#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d4j s ALA 9 N 0.00 2.87 -0.01 0.00 0.00 -1.26 -4.72 121.76 118.64 3d4j s ALA 9 Ca 0.00 0.38 0.04 0.00 0.00 0.00 0.00 51.96 52.38 3d4j s ALA 9 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 3d4j s ALA 9 CO 0.00 -0.51 -0.14 0.54 0.00 0.00 0.00 175.76 175.65 3d4j s VAL 10 N -2.40 1.08 -0.03 0.00 0.11 -0.51 -4.99 120.40 113.66 3d4j s VAL 10 Ca 0.63 -0.58 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 3d4j s VAL 10 Cb -0.14 -0.90 0.03 0.00 -1.53 0.00 0.00 36.38 33.84 3d4j s VAL 10 CO 0.31 0.31 -0.01 -0.89 -3.33 0.00 0.00 175.10 171.49 3d4j s THR 11 N -0.32 0.25 0.31 5.04 2.01 -1.26 -1.33 115.64 120.34 3d4j s THR 11 Ca 0.05 0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.15 3d4j s THR 11 Cb -0.05 -0.34 -0.06 0.00 0.01 0.00 0.00 72.50 72.06 3d4j s THR 11 CO -0.01 0.16 0.01 0.00 -0.69 0.00 0.00 174.62 174.10 3d4j s THR 13 N -3.17 1.33 0.06 0.00 -4.23 0.16 -1.09 115.64 108.70 3d4j s THR 13 Ca 0.33 -1.45 0.02 0.00 -1.18 0.00 0.00 61.69 59.41 3d4j s THR 13 Cb 0.07 -1.30 -0.03 0.00 1.34 0.00 0.00 72.50 72.58 3d4j s THR 13 CO 0.14 -0.21 -0.07 0.00 -0.54 0.00 0.00 174.62 173.94 3d4j s ALA 14 N -1.39 0.66 0.37 3.99 0.00 -0.43 -0.66 121.76 124.30 3d4j s ALA 14 Ca 0.02 -0.96 0.07 0.00 0.00 0.00 0.00 51.96 51.09 3d4j s ALA 14 Cb -0.09 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.13 3d4j s ALA 14 CO 0.03 -0.12 0.51 -1.25 0.00 0.00 0.00 175.76 174.93 3d4j s PRO 15 N -2.41 3.02 0.39 0.00 0.04 -1.26 -1.20 135.00 133.58 3d4j s PRO 15 Ca -0.03 -1.05 0.07 0.00 0.04 0.00 0.00 61.00 60.03 3d4j s PRO 15 Cb -0.04 -2.79 0.00 0.00 0.04 0.00 0.00 34.50 31.71 3d4j s PRO 15 CO -0.02 -0.06 0.54 0.14 0.04 0.00 0.00 177.00 177.64 3d4j s VAL 16 N -2.25 3.38 0.02 -0.36 -7.23 -1.26 -4.24 120.40 108.46 3d4j s VAL 16 Ca 0.48 -0.98 -0.07 0.00 -1.81 0.00 0.00 61.98 59.60 3d4j s VAL 16 Cb -0.10 -3.15 -0.00 0.00 0.56 0.00 0.00 36.38 33.69 3d4j s VAL 16 CO 0.32 -0.06 0.14 0.54 -0.31 0.00 0.00 175.10 175.73 3d4j s ASN 17 N -4.29 0.07 -0.21 4.85 2.20 -1.26 -1.80 114.94 114.51 3d4j s ASN 17 Ca 0.51 -0.35 -0.04 0.00 -0.94 0.00 0.00 52.86 52.04 3d4j s ASN 17 Cb -0.10 0.24 -0.02 0.00 -2.00 0.00 0.00 41.25 39.37 3d4j s ASN 17 CO 0.33 -0.47 -0.02 -0.63 -2.94 0.00 0.00 177.10 173.37 3d4j s ILE 18 N -2.10 3.72 -0.07 0.54 -1.09 -0.27 -4.86 121.20 117.06 3d4j s ILE 18 Ca -0.09 -0.39 -0.30 0.00 -2.23 0.00 0.00 60.65 57.64 3d4j s ILE 18 Cb -0.04 -2.68 -0.03 0.00 -1.58 0.00 0.00 42.46 38.13 3d4j s ILE 18 CO -0.02 0.43 1.19 0.00 -1.23 0.00 0.00 174.94 175.31 3d4j s ALA 19 N 1.15 3.51 -0.13 9.38 0.00 -1.26 -1.20 121.76 133.22 3d4j s ALA 19 Ca 0.02 0.58 0.17 0.00 0.00 0.00 0.00 51.96 52.73 3d4j s ALA 19 Cb -0.14 -3.52 -0.23 0.00 0.00 0.00 0.00 23.12 19.22 3d4j s ALA 19 CO 0.00 -0.80 0.42 1.33 0.00 0.00 0.00 175.76 176.71 3d4j n VAL 20 N 4.70 1.29 -3.93 0.00 0.24 0.48 -4.56 118.33 116.55 3d4j n VAL 20 Ca 0.11 -0.78 -0.34 0.00 -2.04 0.00 0.00 64.34 61.29 3d4j n VAL 20 Cb 0.46 -0.64 -0.14 0.00 -1.47 0.00 0.00 33.84 32.06 3d4j n VAL 20 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3d4j s ILE 21 N -2.69 2.77 0.28 1.34 -1.09 -0.68 -4.61 121.20 116.52 3d4j s ILE 21 Ca -0.07 -1.76 -0.29 0.00 -2.23 0.00 0.00 60.65 56.29 3d4j s ILE 21 Cb 0.08 -2.75 -0.10 0.00 -1.58 0.00 0.00 42.46 38.11 3d4j s ILE 21 CO 0.83 -0.32 1.26 -0.54 -1.23 0.00 0.00 174.94 174.95 3d4j s LYS 22 N 1.13 4.43 -0.28 2.79 3.01 -1.26 -2.51 119.74 127.05 3d4j s LYS 22 Ca 0.00 2.07 -0.18 0.00 -1.01 0.00 0.00 55.97 56.86 3d4j s LYS 22 Cb -0.20 -3.14 -0.02 0.00 -1.01 0.00 0.00 37.83 33.46 3d4j s LYS 22 CO -0.04 -0.12 0.51 -0.47 0.51 0.00 0.00 175.35 175.74 3d4j s TYR 23 N -0.76 3.24 -0.29 3.18 5.04 -1.26 -4.83 117.35 121.67 3d4j s TYR 23 Ca 0.50 0.52 0.04 0.00 -2.44 0.00 0.00 57.07 55.69 3d4j s TYR 23 Cb -0.37 -2.77 0.18 0.00 0.35 0.00 0.00 41.96 39.36 3d4j s TYR 23 CO 0.46 -0.34 0.51 -0.46 -1.34 0.00 0.00 175.55 174.38 3d4j s TRP 24 N 2.33 -1.49 0.00 4.97 -0.11 -1.26 -5.12 118.94 118.26 3d4j s TRP 24 Ca 0.20 0.78 0.00 0.00 1.22 0.00 0.00 56.10 58.31 3d4j s TRP 24 Cb -0.16 0.12 0.00 0.00 -1.50 0.00 0.00 33.47 31.94 3d4j s TRP 24 CO 0.10 -1.04 0.00 0.41 -4.62 0.00 0.00 176.95 171.81 3d4j n GLY 25 N 5.39 3.74 3.82 5.86 0.00 -1.26 -4.85 105.19 117.89 3d4j n GLY 25 Ca 0.03 -1.25 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 3d4j n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d4j s LYS 26 N -5.68 3.08 -0.00 1.61 1.02 -1.26 -1.05 119.74 117.45 3d4j s LYS 26 Ca 0.00 -0.60 0.16 0.00 0.02 0.00 0.00 55.97 55.56 3d4j s LYS 26 Cb 0.00 -2.84 -0.18 0.00 -0.52 0.00 0.00 37.83 34.29 3d4j s LYS 26 CO 0.00 0.58 0.68 2.89 -0.92 0.00 0.00 175.35 178.59 3d4j n ARG 27 N 0.44 1.49 -3.28 1.68 1.85 0.33 -4.68 116.66 114.49 3d4j n ARG 27 Ca -0.08 -0.01 -0.05 0.00 -1.00 0.00 0.00 57.85 56.71 3d4j n ARG 27 Cb 0.51 -1.29 -0.05 0.00 -1.05 0.00 0.00 32.46 30.59 3d4j n ARG 27 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3d4j s ASP 28 N -2.64 -0.22 0.52 2.89 -1.08 -1.14 -4.98 116.67 110.01 3d4j s ASP 28 Ca 0.05 0.21 0.30 0.00 -0.52 0.00 0.00 52.55 52.60 3d4j s ASP 28 Cb 0.12 1.41 1.16 0.00 -1.46 0.00 0.00 42.92 44.16 3d4j s ASP 28 CO 0.68 -0.30 1.91 -0.33 0.52 0.00 0.00 175.17 177.64 3d4j h GLU 29 N 8.12 0.00 0.21 4.34 4.39 -1.88 -1.17 114.58 128.59 3d4j h GLU 29 Ca -0.16 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 3d4j h GLU 29 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3d4j h GLU 29 CO 0.26 0.05 -0.10 1.49 -1.16 0.00 0.00 179.01 179.55 3d4j h GLU 30 N 0.00 -0.27 -0.00 2.33 4.57 -1.98 -3.33 114.58 115.91 3d4j h GLU 30 Ca -0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 3d4j h GLU 30 Cb 0.62 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 3d4j h GLU 30 CO 0.01 -0.11 -0.17 1.28 -1.18 0.00 0.00 179.01 178.84 3d4j n LEU 31 N -4.96 0.25 -2.70 1.64 4.77 -1.25 -4.97 117.00 109.78 3d4j n LEU 31 Ca -0.04 0.24 -0.01 0.00 -0.03 0.00 0.00 56.01 56.17 3d4j n LEU 31 Cb 0.14 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 3d4j n LEU 31 CO 0.11 0.06 0.25 0.52 -1.33 0.00 0.00 177.39 177.00 3d4j n VAL 32 N -1.37 -8.29 -4.97 4.08 0.31 -0.56 -4.61 118.33 102.92 3d4j n VAL 32 Ca 0.09 -0.09 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 3d4j n VAL 32 Cb 0.32 -6.24 -0.16 0.00 -0.91 0.00 0.00 33.84 26.85 3d4j n VAL 32 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3d4j s LEU 33 N -3.41 2.26 0.49 7.52 1.43 -0.55 -4.90 118.68 121.51 3d4j s LEU 33 Ca 0.02 -0.51 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 3d4j s LEU 33 Cb -0.01 -1.47 -0.08 0.00 0.03 0.00 0.00 46.19 44.66 3d4j s LEU 33 CO 0.59 0.14 1.00 -2.16 0.23 0.00 0.00 176.35 176.15 3d4j s PRO 34 N 0.47 3.91 0.00 1.29 0.04 -1.26 0.12 135.00 139.57 3d4j s PRO 34 Ca -0.14 1.15 0.28 0.00 0.04 0.00 0.00 61.00 62.33 3d4j s PRO 34 Cb -0.17 -2.12 1.28 0.00 0.04 0.00 0.00 34.50 33.53 3d4j s PRO 34 CO 0.06 -0.31 1.92 0.44 0.04 0.00 0.00 177.00 179.15 3d4j n ILE 35 N -1.17 0.09 -3.58 0.56 -5.35 -0.22 -4.49 119.36 105.20 3d4j n ILE 35 Ca 0.08 0.02 -0.11 0.00 -0.27 0.00 0.00 62.75 62.47 3d4j n ILE 35 Cb 0.53 -0.55 -0.04 0.00 -1.74 0.00 0.00 39.64 37.85 3d4j n ILE 35 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3d4j s ASN 36 N -2.82 -0.34 0.72 7.28 2.20 -1.26 -4.79 114.94 115.94 3d4j s ASN 36 Ca 0.19 -0.24 -0.10 0.00 -0.94 0.00 0.00 52.86 51.77 3d4j s ASN 36 Cb 0.18 0.53 0.04 0.00 -2.00 0.00 0.00 41.25 40.00 3d4j s ASN 36 CO 0.47 -0.91 1.09 -0.44 -2.94 0.00 0.00 177.10 174.36 3d4j s SER 37 N -2.80 5.11 0.03 3.54 0.01 -1.26 -4.57 113.70 113.75 3d4j s SER 37 Ca 0.03 0.89 -0.03 0.00 1.31 0.00 0.00 55.95 58.15 3d4j s SER 37 Cb 0.01 -1.60 -0.02 0.00 0.21 0.00 0.00 66.02 64.62 3d4j s SER 37 CO -0.11 -1.50 0.03 -0.94 0.41 0.00 0.00 173.24 171.12 3d4j s SER 38 N -4.44 0.22 -0.06 2.44 1.04 -0.88 -4.77 113.70 107.26 3d4j s SER 38 Ca 0.59 -0.53 0.03 0.00 0.48 0.00 0.00 55.95 56.52 3d4j s SER 38 Cb -0.11 0.16 0.01 0.00 0.10 0.00 0.00 66.02 66.18 3d4j s SER 38 CO 0.49 -0.41 -0.14 -0.22 0.98 0.00 0.00 173.24 173.94 3d4j s LEU 39 N -1.83 1.78 0.22 2.42 1.98 -1.04 0.02 118.68 122.22 3d4j s LEU 39 Ca -0.10 -0.33 -0.00 0.00 -2.89 0.00 0.00 54.13 50.82 3d4j s LEU 39 Cb -0.05 -0.89 -0.04 0.00 0.66 0.00 0.00 46.19 45.87 3d4j s LEU 39 CO -0.03 0.09 0.12 -0.94 -1.89 0.00 0.00 176.35 173.70 3d4j s SER 40 N 0.38 0.48 -0.13 3.68 1.04 0.13 -0.39 113.70 118.89 3d4j s SER 40 Ca -0.10 -1.39 0.00 0.00 0.48 0.00 0.00 55.95 54.95 3d4j s SER 40 Cb -0.14 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.28 3d4j s SER 40 CO 0.03 -0.80 -0.15 -0.69 0.98 0.00 0.00 173.24 172.61 3d4j s VAL 41 N -4.03 2.91 -0.17 5.02 1.01 -0.34 -0.95 120.40 123.85 3d4j s VAL 41 Ca 0.38 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.38 3d4j s VAL 41 Cb 0.07 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 3d4j s VAL 41 CO 0.12 0.53 0.90 -0.89 0.00 0.00 0.00 175.10 175.77 3d4j s THR 42 N 0.35 4.82 0.47 3.92 2.01 0.33 -1.11 115.64 126.44 3d4j s THR 42 Ca -0.12 1.78 -0.12 0.00 0.31 0.00 0.00 61.69 63.54 3d4j s THR 42 Cb -0.16 -4.20 -0.06 0.00 0.01 0.00 0.00 72.50 68.08 3d4j s THR 42 CO 0.06 -0.02 0.86 -0.76 -0.69 0.00 0.00 174.62 174.08 3d4j s LEU 43 N 2.33 3.67 -0.04 4.42 1.43 -0.75 -0.92 118.68 128.83 3d4j s LEU 43 Ca 0.41 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.48 3d4j s LEU 43 Cb -0.17 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 41.82 3d4j s LEU 43 CO 0.12 -0.53 1.24 -2.28 0.23 0.00 0.00 176.35 175.13 3d4j s HIS 44 N -2.59 3.14 -0.13 0.29 2.46 -0.50 -4.14 115.29 113.81 3d4j s HIS 44 Ca 0.53 1.15 0.22 0.00 0.47 0.00 0.00 55.06 57.43 3d4j s HIS 44 Cb -0.10 -3.47 1.17 0.00 -0.13 0.00 0.00 32.58 30.06 3d4j s HIS 44 CO 0.36 -1.52 1.65 1.96 -2.47 0.00 0.00 174.74 174.72 3d4j h GLN 45 N 7.49 0.00 -0.91 2.88 4.20 -1.87 -0.28 115.11 126.63 3d4j h GLN 45 Ca -0.35 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.36 3d4j h GLN 45 Cb 1.17 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.90 3d4j h GLN 45 CO 0.88 0.00 0.59 -0.44 -0.67 0.00 0.00 178.83 179.19 3d4j h ASP 46 N 0.00 1.06 0.00 1.46 3.32 -1.98 -3.32 116.42 116.95 3d4j h ASP 46 Ca 0.00 -0.04 -0.17 0.00 0.02 0.00 0.00 57.03 56.85 3d4j h ASP 46 Cb 0.08 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 3d4j h ASP 46 CO 0.00 0.77 -1.10 0.00 -1.72 0.00 0.00 179.24 177.20 3d4j n GLN 47 N -4.44 0.53 -5.02 3.56 3.00 -0.18 -4.97 117.38 109.87 3d4j n GLN 47 Ca 0.10 0.53 -0.29 0.00 -0.01 0.00 0.00 57.00 57.34 3d4j n GLN 47 Cb 0.02 -1.70 -0.16 0.00 0.00 0.00 0.00 30.24 28.39 3d4j n GLN 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3d4j s LEU 48 N -7.96 1.97 0.09 1.08 1.43 -0.81 -4.95 118.68 109.54 3d4j s LEU 48 Ca -0.25 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.17 3d4j s LEU 48 Cb 0.05 -1.15 0.08 0.00 0.03 0.00 0.00 46.19 45.20 3d4j s LEU 48 CO 0.46 0.18 0.74 -1.59 0.23 0.00 0.00 176.35 176.37 3d4j s LYS 49 N 0.03 1.10 -0.16 1.70 -2.85 -1.26 -3.59 119.74 114.71 3d4j s LYS 49 Ca -0.06 -0.42 0.01 0.00 -1.00 0.00 0.00 55.97 54.49 3d4j s LYS 49 Cb -0.13 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.13 3d4j s LYS 49 CO 0.03 -0.48 -0.17 0.99 0.10 0.00 0.00 175.35 175.82 3d4j s THR 50 N -3.47 2.50 -0.14 3.79 2.01 -0.34 -2.37 115.64 117.62 3d4j s THR 50 Ca 0.04 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.12 3d4j s THR 50 Cb -0.01 -2.05 -0.05 0.00 0.01 0.00 0.00 72.50 70.41 3d4j s THR 50 CO -0.10 0.52 0.18 -0.89 -0.69 0.00 0.00 174.62 173.64 3d4j s THR 51 N 0.88 5.41 -0.03 -0.82 2.01 0.22 -1.31 115.64 122.00 3d4j s THR 51 Ca -0.04 0.29 0.01 0.00 0.31 0.00 0.00 61.69 62.26 3d4j s THR 51 Cb -0.15 -3.48 0.02 0.00 0.01 0.00 0.00 72.50 68.90 3d4j s THR 51 CO -0.02 0.52 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.53 3d4j s THR 52 N -0.34 0.25 -0.06 -0.82 2.01 -0.25 -0.79 115.64 115.64 3d4j s THR 52 Ca 0.13 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.21 3d4j s THR 52 Cb -0.12 -0.32 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 3d4j s THR 52 CO 0.03 0.15 -0.23 -0.89 -0.69 0.00 0.00 174.62 172.99 3d4j s THR 53 N 0.90 1.92 0.03 -0.82 2.01 -0.21 -1.39 115.64 118.07 3d4j s THR 53 Ca -0.10 -0.98 0.04 0.00 0.31 0.00 0.00 61.69 60.96 3d4j s THR 53 Cb -0.13 -1.63 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 3d4j s THR 53 CO -0.01 0.53 -0.11 0.00 -0.69 0.00 0.00 174.62 174.34 3d4j s ALA 54 N -0.06 0.94 -0.00 7.40 0.00 -0.44 -1.25 121.76 128.34 3d4j s ALA 54 Ca -0.05 -0.72 -0.03 0.00 0.00 0.00 0.00 51.96 51.16 3d4j s ALA 54 Cb -0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 22.85 3d4j s ALA 54 CO 0.04 0.16 0.05 0.08 0.00 0.00 0.00 175.76 176.08 3d4j s VAL 55 N -0.85 0.05 0.02 0.00 1.01 -0.63 -1.42 120.40 118.59 3d4j s VAL 55 Ca -0.01 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 61.61 3d4j s VAL 55 Cb -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 3d4j s VAL 55 CO 0.01 -0.23 -0.19 0.27 0.00 0.00 0.00 175.10 174.96 3d4j s ILE 56 N -0.72 1.49 0.00 2.22 -4.36 -1.26 -1.74 121.20 116.83 3d4j s ILE 56 Ca -0.08 -0.99 0.00 0.00 -0.26 0.00 0.00 60.65 59.32 3d4j s ILE 56 Cb -0.05 -1.28 0.00 0.00 1.25 0.00 0.00 42.46 42.39 3d4j s ILE 56 CO 0.00 0.26 0.00 -0.24 0.24 0.00 0.00 174.94 175.20 3d4j n SER 57 N 2.18 -0.80 0.00 4.36 2.88 0.18 -4.80 113.62 117.61 3d4j n SER 57 Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 3d4j n SER 57 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 3d4j n SER 57 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3d4j n LYS 58 N -0.15 0.00 -3.21 -1.46 4.81 -1.26 -3.74 118.16 113.16 3d4j n LYS 58 Ca 0.00 0.08 -0.11 0.00 -0.87 0.00 0.00 58.31 57.41 3d4j n LYS 58 Cb 0.00 -2.56 0.05 0.00 0.02 0.00 0.00 35.03 32.54 3d4j n LYS 58 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 3d4j n ASP 59 N 1.42 -6.96 -4.51 3.14 2.03 -1.26 -4.95 116.55 105.46 3d4j n ASP 59 Ca 0.00 -0.53 -0.30 0.00 0.52 0.00 0.00 54.79 54.48 3d4j n ASP 59 Cb 0.28 -5.17 0.21 0.00 -0.72 0.00 0.00 41.12 35.72 3d4j n ASP 59 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3d4j n PHE 60 N -2.81 -0.57 -1.31 -0.67 3.72 -1.24 -4.82 117.46 109.75 3d4j n PHE 60 Ca -0.05 0.10 -0.37 0.00 -0.05 0.00 0.00 57.45 57.08 3d4j n PHE 60 Cb 0.58 -1.80 -0.02 0.00 -0.94 0.00 0.00 39.48 37.30 3d4j n PHE 60 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3d4j n THR 61 N -4.56 3.53 -4.27 4.37 -2.24 -1.26 -4.89 114.28 104.97 3d4j n THR 61 Ca 0.06 -2.41 0.00 0.00 -2.27 0.00 0.00 64.05 59.43 3d4j n THR 61 Cb 0.54 -2.51 0.00 0.00 -2.10 0.00 0.00 70.33 66.27 3d4j n THR 61 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d4j n GLU 62 N 4.69 0.00 -3.88 -0.78 1.02 -1.26 -4.70 120.64 115.73 3d4j n GLU 62 Ca 0.63 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 57.41 3d4j n GLU 62 Cb 0.27 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.56 3d4j n GLU 62 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d4j s ASP 63 N -4.00 4.79 -0.02 1.62 1.01 -1.26 -3.94 116.67 114.87 3d4j s ASP 63 Ca 0.00 -0.26 0.01 0.00 0.71 0.00 0.00 52.55 53.01 3d4j s ASP 63 Cb 0.00 -1.84 0.01 0.00 1.01 0.00 0.00 42.92 42.10 3d4j s ASP 63 CO 0.00 -0.01 -0.03 -0.13 0.21 0.00 0.00 175.17 175.22 3d4j s ARG 64 N 1.42 0.47 -0.07 8.23 0.52 -1.14 -4.73 118.95 123.65 3d4j s ARG 64 Ca 0.05 -0.07 0.04 0.00 -0.52 0.00 0.00 55.73 55.24 3d4j s ARG 64 Cb -0.15 -0.53 -0.00 0.00 0.52 0.00 0.00 34.95 34.80 3d4j s ARG 64 CO 0.01 -0.03 -0.21 0.42 0.02 0.00 0.00 175.30 175.51 3d4j s ILE 65 N 0.54 1.76 -0.06 1.52 1.01 -1.26 -1.72 121.20 122.99 3d4j s ILE 65 Ca -0.06 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.74 3d4j s ILE 65 Cb -0.09 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 3d4j s ILE 65 CO -0.01 0.49 -0.13 0.26 0.00 0.00 0.00 174.94 175.56 3d4j s TRP 66 N 0.18 2.75 -0.15 3.97 0.51 0.17 -2.75 118.94 123.62 3d4j s TRP 66 Ca -0.10 -0.14 -0.02 0.00 -2.12 0.00 0.00 56.10 53.71 3d4j s TRP 66 Cb -0.15 -1.65 0.05 0.00 -0.81 0.00 0.00 33.47 30.90 3d4j s TRP 66 CO 0.05 0.20 0.02 -0.51 -0.51 0.00 0.00 176.95 176.20 3d4j s LEU 67 N -0.70 1.01 0.00 2.99 2.01 -0.95 -0.09 118.68 122.95 3d4j s LEU 67 Ca 0.11 -0.56 0.00 0.00 0.01 0.00 0.00 54.13 53.68 3d4j s LEU 67 Cb -0.11 -0.57 0.00 0.00 0.01 0.00 0.00 46.19 45.52 3d4j s LEU 67 CO 0.01 -0.26 0.00 0.59 1.01 0.00 0.00 176.35 177.70 3d4j n ASN 68 N 5.07 0.00 0.00 2.29 3.02 0.13 -2.63 115.26 123.14 3d4j n ASN 68 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 3d4j n ASN 68 Cb 0.48 -1.09 0.00 0.00 -0.61 0.00 0.00 39.78 38.56 3d4j n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d4j n GLY 69 N -1.69 2.10 3.68 7.41 0.00 -1.26 -5.07 105.19 110.36 3d4j n GLY 69 Ca 0.00 -0.24 -0.45 0.00 0.00 0.00 0.00 46.02 45.33 3d4j n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d4j n ARG 70 N 0.00 2.16 -2.94 1.61 3.00 -1.08 -4.89 116.66 114.52 3d4j n ARG 70 Ca 0.00 0.77 -0.44 0.00 -0.01 0.00 0.00 57.85 58.17 3d4j n ARG 70 Cb 0.00 -2.49 -0.00 0.00 0.00 0.00 0.00 32.46 29.96 3d4j n ARG 70 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 3d4j s GLU 71 N 0.19 4.02 1.11 5.56 2.12 -1.26 -2.23 118.70 128.21 3d4j s GLU 71 Ca 0.73 -2.45 -0.19 0.00 0.36 0.00 0.00 54.97 53.42 3d4j s GLU 71 Cb -0.65 -5.05 0.10 0.00 0.26 0.00 0.00 34.13 28.80 3d4j s GLU 71 CO 0.44 -1.77 0.01 0.39 -0.54 0.00 0.00 175.26 173.78 3d4j n GLU 72 N 5.81 -1.54 -4.18 4.30 4.71 -1.11 -4.94 120.64 123.69 3d4j n GLU 72 Ca 0.35 -0.43 -0.36 0.00 -0.01 0.00 0.00 57.16 56.71 3d4j n GLU 72 Cb 0.44 -1.70 -0.08 0.00 -1.01 0.00 0.00 31.44 29.08 3d4j n GLU 72 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3d4j s ASP 73 N -1.84 5.64 0.10 1.62 2.15 -1.26 -4.39 116.67 118.69 3d4j s ASP 73 Ca 0.56 0.24 0.17 0.00 0.43 0.00 0.00 52.55 53.95 3d4j s ASP 73 Cb -0.12 -1.71 0.72 0.00 -0.30 0.00 0.00 42.92 41.50 3d4j s ASP 73 CO 0.66 0.37 1.52 0.52 -0.17 0.00 0.00 175.17 178.07 3d4j n VAL 74 N 2.22 1.03 0.17 1.11 0.31 -1.26 -2.75 118.33 119.16 3d4j n VAL 74 Ca -0.19 0.29 0.02 0.00 -0.01 0.00 0.00 64.34 64.45 3d4j n VAL 74 Cb 0.54 -1.13 0.31 0.00 -0.91 0.00 0.00 33.84 32.64 3d4j n VAL 74 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3d4j h GLY 75 N 2.09 0.00 -6.67 2.92 0.00 -1.97 -3.35 103.07 96.08 3d4j h GLY 75 Ca 0.00 0.00 -0.85 0.00 0.00 0.00 0.00 47.33 46.48 3d4j h GLY 75 CO 0.00 0.00 0.52 -1.06 0.00 0.00 0.00 176.54 176.00 3d4j n GLN 76 N -3.96 0.00 -0.25 4.80 6.02 -1.11 -4.74 117.38 118.14 3d4j n GLN 76 Ca -0.02 0.00 0.26 0.00 -0.01 0.00 0.00 57.00 57.24 3d4j n GLN 76 Cb 0.47 -1.48 0.63 0.00 1.02 0.00 0.00 30.24 30.88 3d4j n GLN 76 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3d4j h PRO 77 N 4.45 0.18 0.38 -1.09 0.13 -1.93 -1.83 132.00 132.28 3d4j h PRO 77 Ca -0.45 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 3d4j h PRO 77 Cb 1.37 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.46 3d4j h PRO 77 CO 0.89 0.12 -0.18 0.00 -0.23 0.00 0.00 178.00 178.59 3d4j h ARG 78 N 0.19 -0.49 -0.70 0.86 2.47 -1.87 -1.99 114.38 112.84 3d4j h ARG 78 Ca 0.50 0.03 0.07 0.00 -1.26 0.00 0.00 59.98 59.32 3d4j h ARG 78 Cb 1.64 0.11 -0.06 0.00 -1.65 0.00 0.00 29.97 30.01 3d4j h ARG 78 CO -0.11 -0.18 0.38 -0.07 0.56 0.00 0.00 179.97 180.55 3d4j h LEU 79 N -0.84 0.55 -0.10 3.04 3.38 -1.73 -1.61 115.31 118.01 3d4j h LEU 79 Ca -0.05 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3d4j h LEU 79 Cb 0.54 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 3d4j h LEU 79 CO 0.09 0.35 -0.39 -0.61 0.09 0.00 0.00 178.44 177.96 3d4j h GLN 80 N 0.69 -0.47 -0.99 1.13 4.15 -1.30 0.69 115.11 119.00 3d4j h GLN 80 Ca 0.32 0.03 0.10 0.00 0.77 0.00 0.00 58.65 59.88 3d4j h GLN 80 Cb 0.24 0.11 -0.08 0.00 0.21 0.00 0.00 27.48 27.96 3d4j h GLN 80 CO -0.21 -0.31 0.63 0.00 -1.93 0.00 0.00 178.83 177.01 3d4j h ALA 81 N 0.17 1.51 0.20 3.38 0.00 -0.83 0.59 119.26 124.27 3d4j h ALA 81 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3d4j h ALA 81 Cb 0.61 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3d4j h ALA 81 CO -0.37 0.28 -0.09 0.00 0.00 0.00 0.00 179.25 179.07 3d4j h LEU 83 N -0.73 0.00 0.49 0.00 3.38 0.66 -2.44 115.31 116.68 3d4j h LEU 83 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3d4j h LEU 83 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3d4j h LEU 83 CO 0.04 0.00 -0.23 0.03 0.09 0.00 0.00 178.44 178.37 3d4j h ARG 84 N 0.00 -0.63 -0.73 1.13 3.08 -0.75 -2.80 114.38 113.67 3d4j h ARG 84 Ca 0.13 0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.39 3d4j h ARG 84 Cb 0.60 0.14 -0.13 0.00 0.08 0.00 0.00 29.97 30.67 3d4j h ARG 84 CO -0.00 -0.42 -0.00 0.93 -1.07 0.00 0.00 179.97 179.41 3d4j h GLU 85 N -1.15 0.10 -0.27 0.04 4.39 -0.95 1.17 114.58 117.91 3d4j h GLU 85 Ca -0.07 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 3d4j h GLU 85 Cb 0.50 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 3d4j h GLU 85 CO 0.11 0.07 0.12 -0.84 -1.16 0.00 0.00 179.01 177.30 3d4j h ILE 86 N 0.10 1.16 -0.05 3.13 3.07 -1.59 0.40 117.51 123.73 3d4j h ILE 86 Ca 0.40 -0.49 -0.14 0.00 1.55 0.00 0.00 64.86 66.18 3d4j h ILE 86 Cb 0.69 0.99 -0.01 0.00 -0.27 0.00 0.00 36.82 38.21 3d4j h ILE 86 CO -0.65 0.17 -0.60 0.03 -1.05 0.00 0.00 178.15 176.05 3d4j h ARG 87 N 0.29 0.16 0.00 0.16 3.08 -0.91 -2.37 114.38 114.79 3d4j h ARG 87 Ca 0.09 -0.11 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 3d4j h ARG 87 Cb 0.15 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3d4j h ARG 87 CO -0.01 0.71 -0.35 0.00 -1.07 0.00 0.00 179.97 179.25 3d4j n LEU 89 N -3.49 0.60 -0.68 0.00 0.00 0.11 -4.15 117.00 109.39 3d4j n LEU 89 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 56.01 55.98 3d4j n LEU 89 Cb 0.50 -0.20 0.00 0.00 0.00 0.00 0.00 43.42 43.72 3d4j n LEU 89 CO 0.36 0.12 0.21 0.00 0.00 0.00 0.00 177.39 178.08 3d4j n ALA 90 N -0.99 2.01 -0.11 1.96 0.00 -0.93 -4.95 120.51 117.49 3d4j n ALA 90 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3d4j n ALA 90 Cb 0.31 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.76 3d4j n ALA 90 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 3d4j n ARG 91 N 0.37 0.00 -2.25 0.00 0.00 -1.26 -5.11 116.66 108.41 3d4j n ARG 91 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.85 57.71 3d4j n ARG 91 Cb 0.21 0.00 -0.01 0.00 -0.00 0.00 0.00 32.46 32.67 3d4j n ARG 91 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3d4j n SER 107 N 0.00 -4.38 0.05 2.89 2.88 -1.26 -5.18 113.62 108.62 3d4j n SER 107 Ca 0.00 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 3d4j n SER 107 Cb 0.00 -3.53 0.00 0.00 -0.75 0.00 0.00 64.21 59.93 3d4j n SER 107 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3d4j s LYS 109 N -2.00 4.44 0.11 0.00 2.47 -1.26 -4.91 119.74 118.59 3d4j s LYS 109 Ca 0.00 1.32 0.07 0.00 -1.56 0.00 0.00 55.97 55.80 3d4j s LYS 109 Cb 0.00 -2.64 -0.04 0.00 -1.46 0.00 0.00 37.83 33.69 3d4j s LYS 109 CO 0.00 0.15 -0.17 0.08 0.16 0.00 0.00 175.35 175.57 3d4j s VAL 110 N -1.73 1.46 -0.03 4.02 1.01 -1.25 -0.65 120.40 123.23 3d4j s VAL 110 Ca 0.54 -1.60 0.01 0.00 0.00 0.00 0.00 61.98 60.92 3d4j s VAL 110 Cb -0.17 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.75 3d4j s VAL 110 CO 0.22 -0.26 -0.03 -1.00 0.00 0.00 0.00 175.10 174.04 3d4j s HIS 111 N -1.65 0.49 -0.01 5.22 3.76 -0.71 -2.87 115.29 119.52 3d4j s HIS 111 Ca 0.07 -0.09 0.00 0.00 -0.15 0.00 0.00 55.06 54.89 3d4j s HIS 111 Cb -0.08 -0.45 0.01 0.00 1.11 0.00 0.00 32.58 33.17 3d4j s HIS 111 CO 0.04 -0.11 -0.01 0.08 -0.85 0.00 0.00 174.74 173.88 3d4j s VAL 112 N 0.65 0.12 -0.05 -0.90 1.01 -0.70 -1.60 120.40 118.93 3d4j s VAL 112 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.89 3d4j s VAL 112 Cb -0.11 -0.13 0.02 0.00 0.00 0.00 0.00 36.38 36.16 3d4j s VAL 112 CO -0.01 0.06 -0.04 0.00 0.00 0.00 0.00 175.10 175.11 3d4j s ALA 113 N 0.21 0.72 0.12 5.51 0.00 -0.38 0.42 121.76 128.36 3d4j s ALA 113 Ca -0.02 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.88 3d4j s ALA 113 Cb -0.04 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 3d4j s ALA 113 CO -0.01 -0.15 -0.11 0.45 0.00 0.00 0.00 175.76 175.95 3d4j s SER 114 N 1.22 1.67 0.16 0.00 0.15 0.87 -1.05 113.70 116.72 3d4j s SER 114 Ca -0.06 -0.89 -0.15 0.00 0.70 0.00 0.00 55.95 55.55 3d4j s SER 114 Cb -0.14 -0.01 0.02 0.00 -1.71 0.00 0.00 66.02 64.18 3d4j s SER 114 CO -0.02 -0.27 0.42 0.54 1.20 0.00 0.00 173.24 175.11 3d4j s VAL 115 N -2.75 0.05 0.13 4.45 0.11 0.03 -0.69 120.40 121.73 3d4j s VAL 115 Ca 0.10 -0.87 -0.05 0.00 -2.93 0.00 0.00 61.98 58.23 3d4j s VAL 115 Cb -0.01 -1.51 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 3d4j s VAL 115 CO 0.01 -0.24 0.15 0.54 -3.33 0.00 0.00 175.10 172.23 3d4j s ASN 116 N -2.87 0.20 -0.16 3.54 2.20 -1.26 0.73 114.94 117.31 3d4j s ASN 116 Ca 0.09 -0.97 0.16 0.00 -0.94 0.00 0.00 52.86 51.19 3d4j s ASN 116 Cb 0.01 0.35 0.55 0.00 -2.00 0.00 0.00 41.25 40.16 3d4j s ASN 116 CO -0.05 -0.78 1.46 -0.46 -2.94 0.00 0.00 177.10 174.33 3d4j n ASN 117 N -0.11 4.07 -4.46 3.54 2.04 -1.00 -4.95 115.26 114.39 3d4j n ASN 117 Ca -0.09 -2.85 -0.34 0.00 -0.44 0.00 0.00 54.58 50.86 3d4j n ASN 117 Cb 0.63 -0.53 -0.12 0.00 -2.53 0.00 0.00 39.78 37.23 3d4j n ASN 117 CO 0.00 0.00 0.00 0.72 -0.44 0.00 0.00 177.26 177.54 3d4j s PHE 118 N -2.54 3.02 0.44 -2.53 -0.71 -1.26 -4.92 117.98 109.47 3d4j s PHE 118 Ca 0.42 -0.42 -0.26 0.00 -1.04 0.00 0.00 56.93 55.63 3d4j s PHE 118 Cb 0.32 -2.01 -0.09 0.00 -1.21 0.00 0.00 43.02 40.03 3d4j s PHE 118 CO 0.12 -0.16 1.44 -1.25 -1.34 0.00 0.00 175.22 174.03 3d4j s PRO 119 N 0.69 3.77 0.19 1.99 0.04 -1.26 -4.84 135.00 135.59 3d4j s PRO 119 Ca -0.01 2.46 0.12 0.00 0.04 0.00 0.00 61.00 63.60 3d4j s PRO 119 Cb -0.14 -2.72 0.67 0.00 0.04 0.00 0.00 34.50 32.35 3d4j s PRO 119 CO 0.02 -0.76 1.36 0.25 0.04 0.00 0.00 177.00 177.91 3d4j n THR 120 N -0.06 1.36 0.00 1.26 -2.24 -1.26 -0.28 114.28 113.06 3d4j n THR 120 Ca 0.04 0.64 -0.20 0.00 -2.27 0.00 0.00 64.05 62.26 3d4j n THR 120 Cb 0.41 -1.64 -0.14 0.00 -2.10 0.00 0.00 70.33 66.86 3d4j n THR 120 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d4j n ALA 121 N -1.64 0.93 -0.31 6.98 0.00 -1.26 -4.68 120.51 120.53 3d4j n ALA 121 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 3d4j n ALA 121 Cb 0.05 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.82 3d4j n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d4j n ALA 122 N -2.97 0.00 -2.80 0.00 0.00 0.61 -4.88 120.51 110.47 3d4j n ALA 122 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.13 3d4j n ALA 122 Cb 1.05 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.52 3d4j n ALA 122 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d4j n GLY 123 N -0.21 5.21 0.00 0.00 0.00 -1.26 -4.61 105.19 104.32 3d4j n GLY 123 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 3d4j n GLY 123 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d4j n LEU 124 N 0.00 0.00 -1.98 0.99 4.77 -1.26 -4.89 117.00 114.64 3d4j n LEU 124 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 3d4j n LEU 124 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3d4j n LEU 124 CO 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 177.39 176.03 3d4j n ALA 125 N -3.00 -0.47 0.00 -1.18 0.00 -1.26 -4.69 120.51 109.92 3d4j n ALA 125 Ca 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.32 3d4j n ALA 125 Cb 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 19.45 18.73 3d4j n ALA 125 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3d4j h SER 126 N -0.16 0.02 0.01 0.00 0.87 -1.97 -3.29 113.55 109.03 3d4j h SER 126 Ca -0.11 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.42 3d4j h SER 126 Cb 0.50 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 3d4j h SER 126 CO 0.16 1.03 -0.01 0.28 -0.53 0.00 0.00 176.83 177.76 3d4j h SER 127 N 0.00 -0.01 0.20 6.23 0.02 -2.00 -2.19 113.55 115.80 3d4j h SER 127 Ca -0.21 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 3d4j h SER 127 Cb 1.95 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.46 3d4j h SER 127 CO 0.10 0.29 -0.38 0.00 -1.14 0.00 0.00 176.83 175.69 3d4j h ALA 128 N 0.66 -0.95 -0.81 3.77 0.00 -1.91 -1.39 119.26 118.64 3d4j h ALA 128 Ca -0.00 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.98 3d4j h ALA 128 Cb 0.31 0.71 -0.15 0.00 0.00 0.00 0.00 17.79 18.67 3d4j h ALA 128 CO 0.00 -1.01 -0.11 0.00 0.00 0.00 0.00 179.25 178.13 3d4j h ALA 129 N -0.94 0.68 -0.33 0.00 0.00 -1.63 0.11 119.26 117.16 3d4j h ALA 129 Ca -0.02 0.29 0.03 0.00 0.00 0.00 0.00 54.91 55.21 3d4j h ALA 129 Cb 0.59 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 3d4j h ALA 129 CO -0.15 -0.43 0.15 0.78 0.00 0.00 0.00 179.25 179.60 3d4j h GLY 130 N 0.03 0.43 2.00 0.00 0.00 -0.82 -1.60 103.07 103.11 3d4j h GLY 130 Ca 0.42 -0.10 -0.10 0.00 0.00 0.00 0.00 47.33 47.55 3d4j h GLY 130 CO -0.78 0.07 -0.46 -0.97 0.00 0.00 0.00 176.54 174.39 3d4j h TYR 131 N 0.31 0.00 -0.14 5.60 -1.99 -0.15 -1.56 116.97 119.03 3d4j h TYR 131 Ca 0.14 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.85 3d4j h TYR 131 Cb 0.07 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.80 3d4j h TYR 131 CO -0.11 0.46 0.01 0.00 -0.00 0.00 0.00 178.16 178.52 3d4j h ALA 132 N 1.54 0.19 -0.12 3.88 0.00 -0.55 0.37 119.26 124.55 3d4j h ALA 132 Ca -0.00 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 3d4j h ALA 132 Cb 1.11 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3d4j h ALA 132 CO 0.06 -0.13 -0.30 0.00 0.00 0.00 0.00 179.25 178.88 3d4j h LEU 134 N 0.20 0.34 -0.93 0.00 5.85 -1.03 -0.65 115.31 119.09 3d4j h LEU 134 Ca 0.03 -0.40 -0.07 0.00 0.84 0.00 0.00 57.88 58.28 3d4j h LEU 134 Cb 0.63 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 3d4j h LEU 134 CO 0.05 0.67 0.05 0.00 -0.34 0.00 0.00 178.44 178.86 3d4j h ALA 135 N 0.68 1.12 -0.03 1.25 0.00 -0.66 -2.31 119.26 119.32 3d4j h ALA 135 Ca 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 3d4j h ALA 135 Cb 0.54 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3d4j h ALA 135 CO 0.02 0.57 -0.05 -0.92 0.00 0.00 0.00 179.25 178.87 3d4j h TYR 136 N 0.79 0.11 0.52 0.00 3.20 -1.05 -0.07 116.97 120.47 3d4j h TYR 136 Ca 0.16 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 3d4j h TYR 136 Cb 0.40 -0.02 0.01 0.00 1.54 0.00 0.00 36.73 38.66 3d4j h TYR 136 CO 0.02 0.63 -0.25 1.15 -1.64 0.00 0.00 178.16 178.07 3d4j h THR 137 N -0.44 0.49 -0.39 1.81 2.02 -1.11 -2.69 112.91 112.59 3d4j h THR 137 Ca 0.00 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 3d4j h THR 137 Cb 0.62 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 3d4j h THR 137 CO 0.01 0.00 0.04 -0.07 0.37 0.00 0.00 175.52 175.87 3d4j h LEU 138 N -0.70 0.57 -1.10 2.58 3.38 -1.53 -2.12 115.31 116.40 3d4j h LEU 138 Ca -0.07 -0.10 0.19 0.00 0.09 0.00 0.00 57.88 57.99 3d4j h LEU 138 Cb 0.53 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 3d4j h LEU 138 CO 0.12 0.61 0.61 0.00 0.09 0.00 0.00 178.44 179.87 3d4j h ALA 139 N 1.47 1.77 -0.71 1.53 0.00 -0.72 0.21 119.26 122.79 3d4j h ALA 139 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3d4j h ALA 139 Cb 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3d4j h ALA 139 CO 0.01 -0.12 0.00 2.89 0.00 0.00 0.00 179.25 182.03 3d4j n ARG 140 N -4.71 2.72 0.01 0.00 1.85 -0.84 0.13 116.66 115.82 3d4j n ARG 140 Ca 0.23 -2.59 0.11 0.00 -1.00 0.00 0.00 57.85 54.59 3d4j n ARG 140 Cb 0.59 -1.58 0.07 0.00 -1.05 0.00 0.00 32.46 30.49 3d4j n ARG 140 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 3d4j n VAL 141 N 1.57 0.06 -0.03 8.89 0.31 0.69 -3.85 118.33 125.99 3d4j n VAL 141 Ca 0.24 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.48 3d4j n VAL 141 Cb 0.62 0.43 0.00 0.00 -0.91 0.00 0.00 33.84 33.98 3d4j n VAL 141 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3d4j n TYR 142 N -1.67 0.00 -1.58 3.52 4.02 -0.99 -5.01 117.16 115.44 3d4j n TYR 142 Ca 0.04 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.88 3d4j n TYR 142 Cb 0.37 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.68 3d4j n TYR 142 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3d4j n GLY 143 N 0.39 0.46 3.62 2.72 0.00 -0.94 -4.97 105.19 106.47 3d4j n GLY 143 Ca 0.00 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.80 3d4j n GLY 143 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d4j s VAL 144 N -2.19 3.78 -0.24 1.61 1.01 0.36 -4.84 120.40 119.88 3d4j s VAL 144 Ca 0.00 0.84 0.22 0.00 0.00 0.00 0.00 61.98 63.05 3d4j s VAL 144 Cb 0.00 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.42 3d4j s VAL 144 CO 0.00 -0.45 0.94 -0.62 0.00 0.00 0.00 175.10 174.97 3d4j n GLU 145 N 7.85 0.58 -0.65 2.72 4.71 -1.26 -4.56 120.64 130.02 3d4j n GLU 145 Ca 0.18 0.05 -0.31 0.00 -0.01 0.00 0.00 57.16 57.08 3d4j n GLU 145 Cb 0.46 -1.75 0.18 0.00 -1.01 0.00 0.00 31.44 29.33 3d4j n GLU 145 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 3d4j n SER 146 N -2.52 -0.44 -4.63 1.62 7.64 -1.26 -4.91 113.62 109.11 3d4j n SER 146 Ca -0.01 0.28 -0.43 0.00 1.01 0.00 0.00 58.87 59.73 3d4j n SER 146 Cb 0.54 -1.39 -0.02 0.00 -1.01 0.00 0.00 64.21 62.33 3d4j n SER 146 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3d4j s ASP 147 N -2.49 6.56 -0.53 6.43 2.15 -1.26 -4.91 116.67 122.61 3d4j s ASP 147 Ca 0.66 1.52 -0.00 0.00 0.43 0.00 0.00 52.55 55.16 3d4j s ASP 147 Cb -0.23 -2.54 0.45 0.00 -0.30 0.00 0.00 42.92 40.31 3d4j s ASP 147 CO 0.61 -1.13 1.97 0.00 -0.17 0.00 0.00 175.17 176.45 3d4j n LEU 148 N 7.90 7.11 0.21 -1.34 -0.00 -1.26 -4.57 117.00 125.04 3d4j n LEU 148 Ca 0.17 -3.86 -0.15 0.00 -0.00 0.00 0.00 56.01 52.17 3d4j n LEU 148 Cb 0.45 -0.94 -0.08 0.00 -0.00 0.00 0.00 43.42 42.85 3d4j n LEU 148 CO 0.63 1.29 0.70 0.28 -0.00 0.00 0.00 177.39 180.29 3d4j h SER 149 N 1.59 -0.41 -0.94 1.45 0.02 -1.93 -2.31 113.55 111.03 3d4j h SER 149 Ca 0.55 -0.04 0.16 0.00 -0.84 0.00 0.00 61.79 61.62 3d4j h SER 149 Cb 1.37 0.11 -0.08 0.00 0.14 0.00 0.00 62.40 63.93 3d4j h SER 149 CO 1.29 -0.22 0.60 -0.08 -1.14 0.00 0.00 176.83 177.27 3d4j h GLU 150 N -0.57 0.68 -0.05 3.45 4.81 -1.85 0.12 114.58 121.17 3d4j h GLU 150 Ca -0.05 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3d4j h GLU 150 Cb 0.42 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 3d4j h GLU 150 CO 0.08 0.45 0.03 0.28 -0.73 0.00 0.00 179.01 179.12 3d4j h VAL 151 N 0.70 1.06 -0.37 0.32 2.07 -1.80 -2.53 116.25 115.71 3d4j h VAL 151 Ca 0.49 -0.16 -0.15 0.00 0.82 0.00 0.00 66.70 67.69 3d4j h VAL 151 Cb 0.81 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 3d4j h VAL 151 CO -0.25 0.05 -0.38 0.00 0.02 0.00 0.00 177.57 177.01 3d4j h ALA 152 N 0.96 0.63 -0.83 1.67 0.00 -0.76 -3.21 119.26 117.72 3d4j h ALA 152 Ca 0.02 -0.45 0.09 0.00 0.00 0.00 0.00 54.91 54.57 3d4j h ALA 152 Cb 0.05 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 3d4j h ALA 152 CO -0.00 0.67 0.48 -0.09 0.00 0.00 0.00 179.25 180.31 3d4j h ARG 153 N 0.72 0.79 0.00 0.00 2.43 -0.71 0.22 114.38 117.84 3d4j h ARG 153 Ca 0.06 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 3d4j h ARG 153 Cb 0.96 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3d4j h ARG 153 CO 0.09 0.53 -0.15 0.00 -1.51 0.00 0.00 179.97 178.93 3d4j h ARG 154 N 0.82 0.00 0.11 0.20 2.47 -1.46 -2.75 114.38 113.78 3d4j h ARG 154 Ca 0.39 0.00 -0.24 0.00 -1.26 0.00 0.00 59.98 58.87 3d4j h ARG 154 Cb 0.33 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 3d4j h ARG 154 CO -0.24 0.15 -1.22 0.78 0.56 0.00 0.00 179.97 180.00 3d4j h GLY 155 N 0.73 0.27 -5.46 0.04 0.00 -1.13 -3.43 103.07 94.09 3d4j h GLY 155 Ca -0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.61 3d4j h GLY 155 CO 0.02 0.61 -0.25 -0.45 0.00 0.00 0.00 176.54 176.48 3d4j s SER 156 N -6.99 -0.68 0.12 0.19 0.15 0.61 -4.91 113.70 102.18 3d4j s SER 156 Ca -0.19 1.27 -0.23 0.00 0.70 0.00 0.00 55.95 57.50 3d4j s SER 156 Cb 0.03 1.75 -0.05 0.00 -1.71 0.00 0.00 66.02 66.04 3d4j s SER 156 CO 0.77 -0.23 1.40 1.23 1.20 0.00 0.00 173.24 177.61 3d4j h GLY 157 N 8.01 -1.35 1.03 9.45 0.00 -1.74 0.42 103.07 118.90 3d4j h GLY 157 Ca -0.18 0.90 0.00 0.00 0.00 0.00 0.00 47.33 48.05 3d4j h GLY 157 CO 0.12 -0.25 0.00 -1.14 0.00 0.00 0.00 176.54 175.27 3d4j n SER 158 N -4.65 0.00 0.25 0.19 3.41 -1.26 -3.51 113.62 108.05 3d4j n SER 158 Ca 0.01 -0.66 0.09 0.00 -0.26 0.00 0.00 58.87 58.06 3d4j n SER 158 Cb 0.19 -0.02 0.64 0.00 -0.26 0.00 0.00 64.21 64.76 3d4j n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d4j h ALA 159 N 3.36 1.61 0.00 7.33 0.00 -1.15 -2.43 119.26 127.99 3d4j h ALA 159 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3d4j h ALA 159 Cb 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3d4j h ALA 159 CO 0.00 0.15 -0.18 0.00 0.00 0.00 0.00 179.25 179.22 3d4j h ARG 161 N 0.00 0.00 -0.18 0.00 3.08 -1.71 -2.72 114.38 112.85 3d4j h ARG 161 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d4j h ARG 161 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 3d4j h ARG 161 CO 0.02 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.35 3d4j n SER 162 N -2.83 1.32 0.11 7.04 7.64 -0.88 -3.88 113.62 122.14 3d4j n SER 162 Ca 0.02 -1.77 0.13 0.00 1.01 0.00 0.00 58.87 58.26 3d4j n SER 162 Cb 0.37 -0.12 0.36 0.00 -1.01 0.00 0.00 64.21 63.81 3d4j n SER 162 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3d4j h LEU 163 N 1.62 0.00 -8.59 -3.43 3.38 -1.59 -3.36 115.31 103.33 3d4j h LEU 163 Ca 0.00 -0.02 -0.36 0.00 0.09 0.00 0.00 57.88 57.59 3d4j h LEU 163 Cb 0.36 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.95 3d4j h LEU 163 CO 0.00 0.01 -0.73 -0.31 0.09 0.00 0.00 178.44 177.50 3d4j s TYR 164 N -3.12 1.27 0.50 1.13 1.51 -1.25 -4.38 117.35 113.01 3d4j s TYR 164 Ca 0.10 -0.66 -0.02 0.00 -1.01 0.00 0.00 57.07 55.47 3d4j s TYR 164 Cb 0.12 -0.66 -0.00 0.00 -0.11 0.00 0.00 41.96 41.31 3d4j s TYR 164 CO 0.62 0.09 0.76 0.20 -1.11 0.00 0.00 175.55 176.11 3d4j s GLY 165 N -2.77 1.57 0.00 0.71 0.00 -1.26 -4.34 107.32 101.23 3d4j s GLY 165 Ca 0.12 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.95 3d4j s GLY 165 CO 0.01 -0.67 0.00 0.61 0.00 0.00 0.00 173.10 173.05 3d4j n GLY 166 N -2.27 1.19 3.28 0.20 0.00 0.01 -4.21 105.19 103.39 3d4j n GLY 166 Ca 0.02 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 3d4j n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d4j s PHE 167 N 0.00 2.95 0.01 1.61 0.08 0.11 -0.51 117.98 122.23 3d4j s PHE 167 Ca 0.00 -1.08 0.07 0.00 0.12 0.00 0.00 56.93 56.04 3d4j s PHE 167 Cb 0.00 -2.08 -0.02 0.00 -0.57 0.00 0.00 43.02 40.35 3d4j s PHE 167 CO 0.00 -0.60 -0.20 0.08 -0.10 0.00 0.00 175.22 174.40 3d4j s VAL 168 N 1.44 1.59 0.02 -0.44 1.01 -0.12 0.14 120.40 124.04 3d4j s VAL 168 Ca 0.05 -1.01 0.05 0.00 0.00 0.00 0.00 61.98 61.07 3d4j s VAL 168 Cb -0.14 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 3d4j s VAL 168 CO -0.05 0.31 -0.12 -0.70 0.00 0.00 0.00 175.10 174.55 3d4j s GLU 169 N -0.82 2.35 -0.41 2.72 2.12 -0.39 0.17 118.70 124.44 3d4j s GLU 169 Ca 0.07 -0.83 -0.05 0.00 0.36 0.00 0.00 54.97 54.52 3d4j s GLU 169 Cb -0.08 -2.36 0.10 0.00 0.26 0.00 0.00 34.13 32.05 3d4j s GLU 169 CO 0.00 0.58 0.21 -0.46 -0.54 0.00 0.00 175.26 175.05 3d4j s TRP 170 N -0.95 3.48 -0.05 5.30 -0.00 0.10 -1.29 118.94 125.53 3d4j s TRP 170 Ca 0.16 -2.12 -0.30 0.00 -0.00 0.00 0.00 56.10 53.84 3d4j s TRP 170 Cb -0.11 -3.08 -0.05 0.00 -0.00 0.00 0.00 33.47 30.24 3d4j s TRP 170 CO 0.06 -0.93 1.46 -0.65 -0.00 0.00 0.00 176.95 176.89 3d4j s GLN 171 N 1.23 4.24 0.57 5.86 -0.21 0.93 -2.06 119.66 130.21 3d4j s GLN 171 Ca 0.05 1.98 0.27 0.00 0.02 0.00 0.00 55.36 57.69 3d4j s GLN 171 Cb -0.23 -3.75 1.52 0.00 1.00 0.00 0.00 33.01 31.55 3d4j s GLN 171 CO -0.02 -0.70 2.03 0.00 -2.12 0.00 0.00 175.29 174.48 3d4j h MET 172 N 8.48 0.00 0.00 2.91 -0.00 -1.85 -3.14 114.93 121.32 3d4j h MET 172 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.34 3d4j h MET 172 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.76 3d4j h MET 172 CO 0.93 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 178.25 3d4j n GLY 173 N -1.51 -1.34 0.01 -3.00 0.00 -1.26 -4.54 105.19 93.55 3d4j n GLY 173 Ca 0.05 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.61 3d4j n GLY 173 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3d4j n GLU 174 N -0.61 1.38 -2.88 1.61 2.13 -1.26 -4.90 120.64 116.11 3d4j n GLU 174 Ca 0.00 -0.02 -0.41 0.00 0.66 0.00 0.00 57.16 57.39 3d4j n GLU 174 Cb 0.00 -1.08 -0.04 0.00 0.27 0.00 0.00 31.44 30.60 3d4j n GLU 174 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3d4j s GLN 175 N -2.17 4.35 0.23 5.31 -0.21 -1.26 -4.93 119.66 120.99 3d4j s GLN 175 Ca -0.01 1.07 0.15 0.00 0.02 0.00 0.00 55.36 56.58 3d4j s GLN 175 Cb 0.02 -3.54 0.82 0.00 1.00 0.00 0.00 33.01 31.31 3d4j s GLN 175 CO 0.13 -0.25 1.45 0.00 -2.12 0.00 0.00 175.29 174.50 3d4j n ALA 176 N 4.89 1.00 1.65 6.09 0.00 -1.26 -1.05 120.51 131.84 3d4j n ALA 176 Ca 0.04 0.14 0.15 0.00 0.00 0.00 0.00 53.44 53.77 3d4j n ALA 176 Cb 0.49 -1.19 0.76 0.00 0.00 0.00 0.00 19.45 19.51 3d4j n ALA 176 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3d4j n ASP 177 N -2.03 0.35 -3.32 0.00 5.75 -1.26 -4.94 116.55 111.10 3d4j n ASP 177 Ca -0.01 -0.79 -0.14 0.00 -0.01 0.00 0.00 54.79 53.84 3d4j n ASP 177 Cb 0.05 -0.07 0.03 0.00 -1.03 0.00 0.00 41.12 40.10 3d4j n ASP 177 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d4j n GLY 178 N 1.16 -1.17 0.00 6.12 0.00 -0.21 -4.93 105.19 106.16 3d4j n GLY 178 Ca 0.19 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.73 3d4j n GLY 178 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3d4j n LYS 179 N -2.86 2.42 -0.05 1.61 3.00 -1.26 -4.70 118.16 116.32 3d4j n LYS 179 Ca -0.07 0.00 0.11 0.00 -0.00 0.00 0.00 58.31 58.35 3d4j n LYS 179 Cb 0.58 -0.81 0.12 0.00 0.00 0.00 0.00 35.03 34.92 3d4j n LYS 179 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 3d4j n ASP 180 N -1.30 3.04 -4.27 3.14 5.75 -1.26 -4.64 116.55 117.01 3d4j n ASP 180 Ca 0.00 -1.96 -0.43 0.00 -0.01 0.00 0.00 54.79 52.39 3d4j n ASP 180 Cb 0.23 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 3d4j n ASP 180 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 3d4j n SER 181 N 1.33 4.95 -3.23 -1.12 2.88 -1.26 -4.16 113.62 113.01 3d4j n SER 181 Ca 0.15 -2.97 -0.15 0.00 -1.33 0.00 0.00 58.87 54.56 3d4j n SER 181 Cb 0.58 -1.61 -0.03 0.00 -0.75 0.00 0.00 64.21 62.40 3d4j n SER 181 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 3d4j n ILE 182 N 4.85 0.00 -4.20 2.46 -6.64 -1.19 -4.73 119.36 109.92 3d4j n ILE 182 Ca 0.43 -1.12 -0.27 0.00 -1.77 0.00 0.00 62.75 60.01 3d4j n ILE 182 Cb 0.42 0.23 -0.08 0.00 -1.44 0.00 0.00 39.64 38.77 3d4j n ILE 182 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3d4j s ALA 183 N -2.41 3.18 -0.15 -1.28 0.00 -1.26 -0.05 121.76 119.80 3d4j s ALA 183 Ca 0.00 -1.32 -0.14 0.00 0.00 0.00 0.00 51.96 50.51 3d4j s ALA 183 Cb 0.00 -1.01 0.04 0.00 0.00 0.00 0.00 23.12 22.15 3d4j s ALA 183 CO 0.00 0.53 0.39 -0.98 0.00 0.00 0.00 175.76 175.71 3d4j s ARG 184 N -2.76 0.46 0.24 0.00 1.70 -0.41 -4.96 118.95 113.22 3d4j s ARG 184 Ca 0.26 0.55 -0.30 0.00 -0.47 0.00 0.00 55.73 55.78 3d4j s ARG 184 Cb -0.10 0.22 -0.09 0.00 -0.57 0.00 0.00 34.95 34.41 3d4j s ARG 184 CO 0.18 -0.06 1.21 -1.14 -1.08 0.00 0.00 175.30 174.41 3d4j s GLN 185 N 0.22 4.49 -0.18 3.89 0.74 -1.26 -1.27 119.66 126.30 3d4j s GLN 185 Ca -0.00 1.94 0.05 0.00 0.05 0.00 0.00 55.36 57.41 3d4j s GLN 185 Cb -0.03 -3.19 -0.22 0.00 1.10 0.00 0.00 33.01 30.67 3d4j s GLN 185 CO 0.00 -0.04 0.12 0.28 -0.55 0.00 0.00 175.29 175.10 3d4j n VAL 186 N 1.85 1.55 -3.63 1.34 0.31 0.38 -4.89 118.33 115.24 3d4j n VAL 186 Ca 0.02 -0.70 -0.11 0.00 -0.01 0.00 0.00 64.34 63.55 3d4j n VAL 186 Cb 0.44 -1.20 -0.07 0.00 -0.91 0.00 0.00 33.84 32.10 3d4j n VAL 186 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3d4j s ALA 187 N -2.53 -1.89 0.97 3.52 0.00 -1.02 -4.96 121.76 115.84 3d4j s ALA 187 Ca -0.21 2.01 -0.12 0.00 0.00 0.00 0.00 51.96 53.64 3d4j s ALA 187 Cb 0.08 -1.33 0.17 0.00 0.00 0.00 0.00 23.12 22.03 3d4j s ALA 187 CO 0.73 -0.30 1.09 -1.25 0.00 0.00 0.00 175.76 176.03 3d4j s PRO 188 N 0.48 0.68 0.12 0.00 0.04 -1.26 0.06 135.00 135.12 3d4j s PRO 188 Ca -0.00 0.61 -0.32 0.00 0.04 0.00 0.00 61.00 61.33 3d4j s PRO 188 Cb -0.05 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.63 3d4j s PRO 188 CO -0.04 -2.58 1.57 0.93 0.04 0.00 0.00 177.00 176.92 3d4j h GLU 189 N -1.79 -0.61 0.00 4.56 3.07 -1.81 -1.22 114.58 116.79 3d4j h GLU 189 Ca -0.53 0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.37 3d4j h GLU 189 Cb 1.31 0.14 0.00 0.00 -0.84 0.00 0.00 28.75 29.36 3d4j h GLU 189 CO 0.57 -0.40 0.15 -1.13 -1.40 0.00 0.00 179.01 176.79 3d4j n SER 190 N -5.46 0.02 -0.21 1.42 3.41 -1.26 -2.94 113.62 108.60 3d4j n SER 190 Ca -0.07 0.36 -0.02 0.00 -0.26 0.00 0.00 58.87 58.89 3d4j n SER 190 Cb 0.39 -0.36 0.18 0.00 -0.26 0.00 0.00 64.21 64.16 3d4j n SER 190 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 3d4j h HIS 191 N 0.00 0.99 -2.41 7.33 6.17 -1.57 -3.34 115.15 122.31 3d4j h HIS 191 Ca 0.00 -0.03 -0.59 0.00 0.71 0.00 0.00 60.37 60.46 3d4j h HIS 191 Cb 0.30 -0.31 -0.40 0.00 2.52 0.00 0.00 27.41 29.52 3d4j h HIS 191 CO 0.00 0.71 -0.88 1.87 0.71 0.00 0.00 177.93 180.35 3d4j n TRP 192 N -4.34 0.65 0.19 5.26 -0.00 -1.15 -4.97 117.44 113.08 3d4j n TRP 192 Ca 0.07 -3.68 0.15 0.00 -0.00 0.00 0.00 57.50 54.03 3d4j n TRP 192 Cb 0.13 -0.17 0.76 0.00 -0.00 0.00 0.00 31.31 32.03 3d4j n TRP 192 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 3d4j h PRO 193 N 5.01 0.00 0.00 5.87 0.11 -1.78 -2.84 132.00 138.37 3d4j h PRO 193 Ca 0.19 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.17 3d4j h PRO 193 Cb 0.84 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3d4j h PRO 193 CO 0.52 0.00 -0.72 0.93 -0.21 0.00 0.00 178.00 178.52 3d4j h GLU 194 N 0.00 0.00 -6.87 1.05 3.07 -1.95 -3.47 114.58 106.41 3d4j h GLU 194 Ca 0.09 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.39 3d4j h GLU 194 Cb 0.41 0.00 0.12 0.00 -0.84 0.00 0.00 28.75 28.44 3d4j h GLU 194 CO -0.00 0.54 0.58 -0.11 -1.40 0.00 0.00 179.01 178.63 3d4j n LEU 195 N -3.19 4.31 -4.15 1.33 7.94 -1.07 -0.72 117.00 121.45 3d4j n LEU 195 Ca -0.00 1.14 -0.16 0.00 -1.11 0.00 0.00 56.01 55.88 3d4j n LEU 195 Cb 0.78 -1.54 -0.11 0.00 0.53 0.00 0.00 43.42 43.08 3d4j n LEU 195 CO 0.42 -0.39 -0.43 -0.13 -1.11 0.00 0.00 177.39 175.75 3d4j s ARG 196 N -2.20 0.77 -0.07 1.96 1.81 0.28 -4.31 118.95 117.19 3d4j s ARG 196 Ca 0.59 -0.98 0.02 0.00 -1.72 0.00 0.00 55.73 53.64 3d4j s ARG 196 Cb -0.50 -0.63 0.01 0.00 -0.45 0.00 0.00 34.95 33.39 3d4j s ARG 196 CO 0.59 0.13 -0.12 0.08 -0.68 0.00 0.00 175.30 175.30 3d4j s VAL 197 N -1.66 1.13 -0.03 3.52 1.01 -0.89 -1.64 120.40 121.84 3d4j s VAL 197 Ca -0.01 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.58 3d4j s VAL 197 Cb -0.08 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 3d4j s VAL 197 CO 0.01 0.36 -0.24 -0.76 0.00 0.00 0.00 175.10 174.47 3d4j s LEU 198 N 0.82 2.04 -0.25 3.92 1.43 0.21 -1.00 118.68 125.86 3d4j s LEU 198 Ca -0.12 -0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 52.50 3d4j s LEU 198 Cb -0.15 -1.27 0.01 0.00 0.03 0.00 0.00 46.19 44.81 3d4j s LEU 198 CO 0.02 0.27 -0.04 -0.63 0.23 0.00 0.00 176.35 176.20 3d4j s ILE 199 N -0.38 3.17 -0.47 -0.59 1.01 -0.22 0.16 121.20 123.89 3d4j s ILE 199 Ca 0.04 -0.83 -0.15 0.00 0.00 0.00 0.00 60.65 59.71 3d4j s ILE 199 Cb -0.11 -2.56 0.07 0.00 0.01 0.00 0.00 42.46 39.87 3d4j s ILE 199 CO 0.01 0.25 0.38 -0.76 0.00 0.00 0.00 174.94 174.81 3d4j s LEU 200 N 1.39 5.56 -0.38 2.97 1.43 0.27 -1.38 118.68 128.54 3d4j s LEU 200 Ca 0.02 -1.35 -0.29 0.00 -1.03 0.00 0.00 54.13 51.48 3d4j s LEU 200 Cb -0.16 -2.16 0.02 0.00 0.03 0.00 0.00 46.19 43.92 3d4j s LEU 200 CO -0.03 -0.63 1.15 -0.69 0.23 0.00 0.00 176.35 176.38 3d4j s VAL 201 N 1.61 4.31 0.43 -1.59 1.01 -0.88 -1.63 120.40 123.66 3d4j s VAL 201 Ca 0.04 1.44 0.03 0.00 0.00 0.00 0.00 61.98 63.48 3d4j s VAL 201 Cb -0.24 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.71 3d4j s VAL 201 CO 0.06 -0.69 0.62 0.68 0.00 0.00 0.00 175.10 175.77 3d4j s VAL 202 N 4.16 3.72 0.16 2.92 -7.23 -1.26 0.01 120.40 122.88 3d4j s VAL 202 Ca 0.49 -0.72 -0.30 0.00 -1.81 0.00 0.00 61.98 59.64 3d4j s VAL 202 Cb -0.11 -3.34 -0.08 0.00 0.56 0.00 0.00 36.38 33.41 3d4j s VAL 202 CO 0.23 -0.20 1.29 -0.55 -0.31 0.00 0.00 175.10 175.56 3d4j s SER 203 N -4.25 6.94 -0.28 4.85 0.15 -0.86 -4.71 113.70 115.54 3d4j s SER 203 Ca 0.49 2.30 -0.21 0.00 0.70 0.00 0.00 55.95 59.24 3d4j s SER 203 Cb -0.10 -2.60 0.09 0.00 -1.71 0.00 0.00 66.02 61.70 3d4j s SER 203 CO 0.36 -0.51 0.79 0.00 1.20 0.00 0.00 173.24 175.08 3d4j s ALA 204 N 0.41 -1.91 -0.03 5.45 0.00 -1.26 -4.91 121.76 119.51 3d4j s ALA 204 Ca 0.58 2.17 -0.01 0.00 0.00 0.00 0.00 51.96 54.70 3d4j s ALA 204 Cb -0.35 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 21.38 3d4j s ALA 204 CO 0.35 -0.34 -0.04 -0.85 0.00 0.00 0.00 175.76 174.88 3d4j n GLU 205 N 3.32 0.07 -0.76 0.00 0.00 -1.26 -5.04 120.64 116.97 3d4j n GLU 205 Ca -0.16 0.03 -0.30 0.00 0.00 0.00 0.00 57.16 56.72 3d4j n GLU 205 Cb 0.57 -0.73 -0.04 0.00 0.00 0.00 0.00 31.44 31.24 3d4j n GLU 205 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3d4j n LYS 206 N -2.99 0.00 -2.22 3.44 4.81 -1.26 -4.77 118.16 115.17 3d4j n LYS 206 Ca -0.06 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 56.95 3d4j n LYS 206 Cb 0.55 -0.66 -0.02 0.00 0.02 0.00 0.00 35.03 34.91 3d4j n LYS 206 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 3d4j s LYS 207 N 1.41 4.08 0.25 1.64 2.20 -1.26 -4.98 119.74 123.08 3d4j s LYS 207 Ca 0.47 1.79 -0.26 0.00 -0.36 0.00 0.00 55.97 57.61 3d4j s LYS 207 Cb -0.66 -3.91 -0.09 0.00 -1.51 0.00 0.00 37.83 31.66 3d4j s LYS 207 CO 0.36 -0.93 0.87 -0.51 -0.36 0.00 0.00 175.35 174.77 3d4j s LEU 208 N 4.16 4.47 0.28 5.43 1.43 -1.26 -5.04 118.68 128.15 3d4j s LEU 208 Ca 0.65 1.75 -0.29 0.00 -1.03 0.00 0.00 54.13 55.21 3d4j s LEU 208 Cb -0.26 -3.69 -0.09 0.00 0.03 0.00 0.00 46.19 42.18 3d4j s LEU 208 CO 0.24 0.07 0.98 0.42 0.23 0.00 0.00 176.35 178.29 3d4j s THR 209 N -1.39 3.94 0.68 5.49 -4.23 -1.26 -4.99 115.64 113.87 3d4j s THR 209 Ca 0.44 1.85 -0.17 0.00 -1.18 0.00 0.00 61.69 62.63 3d4j s THR 209 Cb -0.21 -4.14 0.01 0.00 1.34 0.00 0.00 72.50 69.50 3d4j s THR 209 CO 0.26 0.36 1.23 -0.83 -0.54 0.00 0.00 174.62 175.10 3d4j s GLY 210 N -1.23 2.56 0.27 3.99 0.00 -1.26 -4.86 107.32 106.80 3d4j s GLY 210 Ca 0.45 0.99 0.11 0.00 0.00 0.00 0.00 44.72 46.27 3d4j s GLY 210 CO 0.32 1.40 1.60 1.48 0.00 0.00 0.00 173.10 177.90 3d4j h SER 211 N 0.20 0.00 0.06 1.64 4.64 -1.94 0.34 113.55 118.48 3d4j h SER 211 Ca -0.49 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3d4j h SER 211 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3d4j h SER 211 CO 0.52 0.62 -0.03 0.74 -0.87 0.00 0.00 176.83 177.81 3d4j h THR 212 N 0.00 1.25 -0.70 2.95 2.02 -2.00 -1.59 112.91 114.85 3d4j h THR 212 Ca -0.01 -1.14 -0.04 0.00 0.77 0.00 0.00 66.41 66.00 3d4j h THR 212 Cb 1.12 1.99 -0.03 0.00 -1.74 0.00 0.00 68.15 69.49 3d4j h THR 212 CO 0.08 0.28 0.30 0.58 0.37 0.00 0.00 175.52 177.13 3d4j h VAL 213 N -0.60 1.24 -0.14 3.16 2.07 -1.95 -3.07 116.25 116.96 3d4j h VAL 213 Ca -0.01 -0.73 -0.19 0.00 0.82 0.00 0.00 66.70 66.59 3d4j h VAL 213 Cb 0.52 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3d4j h VAL 213 CO 0.01 0.30 -0.70 1.23 0.02 0.00 0.00 177.57 178.43 3d4j h GLY 214 N 0.99 0.66 2.00 2.17 0.00 -0.95 -2.96 103.07 104.99 3d4j h GLY 214 Ca 0.24 -0.89 -0.05 0.00 0.00 0.00 0.00 47.33 46.62 3d4j h GLY 214 CO -0.02 0.80 -0.24 0.00 0.00 0.00 0.00 176.54 177.07 3d4j h MET 215 N 0.43 0.00 -0.17 4.80 -0.00 -1.32 -1.78 114.93 116.88 3d4j h MET 215 Ca -0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.64 3d4j h MET 215 Cb 1.29 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.88 3d4j h MET 215 CO 0.13 0.24 -0.04 -0.09 -0.00 0.00 0.00 176.91 177.16 3d4j h ARG 216 N 0.00 0.33 -0.20 -0.10 2.43 -1.46 -1.77 114.38 113.61 3d4j h ARG 216 Ca -0.00 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 58.99 3d4j h ARG 216 Cb 0.73 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 3d4j h ARG 216 CO 0.03 0.59 -0.13 0.00 -1.51 0.00 0.00 179.97 178.95 3d4j h ALA 217 N 0.73 1.41 -0.50 2.80 0.00 -1.31 -0.95 119.26 121.43 3d4j h ALA 217 Ca 0.04 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 3d4j h ALA 217 Cb 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3d4j h ALA 217 CO 0.02 0.41 0.01 0.77 0.00 0.00 0.00 179.25 180.46 3d4j h SER 218 N 0.30 0.86 -0.61 0.00 0.02 -1.15 -0.67 113.55 112.31 3d4j h SER 218 Ca 0.06 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.63 3d4j h SER 218 Cb 0.43 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3d4j h SER 218 CO 0.02 0.95 0.07 0.58 -1.14 0.00 0.00 176.83 177.32 3d4j h VAL 219 N 0.75 1.26 0.00 2.27 2.07 -0.76 0.42 116.25 122.26 3d4j h VAL 219 Ca 0.14 -1.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 3d4j h VAL 219 Cb 0.50 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 3d4j h VAL 219 CO 0.02 0.39 -0.17 -0.33 0.02 0.00 0.00 177.57 177.51 3d4j h GLU 220 N 0.98 0.00 0.00 1.57 5.08 -1.00 -3.39 114.58 117.81 3d4j h GLU 220 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3d4j h GLU 220 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3d4j h GLU 220 CO 0.02 0.17 -0.05 0.25 -1.00 0.00 0.00 179.01 178.39 3d4j n THR 221 N -3.20 0.00 -3.15 1.13 -2.24 -0.27 -5.02 114.28 101.53 3d4j n THR 221 Ca 0.02 -0.22 -0.45 0.00 -2.27 0.00 0.00 64.05 61.13 3d4j n THR 221 Cb 0.51 0.93 -0.05 0.00 -2.10 0.00 0.00 70.33 69.62 3d4j n THR 221 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3d4j s SER 222 N -0.54 6.20 0.57 3.42 0.15 0.15 -4.65 113.70 119.00 3d4j s SER 222 Ca 0.00 -1.53 0.29 0.00 0.70 0.00 0.00 55.95 55.41 3d4j s SER 222 Cb 0.00 -2.29 1.73 0.00 -1.71 0.00 0.00 66.02 63.75 3d4j s SER 222 CO 0.00 -1.06 2.21 1.55 1.20 0.00 0.00 173.24 177.14 3d4j h PRO 223 N 9.11 0.00 0.00 5.44 0.13 -1.85 -0.78 132.00 144.05 3d4j h PRO 223 Ca -0.28 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.68 3d4j h PRO 223 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 3d4j h PRO 223 CO 1.09 0.03 -0.77 -0.07 -0.23 0.00 0.00 178.00 178.04 3d4j h LEU 224 N 0.00 0.00 -1.09 1.56 3.38 -1.90 -3.16 115.31 114.09 3d4j h LEU 224 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3d4j h LEU 224 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3d4j h LEU 224 CO 0.00 0.77 -0.10 0.25 0.09 0.00 0.00 178.44 179.46 3d4j h LEU 225 N 0.00 0.51 -0.46 1.67 5.85 -1.46 -1.16 115.31 120.25 3d4j h LEU 225 Ca -0.01 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 3d4j h LEU 225 Cb 1.39 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 3d4j h LEU 225 CO 0.10 0.65 -0.07 -0.09 -0.34 0.00 0.00 178.44 178.69 3d4j h ARG 226 N 0.49 0.85 -0.31 1.25 2.43 -1.50 -2.63 114.38 114.97 3d4j h ARG 226 Ca 0.09 -0.31 -0.10 0.00 -0.81 0.00 0.00 59.98 58.86 3d4j h ARG 226 Cb 0.47 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 3d4j h ARG 226 CO 0.03 0.94 -0.23 0.35 -1.51 0.00 0.00 179.97 179.55 3d4j h PHE 227 N 0.69 0.66 -0.14 2.20 3.57 -1.48 -1.74 116.94 120.70 3d4j h PHE 227 Ca 0.12 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.49 3d4j h PHE 227 Cb 0.59 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 3d4j h PHE 227 CO 0.05 0.77 0.06 -0.09 -2.23 0.00 0.00 178.31 176.87 3d4j h ARG 228 N 0.52 0.14 -0.22 1.11 2.43 -1.02 -1.31 114.38 116.02 3d4j h ARG 228 Ca 0.08 -0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 59.06 3d4j h ARG 228 Cb 0.67 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 3d4j h ARG 228 CO 0.05 0.09 -0.56 0.00 -1.51 0.00 0.00 179.97 178.04 3d4j h ALA 229 N 1.08 0.37 0.16 2.80 0.00 -1.37 -0.47 119.26 121.83 3d4j h ALA 229 Ca 0.06 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3d4j h ALA 229 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3d4j h ALA 229 CO -0.05 0.59 -0.08 0.93 0.00 0.00 0.00 179.25 180.65 3d4j h GLU 230 N 0.51 -0.20 0.00 0.00 5.08 -1.29 -3.40 114.58 115.27 3d4j h GLU 230 Ca -0.01 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3d4j h GLU 230 Cb 1.18 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 3d4j h GLU 230 CO 0.12 0.22 -0.39 -1.13 -1.00 0.00 0.00 179.01 176.83 3d4j n SER 231 N -4.96 1.79 0.07 1.42 3.41 -0.50 -4.82 113.62 110.03 3d4j n SER 231 Ca -0.08 -3.47 0.00 0.00 -0.26 0.00 0.00 58.87 55.05 3d4j n SER 231 Cb 0.26 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 3d4j n SER 231 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3d4j n VAL 232 N -1.06 0.47 0.14 -3.33 0.31 -0.71 -4.92 118.33 109.22 3d4j n VAL 232 Ca 0.17 0.15 -0.13 0.00 -0.01 0.00 0.00 64.34 64.52 3d4j n VAL 232 Cb 0.71 -1.06 -0.06 0.00 -0.91 0.00 0.00 33.84 32.52 3d4j n VAL 232 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3d4j h VAL 233 N 0.00 0.49 -0.88 2.52 2.07 -1.33 -2.70 116.25 116.41 3d4j h VAL 233 Ca 0.00 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.70 3d4j h VAL 233 Cb 0.15 0.49 -0.17 0.00 -1.52 0.00 0.00 31.29 30.24 3d4j h VAL 233 CO 0.00 0.00 -0.20 -0.65 0.02 0.00 0.00 177.57 176.74 3d4j h PRO 234 N -0.47 0.00 -0.53 1.57 0.11 -1.85 0.52 132.00 131.36 3d4j h PRO 234 Ca 0.01 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.03 3d4j h PRO 234 Cb 0.46 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.55 3d4j h PRO 234 CO -0.09 0.00 -0.02 0.00 -0.21 0.00 0.00 178.00 177.68 3d4j h ALA 235 N 1.88 0.72 -0.66 -0.75 0.00 -1.89 -2.72 119.26 115.84 3d4j h ALA 235 Ca 0.43 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3d4j h ALA 235 Cb 0.67 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3d4j h ALA 235 CO -0.90 0.56 0.20 0.00 0.00 0.00 0.00 179.25 179.11 3d4j h ARG 236 N 0.83 1.00 -0.26 0.00 3.08 -0.05 0.25 114.38 119.22 3d4j h ARG 236 Ca 0.15 -0.20 0.04 0.00 0.07 0.00 0.00 59.98 60.04 3d4j h ARG 236 Cb 0.56 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.42 3d4j h ARG 236 CO 0.03 0.86 0.04 0.52 -1.07 0.00 0.00 179.97 180.34 3d4j h MET 237 N 0.97 0.13 -0.30 0.04 2.86 -0.01 0.35 114.93 118.97 3d4j h MET 237 Ca 0.21 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 3d4j h MET 237 Cb 0.27 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 3d4j h MET 237 CO -0.01 0.08 0.11 0.00 1.06 0.00 0.00 176.91 178.15 3d4j h ALA 238 N 1.20 0.39 -0.89 6.32 0.00 -1.16 -0.73 119.26 124.40 3d4j h ALA 238 Ca 0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3d4j h ALA 238 Cb 0.14 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3d4j h ALA 238 CO -0.18 0.00 0.49 1.49 0.00 0.00 0.00 179.25 181.06 3d4j h GLU 239 N 0.33 1.23 -0.25 0.00 4.81 -0.60 -1.96 114.58 118.14 3d4j h GLU 239 Ca 0.10 -0.14 -0.15 0.00 -0.13 0.00 0.00 59.36 59.04 3d4j h GLU 239 Cb 0.21 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 3d4j h GLU 239 CO -0.01 0.90 -0.45 1.98 -0.73 0.00 0.00 179.01 180.70 3d4j h MET 240 N 1.24 0.64 -0.30 1.92 4.05 -0.07 -1.57 114.93 120.84 3d4j h MET 240 Ca 0.31 -0.35 -0.08 0.00 -0.28 0.00 0.00 59.70 59.30 3d4j h MET 240 Cb 0.02 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 30.82 3d4j h MET 240 CO -0.05 0.96 -0.14 0.00 0.23 0.00 0.00 176.91 177.91 3d4j h ALA 241 N 0.99 1.20 -0.26 0.39 0.00 -0.86 -2.14 119.26 118.57 3d4j h ALA 241 Ca 0.03 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 3d4j h ALA 241 Cb 0.99 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3d4j h ALA 241 CO 0.09 0.52 -0.16 -0.09 0.00 0.00 0.00 179.25 179.60 3d4j h ARG 242 N 0.48 0.58 -0.32 0.00 2.43 -1.12 -2.26 114.38 114.16 3d4j h ARG 242 Ca 0.09 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 58.98 3d4j h ARG 242 Cb 0.53 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 3d4j h ARG 242 CO 0.03 0.84 0.17 0.00 -1.51 0.00 0.00 179.97 179.50 3d4j h ILE 244 N 0.44 1.48 -0.55 0.00 2.04 -1.26 -0.87 117.51 118.80 3d4j h ILE 244 Ca 0.12 -1.73 0.04 0.00 1.00 0.00 0.00 64.86 64.28 3d4j h ILE 244 Cb 0.03 2.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.57 3d4j h ILE 244 CO -0.02 0.48 0.31 0.03 0.00 0.00 0.00 178.15 178.95 3d4j h ARG 245 N -0.37 0.59 0.00 2.37 3.08 -1.18 -1.80 114.38 117.06 3d4j h ARG 245 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3d4j h ARG 245 Cb 0.89 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.81 3d4j h ARG 245 CO 0.04 0.39 0.00 0.39 -1.07 0.00 0.00 179.97 179.72 3d4j n GLU 246 N -4.81 0.15 -3.70 0.04 1.02 -0.75 -4.92 120.64 107.66 3d4j n GLU 246 Ca 0.05 0.01 -0.26 0.00 -0.02 0.00 0.00 57.16 56.93 3d4j n GLU 246 Cb 0.11 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.09 3d4j n GLU 246 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3d4j n ARG 247 N -1.42 -7.24 -2.90 3.49 1.74 -0.61 -4.92 116.66 104.79 3d4j n ARG 247 Ca 0.09 0.76 -0.43 0.00 -0.77 0.00 0.00 57.85 57.50 3d4j n ARG 247 Cb 0.30 -5.77 -0.04 0.00 -1.02 0.00 0.00 32.46 25.94 3d4j n ARG 247 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3d4j s ASP 248 N -3.32 6.26 0.03 0.55 -1.08 -0.43 -4.94 116.67 113.74 3d4j s ASP 248 Ca 0.61 -1.24 -0.28 0.00 -0.52 0.00 0.00 52.55 51.12 3d4j s ASP 248 Cb -0.28 -2.40 -0.17 0.00 -1.46 0.00 0.00 42.92 38.61 3d4j s ASP 248 CO 0.76 -1.34 1.30 0.15 0.52 0.00 0.00 175.17 176.57 3d4j h PHE 249 N 9.39 -0.73 -0.94 -5.34 3.57 -1.91 -1.74 116.94 119.25 3d4j h PHE 249 Ca -0.20 -0.02 0.25 0.00 3.53 0.00 0.00 57.97 61.53 3d4j h PHE 249 Cb 1.06 0.24 -0.13 0.00 2.79 0.00 0.00 35.95 39.91 3d4j h PHE 249 CO 0.99 -0.39 0.45 -1.00 -2.23 0.00 0.00 178.31 176.12 3d4j h PRO 250 N -1.01 0.38 -0.36 6.41 0.13 -1.93 0.76 132.00 136.38 3d4j h PRO 250 Ca -0.08 -0.02 -0.15 0.00 -0.87 0.00 0.00 66.00 64.88 3d4j h PRO 250 Cb 0.66 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 3d4j h PRO 250 CO 0.13 0.25 -0.36 0.77 -0.23 0.00 0.00 178.00 178.56 3d4j h SER 251 N 0.39 0.90 0.12 1.44 0.02 -1.92 -1.41 113.55 113.08 3d4j h SER 251 Ca 0.61 -0.40 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 3d4j h SER 251 Cb 1.23 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.52 3d4j h SER 251 CO -0.55 1.16 -0.06 0.15 -1.14 0.00 0.00 176.83 176.39 3d4j h PHE 252 N 0.70 -0.14 0.11 3.45 3.57 0.42 -2.38 116.94 122.67 3d4j h PHE 252 Ca 0.06 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.57 3d4j h PHE 252 Cb 0.93 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 3d4j h PHE 252 CO 0.05 0.06 -0.14 0.00 -2.23 0.00 0.00 178.31 176.05 3d4j h ALA 253 N 0.53 -0.25 0.06 2.41 0.00 0.37 -1.25 119.26 121.13 3d4j h ALA 253 Ca -0.02 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3d4j h ALA 253 Cb 0.27 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 3d4j h ALA 253 CO 0.03 -0.67 -0.33 1.96 0.00 0.00 0.00 179.25 180.24 3d4j h GLN 254 N -0.29 -0.50 -0.64 0.00 4.20 -1.28 -1.67 115.11 114.92 3d4j h GLN 254 Ca 0.01 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.88 3d4j h GLN 254 Cb 0.30 0.11 -0.09 0.00 0.30 0.00 0.00 27.48 28.10 3d4j h GLN 254 CO -0.06 -0.33 0.18 1.25 -0.67 0.00 0.00 178.83 179.20 3d4j h LEU 255 N -0.52 0.10 -0.51 1.46 7.12 -1.32 -0.41 115.31 121.23 3d4j h LEU 255 Ca 0.04 0.11 0.01 0.00 0.13 0.00 0.00 57.88 58.18 3d4j h LEU 255 Cb 0.58 0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 40.81 3d4j h LEU 255 CO -0.23 0.05 0.32 0.74 -0.13 0.00 0.00 178.44 179.18 3d4j h THR 256 N 0.32 1.09 -0.38 1.05 2.02 -0.72 -1.07 112.91 115.23 3d4j h THR 256 Ca 0.34 -0.22 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 3d4j h THR 256 Cb 0.50 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 3d4j h THR 256 CO -0.39 0.12 -0.05 0.24 0.37 0.00 0.00 175.52 175.80 3d4j h MET 257 N 0.65 0.71 -0.20 6.66 2.86 -0.40 -1.16 114.93 124.04 3d4j h MET 257 Ca 0.19 -0.25 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 3d4j h MET 257 Cb -0.03 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 3d4j h MET 257 CO -0.06 0.83 -0.13 0.87 1.06 0.00 0.00 176.91 179.48 3d4j h LYS 258 N 0.52 0.32 0.00 1.72 1.57 -0.90 -0.23 116.57 119.57 3d4j h LYS 258 Ca 0.10 -0.08 -0.19 0.00 -1.87 0.00 0.00 60.65 58.61 3d4j h LYS 258 Cb 0.55 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 3d4j h LYS 258 CO 0.03 0.46 -0.96 0.22 -0.57 0.00 0.00 179.45 178.63 3d4j h ASP 259 N 0.31 0.00 -0.18 0.86 1.82 -1.05 -1.56 116.42 116.61 3d4j h ASP 259 Ca 0.06 0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 56.65 3d4j h ASP 259 Cb 0.42 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.43 3d4j h ASP 259 CO 0.02 0.88 -0.09 -1.28 -1.61 0.00 0.00 179.24 177.17 3d4j h SER 260 N 0.00 0.39 -0.59 2.28 0.87 -0.90 -2.30 113.55 113.31 3d4j h SER 260 Ca -0.03 -0.41 -0.02 0.00 -1.23 0.00 0.00 61.79 60.09 3d4j h SER 260 Cb 1.70 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 63.52 3d4j h SER 260 CO 0.11 0.71 0.29 0.78 -0.53 0.00 0.00 176.83 178.19 3d4j h ASN 261 N 0.07 0.79 -0.07 6.23 2.35 -1.02 -2.39 115.58 121.53 3d4j h ASN 261 Ca 0.04 -0.08 -0.16 0.00 -0.55 0.00 0.00 56.30 55.55 3d4j h ASN 261 Cb 0.56 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 3d4j h ASN 261 CO 0.03 0.68 -0.50 -0.61 -1.65 0.00 0.00 177.43 175.37 3d4j h GLN 262 N 0.87 0.64 0.60 0.81 4.15 -1.23 -0.39 115.11 120.57 3d4j h GLN 262 Ca 0.21 -0.38 -0.02 0.00 0.77 0.00 0.00 58.65 59.23 3d4j h GLN 262 Cb 0.11 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 3d4j h GLN 262 CO -0.03 0.99 -0.38 0.35 -1.93 0.00 0.00 178.83 177.84 3d4j h PHE 263 N 0.50 -1.00 -0.01 3.99 3.57 -0.93 0.16 116.94 123.22 3d4j h PHE 263 Ca 0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3d4j h PHE 263 Cb 1.05 0.36 -0.00 0.00 2.79 0.00 0.00 35.95 40.15 3d4j h PHE 263 CO 0.05 -0.57 0.01 0.45 -2.23 0.00 0.00 178.31 176.02 3d4j h HIS 264 N -0.93 0.00 -0.39 0.41 3.86 -1.43 -0.59 115.15 116.08 3d4j h HIS 264 Ca -0.07 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.10 3d4j h HIS 264 Cb 0.76 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.21 3d4j h HIS 264 CO -0.10 0.00 0.12 0.00 0.86 0.00 0.00 177.93 178.80 3d4j h ALA 265 N 1.99 0.51 0.00 2.45 0.00 -0.06 -1.89 119.26 122.26 3d4j h ALA 265 Ca 0.01 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3d4j h ALA 265 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3d4j h ALA 265 CO -0.00 0.16 -0.25 1.79 0.00 0.00 0.00 179.25 180.96 3d4j h THR 266 N 0.49 0.82 -0.15 0.00 1.35 0.57 -1.48 112.91 114.51 3d4j h THR 266 Ca 0.13 -1.00 -0.13 0.00 -0.55 0.00 0.00 66.41 64.86 3d4j h THR 266 Cb 0.27 1.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 3d4j h THR 266 CO -0.00 0.24 -0.47 0.00 -0.25 0.00 0.00 175.52 175.05 3d4j h LEU 268 N 0.29 0.00 -0.34 0.00 5.85 -0.58 0.35 115.31 120.89 3d4j h LEU 268 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3d4j h LEU 268 Cb 0.93 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.96 3d4j h LEU 268 CO 0.08 0.51 -0.07 -0.67 -0.34 0.00 0.00 178.44 177.95 3d4j n ASP 269 N -3.57 0.60 -4.86 1.25 2.03 -0.63 -4.63 116.55 106.74 3d4j n ASP 269 Ca -0.00 -0.84 -0.31 0.00 0.52 0.00 0.00 54.79 54.15 3d4j n ASP 269 Cb 0.60 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 3d4j n ASP 269 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3d4j s THR 270 N -2.30 4.64 -0.14 5.18 2.01 -0.85 -4.27 115.64 119.91 3d4j s THR 270 Ca 0.34 0.93 -0.01 0.00 0.31 0.00 0.00 61.69 63.26 3d4j s THR 270 Cb 0.21 -3.82 0.04 0.00 0.01 0.00 0.00 72.50 68.93 3d4j s THR 270 CO 0.43 -1.05 -0.02 0.12 -0.69 0.00 0.00 174.62 173.41 3d4j s PHE 271 N -3.07 1.22 0.82 4.92 5.36 -1.26 -1.99 117.98 123.99 3d4j s PHE 271 Ca 0.56 -0.74 -0.12 0.00 -0.96 0.00 0.00 56.93 55.67 3d4j s PHE 271 Cb -0.11 -1.09 0.09 0.00 -0.34 0.00 0.00 43.02 41.57 3d4j s PHE 271 CO 0.50 -0.52 1.16 -2.14 -1.46 0.00 0.00 175.22 172.76 3d4j s PRO 272 N 1.79 1.62 0.54 10.12 0.02 -1.26 -4.92 135.00 142.91 3d4j s PRO 272 Ca 0.02 1.58 -0.20 0.00 0.02 0.00 0.00 61.00 62.42 3d4j s PRO 272 Cb -0.15 -1.79 -0.06 0.00 0.02 0.00 0.00 34.50 32.53 3d4j s PRO 272 CO -0.07 -2.19 1.16 -1.25 -0.33 0.00 0.00 177.00 174.32 3d4j s PRO 273 N -4.39 3.35 0.00 5.54 0.04 -0.84 -5.02 135.00 133.68 3d4j s PRO 273 Ca 0.69 1.72 0.02 0.00 0.04 0.00 0.00 61.00 63.47 3d4j s PRO 273 Cb -0.25 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 3d4j s PRO 273 CO 0.53 -0.88 -0.03 0.42 0.04 0.00 0.00 177.00 177.08 3d4j s ILE 274 N -1.66 3.95 -0.15 0.56 1.01 0.12 -4.98 121.20 120.05 3d4j s ILE 274 Ca 0.72 -0.68 -0.02 0.00 0.00 0.00 0.00 60.65 60.67 3d4j s ILE 274 Cb -0.27 -2.75 0.05 0.00 0.01 0.00 0.00 42.46 39.50 3d4j s ILE 274 CO 0.31 0.38 -0.00 -0.55 0.00 0.00 0.00 174.94 175.07 3d4j s SER 275 N -1.52 2.55 -0.07 3.58 0.15 -1.26 -3.72 113.70 113.41 3d4j s SER 275 Ca 0.19 -0.59 0.08 0.00 0.70 0.00 0.00 55.95 56.33 3d4j s SER 275 Cb -0.11 -0.66 -0.12 0.00 -1.71 0.00 0.00 66.02 63.42 3d4j s SER 275 CO 0.09 -0.24 0.07 -1.22 1.20 0.00 0.00 173.24 173.15 3d4j n TYR 276 N 5.02 0.00 -2.86 3.44 0.53 -1.26 -4.90 117.16 117.13 3d4j n TYR 276 Ca -0.09 0.00 -0.41 0.00 -1.02 0.00 0.00 57.90 56.38 3d4j n TYR 276 Cb 0.48 -0.39 -0.04 0.00 -1.03 0.00 0.00 39.34 38.36 3d4j n TYR 276 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 3d4j s LEU 277 N -4.43 4.40 0.00 7.72 1.43 -1.26 -1.62 118.68 124.92 3d4j s LEU 277 Ca -0.04 1.51 0.04 0.00 -1.03 0.00 0.00 54.13 54.61 3d4j s LEU 277 Cb 0.03 -3.37 0.04 0.00 0.03 0.00 0.00 46.19 42.93 3d4j s LEU 277 CO 0.37 -0.13 0.36 -0.46 0.23 0.00 0.00 176.35 176.73 3d4j n ASN 278 N 3.43 2.87 -0.34 2.29 0.23 -1.26 -4.95 115.26 117.53 3d4j n ASN 278 Ca 0.02 -2.96 0.18 0.00 -0.53 0.00 0.00 54.58 51.28 3d4j n ASN 278 Cb 0.51 0.01 0.40 0.00 -2.08 0.00 0.00 39.78 38.61 3d4j n ASN 278 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3d4j h ALA 279 N 0.75 1.82 -0.66 -2.53 0.00 -1.97 0.16 119.26 116.83 3d4j h ALA 279 Ca -0.36 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 3d4j h ALA 279 Cb 1.29 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 3d4j h ALA 279 CO 0.57 -0.30 0.09 0.82 0.00 0.00 0.00 179.25 180.43 3d4j h ILE 280 N 0.56 1.26 -0.70 0.00 1.08 -1.94 -2.16 117.51 115.62 3d4j h ILE 280 Ca 0.65 -1.06 0.09 0.00 -0.39 0.00 0.00 64.86 64.14 3d4j h ILE 280 Cb 1.26 0.66 -0.07 0.00 -3.07 0.00 0.00 36.82 35.60 3d4j h ILE 280 CO -0.47 0.40 0.34 0.28 -0.69 0.00 0.00 178.15 178.01 3d4j h SER 281 N 1.03 0.44 0.10 1.72 0.02 -0.92 -1.11 113.55 114.83 3d4j h SER 281 Ca 0.20 0.06 -0.16 0.00 -0.84 0.00 0.00 61.79 61.05 3d4j h SER 281 Cb 0.47 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 3d4j h SER 281 CO 0.02 0.26 -0.57 -0.50 -1.14 0.00 0.00 176.83 174.89 3d4j h TRP 282 N 0.59 0.62 -0.11 3.45 4.06 -1.17 -0.19 115.95 123.20 3d4j h TRP 282 Ca 0.34 -0.23 -0.10 0.00 2.06 0.00 0.00 58.89 60.97 3d4j h TRP 282 Cb 0.36 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.39 3d4j h TRP 282 CO -0.11 0.94 -0.37 0.00 -3.56 0.00 0.00 178.44 175.35 3d4j h ARG 283 N 0.37 0.23 -0.13 0.49 3.08 -0.93 0.17 114.38 117.66 3d4j h ARG 283 Ca 0.00 -0.10 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 3d4j h ARG 283 Cb 1.11 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.16 3d4j h ARG 283 CO 0.10 0.57 -0.49 0.82 -1.07 0.00 0.00 179.97 179.91 3d4j h ILE 284 N 0.20 1.35 -0.45 2.04 2.04 -0.99 -0.42 117.51 121.28 3d4j h ILE 284 Ca 0.02 -1.78 0.06 0.00 1.00 0.00 0.00 64.86 64.16 3d4j h ILE 284 Cb 0.74 2.10 -0.05 0.00 -0.74 0.00 0.00 36.82 38.87 3d4j h ILE 284 CO 0.06 0.54 0.15 0.40 0.00 0.00 0.00 178.15 179.30 3d4j h ILE 285 N 0.18 0.84 0.00 -0.67 2.04 -0.65 -0.11 117.51 119.14 3d4j h ILE 285 Ca -0.02 -0.11 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 3d4j h ILE 285 Cb 1.12 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 3d4j h ILE 285 CO 0.10 0.06 -0.17 0.45 0.00 0.00 0.00 178.15 178.58 3d4j h HIS 286 N 0.32 0.00 -0.18 1.37 3.86 -0.89 -2.55 115.15 117.08 3d4j h HIS 286 Ca 0.22 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.23 3d4j h HIS 286 Cb 0.23 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.70 3d4j h HIS 286 CO -0.16 0.17 -0.66 1.25 0.86 0.00 0.00 177.93 179.39 3d4j h LEU 287 N 0.00 0.89 -0.39 2.43 5.85 0.70 -2.51 115.31 122.29 3d4j h LEU 287 Ca -0.00 -0.60 -0.03 0.00 0.84 0.00 0.00 57.88 58.09 3d4j h LEU 287 Cb 0.56 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3d4j h LEU 287 CO 0.02 1.34 0.13 0.58 -0.34 0.00 0.00 178.44 180.17 3d4j h VAL 288 N 0.49 1.21 -0.35 1.05 2.07 -0.94 0.83 116.25 120.61 3d4j h VAL 288 Ca -0.03 -0.68 -0.10 0.00 0.82 0.00 0.00 66.70 66.71 3d4j h VAL 288 Cb 1.28 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 3d4j h VAL 288 CO 0.14 0.24 -0.19 0.45 0.02 0.00 0.00 177.57 178.22 3d4j h HIS 289 N 0.48 0.74 -0.17 1.57 3.86 -1.51 -1.31 115.15 118.82 3d4j h HIS 289 Ca 0.13 -0.15 -0.17 0.00 -1.16 0.00 0.00 60.37 59.02 3d4j h HIS 289 Cb 0.24 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 3d4j h HIS 289 CO 0.01 0.81 -0.59 0.00 0.86 0.00 0.00 177.93 179.02 3d4j h ARG 290 N 0.59 0.54 0.18 2.45 2.47 -1.28 -1.00 114.38 118.34 3d4j h ARG 290 Ca 0.09 -0.36 -0.01 0.00 -1.26 0.00 0.00 59.98 58.44 3d4j h ARG 290 Cb 0.66 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.03 3d4j h ARG 290 CO 0.05 0.97 -0.09 0.35 0.56 0.00 0.00 179.97 181.81 3d4j h PHE 291 N 0.41 -0.23 -0.50 3.04 3.57 -0.62 -1.73 116.94 120.88 3d4j h PHE 291 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3d4j h PHE 291 Cb 1.14 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 3d4j h PHE 291 CO 0.05 -0.04 0.30 -0.91 -2.23 0.00 0.00 178.31 175.47 3d4j h ASN 292 N -0.37 0.60 -0.21 0.41 2.35 -1.21 -2.43 115.58 114.72 3d4j h ASN 292 Ca -0.03 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 3d4j h ASN 292 Cb 0.29 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 3d4j h ASN 292 CO 0.04 0.48 0.03 0.00 -1.65 0.00 0.00 177.43 176.33 3d4j h ALA 293 N 1.15 1.50 -0.35 -0.83 0.00 -1.14 0.94 119.26 120.53 3d4j h ALA 293 Ca 0.18 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 3d4j h ALA 293 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3d4j h ALA 293 CO -0.03 0.37 -0.24 1.25 0.00 0.00 0.00 179.25 180.59 3d4j h HIS 294 N 0.44 0.78 -0.01 0.00 -0.00 -0.86 -1.48 115.15 114.03 3d4j h HIS 294 Ca 0.10 -0.18 0.00 0.00 -0.00 0.00 0.00 60.37 60.29 3d4j h HIS 294 Cb 0.24 -0.19 0.00 0.00 -0.00 0.00 0.00 27.41 27.46 3d4j h HIS 294 CO 0.01 0.87 -0.06 0.72 -0.00 0.00 0.00 177.93 179.47 3d4j n HIS 295 N -4.11 0.00 -3.03 5.26 -0.00 -0.83 -4.89 115.22 107.62 3d4j n HIS 295 Ca -0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.51 3d4j n HIS 295 Cb 0.43 -0.08 0.01 0.00 -0.00 0.00 0.00 29.99 30.35 3d4j n HIS 295 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3d4j n GLY 296 N 1.18 -0.50 3.62 -1.41 0.00 0.20 -4.93 105.19 103.34 3d4j n GLY 296 Ca 0.18 0.09 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 3d4j n GLY 296 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3d4j s ASP 297 N -2.57 -0.58 -0.91 1.61 3.68 -0.45 -5.01 116.67 112.44 3d4j s ASP 297 Ca 0.28 1.05 -0.24 0.00 2.13 0.00 0.00 52.55 55.76 3d4j s ASP 297 Cb -0.14 1.04 -0.01 0.00 -1.45 0.00 0.00 42.92 42.36 3d4j s ASP 297 CO 0.34 -0.25 1.77 -0.89 0.13 0.00 0.00 175.17 176.27 3d4j s THR 298 N 0.04 3.59 -0.78 1.71 2.01 -1.26 -4.49 115.64 116.47 3d4j s THR 298 Ca 0.00 -0.42 0.21 0.00 0.31 0.00 0.00 61.69 61.79 3d4j s THR 298 Cb -0.04 -4.35 -0.25 0.00 0.01 0.00 0.00 72.50 67.87 3d4j s THR 298 CO -0.01 -1.28 0.79 0.29 -0.69 0.00 0.00 174.62 173.73 3d4j n LYS 299 N 8.91 0.24 -3.99 4.92 5.02 -1.26 -4.18 118.16 127.82 3d4j n LYS 299 Ca 0.35 -0.04 -0.09 0.00 -2.02 0.00 0.00 58.31 56.51 3d4j n LYS 299 Cb 0.49 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.90 3d4j n LYS 299 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3d4j s VAL 300 N -3.08 0.13 0.03 -0.18 1.01 -1.26 -4.39 120.40 112.66 3d4j s VAL 300 Ca 0.04 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.06 3d4j s VAL 300 Cb 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 36.17 3d4j s VAL 300 CO 0.86 -0.53 -0.05 0.00 0.00 0.00 0.00 175.10 175.39 3d4j s ALA 301 N -1.60 0.31 0.20 5.51 0.00 -0.51 -4.91 121.76 120.75 3d4j s ALA 301 Ca -0.14 -0.64 0.10 0.00 0.00 0.00 0.00 51.96 51.28 3d4j s ALA 301 Cb -0.09 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 3d4j s ALA 301 CO -0.01 -0.09 -0.21 1.52 0.00 0.00 0.00 175.76 176.97 3d4j s TYR 302 N -1.36 2.08 -0.21 0.00 -0.85 -1.26 -0.89 117.35 114.86 3d4j s TYR 302 Ca -0.13 -0.41 -0.17 0.00 -0.52 0.00 0.00 57.07 55.84 3d4j s TYR 302 Cb -0.10 -1.01 0.06 0.00 0.38 0.00 0.00 41.96 41.29 3d4j s TYR 302 CO -0.00 0.46 0.54 -0.08 -1.52 0.00 0.00 175.55 174.95 3d4j s THR 303 N -2.01 -0.00 -0.03 -3.49 -1.32 0.00 -3.88 115.64 104.91 3d4j s THR 303 Ca 0.20 0.01 0.07 0.00 -1.21 0.00 0.00 61.69 60.76 3d4j s THR 303 Cb -0.06 -0.77 -0.02 0.00 -1.51 0.00 0.00 72.50 70.14 3d4j s THR 303 CO 0.09 0.01 -0.23 -0.36 -2.21 0.00 0.00 174.62 171.92 3d4j s PHE 304 N 0.62 2.09 0.00 9.09 0.40 -1.26 -1.63 117.98 127.28 3d4j s PHE 304 Ca -0.03 -0.45 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 3d4j s PHE 304 Cb -0.05 -1.35 0.00 0.00 0.51 0.00 0.00 43.02 42.13 3d4j s PHE 304 CO -0.04 -0.07 0.00 -0.25 0.70 0.00 0.00 175.22 175.56 3d4j n ASP 305 N 2.64 0.00 -3.54 1.36 8.00 -1.26 -4.93 116.55 118.82 3d4j n ASP 305 Ca -0.16 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 54.94 3d4j n ASP 305 Cb 0.52 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.63 3d4j n ASP 305 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d4j n ALA 306 N -3.00 6.42 -3.68 2.24 0.00 -1.26 -4.86 120.51 116.37 3d4j n ALA 306 Ca 0.00 -4.35 0.03 0.00 0.00 0.00 0.00 53.44 49.12 3d4j n ALA 306 Cb 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.01 3d4j n ALA 306 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d4j s GLY 307 N -0.55 -0.41 0.00 0.00 0.00 -1.26 -4.95 107.32 100.15 3d4j s GLY 307 Ca 0.46 0.69 0.29 0.00 0.00 0.00 0.00 44.72 46.16 3d4j s GLY 307 CO -0.12 1.54 1.86 -1.55 0.00 0.00 0.00 173.10 174.83 3d4j n PRO 308 N -0.60 0.05 -1.80 2.90 -0.04 -0.64 -4.49 135.00 130.38 3d4j n PRO 308 Ca -0.06 -0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 63.00 3d4j n PRO 308 Cb 0.62 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.60 3d4j n PRO 308 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3d4j s ASN 309 N -2.95 5.78 -0.18 3.54 0.01 -1.26 -4.47 114.94 115.41 3d4j s ASN 309 Ca 0.15 2.89 -0.08 0.00 -0.71 0.00 0.00 52.86 55.11 3d4j s ASN 309 Cb 0.19 -2.65 -0.04 0.00 0.41 0.00 0.00 41.25 39.16 3d4j s ASN 309 CO 0.55 -1.24 0.08 0.00 -1.51 0.00 0.00 177.10 174.98 3d4j s ALA 310 N -1.22 3.49 -0.22 0.60 0.00 -0.64 -4.51 121.76 119.26 3d4j s ALA 310 Ca 0.63 -0.73 -0.08 0.00 0.00 0.00 0.00 51.96 51.78 3d4j s ALA 310 Cb -0.43 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.67 3d4j s ALA 310 CO 0.55 0.19 0.09 0.08 0.00 0.00 0.00 175.76 176.67 3d4j s VAL 311 N 0.32 4.77 -0.14 0.00 1.01 -0.65 0.94 120.40 126.65 3d4j s VAL 311 Ca 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 3d4j s VAL 311 Cb -0.12 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 3d4j s VAL 311 CO -0.00 0.38 -0.12 -0.63 0.00 0.00 0.00 175.10 174.73 3d4j s ILE 312 N 1.04 3.11 -0.14 2.22 -1.09 0.42 -0.82 121.20 125.94 3d4j s ILE 312 Ca 0.05 -0.63 -0.03 0.00 -2.23 0.00 0.00 60.65 57.80 3d4j s ILE 312 Cb -0.14 -2.32 -0.03 0.00 -1.58 0.00 0.00 42.46 38.39 3d4j s ILE 312 CO 0.03 0.51 -0.02 -0.36 -1.23 0.00 0.00 174.94 173.88 3d4j s PHE 313 N 0.50 3.08 0.13 3.97 0.40 -0.07 0.65 117.98 126.66 3d4j s PHE 313 Ca -0.08 -0.10 -0.25 0.00 -0.60 0.00 0.00 56.93 55.90 3d4j s PHE 313 Cb -0.16 -1.92 0.07 0.00 0.51 0.00 0.00 43.02 41.53 3d4j s PHE 313 CO 0.04 0.14 0.76 -0.08 0.70 0.00 0.00 175.22 176.78 3d4j s THR 314 N -0.02 0.00 0.39 0.64 -1.32 -0.65 -1.43 115.64 113.25 3d4j s THR 314 Ca 0.02 -0.30 -0.10 0.00 -1.21 0.00 0.00 61.69 60.11 3d4j s THR 314 Cb -0.13 -1.35 -0.06 0.00 -1.51 0.00 0.00 72.50 69.45 3d4j s THR 314 CO 0.02 0.00 0.74 -0.76 -2.21 0.00 0.00 174.62 172.41 3d4j s LEU 315 N -2.74 3.87 0.30 9.08 1.43 -1.26 0.10 118.68 129.46 3d4j s LEU 315 Ca 0.06 1.07 0.05 0.00 -1.03 0.00 0.00 54.13 54.28 3d4j s LEU 315 Cb -0.02 -3.94 0.77 0.00 0.03 0.00 0.00 46.19 43.03 3d4j s LEU 315 CO -0.06 -0.37 1.69 -2.24 0.23 0.00 0.00 176.35 175.60 3d4j h ASP 316 N 1.33 0.31 0.41 2.29 2.03 -1.23 -0.76 116.42 120.81 3d4j h ASP 316 Ca -0.47 0.16 0.00 0.00 -0.73 0.00 0.00 57.03 55.99 3d4j h ASP 316 Cb 1.19 0.15 0.00 0.00 -0.83 0.00 0.00 39.33 39.84 3d4j h ASP 316 CO 0.64 -0.04 0.00 -0.90 -1.03 0.00 0.00 179.24 177.91 3d4j n ASP 317 N -5.07 0.00 -0.06 4.15 5.75 -1.26 -2.89 116.55 117.17 3d4j n ASP 317 Ca 0.23 0.35 0.01 0.00 -0.01 0.00 0.00 54.79 55.37 3d4j n ASP 317 Cb 0.70 -0.42 0.01 0.00 -1.03 0.00 0.00 41.12 40.38 3d4j n ASP 317 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 3d4j n THR 318 N -1.42 0.27 0.17 2.12 5.66 -0.31 -4.77 114.28 116.00 3d4j n THR 318 Ca 0.05 -0.64 -0.14 0.00 -3.05 0.00 0.00 64.05 60.27 3d4j n THR 318 Cb 0.15 0.88 -0.08 0.00 -1.55 0.00 0.00 70.33 69.73 3d4j n THR 318 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 3d4j h VAL 319 N 0.25 0.74 -0.51 1.08 2.07 -1.38 -2.36 116.25 116.15 3d4j h VAL 319 Ca 0.00 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.40 3d4j h VAL 319 Cb 0.18 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 3d4j h VAL 319 CO 0.00 0.04 0.20 0.00 0.02 0.00 0.00 177.57 177.83 3d4j h ALA 320 N 0.21 0.64 -0.36 1.67 0.00 -1.85 0.39 119.26 119.95 3d4j h ALA 320 Ca -0.04 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3d4j h ALA 320 Cb 0.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3d4j h ALA 320 CO 0.06 -0.18 -0.37 1.49 0.00 0.00 0.00 179.25 180.25 3d4j h GLU 321 N 0.40 0.86 -0.56 0.00 4.81 -1.88 -1.76 114.58 116.45 3d4j h GLU 321 Ca 0.24 -0.44 -0.11 0.00 -0.13 0.00 0.00 59.36 58.93 3d4j h GLU 321 Cb 0.23 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 3d4j h GLU 321 CO -0.22 1.08 -0.07 0.35 -0.73 0.00 0.00 179.01 179.42 3d4j h PHE 322 N 0.71 1.13 -0.33 0.92 3.57 -1.03 -1.21 116.94 120.69 3d4j h PHE 322 Ca 0.06 -0.22 -0.08 0.00 3.53 0.00 0.00 57.97 61.26 3d4j h PHE 322 Cb 0.94 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3d4j h PHE 322 CO 0.06 1.03 -0.15 0.28 -2.23 0.00 0.00 178.31 177.29 3d4j h VAL 323 N 0.92 1.25 0.00 1.41 2.07 -0.88 -1.06 116.25 119.95 3d4j h VAL 323 Ca 0.15 -1.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.48 3d4j h VAL 323 Cb 0.63 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3d4j h VAL 323 CO 0.04 0.37 -0.26 0.00 0.02 0.00 0.00 177.57 177.74 3d4j h ALA 324 N 1.31 1.47 -0.19 1.67 0.00 -0.93 -1.19 119.26 121.40 3d4j h ALA 324 Ca 0.09 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 3d4j h ALA 324 Cb 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3d4j h ALA 324 CO 0.04 0.33 -0.51 0.00 0.00 0.00 0.00 179.25 179.10 3d4j h ALA 325 N 1.74 0.32 -0.12 0.00 0.00 -0.01 -2.41 119.26 118.77 3d4j h ALA 325 Ca -0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 3d4j h ALA 325 Cb 0.49 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3d4j h ALA 325 CO 0.03 0.50 -0.47 -0.39 0.00 0.00 0.00 179.25 178.93 3d4j h VAL 326 N 0.38 1.33 -0.75 0.00 -1.51 -0.89 -1.42 116.25 113.39 3d4j h VAL 326 Ca -0.01 -1.68 -0.01 0.00 -1.23 0.00 0.00 66.70 63.77 3d4j h VAL 326 Cb 1.13 1.76 -0.04 0.00 -2.13 0.00 0.00 31.29 32.01 3d4j h VAL 326 CO 0.11 0.50 0.42 -0.25 -1.23 0.00 0.00 177.57 177.13 3d4j h TRP 327 N 0.25 1.01 -0.34 5.19 2.91 -1.21 0.67 115.95 124.44 3d4j h TRP 327 Ca 0.01 -0.02 -0.05 0.00 1.13 0.00 0.00 58.89 59.97 3d4j h TRP 327 Cb 0.93 -0.33 -0.01 0.00 -0.51 0.00 0.00 29.16 29.24 3d4j h TRP 327 CO 0.02 0.70 0.02 1.25 -1.03 0.00 0.00 178.44 179.41 3d4j h HIS 328 N 1.03 0.64 -0.06 2.65 2.76 -1.13 -1.77 115.15 119.27 3d4j h HIS 328 Ca 0.26 -0.10 -0.13 0.00 -2.20 0.00 0.00 60.37 58.20 3d4j h HIS 328 Cb 0.01 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.79 3d4j h HIS 328 CO -0.00 0.68 -0.55 0.78 -1.30 0.00 0.00 177.93 177.54 3d4j h GLY 329 N 0.41 0.18 -6.08 5.26 0.00 -0.76 -3.39 103.07 98.69 3d4j h GLY 329 Ca 0.10 -0.21 -0.57 0.00 0.00 0.00 0.00 47.33 46.66 3d4j h GLY 329 CO 0.01 0.18 -1.06 0.69 0.00 0.00 0.00 176.54 176.36 3d4j n PHE 330 N -3.90 -0.31 -1.85 5.60 3.01 0.23 -0.77 117.46 119.46 3d4j n PHE 330 Ca -0.02 -3.54 -0.42 0.00 1.01 0.00 0.00 57.45 54.48 3d4j n PHE 330 Cb 0.57 -0.25 -0.03 0.00 -0.01 0.00 0.00 39.48 39.77 3d4j n PHE 330 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3d4j s PRO 331 N -1.00 4.17 0.56 -1.08 0.04 -0.67 -4.44 135.00 132.58 3d4j s PRO 331 Ca 0.35 2.43 0.37 0.00 0.04 0.00 0.00 61.00 64.19 3d4j s PRO 331 Cb 0.14 -3.59 1.95 0.00 0.04 0.00 0.00 34.50 33.04 3d4j s PRO 331 CO -0.12 -0.77 2.14 -1.00 0.04 0.00 0.00 177.00 177.28 3d4j h PRO 332 N 8.41 0.00 -1.87 0.56 0.13 -1.84 -1.03 132.00 136.36 3d4j h PRO 332 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3d4j h PRO 332 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3d4j h PRO 332 CO 0.94 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.12 3d4j n GLY 333 N -0.91 0.74 2.16 1.56 0.00 -1.26 -4.55 105.19 102.94 3d4j n GLY 333 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3d4j n GLY 333 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d4j n SER 334 N -0.87 -7.05 0.00 1.61 7.64 -1.26 -5.01 113.62 108.69 3d4j n SER 334 Ca 0.00 1.54 0.00 0.00 1.01 0.00 0.00 58.87 61.42 3d4j n SER 334 Cb 0.31 -4.28 0.00 0.00 -1.01 0.00 0.00 64.21 59.23 3d4j n SER 334 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3d4j n ASN 335 N 1.89 0.00 0.00 6.43 2.04 -1.26 -4.98 115.26 119.38 3d4j n ASN 335 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 3d4j n ASN 335 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 3d4j n ASN 335 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3d4j n GLY 336 N 0.00 3.06 3.77 4.83 0.00 -1.26 -4.97 105.19 110.63 3d4j n GLY 336 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3d4j n GLY 336 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d4j s ASP 337 N -1.16 7.42 0.00 1.61 1.11 -1.26 -3.44 116.67 120.95 3d4j s ASP 337 Ca 0.00 1.81 0.00 0.00 0.18 0.00 0.00 52.55 54.54 3d4j s ASP 337 Cb 0.00 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 3d4j s ASP 337 CO 0.00 0.05 0.00 0.35 1.18 0.00 0.00 175.17 176.75 3d4j n THR 338 N 1.01 0.00 0.02 -1.27 -2.24 -1.26 -4.67 114.28 105.87 3d4j n THR 338 Ca -0.01 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.71 3d4j n THR 338 Cb 0.49 -0.58 -0.11 0.00 -2.10 0.00 0.00 70.33 68.02 3d4j n THR 338 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3d4j h PHE 339 N 0.00 0.00 -3.12 4.78 3.57 -1.86 -3.43 116.94 116.87 3d4j h PHE 339 Ca 0.00 0.00 -0.67 0.00 3.53 0.00 0.00 57.97 60.83 3d4j h PHE 339 Cb 0.43 0.00 -0.34 0.00 2.79 0.00 0.00 35.95 38.83 3d4j h PHE 339 CO 0.27 0.90 -0.85 -0.51 -2.23 0.00 0.00 178.31 175.89 3d4j s LEU 340 N -6.28 2.18 0.24 0.59 1.43 -1.26 0.27 118.68 115.85 3d4j s LEU 340 Ca -0.02 -0.62 0.09 0.00 -1.03 0.00 0.00 54.13 52.55 3d4j s LEU 340 Cb 0.09 -1.49 -0.05 0.00 0.03 0.00 0.00 46.19 44.77 3d4j s LEU 340 CO 0.82 0.02 -0.15 -0.54 0.23 0.00 0.00 176.35 176.72 3d4j s LYS 341 N 1.18 1.46 3.48 1.70 1.02 0.65 -4.96 119.74 124.26 3d4j s LYS 341 Ca 0.02 -1.66 0.00 0.00 0.02 0.00 0.00 55.97 54.35 3d4j s LYS 341 Cb -0.14 -1.32 0.00 0.00 -0.52 0.00 0.00 37.83 35.85 3d4j s LYS 341 CO -0.10 0.22 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 3d4j n GLY 342 N -0.47 0.13 3.52 -3.33 0.00 -1.26 -0.53 105.19 103.25 3d4j n GLY 342 Ca -0.07 -1.04 -0.46 0.00 0.00 0.00 0.00 46.02 44.46 3d4j n GLY 342 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d4j n LEU 343 N 0.00 0.69 -4.68 0.99 4.32 0.59 -4.87 117.00 114.04 3d4j n LEU 343 Ca 0.00 1.15 -0.42 0.00 -0.02 0.00 0.00 56.01 56.72 3d4j n LEU 343 Cb 0.00 -1.17 -0.03 0.00 -1.62 0.00 0.00 43.42 40.61 3d4j n LEU 343 CO 0.00 -2.00 1.08 0.00 -1.22 0.00 0.00 177.39 175.26 3d4j s GLN 344 N -1.37 4.29 -0.13 3.23 0.00 -1.26 -4.72 119.66 119.70 3d4j s GLN 344 Ca 0.61 1.84 0.03 0.00 -0.00 0.00 0.00 55.36 57.83 3d4j s GLN 344 Cb -0.78 -3.64 0.01 0.00 0.00 0.00 0.00 33.01 28.61 3d4j s GLN 344 CO 0.59 -0.58 -0.21 0.54 0.00 0.00 0.00 175.29 175.62 3d4j s VAL 345 N 2.67 1.97 -0.10 3.63 0.11 -1.26 -5.10 120.40 122.32 3d4j s VAL 345 Ca 0.60 -0.93 -0.28 0.00 -2.93 0.00 0.00 61.98 58.45 3d4j s VAL 345 Cb -0.28 -1.74 -0.02 0.00 -1.53 0.00 0.00 36.38 32.81 3d4j s VAL 345 CO 0.23 0.53 0.93 0.00 -3.33 0.00 0.00 175.10 173.47 3d4j s ARG 346 N 0.80 4.41 0.08 1.54 1.70 -1.26 -4.99 118.95 121.23 3d4j s ARG 346 Ca -0.08 1.26 -0.33 0.00 -0.47 0.00 0.00 55.73 56.11 3d4j s ARG 346 Cb -0.16 -3.53 -0.12 0.00 -0.57 0.00 0.00 34.95 30.57 3d4j s ARG 346 CO -0.01 -0.24 1.75 -0.35 -1.08 0.00 0.00 175.30 175.37 3d4j n PRO 347 N 4.78 2.38 -4.21 3.89 -0.04 -1.26 -4.75 135.00 135.79 3d4j n PRO 347 Ca 0.06 0.87 -0.30 0.00 -0.04 0.00 0.00 63.50 64.09 3d4j n PRO 347 Cb 0.49 -2.70 -0.09 0.00 -0.04 0.00 0.00 33.50 31.16 3d4j n PRO 347 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d4j s ALA 348 N 2.39 3.12 0.50 0.55 0.00 -1.26 -5.09 121.76 121.98 3d4j s ALA 348 Ca 0.84 -1.15 -0.12 0.00 0.00 0.00 0.00 51.96 51.52 3d4j s ALA 348 Cb -0.61 -1.07 -0.06 0.00 0.00 0.00 0.00 23.12 21.38 3d4j s ALA 348 CO 0.41 0.67 0.91 -1.25 0.00 0.00 0.00 175.76 176.50 3d4j s PRO 349 N -2.15 3.76 -0.22 0.00 0.04 -1.26 -4.69 135.00 130.48 3d4j s PRO 349 Ca 0.23 0.66 -0.10 0.00 0.04 0.00 0.00 61.00 61.83 3d4j s PRO 349 Cb -0.11 -2.23 -0.05 0.00 0.04 0.00 0.00 34.50 32.15 3d4j s PRO 349 CO 0.15 -0.26 0.13 -0.51 0.04 0.00 0.00 177.00 176.55 3d4j s LEU 350 N -4.36 4.02 0.53 -3.56 1.43 -1.26 -4.98 118.68 110.49 3d4j s LEU 350 Ca 0.54 0.10 -0.22 0.00 -1.03 0.00 0.00 54.13 53.52 3d4j s LEU 350 Cb -0.10 -2.06 -0.06 0.00 0.03 0.00 0.00 46.19 43.99 3d4j s LEU 350 CO 0.39 0.09 1.22 -0.24 0.23 0.00 0.00 176.35 178.04 3d4j n SER 351 N 4.09 2.10 -0.03 2.29 2.88 -1.26 -4.80 113.62 118.88 3d4j n SER 351 Ca -0.16 0.96 -0.08 0.00 -1.33 0.00 0.00 58.87 58.26 3d4j n SER 351 Cb 0.52 -1.50 0.08 0.00 -0.75 0.00 0.00 64.21 62.56 3d4j n SER 351 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3d4j h ALA 352 N 1.33 0.79 -0.07 -1.46 0.00 -1.98 0.24 119.26 118.11 3d4j h ALA 352 Ca -0.49 -0.44 -0.18 0.00 0.00 0.00 0.00 54.91 53.80 3d4j h ALA 352 Cb 1.32 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3d4j h ALA 352 CO 0.56 0.65 -0.71 1.49 0.00 0.00 0.00 179.25 181.24 3d4j h GLU 353 N 0.54 0.36 -0.23 0.00 4.81 -1.99 -1.59 114.58 116.48 3d4j h GLU 353 Ca 0.05 -0.29 -0.15 0.00 -0.13 0.00 0.00 59.36 58.83 3d4j h GLU 353 Cb 0.91 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.35 3d4j h GLU 353 CO 0.08 0.93 -0.46 1.25 -0.73 0.00 0.00 179.01 180.09 3d4j h LEU 354 N 0.25 0.80 -1.05 1.64 7.12 -1.88 -0.67 115.31 121.52 3d4j h LEU 354 Ca -0.03 -0.54 0.01 0.00 0.13 0.00 0.00 57.88 57.45 3d4j h LEU 354 Cb 1.28 -0.23 -0.05 0.00 -0.53 0.00 0.00 40.66 41.13 3d4j h LEU 354 CO 0.12 1.20 0.61 -0.61 -0.13 0.00 0.00 178.44 179.62 3d4j h GLN 355 N 0.44 1.25 -0.33 1.25 4.15 -0.45 -1.50 115.11 119.91 3d4j h GLN 355 Ca 0.01 -0.08 -0.18 0.00 0.77 0.00 0.00 58.65 59.17 3d4j h GLN 355 Cb 1.06 -0.28 -0.00 0.00 0.21 0.00 0.00 27.48 28.47 3d4j h GLN 355 CO 0.10 0.84 -0.48 0.00 -1.93 0.00 0.00 178.83 177.36 3d4j h ALA 356 N 1.39 0.51 -0.30 3.38 0.00 -1.15 -3.04 119.26 120.05 3d4j h ALA 356 Ca 0.34 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3d4j h ALA 356 Cb -0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3d4j h ALA 356 CO -0.07 0.68 0.08 0.00 0.00 0.00 0.00 179.25 179.94 3d4j h ALA 357 N 0.72 1.59 -0.25 0.00 0.00 -0.59 -0.90 119.26 119.83 3d4j h ALA 357 Ca 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3d4j h ALA 357 Cb 1.08 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3d4j h ALA 357 CO 0.11 0.31 -0.00 -0.07 0.00 0.00 0.00 179.25 179.60 3d4j h LEU 358 N 0.42 0.34 -3.79 0.00 3.38 -1.17 -3.46 115.31 111.02 3d4j h LEU 358 Ca 0.10 -0.05 -0.52 0.00 0.09 0.00 0.00 57.88 57.51 3d4j h LEU 358 Cb 0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3d4j h LEU 358 CO -0.01 0.40 -1.03 0.00 0.09 0.00 0.00 178.44 177.89 3d4j n ALA 359 N -2.49 -2.66 -3.66 1.53 0.00 -0.35 -4.92 120.51 107.97 3d4j n ALA 359 Ca 0.01 -0.39 -0.07 0.00 0.00 0.00 0.00 53.44 52.99 3d4j n ALA 359 Cb 0.21 -1.33 -0.08 0.00 0.00 0.00 0.00 19.45 18.25 3d4j n ALA 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d4j s MET 360 N -5.82 0.49 0.28 0.00 0.23 -1.26 -5.14 119.30 108.09 3d4j s MET 360 Ca 0.18 1.12 -0.29 0.00 -1.03 0.00 0.00 55.69 55.67 3d4j s MET 360 Cb -0.10 0.33 -0.10 0.00 -1.53 0.00 0.00 34.83 33.43 3d4j s MET 360 CO 0.89 -0.19 1.35 -1.83 -2.03 0.00 0.00 175.02 173.20 3d4j s GLU 361 N 2.16 4.34 0.82 3.16 -1.05 -1.26 -4.89 118.70 121.97 3d4j s GLU 361 Ca -0.07 2.21 -0.13 0.00 -0.15 0.00 0.00 54.97 56.84 3d4j s GLU 361 Cb -0.09 -3.11 0.09 0.00 -0.44 0.00 0.00 34.13 30.58 3d4j s GLU 361 CO -0.16 -0.27 1.19 -1.25 0.95 0.00 0.00 175.26 175.73 3d4j s PRO 362 N -1.05 1.57 -0.48 -4.83 0.04 -1.26 -5.00 135.00 123.99 3d4j s PRO 362 Ca 0.53 1.71 0.03 0.00 0.04 0.00 0.00 61.00 63.31 3d4j s PRO 362 Cb -0.40 -1.77 0.14 0.00 0.04 0.00 0.00 34.50 32.51 3d4j s PRO 362 CO 0.47 -2.26 0.28 0.99 0.04 0.00 0.00 177.00 176.52 3d4j s THR 363 N -2.24 1.69 0.22 1.26 2.01 0.05 -5.00 115.64 113.62 3d4j s THR 363 Ca 0.72 -2.89 -0.32 0.00 0.31 0.00 0.00 61.69 59.51 3d4j s THR 363 Cb -0.27 -2.17 -0.13 0.00 0.01 0.00 0.00 72.50 69.94 3d4j s THR 363 CO 0.52 -0.92 1.46 -2.65 -0.69 0.00 0.00 174.62 172.34 3d4j n PRO 364 N 3.23 2.08 -0.36 4.92 -0.02 -1.26 -1.03 135.00 142.57 3d4j n PRO 364 Ca 0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3d4j n PRO 364 Cb 0.35 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3d4j n PRO 364 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d4j n GLY 365 N 2.50 2.21 0.40 -1.23 0.00 -0.39 -4.88 105.19 103.80 3d4j n GLY 365 Ca 0.13 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.35 3d4j n GLY 365 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d4j h GLY 366 N 0.00 0.35 -6.18 -0.02 0.00 -1.35 -3.38 103.07 92.49 3d4j h GLY 366 Ca 0.00 -0.08 -0.67 0.00 0.00 0.00 0.00 47.33 46.58 3d4j h GLY 366 CO 0.00 0.02 -0.83 0.14 0.00 0.00 0.00 176.54 175.86 3d4j s VAL 367 N -5.19 2.32 0.02 4.60 1.01 -1.26 -2.03 120.40 119.87 3d4j s VAL 367 Ca -0.06 -0.85 -0.25 0.00 0.00 0.00 0.00 61.98 60.81 3d4j s VAL 367 Cb 0.21 -1.99 -0.18 0.00 0.00 0.00 0.00 36.38 34.42 3d4j s VAL 367 CO 0.76 0.52 1.39 0.11 0.00 0.00 0.00 175.10 177.88 3d4j h LYS 368 N 7.93 -0.15 -2.13 2.72 1.57 -0.59 -3.44 116.57 122.49 3d4j h LYS 368 Ca -0.44 0.01 0.20 0.00 -1.87 0.00 0.00 60.65 58.55 3d4j h LYS 368 Cb 1.15 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 33.39 3d4j h LYS 368 CO 0.63 0.16 0.56 1.52 -0.57 0.00 0.00 179.45 181.75 3d4j s TYR 369 N -4.94 -0.14 -0.14 -1.35 -0.85 -1.22 -4.79 117.35 103.93 3d4j s TYR 369 Ca -0.15 -0.10 0.01 0.00 -0.52 0.00 0.00 57.07 56.32 3d4j s TYR 369 Cb 0.03 0.61 0.02 0.00 0.38 0.00 0.00 41.96 42.99 3d4j s TYR 369 CO 0.63 -0.67 -0.17 0.42 -1.52 0.00 0.00 175.55 174.25 3d4j s ILE 370 N -3.07 1.69 -0.24 -3.49 1.01 0.14 -2.07 121.20 115.17 3d4j s ILE 370 Ca 0.12 -0.74 -0.15 0.00 0.00 0.00 0.00 60.65 59.88 3d4j s ILE 370 Cb -0.00 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 3d4j s ILE 370 CO -0.01 0.48 0.36 -0.63 0.00 0.00 0.00 174.94 175.14 3d4j s ILE 371 N 1.16 5.20 -0.19 2.92 1.01 -0.48 -0.25 121.20 130.57 3d4j s ILE 371 Ca -0.01 0.58 -0.04 0.00 0.00 0.00 0.00 60.65 61.17 3d4j s ILE 371 Cb -0.14 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 3d4j s ILE 371 CO -0.06 0.21 -0.04 -0.69 0.00 0.00 0.00 174.94 174.37 3d4j s VAL 372 N 1.66 3.62 0.00 2.92 1.01 0.31 -1.05 120.40 128.88 3d4j s VAL 372 Ca 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.71 3d4j s VAL 372 Cb -0.15 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.61 3d4j s VAL 372 CO 0.09 0.45 0.00 1.07 0.00 0.00 0.00 175.10 176.70 3d4j n THR 373 N 4.26 0.00 -3.77 3.92 5.66 -0.17 -0.30 114.28 123.88 3d4j n THR 373 Ca -0.18 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.74 3d4j n THR 373 Cb 0.52 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.29 3d4j n THR 373 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3d4j n GLN 374 N 0.00 0.63 -2.14 1.09 10.64 -1.26 -2.10 117.38 124.24 3d4j n GLN 374 Ca 0.00 -1.84 -0.42 0.00 -1.83 0.00 0.00 57.00 52.91 3d4j n GLN 374 Cb 0.00 1.96 -0.03 0.00 -0.86 0.00 0.00 30.24 31.31 3d4j n GLN 374 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 3d4j s VAL 375 N -2.57 3.22 0.52 -0.39 1.01 -1.26 -1.42 120.40 119.52 3d4j s VAL 375 Ca 0.17 0.88 0.00 0.00 0.00 0.00 0.00 61.98 63.03 3d4j s VAL 375 Cb -0.02 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.80 3d4j s VAL 375 CO 0.12 0.07 0.01 0.61 0.00 0.00 0.00 175.10 175.91 3d4j n GLY 376 N 3.50 3.52 3.95 4.51 0.00 -0.10 -4.61 105.19 115.96 3d4j n GLY 376 Ca 0.12 -2.36 -0.27 0.00 0.00 0.00 0.00 46.02 43.50 3d4j n GLY 376 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3d4j s PRO 377 N -3.89 1.28 0.32 1.61 0.04 -1.26 -0.81 135.00 132.29 3d4j s PRO 377 Ca 0.01 -0.55 -0.05 0.00 0.04 0.00 0.00 61.00 60.45 3d4j s PRO 377 Cb 0.00 -2.04 0.07 0.00 0.04 0.00 0.00 34.50 32.57 3d4j s PRO 377 CO 0.01 -1.89 0.39 0.41 0.04 0.00 0.00 177.00 175.95 3d4j n GLY 378 N -3.33 -1.58 3.59 0.56 0.00 -1.26 -4.34 105.19 98.83 3d4j n GLY 378 Ca 0.13 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.15 3d4j n GLY 378 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d4j n PRO 379 N -2.03 0.83 -4.32 1.61 -0.04 -1.26 -4.83 135.00 124.97 3d4j n PRO 379 Ca 0.05 0.32 -0.27 0.00 -0.04 0.00 0.00 63.50 63.57 3d4j n PRO 379 Cb 0.18 -2.07 -0.10 0.00 -0.04 0.00 0.00 33.50 31.47 3d4j n PRO 379 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3d4j s GLN 380 N -2.61 1.97 -0.15 0.54 -1.52 0.16 -4.93 119.66 113.12 3d4j s GLN 380 Ca 0.74 -1.32 -0.04 0.00 -1.95 0.00 0.00 55.36 52.78 3d4j s GLN 380 Cb -0.43 -2.10 -0.03 0.00 -0.22 0.00 0.00 33.01 30.23 3d4j s GLN 380 CO 0.49 0.43 -0.00 0.42 -0.25 0.00 0.00 175.29 176.37 3d4j s ILE 381 N -1.73 4.23 0.40 1.08 1.01 -1.26 -0.67 121.20 124.26 3d4j s ILE 381 Ca 0.24 -0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.59 3d4j s ILE 381 Cb -0.08 -2.86 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3d4j s ILE 381 CO 0.14 0.51 0.71 -0.76 0.00 0.00 0.00 174.94 175.54 3d4j s LEU 382 N 0.12 3.83 -0.06 2.97 1.43 0.23 -4.97 118.68 122.23 3d4j s LEU 382 Ca 0.01 0.91 0.18 0.00 -1.03 0.00 0.00 54.13 54.20 3d4j s LEU 382 Cb -0.13 -3.80 0.35 0.00 0.03 0.00 0.00 46.19 42.64 3d4j s LEU 382 CO 0.02 -0.40 1.15 -0.90 0.23 0.00 0.00 176.35 176.45 3d4j n ASP 383 N -1.57 1.12 -4.05 2.29 5.68 -1.26 -4.69 116.55 114.07 3d4j n ASP 383 Ca 0.00 -2.55 -0.29 0.00 -0.50 0.00 0.00 54.79 51.45 3d4j n ASP 383 Cb 0.54 -0.35 -0.17 0.00 -1.14 0.00 0.00 41.12 40.01 3d4j n ASP 383 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3d4j s ASP 384 N -2.21 2.54 0.33 -1.12 3.68 -1.26 -5.02 116.67 113.61 3d4j s ASP 384 Ca 0.29 -0.45 0.02 0.00 2.13 0.00 0.00 52.55 54.55 3d4j s ASP 384 Cb 0.32 -1.13 0.56 0.00 -1.45 0.00 0.00 42.92 41.22 3d4j s ASP 384 CO -0.10 0.00 1.91 -0.65 0.13 0.00 0.00 175.17 176.46 3d4j h PRO 385 N 7.56 0.71 0.00 4.34 0.11 -1.99 -1.89 132.00 140.84 3d4j h PRO 385 Ca -0.33 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3d4j h PRO 385 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3d4j h PRO 385 CO 0.50 0.60 0.00 0.00 -0.21 0.00 0.00 178.00 178.89 3d4j n ALA 387 N -1.66 2.39 -1.56 0.00 0.00 -0.71 -4.94 120.51 114.03 3d4j n ALA 387 Ca -0.00 -0.37 -0.47 0.00 0.00 0.00 0.00 53.44 52.59 3d4j n ALA 387 Cb 0.04 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 3d4j n ALA 387 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3d4j n HIS 388 N -2.68 1.04 0.04 0.00 8.25 -0.64 -4.88 115.22 116.36 3d4j n HIS 388 Ca -0.04 0.73 -0.13 0.00 -0.26 0.00 0.00 57.72 58.03 3d4j n HIS 388 Cb 0.64 -2.22 -0.14 0.00 1.12 0.00 0.00 29.99 29.39 3d4j n HIS 388 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3d4j h LEU 389 N 2.48 0.23 -9.25 2.41 4.07 -1.90 -3.44 115.31 109.90 3d4j h LEU 389 Ca -0.40 -0.33 -0.59 0.00 0.08 0.00 0.00 57.88 56.65 3d4j h LEU 389 Cb 1.36 -0.07 -0.09 0.00 1.08 0.00 0.00 40.66 42.93 3d4j h LEU 389 CO 0.64 1.28 -0.17 -0.76 -1.08 0.00 0.00 178.44 178.35 3d4j s LEU 390 N -6.74 4.23 0.00 1.67 1.43 -1.26 -4.63 118.68 113.38 3d4j s LEU 390 Ca -0.06 0.68 0.00 0.00 -1.03 0.00 0.00 54.13 53.71 3d4j s LEU 390 Cb 0.08 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.69 3d4j s LEU 390 CO 0.84 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 178.00 3d4j n GLY 391 N 3.51 -1.62 0.74 -3.19 0.00 0.58 -4.74 105.19 100.48 3d4j n GLY 391 Ca -0.08 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3d4j n GLY 391 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3d4j n PRO 392 N 0.00 0.33 0.00 1.61 -0.02 -1.26 -4.19 135.00 131.47 3d4j n PRO 392 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3d4j n PRO 392 Cb 0.00 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 3d4j n PRO 392 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3d4j n ASP 393 N 0.57 -0.02 0.00 2.55 5.68 -1.26 -5.14 116.55 118.94 3d4j n ASP 393 Ca 0.00 0.23 0.00 0.00 -0.50 0.00 0.00 54.79 54.52 3d4j n ASP 393 Cb 0.12 0.24 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 3d4j n ASP 393 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d4j n GLY 394 N -1.27 1.96 3.10 6.12 0.00 -1.26 -5.04 105.19 108.79 3d4j n GLY 394 Ca 0.00 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 3d4j n GLY 394 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d4j s LEU 395 N 0.00 2.38 0.00 0.99 1.02 -1.26 -0.31 118.68 121.50 3d4j s LEU 395 Ca 0.00 -0.77 0.19 0.00 0.02 0.00 0.00 54.13 53.57 3d4j s LEU 395 Cb 0.00 -0.05 1.15 0.00 0.02 0.00 0.00 46.19 47.30 3d4j s LEU 395 CO 0.00 -0.36 1.54 -2.65 0.02 0.00 0.00 176.35 174.89