14 0.12 -0.12 0.00 0.70 0.00 0.00 175.22 176.05 1a0r s LYS 169 N -2.78 0.60 -0.23 0.00 -2.85 0.09 0.09 119.74 114.65 1a0r s LYS 169 Ca 0.08 -0.81 -0.15 0.00 -1.00 0.00 0.00 55.97 54.10 1a0r s LYS 169 Cb -0.04 -0.43 0.07 0.00 -2.06 0.00 0.00 37.83 35.37 1a0r s LYS 169 CO 0.02 0.08 0.58 -1.50 0.10 0.00 0.00 175.35 174.64 1a0r s ILE 170 N -1.35 -0.01 0.41 3.79 2.07 -0.57 -0.66 121.20 124.89 1a0r s ILE 170 Ca -0.08 0.03 -0.25 0.00 -1.41 0.00 0.00 60.65 58.94 1a0r s ILE 170 Cb -0.10 -0.84 -0.08 0.00 0.13 0.00 0.00 42.46 41.57 1a0r s ILE 170 CO 0.01 0.01 1.24 -0.54 -1.91 0.00 0.00 174.94 173.76 1a0r s LYS 171 N 1.34 3.95 0.30 3.50 1.02 -1.26 -1.09 119.74 127.50 1a0r s LYS 171 Ca -0.08 2.01 0.01 0.00 0.02 0.00 0.00 55.97 57.93 1a0r s LYS 171 Cb -0.06 -2.68 0.55 0.00 -0.52 0.00 0.00 37.83 35.12 1a0r s LYS 171 CO -0.14 -0.46 1.89 0.00 -0.92 0.00 0.00 175.35 175.72 1a0r h ALA 172 N 2.57 1.53 0.00 5.17 0.00 -1.25 0.67 119.26 127.95 1a0r h ALA 172 Ca -0.49 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1a0r h ALA 172 Cb 1.24 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1a0r h ALA 172 CO 0.62 0.31 -0.03 0.77 0.00 0.00 0.00 179.25 180.91 1a0r h SER 173 N 1.01 0.00 0.11 0.00 0.02 -1.88 -2.38 113.55 110.42 1a0r h SER 173 Ca 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 1a0r h SER 173 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1a0r h SER 173 CO -0.17 0.03 -0.78 0.59 -1.14 0.00 0.00 176.83 175.36 1a0r n ASN 174 N -3.36 1.07 0.02 3.07 4.13 0.19 -4.19 115.26 116.19 1a0r n ASN 174 Ca -0.02 -0.93 -0.07 0.00 1.68 0.00 0.00 54.58 55.23 1a0r n ASN 174 Cb 0.16 0.73 0.10 0.00 -1.54 0.00 0.00 39.78 39.22 1a0r n ASN 174 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1a0r h THR 175 N 0.45 1.32 0.00 3.41 1.35 -1.01 -2.44 112.91 115.99 1a0r h THR 175 Ca 0.00 -1.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.16 1a0r h THR 175 Cb 0.54 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1a0r h THR 175 CO 0.00 0.52 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 1a0r n GLY 176 N 0.10 0.45 2.39 5.82 0.00 -1.25 -3.94 105.19 108.75 1a0r n GLY 176 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1a0r n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a0r n ALA 177 N 1.00 7.24 -0.54 4.61 0.00 -1.26 -4.92 120.51 126.64 1a0r n ALA 177 Ca 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 53.44 49.77 1a0r n ALA 177 Cb 0.09 -3.29 0.00 0.00 0.00 0.00 0.00 19.45 16.26 1a0r n ALA 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a0r n GLY 178 N 3.30 1.86 2.71 0.00 0.00 -1.26 -1.60 105.19 110.19 1a0r n GLY 178 Ca 0.73 0.46 -0.05 0.00 0.00 0.00 0.00 46.02 47.15 1a0r n GLY 178 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1a0r n ASP 179 N 7.88 1.97 0.06 1.61 8.00 -1.26 -4.88 116.55 129.92 1a0r n ASP 179 Ca 0.00 -2.40 -0.23 0.00 0.71 0.00 0.00 54.79 52.87 1a0r n ASP 179 Cb 0.00 -0.48 -0.15 0.00 -0.02 0.00 0.00 41.12 40.48 1a0r n ASP 179 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1a0r h ARG 180 N 2.66 0.36 -4.47 -1.24 0.11 -1.72 -3.40 114.38 106.68 1a0r h ARG 180 Ca -0.07 -0.62 -0.75 0.00 0.10 0.00 0.00 59.98 58.64 1a0r h ARG 180 Cb 1.26 0.23 -0.21 0.00 1.11 0.00 0.00 29.97 32.37 1a0r h ARG 180 CO 0.33 1.29 0.93 -0.06 0.10 0.00 0.00 179.97 182.57 1a0r s PHE 181 N -2.57 3.61 0.50 4.08 0.08 -1.26 -4.91 117.98 117.50 1a0r s PHE 181 Ca -0.17 -2.08 0.07 0.00 0.12 0.00 0.00 56.93 54.87 1a0r s PHE 181 Cb 0.06 -4.16 0.03 0.00 -0.57 0.00 0.00 43.02 38.38 1a0r s PHE 181 CO 0.84 -1.28 0.50 -1.12 -0.10 0.00 0.00 175.22 174.05 1a0r s SER 182 N 2.62 4.96 0.55 1.36 0.01 -1.26 -4.80 113.70 117.13 1a0r s SER 182 Ca 0.36 -0.93 0.28 0.00 1.31 0.00 0.00 55.95 56.97 1a0r s SER 182 Cb -0.05 -0.02 1.46 0.00 0.21 0.00 0.00 66.02 67.62 1a0r s SER 182 CO -0.05 -0.99 1.95 0.28 0.41 0.00 0.00 173.24 174.84 1a0r h SER 183 N 0.70 0.00 0.98 2.44 0.02 -1.94 0.23 113.55 115.97 1a0r h SER 183 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1a0r h SER 183 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1a0r h SER 183 CO 0.52 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.31 1a0r n ASP 184 N -4.12 0.17 -0.06 3.07 5.75 -1.26 -3.42 116.55 116.68 1a0r n ASP 184 Ca 0.11 0.52 -0.06 0.00 -0.01 0.00 0.00 54.79 55.35 1a0r n ASP 184 Cb 0.70 -0.56 -0.10 0.00 -1.03 0.00 0.00 41.12 40.13 1a0r n ASP 184 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1a0r n VAL 185 N -1.66 0.85 -2.30 2.12 0.31 0.62 -4.82 118.33 113.46 1a0r n VAL 185 Ca 0.06 -0.51 -0.39 0.00 -0.01 0.00 0.00 64.34 63.50 1a0r n VAL 185 Cb 0.32 -0.70 -0.02 0.00 -0.91 0.00 0.00 33.84 32.53 1a0r n VAL 185 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1a0r s LEU 186 N -4.98 4.25 -0.08 7.52 1.43 -0.20 -0.88 118.68 125.72 1a0r s LEU 186 Ca -0.07 2.37 -0.29 0.00 -1.03 0.00 0.00 54.13 55.11 1a0r s LEU 186 Cb 0.04 -3.95 -0.02 0.00 0.03 0.00 0.00 46.19 42.29 1a0r s LEU 186 CO 0.49 -0.61 0.99 -2.84 0.23 0.00 0.00 176.35 174.61 1a0r s PRO 187 N -2.17 4.45 -0.12 1.29 0.02 -1.26 -4.54 135.00 132.67 1a0r s PRO 187 Ca 0.55 1.37 -0.06 0.00 0.02 0.00 0.00 61.00 62.88 1a0r s PRO 187 Cb -0.32 -3.52 -0.04 0.00 0.02 0.00 0.00 34.50 30.64 1a0r s PRO 187 CO 0.40 -0.25 0.10 0.99 -0.33 0.00 0.00 177.00 177.91 1a0r s THR 188 N 1.77 5.16 -0.22 0.99 2.01 -1.07 -1.17 115.64 123.11 1a0r s THR 188 Ca 0.48 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.56 1a0r s THR 188 Cb -0.19 -3.24 0.06 0.00 0.01 0.00 0.00 72.50 69.13 1a0r s THR 188 CO 0.20 0.59 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.46 1a0r s LEU 189 N -0.79 2.22 -0.15 4.42 2.96 -0.29 -1.36 118.68 125.69 1a0r s LEU 189 Ca 0.13 -1.03 -0.08 0.00 -0.22 0.00 0.00 54.13 52.93 1a0r s LEU 189 Cb -0.12 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 1a0r s LEU 189 CO 0.03 -0.23 0.13 -0.76 -1.32 0.00 0.00 176.35 174.20 1a0r s LEU 190 N 1.49 4.29 -0.19 -0.68 1.02 0.33 -1.05 118.68 123.88 1a0r s LEU 190 Ca -0.04 0.37 0.01 0.00 0.02 0.00 0.00 54.13 54.49 1a0r s LEU 190 Cb -0.18 -2.07 0.03 0.00 0.02 0.00 0.00 46.19 44.00 1a0r s LEU 190 CO -0.07 0.32 -0.14 -0.69 0.02 0.00 0.00 176.35 175.80 1a0r s VAL 191 N -0.51 1.80 0.36 -1.59 1.01 -0.06 0.05 120.40 121.46 1a0r s VAL 191 Ca 0.12 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.19 1a0r s VAL 191 Cb -0.12 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 1a0r s VAL 191 CO 0.02 0.30 0.10 -0.31 0.00 0.00 0.00 175.10 175.21 1a0r s TYR 192 N 1.35 2.62 -0.30 5.22 1.51 0.87 -0.45 117.35 128.17 1a0r s TYR 192 Ca 0.01 -0.46 -0.14 0.00 -1.01 0.00 0.00 57.07 55.46 1a0r s TYR 192 Cb -0.15 -1.68 0.17 0.00 -0.11 0.00 0.00 41.96 40.19 1a0r s TYR 192 CO -0.10 0.35 0.98 0.21 -1.11 0.00 0.00 175.55 175.88 1a0r s LYS 193 N -3.81 0.30 -1.37 -0.62 2.20 -0.27 -0.53 119.74 115.64 1a0r s LYS 193 Ca 0.37 0.72 -0.06 0.00 -0.36 0.00 0.00 55.97 56.64 1a0r s LYS 193 Cb 0.00 0.43 0.03 0.00 -1.51 0.00 0.00 37.83 36.78 1a0r s LYS 193 CO 0.21 -0.13 0.96 0.41 -0.36 0.00 0.00 175.35 176.45 1a0r n GLY 194 N 5.04 -0.43 3.78 5.54 0.00 -1.14 -1.20 105.19 116.78 1a0r n GLY 194 Ca -0.09 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1a0r n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a0r n GLY 195 N -1.64 1.90 3.79 -0.02 0.00 -1.25 -4.97 105.19 103.00 1a0r n GLY 195 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 1a0r n GLY 195 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a0r s GLU 196 N 0.00 4.22 -0.53 1.61 2.02 -0.34 -5.03 118.70 120.64 1a0r s GLU 196 Ca 0.00 0.69 -0.22 0.00 0.02 0.00 0.00 54.97 55.46 1a0r s GLU 196 Cb 0.00 -3.28 0.05 0.00 0.10 0.00 0.00 34.13 31.00 1a0r s GLU 196 CO 0.00 0.54 0.84 -1.17 0.02 0.00 0.00 175.26 175.49 1a0r s LEU 197 N -0.76 4.38 -0.05 1.80 2.96 -1.26 -1.11 118.68 124.64 1a0r s LEU 197 Ca 0.29 -0.52 -0.25 0.00 -0.22 0.00 0.00 54.13 53.43 1a0r s LEU 197 Cb -0.19 -2.71 -0.20 0.00 0.50 0.00 0.00 46.19 43.59 1a0r s LEU 197 CO 0.18 -1.11 1.06 -0.07 -1.32 0.00 0.00 176.35 175.09 1a0r h LEU 198 N 10.54 -0.06 -7.38 -0.68 3.38 -1.09 -3.48 115.31 116.54 1a0r h LEU 198 Ca -0.27 -0.53 -0.11 0.00 0.09 0.00 0.00 57.88 57.07 1a0r h LEU 198 Cb 1.08 0.02 -0.20 0.00 0.09 0.00 0.00 40.66 41.64 1a0r h LEU 198 CO 1.04 0.53 -0.17 -0.44 0.09 0.00 0.00 178.44 179.50 1a0r s SER 199 N -5.71 -0.32 -0.26 -0.43 0.01 -1.09 -5.02 113.70 100.88 1a0r s SER 199 Ca -0.15 0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1a0r s SER 199 Cb 0.00 0.42 0.08 0.00 0.21 0.00 0.00 66.02 66.73 1a0r s SER 199 CO 0.62 -0.45 0.02 0.21 0.41 0.00 0.00 173.24 174.05 1a0r s ASN 200 N -1.12 3.87 -0.29 2.44 2.47 -1.26 -0.88 114.94 120.17 1a0r s ASN 200 Ca -0.12 -1.39 -0.12 0.00 0.42 0.00 0.00 52.86 51.66 1a0r s ASN 200 Cb -0.04 -1.05 -0.04 0.00 -1.45 0.00 0.00 41.25 38.67 1a0r s ASN 200 CO 0.05 -0.32 0.22 -0.36 -3.72 0.00 0.00 177.10 172.97 1a0r s PHE 201 N 1.47 3.22 -0.11 0.43 0.08 -0.22 -4.97 117.98 117.88 1a0r s PHE 201 Ca 0.02 0.09 -0.17 0.00 0.12 0.00 0.00 56.93 56.99 1a0r s PHE 201 Cb -0.18 -2.42 -0.05 0.00 -0.57 0.00 0.00 43.02 39.81 1a0r s PHE 201 CO -0.12 -0.20 0.43 0.42 -0.10 0.00 0.00 175.22 175.64 1a0r s ILE 202 N 1.79 5.19 -1.28 0.64 1.01 -1.26 -1.14 121.20 126.14 1a0r s ILE 202 Ca 0.08 0.85 -0.05 0.00 0.00 0.00 0.00 60.65 61.52 1a0r s ILE 202 Cb -0.16 -3.76 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1a0r s ILE 202 CO 0.11 0.38 0.66 -1.20 0.00 0.00 0.00 174.94 174.89 1a0r n SER 203 N 3.36 -2.25 -0.29 3.58 7.64 -0.06 -4.86 113.62 120.74 1a0r n SER 203 Ca -0.09 -0.91 0.11 0.00 1.01 0.00 0.00 58.87 58.98 1a0r n SER 203 Cb 0.52 -3.69 0.27 0.00 -1.01 0.00 0.00 64.21 60.29 1a0r n SER 203 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1a0r h VAL 204 N -1.82 0.51 -0.22 0.44 2.07 -1.32 -0.86 116.25 115.05 1a0r h VAL 204 Ca -0.63 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 66.79 1a0r h VAL 204 Cb 1.36 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1a0r h VAL 204 CO 0.55 0.07 0.15 0.71 0.02 0.00 0.00 177.57 179.07 1a0r h THR 205 N 0.39 0.98 0.00 2.57 1.35 -1.89 -0.99 112.91 115.31 1a0r h THR 205 Ca 0.52 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 66.32 1a0r h THR 205 Cb 0.94 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1a0r h THR 205 CO -0.51 0.03 0.00 -0.62 -0.25 0.00 0.00 175.52 174.17 1a0r n GLU 206 N -4.50 0.10 -0.70 4.72 1.02 -0.33 -1.23 120.64 119.72 1a0r n GLU 206 Ca 0.01 0.46 -0.01 0.00 -0.02 0.00 0.00 57.16 57.61 1a0r n GLU 206 Cb 0.18 -1.73 0.23 0.00 -0.02 0.00 0.00 31.44 30.09 1a0r n GLU 206 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1a0r n GLN 207 N -1.92 2.39 -4.36 3.49 6.02 -0.38 -4.98 117.38 117.65 1a0r n GLN 207 Ca 0.01 -3.03 -0.19 0.00 -0.01 0.00 0.00 57.00 53.78 1a0r n GLN 207 Cb 0.12 -1.88 -0.10 0.00 1.02 0.00 0.00 30.24 29.40 1a0r n GLN 207 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1a0r s LEU 208 N -3.07 1.74 0.62 1.08 1.43 -0.37 -5.06 118.68 115.06 1a0r s LEU 208 Ca 0.45 -1.49 -0.18 0.00 -1.03 0.00 0.00 54.13 51.88 1a0r s LEU 208 Cb 0.39 0.05 -0.02 0.00 0.03 0.00 0.00 46.19 46.64 1a0r s LEU 208 CO 0.05 -0.81 1.19 0.00 0.23 0.00 0.00 176.35 177.01 1a0r s ALA 209 N -3.59 2.47 0.31 4.21 0.00 -1.26 -4.90 121.76 119.00 1a0r s ALA 209 Ca 0.35 0.91 0.07 0.00 0.00 0.00 0.00 51.96 53.29 1a0r s ALA 209 Cb 0.06 -3.43 0.81 0.00 0.00 0.00 0.00 23.12 20.56 1a0r s ALA 209 CO 0.16 -1.28 1.72 0.93 0.00 0.00 0.00 175.76 177.28 1a0r h GLU 210 N 0.58 0.49 -3.12 0.00 5.08 -1.99 -3.09 114.58 112.53 1a0r h GLU 210 Ca -0.49 -0.03 -0.61 0.00 -1.00 0.00 0.00 59.36 57.22 1a0r h GLU 210 Cb 1.29 -0.11 -0.40 0.00 0.50 0.00 0.00 28.75 30.03 1a0r h GLU 210 CO 0.54 0.33 -0.73 -1.21 -1.00 0.00 0.00 179.01 176.94 1a0r s GLU 211 N -5.83 1.32 0.49 2.33 2.02 -1.26 -5.09 118.70 112.68 1a0r s GLU 211 Ca -0.11 -1.99 0.08 0.00 0.02 0.00 0.00 54.97 52.97 1a0r s GLU 211 Cb 0.26 -2.44 0.04 0.00 0.10 0.00 0.00 34.13 32.10 1a0r s GLU 211 CO 0.79 -1.13 0.68 -0.59 0.02 0.00 0.00 175.26 175.02 1a0r s PHE 212 N 0.41 2.30 0.24 1.61 -0.71 -1.17 -5.13 117.98 115.53 1a0r s PHE 212 Ca 0.17 -0.47 0.04 0.00 -1.04 0.00 0.00 56.93 55.63 1a0r s PHE 212 Cb -0.24 -2.38 -0.02 0.00 -1.21 0.00 0.00 43.02 39.18 1a0r s PHE 212 CO -0.02 -0.75 0.23 1.19 -1.34 0.00 0.00 175.22 174.53 1a0r n PHE 213 N -2.06 -0.68 -0.25 3.49 3.72 -1.26 -5.01 117.46 115.40 1a0r n PHE 213 Ca 0.11 -1.98 0.05 0.00 -0.05 0.00 0.00 57.45 55.58 1a0r n PHE 213 Cb 0.60 0.25 0.16 0.00 -0.94 0.00 0.00 39.48 39.55 1a0r n PHE 213 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1a0r h THR 214 N 1.77 0.40 -0.54 4.37 2.02 -1.93 -0.04 112.91 118.96 1a0r h THR 214 Ca -0.17 -0.05 0.09 0.00 0.77 0.00 0.00 66.41 67.05 1a0r h THR 214 Cb 0.87 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 1a0r h THR 214 CO 0.25 0.03 0.37 1.23 0.37 0.00 0.00 175.52 177.77 1a0r h GLY 215 N 0.15 0.48 0.82 2.16 0.00 -1.96 -1.49 103.07 103.22 1a0r h GLY 215 Ca 0.41 -0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.54 1a0r h GLY 215 CO -0.61 0.09 -0.10 -0.55 0.00 0.00 0.00 176.54 175.37 1a0r h ASP 216 N 0.35 0.46 -0.63 0.19 5.19 -1.39 -0.38 116.42 120.20 1a0r h ASP 216 Ca 0.25 -0.41 -0.06 0.00 -0.62 0.00 0.00 57.03 56.19 1a0r h ASP 216 Cb 0.52 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 39.88 1a0r h ASP 216 CO -0.06 0.76 0.18 0.58 -3.12 0.00 0.00 179.24 177.58 1a0r h VAL 217 N 0.15 1.25 0.19 -1.35 2.07 -1.38 -0.97 116.25 116.20 1a0r h VAL 217 Ca 0.05 -0.88 0.01 0.00 0.82 0.00 0.00 66.70 66.70 1a0r h VAL 217 Cb 0.59 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1a0r h VAL 217 CO 0.03 0.34 -0.20 -0.08 0.02 0.00 0.00 177.57 177.67 1a0r h GLU 218 N 0.97 -0.42 -0.33 1.57 4.81 -1.08 -0.71 114.58 119.39 1a0r h GLU 218 Ca 0.21 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 1a0r h GLU 218 Cb 0.31 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 1a0r h GLU 218 CO -0.00 -0.28 0.14 0.77 -0.73 0.00 0.00 179.01 178.91 1a0r h SER 219 N -0.43 0.18 0.12 1.04 0.02 -0.76 0.09 113.55 113.80 1a0r h SER 219 Ca 0.00 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1a0r h SER 219 Cb 0.41 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1a0r h SER 219 CO -0.06 0.14 -0.25 0.15 -1.14 0.00 0.00 176.83 175.68 1a0r h PHE 220 N 0.30 -0.66 -0.16 3.45 3.57 -0.92 -0.84 116.94 121.68 1a0r h PHE 220 Ca 0.14 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 1a0r h PHE 220 Cb 0.09 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 1a0r h PHE 220 CO -0.12 -0.35 -0.12 -0.07 -2.23 0.00 0.00 178.31 175.42 1a0r h LEU 221 N -0.45 0.24 -0.88 0.59 3.38 -0.93 -2.27 115.31 114.98 1a0r h LEU 221 Ca 0.03 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1a0r h LEU 221 Cb 0.47 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1a0r h LEU 221 CO -0.14 0.39 -0.30 0.78 0.09 0.00 0.00 178.44 179.26 1a0r h ASN 222 N 0.24 0.48 0.00 -0.43 -0.26 -0.41 -1.34 115.58 113.86 1a0r h ASN 222 Ca 0.05 -0.18 0.00 0.00 -0.56 0.00 0.00 56.30 55.61 1a0r h ASN 222 Cb 0.37 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 1a0r h ASN 222 CO 0.02 0.77 0.00 -0.62 -1.06 0.00 0.00 177.43 176.54 1a0r n GLU 223 N -4.09 0.73 0.00 0.81 1.02 -0.37 -1.74 120.64 117.00 1a0r n GLU 223 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1a0r n GLU 223 Cb 0.44 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 1a0r n GLU 223 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1a0r n TYR 224 N -0.74 0.00 -2.17 -0.32 4.01 -0.85 -5.00 117.16 112.08 1a0r n TYR 224 Ca 0.08 -0.03 -0.19 0.00 -0.16 0.00 0.00 57.90 57.61 1a0r n TYR 224 Cb 0.04 -0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.04 1a0r n TYR 224 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1a0r n GLY 225 N -0.03 0.10 0.03 2.72 0.00 -0.71 -4.89 105.19 102.41 1a0r n GLY 225 Ca 0.00 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1a0r n GLY 225 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1a0r n LEU 226 N -2.54 0.62 -4.54 0.99 4.77 -0.56 -4.86 117.00 110.88 1a0r n LEU 226 Ca -0.21 0.03 -0.34 0.00 -0.03 0.00 0.00 56.01 55.46 1a0r n LEU 226 Cb 0.65 -0.16 -0.12 0.00 -2.33 0.00 0.00 43.42 41.47 1a0r n LEU 226 CO 0.26 0.05 -0.37 -0.76 -1.33 0.00 0.00 177.39 175.25 1a0r s LEU 227 N -3.70 3.20 0.00 2.23 1.43 -1.25 -5.00 118.68 115.59 1a0r s LEU 227 Ca 0.07 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.09 1a0r s LEU 227 Cb 0.15 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.64 1a0r s LEU 227 CO 0.75 0.26 0.00 -2.65 0.23 0.00 0.00 176.35 174.95 1a0r n PRO 228 N 2.89 -0.43 -2.95 1.29 -0.02 -1.26 -4.92 135.00 129.61 1a0r n PRO 228 Ca -0.18 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.12 1a0r n PRO 228 Cb 0.53 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.02 1a0r n PRO 228 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1a0r s GLU 229 N -2.21 2.78 0.00 -0.52 2.02 -1.26 -5.11 118.70 114.41 1a0r s GLU 229 Ca 0.00 -1.12 0.26 0.00 0.02 0.00 0.00 54.97 54.13 1a0r s GLU 229 Cb 0.00 -2.70 0.62 0.00 0.10 0.00 0.00 34.13 32.15 1a0r s GLU 229 CO 0.00 -0.35 1.50 1.63 0.02 0.00 0.00 175.26 178.06