#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b47 n PRO 48 N 0.00 0.85 -2.18 0.58 -0.05 -1.26 -5.00 135.00 127.94 1b47 n PRO 48 Ca 0.00 0.33 -0.28 0.00 -0.05 0.00 0.00 63.50 63.50 1b47 n PRO 48 Cb 0.00 -2.10 0.04 0.00 -0.05 0.00 0.00 33.50 31.39 1b47 n PRO 48 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 175.50 175.65 1b47 s GLY 49 N -1.23 1.62 0.45 0.55 0.00 -1.26 -4.93 107.32 102.52 1b47 s GLY 49 Ca 0.75 -0.58 -0.24 0.00 0.00 0.00 0.00 44.72 44.65 1b47 s GLY 49 CO 0.48 -0.26 1.08 2.41 0.00 0.00 0.00 173.10 176.82 1b47 n THR 50 N -2.79 2.70 -3.02 0.90 -1.04 -1.26 -4.86 114.28 104.92 1b47 n THR 50 Ca 0.06 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.15 1b47 n THR 50 Cb 0.58 -1.28 -0.06 0.00 -1.82 0.00 0.00 70.33 67.75 1b47 n THR 50 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1b47 s VAL 51 N -1.29 4.89 0.44 12.58 1.01 0.05 -4.97 120.40 133.10 1b47 s VAL 51 Ca 0.65 1.15 0.06 0.00 0.00 0.00 0.00 61.98 63.84 1b47 s VAL 51 Cb -0.52 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 31.76 1b47 s VAL 51 CO 0.55 -0.12 0.09 1.51 0.00 0.00 0.00 175.10 177.13 1b47 s ASP 52 N 1.54 4.16 0.00 3.32 1.47 -1.26 -4.37 116.67 121.54 1b47 s ASP 52 Ca 0.29 -1.32 0.19 0.00 1.18 0.00 0.00 52.55 52.90 1b47 s ASP 52 Cb -0.15 -0.18 1.00 0.00 -0.34 0.00 0.00 42.92 43.25 1b47 s ASP 52 CO 0.10 -0.61 1.60 0.29 0.68 0.00 0.00 175.17 177.23 1b47 n LYS 53 N -1.17 0.32 0.00 2.11 5.02 -1.26 -0.48 118.16 122.70 1b47 n LYS 53 Ca -0.06 0.09 -0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1b47 n LYS 53 Cb 0.66 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.06 1b47 n LYS 53 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1b47 n LYS 54 N -1.25 0.64 -0.10 1.97 4.81 -1.26 -1.03 118.16 121.93 1b47 n LYS 54 Ca 0.10 0.11 -0.02 0.00 -0.87 0.00 0.00 58.31 57.63 1b47 n LYS 54 Cb 0.14 -1.71 0.22 0.00 0.02 0.00 0.00 35.03 33.70 1b47 n LYS 54 CO 0.00 0.00 0.00 1.98 1.17 0.00 0.00 177.40 180.55 1b47 h MET 55 N 0.00 0.76 -0.23 1.64 4.05 -1.15 -2.72 114.93 117.28 1b47 h MET 55 Ca -0.21 -0.16 -0.20 0.00 -0.28 0.00 0.00 59.70 58.86 1b47 h MET 55 Cb 1.62 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.31 1b47 h MET 55 CO 0.04 0.70 -0.62 -0.39 0.23 0.00 0.00 176.91 176.86 1b47 h VAL 56 N 0.73 1.28 -0.74 -5.77 -1.51 -1.26 -0.32 116.25 108.66 1b47 h VAL 56 Ca 0.16 -1.82 -0.04 0.00 -1.23 0.00 0.00 66.70 63.77 1b47 h VAL 56 Cb 0.30 1.76 -0.03 0.00 -2.13 0.00 0.00 31.29 31.18 1b47 h VAL 56 CO 0.00 0.59 0.29 -0.33 -1.23 0.00 0.00 177.57 176.89 1b47 h GLU 57 N 0.60 1.10 -0.73 5.19 4.39 -1.18 -1.02 114.58 122.93 1b47 h GLU 57 Ca -0.01 -0.20 0.04 0.00 0.34 0.00 0.00 59.36 59.53 1b47 h GLU 57 Cb 1.23 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 29.65 1b47 h GLU 57 CO 0.13 0.91 0.45 -0.22 -1.16 0.00 0.00 179.01 179.12 1b47 h LYS 58 N 1.06 0.82 -0.64 2.33 3.64 -1.18 -2.41 116.57 120.19 1b47 h LYS 58 Ca 0.24 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.56 1b47 h LYS 58 Cb 0.22 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 1b47 h LYS 58 CO -0.02 0.55 0.33 0.00 -2.27 0.00 0.00 179.45 178.03 1b47 h TRP 60 N 0.87 1.19 0.00 0.00 6.55 -1.14 -0.07 115.95 123.36 1b47 h TRP 60 Ca 0.22 0.03 -0.07 0.00 0.95 0.00 0.00 58.89 60.02 1b47 h TRP 60 Cb 0.08 -0.39 -0.01 0.00 -0.86 0.00 0.00 29.16 27.98 1b47 h TRP 60 CO -0.00 0.62 -0.32 -0.22 -1.05 0.00 0.00 178.44 177.46 1b47 h LYS 61 N 1.17 0.00 0.02 0.49 3.64 -1.29 0.24 116.57 120.84 1b47 h LYS 61 Ca 0.43 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.70 1b47 h LYS 61 Cb 0.16 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1b47 h LYS 61 CO -0.17 0.32 -0.42 -0.07 -2.27 0.00 0.00 179.45 176.85 1b47 h LEU 62 N 0.00 0.34 -0.49 5.20 -0.00 -0.80 -2.87 115.31 116.68 1b47 h LEU 62 Ca -0.00 -0.81 0.08 0.00 -0.00 0.00 0.00 57.88 57.14 1b47 h LEU 62 Cb 0.61 -0.10 -0.06 0.00 -0.00 0.00 0.00 40.66 41.11 1b47 h LEU 62 CO 0.04 1.11 0.13 0.24 -0.00 0.00 0.00 178.44 179.96 1b47 h MET 63 N -0.39 0.27 -0.52 1.13 2.86 -0.88 -1.31 114.93 116.09 1b47 h MET 63 Ca -0.06 -0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.67 1b47 h MET 63 Cb 1.19 -0.06 -0.11 0.00 0.06 0.00 0.00 31.60 32.68 1b47 h MET 63 CO 0.08 0.18 -0.22 -0.44 1.06 0.00 0.00 176.91 177.57 1b47 h ASP 64 N 0.28 -0.78 -0.58 1.22 3.32 -0.59 -0.72 116.42 118.57 1b47 h ASP 64 Ca 0.24 0.19 0.05 0.00 0.02 0.00 0.00 57.03 57.53 1b47 h ASP 64 Cb 0.30 0.43 -0.05 0.00 0.22 0.00 0.00 39.33 40.23 1b47 h ASP 64 CO -0.29 -0.25 0.31 0.50 -1.72 0.00 0.00 179.24 177.80 1b47 h LYS 65 N -0.10 0.58 -0.45 3.56 3.64 -1.14 -1.29 116.57 121.37 1b47 h LYS 65 Ca 0.24 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 1b47 h LYS 65 Cb 0.48 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.12 1b47 h LYS 65 CO -0.59 0.38 0.15 0.28 -2.27 0.00 0.00 179.45 177.40 1b47 h VAL 66 N 0.59 0.84 -0.28 2.00 2.07 -0.39 0.24 116.25 121.34 1b47 h VAL 66 Ca 0.26 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.69 1b47 h VAL 66 Cb 0.15 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1b47 h VAL 66 CO -0.17 0.06 0.14 0.58 0.02 0.00 0.00 177.57 178.20 1b47 h VAL 67 N 0.31 1.00 -0.82 2.57 2.07 -0.90 -1.48 116.25 119.00 1b47 h VAL 67 Ca 0.21 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.66 1b47 h VAL 67 Cb 0.22 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 1b47 h VAL 67 CO -0.23 0.05 0.52 0.03 0.02 0.00 0.00 177.57 177.97 1b47 h ARG 68 N 0.30 0.99 -0.19 1.57 3.08 -0.57 0.83 114.38 120.39 1b47 h ARG 68 Ca 0.11 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.14 1b47 h ARG 68 Cb 0.03 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 1b47 h ARG 68 CO -0.07 0.65 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.40 1b47 h LEU 69 N 1.02 -0.10 -0.02 3.04 3.38 -0.29 -2.72 115.31 119.61 1b47 h LEU 69 Ca 0.33 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1b47 h LEU 69 Cb 0.01 0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1b47 h LEU 69 CO -0.11 -0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.39 1b47 n GLN 71 N -2.13 0.33 -1.97 0.00 6.02 0.26 -4.81 117.38 115.08 1b47 n GLN 71 Ca 0.06 0.08 -0.42 0.00 -0.01 0.00 0.00 57.00 56.71 1b47 n GLN 71 Cb 0.41 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.14 1b47 n GLN 71 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1b47 s ASN 72 N -2.51 6.61 0.49 1.08 3.84 -1.07 -4.88 114.94 118.50 1b47 s ASN 72 Ca 0.21 2.68 0.17 0.00 0.21 0.00 0.00 52.86 56.13 1b47 s ASN 72 Cb 0.14 -2.62 1.20 0.00 -0.55 0.00 0.00 41.25 39.42 1b47 s ASN 72 CO 0.31 -0.76 2.08 -0.65 -2.79 0.00 0.00 177.10 175.29 1b47 h PRO 73 N 5.45 0.00 0.00 0.43 0.11 -1.92 -1.36 132.00 134.71 1b47 h PRO 73 Ca -0.45 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 1b47 h PRO 73 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1b47 h PRO 73 CO 0.81 0.09 -0.39 0.87 -0.21 0.00 0.00 178.00 179.17 1b47 h LYS 74 N 0.00 0.00 0.12 1.05 1.57 -1.98 -2.53 116.57 114.81 1b47 h LYS 74 Ca -0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1b47 h LYS 74 Cb 0.16 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 1b47 h LYS 74 CO 0.01 0.39 -0.47 -0.07 -0.57 0.00 0.00 179.45 178.74 1b47 h LEU 75 N 0.00 -1.40 -1.69 2.94 3.38 -1.56 -3.45 115.31 113.53 1b47 h LEU 75 Ca -0.00 0.15 -0.18 0.00 0.09 0.00 0.00 57.88 57.93 1b47 h LEU 75 Cb 0.93 0.52 0.09 0.00 0.09 0.00 0.00 40.66 42.29 1b47 h LEU 75 CO 0.05 -0.53 -0.41 0.00 0.09 0.00 0.00 178.44 177.65 1b47 n ALA 76 N -2.88 -1.04 -2.02 1.53 0.00 -0.95 -4.86 120.51 110.29 1b47 n ALA 76 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 1b47 n ALA 76 Cb 0.40 -1.76 -0.03 0.00 0.00 0.00 0.00 19.45 18.06 1b47 n ALA 76 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1b47 s LEU 77 N -4.35 3.95 0.64 0.00 2.96 -1.26 -4.99 118.68 115.62 1b47 s LEU 77 Ca 0.04 1.80 -0.18 0.00 -0.22 0.00 0.00 54.13 55.58 1b47 s LEU 77 Cb -0.02 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.13 1b47 s LEU 77 CO 0.39 -1.26 1.25 -1.59 -1.32 0.00 0.00 176.35 173.82 1b47 s LYS 78 N 4.72 2.66 0.00 1.98 -2.85 -1.26 -4.95 119.74 120.04 1b47 s LYS 78 Ca 0.75 1.93 0.10 0.00 -1.00 0.00 0.00 55.97 57.76 1b47 s LYS 78 Cb -0.28 -1.88 0.33 0.00 -2.06 0.00 0.00 37.83 33.94 1b47 s LYS 78 CO 0.31 -1.48 1.26 0.09 0.10 0.00 0.00 175.35 175.63 1b47 n ASN 79 N -1.89 1.52 -4.88 0.03 5.03 -1.26 -4.93 115.26 108.88 1b47 n ASN 79 Ca 0.15 -1.95 -0.30 0.00 0.87 0.00 0.00 54.58 53.34 1b47 n ASN 79 Cb 0.49 -0.18 -0.03 0.00 -1.02 0.00 0.00 39.78 39.04 1b47 n ASN 79 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1b47 s SER 80 N -1.08 6.53 0.44 6.41 1.04 -1.26 -4.75 113.70 121.04 1b47 s SER 80 Ca 0.21 1.09 -0.24 0.00 0.48 0.00 0.00 55.95 57.49 1b47 s SER 80 Cb 0.11 -2.30 -0.08 0.00 0.10 0.00 0.00 66.02 63.85 1b47 s SER 80 CO 0.15 -0.36 1.18 -2.16 0.98 0.00 0.00 173.24 173.03 1b47 s PRO 81 N -3.73 3.84 0.27 4.02 0.04 -1.26 -3.38 135.00 134.80 1b47 s PRO 81 Ca 0.50 1.82 -0.29 0.00 0.04 0.00 0.00 61.00 63.07 1b47 s PRO 81 Cb -0.10 -2.50 -0.09 0.00 0.04 0.00 0.00 34.50 31.84 1b47 s PRO 81 CO 0.30 -0.49 1.09 -1.25 0.04 0.00 0.00 177.00 176.69 1b47 s PRO 82 N -2.56 4.65 -0.28 0.56 0.04 -1.26 -4.86 135.00 131.29 1b47 s PRO 82 Ca 0.61 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1b47 s PRO 82 Cb -0.30 -3.20 0.05 0.00 0.04 0.00 0.00 34.50 31.10 1b47 s PRO 82 CO 0.37 0.22 -0.06 -0.47 0.04 0.00 0.00 177.00 177.10 1b47 s TYR 83 N -1.12 3.25 0.37 0.56 5.04 -1.22 -4.80 117.35 119.43 1b47 s TYR 83 Ca 0.45 -2.06 0.17 0.00 -2.44 0.00 0.00 57.07 53.18 1b47 s TYR 83 Cb -0.32 -2.02 0.92 0.00 0.35 0.00 0.00 41.96 40.89 1b47 s TYR 83 CO 0.40 -0.84 1.89 0.97 -1.34 0.00 0.00 175.55 176.64 1b47 h ILE 84 N 6.58 1.04 0.00 3.14 2.10 -1.90 0.03 117.51 128.51 1b47 h ILE 84 Ca -0.21 -1.05 0.00 0.00 1.08 0.00 0.00 64.86 64.68 1b47 h ILE 84 Cb 1.05 1.59 0.00 0.00 -1.09 0.00 0.00 36.82 38.38 1b47 h ILE 84 CO 0.50 0.28 0.00 0.18 -1.08 0.00 0.00 178.15 178.04 1b47 n LEU 85 N -3.95 0.37 -0.04 2.19 4.77 -1.26 -2.33 117.00 116.75 1b47 n LEU 85 Ca -0.02 0.57 -0.20 0.00 -0.03 0.00 0.00 56.01 56.34 1b47 n LEU 85 Cb 0.36 -0.50 -0.13 0.00 -2.33 0.00 0.00 43.42 40.81 1b47 n LEU 85 CO 0.36 -0.33 -0.99 0.47 -1.33 0.00 0.00 177.39 175.58 1b47 n ASP 86 N -1.89 2.00 -0.26 -1.43 8.00 -0.08 -4.46 116.55 118.43 1b47 n ASP 86 Ca 0.04 0.10 -0.06 0.00 0.71 0.00 0.00 54.79 55.57 1b47 n ASP 86 Cb 0.25 -0.65 0.07 0.00 -0.02 0.00 0.00 41.12 40.77 1b47 n ASP 86 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1b47 h LEU 87 N 0.04 1.06 -0.04 0.64 3.38 -1.16 0.29 115.31 119.52 1b47 h LEU 87 Ca -0.47 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.29 1b47 h LEU 87 Cb 1.99 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.46 1b47 h LEU 87 CO 0.03 0.99 0.01 -0.07 0.09 0.00 0.00 178.44 179.49 1b47 h LEU 88 N 1.08 0.07 -0.92 1.67 4.07 -1.72 0.54 115.31 120.10 1b47 h LEU 88 Ca 0.23 -0.26 0.07 0.00 0.08 0.00 0.00 57.88 58.01 1b47 h LEU 88 Cb 0.32 -0.02 -0.07 0.00 1.08 0.00 0.00 40.66 41.97 1b47 h LEU 88 CO -0.01 0.31 0.58 -0.65 -1.08 0.00 0.00 178.44 177.59 1b47 h PRO 89 N -0.18 0.99 -0.10 1.13 0.11 -1.75 -0.17 132.00 132.04 1b47 h PRO 89 Ca 0.01 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.98 1b47 h PRO 89 Cb 0.27 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 1b47 h PRO 89 CO 0.00 0.66 -0.33 -0.44 -0.21 0.00 0.00 178.00 177.67 1b47 h ASP 90 N 1.02 0.20 -0.36 -2.05 5.19 -0.75 -0.53 116.42 119.15 1b47 h ASP 90 Ca 0.41 -0.07 -0.09 0.00 -0.62 0.00 0.00 57.03 56.66 1b47 h ASP 90 Cb 0.22 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 1b47 h ASP 90 CO -0.19 0.53 -0.13 0.74 -3.12 0.00 0.00 179.24 177.08 1b47 h THR 91 N 0.18 1.28 -0.41 0.35 2.02 0.60 -1.68 112.91 115.25 1b47 h THR 91 Ca 0.02 -1.23 0.03 0.00 0.77 0.00 0.00 66.41 66.01 1b47 h THR 91 Cb 0.68 1.31 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 1b47 h THR 91 CO 0.05 0.40 0.21 0.22 0.37 0.00 0.00 175.52 176.77 1b47 h TYR 92 N 0.52 0.38 -0.43 3.16 3.20 -0.79 0.15 116.97 123.17 1b47 h TYR 92 Ca 0.09 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.04 1b47 h TYR 92 Cb 0.65 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.76 1b47 h TYR 92 CO 0.05 0.20 0.11 0.37 -1.64 0.00 0.00 178.16 177.25 1b47 h GLN 93 N 0.42 0.24 -0.33 1.82 4.15 -0.99 0.13 115.11 120.55 1b47 h GLN 93 Ca 0.17 -0.01 -0.15 0.00 0.77 0.00 0.00 58.65 59.43 1b47 h GLN 93 Cb 0.08 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 27.71 1b47 h GLN 93 CO -0.12 0.16 -0.37 1.25 -1.93 0.00 0.00 178.83 177.81 1b47 h HIS 94 N 0.25 1.01 -0.61 3.99 2.76 -1.09 0.55 115.15 122.00 1b47 h HIS 94 Ca 0.21 -0.32 -0.02 0.00 -2.20 0.00 0.00 60.37 58.04 1b47 h HIS 94 Cb 0.24 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 28.96 1b47 h HIS 94 CO -0.19 1.11 0.29 -0.07 -1.30 0.00 0.00 177.93 177.78 1b47 h LEU 95 N 0.62 0.78 -0.88 0.26 3.38 -0.49 -1.08 115.31 117.89 1b47 h LEU 95 Ca 0.05 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 1b47 h LEU 95 Cb 0.96 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1b47 h LEU 95 CO 0.09 0.66 -0.48 0.03 0.09 0.00 0.00 178.44 178.83 1b47 h ARG 96 N 0.87 0.17 -0.10 1.13 2.47 -0.10 -1.50 114.38 117.33 1b47 h ARG 96 Ca 0.21 -0.09 -0.00 0.00 -1.26 0.00 0.00 59.98 58.84 1b47 h ARG 96 Cb 0.09 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1b47 h ARG 96 CO -0.03 0.62 0.05 1.15 0.56 0.00 0.00 179.97 182.32 1b47 h THR 97 N 0.14 1.11 -0.22 2.04 2.02 -0.16 0.32 112.91 118.16 1b47 h THR 97 Ca 0.01 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 66.90 1b47 h THR 97 Cb 0.91 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 1b47 h THR 97 CO 0.07 0.10 -0.03 0.40 0.37 0.00 0.00 175.52 176.43 1b47 h ILE 98 N 0.03 0.81 -0.66 3.11 2.04 -1.00 -1.27 117.51 120.57 1b47 h ILE 98 Ca 0.03 -0.01 0.10 0.00 1.00 0.00 0.00 64.86 65.98 1b47 h ILE 98 Cb 0.12 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 36.90 1b47 h ILE 98 CO -0.00 0.01 0.28 -0.07 0.00 0.00 0.00 178.15 178.36 1b47 h LEU 99 N 0.03 0.32 -0.45 1.44 -0.00 -0.92 -1.95 115.31 113.78 1b47 h LEU 99 Ca 0.10 0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 58.05 1b47 h LEU 99 Cb 0.15 0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 40.82 1b47 h LEU 99 CO -0.20 0.18 0.26 -1.28 -0.00 0.00 0.00 178.44 177.40 1b47 h SER 100 N 0.48 0.54 0.09 -0.43 0.87 -0.65 -2.13 113.55 112.32 1b47 h SER 100 Ca 0.33 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.82 1b47 h SER 100 Cb 0.40 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1b47 h SER 100 CO -0.30 0.45 -0.05 0.03 -0.53 0.00 0.00 176.83 176.43 1b47 h ARG 101 N 0.59 0.00 -0.61 2.24 2.47 -0.59 -2.77 114.38 115.72 1b47 h ARG 101 Ca 0.16 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.74 1b47 h ARG 101 Cb 0.01 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.25 1b47 h ARG 101 CO -0.03 0.05 0.16 0.66 0.56 0.00 0.00 179.97 181.36 1b47 n TYR 102 N -4.05 2.06 -0.22 3.04 4.02 -0.80 -4.75 117.16 116.47 1b47 n TYR 102 Ca -0.03 -1.10 0.05 0.00 -0.01 0.00 0.00 57.90 56.81 1b47 n TYR 102 Cb 0.13 -0.59 0.31 0.00 -0.02 0.00 0.00 39.34 39.17 1b47 n TYR 102 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1b47 h GLU 103 N 2.64 0.84 -0.01 -0.72 5.08 -1.16 0.20 114.58 121.45 1b47 h GLU 103 Ca 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1b47 h GLU 103 Cb 2.09 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 31.15 1b47 h GLU 103 CO 0.59 0.56 0.00 0.41 -1.00 0.00 0.00 179.01 179.57 1b47 n GLY 104 N -1.43 -0.80 2.61 -3.84 0.00 -1.26 -4.51 105.19 95.97 1b47 n GLY 104 Ca 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 1b47 n GLY 104 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1b47 n LYS 105 N -0.72 1.39 -0.03 1.61 2.85 0.68 -4.94 118.16 119.00 1b47 n LYS 105 Ca 0.20 -2.09 -0.06 0.00 -1.05 0.00 0.00 58.31 55.31 1b47 n LYS 105 Cb 0.14 -0.35 0.14 0.00 -0.65 0.00 0.00 35.03 34.31 1b47 n LYS 105 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 177.40 177.87 1b47 h MET 106 N 1.56 0.62 -0.73 -1.58 2.86 -1.76 -1.32 114.93 114.57 1b47 h MET 106 Ca -0.33 -0.25 0.06 0.00 -2.06 0.00 0.00 59.70 57.12 1b47 h MET 106 Cb 1.31 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.90 1b47 h MET 106 CO -0.05 0.82 0.48 0.93 1.06 0.00 0.00 176.91 180.15 1b47 h GLU 107 N 0.54 0.75 -0.10 1.72 3.07 -1.92 0.30 114.58 118.94 1b47 h GLU 107 Ca 0.07 -0.04 -0.17 0.00 -0.50 0.00 0.00 59.36 58.72 1b47 h GLU 107 Cb 0.73 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 28.48 1b47 h GLU 107 CO 0.06 0.49 -0.59 0.00 -1.40 0.00 0.00 179.01 177.57 1b47 h THR 108 N 0.77 1.35 -0.34 1.13 1.03 -1.72 -3.22 112.91 111.90 1b47 h THR 108 Ca 0.32 -1.89 0.02 0.00 -0.01 0.00 0.00 66.41 64.84 1b47 h THR 108 Cb 0.25 2.18 -0.03 0.00 -1.07 0.00 0.00 68.15 69.49 1b47 h THR 108 CO -0.11 0.58 0.19 0.25 -0.01 0.00 0.00 175.52 176.42 1b47 h LEU 109 N 0.21 0.29 -0.55 0.00 5.85 -1.13 -3.30 115.31 116.67 1b47 h LEU 109 Ca -0.04 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1b47 h LEU 109 Cb 1.24 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1b47 h LEU 109 CO 0.12 0.21 0.00 1.23 -0.34 0.00 0.00 178.44 179.67 1b47 h GLY 110 N 0.38 0.00 -0.28 3.75 0.00 -0.42 -2.34 103.07 104.16 1b47 h GLY 110 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1b47 h GLY 110 CO -0.08 0.00 -0.34 -1.84 0.00 0.00 0.00 176.54 174.28 1b47 n GLU 111 N -2.65 1.01 -2.06 4.80 -0.00 -1.22 -0.77 120.64 119.75 1b47 n GLU 111 Ca 0.03 -0.71 -0.42 0.00 -0.00 0.00 0.00 57.16 56.06 1b47 n GLU 111 Cb 0.37 -1.49 -0.03 0.00 -0.00 0.00 0.00 31.44 30.29 1b47 n GLU 111 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1b47 s ASN 112 N -2.48 6.72 0.08 -1.84 3.84 -0.88 -4.91 114.94 115.46 1b47 s ASN 112 Ca 0.22 2.36 -0.25 0.00 0.21 0.00 0.00 52.86 55.39 1b47 s ASN 112 Cb 0.19 -2.57 -0.16 0.00 -0.55 0.00 0.00 41.25 38.16 1b47 s ASN 112 CO 0.54 -0.79 1.70 -0.08 -2.79 0.00 0.00 177.10 175.68 1b47 h GLU 113 N 7.75 -0.22 -0.89 0.43 4.81 -1.92 0.23 114.58 124.77 1b47 h GLU 113 Ca -0.41 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 58.88 1b47 h GLU 113 Cb 1.20 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.57 1b47 h GLU 113 CO 0.91 -0.13 0.59 -0.92 -0.73 0.00 0.00 179.01 178.72 1b47 h TYR 114 N -0.24 1.06 0.00 0.92 5.03 -1.96 0.85 116.97 122.64 1b47 h TYR 114 Ca -0.02 0.03 -0.07 0.00 2.58 0.00 0.00 58.73 61.25 1b47 h TYR 114 Cb 0.18 -0.35 -0.01 0.00 1.55 0.00 0.00 36.73 38.10 1b47 h TYR 114 CO -0.06 0.60 -0.32 0.35 -1.32 0.00 0.00 178.16 177.40 1b47 h PHE 115 N 1.08 0.00 0.24 -3.82 3.57 -1.65 0.22 116.94 116.59 1b47 h PHE 115 Ca 0.37 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 61.53 1b47 h PHE 115 Cb 0.08 0.00 0.04 0.00 2.79 0.00 0.00 35.95 38.86 1b47 h PHE 115 CO -0.00 0.32 -1.45 0.00 -2.23 0.00 0.00 178.31 174.95 1b47 h ARG 116 N 0.00 0.56 -0.49 1.11 3.08 0.11 -1.63 114.38 117.12 1b47 h ARG 116 Ca -0.00 -0.92 -0.02 0.00 0.07 0.00 0.00 59.98 59.11 1b47 h ARG 116 Cb 0.86 0.34 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 1b47 h ARG 116 CO 0.04 1.44 0.23 0.28 -1.07 0.00 0.00 179.97 180.90 1b47 h VAL 117 N 0.16 1.19 0.26 2.04 2.07 -0.72 -1.47 116.25 119.78 1b47 h VAL 117 Ca -0.25 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1b47 h VAL 117 Cb 2.14 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 1b47 h VAL 117 CO 0.27 0.21 -0.13 0.15 0.02 0.00 0.00 177.57 178.10 1b47 h PHE 118 N 0.64 -0.32 -0.51 1.57 3.57 -0.42 -1.59 116.94 119.87 1b47 h PHE 118 Ca 0.17 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.58 1b47 h PHE 118 Cb 0.12 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1b47 h PHE 118 CO -0.01 -0.11 -0.01 0.52 -2.23 0.00 0.00 178.31 176.47 1b47 h MET 119 N -0.48 0.87 -0.36 1.11 2.86 -1.28 -0.26 114.93 117.39 1b47 h MET 119 Ca -0.04 -0.25 0.05 0.00 -2.06 0.00 0.00 59.70 57.40 1b47 h MET 119 Cb 0.36 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 1b47 h MET 119 CO 0.06 0.87 0.10 1.49 1.06 0.00 0.00 176.91 180.49 1b47 h GLU 120 N 0.81 0.22 -0.20 1.72 4.81 -1.22 -2.26 114.58 118.46 1b47 h GLU 120 Ca 0.15 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 1b47 h GLU 120 Cb 0.49 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1b47 h GLU 120 CO 0.02 0.15 -0.25 -0.97 -0.73 0.00 0.00 179.01 177.23 1b47 h ASN 121 N 0.23 0.36 -0.33 1.04 -1.24 -0.95 -1.44 115.58 113.26 1b47 h ASN 121 Ca 0.17 -0.12 -0.01 0.00 0.71 0.00 0.00 56.30 57.05 1b47 h ASN 121 Cb 0.18 -0.10 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 1b47 h ASN 121 CO -0.20 0.62 0.17 0.25 -1.29 0.00 0.00 177.43 176.98 1b47 h LEU 122 N 0.33 0.42 -0.93 0.34 5.85 -0.82 0.80 115.31 121.30 1b47 h LEU 122 Ca 0.05 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.68 1b47 h LEU 122 Cb 0.63 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 1b47 h LEU 122 CO 0.04 0.41 0.62 0.24 -0.34 0.00 0.00 178.44 179.41 1b47 h MET 123 N 0.40 1.21 -0.27 1.25 2.86 -1.30 -0.19 114.93 118.89 1b47 h MET 123 Ca 0.11 -0.07 -0.16 0.00 -2.06 0.00 0.00 59.70 57.53 1b47 h MET 123 Cb 0.09 -0.27 -0.00 0.00 0.06 0.00 0.00 31.60 31.48 1b47 h MET 123 CO -0.02 0.80 -0.44 0.87 1.06 0.00 0.00 176.91 179.19 1b47 h LYS 124 N 1.25 0.78 -0.12 1.72 1.57 -0.84 -1.58 116.57 119.35 1b47 h LYS 124 Ca 0.35 -0.47 -0.12 0.00 -1.87 0.00 0.00 60.65 58.54 1b47 h LYS 124 Cb -0.13 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1b47 h LYS 124 CO -0.08 1.10 -0.45 0.87 -0.57 0.00 0.00 179.45 180.32 1b47 h LYS 125 N 0.53 0.28 -0.15 3.15 1.79 -0.56 -1.59 116.57 120.01 1b47 h LYS 125 Ca 0.02 -0.15 -0.08 0.00 -2.18 0.00 0.00 60.65 58.26 1b47 h LYS 125 Cb 1.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.69 1b47 h LYS 125 CO 0.10 0.68 -0.24 1.15 -1.08 0.00 0.00 179.45 180.06 1b47 h THR 126 N 0.23 1.35 -0.98 -0.16 2.02 -0.95 -1.45 112.91 112.99 1b47 h THR 126 Ca 0.02 -1.46 0.04 0.00 0.77 0.00 0.00 66.41 65.78 1b47 h THR 126 Cb 0.88 1.93 -0.06 0.00 -1.74 0.00 0.00 68.15 69.17 1b47 h THR 126 CO 0.07 0.43 0.64 0.11 0.37 0.00 0.00 175.52 177.15 1b47 h LYS 127 N 0.06 1.18 -0.46 6.66 1.57 -1.19 -1.73 116.57 122.65 1b47 h LYS 127 Ca 0.01 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1b47 h LYS 127 Cb 0.81 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 1b47 h LYS 127 CO 0.05 0.78 0.24 0.37 -0.57 0.00 0.00 179.45 180.32 1b47 h GLN 128 N 1.21 0.64 -0.59 3.15 4.15 -1.27 -1.79 115.11 120.62 1b47 h GLN 128 Ca 0.40 -0.08 0.06 0.00 0.77 0.00 0.00 58.65 59.80 1b47 h GLN 128 Cb 0.05 -0.12 -0.06 0.00 0.21 0.00 0.00 27.48 27.56 1b47 h GLN 128 CO -0.13 0.53 0.29 1.15 -1.93 0.00 0.00 178.83 178.74 1b47 h THR 129 N 0.60 0.91 -0.54 2.39 2.02 -0.92 -1.28 112.91 116.09 1b47 h THR 129 Ca 0.16 -0.18 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 1b47 h THR 129 Cb 0.08 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1b47 h THR 129 CO -0.02 0.10 0.13 0.40 0.37 0.00 0.00 175.52 176.49 1b47 h ILE 130 N 0.54 1.23 0.00 3.11 2.04 -1.09 -2.71 117.51 120.62 1b47 h ILE 130 Ca 0.27 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1b47 h ILE 130 Cb 0.22 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1b47 h ILE 130 CO -0.21 0.30 -0.30 0.77 0.00 0.00 0.00 178.15 178.72 1b47 h SER 131 N 0.80 0.00 -0.48 1.72 4.64 -1.17 0.98 113.55 120.03 1b47 h SER 131 Ca 0.17 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1b47 h SER 131 Cb 0.30 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 1b47 h SER 131 CO -0.00 0.01 0.32 0.25 -0.87 0.00 0.00 176.83 176.53 1b47 h LEU 132 N 0.00 0.55 -0.05 5.97 5.85 -0.93 -1.24 115.31 125.47 1b47 h LEU 132 Ca 0.00 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1b47 h LEU 132 Cb 0.97 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 1b47 h LEU 132 CO 0.00 0.40 -0.01 -0.26 -0.34 0.00 0.00 178.44 178.23 1b47 h PHE 133 N 0.65 0.10 -0.72 1.25 -1.00 -0.99 -1.48 116.94 114.76 1b47 h PHE 133 Ca 0.18 -0.02 0.10 0.00 2.81 0.00 0.00 57.97 61.03 1b47 h PHE 133 Cb -0.08 -0.03 -0.07 0.00 3.61 0.00 0.00 35.95 39.39 1b47 h PHE 133 CO -0.04 0.40 0.35 -0.22 -1.61 0.00 0.00 178.31 177.19 1b47 h LYS 134 N -0.23 0.58 0.11 1.51 3.64 -0.30 -2.21 116.57 119.67 1b47 h LYS 134 Ca 0.01 -0.03 -0.28 0.00 -1.27 0.00 0.00 60.65 59.08 1b47 h LYS 134 Cb 0.37 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1b47 h LYS 134 CO 0.00 0.38 -1.30 0.93 -2.27 0.00 0.00 179.45 177.20 1b47 h GLU 135 N 0.60 0.23 -0.05 1.90 5.08 -1.32 -3.34 114.58 117.68 1b47 h GLU 135 Ca 0.35 -0.40 -0.16 0.00 -1.00 0.00 0.00 59.36 58.15 1b47 h GLU 135 Cb 0.38 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1b47 h GLU 135 CO -0.28 1.16 -0.68 0.78 -1.00 0.00 0.00 179.01 178.99 1b47 h GLY 136 N 1.79 0.24 0.00 -3.84 0.00 -1.13 -3.48 103.07 96.65 1b47 h GLY 136 Ca -0.15 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1b47 h GLY 136 CO 0.18 0.30 0.00 0.28 0.00 0.00 0.00 176.54 177.30 1b47 n LYS 137 N -3.81 0.00 -0.19 4.80 5.02 -0.84 -1.57 118.16 121.57 1b47 n LYS 137 Ca -0.03 0.00 0.30 0.00 -2.02 0.00 0.00 58.31 56.56 1b47 n LYS 137 Cb 0.67 0.00 0.73 0.00 -0.02 0.00 0.00 35.03 36.41 1b47 n LYS 137 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1b47 h GLU 138 N 0.00 0.00 0.00 1.97 5.08 -1.92 -1.04 114.58 118.67 1b47 h GLU 138 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1b47 h GLU 138 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1b47 h GLU 138 CO 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 179.01 177.96 1b47 h ARG 139 N 0.00 0.00 -0.08 2.33 3.08 -1.69 -2.69 114.38 115.34 1b47 h ARG 139 Ca 0.44 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.51 1b47 h ARG 139 Cb 1.83 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.88 1b47 h ARG 139 CO -0.00 0.05 0.18 0.52 -1.07 0.00 0.00 179.97 179.65 1b47 h MET 140 N 0.00 0.00 -0.06 0.04 2.86 -1.33 -1.64 114.93 114.81 1b47 h MET 140 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1b47 h MET 140 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1b47 h MET 140 CO 0.01 0.00 0.00 0.66 1.06 0.00 0.00 176.91 178.64 1b47 n TYR 141 N -3.33 0.06 -3.57 -0.22 4.01 -1.01 -4.72 117.16 108.37 1b47 n TYR 141 Ca -0.01 -0.03 -0.41 0.00 -0.16 0.00 0.00 57.90 57.30 1b47 n TYR 141 Cb 0.26 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.19 1b47 n TYR 141 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1b47 s GLU 142 N -1.94 3.09 0.37 -0.72 2.02 -0.62 -4.94 118.70 115.96 1b47 s GLU 142 Ca 0.36 -0.91 0.09 0.00 0.02 0.00 0.00 54.97 54.53 1b47 s GLU 142 Cb 0.20 -3.76 0.82 0.00 0.10 0.00 0.00 34.13 31.50 1b47 s GLU 142 CO 0.32 -0.60 1.92 1.49 0.02 0.00 0.00 175.26 178.41 1b47 h GLU 143 N 8.46 0.66 -0.65 1.61 4.81 -1.85 0.20 114.58 127.82 1b47 h GLU 143 Ca -0.28 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1b47 h GLU 143 Cb 1.13 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.36 1b47 h GLU 143 CO 0.66 0.43 0.00 -1.71 -0.73 0.00 0.00 179.01 177.67 1b47 n ASN 144 N -4.51 3.80 -4.57 1.04 2.85 -1.26 -4.61 115.26 108.00 1b47 n ASN 144 Ca 0.14 -1.99 -0.31 0.00 -0.11 0.00 0.00 54.58 52.31 1b47 n ASN 144 Cb 0.37 -0.43 0.18 0.00 1.24 0.00 0.00 39.78 41.14 1b47 n ASN 144 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1b47 n SER 145 N 1.54 -0.63 -0.05 1.20 3.41 0.71 -4.80 113.62 115.00 1b47 n SER 145 Ca 0.23 0.25 -0.15 0.00 -0.26 0.00 0.00 58.87 58.94 1b47 n SER 145 Cb 0.60 -1.36 -0.07 0.00 -0.26 0.00 0.00 64.21 63.12 1b47 n SER 145 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1b47 h GLN 146 N -2.03 0.61 -0.77 4.33 5.75 -1.91 -1.22 115.11 119.87 1b47 h GLN 146 Ca -0.48 -0.42 0.18 0.00 -0.15 0.00 0.00 58.65 57.78 1b47 h GLN 146 Cb 1.29 0.06 -0.12 0.00 1.07 0.00 0.00 27.48 29.78 1b47 h GLN 146 CO 0.41 1.04 0.13 -1.35 -2.65 0.00 0.00 178.83 176.41 1b47 h PRO 147 N 0.28 0.19 0.00 -2.39 0.11 -1.92 0.26 132.00 128.52 1b47 h PRO 147 Ca -0.00 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 1b47 h PRO 147 Cb 1.05 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1b47 h PRO 147 CO 0.10 0.12 -0.20 -0.09 -0.21 0.00 0.00 178.00 177.72 1b47 h ARG 148 N 0.19 0.00 0.00 1.05 9.65 -1.72 -0.59 114.38 122.96 1b47 h ARG 148 Ca 0.44 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 59.13 1b47 h ARG 148 Cb 0.79 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.35 1b47 h ARG 148 CO -0.59 0.20 -0.91 0.00 2.80 0.00 0.00 179.97 181.46 1b47 h ARG 149 N 0.00 0.00 -0.47 0.20 3.08 0.17 -2.75 114.38 114.61 1b47 h ARG 149 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 1b47 h ARG 149 Cb 0.78 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 1b47 h ARG 149 CO 0.03 0.91 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.92 1b47 h ASN 150 N 0.00 0.75 -0.65 7.04 -0.26 -0.20 -1.54 115.58 120.70 1b47 h ASN 150 Ca -0.01 -0.18 0.00 0.00 -0.56 0.00 0.00 56.30 55.55 1b47 h ASN 150 Cb 1.69 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 38.72 1b47 h ASN 150 CO 0.12 0.82 0.42 0.25 -1.06 0.00 0.00 177.43 177.98 1b47 h LEU 151 N 0.72 0.77 -0.09 1.61 5.85 -1.03 -0.84 115.31 122.31 1b47 h LEU 151 Ca 0.14 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1b47 h LEU 151 Cb 0.46 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1b47 h LEU 151 CO 0.02 0.58 -0.29 0.74 -0.34 0.00 0.00 178.44 179.15 1b47 h THR 152 N 0.90 1.40 -0.67 1.05 2.02 -1.34 0.07 112.91 116.35 1b47 h THR 152 Ca 0.24 -1.64 0.12 0.00 0.77 0.00 0.00 66.41 65.90 1b47 h THR 152 Cb -0.07 2.21 -0.08 0.00 -1.74 0.00 0.00 68.15 68.47 1b47 h THR 152 CO -0.05 0.47 0.24 0.11 0.37 0.00 0.00 175.52 176.67 1b47 h LYS 153 N -0.10 0.39 0.00 6.66 1.57 -1.10 -0.50 116.57 123.49 1b47 h LYS 153 Ca -0.01 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1b47 h LYS 153 Cb 0.91 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 1b47 h LYS 153 CO 0.06 0.26 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.06 1b47 h LEU 154 N 0.40 0.00 -0.12 2.94 3.38 -0.59 -2.56 115.31 118.76 1b47 h LEU 154 Ca 0.35 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.18 1b47 h LEU 154 Cb 0.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1b47 h LEU 154 CO -0.36 0.07 -0.49 0.28 0.09 0.00 0.00 178.44 178.02 1b47 h SER 155 N 0.00 0.64 -0.21 -0.43 0.02 0.51 -1.36 113.55 112.72 1b47 h SER 155 Ca -0.00 -0.63 0.05 0.00 -0.84 0.00 0.00 61.79 60.37 1b47 h SER 155 Cb 0.63 -0.19 -0.07 0.00 0.14 0.00 0.00 62.40 62.91 1b47 h SER 155 CO 0.01 1.16 -0.46 -0.07 -1.14 0.00 0.00 176.83 176.33 1b47 h LEU 156 N 0.16 -1.48 -0.49 5.07 -0.00 -0.90 -1.96 115.31 115.70 1b47 h LEU 156 Ca -0.03 0.20 0.10 0.00 -0.00 0.00 0.00 57.88 58.15 1b47 h LEU 156 Cb 1.13 0.61 -0.10 0.00 -0.00 0.00 0.00 40.66 42.29 1b47 h LEU 156 CO 0.10 -0.43 -0.24 0.40 -0.00 0.00 0.00 178.44 178.27 1b47 h ILE 157 N -0.48 0.32 -1.00 1.22 2.04 -1.18 -0.56 117.51 117.87 1b47 h ILE 157 Ca 0.08 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.11 1b47 h ILE 157 Cb 0.63 0.32 -0.10 0.00 -0.74 0.00 0.00 36.82 36.93 1b47 h ILE 157 CO -0.46 0.00 0.62 -0.26 0.00 0.00 0.00 178.15 178.05 1b47 h PHE 158 N -0.13 1.09 -0.16 1.37 0.04 -1.14 0.23 116.94 118.24 1b47 h PHE 158 Ca 0.23 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.03 1b47 h PHE 158 Cb 0.49 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1b47 h PHE 158 CO -0.51 0.30 0.09 1.03 -0.60 0.00 0.00 178.31 178.62 1b47 h SER 159 N 0.83 0.20 -0.92 2.17 0.87 -0.75 -1.51 113.55 114.45 1b47 h SER 159 Ca 0.55 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 61.04 1b47 h SER 159 Cb 0.78 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.64 1b47 h SER 159 CO -0.34 0.21 0.56 0.45 -0.53 0.00 0.00 176.83 177.18 1b47 h HIS 160 N 0.17 1.21 -0.48 2.24 3.86 -0.70 -1.69 115.15 119.75 1b47 h HIS 160 Ca 0.06 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.23 1b47 h HIS 160 Cb 0.05 -0.40 -0.02 0.00 1.06 0.00 0.00 27.41 28.10 1b47 h HIS 160 CO -0.04 0.80 0.16 0.52 0.86 0.00 0.00 177.93 180.22 1b47 h MET 161 N 1.27 0.75 -0.45 2.45 2.07 -0.09 -1.27 114.93 119.66 1b47 h MET 161 Ca 0.33 -0.16 -0.04 0.00 -2.07 0.00 0.00 59.70 57.77 1b47 h MET 161 Cb -0.06 -0.11 -0.02 0.00 -1.87 0.00 0.00 31.60 29.54 1b47 h MET 161 CO -0.06 0.70 0.12 1.25 1.07 0.00 0.00 176.91 179.99 1b47 h LEU 162 N 0.65 0.67 -1.47 1.22 5.85 -0.90 -0.85 115.31 120.48 1b47 h LEU 162 Ca 0.16 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.73 1b47 h LEU 162 Cb 0.26 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1b47 h LEU 162 CO -0.01 0.71 0.43 0.00 -0.34 0.00 0.00 178.44 179.24 1b47 h ALA 163 N 0.98 1.79 -0.06 1.25 0.00 -1.20 -0.43 119.26 121.60 1b47 h ALA 163 Ca 0.14 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1b47 h ALA 163 Cb 0.30 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1b47 h ALA 163 CO -0.00 0.10 -0.14 1.49 0.00 0.00 0.00 179.25 180.70 1b47 h GLU 164 N 0.64 0.19 -0.81 0.00 4.81 -1.04 -1.12 114.58 117.25 1b47 h GLU 164 Ca 0.29 -0.13 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1b47 h GLU 164 Cb 0.31 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 1b47 h GLU 164 CO -0.09 0.73 0.52 1.25 -0.73 0.00 0.00 179.01 180.70 1b47 h LEU 165 N -0.33 0.88 -1.17 1.64 5.85 -0.57 -0.96 115.31 120.65 1b47 h LEU 165 Ca -0.00 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1b47 h LEU 165 Cb 0.74 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1b47 h LEU 165 CO 0.03 0.62 0.12 0.11 -0.34 0.00 0.00 178.44 178.98 1b47 h LYS 166 N 1.04 0.70 0.00 1.25 1.57 -1.06 0.30 116.57 120.37 1b47 h LYS 166 Ca 0.31 -0.13 -0.09 0.00 -1.87 0.00 0.00 60.65 58.87 1b47 h LYS 166 Cb -0.05 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1b47 h LYS 166 CO -0.09 0.63 -0.45 0.78 -0.57 0.00 0.00 179.45 179.75 1b47 h GLY 167 N 0.88 0.00 1.19 3.86 0.00 -0.71 -2.00 103.07 106.28 1b47 h GLY 167 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.21 1b47 h GLY 167 CO -0.00 0.00 -1.56 -2.22 0.00 0.00 0.00 176.54 172.75 1b47 h ILE 168 N 0.00 1.03 -1.94 2.60 1.08 -1.05 -3.38 117.51 115.85 1b47 h ILE 168 Ca -0.00 -2.85 -0.54 0.00 -0.39 0.00 0.00 64.86 61.07 1b47 h ILE 168 Cb 0.95 2.51 -0.41 0.00 -3.07 0.00 0.00 36.82 36.80 1b47 h ILE 168 CO 0.06 0.59 -0.84 0.49 -0.69 0.00 0.00 178.15 177.76 1b47 n PHE 169 N -3.11 2.79 -1.52 1.37 3.01 0.08 -0.91 117.46 119.16 1b47 n PHE 169 Ca -0.13 -3.66 -0.56 0.00 1.01 0.00 0.00 57.45 54.11 1b47 n PHE 169 Cb 1.03 -0.38 -0.08 0.00 -0.01 0.00 0.00 39.48 40.04 1b47 n PHE 169 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1b47 n PRO 170 N -0.16 0.84 -1.96 -1.08 -0.04 -0.76 -0.47 135.00 131.37 1b47 n PRO 170 Ca 0.29 0.27 -0.16 0.00 -0.04 0.00 0.00 63.50 63.86 1b47 n PRO 170 Cb 0.55 -2.09 -0.03 0.00 -0.04 0.00 0.00 33.50 31.88 1b47 n PRO 170 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1b47 n SER 171 N 7.45 -4.92 0.00 3.54 2.88 -1.26 -1.98 113.62 119.33 1b47 n SER 171 Ca 0.38 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 1b47 n SER 171 Cb 0.12 -3.96 0.00 0.00 -0.75 0.00 0.00 64.21 59.62 1b47 n SER 171 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1b47 n GLY 172 N -0.99 0.75 3.51 0.46 0.00 0.38 -4.88 105.19 104.41 1b47 n GLY 172 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1b47 n GLY 172 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b47 s LEU 173 N 0.00 2.83 -0.00 0.99 1.43 -0.84 -4.40 118.68 118.68 1b47 s LEU 173 Ca 0.00 -0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 52.52 1b47 s LEU 173 Cb 0.00 -1.63 -0.07 0.00 0.03 0.00 0.00 46.19 44.52 1b47 s LEU 173 CO 0.00 0.28 1.70 0.12 0.23 0.00 0.00 176.35 178.68 1b47 s PHE 174 N -0.91 2.02 -0.11 0.29 5.36 -1.26 -3.75 117.98 119.62 1b47 s PHE 174 Ca 0.15 0.14 0.14 0.00 -0.96 0.00 0.00 56.93 56.40 1b47 s PHE 174 Cb -0.11 -3.98 0.27 0.00 -0.34 0.00 0.00 43.02 38.87 1b47 s PHE 174 CO 0.05 -4.11 1.14 1.04 -1.46 0.00 0.00 175.22 171.88 1b47 n GLN 175 N 6.70 1.01 -0.26 10.12 1.13 -0.09 -4.90 117.38 131.08 1b47 n GLN 175 Ca 0.17 -2.39 -0.04 0.00 -1.94 0.00 0.00 57.00 52.80 1b47 n GLN 175 Cb 0.42 -1.23 0.11 0.00 0.11 0.00 0.00 30.24 29.65 1b47 n GLN 175 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1b47 h GLY 176 N 0.28 1.20 2.00 1.08 0.00 -1.88 -2.44 103.07 103.30 1b47 h GLY 176 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1b47 h GLY 176 CO 0.01 0.60 0.00 2.09 0.00 0.00 0.00 176.54 179.24 1b47 n ASP 177 N -4.29 0.55 -0.40 0.19 5.75 -1.26 -2.20 116.55 114.89 1b47 n ASP 177 Ca 0.07 0.64 0.07 0.00 -0.01 0.00 0.00 54.79 55.56 1b47 n ASP 177 Cb 0.17 -0.75 0.15 0.00 -1.03 0.00 0.00 41.12 39.66 1b47 n ASP 177 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1b47 n THR 178 N -2.11 1.72 -1.53 2.12 -2.24 -1.02 -4.82 114.28 106.41 1b47 n THR 178 Ca 0.02 -2.35 -0.37 0.00 -2.27 0.00 0.00 64.05 59.08 1b47 n THR 178 Cb 0.22 -0.09 0.05 0.00 -2.10 0.00 0.00 70.33 68.41 1b47 n THR 178 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1b47 n PHE 179 N -1.07 0.30 -3.53 4.78 7.35 -0.93 -4.95 117.46 119.41 1b47 n PHE 179 Ca 0.15 0.42 -0.42 0.00 -0.76 0.00 0.00 57.45 56.85 1b47 n PHE 179 Cb 0.70 -2.07 -0.10 0.00 0.35 0.00 0.00 39.48 38.36 1b47 n PHE 179 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1b47 s ARG 180 N -2.67 2.79 0.05 -4.13 3.52 -1.26 -5.04 118.95 112.21 1b47 s ARG 180 Ca 0.74 -1.30 -0.26 0.00 -0.13 0.00 0.00 55.73 54.77 1b47 s ARG 180 Cb -0.41 -3.88 -0.05 0.00 -1.56 0.00 0.00 34.95 29.05 1b47 s ARG 180 CO 0.49 -0.89 0.82 0.42 -0.81 0.00 0.00 175.30 175.33 1b47 s ILE 181 N 1.54 4.69 0.03 4.11 1.01 -1.26 -4.97 121.20 126.35 1b47 s ILE 181 Ca 0.03 1.75 -0.25 0.00 0.00 0.00 0.00 60.65 62.18 1b47 s ILE 181 Cb -0.22 -4.17 -0.17 0.00 0.01 0.00 0.00 42.46 37.90 1b47 s ILE 181 CO 0.05 0.34 1.44 0.74 0.00 0.00 0.00 174.94 177.51 1b47 h THR 182 N 4.15 1.02 -3.40 2.92 2.02 -1.96 -3.43 112.91 114.23 1b47 h THR 182 Ca -0.43 -0.55 -0.59 0.00 0.77 0.00 0.00 66.41 65.61 1b47 h THR 182 Cb 1.21 1.37 -0.09 0.00 -1.74 0.00 0.00 68.15 68.89 1b47 h THR 182 CO 0.71 0.13 -0.04 -0.54 0.37 0.00 0.00 175.52 176.16 1b47 s LYS 183 N -5.12 4.27 0.33 6.66 -0.14 -1.26 -4.93 119.74 119.55 1b47 s LYS 183 Ca -0.15 0.50 0.13 0.00 -1.36 0.00 0.00 55.97 55.09 1b47 s LYS 183 Cb 0.03 -3.51 0.55 0.00 -1.68 0.00 0.00 37.83 33.23 1b47 s LYS 183 CO 0.63 -0.04 1.72 0.00 -0.76 0.00 0.00 175.35 176.90 1b47 h ALA 184 N 7.14 1.13 -0.11 5.17 0.00 -1.99 0.24 119.26 130.84 1b47 h ALA 184 Ca -0.37 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.09 1b47 h ALA 184 Cb 1.16 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1b47 h ALA 184 CO 0.75 0.61 0.03 -0.44 0.00 0.00 0.00 179.25 180.20 1b47 h ASP 185 N 0.00 0.17 -0.49 0.00 3.32 -1.97 -0.02 116.42 117.44 1b47 h ASP 185 Ca -0.00 -0.23 0.08 0.00 0.02 0.00 0.00 57.03 56.90 1b47 h ASP 185 Cb 0.89 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 40.33 1b47 h ASP 185 CO 0.06 0.35 0.09 0.00 -1.72 0.00 0.00 179.24 178.03 1b47 h ALA 186 N 0.83 0.54 -0.59 3.45 0.00 -1.80 -1.75 119.26 119.93 1b47 h ALA 186 Ca 0.04 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.09 1b47 h ALA 186 Cb 0.25 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1b47 h ALA 186 CO 0.00 -0.31 0.34 0.00 0.00 0.00 0.00 179.25 179.28 1b47 h ALA 187 N 1.38 0.78 -0.39 0.00 0.00 0.08 -1.59 119.26 119.51 1b47 h ALA 187 Ca 0.24 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1b47 h ALA 187 Cb 0.33 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1b47 h ALA 187 CO -0.32 0.04 0.21 1.05 0.00 0.00 0.00 179.25 180.22 1b47 h GLU 188 N 0.65 0.54 -0.27 0.00 4.11 -0.60 -1.90 114.58 117.12 1b47 h GLU 188 Ca 0.25 -0.06 0.06 0.00 0.07 0.00 0.00 59.36 59.68 1b47 h GLU 188 Cb 0.10 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 1b47 h GLU 188 CO -0.14 0.44 -0.12 0.35 0.07 0.00 0.00 179.01 179.62 1b47 h PHE 189 N 0.50 -0.28 -0.78 2.06 3.57 -0.50 0.25 116.94 121.75 1b47 h PHE 189 Ca 0.14 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 1b47 h PHE 189 Cb 0.06 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 1b47 h PHE 189 CO -0.02 -0.18 0.48 2.35 -2.23 0.00 0.00 178.31 178.70 1b47 h TRP 190 N -0.08 1.03 -0.01 0.41 2.91 -1.27 0.06 115.95 119.00 1b47 h TRP 190 Ca 0.14 0.00 -0.10 0.00 1.13 0.00 0.00 58.89 60.06 1b47 h TRP 190 Cb 0.29 -0.34 -0.01 0.00 -0.51 0.00 0.00 29.16 28.59 1b47 h TRP 190 CO -0.31 0.68 -0.47 -0.09 -1.03 0.00 0.00 178.44 177.22 1b47 h ARG 191 N 1.07 0.03 0.02 2.65 2.43 -0.65 0.56 114.38 120.49 1b47 h ARG 191 Ca 0.28 -0.02 -0.26 0.00 -0.81 0.00 0.00 59.98 59.18 1b47 h ARG 191 Cb -0.05 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1b47 h ARG 191 CO -0.05 0.50 -1.02 0.87 -1.51 0.00 0.00 179.97 178.76 1b47 h LYS 192 N 0.02 0.66 0.04 0.20 1.57 0.85 -2.46 116.57 117.45 1b47 h LYS 192 Ca -0.00 -0.73 -0.00 0.00 -1.87 0.00 0.00 60.65 58.04 1b47 h LYS 192 Cb 0.85 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1b47 h LYS 192 CO 0.06 1.31 -0.02 0.00 -0.57 0.00 0.00 179.45 180.24 1b47 h ALA 193 N 0.37 -0.05 0.00 3.86 0.00 -0.90 -3.39 119.26 119.15 1b47 h ALA 193 Ca -0.13 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1b47 h ALA 193 Cb 1.68 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1b47 h ALA 193 CO 0.20 -0.27 0.00 1.19 0.00 0.00 0.00 179.25 180.37 1b47 n PHE 194 N -4.87 0.00 0.00 0.00 3.72 0.20 -5.09 117.46 111.42 1b47 n PHE 194 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 1b47 n PHE 194 Cb 0.26 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 1b47 n PHE 194 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b47 n GLY 195 N 0.17 3.51 1.01 1.37 0.00 -0.93 -2.32 105.19 108.01 1b47 n GLY 195 Ca 0.00 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1b47 n GLY 195 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b47 n GLU 196 N 10.85 2.34 -1.47 1.61 1.02 -1.26 -4.34 120.64 129.38 1b47 n GLU 196 Ca 0.00 -2.03 -0.43 0.00 -0.02 0.00 0.00 57.16 54.68 1b47 n GLU 196 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 1b47 n GLU 196 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1b47 n LYS 197 N 1.38 0.63 -0.03 3.49 5.02 -0.98 -4.19 118.16 123.47 1b47 n LYS 197 Ca 0.16 0.23 -0.10 0.00 -2.02 0.00 0.00 58.31 56.57 1b47 n LYS 197 Cb 0.59 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.96 1b47 n LYS 197 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1b47 n THR 198 N -0.62 1.60 -3.76 -0.18 -1.04 -1.26 -4.72 114.28 104.30 1b47 n THR 198 Ca 0.12 -0.79 -0.12 0.00 -2.04 0.00 0.00 64.05 61.21 1b47 n THR 198 Cb 0.37 -1.04 -0.12 0.00 -1.82 0.00 0.00 70.33 67.72 1b47 n THR 198 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1b47 s ILE 199 N -2.58 -0.01 0.02 12.58 2.07 -1.26 0.98 121.20 132.99 1b47 s ILE 199 Ca -0.07 0.05 0.02 0.00 -1.41 0.00 0.00 60.65 59.24 1b47 s ILE 199 Cb 0.08 -0.39 -0.02 0.00 0.13 0.00 0.00 42.46 42.26 1b47 s ILE 199 CO 0.82 0.02 -0.06 0.68 -1.91 0.00 0.00 174.94 174.49 1b47 s VAL 200 N 0.55 0.40 0.38 4.00 -7.23 -0.08 -4.93 120.40 113.48 1b47 s VAL 200 Ca -0.03 -0.76 -0.26 0.00 -1.81 0.00 0.00 61.98 59.11 1b47 s VAL 200 Cb -0.05 -0.44 -0.11 0.00 0.56 0.00 0.00 36.38 36.34 1b47 s VAL 200 CO -0.03 -0.25 1.22 -2.65 -0.31 0.00 0.00 175.10 173.08 1b47 n PRO 201 N 1.98 1.86 -0.31 4.82 -0.02 -1.26 0.98 135.00 143.04 1b47 n PRO 201 Ca -0.20 0.66 0.24 0.00 -2.02 0.00 0.00 63.50 62.18 1b47 n PRO 201 Cb 0.56 -2.27 0.53 0.00 -0.02 0.00 0.00 33.50 32.31 1b47 n PRO 201 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 1b47 h TRP 202 N 2.15 0.58 0.10 6.00 2.91 -1.51 -2.01 115.95 124.16 1b47 h TRP 202 Ca -0.46 0.02 -0.29 0.00 1.13 0.00 0.00 58.89 59.29 1b47 h TRP 202 Cb 1.30 -0.17 0.03 0.00 -0.51 0.00 0.00 29.16 29.81 1b47 h TRP 202 CO 0.48 0.06 -1.21 -0.22 -1.03 0.00 0.00 178.44 176.52 1b47 h LYS 203 N 0.35 0.64 -0.94 2.65 3.11 -1.88 -0.77 116.57 119.73 1b47 h LYS 203 Ca 0.58 -0.82 0.05 0.00 -2.81 0.00 0.00 60.65 57.65 1b47 h LYS 203 Cb 1.55 0.26 -0.06 0.00 -1.00 0.00 0.00 32.23 32.98 1b47 h LYS 203 CO -0.26 1.37 0.62 0.77 -2.81 0.00 0.00 179.45 179.14 1b47 h SER 204 N 0.30 1.00 0.03 4.20 0.02 -1.75 -1.90 113.55 115.45 1b47 h SER 204 Ca -0.18 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1b47 h SER 204 Cb 1.88 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 64.20 1b47 h SER 204 CO 0.23 0.66 -0.01 0.15 -1.14 0.00 0.00 176.83 176.72 1b47 h PHE 205 N 1.14 -0.03 -0.92 3.45 3.57 -1.37 -2.42 116.94 120.36 1b47 h PHE 205 Ca 0.39 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 62.01 1b47 h PHE 205 Cb 0.08 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 38.75 1b47 h PHE 205 CO -0.00 0.43 0.55 -0.09 -2.23 0.00 0.00 178.31 176.97 1b47 h ARG 206 N -0.50 0.84 -0.32 1.11 2.43 -1.01 -0.66 114.38 116.27 1b47 h ARG 206 Ca -0.00 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 1b47 h ARG 206 Cb 0.47 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.79 1b47 h ARG 206 CO 0.01 0.56 0.04 1.96 -1.51 0.00 0.00 179.97 181.02 1b47 h GLN 207 N 0.86 0.14 0.04 0.20 4.20 -1.26 -1.46 115.11 117.83 1b47 h GLN 207 Ca 0.46 -0.01 -0.18 0.00 0.06 0.00 0.00 58.65 58.99 1b47 h GLN 207 Cb 0.49 -0.03 0.02 0.00 0.30 0.00 0.00 27.48 28.26 1b47 h GLN 207 CO -0.28 0.09 -0.72 0.00 -0.67 0.00 0.00 178.83 177.26 1b47 h ALA 208 N 1.25 0.04 -0.43 3.87 0.00 -0.95 -3.04 119.26 120.00 1b47 h ALA 208 Ca 0.15 -0.62 0.09 0.00 0.00 0.00 0.00 54.91 54.53 1b47 h ALA 208 Cb 0.18 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.93 1b47 h ALA 208 CO -0.22 0.40 -0.19 1.25 0.00 0.00 0.00 179.25 180.49 1b47 h LEU 209 N -0.10 -0.65 -2.06 0.00 5.85 -1.16 -1.52 115.31 115.67 1b47 h LEU 209 Ca -0.10 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1b47 h LEU 209 Cb 1.45 0.36 -0.00 0.00 0.37 0.00 0.00 40.66 42.83 1b47 h LEU 209 CO 0.14 -0.22 -0.05 -0.74 -0.34 0.00 0.00 178.44 177.23 1b47 h HIS 210 N -0.10 0.00 0.00 1.25 2.76 -1.22 0.82 115.15 118.67 1b47 h HIS 210 Ca 0.21 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.35 1b47 h HIS 210 Cb 0.42 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.38 1b47 h HIS 210 CO -0.44 0.05 -0.14 0.93 -1.30 0.00 0.00 177.93 177.03 1b47 h GLU 211 N 0.00 0.00 0.00 5.26 3.07 -1.16 -3.13 114.58 118.63 1b47 h GLU 211 Ca -0.00 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.68 1b47 h GLU 211 Cb 0.10 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.97 1b47 h GLU 211 CO 0.01 0.14 -1.68 0.28 -1.40 0.00 0.00 179.01 176.36 1b47 n VAL 212 N -3.47 0.68 -3.48 3.13 0.31 -0.38 -4.91 118.33 110.21 1b47 n VAL 212 Ca -0.01 -0.35 -0.29 0.00 -0.01 0.00 0.00 64.34 63.68 1b47 n VAL 212 Cb 0.30 -0.83 -0.12 0.00 -0.91 0.00 0.00 33.84 32.28 1b47 n VAL 212 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1b47 s HIS 213 N -2.24 0.85 0.14 3.52 3.76 0.27 -5.10 115.29 116.50 1b47 s HIS 213 Ca -0.10 -1.72 -0.34 0.00 -0.15 0.00 0.00 55.06 52.76 1b47 s HIS 213 Cb 0.03 -1.00 -0.14 0.00 1.11 0.00 0.00 32.58 32.58 1b47 s HIS 213 CO 0.35 -0.82 1.60 -2.30 -0.85 0.00 0.00 174.74 172.72 1b47 n PRO 214 N 3.96 2.17 -3.11 8.40 -0.02 -1.19 -4.00 135.00 141.21 1b47 n PRO 214 Ca 0.12 0.79 -0.40 0.00 -2.02 0.00 0.00 63.50 61.98 1b47 n PRO 214 Cb 0.37 -2.56 -0.06 0.00 -0.02 0.00 0.00 33.50 31.23 1b47 n PRO 214 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1b47 s ILE 215 N 1.15 4.99 -2.11 4.25 1.01 -1.26 -4.98 121.20 124.25 1b47 s ILE 215 Ca 0.80 1.15 0.19 0.00 0.00 0.00 0.00 60.65 62.79 1b47 s ILE 215 Cb -0.67 -3.94 0.49 0.00 0.01 0.00 0.00 42.46 38.34 1b47 s ILE 215 CO 0.39 0.05 1.63 -1.54 0.00 0.00 0.00 174.94 175.46 1b47 n SER 216 N 5.51 0.68 0.00 3.58 3.41 -1.26 -4.87 113.62 120.67 1b47 n SER 216 Ca -0.01 -1.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 1b47 n SER 216 Cb 0.49 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1b47 n SER 216 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1b47 n SER 217 N -0.33 0.00 0.15 4.04 3.41 -1.26 -5.00 113.62 114.63 1b47 n SER 217 Ca 0.14 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1b47 n SER 217 Cb 0.17 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.33 1b47 n SER 217 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1b47 h GLY 218 N 0.00 0.00 0.78 5.00 0.00 -1.99 -1.37 103.07 105.50 1b47 h GLY 218 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1b47 h GLY 218 CO 0.00 0.00 -0.17 1.41 0.00 0.00 0.00 176.54 177.78 1b47 h LEU 219 N 0.00 -0.39 -0.32 3.11 3.38 -1.99 -2.66 115.31 116.43 1b47 h LEU 219 Ca -0.01 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 57.91 1b47 h LEU 219 Cb 1.02 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1b47 h LEU 219 CO 0.07 -0.11 -0.04 -0.08 0.09 0.00 0.00 178.44 178.37 1b47 h GLU 220 N -0.69 0.04 -0.82 1.13 4.81 -1.95 -1.59 114.58 115.52 1b47 h GLU 220 Ca -0.05 -0.00 0.19 0.00 -0.13 0.00 0.00 59.36 59.37 1b47 h GLU 220 Cb 0.48 -0.01 -0.12 0.00 0.63 0.00 0.00 28.75 29.73 1b47 h GLU 220 CO 0.08 0.03 0.25 0.00 -0.73 0.00 0.00 179.01 178.63 1b47 h ALA 221 N 1.30 1.16 0.00 2.92 0.00 -1.29 -0.07 119.26 123.28 1b47 h ALA 221 Ca 0.16 0.18 -0.18 0.00 0.00 0.00 0.00 54.91 55.07 1b47 h ALA 221 Cb 0.23 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1b47 h ALA 221 CO -0.30 -0.37 -0.82 0.52 0.00 0.00 0.00 179.25 178.28 1b47 h MET 222 N 0.29 0.07 -0.25 0.00 2.86 -1.36 -0.82 114.93 115.73 1b47 h MET 222 Ca 0.49 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.97 1b47 h MET 222 Cb 0.90 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 1b47 h MET 222 CO -0.55 0.85 -0.21 0.00 1.06 0.00 0.00 176.91 178.05 1b47 h ALA 223 N 1.12 1.18 -0.60 6.32 0.00 -0.69 -2.75 119.26 123.84 1b47 h ALA 223 Ca -0.02 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.52 1b47 h ALA 223 Cb 1.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1b47 h ALA 223 CO 0.11 0.52 0.14 1.25 0.00 0.00 0.00 179.25 181.28 1b47 h LEU 224 N 0.40 0.92 -0.72 0.00 6.46 -0.63 -2.95 115.31 118.79 1b47 h LEU 224 Ca 0.07 -0.24 0.04 0.00 -0.12 0.00 0.00 57.88 57.63 1b47 h LEU 224 Cb 0.60 -0.24 -0.05 0.00 -0.73 0.00 0.00 40.66 40.24 1b47 h LEU 224 CO 0.04 0.92 0.44 0.50 -0.62 0.00 0.00 178.44 179.72 1b47 h LYS 225 N 0.88 0.83 -0.10 1.25 3.64 -0.93 -0.05 116.57 122.10 1b47 h LYS 225 Ca 0.19 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.42 1b47 h LYS 225 Cb 0.36 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1b47 h LYS 225 CO 0.00 0.55 -0.40 0.66 -2.27 0.00 0.00 179.45 177.99 1b47 h SER 226 N 0.85 0.22 -0.26 4.20 4.64 -1.37 0.26 113.55 122.09 1b47 h SER 226 Ca 0.30 -0.09 -0.18 0.00 -0.47 0.00 0.00 61.79 61.36 1b47 h SER 226 Cb 0.07 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1b47 h SER 226 CO -0.13 0.60 -0.53 0.74 -0.87 0.00 0.00 176.83 176.65 1b47 h THR 227 N 0.18 1.29 0.09 2.95 2.02 -1.25 -3.36 112.91 114.82 1b47 h THR 227 Ca 0.02 -1.72 -0.33 0.00 0.77 0.00 0.00 66.41 65.15 1b47 h THR 227 Cb 0.79 1.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.90 1b47 h THR 227 CO 0.06 0.55 -1.78 0.40 0.37 0.00 0.00 175.52 175.12 1b47 h ILE 228 N 0.57 0.84 -1.74 3.11 2.04 -0.30 -3.43 117.51 118.59 1b47 h ILE 228 Ca 0.01 -2.57 -0.74 0.00 1.00 0.00 0.00 64.86 62.55 1b47 h ILE 228 Cb 1.14 2.56 -0.16 0.00 -0.74 0.00 0.00 36.82 39.61 1b47 h ILE 228 CO 0.12 0.76 1.71 -0.67 0.00 0.00 0.00 178.15 180.06 1b47 n ASP 229 N -3.35 5.13 -0.17 1.72 2.03 0.84 -4.81 116.55 117.95 1b47 n ASP 229 Ca -0.23 -3.03 -0.09 0.00 0.52 0.00 0.00 54.79 51.96 1b47 n ASP 229 Cb 1.05 -1.54 0.03 0.00 -0.72 0.00 0.00 41.12 39.94 1b47 n ASP 229 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1b47 h LEU 230 N 9.05 1.00 -0.06 -2.67 4.07 -1.85 -2.45 115.31 122.39 1b47 h LEU 230 Ca 0.36 -0.33 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1b47 h LEU 230 Cb 0.76 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1b47 h LEU 230 CO 1.43 1.11 0.00 0.35 -1.08 0.00 0.00 178.44 180.25 1b47 n THR 231 N -4.15 0.01 -4.09 0.22 -2.24 -1.26 -4.74 114.28 98.03 1b47 n THR 231 Ca 0.02 -0.02 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1b47 n THR 231 Cb 0.40 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 1b47 n THR 231 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b47 n ASN 233 N -2.86 2.44 -0.38 0.00 0.23 -1.26 -5.00 115.26 108.43 1b47 n ASN 233 Ca -0.19 -1.78 -0.05 0.00 -0.53 0.00 0.00 54.58 52.03 1b47 n ASN 233 Cb 0.62 -0.13 -0.02 0.00 -2.08 0.00 0.00 39.78 38.17 1b47 n ASN 233 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1b47 n ASP 234 N 0.44 -4.67 -4.41 0.53 8.00 -1.26 -4.99 116.55 110.20 1b47 n ASP 234 Ca 0.08 0.12 -0.21 0.00 0.71 0.00 0.00 54.79 55.49 1b47 n ASP 234 Cb 0.34 -2.60 -0.10 0.00 -0.02 0.00 0.00 41.12 38.74 1b47 n ASP 234 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1b47 s TYR 235 N -1.83 1.99 -0.26 1.24 1.51 -1.26 -1.37 117.35 117.38 1b47 s TYR 235 Ca 0.00 -0.50 0.02 0.00 -1.01 0.00 0.00 57.07 55.58 1b47 s TYR 235 Cb 0.00 -0.95 0.06 0.00 -0.11 0.00 0.00 41.96 40.96 1b47 s TYR 235 CO 0.00 0.49 -0.10 0.42 -1.11 0.00 0.00 175.55 175.25 1b47 s ILE 236 N -2.79 2.28 0.73 2.71 -1.09 0.27 -4.74 121.20 118.57 1b47 s ILE 236 Ca 0.27 -1.56 -0.11 0.00 -2.23 0.00 0.00 60.65 57.02 1b47 s ILE 236 Cb -0.01 -2.31 0.03 0.00 -1.58 0.00 0.00 42.46 38.58 1b47 s ILE 236 CO 0.11 -0.00 1.07 -0.94 -1.23 0.00 0.00 174.94 173.95 1b47 s SER 237 N 1.13 5.12 0.48 3.58 1.04 -1.26 -0.91 113.70 122.89 1b47 s SER 237 Ca -0.08 1.50 0.26 0.00 0.48 0.00 0.00 55.95 58.11 1b47 s SER 237 Cb -0.19 -2.33 1.32 0.00 0.10 0.00 0.00 66.02 64.91 1b47 s SER 237 CO -0.05 -1.59 1.85 1.62 0.98 0.00 0.00 173.24 176.04 1b47 h VAL 238 N -0.82 0.56 -0.04 5.02 3.04 0.33 -1.59 116.25 122.75 1b47 h VAL 238 Ca -0.45 -0.06 -0.13 0.00 -1.01 0.00 0.00 66.70 65.05 1b47 h VAL 238 Cb 1.23 0.36 0.01 0.00 -2.01 0.00 0.00 31.29 30.88 1b47 h VAL 238 CO 0.58 0.03 -0.47 0.15 -1.01 0.00 0.00 177.57 176.85 1b47 h PHE 239 N 0.18 0.55 -0.35 3.17 3.04 -1.93 -0.88 116.94 120.72 1b47 h PHE 239 Ca 0.49 -0.27 -0.03 0.00 3.98 0.00 0.00 57.97 62.14 1b47 h PHE 239 Cb 1.61 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 40.02 1b47 h PHE 239 CO -0.00 1.06 0.09 0.93 -2.02 0.00 0.00 178.31 178.36 1b47 h GLU 240 N -0.11 0.51 -0.13 1.11 5.08 -1.77 -1.93 114.58 117.34 1b47 h GLU 240 Ca -0.05 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.15 1b47 h GLU 240 Cb 1.16 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1b47 h GLU 240 CO 0.09 0.47 -0.25 0.35 -1.00 0.00 0.00 179.01 178.68 1b47 h PHE 241 N 0.50 0.51 -0.51 4.33 3.57 -1.06 -1.34 116.94 122.94 1b47 h PHE 241 Ca 0.12 -0.18 0.10 0.00 3.53 0.00 0.00 57.97 61.54 1b47 h PHE 241 Cb 0.20 -0.10 -0.10 0.00 2.79 0.00 0.00 35.95 38.74 1b47 h PHE 241 CO 0.01 0.87 -0.17 0.22 -2.23 0.00 0.00 178.31 177.00 1b47 h ASP 242 N 0.00 -0.61 -0.23 0.41 3.58 -1.22 0.07 116.42 118.43 1b47 h ASP 242 Ca 0.01 0.17 0.05 0.00 0.42 0.00 0.00 57.03 57.67 1b47 h ASP 242 Cb 0.83 0.37 -0.05 0.00 1.72 0.00 0.00 39.33 42.20 1b47 h ASP 242 CO 0.06 -0.21 -0.09 0.40 -2.88 0.00 0.00 179.24 176.52 1b47 h ILE 243 N -0.05 0.70 -0.39 2.25 2.04 -1.22 -2.49 117.51 118.35 1b47 h ILE 243 Ca 0.24 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.05 1b47 h ILE 243 Cb 0.43 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1b47 h ILE 243 CO -0.55 0.00 0.03 0.15 0.00 0.00 0.00 178.15 177.78 1b47 h PHE 244 N -0.05 0.72 0.00 1.37 3.57 -0.50 -2.71 116.94 119.35 1b47 h PHE 244 Ca 0.12 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1b47 h PHE 244 Cb 0.22 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.77 1b47 h PHE 244 CO -0.26 0.73 0.00 0.25 -2.23 0.00 0.00 178.31 176.80 1b47 n THR 245 N -4.49 0.83 -0.09 4.41 -2.24 -0.06 -2.18 114.28 110.47 1b47 n THR 245 Ca -0.01 0.19 -0.16 0.00 -2.27 0.00 0.00 64.05 61.80 1b47 n THR 245 Cb 0.26 -0.98 -0.11 0.00 -2.10 0.00 0.00 70.33 67.40 1b47 n THR 245 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1b47 h ARG 246 N 0.00 0.00 -0.83 -0.78 3.08 -1.26 -2.68 114.38 111.90 1b47 h ARG 246 Ca 0.00 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.21 1b47 h ARG 246 Cb 0.33 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.28 1b47 h ARG 246 CO 0.00 0.87 0.39 -0.07 -1.07 0.00 0.00 179.97 180.09 1b47 h LEU 247 N -1.00 0.41 -2.94 3.04 3.38 -1.19 -3.28 115.31 113.73 1b47 h LEU 247 Ca -0.16 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1b47 h LEU 247 Cb 1.05 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1b47 h LEU 247 CO -0.10 0.14 0.00 0.49 0.09 0.00 0.00 178.44 179.06 1b47 n PHE 248 N -4.95 0.09 -1.14 1.13 3.72 -0.93 -4.74 117.46 110.65 1b47 n PHE 248 Ca 0.17 -0.49 -0.36 0.00 -0.05 0.00 0.00 57.45 56.72 1b47 n PHE 248 Cb 0.48 -0.04 0.06 0.00 -0.94 0.00 0.00 39.48 39.04 1b47 n PHE 248 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1b47 n GLN 249 N -0.29 0.11 -1.47 -1.08 10.64 -1.01 -4.56 117.38 119.72 1b47 n GLN 249 Ca 0.02 0.07 -0.31 0.00 -1.83 0.00 0.00 57.00 54.95 1b47 n GLN 249 Cb 0.28 -1.57 0.07 0.00 -0.86 0.00 0.00 30.24 28.16 1b47 n GLN 249 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1b47 s PRO 250 N -2.51 2.63 0.31 2.61 0.04 -1.26 -4.86 135.00 131.96 1b47 s PRO 250 Ca 0.58 0.99 0.03 0.00 0.04 0.00 0.00 61.00 62.64 1b47 s PRO 250 Cb -0.32 -1.95 0.52 0.00 0.04 0.00 0.00 34.50 32.79 1b47 s PRO 250 CO 0.65 -1.33 1.82 2.35 0.04 0.00 0.00 177.00 180.54 1b47 h TRP 251 N -0.89 0.58 -0.79 0.56 2.91 -1.88 -3.03 115.95 113.42 1b47 h TRP 251 Ca -0.44 -0.08 -0.01 0.00 1.13 0.00 0.00 58.89 59.49 1b47 h TRP 251 Cb 1.22 -0.16 -0.04 0.00 -0.51 0.00 0.00 29.16 29.67 1b47 h TRP 251 CO 0.59 0.60 0.45 0.66 -1.03 0.00 0.00 178.44 179.72 1b47 h SER 252 N 0.52 0.96 -0.89 2.65 4.64 -1.98 -3.10 113.55 116.34 1b47 h SER 252 Ca 0.10 -0.06 -0.61 0.00 -0.47 0.00 0.00 61.79 60.74 1b47 h SER 252 Cb 0.43 -0.24 -0.36 0.00 -0.31 0.00 0.00 62.40 61.91 1b47 h SER 252 CO 0.02 0.75 -0.01 -1.54 -0.87 0.00 0.00 176.83 175.18 1b47 n SER 253 N -4.37 6.25 -0.16 4.97 3.41 -1.19 -4.99 113.62 117.54 1b47 n SER 253 Ca 0.08 -3.77 -0.06 0.00 -0.26 0.00 0.00 58.87 54.86 1b47 n SER 253 Cb 0.08 -0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 63.33 1b47 n SER 253 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1b47 h LEU 254 N 2.11 -1.03 -1.06 1.04 5.85 -1.45 0.60 115.31 121.37 1b47 h LEU 254 Ca 0.48 0.15 -0.04 0.00 0.84 0.00 0.00 57.88 59.31 1b47 h LEU 254 Cb 1.18 0.44 -0.01 0.00 0.37 0.00 0.00 40.66 42.65 1b47 h LEU 254 CO 1.16 -0.15 -0.21 -0.07 -0.34 0.00 0.00 178.44 178.83 1b47 h LEU 255 N -0.07 0.00 -0.31 2.25 3.38 -1.91 -0.79 115.31 117.85 1b47 h LEU 255 Ca 0.06 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1b47 h LEU 255 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1b47 h LEU 255 CO -0.41 0.21 -0.00 -0.09 0.09 0.00 0.00 178.44 178.24 1b47 h ARG 256 N 0.00 0.56 -0.33 1.13 9.65 -1.83 0.51 114.38 124.06 1b47 h ARG 256 Ca -0.00 -0.18 0.06 0.00 -1.10 0.00 0.00 59.98 58.76 1b47 h ARG 256 Cb 0.76 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 29.24 1b47 h ARG 256 CO 0.03 0.70 -0.01 -0.91 2.80 0.00 0.00 179.97 182.58 1b47 h ASN 257 N 0.36 -0.15 -0.28 -3.80 2.35 0.21 -1.48 115.58 112.79 1b47 h ASN 257 Ca 0.09 0.08 0.01 0.00 -0.55 0.00 0.00 56.30 55.92 1b47 h ASN 257 Cb 0.45 0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.94 1b47 h ASN 257 CO 0.02 -0.04 0.18 -0.25 -1.65 0.00 0.00 177.43 175.69 1b47 h TRP 258 N 0.09 0.34 -0.28 1.19 7.01 -1.01 -0.89 115.95 122.40 1b47 h TRP 258 Ca 0.16 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.23 1b47 h TRP 258 Cb 0.22 -0.11 -0.06 0.00 -2.10 0.00 0.00 29.16 27.11 1b47 h TRP 258 CO -0.24 0.21 -0.11 -0.91 -2.79 0.00 0.00 178.44 174.60 1b47 h ASN 259 N 0.37 -0.37 0.80 2.65 2.35 -0.76 0.56 115.58 121.18 1b47 h ASN 259 Ca 0.11 0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1b47 h ASN 259 Cb -0.03 0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 1b47 h ASN 259 CO -0.03 -0.14 -0.03 0.77 -1.65 0.00 0.00 177.43 176.34 1b47 h SER 260 N -0.06 0.00 0.00 5.81 4.64 -0.81 0.42 113.55 123.55 1b47 h SER 260 Ca 0.14 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.11 1b47 h SER 260 Cb 0.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.30 1b47 h SER 260 CO -0.32 0.03 -2.32 0.18 -0.87 0.00 0.00 176.83 173.53 1b47 n LEU 261 N -3.17 2.30 -0.05 5.97 4.77 -0.38 -4.18 117.00 122.27 1b47 n LEU 261 Ca -0.00 -0.10 -0.05 0.00 -0.03 0.00 0.00 56.01 55.83 1b47 n LEU 261 Cb 0.28 -0.53 -0.07 0.00 -2.33 0.00 0.00 43.42 40.76 1b47 n LEU 261 CO 0.27 0.80 -0.81 0.00 -1.33 0.00 0.00 177.39 176.32 1b47 n ALA 262 N -3.07 1.77 -0.07 -1.18 0.00 0.14 -4.30 120.51 113.79 1b47 n ALA 262 Ca -0.39 -0.62 -0.22 0.00 0.00 0.00 0.00 53.44 52.21 1b47 n ALA 262 Cb 0.98 0.06 -0.12 0.00 0.00 0.00 0.00 19.45 20.36 1b47 n ALA 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1b47 n VAL 263 N -2.37 1.63 -1.03 0.00 0.31 -0.53 -4.63 118.33 111.71 1b47 n VAL 263 Ca -0.16 -0.37 0.09 0.00 -0.01 0.00 0.00 64.34 63.89 1b47 n VAL 263 Cb 0.80 -1.85 0.22 0.00 -0.91 0.00 0.00 33.84 32.11 1b47 n VAL 263 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1b47 n THR 264 N -3.93 2.17 -4.29 2.52 -2.24 0.14 -4.98 114.28 103.67 1b47 n THR 264 Ca -0.36 -2.03 -0.33 0.00 -2.27 0.00 0.00 64.05 59.06 1b47 n THR 264 Cb 0.88 -0.25 -0.16 0.00 -2.10 0.00 0.00 70.33 68.70 1b47 n THR 264 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1b47 s HIS 265 N -2.86 2.76 -1.39 4.78 5.04 -1.26 -4.99 115.29 117.38 1b47 s HIS 265 Ca 0.39 -1.45 0.28 0.00 -1.54 0.00 0.00 55.06 52.75 1b47 s HIS 265 Cb 0.32 -1.90 1.40 0.00 0.04 0.00 0.00 32.58 32.44 1b47 s HIS 265 CO 0.07 -0.70 1.96 -2.30 -2.34 0.00 0.00 174.74 171.43 1b47 n PRO 266 N 4.43 0.36 0.00 2.88 -0.02 -1.26 -0.67 135.00 140.71 1b47 n PRO 266 Ca -0.20 0.02 0.14 0.00 -2.02 0.00 0.00 63.50 61.44 1b47 n PRO 266 Cb 0.51 -1.50 0.58 0.00 -0.02 0.00 0.00 33.50 33.07 1b47 n PRO 266 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b47 n GLY 267 N 1.14 -1.47 3.65 -1.23 0.00 -1.26 -4.36 105.19 101.66 1b47 n GLY 267 Ca 0.13 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1b47 n GLY 267 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b47 s TYR 268 N -3.00 2.05 -1.26 1.61 5.04 0.15 -0.83 117.35 121.11 1b47 s TYR 268 Ca 0.14 0.31 0.14 0.00 -2.44 0.00 0.00 57.07 55.22 1b47 s TYR 268 Cb 0.19 -3.90 -0.00 0.00 0.35 0.00 0.00 41.96 38.60 1b47 s TYR 268 CO 0.55 -3.55 0.77 -1.33 -1.34 0.00 0.00 175.55 170.64 1b47 n MET 269 N 7.20 1.82 0.00 4.97 2.81 -0.34 -4.93 117.12 128.65 1b47 n MET 269 Ca 0.17 -0.74 0.00 0.00 -1.81 0.00 0.00 57.70 55.33 1b47 n MET 269 Cb 0.43 -1.20 0.00 0.00 -0.71 0.00 0.00 33.22 31.74 1b47 n MET 269 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1b47 n ALA 270 N -0.16 0.00 -2.17 3.04 0.00 -1.26 -4.70 120.51 115.26 1b47 n ALA 270 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.09 1b47 n ALA 270 Cb 0.29 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.70 1b47 n ALA 270 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1b47 s PHE 271 N 0.00 3.65 -0.02 0.00 0.08 -1.26 -0.20 117.98 120.23 1b47 s PHE 271 Ca 0.00 1.64 -0.29 0.00 0.12 0.00 0.00 56.93 58.40 1b47 s PHE 271 Cb 0.00 -3.21 0.08 0.00 -0.57 0.00 0.00 43.02 39.32 1b47 s PHE 271 CO 0.00 -0.39 0.74 -1.17 -0.10 0.00 0.00 175.22 174.30 1b47 s LEU 272 N -0.11 -0.57 0.61 -0.37 2.96 -1.05 -4.94 118.68 115.21 1b47 s LEU 272 Ca 0.49 0.45 -0.07 0.00 -0.22 0.00 0.00 54.13 54.78 1b47 s LEU 272 Cb -0.27 2.39 0.00 0.00 0.50 0.00 0.00 46.19 48.81 1b47 s LEU 272 CO 0.33 -0.64 0.94 -0.89 -1.32 0.00 0.00 176.35 174.77 1b47 s THR 273 N -1.87 3.81 0.26 3.68 2.01 -1.26 -4.64 115.64 117.63 1b47 s THR 273 Ca -0.06 0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.09 1b47 s THR 273 Cb -0.00 -3.53 0.21 0.00 0.01 0.00 0.00 72.50 69.19 1b47 s THR 273 CO 0.02 -0.59 1.87 0.22 -0.69 0.00 0.00 174.62 175.46 1b47 h TYR 274 N -0.26 1.10 -0.25 4.92 5.03 -1.99 -2.20 116.97 123.32 1b47 h TYR 274 Ca -0.45 -0.03 -0.17 0.00 2.58 0.00 0.00 58.73 60.66 1b47 h TYR 274 Cb 1.25 -0.35 -0.00 0.00 1.55 0.00 0.00 36.73 39.17 1b47 h TYR 274 CO 0.50 0.77 -0.52 -0.44 -1.32 0.00 0.00 178.16 177.15 1b47 h ASP 275 N 1.11 0.79 0.93 -2.11 3.32 -2.00 -2.07 116.42 116.40 1b47 h ASP 275 Ca 0.28 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1b47 h ASP 275 Cb 0.06 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1b47 h ASP 275 CO -0.04 1.16 -0.29 -0.33 -1.72 0.00 0.00 179.24 178.02 1b47 h GLU 276 N 0.56 0.00 -0.56 3.56 5.08 -1.91 -1.65 114.58 119.66 1b47 h GLU 276 Ca 0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1b47 h GLU 276 Cb 1.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 1b47 h GLU 276 CO 0.11 0.29 0.12 0.28 -1.00 0.00 0.00 179.01 178.81 1b47 h VAL 277 N 0.00 1.25 -0.24 3.13 2.07 -1.03 -3.20 116.25 118.23 1b47 h VAL 277 Ca -0.00 -0.91 -0.16 0.00 0.82 0.00 0.00 66.70 66.45 1b47 h VAL 277 Cb 0.84 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1b47 h VAL 277 CO 0.04 0.33 -0.49 0.11 0.02 0.00 0.00 177.57 177.58 1b47 h LYS 278 N 0.80 0.66 0.00 1.57 1.57 -0.98 -2.38 116.57 117.82 1b47 h LYS 278 Ca 0.17 -0.39 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1b47 h LYS 278 Cb 0.37 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1b47 h LYS 278 CO 0.01 1.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.89 1b47 n ALA 279 N -2.53 2.41 -0.02 3.86 0.00 -0.66 -1.94 120.51 121.64 1b47 n ALA 279 Ca -0.03 -0.10 -0.02 0.00 0.00 0.00 0.00 53.44 53.29 1b47 n ALA 279 Cb 0.58 -1.26 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 1b47 n ALA 279 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1b47 n ARG 280 N -0.81 0.07 0.00 0.00 0.63 -0.96 -4.44 116.66 111.15 1b47 n ARG 280 Ca 0.12 0.02 0.04 0.00 -0.92 0.00 0.00 57.85 57.11 1b47 n ARG 280 Cb 0.05 -0.97 0.21 0.00 0.45 0.00 0.00 32.46 32.21 1b47 n ARG 280 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1b47 n LEU 281 N -2.70 0.00 0.22 6.15 4.77 -0.94 -3.58 117.00 120.92 1b47 n LEU 281 Ca -0.06 0.29 0.10 0.00 -0.03 0.00 0.00 56.01 56.32 1b47 n LEU 281 Cb 0.55 -0.29 0.42 0.00 -2.33 0.00 0.00 43.42 41.77 1b47 n LEU 281 CO 0.02 -0.21 0.79 -0.61 -1.33 0.00 0.00 177.39 176.05 1b47 h GLN 282 N 0.00 0.00 -0.94 3.23 5.75 -1.60 -0.05 115.11 121.49 1b47 h GLN 282 Ca 0.00 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.39 1b47 h GLN 282 Cb 0.08 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.57 1b47 h GLN 282 CO 0.00 0.21 0.14 1.63 -2.65 0.00 0.00 178.83 178.16 1b47 n LYS 283 N -3.32 1.78 -0.06 1.69 4.76 -1.23 -2.89 118.16 118.88 1b47 n LYS 283 Ca 0.01 -1.05 0.00 0.00 -2.87 0.00 0.00 58.31 54.40 1b47 n LYS 283 Cb 0.45 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 1b47 n LYS 283 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1b47 n PHE 284 N 0.04 0.00 -0.15 2.13 3.72 -0.05 -4.88 117.46 118.27 1b47 n PHE 284 Ca 0.16 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.71 1b47 n PHE 284 Cb 0.78 0.09 0.50 0.00 -0.94 0.00 0.00 39.48 39.91 1b47 n PHE 284 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1b47 h ILE 285 N 3.35 0.82 0.00 4.37 2.10 -1.38 0.19 117.51 126.97 1b47 h ILE 285 Ca 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 65.80 1b47 h ILE 285 Cb 1.02 0.36 0.00 0.00 -1.09 0.00 0.00 36.82 37.11 1b47 h ILE 285 CO 0.00 0.08 0.00 1.41 -1.08 0.00 0.00 178.15 178.56 1b47 n HIS 286 N -4.48 0.00 -2.76 2.19 8.25 -1.26 -4.43 115.22 112.73 1b47 n HIS 286 Ca 0.13 -0.75 -0.09 0.00 -0.26 0.00 0.00 57.72 56.75 1b47 n HIS 286 Cb 0.50 -0.38 0.08 0.00 1.12 0.00 0.00 29.99 31.31 1b47 n HIS 286 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1b47 n LYS 287 N 1.04 1.09 0.00 -0.41 0.00 0.68 -5.09 118.16 115.47 1b47 n LYS 287 Ca 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 58.31 56.14 1b47 n LYS 287 Cb 0.49 -0.77 0.00 0.00 0.00 0.00 0.00 35.03 34.75 1b47 n LYS 287 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1b47 n PRO 288 N -0.03 0.00 -0.35 1.64 -0.02 -1.26 -1.00 135.00 133.98 1b47 n PRO 288 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1b47 n PRO 288 Cb 0.76 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.24 1b47 n PRO 288 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b47 n GLY 289 N 0.00 0.79 3.69 -1.23 0.00 0.23 -4.88 105.19 103.78 1b47 n GLY 289 Ca 0.00 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 1b47 n GLY 289 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b47 s SER 290 N -2.33 6.50 0.10 1.61 0.01 -0.17 -0.88 113.70 118.55 1b47 s SER 290 Ca 0.00 2.63 0.05 0.00 1.31 0.00 0.00 55.95 59.94 1b47 s SER 290 Cb 0.00 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 1b47 s SER 290 CO 0.00 -0.95 -0.12 -0.72 0.41 0.00 0.00 173.24 171.86 1b47 s TYR 291 N 2.76 1.19 0.14 2.43 1.13 -1.04 -2.21 117.35 121.75 1b47 s TYR 291 Ca 0.78 -0.60 0.05 0.00 -1.41 0.00 0.00 57.07 55.89 1b47 s TYR 291 Cb -0.43 -0.64 -0.04 0.00 -1.10 0.00 0.00 41.96 39.75 1b47 s TYR 291 CO 0.35 0.06 -0.12 0.96 -2.51 0.00 0.00 175.55 174.28 1b47 s ILE 292 N -2.24 1.27 0.14 -3.49 -4.36 -1.12 -0.63 121.20 110.77 1b47 s ILE 292 Ca 0.06 -1.91 0.06 0.00 -0.26 0.00 0.00 60.65 58.60 1b47 s ILE 292 Cb -0.04 -1.70 -0.04 0.00 1.25 0.00 0.00 42.46 41.92 1b47 s ILE 292 CO 0.01 -0.59 -0.13 0.72 0.24 0.00 0.00 174.94 175.19 1b47 s PHE 293 N -2.76 1.41 -0.03 1.37 -0.12 -0.01 -1.38 117.98 116.45 1b47 s PHE 293 Ca 0.13 -0.60 -0.25 0.00 -0.05 0.00 0.00 56.93 56.16 1b47 s PHE 293 Cb -0.01 -0.72 0.05 0.00 -0.63 0.00 0.00 43.02 41.71 1b47 s PHE 293 CO 0.02 0.16 0.55 -0.98 -0.05 0.00 0.00 175.22 174.92 1b47 s ARG 294 N -3.06 0.94 0.37 1.99 1.70 0.03 -1.20 118.95 119.72 1b47 s ARG 294 Ca 0.13 0.08 0.04 0.00 -0.47 0.00 0.00 55.73 55.50 1b47 s ARG 294 Cb -0.03 0.43 -0.01 0.00 -0.57 0.00 0.00 34.95 34.78 1b47 s ARG 294 CO 0.03 -0.29 0.55 -0.51 -1.08 0.00 0.00 175.30 174.00 1b47 s LEU 295 N -1.29 3.88 -0.07 -1.89 1.43 0.72 -1.17 118.68 120.27 1b47 s LEU 295 Ca -0.11 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 1b47 s LEU 295 Cb -0.02 -2.96 0.02 0.00 0.03 0.00 0.00 46.19 43.26 1b47 s LEU 295 CO 0.07 -0.50 -0.07 -0.55 0.23 0.00 0.00 176.35 175.54 1b47 s SER 296 N -4.17 1.58 0.52 2.29 0.15 -1.26 -2.53 113.70 110.29 1b47 s SER 296 Ca 0.45 -0.21 0.30 0.00 0.70 0.00 0.00 55.95 57.19 1b47 s SER 296 Cb -0.10 -0.65 1.38 0.00 -1.71 0.00 0.00 66.02 64.94 1b47 s SER 296 CO 0.34 -0.07 2.01 0.00 1.20 0.00 0.00 173.24 176.72 1b47 n THR 298 N -3.34 0.03 -3.45 0.00 -2.24 -1.26 -4.34 114.28 99.68 1b47 n THR 298 Ca -0.01 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.49 1b47 n THR 298 Cb 0.30 0.18 -0.09 0.00 -2.10 0.00 0.00 70.33 68.62 1b47 n THR 298 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1b47 n ARG 299 N -1.55 1.65 -2.21 -0.78 1.74 -0.67 -5.11 116.66 109.73 1b47 n ARG 299 Ca 0.05 -4.09 -0.40 0.00 -0.77 0.00 0.00 57.85 52.65 1b47 n ARG 299 Cb 0.34 -1.92 -0.02 0.00 -1.02 0.00 0.00 32.46 29.84 1b47 n ARG 299 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1b47 s LEU 300 N -1.65 4.34 0.00 0.55 1.43 -1.24 -2.73 118.68 119.37 1b47 s LEU 300 Ca 0.35 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.97 1b47 s LEU 300 Cb 0.11 -3.80 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1b47 s LEU 300 CO -0.09 -0.57 0.00 0.61 0.23 0.00 0.00 176.35 176.53 1b47 n GLY 301 N 0.79 0.80 3.17 -3.19 0.00 -1.26 -5.01 105.19 100.49 1b47 n GLY 301 Ca 0.02 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1b47 n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b47 s GLN 302 N -0.61 1.05 0.11 1.61 -0.21 -1.11 -4.22 119.66 116.29 1b47 s GLN 302 Ca 0.00 -0.80 -0.04 0.00 0.02 0.00 0.00 55.36 54.54 1b47 s GLN 302 Cb 0.00 -1.09 -0.05 0.00 1.00 0.00 0.00 33.01 32.87 1b47 s GLN 302 CO 0.00 0.27 0.33 -1.58 -2.12 0.00 0.00 175.29 172.20 1b47 s TRP 303 N -0.83 3.49 0.11 0.91 0.52 -1.26 -4.26 118.94 117.62 1b47 s TRP 303 Ca 0.03 0.50 0.07 0.00 0.02 0.00 0.00 56.10 56.72 1b47 s TRP 303 Cb -0.08 -1.96 -0.03 0.00 -1.15 0.00 0.00 33.47 30.25 1b47 s TRP 303 CO 0.01 0.48 -0.18 0.00 0.02 0.00 0.00 176.95 177.29 1b47 s ALA 304 N -1.60 1.62 -0.10 0.98 0.00 -0.32 -4.01 121.76 118.35 1b47 s ALA 304 Ca 0.39 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 51.14 1b47 s ALA 304 Cb -0.12 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.84 1b47 s ALA 304 CO 0.25 0.26 -0.14 0.42 0.00 0.00 0.00 175.76 176.54 1b47 s ILE 305 N -1.45 1.39 0.27 0.00 1.01 -1.21 -0.79 121.20 120.42 1b47 s ILE 305 Ca 0.06 -0.59 0.06 0.00 0.00 0.00 0.00 60.65 60.18 1b47 s ILE 305 Cb -0.09 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 1b47 s ILE 305 CO 0.04 0.42 0.30 -0.83 0.00 0.00 0.00 174.94 174.87 1b47 s GLY 306 N 0.90 1.42 -0.28 6.18 0.00 -0.48 0.03 107.32 115.08 1b47 s GLY 306 Ca -0.09 -1.39 -0.26 0.00 0.00 0.00 0.00 44.72 42.98 1b47 s GLY 306 CO 0.00 -1.39 1.33 -2.52 0.00 0.00 0.00 173.10 170.52 1b47 s TYR 307 N -2.11 -0.14 -0.07 1.90 1.13 -0.76 -2.81 117.35 114.49 1b47 s TYR 307 Ca 0.36 0.32 -0.16 0.00 -1.41 0.00 0.00 57.07 56.17 1b47 s TYR 307 Cb -0.08 0.46 -0.05 0.00 -1.10 0.00 0.00 41.96 41.19 1b47 s TYR 307 CO 0.27 -0.08 0.43 0.08 -2.51 0.00 0.00 175.55 173.74 1b47 s VAL 308 N -0.23 5.12 -0.10 -3.49 1.01 -0.94 -2.69 120.40 119.07 1b47 s VAL 308 Ca 0.06 0.87 0.02 0.00 0.00 0.00 0.00 61.98 62.94 1b47 s VAL 308 Cb -0.04 -3.76 -0.24 0.00 0.00 0.00 0.00 36.38 32.34 1b47 s VAL 308 CO -0.11 0.45 0.43 0.35 0.00 0.00 0.00 175.10 176.21 1b47 n THR 309 N 2.82 1.68 0.00 3.92 -2.24 -0.54 0.77 114.28 120.70 1b47 n THR 309 Ca -0.11 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 1b47 n THR 309 Cb 0.52 -1.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.35 1b47 n THR 309 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b47 n ALA 310 N -2.84 0.00 0.00 6.98 0.00 -1.26 -4.69 120.51 118.70 1b47 n ALA 310 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1b47 n ALA 310 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.50 1b47 n ALA 310 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1b47 n ASP 311 N 0.00 0.00 -1.39 0.00 -0.08 -1.26 -4.71 116.55 109.11 1b47 n ASP 311 Ca 0.00 0.25 -0.08 0.00 -1.51 0.00 0.00 54.79 53.44 1b47 n ASP 311 Cb 0.00 -0.25 0.02 0.00 2.34 0.00 0.00 41.12 43.23 1b47 n ASP 311 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1b47 n GLY 312 N -1.21 0.30 3.69 0.27 0.00 -1.26 -5.04 105.19 101.93 1b47 n GLY 312 Ca 0.00 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 1b47 n GLY 312 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b47 s ASN 313 N -2.97 5.11 -0.44 1.61 -0.87 -1.26 -4.79 114.94 111.32 1b47 s ASN 313 Ca 0.15 -0.08 -0.22 0.00 -1.57 0.00 0.00 52.86 51.14 1b47 s ASN 313 Cb -0.06 -1.29 0.02 0.00 -0.02 0.00 0.00 41.25 39.90 1b47 s ASN 313 CO 0.18 0.23 0.73 -0.63 -2.57 0.00 0.00 177.10 175.04 1b47 s ILE 314 N -1.20 4.72 0.39 0.60 1.01 -1.26 -1.47 121.20 123.99 1b47 s ILE 314 Ca 0.23 0.32 0.08 0.00 0.00 0.00 0.00 60.65 61.27 1b47 s ILE 314 Cb -0.12 -4.27 -0.06 0.00 0.01 0.00 0.00 42.46 38.02 1b47 s ILE 314 CO 0.14 -0.66 0.05 -0.76 0.00 0.00 0.00 174.94 173.71 1b47 s LEU 315 N 3.09 2.96 -0.11 2.97 1.43 -1.10 -4.94 118.68 122.98 1b47 s LEU 315 Ca 0.27 -1.17 -0.05 0.00 -1.03 0.00 0.00 54.13 52.15 1b47 s LEU 315 Cb -0.13 -1.18 0.05 0.00 0.03 0.00 0.00 46.19 44.96 1b47 s LEU 315 CO 0.21 -0.40 0.26 -1.10 0.23 0.00 0.00 176.35 175.55 1b47 s GLN 316 N -3.76 0.19 0.00 1.70 -0.21 -1.26 -1.83 119.66 114.50 1b47 s GLN 316 Ca 0.36 0.61 0.00 0.00 0.02 0.00 0.00 55.36 56.36 1b47 s GLN 316 Cb 0.05 -0.09 0.00 0.00 1.00 0.00 0.00 33.01 33.97 1b47 s GLN 316 CO 0.20 -0.21 0.00 2.41 -2.12 0.00 0.00 175.29 175.57 1b47 n THR 317 N 4.62 0.00 -3.35 -0.19 -1.04 0.10 -4.89 114.28 109.53 1b47 n THR 317 Ca -0.19 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.72 1b47 n THR 317 Cb 0.52 -0.39 -0.08 0.00 -1.82 0.00 0.00 70.33 68.56 1b47 n THR 317 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1b47 s ILE 318 N 0.67 -0.57 0.00 12.58 1.01 -1.26 -3.36 121.20 130.27 1b47 s ILE 318 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.45 1b47 s ILE 318 Cb 0.00 -0.88 0.00 0.00 0.01 0.00 0.00 42.46 41.59 1b47 s ILE 318 CO 0.00 -0.22 0.00 -2.65 0.00 0.00 0.00 174.94 172.07 1b47 n PRO 319 N 5.35 0.00 -1.39 2.79 -0.02 -1.26 -4.51 135.00 135.97 1b47 n PRO 319 Ca -0.02 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.31 1b47 n PRO 319 Cb 0.49 -0.62 -0.06 0.00 -0.02 0.00 0.00 33.50 33.29 1b47 n PRO 319 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1b47 n HIS 320 N 1.60 -0.16 -1.98 6.00 8.25 -1.26 -1.64 115.22 126.02 1b47 n HIS 320 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1b47 n HIS 320 Cb 0.00 -2.82 0.00 0.00 1.12 0.00 0.00 29.99 28.29 1b47 n HIS 320 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1b47 n ASN 321 N -0.82 0.00 -4.44 0.41 5.03 -1.26 -5.01 115.26 109.17 1b47 n ASN 321 Ca -0.14 0.00 -0.27 0.00 0.87 0.00 0.00 54.58 55.04 1b47 n ASN 321 Cb 0.53 0.00 -0.09 0.00 -1.02 0.00 0.00 39.78 39.20 1b47 n ASN 321 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1b47 s LYS 322 N -2.44 1.94 0.81 3.52 -2.85 -0.65 -5.15 119.74 114.92 1b47 s LYS 322 Ca 0.00 -2.17 -0.14 0.00 -1.00 0.00 0.00 55.97 52.66 1b47 s LYS 322 Cb 0.00 -1.05 0.04 0.00 -2.06 0.00 0.00 37.83 34.75 1b47 s LYS 322 CO 0.00 -0.32 0.82 -2.30 0.10 0.00 0.00 175.35 173.65 1b47 n PRO 323 N -0.96 0.11 0.08 1.78 -0.01 -1.26 -4.70 135.00 130.03 1b47 n PRO 323 Ca -0.09 0.10 -0.12 0.00 -0.01 0.00 0.00 63.50 63.39 1b47 n PRO 323 Cb 0.66 -2.13 -0.05 0.00 -0.01 0.00 0.00 33.50 31.98 1b47 n PRO 323 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 175.50 176.74 1b47 h LEU 324 N -0.89 -0.65 -0.56 2.45 5.85 -1.89 -0.92 115.31 118.70 1b47 h LEU 324 Ca -0.45 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.40 1b47 h LEU 324 Cb 1.31 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 42.53 1b47 h LEU 324 CO 0.42 -0.30 -0.33 0.33 -0.34 0.00 0.00 178.44 178.22 1b47 n PHE 325 N -5.35 -0.25 -0.01 1.25 -0.00 -1.26 -0.60 117.46 111.25 1b47 n PHE 325 Ca -0.05 0.70 -0.09 0.00 -0.00 0.00 0.00 57.45 58.00 1b47 n PHE 325 Cb 0.26 -0.51 -0.03 0.00 -0.00 0.00 0.00 39.48 39.20 1b47 n PHE 325 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.76 177.13 1b47 h GLN 326 N 0.00 -0.23 0.00 -4.13 5.75 -1.69 -2.10 115.11 112.71 1b47 h GLN 326 Ca 0.09 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1b47 h GLN 326 Cb 0.23 0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.83 1b47 h GLN 326 CO -0.53 -0.15 0.00 0.00 -2.65 0.00 0.00 178.83 175.50 1b47 n ALA 327 N -2.65 1.81 -0.05 3.38 0.00 0.23 -0.02 120.51 123.21 1b47 n ALA 327 Ca -0.03 -0.06 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 1b47 n ALA 327 Cb 0.25 -1.27 -0.13 0.00 0.00 0.00 0.00 19.45 18.30 1b47 n ALA 327 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1b47 n LEU 328 N -1.43 2.34 0.00 0.00 4.77 -0.20 -2.88 117.00 119.59 1b47 n LEU 328 Ca 0.05 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1b47 n LEU 328 Cb 0.18 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.23 1b47 n LEU 328 CO 0.15 0.63 0.03 -0.38 -1.33 0.00 0.00 177.39 176.49 1b47 n ILE 329 N -3.86 0.00 0.00 -0.08 5.41 -0.84 -2.20 119.36 117.79 1b47 n ILE 329 Ca -0.34 0.56 0.00 0.00 1.00 0.00 0.00 62.75 63.97 1b47 n ILE 329 Cb 0.90 -1.30 0.00 0.00 -0.71 0.00 0.00 39.64 38.53 1b47 n ILE 329 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1b47 n ASP 330 N -0.10 0.00 -0.10 4.38 8.00 0.96 0.28 116.55 129.98 1b47 n ASP 330 Ca 0.00 0.21 -0.02 0.00 0.71 0.00 0.00 54.79 55.68 1b47 n ASP 330 Cb 0.00 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.06 1b47 n ASP 330 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b47 n GLY 331 N -0.72 -0.57 0.40 0.44 0.00 -1.14 0.25 105.19 103.85 1b47 n GLY 331 Ca 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 1b47 n GLY 331 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1b47 h PHE 332 N 0.00 -1.31 -1.00 1.61 3.04 0.45 0.40 116.94 120.13 1b47 h PHE 332 Ca 0.04 0.07 0.13 0.00 3.98 0.00 0.00 57.97 62.20 1b47 h PHE 332 Cb 0.10 0.64 -0.09 0.00 2.56 0.00 0.00 35.95 39.16 1b47 h PHE 332 CO -0.23 -0.45 0.63 0.00 -2.02 0.00 0.00 178.31 176.24 1b47 h ARG 333 N -0.32 0.92 0.00 1.11 3.08 0.54 1.84 114.38 121.55 1b47 h ARG 333 Ca 0.14 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1b47 h ARG 333 Cb 0.58 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1b47 h ARG 333 CO -0.60 0.61 0.00 0.39 -1.07 0.00 0.00 179.97 179.31 1b47 n GLU 334 N -4.65 0.52 -2.54 0.04 1.02 -0.44 -4.93 120.64 109.66 1b47 n GLU 334 Ca 0.20 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.19 1b47 n GLU 334 Cb 0.39 -1.12 0.01 0.00 -0.02 0.00 0.00 31.44 30.70 1b47 n GLU 334 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b47 n GLY 335 N 0.03 -0.21 0.09 0.62 0.00 0.62 -4.88 105.19 101.46 1b47 n GLY 335 Ca 0.03 0.41 -0.11 0.00 0.00 0.00 0.00 46.02 46.36 1b47 n GLY 335 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b47 n PHE 336 N -0.68 0.00 -3.72 1.61 3.72 0.13 -4.99 117.46 113.53 1b47 n PHE 336 Ca -0.09 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.93 1b47 n PHE 336 Cb 0.31 -0.78 -0.12 0.00 -0.94 0.00 0.00 39.48 37.95 1b47 n PHE 336 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1b47 s TYR 337 N -2.39 3.29 0.12 1.38 2.02 -1.17 -4.42 117.35 116.17 1b47 s TYR 337 Ca -0.17 -1.46 0.00 0.00 -0.37 0.00 0.00 57.07 55.07 1b47 s TYR 337 Cb 0.06 -2.46 0.00 0.00 -0.40 0.00 0.00 41.96 39.16 1b47 s TYR 337 CO 0.56 -0.76 0.00 1.28 -1.57 0.00 0.00 175.55 175.06 1b47 n LEU 338 N 4.83 0.07 -4.00 -1.29 4.77 -0.97 -4.04 117.00 116.37 1b47 n LEU 338 Ca -0.11 0.20 -0.32 0.00 -0.03 0.00 0.00 56.01 55.74 1b47 n LEU 338 Cb 0.44 0.11 -0.11 0.00 -2.33 0.00 0.00 43.42 41.53 1b47 n LEU 338 CO 0.33 -0.57 -0.03 -0.36 -1.33 0.00 0.00 177.39 175.43 1b47 s PHE 339 N -2.00 3.40 -0.53 -1.77 0.08 -0.06 -4.17 117.98 112.93 1b47 s PHE 339 Ca 0.00 -3.06 -0.27 0.00 0.12 0.00 0.00 56.93 53.72 1b47 s PHE 339 Cb 0.00 -2.96 -0.03 0.00 -0.57 0.00 0.00 43.02 39.46 1b47 s PHE 339 CO 0.00 -0.73 2.02 -1.25 -0.10 0.00 0.00 175.22 175.15 1b47 s PRO 340 N -0.57 2.59 -1.05 0.24 0.04 -1.22 0.16 135.00 135.20 1b47 s PRO 340 Ca 0.20 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.22 1b47 s PRO 340 Cb -0.18 -4.42 0.00 0.00 0.04 0.00 0.00 34.50 29.94 1b47 s PRO 340 CO -0.05 -2.75 0.00 -3.47 0.04 0.00 0.00 177.00 170.77 1b47 n ASP 341 N 13.27 -4.17 0.00 6.66 2.03 0.20 -3.55 116.55 130.99 1b47 n ASP 341 Ca 0.26 0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.80 1b47 n ASP 341 Cb 0.52 -2.57 0.00 0.00 -0.72 0.00 0.00 41.12 38.35 1b47 n ASP 341 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1b47 n GLY 342 N -1.75 2.33 3.77 0.27 0.00 0.43 -5.02 105.19 105.22 1b47 n GLY 342 Ca -0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 1b47 n GLY 342 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b47 s ARG 343 N -0.89 3.91 0.19 1.61 0.52 -1.23 -4.89 118.95 118.17 1b47 s ARG 343 Ca 0.00 2.10 0.09 0.00 -0.52 0.00 0.00 55.73 57.40 1b47 s ARG 343 Cb 0.00 -2.69 0.04 0.00 0.52 0.00 0.00 34.95 32.82 1b47 s ARG 343 CO 0.00 -0.52 1.43 -0.91 0.02 0.00 0.00 175.30 175.31 1b47 h ASN 344 N 2.55 0.00 -3.37 0.23 -0.26 -1.92 -3.22 115.58 109.59 1b47 h ASN 344 Ca -0.50 0.00 -0.58 0.00 -0.56 0.00 0.00 56.30 54.67 1b47 h ASN 344 Cb 1.25 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 38.43 1b47 h ASN 344 CO 0.62 0.81 0.14 -1.58 -1.06 0.00 0.00 177.43 176.36 1b47 s GLN 345 N -3.08 4.32 -0.10 0.81 2.00 -1.26 -4.84 119.66 117.52 1b47 s GLN 345 Ca 0.00 0.77 -0.17 0.00 -2.00 0.00 0.00 55.36 53.97 1b47 s GLN 345 Cb 0.11 -3.52 -0.05 0.00 0.80 0.00 0.00 33.01 30.35 1b47 s GLN 345 CO 0.79 -0.11 0.43 1.21 -0.50 0.00 0.00 175.29 177.10 1b47 s ASN 346 N 1.00 6.67 0.95 6.67 3.84 -1.26 -4.64 114.94 128.17 1b47 s ASN 346 Ca 0.33 0.80 -0.15 0.00 0.21 0.00 0.00 52.86 54.05 1b47 s ASN 346 Cb -0.17 -2.26 -0.07 0.00 -0.55 0.00 0.00 41.25 38.21 1b47 s ASN 346 CO 0.13 0.10 -0.23 -2.65 -2.79 0.00 0.00 177.10 171.66 1b47 n PRO 347 N 3.21 -0.11 -4.01 0.43 -0.02 -1.26 -4.96 135.00 128.29 1b47 n PRO 347 Ca -0.10 -0.01 -0.32 0.00 -2.02 0.00 0.00 63.50 61.05 1b47 n PRO 347 Cb 0.52 -1.39 -0.15 0.00 -0.02 0.00 0.00 33.50 32.46 1b47 n PRO 347 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1b47 s ASP 348 N -1.44 4.71 0.00 2.55 2.15 -1.26 -4.96 116.67 118.42 1b47 s ASP 348 Ca 0.49 -1.80 0.28 0.00 0.43 0.00 0.00 52.55 51.94 1b47 s ASP 348 Cb -0.21 -1.63 1.23 0.00 -0.30 0.00 0.00 42.92 42.01 1b47 s ASP 348 CO 0.75 -0.32 1.90 0.18 -0.17 0.00 0.00 175.17 177.51 1b47 n LEU 349 N 4.38 0.00 -0.92 -1.34 4.77 -1.26 -5.18 117.00 117.45 1b47 n LEU 349 Ca -0.04 0.46 0.12 0.00 -0.03 0.00 0.00 56.01 56.51 1b47 n LEU 349 Cb 0.42 -0.46 0.14 0.00 -2.33 0.00 0.00 43.42 41.19 1b47 n LEU 349 CO 0.23 -0.03 0.65 1.07 -1.33 0.00 0.00 177.39 177.99