#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n24 s ALA 63 N 0.00 3.28 -1.12 3.55 0.00 -1.24 -4.81 121.76 121.42 1n24 s ALA 63 Ca 0.00 0.56 0.15 0.00 0.00 0.00 0.00 51.96 52.67 1n24 s ALA 63 Cb 0.00 -3.24 0.66 0.00 0.00 0.00 0.00 23.12 20.55 1n24 s ALA 63 CO 0.00 0.04 1.46 1.28 0.00 0.00 0.00 175.76 178.54 1n24 n LEU 64 N 2.44 0.00 -3.64 0.00 4.77 -1.26 -4.42 117.00 114.89 1n24 n LEU 64 Ca 0.01 0.44 -0.20 0.00 -0.03 0.00 0.00 56.01 56.23 1n24 n LEU 64 Cb 0.49 -0.44 -0.17 0.00 -2.33 0.00 0.00 43.42 40.97 1n24 n LEU 64 CO 0.50 -0.22 -0.30 0.26 -1.33 0.00 0.00 177.39 176.31 1n24 s TRP 65 N -2.88 -0.01 0.30 -1.77 0.51 -1.26 -5.14 118.94 108.68 1n24 s TRP 65 Ca 0.09 0.25 0.02 0.00 -2.12 0.00 0.00 56.10 54.34 1n24 s TRP 65 Cb 0.10 -0.45 0.06 0.00 -0.81 0.00 0.00 33.47 32.36 1n24 s TRP 65 CO 0.26 -0.31 0.41 -0.40 -0.51 0.00 0.00 176.95 176.39 1n24 n ASP 66 N 5.30 0.74 -0.16 2.95 5.75 -1.26 -4.90 116.55 124.97 1n24 n ASP 66 Ca -0.04 -1.58 -0.03 0.00 -0.01 0.00 0.00 54.79 53.12 1n24 n ASP 66 Cb 0.50 -0.25 0.06 0.00 -1.03 0.00 0.00 41.12 40.40 1n24 n ASP 66 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1n24 h SER 67 N -0.13 0.24 -0.37 -1.12 0.87 -1.98 -2.24 113.55 108.81 1n24 h SER 67 Ca -0.14 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 1n24 h SER 67 Cb 0.55 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 1n24 h SER 67 CO 0.16 0.17 0.21 0.78 -0.53 0.00 0.00 176.83 177.62 1n24 h ASN 68 N 0.40 0.45 0.13 6.23 2.35 -1.99 -1.50 115.58 121.66 1n24 h ASN 68 Ca 0.24 -0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.93 1n24 h ASN 68 Cb 0.22 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 1n24 h ASN 68 CO -0.22 0.39 -0.21 0.22 -1.65 0.00 0.00 177.43 175.96 1n24 h TYR 69 N 0.47 -0.56 -0.31 1.19 3.20 -1.88 -0.90 116.97 118.19 1n24 h TYR 69 Ca 0.13 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.05 1n24 h TYR 69 Cb 0.04 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 1n24 h TYR 69 CO -0.03 -0.31 0.08 0.82 -1.64 0.00 0.00 178.16 177.08 1n24 h ILE 70 N -0.41 0.88 0.00 1.81 2.04 -1.29 -2.25 117.51 118.29 1n24 h ILE 70 Ca 0.02 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1n24 h ILE 70 Cb 0.42 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1n24 h ILE 70 CO -0.10 0.04 -0.17 1.56 0.00 0.00 0.00 178.15 179.48 1n24 h GLN 71 N 0.20 0.00 -0.00 2.37 1.08 -1.12 -2.56 115.11 115.09 1n24 h GLN 71 Ca 0.14 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1n24 h GLN 71 Cb 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1n24 h GLN 71 CO -0.17 0.17 -0.11 -1.13 -0.95 0.00 0.00 178.83 176.63 1n24 n SER 72 N -3.44 0.54 -4.68 1.46 3.41 -0.36 -4.90 113.62 105.65 1n24 n SER 72 Ca -0.01 -0.64 -0.45 0.00 -0.26 0.00 0.00 58.87 57.51 1n24 n SER 72 Cb 0.34 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 1n24 n SER 72 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n24 n LEU 73 N -0.89 3.29 -3.92 1.04 4.77 -0.96 -4.99 117.00 115.34 1n24 n LEU 73 Ca 0.15 1.11 -0.19 0.00 -0.03 0.00 0.00 56.01 57.05 1n24 n LEU 73 Cb 0.28 -1.45 -0.16 0.00 -2.33 0.00 0.00 43.42 39.76 1n24 n LEU 73 CO 0.23 -0.29 -0.41 0.21 -1.33 0.00 0.00 177.39 175.80 1n24 s ASN 74 N 0.63 0.86 -0.11 -1.43 2.47 -1.26 -5.10 114.94 111.00 1n24 s ASN 74 Ca 0.73 -0.12 -0.08 0.00 0.42 0.00 0.00 52.86 53.80 1n24 s ASN 74 Cb -0.64 -0.33 0.04 0.00 -1.45 0.00 0.00 41.25 38.87 1n24 s ASN 74 CO 0.43 -0.01 0.27 0.28 -3.72 0.00 0.00 177.10 174.35 1n24 s THR 75 N 0.58 -0.02 -0.43 -5.21 -1.32 -1.26 -5.05 115.64 102.94 1n24 s THR 75 Ca -0.08 0.06 0.26 0.00 -1.21 0.00 0.00 61.69 60.72 1n24 s THR 75 Cb -0.11 -0.39 0.32 0.00 -1.51 0.00 0.00 72.50 70.81 1n24 s THR 75 CO 0.00 0.02 1.75 1.55 -2.21 0.00 0.00 174.62 175.73 1n24 h PRO 76 N 6.32 0.00 -1.87 7.08 0.13 -2.00 -3.38 132.00 138.27 1n24 h PRO 76 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1n24 h PRO 76 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1n24 h PRO 76 CO 0.35 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.78 1n24 n TYR 77 N -2.71 0.00 0.12 1.56 4.02 -1.26 -3.10 117.16 115.79 1n24 n TYR 77 Ca 0.04 -0.46 0.01 0.00 -0.01 0.00 0.00 57.90 57.48 1n24 n TYR 77 Cb 0.41 -0.33 0.01 0.00 -0.02 0.00 0.00 39.34 39.40 1n24 n TYR 77 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1n24 n THR 78 N 1.50 0.00 -2.69 -0.72 -2.24 -1.26 -4.57 114.28 104.29 1n24 n THR 78 Ca 0.00 -0.49 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 1n24 n THR 78 Cb 0.26 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.51 1n24 n THR 78 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1n24 s GLU 79 N -0.44 3.84 0.21 -0.78 2.02 -1.18 -4.99 118.70 117.39 1n24 s GLU 79 Ca 0.03 0.64 -0.09 0.00 0.02 0.00 0.00 54.97 55.58 1n24 s GLU 79 Cb 0.02 -2.30 0.27 0.00 0.10 0.00 0.00 34.13 32.22 1n24 s GLU 79 CO 0.05 -0.12 1.79 0.93 0.02 0.00 0.00 175.26 177.93 1n24 h GLU 80 N 1.14 0.59 -0.89 1.61 5.08 -1.96 -2.20 114.58 117.95 1n24 h GLU 80 Ca -0.47 -0.04 0.30 0.00 -1.00 0.00 0.00 59.36 58.16 1n24 h GLU 80 Cb 1.19 -0.13 -0.16 0.00 0.50 0.00 0.00 28.75 30.14 1n24 h GLU 80 CO 0.63 0.39 0.23 -2.13 -1.00 0.00 0.00 179.01 177.13 1n24 n ARG 81 N -4.84 -0.06 0.07 2.33 0.63 -1.26 0.14 116.66 113.67 1n24 n ARG 81 Ca 0.09 1.29 -0.11 0.00 -0.92 0.00 0.00 57.85 58.20 1n24 n ARG 81 Cb 0.22 -2.16 -0.01 0.00 0.45 0.00 0.00 32.46 30.95 1n24 n ARG 81 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1n24 h HIS 82 N 0.00 0.47 -0.05 -0.14 3.86 -1.78 -2.86 115.15 114.65 1n24 h HIS 82 Ca 0.64 -0.24 -0.00 0.00 -1.16 0.00 0.00 60.37 59.60 1n24 h HIS 82 Cb 1.52 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 29.93 1n24 h HIS 82 CO -0.25 1.04 0.01 -0.07 0.86 0.00 0.00 177.93 179.52 1n24 h LEU 83 N 0.19 0.07 -0.17 2.43 3.38 0.13 -1.55 115.31 119.80 1n24 h LEU 83 Ca -0.05 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1n24 h LEU 83 Cb 1.48 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 1n24 h LEU 83 CO 0.14 0.26 0.11 0.44 0.09 0.00 0.00 178.44 179.48 1n24 h ASP 84 N -0.12 0.20 -0.76 -0.43 3.32 -1.17 -0.92 116.42 116.54 1n24 h ASP 84 Ca 0.02 -0.04 0.10 0.00 0.02 0.00 0.00 57.03 57.13 1n24 h ASP 84 Cb 0.22 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.66 1n24 h ASP 84 CO -0.00 0.18 0.50 -0.09 -1.72 0.00 0.00 179.24 178.11 1n24 h ARG 85 N 0.21 0.62 -0.59 3.56 2.43 -1.47 0.50 114.38 119.64 1n24 h ARG 85 Ca 0.06 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1n24 h ARG 85 Cb 0.01 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 1n24 h ARG 85 CO -0.01 0.41 -0.01 -0.22 -1.51 0.00 0.00 179.97 178.63 1n24 h LYS 86 N 0.64 1.05 -0.51 0.20 3.64 -0.38 -1.89 116.57 119.31 1n24 h LYS 86 Ca 0.35 -0.33 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 1n24 h LYS 86 Cb 0.51 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1n24 h LYS 86 CO -0.13 1.03 0.07 0.00 -2.27 0.00 0.00 179.45 178.15 1n24 h ALA 87 N 1.02 0.68 -0.17 5.00 0.00 0.37 -2.03 119.26 124.13 1n24 h ALA 87 Ca 0.17 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1n24 h ALA 87 Cb 0.56 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1n24 h ALA 87 CO 0.03 0.43 0.04 0.93 0.00 0.00 0.00 179.25 180.68 1n24 h GLU 88 N 0.74 0.28 -0.30 0.00 5.08 -1.12 -1.99 114.58 117.27 1n24 h GLU 88 Ca 0.15 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1n24 h GLU 88 Cb 0.42 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1n24 h GLU 88 CO 0.01 0.43 0.20 -0.07 -1.00 0.00 0.00 179.01 178.58 1n24 h LEU 89 N 0.08 0.15 -0.38 1.33 3.38 -1.27 0.03 115.31 118.62 1n24 h LEU 89 Ca 0.05 -0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 1n24 h LEU 89 Cb 0.28 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1n24 h LEU 89 CO 0.00 0.10 -0.65 0.40 0.09 0.00 0.00 178.44 178.38 1n24 h ILE 90 N 0.17 1.32 -0.04 1.22 2.04 -1.03 -1.66 117.51 119.52 1n24 h ILE 90 Ca 0.13 -1.91 -0.00 0.00 1.00 0.00 0.00 64.86 64.07 1n24 h ILE 90 Cb 0.31 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1n24 h ILE 90 CO -0.02 0.60 0.01 0.58 0.00 0.00 0.00 178.15 179.32 1n24 h VAL 91 N 0.45 1.14 -0.26 1.67 2.07 -0.30 -1.52 116.25 119.49 1n24 h VAL 91 Ca -0.01 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 67.12 1n24 h VAL 91 Cb 1.22 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 1n24 h VAL 91 CO 0.12 0.11 0.13 1.56 0.02 0.00 0.00 177.57 179.52 1n24 h GLN 92 N -0.10 0.27 -0.31 1.57 1.08 -1.14 -2.28 115.11 114.21 1n24 h GLN 92 Ca 0.01 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1n24 h GLN 92 Cb 0.16 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 1n24 h GLN 92 CO -0.00 0.18 0.13 0.28 -0.95 0.00 0.00 178.83 178.46 1n24 h VAL 93 N 0.28 1.12 -0.85 -0.54 2.07 -1.24 -1.53 116.25 115.55 1n24 h VAL 93 Ca 0.10 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1n24 h VAL 93 Cb 0.02 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 1n24 h VAL 93 CO -0.07 0.14 0.56 -0.09 0.02 0.00 0.00 177.57 178.14 1n24 h ARG 94 N 0.43 1.09 0.76 1.57 2.43 -0.68 -1.76 114.38 118.21 1n24 h ARG 94 Ca 0.11 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 1n24 h ARG 94 Cb 0.08 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1n24 h ARG 94 CO -0.01 0.72 -0.44 0.82 -1.51 0.00 0.00 179.97 179.54 1n24 h ILE 95 N 1.12 0.11 -0.77 1.20 2.04 -1.10 -2.20 117.51 117.91 1n24 h ILE 95 Ca 0.32 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.36 1n24 h ILE 95 Cb -0.07 0.11 -0.12 0.00 -0.74 0.00 0.00 36.82 36.00 1n24 h ILE 95 CO -0.08 0.00 0.15 -0.07 0.00 0.00 0.00 178.15 178.15 1n24 h LEU 96 N -1.12 -0.06 -1.98 1.44 3.38 -1.31 0.24 115.31 115.91 1n24 h LEU 96 Ca -0.10 0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1n24 h LEU 96 Cb 0.89 0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1n24 h LEU 96 CO 0.12 -0.09 -0.09 0.25 0.09 0.00 0.00 178.44 178.71 1n24 h LEU 97 N 0.22 0.00 0.00 1.67 5.85 -1.10 -2.79 115.31 119.16 1n24 h LEU 97 Ca 0.44 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.14 1n24 h LEU 97 Cb 0.79 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 1n24 h LEU 97 CO -0.57 0.09 -1.52 0.29 -0.34 0.00 0.00 178.44 176.39 1n24 n LYS 98 N -4.05 0.63 -1.54 1.25 5.02 0.66 -4.97 118.16 115.16 1n24 n LYS 98 Ca -0.02 -0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 55.84 1n24 n LYS 98 Cb 0.18 -1.68 0.02 0.00 -0.02 0.00 0.00 35.03 33.53 1n24 n LYS 98 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1n24 n GLU 99 N -2.50 0.93 -1.61 1.97 1.02 -0.06 -4.83 120.64 115.56 1n24 n GLU 99 Ca -0.03 0.34 -0.45 0.00 -0.02 0.00 0.00 57.16 57.00 1n24 n GLU 99 Cb 0.59 -1.85 -0.02 0.00 -0.02 0.00 0.00 31.44 30.14 1n24 n GLU 99 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1n24 n LYS 100 N 0.08 1.48 -3.51 3.49 5.02 -1.26 -4.96 118.16 118.50 1n24 n LYS 100 Ca 0.11 0.52 -0.12 0.00 -2.02 0.00 0.00 58.31 56.80 1n24 n LYS 100 Cb 0.42 -1.98 -0.04 0.00 -0.02 0.00 0.00 35.03 33.41 1n24 n LYS 100 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1n24 s MET 101 N -1.20 0.89 0.40 1.97 1.75 -1.26 -5.15 119.30 116.71 1n24 s MET 101 Ca 0.62 -0.07 -0.24 0.00 -1.25 0.00 0.00 55.69 54.75 1n24 s MET 101 Cb -0.71 0.42 -0.09 0.00 2.84 0.00 0.00 34.83 37.29 1n24 s MET 101 CO 0.57 -0.34 1.09 -1.21 -0.65 0.00 0.00 175.02 174.49 1n24 s GLU 102 N -2.20 4.11 0.18 4.11 0.41 -1.26 -4.86 118.70 119.18 1n24 s GLU 102 Ca -0.01 1.63 -0.23 0.00 -0.41 0.00 0.00 54.97 55.95 1n24 s GLU 102 Cb -0.01 -2.58 0.08 0.00 -1.78 0.00 0.00 34.13 29.84 1n24 s GLU 102 CO -0.02 -0.22 1.58 -1.35 -0.49 0.00 0.00 175.26 174.76 1n24 h PRO 103 N 2.53 -0.19 -0.62 0.39 0.11 -2.01 0.43 132.00 132.64 1n24 h PRO 103 Ca -0.48 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.70 1n24 h PRO 103 Cb 1.22 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 1n24 h PRO 103 CO 0.62 -0.13 0.41 -0.24 -0.21 0.00 0.00 178.00 178.46 1n24 h VAL 104 N -0.20 1.00 -0.07 3.15 3.04 -1.98 -0.02 116.25 121.17 1n24 h VAL 104 Ca 0.21 -0.21 -0.13 0.00 -1.01 0.00 0.00 66.70 65.56 1n24 h VAL 104 Cb 0.56 0.34 -0.01 0.00 -2.01 0.00 0.00 31.29 30.17 1n24 h VAL 104 CO -0.68 0.11 -0.53 1.56 -1.01 0.00 0.00 177.57 177.03 1n24 h GLN 105 N 0.60 0.19 -0.46 4.17 4.20 -1.35 -2.02 115.11 120.44 1n24 h GLN 105 Ca 0.27 -0.11 -0.10 0.00 0.06 0.00 0.00 58.65 58.77 1n24 h GLN 105 Cb 0.29 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1n24 h GLN 105 CO -0.08 0.67 -0.09 1.96 -0.67 0.00 0.00 178.83 180.62 1n24 h GLN 106 N 0.15 0.86 -0.23 1.46 4.20 0.45 -2.17 115.11 119.83 1n24 h GLN 106 Ca 0.00 -0.32 -0.01 0.00 0.06 0.00 0.00 58.65 58.38 1n24 h GLN 106 Cb 0.98 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 1n24 h GLN 106 CO 0.08 0.96 0.09 -0.07 -0.67 0.00 0.00 178.83 179.22 1n24 h LEU 107 N 0.70 0.32 -1.07 1.46 3.38 -1.16 -1.39 115.31 117.55 1n24 h LEU 107 Ca 0.12 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1n24 h LEU 107 Cb 0.62 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 1n24 h LEU 107 CO 0.04 0.40 0.63 -0.33 0.09 0.00 0.00 178.44 179.27 1n24 h GLU 108 N 0.22 1.18 -0.37 1.13 5.08 -1.30 0.09 114.58 120.61 1n24 h GLU 108 Ca 0.08 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 1n24 h GLU 108 Cb 0.18 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1n24 h GLU 108 CO -0.01 0.78 -0.19 1.25 -1.00 0.00 0.00 179.01 179.84 1n24 h LEU 109 N 1.22 0.80 -0.86 1.33 5.85 -1.20 -0.89 115.31 121.56 1n24 h LEU 109 Ca 0.38 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1n24 h LEU 109 Cb -0.01 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 1n24 h LEU 109 CO -0.11 1.04 0.47 0.40 -0.34 0.00 0.00 178.44 179.90 1n24 h ILE 110 N 0.57 1.25 -0.35 4.05 2.04 -0.63 -0.35 117.51 124.10 1n24 h ILE 110 Ca 0.08 -0.63 -0.09 0.00 1.00 0.00 0.00 64.86 65.23 1n24 h ILE 110 Cb 0.74 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1n24 h ILE 110 CO 0.06 0.28 -0.15 -0.74 0.00 0.00 0.00 178.15 177.60 1n24 h HIS 111 N 1.21 0.68 -0.18 1.37 2.76 -0.84 -0.97 115.15 119.18 1n24 h HIS 111 Ca 0.30 -0.12 -0.02 0.00 -2.20 0.00 0.00 60.37 58.33 1n24 h HIS 111 Cb 0.03 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1n24 h HIS 111 CO 0.01 0.74 0.05 -0.44 -1.30 0.00 0.00 177.93 176.99 1n24 h ASP 112 N 0.56 0.27 -0.84 3.26 3.32 -0.31 -2.68 116.42 120.02 1n24 h ASP 112 Ca 0.09 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1n24 h ASP 112 Cb 0.59 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 1n24 h ASP 112 CO 0.04 0.42 0.46 -0.07 -1.72 0.00 0.00 179.24 178.37 1n24 h LEU 113 N 0.11 1.05 0.83 1.55 3.38 -0.83 -2.38 115.31 119.01 1n24 h LEU 113 Ca 0.06 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1n24 h LEU 113 Cb 0.25 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1n24 h LEU 113 CO -0.00 0.85 -0.43 0.50 0.09 0.00 0.00 178.44 179.45 1n24 h LYS 114 N 1.18 -1.11 0.00 1.13 3.64 -1.03 0.75 116.57 121.13 1n24 h LYS 114 Ca 0.30 0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 1n24 h LYS 114 Cb 0.03 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1n24 h LYS 114 CO -0.05 -0.74 0.00 0.66 -2.27 0.00 0.00 179.45 177.05 1n24 n TYR 115 N -5.59 0.00 0.79 1.91 4.02 -1.02 -1.37 117.16 115.89 1n24 n TYR 115 Ca -0.15 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 57.83 1n24 n TYR 115 Cb 0.47 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.86 1n24 n TYR 115 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1n24 n LEU 116 N -0.74 2.49 -0.98 7.72 4.77 -0.90 -4.67 117.00 124.68 1n24 n LEU 116 Ca 0.10 -0.98 -0.09 0.00 -0.03 0.00 0.00 56.01 55.01 1n24 n LEU 116 Cb 0.05 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.12 1n24 n LEU 116 CO 0.08 0.43 -0.11 0.61 -1.33 0.00 0.00 177.39 177.07 1n24 n GLY 117 N 1.08 0.23 0.00 -0.72 0.00 -0.47 -4.82 105.19 100.49 1n24 n GLY 117 Ca 0.11 -0.52 0.04 0.00 0.00 0.00 0.00 46.02 45.64 1n24 n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n24 n LEU 118 N -1.27 0.34 -0.26 0.99 4.77 0.21 -4.70 117.00 117.08 1n24 n LEU 118 Ca -0.11 -0.43 0.20 0.00 -0.03 0.00 0.00 56.01 55.64 1n24 n LEU 118 Cb 0.52 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 42.13 1n24 n LEU 118 CO 0.13 0.09 1.23 0.77 -1.33 0.00 0.00 177.39 178.27 1n24 h SER 119 N 0.00 0.41 0.28 -1.43 4.64 -1.73 -0.22 113.55 115.51 1n24 h SER 119 Ca 0.00 0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1n24 h SER 119 Cb 0.22 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1n24 h SER 119 CO 0.00 0.15 -0.02 0.44 -0.87 0.00 0.00 176.83 176.53 1n24 h ASP 120 N 0.40 0.00 1.29 4.97 3.32 -1.90 -1.53 116.42 122.96 1n24 h ASP 120 Ca 0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.55 1n24 h ASP 120 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1n24 h ASP 120 CO -0.20 0.02 0.00 -0.26 -1.72 0.00 0.00 179.24 177.08 1n24 h PHE 121 N 0.00 0.00 -0.63 4.55 0.05 -1.38 -3.31 116.94 116.22 1n24 h PHE 121 Ca -0.00 0.00 -0.34 0.00 3.82 0.00 0.00 57.97 61.45 1n24 h PHE 121 Cb 0.16 0.00 -0.41 0.00 2.00 0.00 0.00 35.95 37.70 1n24 h PHE 121 CO 0.00 0.00 -1.04 1.19 -0.18 0.00 0.00 178.31 178.28 1n24 n PHE 122 N -2.54 1.68 -0.24 -0.55 3.01 -0.59 -4.92 117.46 113.31 1n24 n PHE 122 Ca 0.04 -2.30 -0.01 0.00 1.01 0.00 0.00 57.45 56.19 1n24 n PHE 122 Cb 0.37 -0.27 0.11 0.00 -0.01 0.00 0.00 39.48 39.69 1n24 n PHE 122 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1n24 h GLN 123 N 2.57 0.65 0.22 -1.08 1.08 -1.62 -1.34 115.11 115.60 1n24 h GLN 123 Ca 0.00 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1n24 h GLN 123 Cb 1.30 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 28.58 1n24 h GLN 123 CO 0.39 0.43 -0.11 -0.44 -0.95 0.00 0.00 178.83 178.15 1n24 h ASP 124 N 0.67 -0.25 -0.97 1.46 3.32 -1.91 -1.55 116.42 117.19 1n24 h ASP 124 Ca 0.31 -0.13 0.08 0.00 0.02 0.00 0.00 57.03 57.31 1n24 h ASP 124 Cb 0.23 0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.78 1n24 h ASP 124 CO -0.20 -0.01 0.61 -0.33 -1.72 0.00 0.00 179.24 177.59 1n24 h GLU 125 N -0.49 1.05 -0.04 3.56 3.07 -1.93 -1.05 114.58 118.74 1n24 h GLU 125 Ca -0.03 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 1n24 h GLU 125 Cb 0.37 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1n24 h GLU 125 CO 0.05 0.69 -0.01 0.82 -1.40 0.00 0.00 179.01 179.16 1n24 h ILE 126 N 1.08 1.28 0.00 3.13 2.04 -1.16 -0.75 117.51 123.13 1n24 h ILE 126 Ca 0.44 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.38 1n24 h ILE 126 Cb 0.25 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1n24 h ILE 126 CO -0.20 0.23 -0.21 0.11 0.00 0.00 0.00 178.15 178.09 1n24 h LYS 127 N -0.26 0.00 0.04 2.37 1.57 -1.01 0.14 116.57 119.41 1n24 h LYS 127 Ca 0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1n24 h LYS 127 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1n24 h LYS 127 CO 0.00 0.21 -0.02 1.49 -0.57 0.00 0.00 179.45 180.56 1n24 h GLU 128 N 0.00 -0.05 -1.01 3.15 4.81 -1.11 0.16 114.58 120.54 1n24 h GLU 128 Ca -0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 1n24 h GLU 128 Cb 0.40 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.72 1n24 h GLU 128 CO 0.03 0.51 0.65 0.82 -0.73 0.00 0.00 179.01 180.29 1n24 h ILE 129 N -0.66 1.03 0.00 2.32 2.04 -0.78 0.72 117.51 122.20 1n24 h ILE 129 Ca -0.01 -0.39 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 1n24 h ILE 129 Cb 0.59 -0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1n24 h ILE 129 CO 0.01 0.20 -0.49 -0.07 0.00 0.00 0.00 178.15 177.81 1n24 h LEU 130 N 1.12 0.00 -0.42 1.44 3.38 -0.70 -2.52 115.31 117.62 1n24 h LEU 130 Ca 0.46 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.37 1n24 h LEU 130 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1n24 h LEU 130 CO -0.20 0.49 0.05 1.23 0.09 0.00 0.00 178.44 180.09 1n24 h GLY 131 N 2.53 0.77 0.70 0.83 0.00 0.16 -1.94 103.07 106.13 1n24 h GLY 131 Ca -0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 1n24 h GLY 131 CO 0.06 0.49 -0.07 -2.08 0.00 0.00 0.00 176.54 174.95 1n24 h VAL 132 N 0.56 0.99 -0.40 4.60 2.07 -1.18 -2.62 116.25 120.27 1n24 h VAL 132 Ca 0.13 -0.62 0.12 0.00 0.82 0.00 0.00 66.70 67.14 1n24 h VAL 132 Cb 0.41 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1n24 h VAL 132 CO 0.01 0.15 0.30 0.40 0.02 0.00 0.00 177.57 178.45 1n24 h ILE 133 N -0.49 0.74 -0.22 4.57 2.04 -1.44 0.31 117.51 123.01 1n24 h ILE 133 Ca -0.02 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.67 1n24 h ILE 133 Cb 0.39 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1n24 h ILE 133 CO 0.03 0.00 -0.55 0.22 0.00 0.00 0.00 178.15 177.85 1n24 h TYR 134 N 0.00 0.84 0.00 1.37 3.20 -1.17 -3.19 116.97 118.02 1n24 h TYR 134 Ca 0.19 -0.30 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1n24 h TYR 134 Cb 0.79 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.90 1n24 h TYR 134 CO 0.00 1.07 -0.00 -0.91 -1.64 0.00 0.00 178.16 176.67 1n24 h ASN 135 N 0.51 0.00 0.00 -2.11 2.35 -0.39 -3.36 115.58 112.58 1n24 h ASN 135 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1n24 h ASN 135 Cb 1.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.49 1n24 h ASN 135 CO 0.11 0.32 0.01 -0.62 -1.65 0.00 0.00 177.43 175.60 1n24 n GLU 136 N -3.78 0.00 -3.94 0.81 1.02 0.79 -4.26 120.64 111.29 1n24 n GLU 136 Ca -0.00 0.03 -0.30 0.00 -0.02 0.00 0.00 57.16 56.86 1n24 n GLU 136 Cb 0.00 -1.51 -0.15 0.00 -0.02 0.00 0.00 31.44 29.75 1n24 n GLU 136 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1n24 s HIS 137 N -1.76 2.48 0.12 -0.32 3.76 -1.20 -5.00 115.29 113.36 1n24 s HIS 137 Ca 0.00 -1.86 -0.15 0.00 -0.15 0.00 0.00 55.06 52.90 1n24 s HIS 137 Cb 0.00 -1.69 -0.02 0.00 1.11 0.00 0.00 32.58 31.98 1n24 s HIS 137 CO 0.00 -0.80 1.58 0.87 -0.85 0.00 0.00 174.74 175.54 1n24 h LYS 138 N 7.93 0.69 -0.56 1.40 1.57 -1.87 -2.70 116.57 123.03 1n24 h LYS 138 Ca -0.17 -0.21 0.16 0.00 -1.87 0.00 0.00 60.65 58.57 1n24 h LYS 138 Cb 1.06 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 1n24 h LYS 138 CO 0.42 0.77 0.62 0.00 -0.57 0.00 0.00 179.45 180.69 1n24 h PHE 140 N 0.00 0.00 -0.26 0.00 0.05 -1.81 -2.95 116.94 111.97 1n24 h PHE 140 Ca 0.27 0.00 -0.16 0.00 3.82 0.00 0.00 57.97 61.89 1n24 h PHE 140 Cb 1.50 0.00 -0.08 0.00 2.00 0.00 0.00 35.95 39.37 1n24 h PHE 140 CO 0.00 0.00 0.21 -2.39 -0.18 0.00 0.00 178.31 175.95 1n24 n HIS 141 N -2.28 0.82 -0.20 -0.55 1.44 -1.18 -3.60 115.22 109.67 1n24 n HIS 141 Ca -0.00 -1.36 0.00 0.00 -2.01 0.00 0.00 57.72 54.35 1n24 n HIS 141 Cb 0.01 -0.67 0.00 0.00 0.12 0.00 0.00 29.99 29.45 1n24 n HIS 141 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 1n24 n ASN 142 N 0.68 0.00 -3.54 4.39 3.02 -0.88 -5.01 115.26 113.92 1n24 n ASN 142 Ca 0.16 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.51 1n24 n ASN 142 Cb 0.61 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.83 1n24 n ASN 142 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1n24 n ASN 143 N 0.00 -3.06 0.00 6.41 3.02 -1.11 -4.99 115.26 115.52 1n24 n ASN 143 Ca 0.00 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.78 1n24 n ASN 143 Cb 0.00 -4.48 0.00 0.00 -0.61 0.00 0.00 39.78 34.69 1n24 n ASN 143 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1n24 n GLU 144 N -4.00 3.27 -4.04 3.52 1.02 -1.25 -4.91 120.64 114.24 1n24 n GLU 144 Ca -0.22 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.63 1n24 n GLU 144 Cb 0.65 0.00 -0.17 0.00 -0.02 0.00 0.00 31.44 31.91 1n24 n GLU 144 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1n24 s VAL 145 N 4.23 1.34 0.00 2.62 1.01 -1.26 -4.81 120.40 123.53 1n24 s VAL 145 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1n24 s VAL 145 Cb 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 35.09 1n24 s VAL 145 CO 0.00 0.42 0.00 1.21 0.00 0.00 0.00 175.10 176.73 1n24 n GLU 146 N 4.74 3.52 0.20 2.72 2.13 -1.26 -4.87 120.64 127.83 1n24 n GLU 146 Ca -0.16 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.79 1n24 n GLU 146 Cb 0.50 0.00 0.67 0.00 0.27 0.00 0.00 31.44 32.89 1n24 n GLU 146 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1n24 h LYS 147 N 0.00 0.00 -5.97 5.31 1.57 -2.04 -3.46 116.57 111.97 1n24 h LYS 147 Ca 0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1n24 h LYS 147 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1n24 h LYS 147 CO 0.00 0.00 -0.91 -0.12 -0.57 0.00 0.00 179.45 177.85 1n24 n MET 148 N -2.40 -2.09 -3.87 3.15 0.00 -1.26 -4.99 117.12 105.66 1n24 n MET 148 Ca -0.02 1.73 -0.30 0.00 -0.00 0.00 0.00 57.70 59.11 1n24 n MET 148 Cb 0.11 -3.58 -0.15 0.00 0.00 0.00 0.00 33.22 29.60 1n24 n MET 148 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1n24 s ASP 149 N -1.90 4.32 0.13 6.12 2.15 -1.26 -5.03 116.67 121.20 1n24 s ASP 149 Ca 0.29 -1.82 -0.26 0.00 0.43 0.00 0.00 52.55 51.18 1n24 s ASP 149 Cb -0.05 -1.20 -0.07 0.00 -0.30 0.00 0.00 42.92 41.30 1n24 s ASP 149 CO 0.78 -0.39 1.45 0.25 -0.17 0.00 0.00 175.17 177.09 1n24 h LEU 150 N 7.88 -1.74 -0.76 -1.34 5.85 -1.94 0.32 115.31 123.57 1n24 h LEU 150 Ca -0.10 0.26 0.12 0.00 0.84 0.00 0.00 57.88 59.00 1n24 h LEU 150 Cb 1.02 0.76 -0.13 0.00 0.37 0.00 0.00 40.66 42.68 1n24 h LEU 150 CO 0.49 -0.23 -0.39 0.22 -0.34 0.00 0.00 178.44 178.19 1n24 h TYR 151 N -0.09 -1.10 -0.55 1.25 3.20 -1.89 0.20 116.97 117.98 1n24 h TYR 151 Ca 0.11 0.09 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1n24 h TYR 151 Cb 0.39 0.59 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 1n24 h TYR 151 CO -0.93 -0.40 0.09 0.35 -1.64 0.00 0.00 178.16 175.64 1n24 h PHE 152 N -0.11 0.96 -0.31 -3.82 3.57 -1.49 -1.83 116.94 113.91 1n24 h PHE 152 Ca 0.26 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 1n24 h PHE 152 Cb 0.56 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1n24 h PHE 152 CO -0.76 0.85 0.04 1.15 -2.23 0.00 0.00 178.31 177.36 1n24 h THR 153 N 0.79 1.24 -0.18 4.41 2.02 0.90 -0.99 112.91 121.11 1n24 h THR 153 Ca 0.17 -0.83 -0.02 0.00 0.77 0.00 0.00 66.41 66.49 1n24 h THR 153 Cb 0.40 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1n24 h THR 153 CO 0.01 0.27 0.02 0.00 0.37 0.00 0.00 175.52 176.19 1n24 h ALA 154 N 0.88 0.24 -0.26 6.16 0.00 -0.67 -0.50 119.26 125.11 1n24 h ALA 154 Ca 0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1n24 h ALA 154 Cb 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1n24 h ALA 154 CO 0.01 -0.08 0.16 1.25 0.00 0.00 0.00 179.25 180.58 1n24 h LEU 155 N 0.08 0.31 -0.64 0.00 5.85 -1.32 -1.05 115.31 118.55 1n24 h LEU 155 Ca 0.05 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1n24 h LEU 155 Cb 0.33 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1n24 h LEU 155 CO 0.01 0.27 0.26 1.23 -0.34 0.00 0.00 178.44 179.87 1n24 h GLY 156 N 0.33 1.01 0.53 3.75 0.00 -1.16 -1.49 103.07 106.04 1n24 h GLY 156 Ca 0.09 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1n24 h GLY 156 CO -0.02 0.51 -0.38 -2.75 0.00 0.00 0.00 176.54 173.90 1n24 h PHE 157 N 0.89 -1.04 0.12 5.60 3.57 -0.81 0.20 116.94 125.47 1n24 h PHE 157 Ca 0.21 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.75 1n24 h PHE 157 Cb 0.19 0.42 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 1n24 h PHE 157 CO 0.01 -0.52 -0.35 -0.09 -2.23 0.00 0.00 178.31 175.14 1n24 h ARG 158 N -0.73 -0.56 -0.63 1.11 2.43 -1.04 -0.05 114.38 114.90 1n24 h ARG 158 Ca -0.01 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1n24 h ARG 158 Cb 0.68 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.33 1n24 h ARG 158 CO -0.11 -0.37 0.33 -0.07 -1.51 0.00 0.00 179.97 178.24 1n24 h LEU 159 N -0.58 0.81 -0.40 3.80 3.38 -1.20 -1.76 115.31 119.37 1n24 h LEU 159 Ca 0.03 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1n24 h LEU 159 Cb 0.61 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1n24 h LEU 159 CO -0.20 0.69 0.17 -0.07 0.09 0.00 0.00 178.44 179.12 1n24 h LEU 160 N 0.87 0.54 -0.19 1.67 3.38 -0.36 -2.41 115.31 118.80 1n24 h LEU 160 Ca 0.22 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1n24 h LEU 160 Cb 0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1n24 h LEU 160 CO -0.03 0.54 0.01 -0.09 0.09 0.00 0.00 178.44 178.96 1n24 h ARG 161 N 0.50 0.33 -0.12 1.13 2.43 -0.91 -1.68 114.38 116.06 1n24 h ARG 161 Ca 0.14 -0.10 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 1n24 h ARG 161 Cb 0.16 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1n24 h ARG 161 CO -0.01 0.52 0.16 1.96 -1.51 0.00 0.00 179.97 181.09 1n24 h GLN 162 N 0.10 0.00 -0.63 0.20 4.20 -1.24 -1.07 115.11 116.66 1n24 h GLN 162 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1n24 h GLN 162 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1n24 h GLN 162 CO 0.01 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.89 1n24 n HIS 163 N -3.65 1.12 0.00 2.96 8.25 -0.91 -4.94 115.22 118.05 1n24 n HIS 163 Ca 0.00 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.99 1n24 n HIS 163 Cb 0.27 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.23 1n24 n HIS 163 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n24 n GLY 164 N 1.17 0.92 3.77 -1.41 0.00 -0.41 -5.06 105.19 104.17 1n24 n GLY 164 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 1n24 n GLY 164 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n24 s PHE 165 N -2.24 3.15 -0.61 1.61 0.40 -0.67 -4.97 117.98 114.65 1n24 s PHE 165 Ca 0.00 1.56 -0.24 0.00 -0.60 0.00 0.00 56.93 57.65 1n24 s PHE 165 Cb 0.00 -3.41 0.05 0.00 0.51 0.00 0.00 43.02 40.17 1n24 s PHE 165 CO 0.00 -1.26 1.01 1.21 0.70 0.00 0.00 175.22 176.88 1n24 s ASN 166 N -1.01 6.27 -0.09 1.36 2.47 -1.26 -4.28 114.94 118.40 1n24 s ASN 166 Ca 0.54 -0.53 0.04 0.00 0.42 0.00 0.00 52.86 53.33 1n24 s ASN 166 Cb -0.32 -2.46 0.00 0.00 -1.45 0.00 0.00 41.25 37.03 1n24 s ASN 166 CO 0.41 -1.39 -0.22 -0.63 -3.72 0.00 0.00 177.10 171.55 1n24 s ILE 167 N 4.30 1.88 0.55 -5.21 -1.09 -1.26 -4.91 121.20 115.45 1n24 s ILE 167 Ca 0.29 -0.92 -0.13 0.00 -2.23 0.00 0.00 60.65 57.67 1n24 s ILE 167 Cb -0.13 -1.63 -0.06 0.00 -1.58 0.00 0.00 42.46 39.06 1n24 s ILE 167 CO 0.16 0.52 0.97 -0.55 -1.23 0.00 0.00 174.94 174.82 1n24 s SER 168 N 0.38 6.43 0.50 3.58 0.15 -1.26 -4.95 113.70 118.54 1n24 s SER 168 Ca -0.17 1.43 0.29 0.00 0.70 0.00 0.00 55.95 58.20 1n24 s SER 168 Cb -0.17 -2.46 1.08 0.00 -1.71 0.00 0.00 66.02 62.75 1n24 s SER 168 CO 0.08 -0.69 1.88 0.06 1.20 0.00 0.00 173.24 175.77 1n24 h GLN 169 N 0.40 0.00 0.00 5.44 3.07 -2.00 -3.02 115.11 119.01 1n24 h GLN 169 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.28 1n24 h GLN 169 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.75 1n24 h GLN 169 CO 0.62 0.07 0.11 -0.25 0.09 0.00 0.00 178.83 179.46 1n24 n ASP 170 N -3.17 0.39 0.00 0.06 8.00 -1.26 -1.40 116.55 119.18 1n24 n ASP 170 Ca 0.01 0.64 0.04 0.00 0.71 0.00 0.00 54.79 56.19 1n24 n ASP 170 Cb 0.38 -0.66 0.16 0.00 -0.02 0.00 0.00 41.12 40.98 1n24 n ASP 170 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1n24 n VAL 171 N -2.05 1.46 0.63 2.53 0.31 -1.14 -1.51 118.33 118.56 1n24 n VAL 171 Ca -0.01 0.36 0.09 0.00 -0.01 0.00 0.00 64.34 64.78 1n24 n VAL 171 Cb 0.13 -1.24 0.10 0.00 -0.91 0.00 0.00 33.84 31.93 1n24 n VAL 171 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1n24 n PHE 172 N -1.49 0.11 0.08 3.52 3.01 -0.49 -4.41 117.46 117.79 1n24 n PHE 172 Ca 0.02 -0.07 0.01 0.00 1.01 0.00 0.00 57.45 58.41 1n24 n PHE 172 Cb 0.09 -0.00 0.32 0.00 -0.01 0.00 0.00 39.48 39.88 1n24 n PHE 172 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 1n24 h ASN 173 N 3.65 0.31 -1.20 4.37 -0.26 -1.46 -2.66 115.58 118.32 1n24 h ASN 173 Ca 0.00 -0.08 0.35 0.00 -0.56 0.00 0.00 56.30 56.01 1n24 h ASN 173 Cb 0.80 -0.08 -0.09 0.00 -1.06 0.00 0.00 38.32 37.88 1n24 h ASN 173 CO 0.00 0.49 0.80 0.00 -1.06 0.00 0.00 177.43 177.66 1n24 n PHE 175 N -4.51 0.96 -3.73 0.00 3.01 -1.00 -4.90 117.46 107.28 1n24 n PHE 175 Ca 0.30 -0.37 -0.31 0.00 1.01 0.00 0.00 57.45 58.07 1n24 n PHE 175 Cb 1.17 -0.20 -0.04 0.00 -0.01 0.00 0.00 39.48 40.40 1n24 n PHE 175 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1n24 s LYS 176 N -1.77 3.57 0.80 -1.08 1.02 0.53 -0.46 119.74 122.35 1n24 s LYS 176 Ca 0.31 -0.18 -0.13 0.00 0.02 0.00 0.00 55.97 55.98 1n24 s LYS 176 Cb 0.21 -2.89 0.21 0.00 -0.52 0.00 0.00 37.83 34.83 1n24 s LYS 176 CO 0.14 0.50 0.50 0.27 -0.92 0.00 0.00 175.35 175.84 1n24 n ASN 177 N 0.10 -2.99 0.22 2.83 0.23 -0.66 -4.67 115.26 110.32 1n24 n ASN 177 Ca -0.03 -0.54 0.09 0.00 -0.53 0.00 0.00 54.58 53.57 1n24 n ASN 177 Cb 0.52 -0.55 0.45 0.00 -2.08 0.00 0.00 39.78 38.11 1n24 n ASN 177 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1n24 h GLU 178 N 0.00 0.00 0.00 -3.83 5.08 -1.99 -2.72 114.58 111.13 1n24 h GLU 178 Ca -0.22 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.08 1n24 h GLU 178 Cb 0.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1n24 h GLU 178 CO 0.13 0.25 -0.26 0.87 -1.00 0.00 0.00 179.01 179.00 1n24 h LYS 179 N 0.00 0.00 0.00 2.33 1.79 -1.95 -3.47 116.57 115.28 1n24 h LYS 179 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1n24 h LYS 179 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1n24 h LYS 179 CO 0.03 0.26 0.00 0.41 -1.08 0.00 0.00 179.45 179.08 1n24 n GLY 180 N -0.33 0.62 0.00 3.86 0.00 -1.02 -5.01 105.19 103.31 1n24 n GLY 180 Ca -0.01 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1n24 n GLY 180 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n24 n ILE 181 N -2.90 0.00 -2.01 -0.61 5.41 -1.26 -4.98 119.36 113.00 1n24 n ILE 181 Ca 0.00 0.00 -0.28 0.00 1.00 0.00 0.00 62.75 63.47 1n24 n ILE 181 Cb 0.12 -0.44 0.12 0.00 -0.71 0.00 0.00 39.64 38.74 1n24 n ILE 181 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1n24 s ASP 182 N 0.13 4.05 0.28 4.38 1.11 -1.26 -4.87 116.67 120.49 1n24 s ASP 182 Ca 0.00 0.46 -0.22 0.00 0.18 0.00 0.00 52.55 52.97 1n24 s ASP 182 Cb 0.00 -0.81 -0.09 0.00 1.07 0.00 0.00 42.92 43.09 1n24 s ASP 182 CO 0.00 -2.15 0.82 -0.36 1.18 0.00 0.00 175.17 174.67 1n24 s PHE 183 N -3.60 3.63 -0.35 4.23 0.40 -1.26 -1.65 117.98 119.37 1n24 s PHE 183 Ca 0.66 1.54 -0.33 0.00 -0.60 0.00 0.00 56.93 58.21 1n24 s PHE 183 Cb -0.08 -2.74 -0.10 0.00 0.51 0.00 0.00 43.02 40.61 1n24 s PHE 183 CO 0.49 0.25 2.24 1.63 0.70 0.00 0.00 175.22 180.53 1n24 n LYS 184 N 0.51 1.25 0.28 0.44 5.02 0.40 -4.69 118.16 121.38 1n24 n LYS 184 Ca 0.00 0.31 0.10 0.00 -2.02 0.00 0.00 58.31 56.70 1n24 n LYS 184 Cb 0.51 -2.69 0.52 0.00 -0.02 0.00 0.00 35.03 33.34 1n24 n LYS 184 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n24 h ALA 185 N 13.62 1.43 -0.20 7.82 0.00 -1.92 0.06 119.26 140.07 1n24 h ALA 185 Ca -0.29 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1n24 h ALA 185 Cb 1.30 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1n24 h ALA 185 CO 1.03 -0.43 -0.04 0.66 0.00 0.00 0.00 179.25 180.47 1n24 h SER 186 N 0.00 0.28 -0.04 0.00 4.64 -1.98 -2.86 113.55 113.58 1n24 h SER 186 Ca 0.00 -0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1n24 h SER 186 Cb 0.94 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1n24 h SER 186 CO 0.00 0.37 0.05 -0.07 -0.87 0.00 0.00 176.83 176.30 1n24 h LEU 187 N 0.29 0.00 -1.40 5.97 3.38 -1.35 -2.85 115.31 119.36 1n24 h LEU 187 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1n24 h LEU 187 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1n24 h LEU 187 CO 0.01 0.00 0.47 0.00 0.09 0.00 0.00 178.44 179.01 1n24 h ALA 188 N 1.95 1.45 0.00 1.53 0.00 -1.71 0.45 119.26 122.93 1n24 h ALA 188 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 1n24 h ALA 188 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1n24 h ALA 188 CO -0.00 -0.45 -0.88 1.96 0.00 0.00 0.00 179.25 179.88 1n24 h GLN 189 N 0.00 0.00 -5.38 0.00 4.20 -1.76 -3.38 115.11 108.79 1n24 h GLN 189 Ca 0.00 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 58.02 1n24 h GLN 189 Cb 0.93 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.64 1n24 h GLN 189 CO 0.00 0.88 2.34 -3.47 -0.67 0.00 0.00 178.83 177.91 1n24 n ASP 190 N -3.44 4.75 -0.20 1.46 2.03 0.16 -4.78 116.55 116.52 1n24 n ASP 190 Ca -0.00 -2.91 -0.03 0.00 0.52 0.00 0.00 54.79 52.37 1n24 n ASP 190 Cb 0.85 -1.72 0.08 0.00 -0.72 0.00 0.00 41.12 39.62 1n24 n ASP 190 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1n24 h THR 191 N 5.17 0.95 -0.65 5.18 2.02 -1.80 0.28 112.91 124.06 1n24 h THR 191 Ca 0.46 -0.20 0.06 0.00 0.77 0.00 0.00 66.41 67.50 1n24 h THR 191 Cb 0.82 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 67.48 1n24 h THR 191 CO 1.54 0.11 0.35 0.50 0.37 0.00 0.00 175.52 178.39 1n24 h LYS 192 N 0.59 0.63 -0.09 6.66 3.64 -1.96 -1.25 116.57 124.80 1n24 h LYS 192 Ca 0.27 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.46 1n24 h LYS 192 Cb 0.17 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1n24 h LYS 192 CO -0.18 0.42 -0.58 0.78 -2.27 0.00 0.00 179.45 177.62 1n24 h GLY 193 N 0.65 0.33 1.00 5.01 0.00 -1.66 -3.17 103.07 105.23 1n24 h GLY 193 Ca 0.29 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 1n24 h GLY 193 CO -0.19 0.36 0.17 -0.33 0.00 0.00 0.00 176.54 176.54 1n24 h MET 194 N 0.23 0.89 -0.81 4.80 2.86 0.39 -2.18 114.93 121.11 1n24 h MET 194 Ca -0.00 -0.20 0.04 0.00 -2.06 0.00 0.00 59.70 57.48 1n24 h MET 194 Cb 1.09 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.57 1n24 h MET 194 CO 0.09 0.82 0.51 1.25 1.06 0.00 0.00 176.91 180.64 1n24 h LEU 195 N 0.81 0.83 -1.13 1.22 5.85 -1.24 -0.30 115.31 121.35 1n24 h LEU 195 Ca 0.18 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 1n24 h LEU 195 Cb 0.30 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1n24 h LEU 195 CO -0.00 0.56 -0.42 1.56 -0.34 0.00 0.00 178.44 179.79 1n24 h GLN 196 N 0.98 0.02 -0.17 1.25 1.08 -1.49 -1.80 115.11 114.97 1n24 h GLN 196 Ca 0.33 -0.01 -0.17 0.00 -1.45 0.00 0.00 58.65 57.36 1n24 h GLN 196 Cb 0.06 -0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.50 1n24 h GLN 196 CO -0.13 0.44 -0.55 1.25 -0.95 0.00 0.00 178.83 178.89 1n24 h LEU 197 N 0.02 0.78 0.37 1.46 5.85 -0.67 -2.24 115.31 120.88 1n24 h LEU 197 Ca -0.00 -0.59 -0.01 0.00 0.84 0.00 0.00 57.88 58.12 1n24 h LEU 197 Cb 0.76 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1n24 h LEU 197 CO 0.06 1.24 -0.30 0.22 -0.34 0.00 0.00 178.44 179.32 1n24 h TYR 198 N 0.37 -0.79 -0.14 1.25 3.20 -0.88 -1.90 116.97 118.07 1n24 h TYR 198 Ca -0.02 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.89 1n24 h TYR 198 Cb 1.17 0.30 -0.05 0.00 1.54 0.00 0.00 36.73 39.69 1n24 h TYR 198 CO 0.09 -0.44 -0.13 0.93 -1.64 0.00 0.00 178.16 176.97 1n24 h GLU 199 N -0.67 -0.15 -0.27 1.82 4.39 -1.37 -2.30 114.58 116.03 1n24 h GLU 199 Ca -0.03 0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.74 1n24 h GLU 199 Cb 0.58 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 1n24 h GLU 199 CO -0.02 -0.10 0.19 0.00 -1.16 0.00 0.00 179.01 177.93 1n24 h ALA 200 N 0.93 2.14 0.00 3.43 0.00 -1.28 -2.57 119.26 121.92 1n24 h ALA 200 Ca 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1n24 h ALA 200 Cb 0.29 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1n24 h ALA 200 CO -0.24 -0.21 -0.13 0.66 0.00 0.00 0.00 179.25 179.33 1n24 h SER 201 N 0.09 0.00 0.00 0.00 4.64 -0.74 -2.53 113.55 115.01 1n24 h SER 201 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1n24 h SER 201 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1n24 h SER 201 CO -0.01 0.13 0.00 0.49 -0.87 0.00 0.00 176.83 176.57 1n24 n PHE 202 N -3.84 0.00 -0.55 4.77 3.01 -0.97 -2.61 117.46 117.28 1n24 n PHE 202 Ca -0.02 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.54 1n24 n PHE 202 Cb 0.23 0.00 0.35 0.00 -0.01 0.00 0.00 39.48 40.05 1n24 n PHE 202 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1n24 n LEU 203 N -0.80 4.53 -4.73 4.37 4.32 -0.95 -4.92 117.00 118.82 1n24 n LEU 203 Ca 0.14 -2.30 -0.35 0.00 -0.02 0.00 0.00 56.01 53.48 1n24 n LEU 203 Cb 0.07 -0.55 0.07 0.00 -1.62 0.00 0.00 43.42 41.39 1n24 n LEU 203 CO 0.11 0.88 0.82 -1.48 -1.22 0.00 0.00 177.39 176.50 1n24 s LEU 204 N -1.57 3.44 0.46 2.23 2.34 -1.07 -5.00 118.68 119.51 1n24 s LEU 204 Ca 0.51 2.39 0.03 0.00 0.06 0.00 0.00 54.13 57.12 1n24 s LEU 204 Cb 0.31 -4.59 -0.02 0.00 -0.56 0.00 0.00 46.19 41.32 1n24 s LEU 204 CO 0.28 -2.04 0.05 -0.13 -1.06 0.00 0.00 176.35 173.45 1n24 s ARG 205 N -3.70 2.07 0.01 1.48 0.52 -1.26 -4.56 118.95 113.50 1n24 s ARG 205 Ca 0.76 -2.29 -0.37 0.00 -0.52 0.00 0.00 55.73 53.31 1n24 s ARG 205 Cb -0.30 -1.15 -0.15 0.00 0.52 0.00 0.00 34.95 33.86 1n24 s ARG 205 CO 0.41 -0.39 1.54 1.17 0.02 0.00 0.00 175.30 178.05 1n24 n LYS 206 N -1.10 1.48 -1.01 3.54 4.81 -1.26 -2.35 118.16 122.27 1n24 n LYS 206 Ca -0.13 0.54 -0.00 0.00 -0.87 0.00 0.00 58.31 57.85 1n24 n LYS 206 Cb 0.66 -2.24 -0.00 0.00 0.02 0.00 0.00 35.03 33.47 1n24 n LYS 206 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n24 n GLY 207 N 3.27 0.46 3.22 3.14 0.00 -1.26 -4.99 105.19 109.03 1n24 n GLY 207 Ca 0.20 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1n24 n GLY 207 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n24 n GLU 208 N -2.92 3.36 0.24 1.61 1.02 -0.99 -4.86 120.64 118.09 1n24 n GLU 208 Ca -0.00 -4.48 0.10 0.00 -0.02 0.00 0.00 57.16 52.75 1n24 n GLU 208 Cb 0.02 -2.50 0.59 0.00 -0.02 0.00 0.00 31.44 29.53 1n24 n GLU 208 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1n24 h ASP 209 N 6.27 0.00 -0.92 1.62 3.32 -1.94 -2.86 116.42 121.92 1n24 h ASP 209 Ca 0.18 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1n24 h ASP 209 Cb 0.82 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.33 1n24 h ASP 209 CO 1.00 0.20 0.55 0.74 -1.72 0.00 0.00 179.24 180.01 1n24 h THR 210 N 0.00 1.25 -0.09 0.35 2.02 -1.94 0.64 112.91 115.14 1n24 h THR 210 Ca -0.00 -0.55 -0.17 0.00 0.77 0.00 0.00 66.41 66.46 1n24 h THR 210 Cb 0.49 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1n24 h THR 210 CO 0.03 0.26 -0.67 -0.07 0.37 0.00 0.00 175.52 175.44 1n24 h LEU 211 N 1.26 0.44 -0.51 2.58 3.38 -1.86 0.81 115.31 121.41 1n24 h LEU 211 Ca 0.33 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1n24 h LEU 211 Cb -0.05 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1n24 h LEU 211 CO -0.06 0.98 0.02 -0.08 0.09 0.00 0.00 178.44 179.39 1n24 h GLU 212 N 0.27 0.89 -0.49 1.13 4.57 -1.39 0.43 114.58 119.99 1n24 h GLU 212 Ca -0.02 -0.27 -0.03 0.00 -1.18 0.00 0.00 59.36 57.86 1n24 h GLU 212 Cb 1.22 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.70 1n24 h GLU 212 CO 0.11 0.91 0.19 1.25 -1.18 0.00 0.00 179.01 180.29 1n24 h LEU 213 N 0.76 0.67 -1.26 1.64 5.85 -0.71 -1.95 115.31 120.32 1n24 h LEU 213 Ca 0.15 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.72 1n24 h LEU 213 Cb 0.49 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1n24 h LEU 213 CO 0.02 0.66 0.51 0.00 -0.34 0.00 0.00 178.44 179.30 1n24 h ALA 214 N 1.04 1.51 0.32 1.25 0.00 -0.46 -0.82 119.26 122.09 1n24 h ALA 214 Ca 0.16 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1n24 h ALA 214 Cb 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1n24 h ALA 214 CO -0.01 0.43 -0.15 -0.09 0.00 0.00 0.00 179.25 179.42 1n24 h ARG 215 N 0.99 -0.41 -0.91 0.00 2.43 -0.18 0.17 114.38 116.46 1n24 h ARG 215 Ca 0.30 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.50 1n24 h ARG 215 Cb -0.00 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 1n24 h ARG 215 CO -0.08 -0.26 0.56 0.93 -1.51 0.00 0.00 179.97 179.61 1n24 h GLU 216 N -0.44 1.23 0.53 0.20 5.08 -1.03 -0.64 114.58 119.51 1n24 h GLU 216 Ca -0.04 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 1n24 h GLU 216 Cb 0.34 -0.26 0.01 0.00 0.50 0.00 0.00 28.75 29.33 1n24 h GLU 216 CO 0.07 0.86 -0.25 0.35 -1.00 0.00 0.00 179.01 179.03 1n24 h PHE 217 N 1.25 -0.66 -0.47 4.33 3.57 -0.95 -2.46 116.94 121.56 1n24 h PHE 217 Ca 0.33 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.91 1n24 h PHE 217 Cb -0.07 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 1n24 h PHE 217 CO 0.00 -0.41 0.32 0.00 -2.23 0.00 0.00 178.31 176.00 1n24 h ALA 218 N -1.47 2.13 -0.13 2.41 0.00 -0.69 -2.01 119.26 119.51 1n24 h ALA 218 Ca -0.07 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1n24 h ALA 218 Cb 0.54 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1n24 h ALA 218 CO 0.12 -0.24 -0.05 1.15 0.00 0.00 0.00 179.25 180.23 1n24 h THR 219 N 0.23 1.30 -0.70 0.00 2.02 -1.13 -1.82 112.91 112.82 1n24 h THR 219 Ca 0.22 -1.04 0.04 0.00 0.77 0.00 0.00 66.41 66.40 1n24 h THR 219 Cb 0.55 1.72 -0.05 0.00 -1.74 0.00 0.00 68.15 68.63 1n24 h THR 219 CO -0.04 0.30 0.42 0.11 0.37 0.00 0.00 175.52 176.68 1n24 h LYS 220 N -0.06 0.79 0.64 6.66 1.57 -0.89 -1.51 116.57 123.77 1n24 h LYS 220 Ca 0.03 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1n24 h LYS 220 Cb 0.49 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 32.63 1n24 h LYS 220 CO 0.02 0.52 -0.31 0.00 -0.57 0.00 0.00 179.45 179.11 1n24 h LEU 222 N -1.13 0.00 0.01 0.00 3.38 -1.27 -1.14 115.31 115.16 1n24 h LEU 222 Ca -0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1n24 h LEU 222 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1n24 h LEU 222 CO 0.14 0.00 -0.00 -0.61 0.09 0.00 0.00 178.44 178.06 1n24 h GLN 223 N 0.00 -0.01 -0.53 1.13 5.75 -1.16 -2.84 115.11 117.45 1n24 h GLN 223 Ca 0.19 0.00 0.10 0.00 -0.15 0.00 0.00 58.65 58.80 1n24 h GLN 223 Cb 0.97 0.00 -0.09 0.00 1.07 0.00 0.00 27.48 29.43 1n24 h GLN 223 CO -0.00 0.85 -0.03 0.87 -2.65 0.00 0.00 178.83 177.87 1n24 h LYS 224 N -0.95 0.09 0.00 1.69 1.57 -0.15 0.10 116.57 118.91 1n24 h LYS 224 Ca -0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1n24 h LYS 224 Cb 0.86 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 1n24 h LYS 224 CO 0.00 0.06 -0.09 -0.22 -0.57 0.00 0.00 179.45 178.63 1n24 h LYS 225 N 0.09 0.00 -0.00 3.15 1.63 -1.36 -2.18 116.57 117.89 1n24 h LYS 225 Ca 0.27 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.07 1n24 h LYS 225 Cb 0.41 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1n24 h LYS 225 CO -0.46 0.09 -0.12 -0.11 -3.45 0.00 0.00 179.45 175.39 1n24 n LEU 226 N -3.41 0.46 -0.22 5.20 7.94 -0.00 -3.35 117.00 123.62 1n24 n LEU 226 Ca -0.01 0.03 0.06 0.00 -1.11 0.00 0.00 56.01 54.97 1n24 n LEU 226 Cb 0.25 -0.20 -0.01 0.00 0.53 0.00 0.00 43.42 43.99 1n24 n LEU 226 CO 0.28 0.09 0.17 0.47 -1.11 0.00 0.00 177.39 177.30 1n24 n ASP 227 N -1.00 1.18 -4.22 1.96 9.92 -0.83 -5.08 116.55 118.47 1n24 n ASP 227 Ca 0.14 -1.09 -0.30 0.00 -0.53 0.00 0.00 54.79 53.00 1n24 n ASP 227 Cb 0.28 0.58 -0.17 0.00 -0.64 0.00 0.00 41.12 41.18 1n24 n ASP 227 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1n24 s GLU 228 N -1.64 2.48 0.00 -1.24 2.02 -1.16 -5.12 118.70 114.04 1n24 s GLU 228 Ca 0.09 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.26 1n24 s GLU 228 Cb 0.09 -2.04 0.00 0.00 0.10 0.00 0.00 34.13 32.29 1n24 s GLU 228 CO 0.34 0.29 0.00 -1.71 0.02 0.00 0.00 175.26 174.19 1n24 n ASN 231 N 3.17 0.00 -4.17 -0.19 2.85 -1.26 -4.92 115.26 110.74 1n24 n ASN 231 Ca -0.18 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 53.95 1n24 n ASN 231 Cb 0.52 0.00 -0.14 0.00 1.24 0.00 0.00 39.78 41.40 1n24 n ASN 231 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1n24 s GLU 232 N -3.92 2.56 -0.25 1.20 2.56 -1.26 -5.03 118.70 114.56 1n24 s GLU 232 Ca 0.00 -1.17 -0.10 0.00 0.00 0.00 0.00 54.97 53.71 1n24 s GLU 232 Cb 0.00 -3.05 0.11 0.00 2.00 0.00 0.00 34.13 33.18 1n24 s GLU 232 CO 0.00 -0.52 0.56 0.42 -0.56 0.00 0.00 175.26 175.16 1n24 s ILE 233 N 1.26 -0.71 -0.22 -3.70 1.01 -1.26 -5.11 121.20 112.47 1n24 s ILE 233 Ca -0.04 0.06 -0.33 0.00 0.00 0.00 0.00 60.65 60.35 1n24 s ILE 233 Cb -0.19 -0.86 -0.15 0.00 0.01 0.00 0.00 42.46 41.27 1n24 s ILE 233 CO -0.03 0.03 1.03 -0.67 0.00 0.00 0.00 174.94 175.30 1n24 n ASP 234 N 5.23 0.53 -0.03 3.58 -0.08 -1.26 -4.78 116.55 119.73 1n24 n ASP 234 Ca -0.12 0.88 -0.08 0.00 -1.51 0.00 0.00 54.79 53.95 1n24 n ASP 234 Cb 0.51 -0.67 -0.02 0.00 2.34 0.00 0.00 41.12 43.28 1n24 n ASP 234 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1n24 h GLU 235 N 3.11 -0.13 0.74 -0.67 5.08 -1.99 -1.53 114.58 119.20 1n24 h GLU 235 Ca -0.35 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 57.99 1n24 h GLU 235 Cb 1.04 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1n24 h GLU 235 CO 0.63 -0.09 -0.41 -0.91 -1.00 0.00 0.00 179.01 177.23 1n24 h ASN 236 N -0.14 -1.00 -1.12 1.42 2.35 -1.95 -1.28 115.58 113.86 1n24 h ASN 236 Ca 0.12 0.05 0.32 0.00 -0.55 0.00 0.00 56.30 56.23 1n24 h ASN 236 Cb 0.31 0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.90 1n24 h ASN 236 CO -0.28 -0.66 0.78 0.25 -1.65 0.00 0.00 177.43 175.87 1n24 h LEU 237 N -1.06 0.11 -0.13 1.61 5.85 -1.90 0.47 115.31 120.26 1n24 h LEU 237 Ca -0.10 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.54 1n24 h LEU 237 Cb 0.84 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.88 1n24 h LEU 237 CO 0.13 0.02 -0.35 0.25 -0.34 0.00 0.00 178.44 178.15 1n24 h LEU 238 N 0.10 0.53 -1.30 2.25 5.85 -0.64 -1.92 115.31 120.18 1n24 h LEU 238 Ca 0.56 -0.59 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 1n24 h LEU 238 Cb 2.02 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.88 1n24 h LEU 238 CO -0.08 1.02 0.05 -0.07 -0.34 0.00 0.00 178.44 179.02 1n24 h LEU 239 N 0.06 0.49 -0.39 2.25 3.38 0.95 -1.58 115.31 120.46 1n24 h LEU 239 Ca -0.01 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1n24 h LEU 239 Cb 0.96 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1n24 h LEU 239 CO 0.08 0.52 -0.19 -0.25 0.09 0.00 0.00 178.44 178.68 1n24 h TRP 240 N 0.51 0.95 -0.26 1.13 2.91 -0.79 -2.41 115.95 117.99 1n24 h TRP 240 Ca 0.12 -0.24 -0.01 0.00 1.13 0.00 0.00 58.89 59.89 1n24 h TRP 240 Cb 0.25 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 28.67 1n24 h TRP 240 CO 0.01 0.99 0.12 0.82 -1.03 0.00 0.00 178.44 179.35 1n24 h ILE 241 N 0.63 1.15 -0.29 2.65 2.04 -0.82 -0.80 117.51 122.07 1n24 h ILE 241 Ca 0.09 -0.44 0.05 0.00 1.00 0.00 0.00 64.86 65.55 1n24 h ILE 241 Cb 0.75 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 1n24 h ILE 241 CO 0.06 0.15 0.02 0.03 0.00 0.00 0.00 178.15 178.41 1n24 h ARG 242 N 0.28 0.11 -0.13 2.37 3.08 -1.27 0.14 114.38 118.96 1n24 h ARG 242 Ca 0.09 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.18 1n24 h ARG 242 Cb 0.13 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.10 1n24 h ARG 242 CO -0.01 0.07 -0.22 1.25 -1.07 0.00 0.00 179.97 179.99 1n24 h HIS 243 N 0.11 -0.58 0.00 3.04 2.76 -1.13 -1.74 115.15 117.62 1n24 h HIS 243 Ca 0.14 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1n24 h HIS 243 Cb 0.17 0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.40 1n24 h HIS 243 CO -0.20 -0.30 0.00 0.77 -1.30 0.00 0.00 177.93 176.90 1n24 h SER 244 N -0.28 0.00 1.18 3.26 0.02 -0.74 -2.47 113.55 114.53 1n24 h SER 244 Ca 0.10 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.89 1n24 h SER 244 Cb 0.42 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1n24 h SER 244 CO -0.29 0.00 -0.84 -0.07 -1.14 0.00 0.00 176.83 174.49 1n24 h LEU 245 N 0.00 0.00 -0.10 5.07 3.38 -0.12 -2.43 115.31 121.11 1n24 h LEU 245 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1n24 h LEU 245 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1n24 h LEU 245 CO 0.00 0.74 -0.24 0.44 0.09 0.00 0.00 178.44 179.47 1n24 h ASP 246 N 0.00 0.38 -2.33 -0.43 3.32 -0.97 -3.45 116.42 112.95 1n24 h ASP 246 Ca -0.03 -0.59 -0.02 0.00 0.02 0.00 0.00 57.03 56.41 1n24 h ASP 246 Cb 1.59 -0.11 -0.24 0.00 0.22 0.00 0.00 39.33 40.79 1n24 h ASP 246 CO 0.09 0.90 -0.26 -0.76 -1.72 0.00 0.00 179.24 177.49 1n24 s LEU 247 N -8.85 -0.85 1.08 1.55 1.43 -0.99 -5.14 118.68 106.91 1n24 s LEU 247 Ca -0.14 1.25 -0.12 0.00 -1.03 0.00 0.00 54.13 54.09 1n24 s LEU 247 Cb 0.04 1.78 0.24 0.00 0.03 0.00 0.00 46.19 48.28 1n24 s LEU 247 CO 0.76 -0.23 1.07 -2.16 0.23 0.00 0.00 176.35 176.03 1n24 s PRO 248 N 2.67 -0.25 0.35 1.29 0.04 -0.92 -4.08 135.00 134.11 1n24 s PRO 248 Ca -0.04 1.09 0.03 0.00 0.04 0.00 0.00 61.00 62.12 1n24 s PRO 248 Cb -0.12 -1.61 0.66 0.00 0.04 0.00 0.00 34.50 33.47 1n24 s PRO 248 CO -0.16 -3.35 2.00 -0.07 0.04 0.00 0.00 177.00 175.46 1n24 h LEU 249 N -2.36 0.72 -2.66 -3.56 3.38 -1.92 -1.14 115.31 107.77 1n24 h LEU 249 Ca -0.55 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 1n24 h LEU 249 Cb 1.31 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1n24 h LEU 249 CO 0.47 0.51 -0.01 -0.74 0.09 0.00 0.00 178.44 178.76 1n24 h HIS 250 N 0.84 0.00 -0.58 1.13 2.76 -1.90 -1.41 115.15 115.99 1n24 h HIS 250 Ca 0.26 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.43 1n24 h HIS 250 Cb -0.00 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 1n24 h HIS 250 CO -0.00 0.01 0.00 0.91 -1.30 0.00 0.00 177.93 177.55 1n24 n TRP 251 N -3.37 1.36 -4.47 5.26 7.02 -0.44 -4.97 117.44 117.84 1n24 n TRP 251 Ca -0.03 -0.63 -0.23 0.00 -1.02 0.00 0.00 57.50 55.59 1n24 n TRP 251 Cb 0.10 -0.24 -0.10 0.00 -2.42 0.00 0.00 31.31 28.64 1n24 n TRP 251 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1n24 s ARG 252 N -1.91 1.64 -0.07 -0.99 0.52 -0.53 -4.80 118.95 112.82 1n24 s ARG 252 Ca 0.48 -1.85 0.04 0.00 -0.52 0.00 0.00 55.73 53.88 1n24 s ARG 252 Cb 0.32 -1.29 0.00 0.00 0.52 0.00 0.00 34.95 34.50 1n24 s ARG 252 CO 0.22 0.04 -0.17 0.42 0.02 0.00 0.00 175.30 175.82 1n24 s ILE 253 N -2.92 1.51 0.10 1.52 1.01 -1.26 -4.99 121.20 116.17 1n24 s ILE 253 Ca 0.31 -0.73 -0.19 0.00 0.00 0.00 0.00 60.65 60.04 1n24 s ILE 253 Cb 0.04 -1.32 -0.08 0.00 0.01 0.00 0.00 42.46 41.11 1n24 s ILE 253 CO 0.14 0.44 1.65 -0.61 0.00 0.00 0.00 174.94 176.55 1n24 h GLN 254 N 6.60 0.33 -0.02 2.79 -0.00 -1.93 -1.86 115.11 121.03 1n24 h GLN 254 Ca -0.29 -0.06 0.01 0.00 -0.00 0.00 0.00 58.65 58.31 1n24 h GLN 254 Cb 1.19 -0.06 -0.00 0.00 0.00 0.00 0.00 27.48 28.62 1n24 h GLN 254 CO 0.47 0.37 0.04 0.66 0.00 0.00 0.00 178.83 180.37 1n24 h SER 255 N 0.22 0.00 0.16 -0.69 4.64 -1.92 0.24 113.55 116.20 1n24 h SER 255 Ca 0.08 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.08 1n24 h SER 255 Cb 0.16 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1n24 h SER 255 CO -0.01 0.00 -1.57 0.58 -0.87 0.00 0.00 176.83 174.97 1n24 h VAL 256 N 0.00 1.00 -0.63 0.95 2.07 -1.77 -3.37 116.25 114.51 1n24 h VAL 256 Ca 0.01 -2.47 -0.31 0.00 0.82 0.00 0.00 66.70 64.75 1n24 h VAL 256 Cb 0.08 2.77 -0.19 0.00 -1.52 0.00 0.00 31.29 32.43 1n24 h VAL 256 CO -0.00 0.79 0.23 -0.62 0.02 0.00 0.00 177.57 177.99 1n24 n GLU 257 N -3.76 2.13 -0.22 1.57 1.02 -0.74 -4.73 120.64 115.91 1n24 n GLU 257 Ca -0.24 -3.11 0.02 0.00 -0.02 0.00 0.00 57.16 53.81 1n24 n GLU 257 Cb 0.99 -1.98 0.12 0.00 -0.02 0.00 0.00 31.44 30.55 1n24 n GLU 257 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n24 h ALA 258 N 1.11 0.66 -0.44 0.62 0.00 -0.71 -1.66 119.26 118.85 1n24 h ALA 258 Ca 0.38 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1n24 h ALA 258 Cb 2.17 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 20.29 1n24 h ALA 258 CO 0.69 -0.40 0.28 -0.09 0.00 0.00 0.00 179.25 179.73 1n24 h ARG 259 N 0.12 0.58 -0.97 0.00 2.43 -1.86 -0.99 114.38 113.69 1n24 h ARG 259 Ca 0.35 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.49 1n24 h ARG 259 Cb 0.58 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.95 1n24 h ARG 259 CO -0.56 0.41 0.64 2.35 -1.51 0.00 0.00 179.97 181.29 1n24 h TRP 260 N 0.58 1.22 -0.25 2.20 7.01 -1.70 0.39 115.95 125.40 1n24 h TRP 260 Ca 0.16 0.03 -0.19 0.00 2.11 0.00 0.00 58.89 61.00 1n24 h TRP 260 Cb -0.04 -0.41 0.00 0.00 -2.10 0.00 0.00 29.16 26.61 1n24 h TRP 260 CO -0.04 0.76 -0.59 0.74 -2.79 0.00 0.00 178.44 176.52 1n24 h PHE 261 N 1.31 1.08 -0.13 2.65 -1.00 -1.07 -1.35 116.94 118.42 1n24 h PHE 261 Ca 0.36 -0.41 -0.01 0.00 2.81 0.00 0.00 57.97 60.72 1n24 h PHE 261 Cb -0.14 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.22 1n24 h PHE 261 CO -0.00 1.24 0.03 0.82 -1.61 0.00 0.00 178.31 178.78 1n24 h ILE 262 N 0.62 1.21 -0.25 -0.55 2.04 -0.95 -1.28 117.51 118.34 1n24 h ILE 262 Ca -0.00 -0.66 0.06 0.00 1.00 0.00 0.00 64.86 65.26 1n24 h ILE 262 Cb 1.20 1.39 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 1n24 h ILE 262 CO 0.13 0.19 -0.11 0.44 0.00 0.00 0.00 178.15 178.80 1n24 h ASP 263 N 0.01 -0.39 -1.00 1.72 5.19 -0.92 -0.56 116.42 120.47 1n24 h ASP 263 Ca 0.04 0.10 0.07 0.00 -0.62 0.00 0.00 57.03 56.61 1n24 h ASP 263 Cb 0.28 0.22 -0.07 0.00 0.18 0.00 0.00 39.33 39.94 1n24 h ASP 263 CO 0.00 -0.15 0.65 0.00 -3.12 0.00 0.00 179.24 176.62 1n24 h ALA 264 N 1.14 1.40 -0.51 3.45 0.00 -1.12 -1.54 119.26 122.08 1n24 h ALA 264 Ca 0.13 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1n24 h ALA 264 Cb 0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1n24 h ALA 264 CO -0.31 0.44 0.05 -0.92 0.00 0.00 0.00 179.25 178.51 1n24 h TYR 265 N 1.17 0.87 0.00 0.00 3.20 -0.08 -2.56 116.97 119.57 1n24 h TYR 265 Ca 0.43 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 62.20 1n24 h TYR 265 Cb 0.17 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.20 1n24 h TYR 265 CO -0.00 0.77 0.00 0.00 -1.64 0.00 0.00 178.16 177.29 1n24 h ALA 266 N 1.27 1.00 -0.01 1.82 0.00 -0.12 -2.61 119.26 120.61 1n24 h ALA 266 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1n24 h ALA 266 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1n24 h ALA 266 CO 0.01 0.00 -0.21 0.54 0.00 0.00 0.00 179.25 179.59 1n24 n ARG 267 N -3.02 0.86 -2.89 0.00 1.74 -0.97 -4.90 116.66 107.48 1n24 n ARG 267 Ca 0.00 -0.47 -0.41 0.00 -0.77 0.00 0.00 57.85 56.20 1n24 n ARG 267 Cb 0.26 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.17 1n24 n ARG 267 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1n24 s ARG 268 N -2.46 4.52 0.18 5.56 0.52 -0.98 -4.96 118.95 121.32 1n24 s ARG 268 Ca 0.26 1.15 -0.13 0.00 -0.52 0.00 0.00 55.73 56.50 1n24 s ARG 268 Cb 0.19 -3.42 0.15 0.00 0.52 0.00 0.00 34.95 32.39 1n24 s ARG 268 CO 0.50 0.10 1.79 -1.35 0.02 0.00 0.00 175.30 176.36 1n24 h PRO 269 N 6.38 0.51 -0.81 3.54 0.11 -1.90 -1.39 132.00 138.44 1n24 h PRO 269 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1n24 h PRO 269 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1n24 h PRO 269 CO 0.74 0.34 0.00 -0.40 -0.21 0.00 0.00 178.00 178.47 1n24 n ASP 270 N -4.87 1.15 -4.73 -2.05 5.75 -1.26 -4.92 116.55 105.62 1n24 n ASP 270 Ca 0.05 -2.05 -0.38 0.00 -0.01 0.00 0.00 54.79 52.39 1n24 n ASP 270 Cb 0.14 -0.43 0.05 0.00 -1.03 0.00 0.00 41.12 39.84 1n24 n ASP 270 CO 0.00 0.00 0.00 0.80 -0.11 0.00 0.00 177.20 177.89 1n24 n MET 271 N -0.03 1.56 -3.81 0.11 1.56 -0.52 -5.00 117.12 110.99 1n24 n MET 271 Ca 0.02 0.58 -0.37 0.00 -0.27 0.00 0.00 57.70 57.66 1n24 n MET 271 Cb 0.27 -2.52 -0.13 0.00 2.15 0.00 0.00 33.22 32.98 1n24 n MET 271 CO 0.00 0.00 0.00 1.21 -0.73 0.00 0.00 175.97 176.45 1n24 s ASN 272 N -0.98 4.94 0.44 6.12 3.84 -1.26 -5.00 114.94 123.04 1n24 s ASN 272 Ca 0.73 -0.75 0.17 0.00 0.21 0.00 0.00 52.86 53.22 1n24 s ASN 272 Cb -0.42 -1.83 1.09 0.00 -0.55 0.00 0.00 41.25 39.55 1n24 s ASN 272 CO 0.48 -0.18 1.94 -0.65 -2.79 0.00 0.00 177.10 175.91 1n24 h PRO 273 N 8.18 0.35 -0.02 0.43 0.11 -1.98 -0.97 132.00 138.10 1n24 h PRO 273 Ca -0.32 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.77 1n24 h PRO 273 Cb 1.12 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1n24 h PRO 273 CO 0.60 0.23 -0.02 1.25 -0.21 0.00 0.00 178.00 179.85 1n24 h LEU 274 N 0.36 0.05 -0.74 2.35 6.46 -1.99 -0.68 115.31 121.12 1n24 h LEU 274 Ca 0.34 -0.47 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 1n24 h LEU 274 Cb 0.82 -0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.70 1n24 h LEU 274 CO -0.10 0.52 0.44 0.40 -0.62 0.00 0.00 178.44 179.08 1n24 h ILE 275 N -0.41 1.21 -0.27 4.05 2.04 -1.85 -1.81 117.51 120.47 1n24 h ILE 275 Ca 0.00 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1n24 h ILE 275 Cb 0.50 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1n24 h ILE 275 CO 0.00 0.23 0.18 0.15 0.00 0.00 0.00 178.15 178.71 1n24 h PHE 276 N 1.01 0.33 -0.33 1.37 3.57 -1.15 -0.32 116.94 121.42 1n24 h PHE 276 Ca 0.26 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1n24 h PHE 276 Cb -0.02 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 1n24 h PHE 276 CO -0.01 0.21 0.22 1.49 -2.23 0.00 0.00 178.31 177.99 1n24 h GLU 277 N 0.36 0.43 -0.74 1.11 4.81 -0.84 -1.85 114.58 117.86 1n24 h GLU 277 Ca 0.10 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1n24 h GLU 277 Cb -0.04 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.21 1n24 h GLU 277 CO -0.03 0.29 0.31 1.25 -0.73 0.00 0.00 179.01 180.11 1n24 h LEU 278 N 0.44 1.01 -0.45 1.64 5.85 -1.06 0.47 115.31 123.21 1n24 h LEU 278 Ca 0.12 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.68 1n24 h LEU 278 Cb -0.05 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 1n24 h LEU 278 CO -0.03 0.89 0.30 0.00 -0.34 0.00 0.00 178.44 179.26 1n24 h ALA 279 N 1.16 0.57 -0.40 1.25 0.00 -0.78 0.19 119.26 121.26 1n24 h ALA 279 Ca 0.25 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1n24 h ALA 279 Cb 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1n24 h ALA 279 CO -0.02 0.02 -0.09 0.87 0.00 0.00 0.00 179.25 180.03 1n24 h LYS 280 N 0.61 0.76 -0.31 0.00 1.57 -1.05 -1.03 116.57 117.11 1n24 h LYS 280 Ca 0.17 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1n24 h LYS 280 Cb -0.07 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1n24 h LYS 280 CO -0.04 0.89 0.15 1.25 -0.57 0.00 0.00 179.45 181.13 1n24 h LEU 281 N 0.57 0.41 -0.66 2.94 5.85 -0.61 -0.74 115.31 123.07 1n24 h LEU 281 Ca 0.10 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1n24 h LEU 281 Cb 0.61 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1n24 h LEU 281 CO 0.04 0.43 0.43 -1.13 -0.34 0.00 0.00 178.44 177.87 1n24 h ASN 282 N 0.37 0.74 -0.46 1.25 -1.24 -0.54 -0.77 115.58 114.94 1n24 h ASN 282 Ca 0.11 -0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.14 1n24 h ASN 282 Cb 0.12 -0.18 -0.04 0.00 0.73 0.00 0.00 38.32 38.96 1n24 h ASN 282 CO -0.01 0.53 0.25 0.15 -1.29 0.00 0.00 177.43 177.06 1n24 h PHE 283 N 0.88 0.46 -0.11 0.67 3.57 -0.75 -0.84 116.94 120.82 1n24 h PHE 283 Ca 0.25 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.62 1n24 h PHE 283 Cb -0.07 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 1n24 h PHE 283 CO -0.03 0.24 -0.55 -0.91 -2.23 0.00 0.00 178.31 174.82 1n24 h ASN 284 N 0.49 0.37 -0.16 0.41 2.35 -0.73 -1.30 115.58 117.00 1n24 h ASN 284 Ca 0.20 -0.20 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 1n24 h ASN 284 Cb 0.08 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1n24 h ASN 284 CO -0.12 0.85 -0.22 0.40 -1.65 0.00 0.00 177.43 176.68 1n24 h ILE 285 N 0.25 1.35 -0.11 2.81 2.04 -0.88 -2.42 117.51 120.56 1n24 h ILE 285 Ca 0.00 -1.44 -0.07 0.00 1.00 0.00 0.00 64.86 64.35 1n24 h ILE 285 Cb 1.05 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 39.03 1n24 h ILE 285 CO 0.09 0.43 -0.27 0.40 0.00 0.00 0.00 178.15 178.80 1n24 h ILE 286 N 0.06 1.24 -0.56 -0.67 2.04 -1.15 -2.26 117.51 116.21 1n24 h ILE 286 Ca 0.02 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 1n24 h ILE 286 Cb 0.79 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.30 1n24 h ILE 286 CO 0.05 0.34 0.32 -0.61 0.00 0.00 0.00 178.15 178.25 1n24 h GLN 287 N 0.18 0.77 -0.69 2.37 4.15 -1.11 0.28 115.11 121.06 1n24 h GLN 287 Ca 0.03 -0.08 0.01 0.00 0.77 0.00 0.00 58.65 59.38 1n24 h GLN 287 Cb 0.58 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.08 1n24 h GLN 287 CO 0.04 0.58 0.45 0.00 -1.93 0.00 0.00 178.83 177.97 1n24 h ALA 288 N 1.15 0.88 -0.66 3.38 0.00 -0.91 -0.32 119.26 122.78 1n24 h ALA 288 Ca 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1n24 h ALA 288 Cb 0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1n24 h ALA 288 CO -0.03 0.28 0.37 1.15 0.00 0.00 0.00 179.25 181.01 1n24 h THR 289 N 0.92 1.21 -0.76 0.00 2.02 -0.92 -2.20 112.91 113.18 1n24 h THR 289 Ca 0.26 -0.51 -0.04 0.00 0.77 0.00 0.00 66.41 66.89 1n24 h THR 289 Cb -0.08 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 66.63 1n24 h THR 289 CO -0.07 0.22 0.31 0.45 0.37 0.00 0.00 175.52 176.81 1n24 h HIS 290 N 0.91 1.13 -0.64 3.16 -0.00 -0.27 -1.84 115.15 117.59 1n24 h HIS 290 Ca 0.23 -0.07 -0.05 0.00 -0.00 0.00 0.00 60.37 60.48 1n24 h HIS 290 Cb 0.03 -0.34 -0.03 0.00 -0.00 0.00 0.00 27.41 27.07 1n24 h HIS 290 CO -0.01 0.85 0.20 1.96 -0.00 0.00 0.00 177.93 180.93 1n24 h GLN 291 N 1.09 0.97 -0.49 2.45 4.20 -0.65 0.13 115.11 122.81 1n24 h GLN 291 Ca 0.25 -0.19 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 1n24 h GLN 291 Cb 0.19 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1n24 h GLN 291 CO -0.02 0.83 -0.06 0.37 -0.67 0.00 0.00 178.83 179.28 1n24 h GLN 292 N 0.94 0.91 -0.49 1.46 5.75 -1.00 0.11 115.11 122.79 1n24 h GLN 292 Ca 0.21 -0.32 -0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1n24 h GLN 292 Cb 0.27 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 1n24 h GLN 292 CO -0.01 0.97 0.30 0.93 -2.65 0.00 0.00 178.83 178.37 1n24 h GLU 293 N 0.76 0.66 -0.74 1.69 5.08 -0.75 -1.33 114.58 119.96 1n24 h GLU 293 Ca 0.13 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1n24 h GLU 293 Cb 0.60 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 1n24 h GLU 293 CO 0.04 0.47 0.28 1.25 -1.00 0.00 0.00 179.01 180.05 1n24 h LEU 294 N 0.65 1.02 -0.61 1.33 5.85 -0.47 -1.89 115.31 121.18 1n24 h LEU 294 Ca 0.18 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1n24 h LEU 294 Cb -0.02 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1n24 h LEU 294 CO -0.03 0.92 0.37 0.11 -0.34 0.00 0.00 178.44 179.47 1n24 h LYS 295 N 1.08 0.83 -0.51 1.25 1.57 -0.39 0.10 116.57 120.50 1n24 h LYS 295 Ca 0.25 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 1n24 h LYS 295 Cb 0.23 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1n24 h LYS 295 CO -0.02 0.59 -0.04 -0.44 -0.57 0.00 0.00 179.45 178.98 1n24 h ASP 296 N 0.83 0.87 -0.49 0.86 3.32 -0.94 -1.76 116.42 119.12 1n24 h ASP 296 Ca 0.22 -0.24 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1n24 h ASP 296 Cb -0.03 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 1n24 h ASP 296 CO -0.04 0.95 0.05 -0.07 -1.72 0.00 0.00 179.24 178.41 1n24 h LEU 297 N 0.82 0.80 -1.14 1.55 3.38 -0.97 -2.91 115.31 116.84 1n24 h LEU 297 Ca 0.15 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1n24 h LEU 297 Cb 0.54 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1n24 h LEU 297 CO 0.03 0.88 0.32 -1.28 0.09 0.00 0.00 178.44 178.48 1n24 h SER 298 N 0.69 0.83 -0.58 -0.43 0.87 -0.50 0.20 113.55 114.63 1n24 h SER 298 Ca 0.14 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1n24 h SER 298 Cb 0.44 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 1n24 h SER 298 CO 0.02 0.70 0.33 -0.09 -0.53 0.00 0.00 176.83 177.25 1n24 h ARG 299 N 0.92 0.80 -0.04 2.24 2.43 -1.19 0.11 114.38 119.65 1n24 h ARG 299 Ca 0.23 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1n24 h ARG 299 Cb 0.08 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1n24 h ARG 299 CO -0.03 0.60 -0.02 2.35 -1.51 0.00 0.00 179.97 181.36 1n24 h TRP 300 N 0.78 0.10 -0.82 2.20 7.01 -1.20 -2.86 115.95 121.15 1n24 h TRP 300 Ca 0.20 -0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.25 1n24 h TRP 300 Cb 0.03 -0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.00 1n24 h TRP 300 CO -0.01 0.48 0.50 2.35 -2.79 0.00 0.00 178.44 178.97 1n24 h TRP 301 N -0.31 0.92 -0.24 2.65 -0.00 -0.43 -1.77 115.95 116.76 1n24 h TRP 301 Ca 0.01 0.03 -0.05 0.00 -0.00 0.00 0.00 58.89 58.87 1n24 h TRP 301 Cb 0.46 -0.29 -0.01 0.00 -0.00 0.00 0.00 29.16 29.31 1n24 h TRP 301 CO 0.07 0.45 -0.08 0.77 -0.00 0.00 0.00 178.44 179.65 1n24 h SER 302 N 0.90 0.36 -0.04 2.65 0.02 -0.79 -2.68 113.55 113.97 1n24 h SER 302 Ca 0.37 -0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 61.10 1n24 h SER 302 Cb 0.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1n24 h SER 302 CO -0.19 0.48 -0.45 -0.09 -1.14 0.00 0.00 176.83 175.44 1n24 h ARG 303 N 0.36 0.59 -0.50 3.45 2.43 -1.09 -3.13 114.38 116.48 1n24 h ARG 303 Ca 0.08 -0.32 -0.10 0.00 -0.81 0.00 0.00 59.98 58.82 1n24 h ARG 303 Cb 0.37 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1n24 h ARG 303 CO 0.02 0.92 -0.08 1.25 -1.51 0.00 0.00 179.97 180.57 1n24 h LEU 304 N 0.47 0.89 2.31 3.80 5.85 -1.13 -3.47 115.31 124.03 1n24 h LEU 304 Ca 0.03 -0.27 -0.39 0.00 0.84 0.00 0.00 57.88 58.09 1n24 h LEU 304 Cb 0.98 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1n24 h LEU 304 CO 0.09 1.00 -0.53 0.00 -0.34 0.00 0.00 178.44 178.66 1n24 h PHE 306 N -0.36 0.34 -0.84 0.00 -1.00 -1.91 -1.56 116.94 111.60 1n24 h PHE 306 Ca -0.48 0.01 0.18 0.00 2.81 0.00 0.00 57.97 60.49 1n24 h PHE 306 Cb 1.35 -0.11 -0.06 0.00 3.61 0.00 0.00 35.95 40.74 1n24 h PHE 306 CO 0.52 0.20 0.56 -1.35 -1.61 0.00 0.00 178.31 176.62 1n24 h PRO 307 N 0.37 0.39 0.07 1.51 0.11 -1.92 0.35 132.00 132.88 1n24 h PRO 307 Ca 0.13 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 66.10 1n24 h PRO 307 Cb 0.01 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.04 1n24 h PRO 307 CO -0.07 0.26 -0.47 1.49 -0.21 0.00 0.00 178.00 179.01 1n24 h GLU 308 N 0.40 0.20 0.00 1.05 4.81 -1.87 -3.19 114.58 115.98 1n24 h GLU 308 Ca 0.43 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1n24 h GLU 308 Cb 1.05 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1n24 h GLU 308 CO -0.15 1.11 0.00 0.87 -0.73 0.00 0.00 179.01 180.12 1n24 h LYS 309 N -0.57 0.00 -2.24 1.92 1.79 -0.86 -3.36 116.57 113.25 1n24 h LYS 309 Ca -0.08 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.81 1n24 h LYS 309 Cb 1.33 0.00 -0.39 0.00 -1.58 0.00 0.00 32.23 31.59 1n24 h LYS 309 CO 0.09 0.00 -0.94 1.28 -1.08 0.00 0.00 179.45 178.80 1n24 n LEU 310 N -2.62 0.84 0.04 2.94 4.32 0.12 -4.93 117.00 117.71 1n24 n LEU 310 Ca 0.05 -4.77 0.21 0.00 -0.02 0.00 0.00 56.01 51.48 1n24 n LEU 310 Cb 0.46 0.27 0.74 0.00 -1.62 0.00 0.00 43.42 43.26 1n24 n LEU 310 CO 0.31 1.98 1.19 -0.65 -1.22 0.00 0.00 177.39 179.00 1n24 h PRO 311 N 4.63 0.00 0.00 3.23 0.11 -1.71 -2.61 132.00 135.65 1n24 h PRO 311 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1n24 h PRO 311 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1n24 h PRO 311 CO 0.52 0.00 0.00 1.97 -0.21 0.00 0.00 178.00 180.28 1n24 n PHE 312 N -3.92 0.00 -3.10 0.65 1.16 -1.26 -4.87 117.46 106.11 1n24 n PHE 312 Ca 0.09 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.43 1n24 n PHE 312 Cb 0.65 -0.50 0.00 0.00 -1.61 0.00 0.00 39.48 38.02 1n24 n PHE 312 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 1n24 s VAL 313 N -3.00 4.51 0.21 1.97 -7.23 -0.98 -5.01 120.40 110.87 1n24 s VAL 313 Ca 0.12 -0.42 -0.30 0.00 -1.81 0.00 0.00 61.98 59.57 1n24 s VAL 313 Cb 0.17 -3.66 -0.08 0.00 0.56 0.00 0.00 36.38 33.36 1n24 s VAL 313 CO 0.46 -0.47 1.11 -0.13 -0.31 0.00 0.00 175.10 175.76 1n24 s ARG 314 N -4.48 4.61 -0.60 4.82 0.52 -1.26 -4.92 118.95 117.63 1n24 s ARG 314 Ca 0.45 1.76 -0.04 0.00 -0.52 0.00 0.00 55.73 57.37 1n24 s ARG 314 Cb -0.10 -3.25 0.16 0.00 0.52 0.00 0.00 34.95 32.28 1n24 s ARG 314 CO 0.38 0.11 0.43 0.34 0.02 0.00 0.00 175.30 176.58 1n24 s ASP 315 N -0.36 5.42 -0.43 0.23 2.15 -1.26 -4.69 116.67 117.73 1n24 s ASP 315 Ca 0.48 -2.64 0.08 0.00 0.43 0.00 0.00 52.55 50.90 1n24 s ASP 315 Cb -0.30 -1.90 0.42 0.00 -0.30 0.00 0.00 42.92 40.84 1n24 s ASP 315 CO 0.37 -0.44 1.05 0.54 -0.17 0.00 0.00 175.17 176.52 1n24 n ARG 316 N 3.82 2.87 -0.13 4.34 5.12 -1.26 -3.69 116.66 127.73 1n24 n ARG 316 Ca 0.06 -4.26 -0.09 0.00 -1.93 0.00 0.00 57.85 51.63 1n24 n ARG 316 Cb 0.39 -2.03 -0.00 0.00 -1.16 0.00 0.00 32.46 29.66 1n24 n ARG 316 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1n24 h LEU 317 N 2.72 0.52 -0.42 0.55 5.85 -1.95 -0.42 115.31 122.16 1n24 h LEU 317 Ca 0.20 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1n24 h LEU 317 Cb 0.93 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1n24 h LEU 317 CO 0.77 0.49 -0.10 0.58 -0.34 0.00 0.00 178.44 179.83 1n24 h VAL 318 N 0.52 1.27 -0.64 1.05 2.07 -1.91 -1.22 116.25 117.38 1n24 h VAL 318 Ca 0.14 -1.20 -0.03 0.00 0.82 0.00 0.00 66.70 66.43 1n24 h VAL 318 Cb 0.10 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1n24 h VAL 318 CO -0.02 0.40 0.28 -0.33 0.02 0.00 0.00 177.57 177.92 1n24 h GLU 319 N 0.62 0.95 -0.57 1.57 3.07 -1.92 0.15 114.58 118.45 1n24 h GLU 319 Ca 0.11 -0.16 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1n24 h GLU 319 Cb 0.63 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 1n24 h GLU 319 CO 0.04 0.78 0.31 0.77 -1.40 0.00 0.00 179.01 179.51 1n24 h SER 320 N 0.90 0.72 -0.21 1.42 0.02 -0.92 -1.02 113.55 114.45 1n24 h SER 320 Ca 0.22 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.98 1n24 h SER 320 Cb 0.17 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1n24 h SER 320 CO -0.02 0.61 -0.15 0.15 -1.14 0.00 0.00 176.83 176.27 1n24 h PHE 321 N 0.77 0.67 -0.65 3.45 3.57 -0.91 -1.21 116.94 122.63 1n24 h PHE 321 Ca 0.20 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 1n24 h PHE 321 Cb 0.05 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 1n24 h PHE 321 CO -0.01 0.73 0.39 0.35 -2.23 0.00 0.00 178.31 177.54 1n24 h PHE 322 N 0.56 0.85 -0.32 0.41 3.57 -0.45 0.24 116.94 121.79 1n24 h PHE 322 Ca 0.09 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.60 1n24 h PHE 322 Cb 0.58 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1n24 h PHE 322 CO 0.02 0.57 0.21 2.35 -2.23 0.00 0.00 178.31 179.24 1n24 h TRP 323 N 0.88 0.39 -0.70 0.41 2.91 -0.66 -1.42 115.95 117.76 1n24 h TRP 323 Ca 0.23 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.26 1n24 h TRP 323 Cb -0.03 -0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 28.45 1n24 h TRP 323 CO -0.02 0.24 0.44 0.00 -1.03 0.00 0.00 178.44 178.08 1n24 h ALA 324 N 1.12 1.46 -0.67 2.65 0.00 -0.50 0.28 119.26 123.61 1n24 h ALA 324 Ca 0.12 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1n24 h ALA 324 Cb -0.04 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1n24 h ALA 324 CO -0.03 0.48 0.23 0.28 0.00 0.00 0.00 179.25 180.21 1n24 h VAL 325 N 0.96 1.24 -0.33 0.00 2.07 0.23 -1.82 116.25 118.60 1n24 h VAL 325 Ca 0.25 -0.81 -0.14 0.00 0.82 0.00 0.00 66.70 66.83 1n24 h VAL 325 Cb -0.07 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1n24 h VAL 325 CO -0.05 0.32 -0.36 1.23 0.02 0.00 0.00 177.57 178.72 1n24 h GLY 326 N 1.06 0.83 0.85 2.17 0.00 -0.17 -3.31 103.07 104.51 1n24 h GLY 326 Ca 0.22 -0.81 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1n24 h GLY 326 CO -0.01 0.74 -0.14 -0.33 0.00 0.00 0.00 176.54 176.79 1n24 h MET 327 N 0.63 -0.38 -4.26 4.80 2.86 -0.49 -3.40 114.93 114.70 1n24 h MET 327 Ca 0.06 0.03 -0.70 0.00 -2.06 0.00 0.00 59.70 57.02 1n24 h MET 327 Cb 0.91 0.09 -0.33 0.00 0.06 0.00 0.00 31.60 32.32 1n24 h MET 327 CO 0.08 -0.15 -0.46 -0.06 1.06 0.00 0.00 176.91 177.38 1n24 s PHE 328 N -5.50 3.52 -0.01 -0.22 0.40 -0.73 -3.88 117.98 111.56 1n24 s PHE 328 Ca -0.15 -2.34 -0.22 0.00 -0.60 0.00 0.00 56.93 53.62 1n24 s PHE 328 Cb 0.04 -3.30 -0.20 0.00 0.51 0.00 0.00 43.02 40.06 1n24 s PHE 328 CO 0.61 -0.95 1.16 0.93 0.70 0.00 0.00 175.22 177.67 1n24 h GLU 329 N 7.94 0.26 -6.36 0.44 5.08 -1.78 -3.44 114.58 116.72 1n24 h GLU 329 Ca -0.12 -0.21 -0.64 0.00 -1.00 0.00 0.00 59.36 57.38 1n24 h GLU 329 Cb 1.03 0.04 0.07 0.00 0.50 0.00 0.00 28.75 30.40 1n24 h GLU 329 CO 0.74 0.87 0.37 -2.30 -1.00 0.00 0.00 179.01 177.69 1n24 n PRO 330 N -4.50 1.32 -0.28 2.33 -0.02 -1.26 -4.87 135.00 127.72 1n24 n PRO 330 Ca -0.09 0.47 0.07 0.00 -2.02 0.00 0.00 63.50 61.93 1n24 n PRO 330 Cb 0.47 -2.03 0.22 0.00 -0.02 0.00 0.00 33.50 32.14 1n24 n PRO 330 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1n24 h HIS 331 N 3.81 0.69 0.00 6.00 2.76 -2.00 -1.71 115.15 124.69 1n24 h HIS 331 Ca -0.44 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 1n24 h HIS 331 Cb 1.33 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 30.11 1n24 h HIS 331 CO 0.56 0.14 0.00 0.00 -1.30 0.00 0.00 177.93 177.32 1n24 n GLN 332 N -4.92 0.63 -1.48 5.26 0.00 -1.26 -3.85 117.38 111.76 1n24 n GLN 332 Ca 0.16 0.01 -0.35 0.00 0.00 0.00 0.00 57.00 56.83 1n24 n GLN 332 Cb 0.44 -1.50 0.06 0.00 0.00 0.00 0.00 30.24 29.24 1n24 n GLN 332 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1n24 n HIS 333 N -1.04 2.98 -0.03 2.61 8.25 -0.65 -4.61 115.22 122.73 1n24 n HIS 333 Ca 0.15 -2.70 -0.06 0.00 -0.26 0.00 0.00 57.72 54.85 1n24 n HIS 333 Cb 0.09 -1.34 0.15 0.00 1.12 0.00 0.00 29.99 30.00 1n24 n HIS 333 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1n24 h GLY 334 N 2.41 0.66 0.98 -1.41 0.00 -1.80 -1.91 103.07 102.00 1n24 h GLY 334 Ca 0.57 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1n24 h GLY 334 CO 1.46 0.51 0.17 -1.82 0.00 0.00 0.00 176.54 176.86 1n24 h TYR 335 N 0.53 0.85 -0.57 5.60 3.20 -1.94 -1.08 116.97 123.56 1n24 h TYR 335 Ca 0.07 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 1n24 h TYR 335 Cb 0.72 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.72 1n24 h TYR 335 CO 0.03 0.72 0.21 1.96 -1.64 0.00 0.00 178.16 179.44 1n24 h GLN 336 N 0.73 0.83 -0.26 1.82 7.50 -1.88 -0.95 115.11 122.90 1n24 h GLN 336 Ca 0.17 -0.14 -0.03 0.00 0.50 0.00 0.00 58.65 59.15 1n24 h GLN 336 Cb 0.27 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.65 1n24 h GLN 336 CO -0.01 0.70 0.04 0.00 -1.50 0.00 0.00 178.83 178.06 1n24 h ARG 337 N 0.82 0.44 -0.66 1.46 3.08 -0.83 -1.35 114.38 117.35 1n24 h ARG 337 Ca 0.19 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 1n24 h ARG 337 Cb 0.19 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1n24 h ARG 337 CO -0.01 0.57 0.22 0.87 -1.07 0.00 0.00 179.97 180.54 1n24 h LYS 338 N 0.25 0.99 -0.33 0.04 1.57 -0.85 -0.47 116.57 117.77 1n24 h LYS 338 Ca 0.08 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 1n24 h LYS 338 Cb 0.34 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1n24 h LYS 338 CO 0.01 0.83 0.00 1.98 -0.57 0.00 0.00 179.45 181.70 1n24 h MET 339 N 0.96 0.58 -0.54 3.15 4.05 -1.04 -1.41 114.93 120.68 1n24 h MET 339 Ca 0.22 -0.18 -0.06 0.00 -0.28 0.00 0.00 59.70 59.39 1n24 h MET 339 Cb 0.25 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 30.97 1n24 h MET 339 CO -0.01 0.70 0.09 0.00 0.23 0.00 0.00 176.91 177.93 1n24 h ALA 340 N 0.85 0.71 -0.89 0.39 0.00 -1.02 -1.27 119.26 118.04 1n24 h ALA 340 Ca 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1n24 h ALA 340 Cb 0.44 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1n24 h ALA 340 CO 0.02 0.45 0.48 0.00 0.00 0.00 0.00 179.25 180.20 1n24 h ALA 341 N 0.99 1.17 -0.21 0.00 0.00 -0.99 -0.80 119.26 119.42 1n24 h ALA 341 Ca 0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1n24 h ALA 341 Cb 0.40 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1n24 h ALA 341 CO 0.01 0.66 0.05 1.15 0.00 0.00 0.00 179.25 181.12 1n24 h THR 342 N 1.25 1.21 -0.69 0.00 2.02 -0.90 0.30 112.91 116.10 1n24 h THR 342 Ca 0.31 -0.68 -0.08 0.00 0.77 0.00 0.00 66.41 66.74 1n24 h THR 342 Cb 0.04 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1n24 h THR 342 CO -0.05 0.21 0.12 0.40 0.37 0.00 0.00 175.52 176.58 1n24 h ILE 343 N 0.16 1.26 -0.33 3.11 2.04 -1.00 -0.76 117.51 121.99 1n24 h ILE 343 Ca 0.07 -1.03 -0.04 0.00 1.00 0.00 0.00 64.86 64.85 1n24 h ILE 343 Cb 0.28 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1n24 h ILE 343 CO 0.00 0.39 0.05 0.40 0.00 0.00 0.00 178.15 178.99 1n24 h ILE 344 N 1.06 1.24 -0.32 -0.67 2.04 -1.03 0.30 117.51 120.13 1n24 h ILE 344 Ca 0.21 -0.83 -0.10 0.00 1.00 0.00 0.00 64.86 65.14 1n24 h ILE 344 Cb 0.43 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1n24 h ILE 344 CO 0.01 0.28 -0.23 1.62 0.00 0.00 0.00 178.15 179.83 1n24 h VAL 345 N 0.38 1.27 -0.12 1.67 3.04 -0.75 -0.35 116.25 121.39 1n24 h VAL 345 Ca 0.10 -1.28 -0.17 0.00 -1.01 0.00 0.00 66.70 64.34 1n24 h VAL 345 Cb 0.36 1.27 0.01 0.00 -2.01 0.00 0.00 31.29 30.91 1n24 h VAL 345 CO 0.01 0.42 -0.60 -0.07 -1.01 0.00 0.00 177.57 176.32 1n24 h LEU 346 N 0.54 0.74 -1.43 3.16 3.38 -1.00 -3.05 115.31 117.65 1n24 h LEU 346 Ca 0.08 -0.64 -0.03 0.00 0.09 0.00 0.00 57.88 57.39 1n24 h LEU 346 Cb 0.68 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1n24 h LEU 346 CO 0.05 1.25 0.10 0.00 0.09 0.00 0.00 178.44 179.93 1n24 h ALA 347 N 0.50 1.55 -0.72 1.53 0.00 -0.24 -0.37 119.26 121.52 1n24 h ALA 347 Ca -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1n24 h ALA 347 Cb 1.24 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1n24 h ALA 347 CO 0.12 0.34 0.45 1.15 0.00 0.00 0.00 179.25 181.32 1n24 h THR 348 N 0.48 1.20 -0.16 0.00 2.02 -1.02 0.15 112.91 115.57 1n24 h THR 348 Ca 0.12 -0.40 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 1n24 h THR 348 Cb 0.16 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1n24 h THR 348 CO -0.01 0.20 -0.24 0.58 0.37 0.00 0.00 175.52 176.42 1n24 h VAL 349 N 0.97 1.35 -0.52 3.16 2.07 -1.22 -2.67 116.25 119.39 1n24 h VAL 349 Ca 0.26 -1.46 0.02 0.00 0.82 0.00 0.00 66.70 66.33 1n24 h VAL 349 Cb -0.07 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1n24 h VAL 349 CO -0.05 0.44 0.33 0.40 0.02 0.00 0.00 177.57 178.70 1n24 h ILE 350 N 0.08 1.09 -0.14 4.57 2.04 -0.86 -2.03 117.51 122.26 1n24 h ILE 350 Ca 0.02 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.70 1n24 h ILE 350 Cb 0.81 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.21 1n24 h ILE 350 CO 0.06 0.12 -0.20 -0.78 0.00 0.00 0.00 178.15 177.34 1n24 h ASP 351 N 0.66 -0.63 -0.30 1.72 3.58 -0.69 -1.00 116.42 119.76 1n24 h ASP 351 Ca 0.20 0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.80 1n24 h ASP 351 Cb -0.02 0.29 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 1n24 h ASP 351 CO -0.07 -0.25 0.20 0.44 -2.88 0.00 0.00 179.24 176.68 1n24 h ASP 352 N -0.26 0.21 -0.40 2.28 3.32 -1.11 0.29 116.42 120.75 1n24 h ASP 352 Ca 0.10 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.05 1n24 h ASP 352 Cb 0.41 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1n24 h ASP 352 CO -0.29 0.14 -0.13 0.40 -1.72 0.00 0.00 179.24 177.65 1n24 h ILE 353 N 0.24 1.26 0.11 0.35 2.04 -0.49 -1.44 117.51 119.58 1n24 h ILE 353 Ca 0.13 -1.24 -0.19 0.00 1.00 0.00 0.00 64.86 64.56 1n24 h ILE 353 Cb 0.21 1.04 0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1n24 h ILE 353 CO -0.02 0.43 -0.81 1.88 0.00 0.00 0.00 178.15 179.62 1n24 h TYR 354 N 0.77 0.60 -0.70 1.37 -1.99 -0.17 0.64 116.97 117.49 1n24 h TYR 354 Ca 0.12 -0.41 0.00 0.00 2.00 0.00 0.00 58.73 60.45 1n24 h TYR 354 Cb 0.65 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.34 1n24 h TYR 354 CO 0.04 1.29 0.00 -0.40 -0.00 0.00 0.00 178.16 179.09 1n24 n ASP 355 N -4.12 4.37 0.09 3.88 5.68 0.81 -4.68 116.55 122.59 1n24 n ASP 355 Ca -0.13 -2.21 0.00 0.00 -0.50 0.00 0.00 54.79 51.95 1n24 n ASP 355 Cb 0.81 -0.54 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 1n24 n ASP 355 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 1n24 n VAL 356 N 1.43 0.14 -0.04 2.12 0.31 -0.58 -4.80 118.33 116.90 1n24 n VAL 356 Ca 0.25 0.05 -0.15 0.00 -0.01 0.00 0.00 64.34 64.48 1n24 n VAL 356 Cb 0.76 -0.51 -0.14 0.00 -0.91 0.00 0.00 33.84 33.04 1n24 n VAL 356 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n24 n TYR 357 N -3.16 0.83 -2.49 3.52 9.36 -0.96 -5.00 117.16 119.26 1n24 n TYR 357 Ca 0.00 0.23 -0.33 0.00 3.32 0.00 0.00 57.90 61.12 1n24 n TYR 357 Cb 0.00 -1.13 -0.03 0.00 -0.63 0.00 0.00 39.34 37.55 1n24 n TYR 357 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 1n24 s GLY 358 N -5.52 2.38 0.25 2.98 0.00 0.22 -5.06 107.32 102.57 1n24 s GLY 358 Ca -0.16 0.49 -0.07 0.00 0.00 0.00 0.00 44.72 44.99 1n24 s GLY 358 CO 0.78 0.80 0.53 -0.51 0.00 0.00 0.00 173.10 174.70 1n24 s THR 359 N -2.16 5.00 0.29 0.90 -4.23 -1.26 -4.90 115.64 109.28 1n24 s THR 359 Ca 0.65 0.21 0.04 0.00 -1.18 0.00 0.00 61.69 61.41 1n24 s THR 359 Cb -0.14 -3.68 0.28 0.00 1.34 0.00 0.00 72.50 70.30 1n24 s THR 359 CO 0.23 -0.19 1.74 0.25 -0.54 0.00 0.00 174.62 176.11 1n24 h LEU 360 N 2.12 0.57 -0.26 4.79 5.85 -1.96 0.94 115.31 127.35 1n24 h LEU 360 Ca -0.47 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 1n24 h LEU 360 Cb 1.18 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1n24 h LEU 360 CO 0.68 0.15 0.15 0.44 -0.34 0.00 0.00 178.44 179.52 1n24 h ASP 361 N 0.59 0.31 -0.58 1.25 3.32 -2.00 -0.57 116.42 118.75 1n24 h ASP 361 Ca 0.55 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 57.46 1n24 h ASP 361 Cb 0.93 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.38 1n24 h ASP 361 CO -0.43 0.28 0.05 -0.33 -1.72 0.00 0.00 179.24 177.09 1n24 h GLU 362 N 0.32 0.99 0.00 3.56 5.08 -1.56 -2.45 114.58 120.52 1n24 h GLU 362 Ca 0.09 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1n24 h GLU 362 Cb 0.03 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 1n24 h GLU 362 CO -0.02 0.96 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.75 1n24 h LEU 363 N 0.88 0.00 -0.10 1.33 3.38 -0.62 0.10 115.31 120.28 1n24 h LEU 363 Ca 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1n24 h LEU 363 Cb 0.48 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1n24 h LEU 363 CO 0.02 0.13 -0.05 -0.08 0.09 0.00 0.00 178.44 178.55 1n24 h GLU 364 N 0.00 0.22 -0.63 1.13 4.81 -0.64 -0.79 114.58 118.67 1n24 h GLU 364 Ca -0.00 -0.10 -0.07 0.00 -0.13 0.00 0.00 59.36 59.06 1n24 h GLU 364 Cb 0.27 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1n24 h GLU 364 CO 0.02 0.57 0.12 -0.07 -0.73 0.00 0.00 179.01 178.91 1n24 h LEU 365 N -0.15 0.99 0.01 1.64 3.38 -1.10 -1.83 115.31 118.25 1n24 h LEU 365 Ca 0.02 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.75 1n24 h LEU 365 Cb 0.51 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1n24 h LEU 365 CO 0.02 0.99 -0.08 0.15 0.09 0.00 0.00 178.44 179.60 1n24 h PHE 366 N 0.95 -0.21 -0.38 1.13 3.57 -0.76 0.27 116.94 121.51 1n24 h PHE 366 Ca 0.19 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.74 1n24 h PHE 366 Cb 0.41 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.21 1n24 h PHE 366 CO 0.03 -0.13 0.15 1.15 -2.23 0.00 0.00 178.31 177.28 1n24 h THR 367 N -0.15 0.91 -0.92 4.41 2.02 -1.00 -2.25 112.91 115.92 1n24 h THR 367 Ca 0.03 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1n24 h THR 367 Cb 0.19 0.57 -0.05 0.00 -1.74 0.00 0.00 68.15 67.12 1n24 h THR 367 CO -0.08 0.06 0.59 -0.78 0.37 0.00 0.00 175.52 175.68 1n24 h ASP 368 N 0.31 1.08 -0.56 4.18 1.82 -0.99 -1.84 116.42 120.42 1n24 h ASP 368 Ca 0.17 -0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.73 1n24 h ASP 368 Cb 0.13 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 39.85 1n24 h ASP 368 CO -0.16 0.80 0.22 0.74 -1.61 0.00 0.00 179.24 179.23 1n24 h THR 369 N 1.26 1.22 -0.69 2.25 2.02 -0.39 -0.40 112.91 118.17 1n24 h THR 369 Ca 0.33 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.78 1n24 h THR 369 Cb -0.11 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1n24 h THR 369 CO -0.07 0.27 0.32 -0.26 0.37 0.00 0.00 175.52 176.15 1n24 h PHE 370 N 0.76 1.01 -0.78 3.16 -1.00 -1.03 0.27 116.94 119.33 1n24 h PHE 370 Ca 0.18 -0.06 -0.05 0.00 2.81 0.00 0.00 57.97 60.86 1n24 h PHE 370 Cb 0.21 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.42 1n24 h PHE 370 CO 0.01 0.76 0.31 0.87 -1.61 0.00 0.00 178.31 178.65 1n24 h LYS 371 N 0.97 1.17 -0.09 1.51 1.57 -0.93 -2.71 116.57 118.07 1n24 h LYS 371 Ca 0.24 -0.21 -0.17 0.00 -1.87 0.00 0.00 60.65 58.63 1n24 h LYS 371 Cb 0.14 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1n24 h LYS 371 CO -0.03 0.95 -0.69 0.00 -0.57 0.00 0.00 179.45 179.12 1n24 h ARG 372 N 1.14 0.38 -6.30 3.15 3.08 -0.80 -3.47 114.38 111.56 1n24 h ARG 372 Ca 0.26 -0.29 -0.48 0.00 0.07 0.00 0.00 59.98 59.54 1n24 h ARG 372 Cb 0.22 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 1n24 h ARG 372 CO -0.02 0.92 -0.76 1.87 -1.07 0.00 0.00 179.97 180.91 1n24 n TRP 373 N -3.85 -2.30 -2.64 3.04 -0.00 0.91 -4.96 117.44 107.64 1n24 n TRP 373 Ca -0.04 0.91 0.00 0.00 -0.00 0.00 0.00 57.50 58.37 1n24 n TRP 373 Cb 0.68 -3.98 0.00 0.00 -0.00 0.00 0.00 31.31 28.01 1n24 n TRP 373 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 1n24 n ASP 374 N -2.84 0.05 0.00 5.87 5.75 -1.26 -5.05 116.55 119.08 1n24 n ASP 374 Ca 0.04 -0.61 0.00 0.00 -0.01 0.00 0.00 54.79 54.20 1n24 n ASP 374 Cb 0.53 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.62 1n24 n ASP 374 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1n24 n THR 375 N -0.60 0.51 -0.04 2.12 -2.24 -1.26 -4.82 114.28 107.95 1n24 n THR 375 Ca 0.00 -0.60 -0.06 0.00 -2.27 0.00 0.00 64.05 61.12 1n24 n THR 375 Cb 0.00 0.82 -0.04 0.00 -2.10 0.00 0.00 70.33 69.02 1n24 n THR 375 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1n24 n GLU 376 N -0.26 0.20 0.33 -0.78 1.02 -1.26 -4.60 120.64 115.30 1n24 n GLU 376 Ca 0.00 0.05 0.22 0.00 -0.02 0.00 0.00 57.16 57.41 1n24 n GLU 376 Cb 0.26 -1.15 1.17 0.00 -0.02 0.00 0.00 31.44 31.70 1n24 n GLU 376 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1n24 h SER 377 N -0.01 0.00 -0.46 1.62 4.64 -1.98 -2.68 113.55 114.68 1n24 h SER 377 Ca -0.18 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.27 1n24 h SER 377 Cb 1.28 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.35 1n24 h SER 377 CO -0.03 0.00 0.33 -0.29 -0.87 0.00 0.00 176.83 175.97 1n24 h ILE 378 N 0.00 0.77 0.00 0.95 2.10 -1.89 -1.06 117.51 118.39 1n24 h ILE 378 Ca -0.00 -0.00 -0.02 0.00 1.08 0.00 0.00 64.86 65.92 1n24 h ILE 378 Cb 0.05 0.77 -0.00 0.00 -1.09 0.00 0.00 36.82 36.55 1n24 h ILE 378 CO 0.00 0.00 -0.08 0.74 -1.08 0.00 0.00 178.15 177.73 1n24 h THR 379 N 0.00 0.27 0.00 2.19 2.02 -1.80 -2.33 112.91 113.27 1n24 h THR 379 Ca 0.22 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.85 1n24 h THR 379 Cb 0.87 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1n24 h THR 379 CO -0.00 0.08 0.00 0.54 0.37 0.00 0.00 175.52 176.50 1n24 n ARG 380 N -3.31 0.08 -3.19 6.66 1.74 -0.40 -4.86 116.66 113.38 1n24 n ARG 380 Ca -0.01 0.11 -0.27 0.00 -0.77 0.00 0.00 57.85 56.91 1n24 n ARG 380 Cb 0.27 -1.60 -0.02 0.00 -1.02 0.00 0.00 32.46 30.09 1n24 n ARG 380 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1n24 s LEU 381 N -3.48 3.94 0.62 0.55 1.43 -0.88 -5.06 118.68 115.81 1n24 s LEU 381 Ca 0.12 0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 53.74 1n24 s LEU 381 Cb 0.16 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.81 1n24 s LEU 381 CO 0.51 -0.32 1.11 -2.16 0.23 0.00 0.00 176.35 175.73 1n24 s PRO 382 N -4.08 2.99 0.22 1.29 0.04 -1.26 -4.74 135.00 129.45 1n24 s PRO 382 Ca 0.44 1.45 -0.16 0.00 0.04 0.00 0.00 61.00 62.77 1n24 s PRO 382 Cb -0.10 -1.97 0.24 0.00 0.04 0.00 0.00 34.50 32.71 1n24 s PRO 382 CO 0.35 -1.11 1.58 -0.92 0.04 0.00 0.00 177.00 176.94 1n24 h TYR 383 N 0.40 -0.79 -0.36 0.56 3.20 -1.96 0.01 116.97 118.03 1n24 h TYR 383 Ca -0.48 0.08 0.07 0.00 3.14 0.00 0.00 58.73 61.55 1n24 h TYR 383 Cb 1.25 0.46 -0.02 0.00 1.54 0.00 0.00 36.73 39.97 1n24 h TYR 383 CO 0.54 -0.38 0.25 0.10 -1.64 0.00 0.00 178.16 177.03 1n24 h TYR 384 N -0.06 0.17 0.04 -3.82 -0.00 -1.91 -0.31 116.97 111.08 1n24 h TYR 384 Ca 0.32 0.00 -0.22 0.00 0.00 0.00 0.00 58.73 58.83 1n24 h TYR 384 Cb 0.58 -0.06 -0.02 0.00 0.00 0.00 0.00 36.73 37.24 1n24 h TYR 384 CO -0.70 0.09 -1.04 0.52 -0.00 0.00 0.00 178.16 177.03 1n24 h MET 385 N 0.17 0.11 -0.52 0.10 2.86 -1.38 -2.33 114.93 113.95 1n24 h MET 385 Ca 0.17 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1n24 h MET 385 Cb 0.44 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1n24 h MET 385 CO -0.03 1.04 0.24 1.96 1.06 0.00 0.00 176.91 181.19 1n24 h GLN 386 N 0.04 0.76 0.18 1.72 4.20 -0.25 0.40 115.11 122.16 1n24 h GLN 386 Ca -0.05 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 1n24 h GLN 386 Cb 1.76 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.41 1n24 h GLN 386 CO 0.15 0.64 -0.09 1.25 -0.67 0.00 0.00 178.83 180.11 1n24 h LEU 387 N 0.70 -0.21 -0.47 1.46 5.85 -1.23 -0.92 115.31 120.48 1n24 h LEU 387 Ca 0.18 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1n24 h LEU 387 Cb 0.14 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1n24 h LEU 387 CO -0.02 -0.06 0.28 0.00 -0.34 0.00 0.00 178.44 178.30 1n24 h TYR 389 N 0.63 0.16 -0.35 0.00 3.20 -0.86 -1.78 116.97 117.97 1n24 h TYR 389 Ca 0.17 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 1n24 h TYR 389 Cb -0.00 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.21 1n24 h TYR 389 CO -0.03 0.25 -0.07 2.35 -1.64 0.00 0.00 178.16 179.03 1n24 h TRP 390 N 0.01 0.61 -0.47 -3.82 -0.00 -1.09 0.63 115.95 111.82 1n24 h TRP 390 Ca 0.03 -0.08 -0.10 0.00 -0.00 0.00 0.00 58.89 58.74 1n24 h TRP 390 Cb 0.16 -0.17 -0.01 0.00 -0.00 0.00 0.00 29.16 29.14 1n24 h TRP 390 CO -0.02 0.63 -0.12 0.78 -0.00 0.00 0.00 178.44 179.72 1n24 h GLY 391 N 0.92 0.98 0.98 2.65 0.00 -1.13 -0.67 103.07 106.80 1n24 h GLY 391 Ca 0.10 -0.81 -0.11 0.00 0.00 0.00 0.00 47.33 46.52 1n24 h GLY 391 CO 0.02 0.74 -0.19 -2.08 0.00 0.00 0.00 176.54 175.03 1n24 h VAL 392 N 0.75 1.29 -0.75 4.60 2.07 -1.07 -2.33 116.25 120.81 1n24 h VAL 392 Ca 0.12 -1.32 0.05 0.00 0.82 0.00 0.00 66.70 66.37 1n24 h VAL 392 Cb 0.67 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 1n24 h VAL 392 CO 0.05 0.43 0.45 -0.74 0.02 0.00 0.00 177.57 177.78 1n24 h HIS 393 N 0.53 0.83 -0.30 1.57 -0.00 -0.74 -1.63 115.15 115.42 1n24 h HIS 393 Ca 0.08 0.03 -0.13 0.00 -0.00 0.00 0.00 60.37 60.34 1n24 h HIS 393 Cb 0.74 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.88 1n24 h HIS 393 CO 0.06 0.43 -0.36 -0.91 -0.00 0.00 0.00 177.93 177.14 1n24 h ASN 394 N 0.84 0.72 -0.23 3.26 2.35 -1.00 -1.79 115.58 119.72 1n24 h ASN 394 Ca 0.33 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 1n24 h ASN 394 Cb 0.14 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1n24 h ASN 394 CO -0.16 1.01 -0.02 0.22 -1.65 0.00 0.00 177.43 176.83 1n24 h TYR 395 N 0.57 0.47 -0.89 1.19 3.20 -0.97 0.00 116.97 120.54 1n24 h TYR 395 Ca 0.05 -0.09 0.06 0.00 3.14 0.00 0.00 58.73 61.90 1n24 h TYR 395 Cb 0.89 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.97 1n24 h TYR 395 CO 0.04 0.62 0.56 0.82 -1.64 0.00 0.00 178.16 178.57 1n24 h ILE 396 N 0.18 1.05 -0.60 1.81 1.08 -1.28 0.72 117.51 120.48 1n24 h ILE 396 Ca 0.06 -0.35 -0.05 0.00 -0.39 0.00 0.00 64.86 64.13 1n24 h ILE 396 Cb 0.45 -0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 34.12 1n24 h ILE 396 CO 0.02 0.19 0.17 0.28 -0.69 0.00 0.00 178.15 178.11 1n24 h SER 397 N 1.02 0.89 -0.58 1.72 0.02 -1.07 -1.38 113.55 114.17 1n24 h SER 397 Ca 0.39 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 1n24 h SER 397 Cb 0.17 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 1n24 h SER 397 CO -0.17 0.87 0.31 0.44 -1.14 0.00 0.00 176.83 177.14 1n24 h ASP 398 N 0.86 0.73 -0.75 3.07 3.32 0.22 -0.95 116.42 122.91 1n24 h ASP 398 Ca 0.19 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 1n24 h ASP 398 Cb 0.31 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1n24 h ASP 398 CO -0.00 0.61 0.36 0.00 -1.72 0.00 0.00 179.24 178.49 1n24 h ALA 399 N 1.14 0.97 -0.62 3.45 0.00 -0.68 -0.64 119.26 122.87 1n24 h ALA 399 Ca 0.20 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1n24 h ALA 399 Cb 0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1n24 h ALA 399 CO -0.03 0.53 0.27 0.00 0.00 0.00 0.00 179.25 180.02 1n24 h ALA 400 N 1.18 1.31 -0.04 0.00 0.00 -0.82 -1.30 119.26 119.59 1n24 h ALA 400 Ca 0.26 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1n24 h ALA 400 Cb 0.12 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1n24 h ALA 400 CO -0.03 0.52 0.01 -0.92 0.00 0.00 0.00 179.25 178.84 1n24 h TYR 401 N 0.88 0.06 -0.73 0.00 3.20 -0.16 -0.49 116.97 119.74 1n24 h TYR 401 Ca 0.21 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.15 1n24 h TYR 401 Cb 0.14 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.33 1n24 h TYR 401 CO 0.01 0.22 0.41 -0.44 -1.64 0.00 0.00 178.16 176.73 1n24 h ASP 402 N -0.12 0.61 -0.50 -2.11 3.32 -0.74 0.13 116.42 117.02 1n24 h ASP 402 Ca 0.01 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 1n24 h ASP 402 Cb 0.19 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1n24 h ASP 402 CO -0.00 0.38 -0.10 0.40 -1.72 0.00 0.00 179.24 178.21 1n24 h ILE 403 N 0.75 1.27 -0.46 0.35 2.04 -1.13 -0.83 117.51 119.50 1n24 h ILE 403 Ca 0.33 -1.23 -0.03 0.00 1.00 0.00 0.00 64.86 64.94 1n24 h ILE 403 Cb 0.23 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1n24 h ILE 403 CO -0.20 0.43 0.17 0.25 0.00 0.00 0.00 178.15 178.80 1n24 h LEU 404 N 0.80 0.65 -0.28 1.44 5.85 -0.43 0.19 115.31 123.53 1n24 h LEU 404 Ca 0.13 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 1n24 h LEU 404 Cb 0.65 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1n24 h LEU 404 CO 0.04 0.66 0.04 0.50 -0.34 0.00 0.00 178.44 179.34 1n24 h LYS 405 N 0.61 0.47 0.13 1.25 3.11 -0.64 -0.19 116.57 121.30 1n24 h LYS 405 Ca 0.15 -0.13 -0.26 0.00 -2.81 0.00 0.00 60.65 57.61 1n24 h LYS 405 Cb 0.22 -0.05 0.03 0.00 -1.00 0.00 0.00 32.23 31.42 1n24 h LYS 405 CO -0.01 0.59 -1.09 0.93 -2.81 0.00 0.00 179.45 177.06 1n24 h GLU 406 N 0.27 0.51 -0.15 1.90 4.39 -1.07 -3.38 114.58 117.05 1n24 h GLU 406 Ca 0.08 -0.72 0.00 0.00 0.34 0.00 0.00 59.36 59.06 1n24 h GLU 406 Cb 0.35 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1n24 h GLU 406 CO 0.01 1.32 0.00 0.72 -1.16 0.00 0.00 179.01 179.90 1n24 n HIS 407 N -3.92 0.19 -1.73 4.33 8.25 0.65 -5.00 115.22 117.99 1n24 n HIS 407 Ca -0.14 -0.38 -0.20 0.00 -0.26 0.00 0.00 57.72 56.74 1n24 n HIS 407 Cb 0.92 -0.03 -0.07 0.00 1.12 0.00 0.00 29.99 31.93 1n24 n HIS 407 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n24 n GLY 408 N 0.13 1.45 3.21 -1.41 0.00 -0.08 -4.96 105.19 103.52 1n24 n GLY 408 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1n24 n GLY 408 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1n24 s PHE 409 N -2.74 2.02 -0.41 1.61 5.36 -1.25 -4.98 117.98 117.58 1n24 s PHE 409 Ca 0.00 -0.53 -0.15 0.00 -0.96 0.00 0.00 56.93 55.29 1n24 s PHE 409 Cb 0.00 -1.33 0.03 0.00 -0.34 0.00 0.00 43.02 41.38 1n24 s PHE 409 CO 0.00 -0.15 0.30 0.12 -1.46 0.00 0.00 175.22 174.04 1n24 s PHE 410 N -0.18 3.24 -0.64 10.12 5.36 -1.26 -2.92 117.98 131.70 1n24 s PHE 410 Ca -0.00 -0.65 0.14 0.00 -0.96 0.00 0.00 56.93 55.46 1n24 s PHE 410 Cb -0.11 -2.63 0.45 0.00 -0.34 0.00 0.00 43.02 40.39 1n24 s PHE 410 CO 0.02 -0.61 1.37 0.00 -1.46 0.00 0.00 175.22 174.53 1n24 h LEU 412 N 2.17 0.12 -1.58 0.00 5.85 -1.92 -0.46 115.31 119.49 1n24 h LEU 412 Ca 0.00 0.17 0.10 0.00 0.84 0.00 0.00 57.88 58.99 1n24 h LEU 412 Cb 1.11 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.31 1n24 h LEU 412 CO 0.12 -0.08 0.43 0.06 -0.34 0.00 0.00 178.44 178.63 1n24 h GLN 413 N 0.29 0.45 0.15 1.25 3.07 -2.00 0.11 115.11 118.43 1n24 h GLN 413 Ca 0.53 -0.03 -0.30 0.00 0.09 0.00 0.00 58.65 58.94 1n24 h GLN 413 Cb 1.02 -0.10 0.01 0.00 0.08 0.00 0.00 27.48 28.49 1n24 h GLN 413 CO -0.58 0.30 -1.43 1.88 0.09 0.00 0.00 178.83 179.08 1n24 h TYR 414 N 0.46 0.59 -0.55 0.06 -1.99 -1.48 -2.90 116.97 111.16 1n24 h TYR 414 Ca 0.30 -0.43 -0.04 0.00 2.00 0.00 0.00 58.73 60.56 1n24 h TYR 414 Cb 0.55 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 39.23 1n24 h TYR 414 CO -0.00 1.40 0.19 -0.07 -0.00 0.00 0.00 178.16 179.68 1n24 h LEU 415 N 0.09 0.74 -0.72 3.88 3.38 -0.86 -1.31 115.31 120.51 1n24 h LEU 415 Ca -0.21 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 1n24 h LEU 415 Cb 2.04 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.57 1n24 h LEU 415 CO 0.20 0.69 0.14 0.03 0.09 0.00 0.00 178.44 179.60 1n24 h ARG 416 N 0.80 1.12 -0.78 1.13 3.08 -1.05 -2.67 114.38 116.01 1n24 h ARG 416 Ca 0.19 -0.28 -0.05 0.00 0.07 0.00 0.00 59.98 59.90 1n24 h ARG 416 Cb 0.21 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 1n24 h ARG 416 CO -0.01 1.00 0.28 -0.22 -1.07 0.00 0.00 179.97 179.95 1n24 h LYS 417 N 1.06 1.19 -0.45 0.04 3.64 -1.14 0.14 116.57 121.04 1n24 h LYS 417 Ca 0.21 -0.23 0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1n24 h LYS 417 Cb 0.40 -0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 31.99 1n24 h LYS 417 CO 0.01 0.98 0.15 0.77 -2.27 0.00 0.00 179.45 179.09 1n24 h SER 418 N 1.15 0.15 -0.11 4.20 0.02 -0.94 0.02 113.55 118.03 1n24 h SER 418 Ca 0.26 0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 61.19 1n24 h SER 418 Cb 0.26 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1n24 h SER 418 CO -0.02 0.11 -0.20 0.58 -1.14 0.00 0.00 176.83 176.16 1n24 h VAL 419 N 0.32 1.39 -0.39 2.27 2.07 -1.20 -3.02 116.25 117.68 1n24 h VAL 419 Ca 0.21 -1.48 0.03 0.00 0.82 0.00 0.00 66.70 66.29 1n24 h VAL 419 Cb 0.22 2.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 1n24 h VAL 419 CO -0.23 0.43 0.19 0.58 0.02 0.00 0.00 177.57 178.56 1n24 h VAL 420 N -0.11 0.97 -0.53 2.57 2.07 -0.47 -1.16 116.25 119.60 1n24 h VAL 420 Ca 0.00 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1n24 h VAL 420 Cb 0.79 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1n24 h VAL 420 CO 0.05 0.07 0.35 0.44 0.02 0.00 0.00 177.57 178.50 1n24 h ASP 421 N 0.39 0.52 0.08 0.57 3.32 -1.08 -0.19 116.42 120.04 1n24 h ASP 421 Ca 0.17 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1n24 h ASP 421 Cb 0.08 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1n24 h ASP 421 CO -0.12 0.36 -0.04 0.25 -1.72 0.00 0.00 179.24 177.97 1n24 h LEU 422 N 0.61 -0.09 -1.24 1.55 5.85 -1.14 -2.59 115.31 118.26 1n24 h LEU 422 Ca 0.21 -0.35 -0.08 0.00 0.84 0.00 0.00 57.88 58.51 1n24 h LEU 422 Cb 0.09 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1n24 h LEU 422 CO -0.05 0.32 -0.36 -0.37 -0.34 0.00 0.00 178.44 177.63 1n24 h VAL 423 N -0.51 1.13 -0.26 1.05 -1.51 -0.89 -1.88 116.25 113.37 1n24 h VAL 423 Ca -0.01 -1.29 -0.10 0.00 -1.23 0.00 0.00 66.70 64.07 1n24 h VAL 423 Cb 0.43 1.72 -0.01 0.00 -2.13 0.00 0.00 31.29 31.30 1n24 h VAL 423 CO 0.02 0.35 -0.26 -0.33 -1.23 0.00 0.00 177.57 176.12 1n24 h GLU 424 N 0.00 0.51 -0.37 5.19 5.08 -1.03 0.12 114.58 124.08 1n24 h GLU 424 Ca -0.00 -0.20 -0.15 0.00 -1.00 0.00 0.00 59.36 58.01 1n24 h GLU 424 Cb 0.69 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1n24 h GLU 424 CO 0.05 0.73 -0.35 0.00 -1.00 0.00 0.00 179.01 178.43 1n24 h ALA 425 N 1.27 0.68 -0.43 3.43 0.00 -1.02 -1.15 119.26 122.04 1n24 h ALA 425 Ca 0.06 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1n24 h ALA 425 Cb 0.69 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1n24 h ALA 425 CO 0.05 0.67 0.20 1.88 0.00 0.00 0.00 179.25 182.05 1n24 h TYR 426 N 0.70 0.64 -0.68 0.00 0.99 -0.91 -1.18 116.97 116.53 1n24 h TYR 426 Ca 0.07 -0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 1n24 h TYR 426 Cb 0.92 -0.20 -0.03 0.00 1.00 0.00 0.00 36.73 38.42 1n24 h TYR 426 CO 0.05 0.53 0.35 0.35 -0.00 0.00 0.00 178.16 179.44 1n24 h PHE 427 N 0.56 0.97 -0.24 4.88 3.57 -0.59 -0.29 116.94 125.79 1n24 h PHE 427 Ca 0.15 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.65 1n24 h PHE 427 Cb 0.14 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.54 1n24 h PHE 427 CO -0.01 0.71 -0.02 1.25 -2.23 0.00 0.00 178.31 178.02 1n24 h HIS 428 N 0.95 -0.04 -0.77 0.41 2.76 -0.85 0.03 115.15 117.63 1n24 h HIS 428 Ca 0.24 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.39 1n24 h HIS 428 Cb 0.09 0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.07 1n24 h HIS 428 CO 0.00 -0.06 0.33 0.93 -1.30 0.00 0.00 177.93 177.83 1n24 h GLU 429 N 0.05 1.12 -0.69 5.26 5.08 -0.80 -1.63 114.58 122.97 1n24 h GLU 429 Ca 0.12 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1n24 h GLU 429 Cb 0.16 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1n24 h GLU 429 CO -0.21 0.89 0.37 0.00 -1.00 0.00 0.00 179.01 179.06 1n24 h ALA 430 N 1.26 0.89 -0.67 3.43 0.00 -0.27 0.24 119.26 124.14 1n24 h ALA 430 Ca 0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1n24 h ALA 430 Cb 0.17 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1n24 h ALA 430 CO -0.03 0.42 0.34 0.87 0.00 0.00 0.00 179.25 180.85 1n24 h LYS 431 N 0.96 0.95 -0.27 0.00 1.57 -0.59 0.76 116.57 119.94 1n24 h LYS 431 Ca 0.24 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1n24 h LYS 431 Cb 0.06 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1n24 h LYS 431 CO -0.04 0.74 0.16 -1.49 -0.57 0.00 0.00 179.45 178.25 1n24 h TRP 432 N 0.92 0.37 0.26 -1.35 6.55 -0.67 -2.01 115.95 120.01 1n24 h TRP 432 Ca 0.23 -0.00 -0.01 0.00 0.95 0.00 0.00 58.89 60.06 1n24 h TRP 432 Cb 0.08 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 28.27 1n24 h TRP 432 CO -0.00 0.28 -0.13 -0.92 -1.05 0.00 0.00 178.44 176.63 1n24 h TYR 433 N 0.34 -0.33 0.00 0.49 3.20 -0.09 -1.68 116.97 118.90 1n24 h TYR 433 Ca 0.10 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1n24 h TYR 433 Cb 0.03 0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.41 1n24 h TYR 433 CO -0.04 -0.19 0.00 0.45 -1.64 0.00 0.00 178.16 176.74 1n24 h HIS 434 N -0.37 0.00 0.00 -3.82 3.86 -0.81 -2.54 115.15 111.47 1n24 h HIS 434 Ca -0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 1n24 h HIS 434 Cb 0.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.75 1n24 h HIS 434 CO -0.06 0.00 -1.29 -1.13 0.86 0.00 0.00 177.93 176.32 1n24 n SER 435 N -2.95 0.55 0.00 2.45 3.41 -0.76 -4.96 113.62 111.35 1n24 n SER 435 Ca -0.00 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1n24 n SER 435 Cb 0.23 0.97 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1n24 n SER 435 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n24 n GLY 436 N 1.25 0.67 3.75 5.00 0.00 -0.69 -5.04 105.19 110.13 1n24 n GLY 436 Ca -0.01 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1n24 n GLY 436 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1n24 s TYR 437 N -2.00 3.49 -0.30 1.61 5.04 -0.83 -5.03 117.35 119.33 1n24 s TYR 437 Ca 0.00 1.61 0.01 0.00 -2.44 0.00 0.00 57.07 56.25 1n24 s TYR 437 Cb 0.00 -3.35 0.07 0.00 0.35 0.00 0.00 41.96 39.03 1n24 s TYR 437 CO 0.00 -0.82 -0.01 0.99 -1.34 0.00 0.00 175.55 174.37 1n24 s THR 438 N -0.90 2.54 0.96 4.34 2.01 -1.26 -4.67 115.64 118.66 1n24 s THR 438 Ca 0.47 -1.76 -0.12 0.00 0.31 0.00 0.00 61.69 60.59 1n24 s THR 438 Cb -0.33 -2.59 0.17 0.00 0.01 0.00 0.00 72.50 69.76 1n24 s THR 438 CO 0.41 -0.24 1.09 -2.84 -0.69 0.00 0.00 174.62 172.35 1n24 s PRO 439 N 1.10 0.72 0.94 4.92 0.02 -1.26 -5.03 135.00 136.42 1n24 s PRO 439 Ca -0.02 0.84 -0.15 0.00 0.02 0.00 0.00 61.00 61.69 1n24 s PRO 439 Cb -0.20 -1.75 0.17 0.00 0.02 0.00 0.00 34.50 32.74 1n24 s PRO 439 CO -0.04 -2.62 1.24 -1.54 -0.33 0.00 0.00 177.00 173.71 1n24 s SER 440 N -3.20 3.31 0.10 2.53 1.04 -1.26 -4.75 113.70 111.45 1n24 s SER 440 Ca 0.65 0.53 -0.19 0.00 0.48 0.00 0.00 55.95 57.42 1n24 s SER 440 Cb -0.20 -0.77 -0.07 0.00 0.10 0.00 0.00 66.02 65.08 1n24 s SER 440 CO 0.58 -2.64 1.59 0.25 0.98 0.00 0.00 173.24 174.01 1n24 h LEU 441 N -1.57 0.38 -0.55 2.42 5.85 -1.94 -1.62 115.31 118.29 1n24 h LEU 441 Ca -0.46 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 57.99 1n24 h LEU 441 Cb 1.28 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1n24 h LEU 441 CO 0.48 0.50 0.13 0.44 -0.34 0.00 0.00 178.44 179.65 1n24 h ASP 442 N 0.24 0.84 -0.57 1.25 5.19 -1.97 -0.33 116.42 121.07 1n24 h ASP 442 Ca 0.08 -0.24 -0.03 0.00 -0.62 0.00 0.00 57.03 56.23 1n24 h ASP 442 Cb 0.27 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.53 1n24 h ASP 442 CO -0.00 0.86 0.26 -0.08 -3.12 0.00 0.00 179.24 177.16 1n24 h GLU 443 N 0.78 0.86 -0.09 3.56 4.81 -1.92 -1.12 114.58 121.46 1n24 h GLU 443 Ca 0.17 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1n24 h GLU 443 Cb 0.35 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1n24 h GLU 443 CO 0.00 0.69 -0.03 -0.92 -0.73 0.00 0.00 179.01 178.03 1n24 h TYR 444 N 0.86 0.21 -0.05 0.92 3.20 -0.88 -3.22 116.97 117.99 1n24 h TYR 444 Ca 0.21 -0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1n24 h TYR 444 Cb 0.14 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1n24 h TYR 444 CO 0.01 0.51 -0.22 -0.07 -1.64 0.00 0.00 178.16 176.75 1n24 h LEU 445 N -0.15 0.09 -1.62 2.82 3.38 -0.78 0.41 115.31 119.46 1n24 h LEU 445 Ca 0.02 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1n24 h LEU 445 Cb 0.45 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1n24 h LEU 445 CO 0.01 0.31 -0.02 -1.13 0.09 0.00 0.00 178.44 177.70 1n24 h ASN 446 N 0.08 0.19 0.03 -0.43 -1.24 -1.22 -1.92 115.58 111.08 1n24 h ASN 446 Ca 0.01 -0.02 -0.37 0.00 0.71 0.00 0.00 56.30 56.63 1n24 h ASN 446 Cb 0.44 -0.05 -0.05 0.00 0.73 0.00 0.00 38.32 39.39 1n24 h ASN 446 CO 0.03 0.25 -2.12 -0.38 -1.29 0.00 0.00 177.43 173.92 1n24 n ILE 447 N -4.39 1.58 0.32 2.57 2.08 -0.82 -4.39 119.36 116.31 1n24 n ILE 447 Ca -0.01 -0.43 0.20 0.00 0.56 0.00 0.00 62.75 63.07 1n24 n ILE 447 Cb 0.18 -1.75 1.08 0.00 -0.75 0.00 0.00 39.64 38.39 1n24 n ILE 447 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1n24 h ALA 448 N -0.34 1.24 0.00 -1.39 0.00 -0.18 0.40 119.26 119.00 1n24 h ALA 448 Ca -0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1n24 h ALA 448 Cb 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1n24 h ALA 448 CO -0.16 -0.05 0.00 1.57 0.00 0.00 0.00 179.25 180.62 1n24 h LYS 449 N 0.00 0.00 0.04 0.00 2.10 -1.55 -2.03 116.57 115.14 1n24 h LYS 449 Ca 0.01 0.00 -0.38 0.00 -2.00 0.00 0.00 60.65 58.28 1n24 h LYS 449 Cb 0.09 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.37 1n24 h LYS 449 CO -0.00 0.00 -2.27 -0.89 -2.00 0.00 0.00 179.45 174.29 1n24 n ILE 450 N -2.47 1.60 0.27 0.07 2.08 0.03 -4.29 119.36 116.64 1n24 n ILE 450 Ca 0.04 -0.57 0.15 0.00 0.56 0.00 0.00 62.75 62.94 1n24 n ILE 450 Cb 0.40 -1.58 0.70 0.00 -0.75 0.00 0.00 39.64 38.41 1n24 n ILE 450 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1n24 h SER 451 N -0.08 0.00 0.52 4.38 4.64 -1.26 -1.68 113.55 120.07 1n24 h SER 451 Ca -0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1n24 h SER 451 Cb 1.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.00 1n24 h SER 451 CO -0.05 0.07 0.00 0.55 -0.87 0.00 0.00 176.83 176.53 1n24 n VAL 452 N -3.25 0.89 -0.92 0.95 3.14 -0.77 -4.89 118.33 113.48 1n24 n VAL 452 Ca -0.00 0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.60 1n24 n VAL 452 Cb 0.30 -0.95 0.00 0.00 -1.06 0.00 0.00 33.84 32.12 1n24 n VAL 452 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1n24 n ALA 453 N -1.48 0.00 -0.11 1.55 0.00 -0.63 -4.95 120.51 114.89 1n24 n ALA 453 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.43 1n24 n ALA 453 Cb 0.18 -0.11 0.02 0.00 0.00 0.00 0.00 19.45 19.54 1n24 n ALA 453 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1n24 h SER 454 N 0.00 -0.19 -0.95 0.00 0.02 -1.79 0.69 113.55 111.34 1n24 h SER 454 Ca 0.00 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1n24 h SER 454 Cb 0.00 0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.66 1n24 h SER 454 CO 0.00 -0.06 0.58 -0.65 -1.14 0.00 0.00 176.83 175.57 1n24 h PRO 455 N 0.09 1.28 -0.13 3.45 0.11 -1.81 0.49 132.00 135.47 1n24 h PRO 455 Ca 0.19 -0.11 -0.08 0.00 0.11 0.00 0.00 66.00 66.11 1n24 h PRO 455 Cb 0.27 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1n24 h PRO 455 CO -0.33 0.89 -0.28 0.00 -0.21 0.00 0.00 178.00 178.07 1n24 h ALA 456 N 1.34 1.28 0.17 -0.75 0.00 -1.61 -0.56 119.26 119.13 1n24 h ALA 456 Ca 0.34 -0.32 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 1n24 h ALA 456 Cb -0.07 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.66 1n24 h ALA 456 CO -0.07 0.49 -1.11 0.82 0.00 0.00 0.00 179.25 179.39 1n24 h ILE 457 N 0.22 1.38 0.07 0.00 2.04 -0.36 -3.38 117.51 117.48 1n24 h ILE 457 Ca 0.03 -2.54 -0.00 0.00 1.00 0.00 0.00 64.86 63.35 1n24 h ILE 457 Cb 0.62 3.01 0.00 0.00 -0.74 0.00 0.00 36.82 39.71 1n24 h ILE 457 CO 0.04 0.75 -0.03 0.40 0.00 0.00 0.00 178.15 179.31 1n24 h ILE 458 N -0.05 1.24 -0.89 -0.67 2.04 -0.85 -3.37 117.51 114.96 1n24 h ILE 458 Ca -0.19 -1.34 0.16 0.00 1.00 0.00 0.00 64.86 64.50 1n24 h ILE 458 Cb 1.85 2.07 -0.10 0.00 -0.74 0.00 0.00 36.82 39.90 1n24 h ILE 458 CO 0.21 0.32 0.48 0.77 0.00 0.00 0.00 178.15 179.93 1n24 h SER 459 N -0.72 0.59 -0.15 1.72 4.64 -1.30 -1.72 113.55 116.60 1n24 h SER 459 Ca -0.01 0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.37 1n24 h SER 459 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 1n24 h SER 459 CO 0.02 0.23 -0.01 -0.65 -0.87 0.00 0.00 176.83 175.54 1n24 h PRO 460 N 0.65 0.40 0.00 4.77 0.11 -1.73 -2.39 132.00 133.82 1n24 h PRO 460 Ca 0.50 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.52 1n24 h PRO 460 Cb 0.73 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.78 1n24 h PRO 460 CO -0.38 0.44 -0.06 1.79 -0.21 0.00 0.00 178.00 179.58 1n24 h THR 461 N 0.39 0.25 -0.72 -1.15 1.35 -1.46 -2.95 112.91 108.62 1n24 h THR 461 Ca 0.09 -0.47 0.15 0.00 -0.55 0.00 0.00 66.41 65.63 1n24 h THR 461 Cb 0.28 1.37 -0.10 0.00 -1.73 0.00 0.00 68.15 67.97 1n24 h THR 461 CO 0.01 0.06 0.19 0.22 -0.25 0.00 0.00 175.52 175.75 1n24 h TYR 462 N 0.00 0.30 0.00 4.73 3.20 -1.42 -0.77 116.97 123.01 1n24 h TYR 462 Ca -0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1n24 h TYR 462 Cb 0.36 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1n24 h TYR 462 CO 0.00 -0.06 0.00 1.19 -1.64 0.00 0.00 178.16 177.65 1n24 n PHE 463 N -5.13 0.00 1.24 -3.82 3.01 -1.11 -3.13 117.46 108.52 1n24 n PHE 463 Ca 0.14 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.73 1n24 n PHE 463 Cb 0.44 -0.26 0.38 0.00 -0.01 0.00 0.00 39.48 40.03 1n24 n PHE 463 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1n24 n THR 464 N -1.26 0.00 -3.39 4.37 -2.24 -0.30 -4.84 114.28 106.62 1n24 n THR 464 Ca 0.12 -0.13 -0.37 0.00 -2.27 0.00 0.00 64.05 61.39 1n24 n THR 464 Cb 0.17 0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.73 1n24 n THR 464 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1n24 s PHE 465 N -2.50 3.47 0.53 4.78 0.40 -1.18 -4.96 117.98 118.51 1n24 s PHE 465 Ca 0.24 0.75 0.22 0.00 -0.60 0.00 0.00 56.93 57.55 1n24 s PHE 465 Cb 0.19 -2.49 1.37 0.00 0.51 0.00 0.00 43.02 42.61 1n24 s PHE 465 CO 0.52 0.15 2.07 0.00 0.70 0.00 0.00 175.22 178.66 1n24 h ALA 466 N 6.83 2.24 -0.32 5.36 0.00 -1.91 -0.27 119.26 131.17 1n24 h ALA 466 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1n24 h ALA 466 Cb 1.17 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1n24 h ALA 466 CO 0.75 -0.36 0.00 0.27 0.00 0.00 0.00 179.25 179.91 1n24 n ASN 467 N -4.39 1.74 -4.76 0.00 6.94 -1.26 -4.92 115.26 108.61 1n24 n ASN 467 Ca 0.04 -1.99 -0.40 0.00 -0.02 0.00 0.00 54.58 52.21 1n24 n ASN 467 Cb 0.37 -0.22 -0.04 0.00 -2.36 0.00 0.00 39.78 37.54 1n24 n ASN 467 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1n24 s ALA 468 N -1.57 3.34 0.16 -2.53 0.00 -0.12 -4.84 121.76 116.20 1n24 s ALA 468 Ca 0.22 0.89 -0.27 0.00 0.00 0.00 0.00 51.96 52.80 1n24 s ALA 468 Cb 0.11 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 1n24 s ALA 468 CO 0.15 -0.22 0.83 0.45 0.00 0.00 0.00 175.76 176.97 1n24 s SER 469 N -0.99 7.43 0.00 0.00 0.15 -1.26 -4.95 113.70 114.08 1n24 s SER 469 Ca 0.48 1.70 0.25 0.00 0.70 0.00 0.00 55.95 59.08 1n24 s SER 469 Cb -0.31 -2.53 0.73 0.00 -1.71 0.00 0.00 66.02 62.21 1n24 s SER 469 CO 0.39 0.14 1.56 1.41 1.20 0.00 0.00 173.24 177.95 1n24 n HIS 470 N 1.87 0.07 -2.10 3.44 8.25 -1.26 -4.77 115.22 120.73 1n24 n HIS 470 Ca -0.04 -0.04 -0.42 0.00 -0.26 0.00 0.00 57.72 56.97 1n24 n HIS 470 Cb 0.49 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.57 1n24 n HIS 470 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1n24 s ASP 471 N -1.89 6.75 0.43 0.41 -1.08 -1.26 -4.91 116.67 115.12 1n24 s ASP 471 Ca 0.35 2.36 0.14 0.00 -0.52 0.00 0.00 52.55 54.87 1n24 s ASP 471 Cb 0.20 -2.58 1.03 0.00 -1.46 0.00 0.00 42.92 40.11 1n24 s ASP 471 CO 0.31 -0.74 1.97 0.74 0.52 0.00 0.00 175.17 177.97 1n24 h THR 472 N 4.47 0.88 -0.28 1.71 2.02 -1.99 -1.76 112.91 117.96 1n24 h THR 472 Ca -0.41 -0.14 -0.12 0.00 0.77 0.00 0.00 66.41 66.50 1n24 h THR 472 Cb 1.20 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1n24 h THR 472 CO 0.89 0.08 -0.34 0.00 0.37 0.00 0.00 175.52 176.52 1n24 h ALA 473 N 1.69 0.89 -0.15 6.16 0.00 -1.99 -0.36 119.26 125.50 1n24 h ALA 473 Ca 0.29 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1n24 h ALA 473 Cb 0.59 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1n24 h ALA 473 CO -0.08 0.63 -0.17 0.28 0.00 0.00 0.00 179.25 179.90 1n24 h VAL 474 N 0.51 1.35 -0.63 0.00 2.07 -1.73 -1.87 116.25 115.95 1n24 h VAL 474 Ca 0.06 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.17 1n24 h VAL 474 Cb 0.83 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 1n24 h VAL 474 CO 0.07 0.40 0.20 0.40 0.02 0.00 0.00 177.57 178.66 1n24 h ILE 475 N 0.02 1.25 -0.63 4.57 2.04 -1.37 -1.40 117.51 121.98 1n24 h ILE 475 Ca 0.02 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 1n24 h ILE 475 Cb 0.72 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1n24 h ILE 475 CO 0.04 0.32 0.33 0.44 0.00 0.00 0.00 178.15 179.28 1n24 h ASP 476 N 0.91 0.79 -0.32 1.72 3.32 -1.05 -0.74 116.42 121.05 1n24 h ASP 476 Ca 0.20 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1n24 h ASP 476 Cb 0.29 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1n24 h ASP 476 CO -0.01 0.65 0.21 -1.28 -1.72 0.00 0.00 179.24 177.09 1n24 h SER 477 N 0.89 0.36 -0.56 6.45 0.87 -0.48 -0.29 113.55 120.78 1n24 h SER 477 Ca 0.22 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.80 1n24 h SER 477 Cb 0.05 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 61.88 1n24 h SER 477 CO -0.03 0.27 0.33 0.25 -0.53 0.00 0.00 176.83 177.11 1n24 h LEU 478 N 0.43 0.52 -0.00 2.23 5.85 -0.46 -3.10 115.31 120.77 1n24 h LEU 478 Ca 0.12 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1n24 h LEU 478 Cb -0.05 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1n24 h LEU 478 CO -0.02 0.36 -0.10 -1.22 -0.34 0.00 0.00 178.44 177.12 1n24 n TYR 479 N -4.78 0.00 0.37 1.25 4.02 -0.36 -1.89 117.16 115.77 1n24 n TYR 479 Ca 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.05 1n24 n TYR 479 Cb 0.10 -0.44 0.47 0.00 -0.02 0.00 0.00 39.34 39.44 1n24 n TYR 479 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1n24 n GLN 480 N -1.49 0.16 -1.11 -0.72 10.64 -0.17 -4.80 117.38 119.89 1n24 n GLN 480 Ca 0.07 0.43 0.00 0.00 -1.83 0.00 0.00 57.00 55.67 1n24 n GLN 480 Cb 0.34 -1.83 0.00 0.00 -0.86 0.00 0.00 30.24 27.89 1n24 n GLN 480 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1n24 n TYR 481 N -2.13 0.00 -1.47 2.61 0.53 -0.97 -5.04 117.16 110.69 1n24 n TYR 481 Ca 0.02 0.00 -0.37 0.00 -1.02 0.00 0.00 57.90 56.53 1n24 n TYR 481 Cb 0.19 -1.11 0.07 0.00 -1.03 0.00 0.00 39.34 37.46 1n24 n TYR 481 CO 0.00 0.00 0.00 1.58 -1.02 0.00 0.00 176.86 177.42 1n24 n HIS 482 N 0.03 0.49 -0.35 -0.72 -0.00 -0.79 -4.64 115.22 109.25 1n24 n HIS 482 Ca 0.00 0.41 0.23 0.00 -0.00 0.00 0.00 57.72 58.36 1n24 n HIS 482 Cb 0.00 -2.08 0.48 0.00 -0.00 0.00 0.00 29.99 28.39 1n24 n HIS 482 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 1n24 h ASP 483 N 0.06 0.52 -0.62 0.26 3.45 -1.93 -0.70 116.42 117.45 1n24 h ASP 483 Ca -0.48 0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.13 1n24 h ASP 483 Cb 1.35 0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 40.17 1n24 h ASP 483 CO 0.48 -0.02 0.40 0.40 -1.57 0.00 0.00 179.24 178.93 1n24 h ILE 484 N 0.39 1.17 -0.19 0.35 2.04 -1.95 0.18 117.51 119.50 1n24 h ILE 484 Ca 0.69 -0.33 -0.18 0.00 1.00 0.00 0.00 64.86 66.04 1n24 h ILE 484 Cb 1.61 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.97 1n24 h ILE 484 CO -0.47 0.17 -0.62 -0.07 0.00 0.00 0.00 178.15 177.15 1n24 h LEU 485 N 0.84 0.74 -0.59 1.44 3.38 -1.49 -1.42 115.31 118.21 1n24 h LEU 485 Ca 0.23 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1n24 h LEU 485 Cb -0.07 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1n24 h LEU 485 CO -0.05 1.18 0.19 0.00 0.09 0.00 0.00 178.44 179.85 1n24 h LEU 487 N 0.83 0.87 -1.75 0.00 3.38 -0.56 -1.35 115.31 116.74 1n24 h LEU 487 Ca 0.19 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1n24 h LEU 487 Cb 0.28 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1n24 h LEU 487 CO -0.01 0.94 -0.16 0.00 0.09 0.00 0.00 178.44 179.30 1n24 h ALA 488 N 1.15 1.58 -0.17 1.53 0.00 -0.96 0.17 119.26 122.57 1n24 h ALA 488 Ca 0.15 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1n24 h ALA 488 Cb 0.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1n24 h ALA 488 CO 0.03 0.20 -0.52 0.78 0.00 0.00 0.00 179.25 179.74 1n24 h GLY 489 N 0.60 0.71 0.93 0.00 0.00 -0.52 -2.53 103.07 102.25 1n24 h GLY 489 Ca -0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 47.33 46.38 1n24 h GLY 489 CO 0.02 0.82 0.12 -2.22 0.00 0.00 0.00 176.54 175.28 1n24 h ILE 490 N 0.32 1.21 0.00 2.60 1.08 -0.16 0.33 117.51 122.90 1n24 h ILE 490 Ca -0.02 -0.69 -0.03 0.00 -0.39 0.00 0.00 64.86 63.72 1n24 h ILE 490 Cb 1.14 0.95 -0.00 0.00 -3.07 0.00 0.00 36.82 35.83 1n24 h ILE 490 CO 0.11 0.24 -0.17 0.40 -0.69 0.00 0.00 178.15 178.05 1n24 h ILE 491 N 0.47 0.54 0.14 -0.67 2.04 -0.75 -1.53 117.51 117.76 1n24 h ILE 491 Ca 0.12 -0.80 -0.34 0.00 1.00 0.00 0.00 64.86 64.85 1n24 h ILE 491 Cb 0.25 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1n24 h ILE 491 CO -0.00 0.16 -1.76 0.25 0.00 0.00 0.00 178.15 176.80 1n24 h LEU 492 N 0.00 0.47 -0.12 1.44 5.85 -1.25 -3.37 115.31 118.33 1n24 h LEU 492 Ca -0.00 -0.78 -0.00 0.00 0.84 0.00 0.00 57.88 57.94 1n24 h LEU 492 Cb 0.52 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1n24 h LEU 492 CO 0.02 1.67 0.06 -0.09 -0.34 0.00 0.00 178.44 179.76 1n24 h ARG 493 N 0.08 0.17 0.01 1.25 9.65 -0.63 -1.76 114.38 123.15 1n24 h ARG 493 Ca -0.34 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.53 1n24 h ARG 493 Cb 2.06 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 30.60 1n24 h ARG 493 CO 0.15 0.24 -0.04 -0.07 2.80 0.00 0.00 179.97 183.04 1n24 h LEU 494 N 0.07 -0.11 -0.56 3.80 3.38 -1.49 0.23 115.31 120.63 1n24 h LEU 494 Ca 0.04 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1n24 h LEU 494 Cb 0.12 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1n24 h LEU 494 CO -0.01 -0.06 0.09 -0.65 0.09 0.00 0.00 178.44 177.91 1n24 h PRO 495 N -0.08 0.92 -1.00 1.13 0.11 -1.72 -1.81 132.00 129.56 1n24 h PRO 495 Ca 0.02 -0.25 0.03 0.00 0.11 0.00 0.00 66.00 65.91 1n24 h PRO 495 Cb 0.09 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 31.04 1n24 h PRO 495 CO -0.04 0.89 0.66 0.22 -0.21 0.00 0.00 178.00 179.52 1n24 h ASP 496 N 0.81 1.11 -0.28 -2.05 1.82 -1.06 -0.69 116.42 116.08 1n24 h ASP 496 Ca 0.17 -0.02 -0.18 0.00 -0.39 0.00 0.00 57.03 56.62 1n24 h ASP 496 Cb 0.41 -0.26 -0.00 0.00 0.68 0.00 0.00 39.33 40.16 1n24 h ASP 496 CO 0.01 0.77 -0.50 0.44 -1.61 0.00 0.00 179.24 178.35 1n24 h ASP 497 N 1.29 0.95 -0.88 2.28 5.19 -0.77 0.27 116.42 124.76 1n24 h ASP 497 Ca 0.39 -0.49 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1n24 h ASP 497 Cb -0.04 -0.27 -0.04 0.00 0.18 0.00 0.00 39.33 39.16 1n24 h ASP 497 CO -0.11 1.28 0.57 -0.07 -3.12 0.00 0.00 179.24 177.79 1n24 h LEU 498 N 0.68 1.03 0.16 1.55 4.07 -0.82 -3.23 115.31 118.74 1n24 h LEU 498 Ca 0.03 -0.04 -0.32 0.00 0.08 0.00 0.00 57.88 57.63 1n24 h LEU 498 Cb 1.10 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1n24 h LEU 498 CO 0.11 0.76 -1.63 1.23 -1.08 0.00 0.00 178.44 177.83 1n24 h GLY 499 N 1.20 0.38 -2.27 0.83 0.00 -1.05 -3.48 103.07 98.69 1n24 h GLY 499 Ca 0.32 -0.98 -0.49 0.00 0.00 0.00 0.00 47.33 46.19 1n24 h GLY 499 CO -0.07 0.85 -0.38 -0.51 0.00 0.00 0.00 176.54 176.44 1n24 s THR 500 N -2.54 2.87 0.00 4.70 -4.23 0.95 -4.16 115.64 113.23 1n24 s THR 500 Ca -0.18 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1n24 s THR 500 Cb 0.05 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.85 1n24 s THR 500 CO 0.82 -0.03 0.00 -0.11 -0.54 0.00 0.00 174.62 174.75 1n24 n LEU 505 N -1.55 0.00 -0.04 4.79 7.94 -1.26 -4.70 117.00 122.17 1n24 n LEU 505 Ca 0.03 0.00 -0.16 0.00 -1.11 0.00 0.00 56.01 54.77 1n24 n LEU 505 Cb 0.61 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.51 1n24 n LEU 505 CO 0.42 0.00 0.35 0.00 -1.11 0.00 0.00 177.39 177.05 1n24 h ALA 506 N 0.00 0.41 0.00 1.96 0.00 -2.01 -3.11 119.26 116.51 1n24 h ALA 506 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1n24 h ALA 506 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1n24 h ALA 506 CO 0.00 0.69 0.00 2.89 0.00 0.00 0.00 179.25 182.83 1n24 n ARG 507 N -3.96 0.28 -0.46 0.00 1.85 -1.26 -4.91 116.66 108.20 1n24 n ARG 507 Ca -0.06 0.11 0.00 0.00 -1.00 0.00 0.00 57.85 56.90 1n24 n ARG 507 Cb 0.69 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.60 1n24 n ARG 507 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1n24 n GLY 508 N 0.20 -0.74 3.69 2.89 0.00 -1.17 -5.11 105.19 104.95 1n24 n GLY 508 Ca 0.09 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.33 1n24 n GLY 508 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n24 s ASP 509 N 0.00 -0.34 0.12 1.61 2.15 -1.26 -4.87 116.67 114.08 1n24 s ASP 509 Ca 0.00 -0.36 -0.35 0.00 0.43 0.00 0.00 52.55 52.27 1n24 s ASP 509 Cb 0.00 0.63 -0.16 0.00 -0.30 0.00 0.00 42.92 43.09 1n24 s ASP 509 CO 0.00 -1.12 1.29 0.52 -0.17 0.00 0.00 175.17 175.70 1n24 n VAL 510 N -0.42 0.33 -1.65 1.11 0.31 -1.26 -4.77 118.33 111.98 1n24 n VAL 510 Ca -0.08 -0.08 -0.44 0.00 -0.01 0.00 0.00 64.34 63.72 1n24 n VAL 510 Cb 0.61 -0.88 -0.02 0.00 -0.91 0.00 0.00 33.84 32.64 1n24 n VAL 510 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1n24 n PRO 511 N 2.30 1.77 -3.34 5.55 -0.02 -1.26 -4.89 135.00 135.11 1n24 n PRO 511 Ca 0.17 0.62 -0.22 0.00 -2.02 0.00 0.00 63.50 62.05 1n24 n PRO 511 Cb 0.22 -2.14 0.04 0.00 -0.02 0.00 0.00 33.50 31.60 1n24 n PRO 511 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1n24 n LYS 512 N 0.95 0.63 0.00 -0.52 4.76 -1.26 -4.81 118.16 117.90 1n24 n LYS 512 Ca 0.08 -3.29 0.00 0.00 -2.87 0.00 0.00 58.31 52.23 1n24 n LYS 512 Cb 0.33 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.52 1n24 n LYS 512 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1n24 n THR 513 N -2.09 0.00 -0.15 -0.18 -1.04 -1.26 -1.03 114.28 108.53 1n24 n THR 513 Ca 0.09 0.93 -0.11 0.00 -2.04 0.00 0.00 64.05 62.92 1n24 n THR 513 Cb 0.62 -1.25 -0.07 0.00 -1.82 0.00 0.00 70.33 67.81 1n24 n THR 513 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1n24 h ILE 514 N 0.00 0.05 -0.93 12.58 1.08 -1.94 -1.09 117.51 127.26 1n24 h ILE 514 Ca 0.00 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.52 1n24 h ILE 514 Cb 0.00 0.05 -0.06 0.00 -3.07 0.00 0.00 36.82 33.74 1n24 h ILE 514 CO 0.00 0.00 0.61 -0.61 -0.69 0.00 0.00 178.15 177.46 1n24 h GLN 515 N -0.34 1.08 -0.41 2.37 4.15 -1.69 -0.95 115.11 119.32 1n24 h GLN 515 Ca 0.12 -0.06 -0.14 0.00 0.77 0.00 0.00 58.65 59.33 1n24 h GLN 515 Cb 0.58 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 1n24 h GLN 515 CO -0.62 0.71 -0.29 0.00 -1.93 0.00 0.00 178.83 176.70 1n24 h TYR 517 N 0.74 0.30 -0.82 0.00 3.20 -0.79 -2.66 116.97 116.95 1n24 h TYR 517 Ca 0.08 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1n24 h TYR 517 Cb 0.88 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 39.02 1n24 h TYR 517 CO 0.06 0.48 0.54 0.52 -1.64 0.00 0.00 178.16 178.13 1n24 h MET 518 N 0.04 1.06 0.00 1.82 2.86 -1.21 -1.46 114.93 118.03 1n24 h MET 518 Ca 0.05 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 1n24 h MET 518 Cb 0.35 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1n24 h MET 518 CO 0.01 0.70 -0.39 -0.22 1.06 0.00 0.00 176.91 178.06 1n24 h LYS 519 N 1.09 0.00 0.00 1.72 3.64 -1.43 0.43 116.57 122.02 1n24 h LYS 519 Ca 0.31 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.55 1n24 h LYS 519 Cb -0.09 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1n24 h LYS 519 CO -0.07 0.39 -1.06 1.49 -2.27 0.00 0.00 179.45 177.93 1n24 h GLU 520 N 0.00 0.00 0.00 1.90 4.81 -1.06 -3.39 114.58 116.84 1n24 h GLU 520 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1n24 h GLU 520 Cb 0.97 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1n24 h GLU 520 CO 0.05 0.35 0.00 0.25 -0.73 0.00 0.00 179.01 178.93 1n24 n THR 521 N -3.00 0.00 -1.20 0.32 -2.24 -0.60 -4.99 114.28 102.56 1n24 n THR 521 Ca -0.05 -0.41 -0.07 0.00 -2.27 0.00 0.00 64.05 61.25 1n24 n THR 521 Cb 0.79 1.09 -0.03 0.00 -2.10 0.00 0.00 70.33 70.07 1n24 n THR 521 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1n24 n ASN 522 N -0.43 -5.45 -4.65 3.42 3.02 0.15 -4.95 115.26 106.37 1n24 n ASN 522 Ca 0.00 0.17 -0.30 0.00 -0.03 0.00 0.00 54.58 54.42 1n24 n ASN 522 Cb 0.02 -3.56 0.17 0.00 -0.61 0.00 0.00 39.78 35.80 1n24 n ASN 522 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n24 s ALA 523 N -1.72 1.10 0.56 5.41 0.00 -1.24 -5.01 121.76 120.85 1n24 s ALA 523 Ca 0.00 0.23 -0.08 0.00 0.00 0.00 0.00 51.96 52.11 1n24 s ALA 523 Cb 0.00 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 1n24 s ALA 523 CO 0.00 -2.82 0.90 -1.54 0.00 0.00 0.00 175.76 172.30 1n24 s SER 524 N -2.89 6.11 0.30 0.00 1.04 -1.26 -4.76 113.70 112.24 1n24 s SER 524 Ca 0.66 1.08 0.01 0.00 0.48 0.00 0.00 55.95 58.17 1n24 s SER 524 Cb -0.22 -2.23 0.54 0.00 0.10 0.00 0.00 66.02 64.21 1n24 s SER 524 CO 0.59 -0.79 1.90 -0.08 0.98 0.00 0.00 173.24 175.84 1n24 h GLU 525 N -0.06 0.99 -0.40 4.02 4.81 -1.98 0.20 114.58 122.16 1n24 h GLU 525 Ca -0.46 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1n24 h GLU 525 Cb 1.21 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1n24 h GLU 525 CO 0.62 0.66 0.20 0.93 -0.73 0.00 0.00 179.01 180.68 1n24 h GLU 526 N 1.02 0.56 -0.50 1.92 3.07 -2.00 -0.54 114.58 118.12 1n24 h GLU 526 Ca 0.41 -0.08 -0.07 0.00 -0.50 0.00 0.00 59.36 59.13 1n24 h GLU 526 Cb 0.27 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.05 1n24 h GLU 526 CO -0.17 0.49 0.04 0.93 -1.40 0.00 0.00 179.01 178.89 1n24 h GLU 527 N 0.50 0.81 -0.16 2.33 5.08 -1.58 -2.12 114.58 119.45 1n24 h GLU 527 Ca 0.14 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1n24 h GLU 527 Cb 0.10 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1n24 h GLU 527 CO -0.02 0.79 0.03 0.00 -1.00 0.00 0.00 179.01 178.82 1n24 h ALA 528 N 1.27 0.21 -0.48 3.43 0.00 -0.24 -0.84 119.26 122.62 1n24 h ALA 528 Ca 0.15 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1n24 h ALA 528 Cb 0.41 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1n24 h ALA 528 CO 0.01 -0.14 0.24 0.28 0.00 0.00 0.00 179.25 179.64 1n24 h VAL 529 N 0.05 0.96 -0.10 0.00 2.07 -0.96 0.18 116.25 118.45 1n24 h VAL 529 Ca 0.05 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 1n24 h VAL 529 Cb 0.28 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1n24 h VAL 529 CO 0.00 0.09 -0.13 -0.08 0.02 0.00 0.00 177.57 177.47 1n24 h GLU 530 N 0.47 0.15 -0.31 1.57 4.57 -1.26 -1.84 114.58 117.94 1n24 h GLU 530 Ca 0.21 -0.03 -0.13 0.00 -1.18 0.00 0.00 59.36 58.23 1n24 h GLU 530 Cb 0.12 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1n24 h GLU 530 CO -0.15 0.29 -0.32 1.25 -1.18 0.00 0.00 179.01 178.89 1n24 h HIS 531 N 0.14 0.92 -0.78 0.92 2.76 0.35 -2.54 115.15 116.93 1n24 h HIS 531 Ca 0.03 -0.28 -0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1n24 h HIS 531 Cb 0.32 -0.19 -0.04 0.00 1.55 0.00 0.00 27.41 29.05 1n24 h HIS 531 CO 0.00 1.05 0.48 0.28 -1.30 0.00 0.00 177.93 178.44 1n24 h VAL 532 N 0.52 1.21 -0.96 5.26 2.07 -0.44 -0.36 116.25 123.56 1n24 h VAL 532 Ca 0.05 -0.45 0.04 0.00 0.82 0.00 0.00 66.70 67.16 1n24 h VAL 532 Cb 0.90 0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 1n24 h VAL 532 CO 0.08 0.22 0.63 0.11 0.02 0.00 0.00 177.57 178.62 1n24 h LYS 533 N 1.06 1.16 -0.09 1.57 1.57 -1.24 0.58 116.57 121.18 1n24 h LYS 533 Ca 0.28 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1n24 h LYS 533 Cb -0.06 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 31.98 1n24 h LYS 533 CO -0.06 0.77 0.04 0.35 -0.57 0.00 0.00 179.45 179.98 1n24 h PHE 534 N 1.19 0.12 -0.59 -1.35 3.57 -0.85 -2.32 116.94 116.72 1n24 h PHE 534 Ca 0.39 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.91 1n24 h PHE 534 Cb 0.04 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1n24 h PHE 534 CO -0.00 0.20 0.39 -0.07 -2.23 0.00 0.00 178.31 176.59 1n24 h LEU 535 N 0.02 0.62 -0.29 0.59 3.38 -0.09 0.04 115.31 119.58 1n24 h LEU 535 Ca 0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1n24 h LEU 535 Cb 0.12 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1n24 h LEU 535 CO -0.00 0.43 0.04 0.40 0.09 0.00 0.00 178.44 179.39 1n24 h ILE 536 N 0.72 1.24 -0.51 1.22 2.04 -0.66 0.33 117.51 121.89 1n24 h ILE 536 Ca 0.23 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1n24 h ILE 536 Cb 0.03 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1n24 h ILE 536 CO -0.06 0.27 0.27 0.03 0.00 0.00 0.00 178.15 178.66 1n24 h ARG 537 N 0.29 0.72 -0.87 2.37 3.08 -0.83 -1.44 114.38 117.70 1n24 h ARG 537 Ca 0.09 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1n24 h ARG 537 Cb 0.36 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 1n24 h ARG 537 CO 0.01 0.57 0.50 1.49 -1.07 0.00 0.00 179.97 181.47 1n24 h GLU 538 N 0.68 1.20 -0.67 0.04 4.57 -0.75 -1.09 114.58 118.55 1n24 h GLU 538 Ca 0.18 -0.12 -0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1n24 h GLU 538 Cb 0.08 -0.24 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1n24 h GLU 538 CO -0.03 0.86 0.26 0.00 -1.18 0.00 0.00 179.01 178.92 1n24 h ALA 539 N 1.34 0.87 -0.31 2.92 0.00 0.25 -0.98 119.26 123.36 1n24 h ALA 539 Ca 0.31 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1n24 h ALA 539 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1n24 h ALA 539 CO -0.05 0.50 -0.28 -1.49 0.00 0.00 0.00 179.25 177.93 1n24 h TRP 540 N 0.96 0.72 -0.21 0.00 4.06 -0.78 0.10 115.95 120.79 1n24 h TRP 540 Ca 0.22 -0.17 -0.00 0.00 2.06 0.00 0.00 58.89 61.00 1n24 h TRP 540 Cb 0.23 -0.17 -0.01 0.00 -1.00 0.00 0.00 29.16 28.21 1n24 h TRP 540 CO 0.02 0.84 0.13 -0.22 -3.56 0.00 0.00 178.44 175.65 1n24 h LYS 541 N 0.54 0.28 -0.52 0.49 3.64 -0.80 0.15 116.57 120.35 1n24 h LYS 541 Ca 0.07 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1n24 h LYS 541 Cb 0.76 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 1n24 h LYS 541 CO 0.06 0.21 0.34 -0.44 -2.27 0.00 0.00 179.45 177.36 1n24 h ASP 542 N 0.26 0.58 -0.44 4.20 3.32 -0.85 -0.75 116.42 122.75 1n24 h ASP 542 Ca 0.08 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.13 1n24 h ASP 542 Cb 0.00 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1n24 h ASP 542 CO -0.01 0.42 0.27 -0.03 -1.72 0.00 0.00 179.24 178.17 1n24 h MET 543 N 0.69 0.53 -0.67 3.56 4.05 -0.23 0.18 114.93 123.05 1n24 h MET 543 Ca 0.19 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.58 1n24 h MET 543 Cb -0.07 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 30.58 1n24 h MET 543 CO -0.05 0.35 0.43 -0.91 0.23 0.00 0.00 176.91 176.97 1n24 h ASN 544 N 0.55 0.77 0.21 1.39 2.35 -0.40 -1.01 115.58 119.43 1n24 h ASN 544 Ca 0.17 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1n24 h ASN 544 Cb -0.02 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.16 1n24 h ASN 544 CO -0.06 0.57 -0.10 0.74 -1.65 0.00 0.00 177.43 176.93 1n24 h THR 545 N 0.91 0.84 -0.76 2.81 2.02 -0.59 -1.35 112.91 116.78 1n24 h THR 545 Ca 0.24 -0.26 0.11 0.00 0.77 0.00 0.00 66.41 67.27 1n24 h THR 545 Cb -0.09 1.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.25 1n24 h THR 545 CO -0.05 0.06 0.39 0.00 0.37 0.00 0.00 175.52 176.29 1n24 h ALA 546 N 0.35 1.08 -0.46 6.16 0.00 -0.46 0.93 119.26 126.86 1n24 h ALA 546 Ca -0.03 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1n24 h ALA 546 Cb 0.32 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1n24 h ALA 546 CO 0.05 -0.04 -0.25 0.82 0.00 0.00 0.00 179.25 179.83 1n24 h ILE 547 N 0.63 1.27 -0.01 0.00 2.04 -1.10 -2.93 117.51 117.41 1n24 h ILE 547 Ca 0.39 -1.42 -0.09 0.00 1.00 0.00 0.00 64.86 64.74 1n24 h ILE 547 Cb 0.44 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1n24 h ILE 547 CO -0.29 0.49 -0.41 0.00 0.00 0.00 0.00 178.15 177.94 1n24 h ALA 548 N 0.86 1.31 0.00 1.87 0.00 -0.51 -2.66 119.26 120.12 1n24 h ALA 548 Ca 0.10 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1n24 h ALA 548 Cb 0.84 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1n24 h ALA 548 CO 0.07 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.84 1n24 h ALA 549 N 1.57 1.00 0.00 0.00 0.00 -0.64 -3.48 119.26 117.71 1n24 h ALA 549 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1n24 h ALA 549 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1n24 h ALA 549 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1n24 n GLY 550 N -0.85 1.27 3.43 0.00 0.00 -1.00 -5.10 105.19 102.93 1n24 n GLY 550 Ca -0.01 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.13 1n24 n GLY 550 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1n24 s TYR 551 N -2.70 -0.50 -0.27 1.61 -0.85 -1.26 -4.88 117.35 108.50 1n24 s TYR 551 Ca 0.00 0.58 0.02 0.00 -0.52 0.00 0.00 57.07 57.15 1n24 s TYR 551 Cb 0.00 0.41 0.39 0.00 0.38 0.00 0.00 41.96 43.14 1n24 s TYR 551 CO 0.00 -0.69 1.54 -0.35 -1.52 0.00 0.00 175.55 174.53 1n24 n PRO 552 N 0.31 1.74 -4.41 -3.49 -0.04 -1.26 -4.92 135.00 122.94 1n24 n PRO 552 Ca -0.18 -1.76 -0.21 0.00 -0.04 0.00 0.00 63.50 61.31 1n24 n PRO 552 Cb 0.61 -1.69 -0.10 0.00 -0.04 0.00 0.00 33.50 32.27 1n24 n PRO 552 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1n24 s PHE 553 N -1.93 1.93 0.50 0.54 0.40 -1.26 -4.82 117.98 113.34 1n24 s PHE 553 Ca 0.33 -0.57 -0.23 0.00 -0.60 0.00 0.00 56.93 55.86 1n24 s PHE 553 Cb 0.28 -0.97 -0.06 0.00 0.51 0.00 0.00 43.02 42.77 1n24 s PHE 553 CO 0.06 0.40 1.36 -2.14 0.70 0.00 0.00 175.22 175.61 1n24 s PRO 554 N -3.65 3.41 0.25 0.24 0.02 -1.26 -4.90 135.00 129.10 1n24 s PRO 554 Ca 0.27 2.24 -0.06 0.00 0.02 0.00 0.00 61.00 63.47 1n24 s PRO 554 Cb 0.00 -2.42 0.26 0.00 0.02 0.00 0.00 34.50 32.36 1n24 s PRO 554 CO 0.11 -0.98 1.88 -0.44 -0.33 0.00 0.00 177.00 177.23 1n24 h ASP 555 N 1.84 1.09 -0.68 2.53 3.32 -1.99 -2.36 116.42 120.17 1n24 h ASP 555 Ca -0.51 -0.09 0.07 0.00 0.02 0.00 0.00 57.03 56.53 1n24 h ASP 555 Cb 1.28 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 1n24 h ASP 555 CO 0.59 0.86 0.45 1.23 -1.72 0.00 0.00 179.24 180.65 1n24 h GLY 556 N 1.24 0.84 1.03 2.75 0.00 -1.99 0.25 103.07 107.19 1n24 h GLY 556 Ca 0.31 -0.26 -0.18 0.00 0.00 0.00 0.00 47.33 47.20 1n24 h GLY 556 CO -0.05 0.18 -0.64 1.98 0.00 0.00 0.00 176.54 178.02 1n24 h MET 557 N 0.65 0.67 -0.47 4.80 1.85 -1.81 -2.65 114.93 117.98 1n24 h MET 557 Ca 0.30 -0.54 -0.07 0.00 -0.61 0.00 0.00 59.70 58.77 1n24 h MET 557 Cb 0.33 0.11 -0.02 0.00 0.43 0.00 0.00 31.60 32.45 1n24 h MET 557 CO -0.10 1.16 -0.01 0.28 -0.40 0.00 0.00 176.91 177.84 1n24 h VAL 558 N 0.35 1.24 -0.67 -5.77 2.07 -0.96 -0.38 116.25 112.12 1n24 h VAL 558 Ca -0.04 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.46 1n24 h VAL 558 Cb 1.27 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.91 1n24 h VAL 558 CO 0.13 0.36 0.40 0.00 0.02 0.00 0.00 177.57 178.48 1n24 h ALA 559 N 1.26 1.43 -0.32 1.67 0.00 -0.51 0.08 119.26 122.87 1n24 h ALA 559 Ca 0.14 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1n24 h ALA 559 Cb 0.46 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1n24 h ALA 559 CO 0.02 0.49 -0.15 0.78 0.00 0.00 0.00 179.25 180.39 1n24 h GLY 560 N 0.97 0.73 0.96 0.00 0.00 -0.99 -1.72 103.07 103.02 1n24 h GLY 560 Ca 0.24 -0.66 0.02 0.00 0.00 0.00 0.00 47.33 46.93 1n24 h GLY 560 CO -0.04 0.60 0.62 0.00 0.00 0.00 0.00 176.54 177.71 1n24 h ALA 561 N 0.77 1.20 -0.42 3.60 0.00 -0.29 -0.98 119.26 123.14 1n24 h ALA 561 Ca 0.07 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1n24 h ALA 561 Cb 0.68 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1n24 h ALA 561 CO 0.05 0.54 -0.11 0.00 0.00 0.00 0.00 179.25 179.73 1n24 h ALA 562 N 1.36 0.58 -0.08 0.00 0.00 -0.90 -3.26 119.26 116.97 1n24 h ALA 562 Ca 0.35 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1n24 h ALA 562 Cb -0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1n24 h ALA 562 CO -0.09 0.47 -0.54 -0.91 0.00 0.00 0.00 179.25 178.18 1n24 h ASN 563 N 0.64 0.25 -1.00 0.00 2.35 -0.87 -3.30 115.58 113.66 1n24 h ASN 563 Ca 0.11 -0.13 0.15 0.00 -0.55 0.00 0.00 56.30 55.87 1n24 h ASN 563 Cb 0.64 -0.07 -0.09 0.00 0.05 0.00 0.00 38.32 38.85 1n24 h ASN 563 CO 0.04 0.74 0.62 -0.29 -1.65 0.00 0.00 177.43 176.90 1n24 h ILE 564 N 0.18 0.83 -0.10 2.81 2.10 -1.23 0.11 117.51 122.21 1n24 h ILE 564 Ca 0.00 -0.31 -0.16 0.00 1.08 0.00 0.00 64.86 65.48 1n24 h ILE 564 Cb 1.00 -0.14 -0.01 0.00 -1.09 0.00 0.00 36.82 36.58 1n24 h ILE 564 CO 0.08 0.16 -0.61 1.23 -1.08 0.00 0.00 178.15 177.93 1n24 h GLY 565 N 0.90 0.38 1.22 8.18 0.00 -1.73 -3.03 103.07 108.98 1n24 h GLY 565 Ca 0.53 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 1n24 h GLY 565 CO -0.31 0.42 0.41 3.21 0.00 0.00 0.00 176.54 180.27 1n24 h ARG 566 N 0.25 1.02 -0.34 4.80 3.08 -0.92 -1.41 114.38 120.86 1n24 h ARG 566 Ca -0.01 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 1n24 h ARG 566 Cb 1.14 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.97 1n24 h ARG 566 CO 0.10 0.75 0.22 0.28 -1.07 0.00 0.00 179.97 180.25 1n24 h VAL 567 N 1.03 1.11 -0.72 2.04 2.07 -1.16 -1.59 116.25 119.03 1n24 h VAL 567 Ca 0.26 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.59 1n24 h VAL 567 Cb 0.02 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 1n24 h VAL 567 CO -0.04 0.11 0.45 0.00 0.02 0.00 0.00 177.57 178.10 1n24 h ALA 568 N 1.10 0.96 -0.79 1.67 0.00 -1.37 0.63 119.26 121.46 1n24 h ALA 568 Ca 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1n24 h ALA 568 Cb -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 1n24 h ALA 568 CO -0.02 0.21 0.47 1.96 0.00 0.00 0.00 179.25 181.86 1n24 h GLN 569 N 0.86 1.08 0.16 0.00 4.20 -0.81 0.89 115.11 121.48 1n24 h GLN 569 Ca 0.30 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 1n24 h GLN 569 Cb 0.07 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.62 1n24 h GLN 569 CO -0.13 0.76 -0.07 0.35 -0.67 0.00 0.00 178.83 179.07 1n24 h PHE 570 N 1.10 -0.19 0.00 2.96 3.57 -0.34 -2.43 116.94 121.60 1n24 h PHE 570 Ca 0.28 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1n24 h PHE 570 Cb -0.03 0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.77 1n24 h PHE 570 CO 0.00 0.25 0.00 0.97 -2.23 0.00 0.00 178.31 177.30 1n24 h ILE 571 N -0.85 0.00 -0.06 1.41 2.10 0.38 -2.29 117.51 118.21 1n24 h ILE 571 Ca -0.02 -0.19 0.00 0.00 1.08 0.00 0.00 64.86 65.73 1n24 h ILE 571 Cb 0.53 1.03 0.00 0.00 -1.09 0.00 0.00 36.82 37.29 1n24 h ILE 571 CO 0.04 0.00 0.00 -1.22 -1.08 0.00 0.00 178.15 175.89 1n24 n TYR 572 N -2.77 0.19 -0.35 2.19 4.02 0.29 -3.01 117.16 117.72 1n24 n TYR 572 Ca -0.01 -0.87 0.05 0.00 -0.01 0.00 0.00 57.90 57.06 1n24 n TYR 572 Cb 0.16 -0.16 0.22 0.00 -0.02 0.00 0.00 39.34 39.54 1n24 n TYR 572 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1n24 h LEU 573 N 0.42 0.95 -6.60 7.72 5.85 -0.89 -3.36 115.31 119.41 1n24 h LEU 573 Ca 0.00 0.03 -0.49 0.00 0.84 0.00 0.00 57.88 58.25 1n24 h LEU 573 Cb 0.99 -0.17 -0.37 0.00 0.37 0.00 0.00 40.66 41.47 1n24 h LEU 573 CO 0.04 0.56 -0.77 -1.00 -0.34 0.00 0.00 178.44 176.94 1n24 s HIS 574 N -5.96 0.24 0.00 1.25 3.76 -1.26 -5.08 115.29 108.24 1n24 s HIS 574 Ca -0.12 -1.02 0.00 0.00 -0.15 0.00 0.00 55.06 53.77 1n24 s HIS 574 Cb 0.21 -0.76 0.00 0.00 1.11 0.00 0.00 32.58 33.14 1n24 s HIS 574 CO 0.81 -0.87 0.00 0.41 -0.85 0.00 0.00 174.74 174.24 1n24 n GLY 575 N 4.68 -1.39 3.10 -2.22 0.00 -1.26 -4.67 105.19 103.44 1n24 n GLY 575 Ca 0.04 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 1n24 n GLY 575 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n24 s ASP 576 N -4.00 5.34 0.00 1.61 2.15 -1.26 -4.32 116.67 116.20 1n24 s ASP 576 Ca 0.00 -2.93 0.24 0.00 0.43 0.00 0.00 52.55 50.29 1n24 s ASP 576 Cb 0.00 -1.87 1.43 0.00 -0.30 0.00 0.00 42.92 42.17 1n24 s ASP 576 CO 0.00 -0.36 1.87 0.61 -0.17 0.00 0.00 175.17 177.12 1n24 n GLY 577 N 3.40 -0.91 2.45 2.66 0.00 -1.16 -4.98 105.19 106.64 1n24 n GLY 577 Ca 0.09 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1n24 n GLY 577 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1n24 n PHE 578 N -0.91 2.44 0.00 1.61 7.35 -1.26 -4.89 117.46 121.80 1n24 n PHE 578 Ca 0.18 -2.37 0.00 0.00 -0.76 0.00 0.00 57.45 54.50 1n24 n PHE 578 Cb 0.08 -1.27 0.00 0.00 0.35 0.00 0.00 39.48 38.65 1n24 n PHE 578 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1n24 n SER 583 N -0.14 0.00 0.29 -2.13 3.41 -1.26 -4.98 113.62 108.81 1n24 n SER 583 Ca 0.51 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 59.30 1n24 n SER 583 Cb 0.50 0.00 0.88 0.00 -0.26 0.00 0.00 64.21 65.33 1n24 n SER 583 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1n24 h LYS 584 N 0.00 0.00 -0.52 4.33 1.57 -2.00 -2.14 116.57 117.82 1n24 h LYS 584 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1n24 h LYS 584 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1n24 h LYS 584 CO 0.00 0.03 0.02 1.15 -0.57 0.00 0.00 179.45 180.08 1n24 h THR 585 N 0.00 1.25 -0.23 -0.16 2.02 -2.00 -2.06 112.91 111.72 1n24 h THR 585 Ca -0.00 -1.02 0.05 0.00 0.77 0.00 0.00 66.41 66.21 1n24 h THR 585 Cb 0.30 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 1n24 h THR 585 CO 0.00 0.36 -0.04 0.22 0.37 0.00 0.00 175.52 176.43 1n24 h TYR 586 N 0.81 -0.10 -0.07 3.16 3.20 -1.73 -1.35 116.97 120.89 1n24 h TYR 586 Ca 0.16 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.07 1n24 h TYR 586 Cb 0.46 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 1n24 h TYR 586 CO 0.03 -0.09 -0.09 0.93 -1.64 0.00 0.00 178.16 177.30 1n24 h GLU 587 N 0.02 -0.12 -0.21 1.82 4.39 -1.53 -0.58 114.58 118.37 1n24 h GLU 587 Ca 0.11 0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.86 1n24 h GLU 587 Cb 0.17 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.81 1n24 h GLU 587 CO -0.23 -0.08 -0.03 1.25 -1.16 0.00 0.00 179.01 178.75 1n24 h HIS 588 N -0.13 -0.08 -0.71 4.33 2.76 -1.06 0.12 115.15 120.38 1n24 h HIS 588 Ca 0.06 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 1n24 h HIS 588 Cb 0.21 0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.21 1n24 h HIS 588 CO -0.19 -0.07 0.36 0.82 -1.30 0.00 0.00 177.93 177.54 1n24 h ILE 589 N 0.02 1.23 -0.60 6.26 2.04 -1.08 -1.58 117.51 123.80 1n24 h ILE 589 Ca 0.10 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 1n24 h ILE 589 Cb 0.14 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 1n24 h ILE 589 CO -0.20 0.26 0.22 0.00 0.00 0.00 0.00 178.15 178.44 1n24 h ALA 590 N 1.17 0.79 0.00 1.87 0.00 -0.67 0.49 119.26 122.91 1n24 h ALA 590 Ca 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1n24 h ALA 590 Cb 0.09 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1n24 h ALA 590 CO -0.03 0.42 -0.13 0.78 0.00 0.00 0.00 179.25 180.29 1n24 h GLY 591 N 0.85 0.00 0.52 0.00 0.00 -0.33 0.17 103.07 104.27 1n24 h GLY 591 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 47.16 1n24 h GLY 591 CO -0.01 0.00 -2.04 -0.10 0.00 0.00 0.00 176.54 174.39 1n24 n LEU 592 N -3.64 2.66 -0.10 3.11 7.94 -0.64 -4.31 117.00 122.02 1n24 n LEU 592 Ca -0.02 0.17 -0.11 0.00 -1.11 0.00 0.00 56.01 54.95 1n24 n LEU 592 Cb 0.25 -1.09 -0.15 0.00 0.53 0.00 0.00 43.42 42.96 1n24 n LEU 592 CO 0.30 0.85 -1.17 0.18 -1.11 0.00 0.00 177.39 176.45 1n24 n LEU 593 N -3.49 0.38 -0.00 -1.96 4.77 0.12 -4.75 117.00 112.08 1n24 n LEU 593 Ca -0.34 -0.02 0.05 0.00 -0.03 0.00 0.00 56.01 55.67 1n24 n LEU 593 Cb 1.03 0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 42.37 1n24 n LEU 593 CO 0.40 0.54 -0.14 0.49 -1.33 0.00 0.00 177.39 177.35 1n24 n PHE 594 N -2.79 0.00 -3.96 -1.77 0.99 0.48 -4.79 117.46 105.61 1n24 n PHE 594 Ca -0.34 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 56.77 1n24 n PHE 594 Cb 1.12 -0.05 -0.14 0.00 -1.00 0.00 0.00 39.48 39.41 1n24 n PHE 594 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 1n24 s GLU 595 N -2.07 3.01 0.85 -1.08 2.02 -0.58 -5.01 118.70 115.84 1n24 s GLU 595 Ca 0.02 -0.86 -0.12 0.00 0.02 0.00 0.00 54.97 54.03 1n24 s GLU 595 Cb 0.07 -2.96 0.11 0.00 0.10 0.00 0.00 34.13 31.45 1n24 s GLU 595 CO 0.40 -0.33 1.17 -2.14 0.02 0.00 0.00 175.26 174.38 1n24 s PRO 596 N 1.37 1.42 -0.54 0.39 0.02 -1.26 -4.71 135.00 131.68 1n24 s PRO 596 Ca 0.02 1.61 -0.22 0.00 0.02 0.00 0.00 61.00 62.44 1n24 s PRO 596 Cb -0.16 -1.77 0.05 0.00 0.02 0.00 0.00 34.50 32.65 1n24 s PRO 596 CO -0.05 -2.35 0.80 -0.47 -0.33 0.00 0.00 177.00 174.61 1n24 s TYR 597 N -2.44 2.90 -1.56 6.54 5.04 -1.26 -5.11 117.35 121.45 1n24 s TYR 597 Ca 0.69 -0.32 0.00 0.00 -2.44 0.00 0.00 57.07 55.00 1n24 s TYR 597 Cb -0.25 -3.87 0.00 0.00 0.35 0.00 0.00 41.96 38.19 1n24 s TYR 597 CO 0.54 -1.25 0.39 0.00 -1.34 0.00 0.00 175.55 173.90