#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cvx h LEU 77 N 0.00 0.00 -1.67 1.09 5.85 -2.04 -3.38 115.31 115.16 2cvx h LEU 77 Ca 0.00 0.00 0.22 0.00 0.84 0.00 0.00 57.88 58.94 2cvx h LEU 77 Cb 0.00 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2cvx h LEU 77 CO 0.00 0.98 0.79 0.00 -0.34 0.00 0.00 178.44 179.87 2cvx h ALA 78 N 1.02 2.58 0.54 1.25 0.00 -2.01 -1.77 119.26 120.87 2cvx h ALA 78 Ca -0.27 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2cvx h ALA 78 Cb 1.99 0.06 0.01 0.00 0.00 0.00 0.00 17.79 19.84 2cvx h ALA 78 CO 0.08 -1.18 -0.26 0.00 0.00 0.00 0.00 179.25 177.89 2cvx h ALA 79 N 1.14 -0.73 0.00 0.00 0.00 -1.91 0.16 119.26 117.93 2cvx h ALA 79 Ca 0.36 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2cvx h ALA 79 Cb 1.94 0.28 0.00 0.00 0.00 0.00 0.00 17.79 20.01 2cvx h ALA 79 CO -0.00 -0.72 0.00 -2.13 0.00 0.00 0.00 179.25 176.39 2cvx n ARG 80 N -5.28 0.47 0.02 0.00 0.63 -0.67 -2.45 116.66 109.37 2cvx n ARG 80 Ca -0.10 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.83 2cvx n ARG 80 Cb 0.32 -1.24 0.00 0.00 0.45 0.00 0.00 32.46 31.99 2cvx n ARG 80 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 2cvx n ILE 81 N 0.32 0.23 0.17 5.15 2.08 -1.13 -4.69 119.36 121.48 2cvx n ILE 81 Ca 0.00 0.08 0.03 0.00 0.56 0.00 0.00 62.75 63.42 2cvx n ILE 81 Cb 0.13 -0.90 0.42 0.00 -0.75 0.00 0.00 39.64 38.54 2cvx n ILE 81 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2cvx h ALA 82 N 0.00 1.55 -0.11 -1.39 0.00 -0.98 -1.65 119.26 116.69 2cvx h ALA 82 Ca 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2cvx h ALA 82 Cb 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2cvx h ALA 82 CO 0.00 0.33 -0.16 0.82 0.00 0.00 0.00 179.25 180.23 2cvx h ILE 83 N 0.11 1.38 -0.87 0.00 2.04 -1.68 -2.90 117.51 115.59 2cvx h ILE 83 Ca 0.02 -1.41 0.09 0.00 1.00 0.00 0.00 64.86 64.56 2cvx h ILE 83 Cb 0.41 2.05 -0.06 0.00 -0.74 0.00 0.00 36.82 38.48 2cvx h ILE 83 CO 0.03 0.40 0.56 -1.28 0.00 0.00 0.00 178.15 177.87 2cvx h SER 84 N -0.13 0.79 -0.18 1.72 0.87 -1.60 -1.27 113.55 113.74 2cvx h SER 84 Ca 0.01 0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.49 2cvx h SER 84 Cb 0.73 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.53 2cvx h SER 84 CO 0.04 0.47 -0.20 0.78 -0.53 0.00 0.00 176.83 177.39 2cvx h ASN 85 N 0.88 0.62 -0.35 6.23 2.35 -1.36 -2.43 115.58 121.52 2cvx h ASN 85 Ca 0.40 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 2cvx h ASN 85 Cb 0.37 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 2cvx h ASN 85 CO -0.16 0.82 0.20 0.25 -1.65 0.00 0.00 177.43 176.88 2cvx h LEU 86 N 0.55 0.43 -0.74 1.61 5.85 -1.06 -2.46 115.31 119.49 2cvx h LEU 86 Ca 0.08 -0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.84 2cvx h LEU 86 Cb 0.65 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.49 2cvx h LEU 86 CO 0.05 0.38 0.35 0.45 -0.34 0.00 0.00 178.44 179.33 2cvx h HIS 87 N 0.44 0.62 0.00 1.25 3.86 -1.08 -0.70 115.15 119.53 2cvx h HIS 87 Ca 0.12 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.31 2cvx h HIS 87 Cb 0.04 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 2cvx h HIS 87 CO -0.03 0.17 -0.26 0.87 0.86 0.00 0.00 177.93 179.54 2cvx h LYS 88 N 0.56 0.00 -0.13 2.45 1.57 -1.25 -3.12 116.57 116.65 2cvx h LYS 88 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 2cvx h LYS 88 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2cvx h LYS 88 CO -0.32 0.26 0.00 1.04 -0.57 0.00 0.00 179.45 179.86 2cvx n GLN 89 N -4.18 2.03 -4.55 3.15 6.02 -0.62 -4.95 117.38 114.28 2cvx n GLN 89 Ca -0.02 -1.87 -0.26 0.00 -0.01 0.00 0.00 57.00 54.83 2cvx n GLN 89 Cb 0.32 -1.42 -0.14 0.00 1.02 0.00 0.00 30.24 30.03 2cvx n GLN 89 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2cvx s THR 90 N -1.61 1.83 0.45 5.09 2.01 -0.37 -4.99 115.64 118.05 2cvx s THR 90 Ca 0.27 -1.39 -0.25 0.00 0.31 0.00 0.00 61.69 60.63 2cvx s THR 90 Cb 0.18 -1.61 -0.08 0.00 0.01 0.00 0.00 72.50 71.01 2cvx s THR 90 CO 0.27 0.14 1.40 -0.89 -0.69 0.00 0.00 174.62 174.84 2cvx s THR 91 N -0.93 2.18 -0.10 -0.82 2.01 -1.26 -4.84 115.64 111.87 2cvx s THR 91 Ca 0.09 0.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.12 2cvx s THR 91 Cb -0.09 -3.09 -0.10 0.00 0.01 0.00 0.00 72.50 69.22 2cvx s THR 91 CO 0.03 0.02 0.38 0.50 -0.69 0.00 0.00 174.62 174.86 2cvx h LYS 92 N 2.32 -0.06 -6.26 4.92 3.64 -1.98 -3.46 116.57 115.69 2cvx h LYS 92 Ca -0.51 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.32 2cvx h LYS 92 Cb 1.26 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.08 2cvx h LYS 92 CO 0.61 0.31 1.15 -1.14 -2.27 0.00 0.00 179.45 178.11 2cvx s GLN 93 N -2.09 3.88 0.16 1.90 0.74 -1.26 -4.92 119.66 118.06 2cvx s GLN 93 Ca -0.08 1.89 -0.25 0.00 0.05 0.00 0.00 55.36 56.97 2cvx s GLN 93 Cb -0.01 -4.05 0.02 0.00 1.10 0.00 0.00 33.01 30.08 2cvx s GLN 93 CO 0.28 -1.20 1.59 0.35 -0.55 0.00 0.00 175.29 175.77 2cvx h PHE 94 N 10.66 -1.02 0.00 1.67 3.57 -1.89 0.38 116.94 130.30 2cvx h PHE 94 Ca -0.37 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.19 2cvx h PHE 94 Cb 1.17 0.50 0.00 0.00 2.79 0.00 0.00 35.95 40.41 2cvx h PHE 94 CO 0.91 -0.41 0.06 0.66 -2.23 0.00 0.00 178.31 177.29 2cvx h SER 95 N -0.31 0.00 0.23 0.41 4.64 -1.91 -0.04 113.55 116.57 2cvx h SER 95 Ca 0.14 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.12 2cvx h SER 95 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2cvx h SER 95 CO -0.51 0.00 -1.82 0.50 -0.87 0.00 0.00 176.83 174.13 2cvx h LYS 96 N 0.00 0.28 -0.89 4.77 1.63 -1.35 -1.40 116.57 119.62 2cvx h LYS 96 Ca 0.00 -0.48 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 2cvx h LYS 96 Cb 0.12 0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 2cvx h LYS 96 CO 0.00 1.17 0.56 0.28 -3.45 0.00 0.00 179.45 178.01 2cvx h VAL 97 N 0.08 1.24 -0.20 2.00 2.07 -0.47 -0.76 116.25 120.21 2cvx h VAL 97 Ca -0.36 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 66.69 2cvx h VAL 97 Cb 2.05 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 2cvx h VAL 97 CO 0.13 0.24 0.10 0.58 0.02 0.00 0.00 177.57 178.64 2cvx h VAL 98 N 1.22 1.00 -0.25 2.57 2.07 -1.08 0.39 116.25 122.17 2cvx h VAL 98 Ca 0.32 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.82 2cvx h VAL 98 Cb -0.09 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 2cvx h VAL 98 CO -0.06 0.04 -0.06 -0.08 0.02 0.00 0.00 177.57 177.42 2cvx h GLU 99 N 0.21 0.00 -0.08 1.57 4.57 -1.02 1.00 114.58 120.84 2cvx h GLU 99 Ca 0.08 -0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.29 2cvx h GLU 99 Cb 0.01 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.56 2cvx h GLU 99 CO -0.05 0.00 -0.15 -0.44 -1.18 0.00 0.00 179.01 177.19 2cvx h ASP 100 N 0.00 -0.45 -0.88 1.04 3.45 -0.77 -0.33 116.42 118.48 2cvx h ASP 100 Ca 0.12 0.08 0.06 0.00 0.43 0.00 0.00 57.03 57.72 2cvx h ASP 100 Cb 0.18 0.21 -0.06 0.00 -0.56 0.00 0.00 39.33 39.09 2cvx h ASP 100 CO -0.25 -0.20 0.55 -0.07 -1.57 0.00 0.00 179.24 177.70 2cvx h LEU 101 N -0.21 0.87 -0.74 1.55 3.38 -0.71 -2.77 115.31 116.70 2cvx h LEU 101 Ca 0.08 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 2cvx h LEU 101 Cb 0.31 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2cvx h LEU 101 CO -0.20 0.56 -0.61 0.22 0.09 0.00 0.00 178.44 178.49 2cvx h TYR 102 N 1.00 0.10 -0.31 1.13 3.20 -0.06 -1.44 116.97 120.59 2cvx h TYR 102 Ca 0.38 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.21 2cvx h TYR 102 Cb 0.16 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.41 2cvx h TYR 102 CO -0.03 0.67 0.00 0.54 -1.64 0.00 0.00 178.16 177.70 2cvx n ARG 103 N -3.83 2.36 -1.77 1.82 5.12 -0.20 -4.31 116.66 115.84 2cvx n ARG 103 Ca -0.02 -2.05 -0.41 0.00 -1.93 0.00 0.00 57.85 53.45 2cvx n ARG 103 Cb 0.61 -1.49 -0.00 0.00 -1.16 0.00 0.00 32.46 30.42 2cvx n ARG 103 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2cvx n TYR 104 N 1.28 3.01 -4.82 -1.55 9.36 -1.06 -4.89 117.16 118.49 2cvx n TYR 104 Ca 0.18 0.41 -0.27 0.00 3.32 0.00 0.00 57.90 61.54 2cvx n TYR 104 Cb 0.56 -2.55 -0.16 0.00 -0.63 0.00 0.00 39.34 36.56 2cvx n TYR 104 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2cvx s VAL 105 N -0.93 1.44 -0.34 2.97 1.01 -1.26 -0.96 120.40 122.33 2cvx s VAL 105 Ca 0.55 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 2cvx s VAL 105 Cb -0.47 -1.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 2cvx s VAL 105 CO 0.61 0.42 1.69 0.21 0.00 0.00 0.00 175.10 178.03 2cvx s ASN 106 N 0.33 6.04 0.28 3.32 3.84 0.11 -4.84 114.94 124.01 2cvx s ASN 106 Ca -0.11 1.20 -0.03 0.00 0.21 0.00 0.00 52.86 54.13 2cvx s ASN 106 Cb -0.14 -2.53 0.37 0.00 -0.55 0.00 0.00 41.25 38.40 2cvx s ASN 106 CO 0.04 -1.61 1.87 0.00 -2.79 0.00 0.00 177.10 174.61 2cvx h ALA 107 N 12.18 1.26 0.00 1.71 0.00 -1.96 0.15 119.26 132.59 2cvx h ALA 107 Ca -0.32 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2cvx h ALA 107 Cb 1.15 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2cvx h ALA 107 CO 1.04 0.57 -0.06 0.00 0.00 0.00 0.00 179.25 180.80 2cvx h ALA 108 N 1.36 1.10 0.00 0.00 0.00 -1.97 -3.18 119.26 116.57 2cvx h ALA 108 Ca 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2cvx h ALA 108 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2cvx h ALA 108 CO -0.03 0.08 0.00 -2.37 0.00 0.00 0.00 179.25 176.93 2cvx n THR 109 N -3.31 0.00 -1.76 0.00 5.66 -1.12 -5.01 114.28 108.73 2cvx n THR 109 Ca -0.01 -0.37 -0.15 0.00 -3.05 0.00 0.00 64.05 60.46 2cvx n THR 109 Cb 0.24 1.05 -0.04 0.00 -1.55 0.00 0.00 70.33 70.03 2cvx n THR 109 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2cvx n GLY 110 N 0.59 0.86 3.75 1.09 0.00 0.50 -5.00 105.19 106.98 2cvx n GLY 110 Ca 0.00 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 2cvx n GLY 110 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cvx s LYS 111 N -3.84 4.27 -0.06 1.61 2.20 -1.09 -4.87 119.74 117.96 2cvx s LYS 111 Ca 0.00 0.49 -0.30 0.00 -0.36 0.00 0.00 55.97 55.80 2cvx s LYS 111 Cb 0.00 -3.39 -0.06 0.00 -1.51 0.00 0.00 37.83 32.87 2cvx s LYS 111 CO 0.00 0.27 1.79 -2.14 -0.36 0.00 0.00 175.35 174.92 2cvx s PRO 112 N 0.23 4.05 -0.55 4.03 0.02 -1.26 0.07 135.00 141.58 2cvx s PRO 112 Ca 0.26 2.26 0.07 0.00 0.02 0.00 0.00 61.00 63.60 2cvx s PRO 112 Cb -0.16 -4.08 0.30 0.00 0.02 0.00 0.00 34.50 30.59 2cvx s PRO 112 CO 0.12 -1.02 0.81 0.00 -0.33 0.00 0.00 177.00 176.58 2cvx n ALA 113 N 7.74 3.90 -1.76 -1.55 0.00 -0.13 -4.86 120.51 123.85 2cvx n ALA 113 Ca 0.19 -4.43 -0.41 0.00 0.00 0.00 0.00 53.44 48.79 2cvx n ALA 113 Cb 0.43 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.04 2cvx n ALA 113 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2cvx s PRO 114 N -2.79 4.11 0.00 0.00 0.04 -1.25 -4.62 135.00 130.50 2cvx s PRO 114 Ca 0.43 2.59 0.18 0.00 0.04 0.00 0.00 61.00 64.25 2cvx s PRO 114 Cb 0.24 -3.01 0.33 0.00 0.04 0.00 0.00 34.50 32.10 2cvx s PRO 114 CO -0.09 -0.62 1.26 -1.33 0.04 0.00 0.00 177.00 176.26 2cvx n MET 115 N 1.76 2.18 -4.51 4.56 2.81 -0.55 -4.68 117.12 118.70 2cvx n MET 115 Ca 0.07 -2.01 -0.22 0.00 -1.81 0.00 0.00 57.70 53.72 2cvx n MET 115 Cb 0.38 -1.40 -0.15 0.00 -0.71 0.00 0.00 33.22 31.33 2cvx n MET 115 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2cvx s ILE 116 N -1.28 0.95 0.59 2.02 -1.09 -1.26 -4.38 121.20 116.74 2cvx s ILE 116 Ca 0.30 -0.46 -0.19 0.00 -2.23 0.00 0.00 60.65 58.07 2cvx s ILE 116 Cb 0.18 -0.83 -0.04 0.00 -1.58 0.00 0.00 42.46 40.19 2cvx s ILE 116 CO 0.25 0.28 1.19 -0.94 -1.23 0.00 0.00 174.94 174.49 2cvx s SER 117 N 0.07 5.27 0.28 3.58 1.04 -0.96 -4.55 113.70 118.44 2cvx s SER 117 Ca -0.02 2.33 0.02 0.00 0.48 0.00 0.00 55.95 58.76 2cvx s SER 117 Cb -0.08 -2.59 0.66 0.00 0.10 0.00 0.00 66.02 64.10 2cvx s SER 117 CO 0.01 -1.54 1.70 0.44 0.98 0.00 0.00 173.24 174.83 2cvx h ASP 118 N 0.89 0.31 0.19 7.02 3.45 -1.94 -0.43 116.42 125.92 2cvx h ASP 118 Ca -0.50 0.14 -0.01 0.00 0.43 0.00 0.00 57.03 57.09 2cvx h ASP 118 Cb 1.29 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 40.19 2cvx h ASP 118 CO 0.55 0.03 -0.09 -0.78 -1.57 0.00 0.00 179.24 177.38 2cvx h ASP 119 N 0.41 -0.21 -0.04 6.45 -0.00 -1.97 -1.06 116.42 120.00 2cvx h ASP 119 Ca 0.52 -0.07 -0.14 0.00 -0.00 0.00 0.00 57.03 57.35 2cvx h ASP 119 Cb 0.95 0.06 -0.01 0.00 -0.00 0.00 0.00 39.33 40.32 2cvx h ASP 119 CO -0.50 -0.07 -0.43 0.58 -0.00 0.00 0.00 179.24 178.83 2cvx h VAL 120 N -0.35 1.30 -0.09 2.25 2.07 -1.79 -2.12 116.25 117.53 2cvx h VAL 120 Ca -0.03 -1.61 0.02 0.00 0.82 0.00 0.00 66.70 65.90 2cvx h VAL 120 Cb 0.27 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 2cvx h VAL 120 CO 0.04 0.51 -0.02 0.22 0.02 0.00 0.00 177.57 178.34 2cvx h TYR 121 N 0.46 -0.03 -0.77 1.57 3.20 -0.88 -0.74 116.97 119.78 2cvx h TYR 121 Ca 0.04 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 2cvx h TYR 121 Cb 0.94 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.20 2cvx h TYR 121 CO 0.04 -0.03 0.27 -0.91 -1.64 0.00 0.00 178.16 175.89 2cvx h ASN 122 N 0.01 1.09 -0.41 -2.11 2.35 -1.11 -1.34 115.58 114.07 2cvx h ASN 122 Ca 0.04 -0.19 0.04 0.00 -0.55 0.00 0.00 56.30 55.64 2cvx h ASN 122 Cb 0.06 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 38.10 2cvx h ASN 122 CO -0.08 0.99 0.18 0.40 -1.65 0.00 0.00 177.43 177.27 2cvx h ILE 123 N 1.13 0.92 -0.64 2.81 2.04 -1.11 -1.42 117.51 121.24 2cvx h ILE 123 Ca 0.25 -0.12 -0.07 0.00 1.00 0.00 0.00 64.86 65.92 2cvx h ILE 123 Cb 0.27 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 2cvx h ILE 123 CO -0.01 0.07 0.13 0.58 0.00 0.00 0.00 178.15 178.91 2cvx h VAL 124 N 0.36 1.26 -0.56 1.67 2.07 -0.71 -2.89 116.25 117.45 2cvx h VAL 124 Ca 0.18 -0.98 -0.10 0.00 0.82 0.00 0.00 66.70 66.62 2cvx h VAL 124 Cb 0.13 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2cvx h VAL 124 CO -0.16 0.37 -0.05 0.24 0.02 0.00 0.00 177.57 177.99 2cvx h MET 125 N 0.97 1.01 0.00 1.57 2.86 -1.00 -1.55 114.93 118.78 2cvx h MET 125 Ca 0.20 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2cvx h MET 125 Cb 0.40 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2cvx h MET 125 CO 0.01 1.02 0.00 0.39 1.06 0.00 0.00 176.91 179.39 2cvx n GLU 126 N -4.16 0.73 -1.31 1.72 1.02 -0.56 -3.57 120.64 114.51 2cvx n GLU 126 Ca 0.02 0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 2cvx n GLU 126 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 2cvx n GLU 126 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2cvx n ASN 127 N -1.07 0.59 -0.12 1.62 4.13 -1.00 -4.98 115.26 114.42 2cvx n ASN 127 Ca 0.18 -1.98 -0.08 0.00 1.68 0.00 0.00 54.58 54.38 2cvx n ASN 127 Cb 0.12 -0.20 -0.00 0.00 -1.54 0.00 0.00 39.78 38.17 2cvx n ASN 127 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 2cvx h LYS 128 N 0.74 0.53 -0.02 3.52 2.10 -1.34 -2.13 116.57 119.96 2cvx h LYS 128 Ca -0.26 -0.04 0.01 0.00 -2.00 0.00 0.00 60.65 58.37 2cvx h LYS 128 Cb 1.76 -0.11 -0.02 0.00 -0.90 0.00 0.00 32.23 32.96 2cvx h LYS 128 CO 0.03 0.37 -0.06 -0.44 -2.00 0.00 0.00 179.45 177.36 2cvx h ASP 129 N 0.52 -0.16 0.70 7.07 3.32 -1.91 0.15 116.42 126.11 2cvx h ASP 129 Ca 0.14 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 2cvx h ASP 129 Cb -0.02 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 2cvx h ASP 129 CO -0.03 -0.08 -0.42 0.50 -1.72 0.00 0.00 179.24 177.49 2cvx h LYS 130 N -0.09 -1.01 -0.31 3.56 3.64 -1.94 -0.28 116.57 120.14 2cvx h LYS 130 Ca 0.03 0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2cvx h LYS 130 Cb 0.13 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2cvx h LYS 130 CO -0.08 -0.68 0.18 -0.07 -2.27 0.00 0.00 179.45 176.54 2cvx h LEU 131 N -1.05 0.38 -0.48 5.20 -0.00 -1.36 0.14 115.31 118.13 2cvx h LEU 131 Ca -0.09 -0.07 0.08 0.00 -0.00 0.00 0.00 57.88 57.80 2cvx h LEU 131 Cb 0.84 -0.10 -0.07 0.00 -0.00 0.00 0.00 40.66 41.34 2cvx h LEU 131 CO 0.10 0.34 0.10 0.78 -0.00 0.00 0.00 178.44 179.76 2cvx h ASN 132 N 0.39 0.01 1.59 -0.43 2.35 -0.67 -2.78 115.58 116.04 2cvx h ASN 132 Ca 0.11 0.09 -0.06 0.00 -0.55 0.00 0.00 56.30 55.88 2cvx h ASN 132 Cb 0.03 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2cvx h ASN 132 CO -0.02 0.03 -0.30 0.77 -1.65 0.00 0.00 177.43 176.27 2cvx h SER 133 N 0.23 0.00 0.45 5.81 4.64 -0.72 -3.16 113.55 120.81 2cvx h SER 133 Ca 0.24 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.54 2cvx h SER 133 Cb 0.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2cvx h SER 133 CO -0.31 0.30 -0.10 0.00 -0.87 0.00 0.00 176.83 175.84 2cvx h ALA 134 N 1.70 1.20 -2.29 5.18 0.00 -0.68 -3.45 119.26 120.92 2cvx h ALA 134 Ca -0.00 -0.09 -0.56 0.00 0.00 0.00 0.00 54.91 54.26 2cvx h ALA 134 Cb 1.17 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2cvx h ALA 134 CO 0.04 0.12 0.52 0.42 0.00 0.00 0.00 179.25 180.35 2cvx s ILE 135 N -4.09 4.81 -0.49 0.00 1.01 -1.20 -5.02 121.20 116.23 2cvx s ILE 135 Ca -0.02 1.95 -0.12 0.00 0.00 0.00 0.00 60.65 62.46 2cvx s ILE 135 Cb 0.12 -4.27 0.11 0.00 0.01 0.00 0.00 42.46 38.43 2cvx s ILE 135 CO 0.56 0.01 0.40 -0.69 0.00 0.00 0.00 174.94 175.22 2cvx s VAL 136 N 2.01 4.68 -0.44 2.92 1.01 -1.26 -4.95 120.40 124.36 2cvx s VAL 136 Ca 0.46 -1.56 0.25 0.00 0.00 0.00 0.00 61.98 61.13 2cvx s VAL 136 Cb -0.18 -3.99 0.27 0.00 0.00 0.00 0.00 36.38 32.48 2cvx s VAL 136 CO 0.17 -0.76 1.75 1.88 0.00 0.00 0.00 175.10 178.14 2cvx h TYR 137 N 8.63 0.00 -0.25 5.22 -1.99 -1.99 -1.78 116.97 124.82 2cvx h TYR 137 Ca -0.25 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.55 2cvx h TYR 137 Cb 1.09 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.81 2cvx h TYR 137 CO 0.67 0.00 0.18 0.22 -0.00 0.00 0.00 178.16 179.23 2cvx h ASP 138 N 0.00 0.00 0.57 3.88 -0.00 -2.03 -2.00 116.42 116.85 2cvx h ASP 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 2cvx h ASP 138 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.76 2cvx h ASP 138 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 179.24 179.78 2cvx n ARG 139 N -4.41 0.06 0.18 0.28 1.74 -0.67 -1.83 116.66 112.01 2cvx n ARG 139 Ca 0.03 0.30 0.13 0.00 -0.77 0.00 0.00 57.85 57.53 2cvx n ARG 139 Cb 0.34 -1.61 0.65 0.00 -1.02 0.00 0.00 32.46 30.82 2cvx n ARG 139 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2cvx h ASP 140 N 0.00 0.00 -0.56 0.55 3.45 -1.55 -1.71 116.42 116.59 2cvx h ASP 140 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2cvx h ASP 140 Cb 0.29 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.06 2cvx h ASP 140 CO 0.00 0.00 0.00 0.49 -1.57 0.00 0.00 179.24 178.16 2cvx n PHE 141 N -2.39 1.16 0.50 4.55 3.72 -0.76 -3.67 117.46 120.57 2cvx n PHE 141 Ca -0.01 -0.48 0.13 0.00 -0.05 0.00 0.00 57.45 57.04 2cvx n PHE 141 Cb 0.09 -0.17 0.37 0.00 -0.94 0.00 0.00 39.48 38.83 2cvx n PHE 141 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2cvx h GLN 142 N 3.47 0.00 -5.60 -1.08 1.08 -1.51 -3.46 115.11 108.01 2cvx h GLN 142 Ca 0.00 0.00 -0.60 0.00 -1.45 0.00 0.00 58.65 56.60 2cvx h GLN 142 Cb 1.16 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 28.50 2cvx h GLN 142 CO 0.15 0.00 -0.32 0.71 -0.95 0.00 0.00 178.83 178.43 2cvx s TYR 143 N -3.16 3.52 0.62 2.96 1.51 -1.24 -4.96 117.35 116.60 2cvx s TYR 143 Ca 0.09 0.66 -0.11 0.00 -1.01 0.00 0.00 57.07 56.70 2cvx s TYR 143 Cb 0.10 -2.29 0.15 0.00 -0.11 0.00 0.00 41.96 39.81 2cvx s TYR 143 CO 0.59 0.36 0.78 -1.13 -1.11 0.00 0.00 175.55 175.04 2cvx n SER 144 N 3.12 -0.31 0.36 2.29 3.41 -1.26 -4.70 113.62 116.52 2cvx n SER 144 Ca -0.13 -1.21 -0.14 0.00 -0.26 0.00 0.00 58.87 57.13 2cvx n SER 144 Cb 0.52 -0.61 -0.07 0.00 -0.26 0.00 0.00 64.21 63.79 2cvx n SER 144 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 2cvx h TYR 145 N -1.63 -0.86 0.00 7.33 -0.00 -1.95 0.21 116.97 120.07 2cvx h TYR 145 Ca -0.26 -0.02 -0.07 0.00 0.00 0.00 0.00 58.73 58.38 2cvx h TYR 145 Cb 0.73 0.29 -0.01 0.00 0.00 0.00 0.00 36.73 37.73 2cvx h TYR 145 CO 0.00 -0.54 -0.32 0.27 -0.00 0.00 0.00 178.16 177.57 2cvx h PHE 146 N -1.09 0.00 0.03 0.10 -0.00 -1.95 -1.24 116.94 112.78 2cvx h PHE 146 Ca -0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.87 2cvx h PHE 146 Cb 0.71 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.67 2cvx h PHE 146 CO 0.03 0.32 -0.01 0.78 -0.00 0.00 0.00 178.31 179.43 2cvx h GLY 147 N 1.63 -0.04 1.60 6.09 0.00 -1.65 -0.40 103.07 110.31 2cvx h GLY 147 Ca -0.00 0.01 -0.13 0.00 0.00 0.00 0.00 47.33 47.21 2cvx h GLY 147 CO 0.04 -0.01 -0.43 -2.75 0.00 0.00 0.00 176.54 173.39 2cvx h PHE 148 N -0.24 0.52 -0.11 5.60 3.57 -0.49 -2.75 116.94 123.05 2cvx h PHE 148 Ca -0.00 -0.15 -0.07 0.00 3.53 0.00 0.00 57.97 61.27 2cvx h PHE 148 Cb 0.22 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 2cvx h PHE 148 CO -0.01 0.80 -0.25 0.87 -2.23 0.00 0.00 178.31 177.49 2cvx h LYS 149 N 0.36 0.18 -0.32 1.11 1.79 -1.13 -0.41 116.57 118.15 2cvx h LYS 149 Ca 0.03 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 2cvx h LYS 149 Cb 0.90 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.52 2cvx h LYS 149 CO 0.08 0.43 0.04 1.15 -1.08 0.00 0.00 179.45 180.07 2cvx h THR 150 N 0.17 1.24 -0.23 -0.16 2.02 -0.90 -1.92 112.91 113.13 2cvx h THR 150 Ca 0.03 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.36 2cvx h THR 150 Cb 0.53 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2cvx h THR 150 CO 0.04 0.28 0.14 -0.07 0.37 0.00 0.00 175.52 176.28 2cvx h LEU 151 N 0.36 0.28 -0.17 2.58 3.38 -1.22 -2.77 115.31 117.75 2cvx h LEU 151 Ca 0.10 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.04 2cvx h LEU 151 Cb 0.37 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2cvx h LEU 151 CO 0.01 0.23 0.09 -0.08 0.09 0.00 0.00 178.44 178.78 2cvx h GLU 152 N 0.30 0.19 -0.38 1.13 4.81 -1.04 0.14 114.58 119.72 2cvx h GLU 152 Ca 0.08 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2cvx h GLU 152 Cb 0.00 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 2cvx h GLU 152 CO -0.02 0.12 0.12 -0.09 -0.73 0.00 0.00 179.01 178.41 2cvx h ARG 153 N 0.19 0.60 0.00 1.92 9.65 -1.33 -3.40 114.38 122.02 2cvx h ARG 153 Ca 0.07 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 2cvx h ARG 153 Cb 0.01 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.50 2cvx h ARG 153 CO -0.04 0.61 -0.12 -1.13 2.80 0.00 0.00 179.97 182.09 2cvx n SER 154 N -4.61 0.59 -0.06 -3.80 3.41 -1.05 -4.95 113.62 103.16 2cvx n SER 154 Ca -0.01 -0.23 -0.13 0.00 -0.26 0.00 0.00 58.87 58.25 2cvx n SER 154 Cb 0.18 0.58 -0.04 0.00 -0.26 0.00 0.00 64.21 64.67 2cvx n SER 154 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2cvx n TYR 155 N -0.64 0.00 -1.69 7.33 4.02 0.31 -4.97 117.16 121.53 2cvx n TYR 155 Ca 0.00 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.45 2cvx n TYR 155 Cb 0.00 -0.47 -0.03 0.00 -0.02 0.00 0.00 39.34 38.82 2cvx n TYR 155 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2cvx n LEU 156 N -3.86 3.83 -4.74 7.72 4.77 -0.10 -4.79 117.00 119.83 2cvx n LEU 156 Ca -0.23 1.00 -0.39 0.00 -0.03 0.00 0.00 56.01 56.37 2cvx n LEU 156 Cb 0.56 -1.51 0.04 0.00 -2.33 0.00 0.00 43.42 40.19 2cvx n LEU 156 CO 0.06 0.08 0.98 0.18 -1.33 0.00 0.00 177.39 177.36 2cvx n LEU 157 N 5.35 5.44 -4.35 2.23 4.77 -1.26 -4.77 117.00 124.40 2cvx n LEU 157 Ca 0.18 0.99 -0.28 0.00 -0.03 0.00 0.00 56.01 56.87 2cvx n LEU 157 Cb 0.35 -1.58 -0.13 0.00 -2.33 0.00 0.00 43.42 39.73 2cvx n LEU 157 CO 0.66 -0.56 -0.56 -0.13 -1.33 0.00 0.00 177.39 175.48 2cvx s ARG 158 N -2.83 1.45 -0.09 3.23 0.52 -1.26 0.34 118.95 120.31 2cvx s ARG 158 Ca 0.70 -1.23 -0.08 0.00 -0.52 0.00 0.00 55.73 54.60 2cvx s ARG 158 Cb -0.42 -1.81 -0.03 0.00 0.52 0.00 0.00 34.95 33.21 2cvx s ARG 158 CO 0.50 0.44 -0.16 -0.89 0.02 0.00 0.00 175.30 175.21 2cvx n ILE 159 N 1.22 0.77 -3.32 1.52 5.41 0.40 -4.80 119.36 120.56 2cvx n ILE 159 Ca -0.18 0.32 -0.26 0.00 1.00 0.00 0.00 62.75 63.64 2cvx n ILE 159 Cb 0.53 -1.94 -0.07 0.00 -0.71 0.00 0.00 39.64 37.44 2cvx n ILE 159 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2cvx n ASN 160 N -3.50 2.52 0.00 4.38 3.02 -1.26 -4.81 115.26 115.61 2cvx n ASN 160 Ca -0.07 -3.19 0.00 0.00 -0.03 0.00 0.00 54.58 51.29 2cvx n ASN 160 Cb 0.24 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 2cvx n ASN 160 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cvx n GLY 161 N 0.98 1.14 3.81 7.41 0.00 -1.26 -4.96 105.19 112.31 2cvx n GLY 161 Ca 0.27 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 2cvx n GLY 161 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2cvx s GLN 162 N -0.14 3.83 0.08 1.61 0.74 -1.26 -5.05 119.66 119.47 2cvx s GLN 162 Ca 0.00 -0.03 -0.31 0.00 0.05 0.00 0.00 55.36 55.07 2cvx s GLN 162 Cb 0.00 -3.29 -0.09 0.00 1.10 0.00 0.00 33.01 30.73 2cvx s GLN 162 CO 0.00 0.55 1.68 0.08 -0.55 0.00 0.00 175.29 177.06 2cvx s VAL 163 N -0.43 2.97 -0.15 1.34 1.01 -1.26 -0.45 120.40 123.43 2cvx s VAL 163 Ca 0.15 0.42 0.19 0.00 0.00 0.00 0.00 61.98 62.73 2cvx s VAL 163 Cb -0.13 -3.27 -0.26 0.00 0.00 0.00 0.00 36.38 32.73 2cvx s VAL 163 CO 0.04 -0.00 0.26 0.00 0.00 0.00 0.00 175.10 175.40 2cvx n ALA 164 N 5.65 1.85 -2.83 5.51 0.00 0.15 -4.82 120.51 126.02 2cvx n ALA 164 Ca 0.16 -1.05 -0.33 0.00 0.00 0.00 0.00 53.44 52.22 2cvx n ALA 164 Cb 0.40 -0.42 -0.06 0.00 0.00 0.00 0.00 19.45 19.38 2cvx n ALA 164 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2cvx s GLU 165 N -2.78 3.21 0.35 0.00 2.02 -1.15 -4.68 118.70 115.67 2cvx s GLU 165 Ca -0.09 -0.43 -0.01 0.00 0.02 0.00 0.00 54.97 54.47 2cvx s GLU 165 Cb 0.08 -2.95 -0.03 0.00 0.10 0.00 0.00 34.13 31.33 2cvx s GLU 165 CO 0.85 0.65 0.57 1.03 0.02 0.00 0.00 175.26 178.38 2cvx s ARG 166 N -1.86 3.50 0.25 1.61 0.52 -1.26 -4.78 118.95 116.93 2cvx s ARG 166 Ca 0.25 -0.26 -0.04 0.00 -0.52 0.00 0.00 55.73 55.16 2cvx s ARG 166 Cb -0.12 -2.64 0.51 0.00 0.52 0.00 0.00 34.95 33.21 2cvx s ARG 166 CO 0.16 0.13 1.66 -1.35 0.02 0.00 0.00 175.30 175.92 2cvx h PRO 167 N 0.81 0.19 -0.85 3.54 0.11 -1.99 0.11 132.00 133.92 2cvx h PRO 167 Ca -0.49 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.71 2cvx h PRO 167 Cb 1.21 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.22 2cvx h PRO 167 CO 0.62 0.13 0.55 1.96 -0.21 0.00 0.00 178.00 181.05 2cvx h GLN 168 N 0.20 0.77 -0.18 1.05 1.08 -1.93 -0.58 115.11 115.52 2cvx h GLN 168 Ca 0.44 -0.05 -0.08 0.00 -1.45 0.00 0.00 58.65 57.52 2cvx h GLN 168 Cb 0.80 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 28.06 2cvx h GLN 168 CO -0.59 0.51 -0.19 0.45 -0.95 0.00 0.00 178.83 178.06 2cvx h HIS 169 N 0.79 0.53 -0.43 2.96 3.86 -1.21 -1.57 115.15 120.09 2cvx h HIS 169 Ca 0.40 -0.16 0.09 0.00 -1.16 0.00 0.00 60.37 59.54 2cvx h HIS 169 Cb 0.47 -0.11 -0.09 0.00 1.06 0.00 0.00 27.41 28.74 2cvx h HIS 169 CO -0.00 0.82 -0.16 1.25 0.86 0.00 0.00 177.93 180.70 2cvx h LEU 170 N 0.10 -0.55 -0.06 2.43 7.12 -0.85 0.25 115.31 123.75 2cvx h LEU 170 Ca 0.03 0.15 0.01 0.00 0.13 0.00 0.00 57.88 58.20 2cvx h LEU 170 Cb 0.73 0.33 -0.01 0.00 -0.53 0.00 0.00 40.66 41.17 2cvx h LEU 170 CO 0.05 -0.19 -0.01 0.40 -0.13 0.00 0.00 178.44 178.55 2cvx h ILE 171 N -0.06 0.94 -0.65 4.05 2.04 -0.96 0.33 117.51 123.19 2cvx h ILE 171 Ca 0.21 -0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.99 2cvx h ILE 171 Cb 0.39 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2cvx h ILE 171 CO -0.48 0.00 0.11 -0.03 0.00 0.00 0.00 178.15 177.75 2cvx h MET 172 N 0.00 1.07 -0.15 2.37 4.05 -1.08 -0.13 114.93 121.07 2cvx h MET 172 Ca 0.03 -0.28 0.03 0.00 -0.28 0.00 0.00 59.70 59.20 2cvx h MET 172 Cb 0.04 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.68 2cvx h MET 172 CO -0.06 0.98 -0.04 -0.09 0.23 0.00 0.00 176.91 177.93 2cvx h ARG 173 N 1.01 -0.01 -0.47 0.39 2.43 -0.54 -1.48 114.38 115.72 2cvx h ARG 173 Ca 0.20 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.44 2cvx h ARG 173 Cb 0.43 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.92 2cvx h ARG 173 CO 0.01 -0.00 0.14 0.28 -1.51 0.00 0.00 179.97 178.89 2cvx h VAL 174 N -0.01 0.81 -0.96 0.20 2.07 -0.56 0.28 116.25 118.09 2cvx h VAL 174 Ca 0.07 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2cvx h VAL 174 Cb 0.12 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 2cvx h VAL 174 CO -0.16 0.05 0.61 0.00 0.02 0.00 0.00 177.57 178.09 2cvx h ALA 175 N 1.33 1.21 -0.04 1.67 0.00 -0.59 -1.20 119.26 121.64 2cvx h ALA 175 Ca 0.23 -0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 2cvx h ALA 175 Cb 0.26 -0.39 0.01 0.00 0.00 0.00 0.00 17.79 17.67 2cvx h ALA 175 CO -0.25 0.64 -0.92 -0.07 0.00 0.00 0.00 179.25 178.65 2cvx h LEU 176 N 1.31 0.74 -1.55 0.00 4.07 -1.10 -1.68 115.31 117.10 2cvx h LEU 176 Ca 0.35 -0.55 0.05 0.00 0.08 0.00 0.00 57.88 57.80 2cvx h LEU 176 Cb -0.10 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.38 2cvx h LEU 176 CO -0.07 1.35 0.37 1.23 -1.08 0.00 0.00 178.44 180.23 2cvx h GLY 177 N 0.83 0.68 0.31 0.83 0.00 0.13 0.20 103.07 106.04 2cvx h GLY 177 Ca -0.08 -0.23 -0.14 0.00 0.00 0.00 0.00 47.33 46.88 2cvx h GLY 177 CO 0.17 0.19 -0.68 -2.22 0.00 0.00 0.00 176.54 174.00 2cvx h ILE 178 N 0.57 1.45 0.00 2.60 2.04 -1.24 -3.40 117.51 119.53 2cvx h ILE 178 Ca 0.23 -2.39 -0.10 0.00 1.00 0.00 0.00 64.86 63.60 2cvx h ILE 178 Cb 0.20 3.05 -0.02 0.00 -0.74 0.00 0.00 36.82 39.31 2cvx h ILE 178 CO -0.06 0.62 -1.75 1.41 0.00 0.00 0.00 178.15 178.37 2cvx n HIS 179 N -4.31 0.41 0.00 1.37 8.25 -0.63 -4.65 115.22 115.65 2cvx n HIS 179 Ca -0.17 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2cvx n HIS 179 Cb 0.69 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.99 2cvx n HIS 179 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cvx n GLY 180 N 1.36 3.61 0.28 -1.41 0.00 0.68 -2.81 105.19 106.90 2cvx n GLY 180 Ca -0.10 -0.09 0.19 0.00 0.00 0.00 0.00 46.02 46.02 2cvx n GLY 180 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2cvx h ARG 181 N 0.00 0.00 -5.86 1.61 2.47 -1.96 -3.37 114.38 107.27 2cvx h ARG 181 Ca 0.00 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 58.18 2cvx h ARG 181 Cb 0.00 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.24 2cvx h ARG 181 CO 0.00 0.00 1.56 0.34 0.56 0.00 0.00 179.97 182.43 2cvx s ASP 182 N -5.16 6.17 0.19 7.04 3.68 -1.12 -4.80 116.67 122.66 2cvx s ASP 182 Ca -0.02 -1.71 -0.06 0.00 2.13 0.00 0.00 52.55 52.89 2cvx s ASP 182 Cb 0.11 -2.58 0.10 0.00 -1.45 0.00 0.00 42.92 39.10 2cvx s ASP 182 CO 0.44 -1.84 1.55 0.40 0.13 0.00 0.00 175.17 175.85 2cvx h ILE 183 N 6.35 1.28 -0.56 4.11 5.03 -1.88 -2.16 117.51 129.68 2cvx h ILE 183 Ca 0.27 -1.51 0.00 0.00 -0.12 0.00 0.00 64.86 63.51 2cvx h ILE 183 Cb 0.95 1.39 -0.03 0.00 -3.03 0.00 0.00 36.82 36.10 2cvx h ILE 183 CO 1.37 0.50 0.35 -0.33 -0.68 0.00 0.00 178.15 179.36 2cvx h GLU 184 N 0.65 0.74 -0.89 2.37 4.39 -1.95 0.10 114.58 119.99 2cvx h GLU 184 Ca 0.06 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 2cvx h GLU 184 Cb 0.89 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 29.34 2cvx h GLU 184 CO 0.08 0.52 0.53 0.00 -1.16 0.00 0.00 179.01 178.97 2cvx h ALA 185 N 1.19 1.25 -0.53 3.43 0.00 -1.94 -1.55 119.26 121.10 2cvx h ALA 185 Ca 0.20 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2cvx h ALA 185 Cb -0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 2cvx h ALA 185 CO -0.04 0.64 0.09 0.00 0.00 0.00 0.00 179.25 179.93 2cvx h ALA 186 N 1.35 0.71 -0.62 0.00 0.00 -0.73 -1.29 119.26 118.67 2cvx h ALA 186 Ca 0.32 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2cvx h ALA 186 Cb -0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2cvx h ALA 186 CO -0.06 0.44 0.19 -0.07 0.00 0.00 0.00 179.25 179.76 2cvx h LEU 187 N 0.77 0.91 -0.17 0.00 4.07 -0.66 0.36 115.31 120.59 2cvx h LEU 187 Ca 0.16 -0.21 0.02 0.00 0.08 0.00 0.00 57.88 57.94 2cvx h LEU 187 Cb 0.40 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 2cvx h LEU 187 CO 0.01 0.88 0.02 -0.08 -1.08 0.00 0.00 178.44 178.19 2cvx h GLU 188 N 0.89 0.09 -0.67 1.13 4.81 -1.10 -1.14 114.58 118.58 2cvx h GLU 188 Ca 0.20 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 2cvx h GLU 188 Cb 0.30 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 2cvx h GLU 188 CO -0.01 0.06 0.19 1.15 -0.73 0.00 0.00 179.01 179.67 2cvx h THR 189 N 0.09 1.26 -0.21 0.32 2.02 -1.02 -1.67 112.91 113.69 2cvx h THR 189 Ca 0.08 -0.91 0.03 0.00 0.77 0.00 0.00 66.41 66.37 2cvx h THR 189 Cb 0.08 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 2cvx h THR 189 CO -0.11 0.35 0.02 0.22 0.37 0.00 0.00 175.52 176.37 2cvx h TYR 190 N 0.99 0.03 0.17 3.16 3.20 0.00 -1.46 116.97 123.06 2cvx h TYR 190 Ca 0.21 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 2cvx h TYR 190 Cb 0.33 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.62 2cvx h TYR 190 CO 0.03 -0.00 -0.08 -0.91 -1.64 0.00 0.00 178.16 175.55 2cvx h ASN 191 N 0.10 -0.19 -0.84 -2.11 2.35 -1.11 -1.10 115.58 112.68 2cvx h ASN 191 Ca 0.10 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 2cvx h ASN 191 Cb 0.11 0.05 -0.04 0.00 0.05 0.00 0.00 38.32 38.49 2cvx h ASN 191 CO -0.15 -0.11 0.48 -0.07 -1.65 0.00 0.00 177.43 175.93 2cvx h LEU 192 N -0.25 1.03 -0.24 1.61 3.38 -1.25 -0.34 115.31 119.25 2cvx h LEU 192 Ca -0.02 -0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.69 2cvx h LEU 192 Cb 0.20 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2cvx h LEU 192 CO 0.04 0.82 -0.52 0.24 0.09 0.00 0.00 178.44 179.11 2cvx h MET 193 N 1.16 0.77 -0.08 1.13 2.86 -1.25 0.80 114.93 120.33 2cvx h MET 193 Ca 0.30 -0.51 -0.10 0.00 -2.06 0.00 0.00 59.70 57.32 2cvx h MET 193 Cb 0.00 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2cvx h MET 193 CO -0.05 1.14 -0.42 0.66 1.06 0.00 0.00 176.91 179.29 2cvx h SER 194 N 0.52 0.19 -0.01 1.22 4.64 -1.03 -1.21 113.55 117.86 2cvx h SER 194 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2cvx h SER 194 Cb 1.13 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2cvx h SER 194 CO 0.11 0.60 0.00 0.18 -0.87 0.00 0.00 176.83 176.85 2cvx n LEU 195 N -4.02 0.43 -2.23 5.97 4.77 -0.15 -4.93 117.00 116.84 2cvx n LEU 195 Ca -0.02 -0.15 -0.15 0.00 -0.03 0.00 0.00 56.01 55.67 2cvx n LEU 195 Cb 0.48 -0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.60 2cvx n LEU 195 CO 0.41 0.07 0.07 0.29 -1.33 0.00 0.00 177.39 176.91 2cvx n LYS 196 N -0.65 -4.02 0.16 3.23 5.02 -0.46 -4.93 118.16 116.51 2cvx n LYS 196 Ca 0.22 0.56 0.04 0.00 -2.02 0.00 0.00 58.31 57.12 2cvx n LYS 196 Cb 0.18 -4.73 0.15 0.00 -0.02 0.00 0.00 35.03 30.61 2cvx n LYS 196 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 2cvx h TYR 197 N -1.27 0.00 -2.29 2.13 -1.99 -1.10 -3.42 116.97 109.03 2cvx h TYR 197 Ca -0.35 0.00 0.17 0.00 2.00 0.00 0.00 58.73 60.54 2cvx h TYR 197 Cb 1.24 0.00 -0.10 0.00 2.00 0.00 0.00 36.73 39.87 2cvx h TYR 197 CO 0.33 0.44 0.50 -0.59 -0.00 0.00 0.00 178.16 178.84 2cvx s PHE 198 N -3.20 -0.18 0.18 4.88 -0.71 -1.26 -1.77 117.98 115.93 2cvx s PHE 198 Ca 0.03 -0.07 -0.04 0.00 -1.04 0.00 0.00 56.93 55.80 2cvx s PHE 198 Cb 0.09 0.61 -0.03 0.00 -1.21 0.00 0.00 43.02 42.48 2cvx s PHE 198 CO 0.72 -0.73 0.20 -0.08 -1.34 0.00 0.00 175.22 173.98 2cvx s THR 199 N -3.21 0.04 0.17 -4.49 -1.32 -0.52 -4.43 115.64 101.88 2cvx s THR 199 Ca 0.10 -1.76 0.04 0.00 -1.21 0.00 0.00 61.69 58.86 2cvx s THR 199 Cb -0.01 -2.22 -0.03 0.00 -1.51 0.00 0.00 72.50 68.73 2cvx s THR 199 CO -0.01 -0.17 0.27 -1.00 -2.21 0.00 0.00 174.62 171.50 2cvx s HIS 200 N -4.07 3.40 0.83 9.09 3.76 -1.26 -1.46 115.29 125.58 2cvx s HIS 200 Ca 0.29 0.06 -0.13 0.00 -0.15 0.00 0.00 55.06 55.12 2cvx s HIS 200 Cb 0.05 -1.61 0.06 0.00 1.11 0.00 0.00 32.58 32.19 2cvx s HIS 200 CO 0.07 0.50 0.94 0.00 -0.85 0.00 0.00 174.74 175.40 2cvx n ALA 201 N -0.71 -0.80 -0.33 -1.40 0.00 -0.91 -4.56 120.51 111.80 2cvx n ALA 201 Ca -0.08 -0.38 0.01 0.00 0.00 0.00 0.00 53.44 53.00 2cvx n ALA 201 Cb 0.55 -2.09 0.08 0.00 0.00 0.00 0.00 19.45 17.98 2cvx n ALA 201 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cvx h SER 202 N -1.00 -1.09 0.39 0.00 0.02 -1.94 -1.21 113.55 108.73 2cvx h SER 202 Ca -0.45 0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.73 2cvx h SER 202 Cb 1.30 0.63 -0.01 0.00 0.14 0.00 0.00 62.40 64.47 2cvx h SER 202 CO 0.43 -0.30 -0.20 -0.65 -1.14 0.00 0.00 176.83 174.97 2cvx h PRO 203 N -0.02 0.00 -0.21 3.45 0.11 -1.88 0.14 132.00 133.59 2cvx h PRO 203 Ca 0.38 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.43 2cvx h PRO 203 Cb 0.63 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.73 2cvx h PRO 203 CO -0.92 0.20 -0.10 1.15 -0.21 0.00 0.00 178.00 178.13 2cvx h THR 204 N 0.00 1.30 -0.88 -1.15 2.02 -1.24 -1.02 112.91 111.94 2cvx h THR 204 Ca -0.00 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.03 2cvx h THR 204 Cb 0.45 1.61 -0.04 0.00 -1.74 0.00 0.00 68.15 68.43 2cvx h THR 204 CO 0.03 0.35 0.56 -0.07 0.37 0.00 0.00 175.52 176.76 2cvx h LEU 205 N 0.14 1.03 -0.31 2.58 3.38 -0.67 -0.48 115.31 120.98 2cvx h LEU 205 Ca 0.05 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2cvx h LEU 205 Cb 0.58 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2cvx h LEU 205 CO 0.03 0.77 -0.18 -0.26 0.09 0.00 0.00 178.44 178.89 2cvx h PHE 206 N 1.20 0.76 0.00 1.13 0.05 -0.73 -3.40 116.94 115.95 2cvx h PHE 206 Ca 0.32 -0.20 0.00 0.00 3.82 0.00 0.00 57.97 61.91 2cvx h PHE 206 Cb -0.10 -0.17 0.00 0.00 2.00 0.00 0.00 35.95 37.68 2cvx h PHE 206 CO -0.01 0.90 -0.59 0.09 -0.18 0.00 0.00 178.31 178.52 2cvx n ASN 207 N -4.36 1.34 -4.74 2.17 3.02 -0.39 -4.92 115.26 107.39 2cvx n ASN 207 Ca -0.03 -0.43 -0.42 0.00 -0.03 0.00 0.00 54.58 53.67 2cvx n ASN 207 Cb 0.40 1.09 -0.02 0.00 -0.61 0.00 0.00 39.78 40.63 2cvx n ASN 207 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cvx s ALA 208 N -1.82 3.78 0.00 5.41 0.00 -0.21 -1.52 121.76 127.41 2cvx s ALA 208 Ca 0.01 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.48 2cvx s ALA 208 Cb 0.04 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2cvx s ALA 208 CO 0.24 -0.90 0.00 0.41 0.00 0.00 0.00 175.76 175.51 2cvx n GLY 209 N 2.89 0.33 3.99 0.00 0.00 -1.26 -4.37 105.19 106.76 2cvx n GLY 209 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 2cvx n GLY 209 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cvx s THR 210 N -1.67 2.69 0.17 2.61 -4.23 -0.58 -2.26 115.64 112.38 2cvx s THR 210 Ca 0.00 -0.79 -0.14 0.00 -1.18 0.00 0.00 61.69 59.58 2cvx s THR 210 Cb 0.00 -2.91 0.06 0.00 1.34 0.00 0.00 72.50 70.99 2cvx s THR 210 CO 0.00 0.00 1.84 -0.65 -0.54 0.00 0.00 174.62 175.27 2cvx h PRO 211 N 0.21 0.69 -3.30 3.99 0.11 -1.80 -3.27 132.00 128.64 2cvx h PRO 211 Ca -0.40 -0.04 -0.64 0.00 0.11 0.00 0.00 66.00 65.03 2cvx h PRO 211 Cb 1.29 -0.15 -0.41 0.00 0.11 0.00 0.00 31.00 31.83 2cvx h PRO 211 CO 0.48 0.46 -0.60 0.15 -0.21 0.00 0.00 178.00 178.28 2cvx s LYS 212 N -6.14 2.16 -0.54 1.05 1.02 -1.26 -4.89 119.74 111.15 2cvx s LYS 212 Ca -0.13 -2.85 -0.28 0.00 0.02 0.00 0.00 55.97 52.73 2cvx s LYS 212 Cb 0.12 -3.37 0.01 0.00 -0.52 0.00 0.00 37.83 34.07 2cvx s LYS 212 CO 0.74 -1.17 1.40 -1.25 -0.92 0.00 0.00 175.35 174.16 2cvx s PRO 213 N -0.65 3.35 -0.52 -1.68 0.04 -1.23 -4.86 135.00 129.45 2cvx s PRO 213 Ca 0.19 0.51 -0.14 0.00 0.04 0.00 0.00 61.00 61.60 2cvx s PRO 213 Cb -0.19 -4.10 0.13 0.00 0.04 0.00 0.00 34.50 30.37 2cvx s PRO 213 CO -0.05 -1.87 0.46 -1.14 0.04 0.00 0.00 177.00 174.44 2cvx s GLN 214 N 5.39 2.86 0.00 4.56 -0.44 -1.26 0.40 119.66 131.16 2cvx s GLN 214 Ca 0.53 -1.73 0.15 0.00 -2.50 0.00 0.00 55.36 51.81 2cvx s GLN 214 Cb -0.11 -4.20 -0.07 0.00 -1.64 0.00 0.00 33.01 26.99 2cvx s GLN 214 CO 0.26 -1.29 0.77 -1.33 0.50 0.00 0.00 175.29 174.19 2cvx n MET 215 N 5.15 1.83 -2.61 1.67 2.81 -1.26 -4.61 117.12 120.10 2cvx n MET 215 Ca -0.12 -0.49 -0.37 0.00 -1.81 0.00 0.00 57.70 54.91 2cvx n MET 215 Cb 0.40 -1.24 -0.05 0.00 -0.71 0.00 0.00 33.22 31.62 2cvx n MET 215 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2cvx s SER 216 N -2.08 6.95 -0.15 7.83 0.01 -1.26 -3.36 113.70 121.64 2cvx s SER 216 Ca 0.10 2.00 0.18 0.00 1.31 0.00 0.00 55.95 59.54 2cvx s SER 216 Cb 0.12 -2.59 -0.26 0.00 0.21 0.00 0.00 66.02 63.50 2cvx s SER 216 CO 0.48 -0.35 0.17 -1.20 0.41 0.00 0.00 173.24 172.75 2cvx n SER 217 N 0.17 0.16 -4.11 2.44 7.64 -0.69 -4.59 113.62 114.63 2cvx n SER 217 Ca 0.04 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.67 2cvx n SER 217 Cb 0.49 1.24 -0.16 0.00 -1.01 0.00 0.00 64.21 64.78 2cvx n SER 217 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cvx s PHE 219 N -0.07 0.96 -0.25 0.00 0.40 -0.85 -1.73 117.98 116.44 2cvx s PHE 219 Ca -0.00 -0.32 -0.04 0.00 -0.60 0.00 0.00 56.93 55.97 2cvx s PHE 219 Cb -0.09 -0.81 0.01 0.00 0.51 0.00 0.00 43.02 42.64 2cvx s PHE 219 CO 0.01 -0.24 -0.01 -0.51 0.70 0.00 0.00 175.22 175.17 2cvx s LEU 220 N 0.96 3.30 -0.15 -0.37 1.43 0.57 -0.89 118.68 123.54 2cvx s LEU 220 Ca -0.10 -0.69 -0.03 0.00 -1.03 0.00 0.00 54.13 52.28 2cvx s LEU 220 Cb -0.14 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 2cvx s LEU 220 CO 0.00 -0.12 -0.05 -0.69 0.23 0.00 0.00 176.35 175.73 2cvx s VAL 221 N 1.42 3.79 -0.16 -1.59 1.01 0.15 -2.18 120.40 122.85 2cvx s VAL 221 Ca 0.02 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.42 2cvx s VAL 221 Cb -0.16 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 2cvx s VAL 221 CO -0.02 0.50 0.55 0.00 0.00 0.00 0.00 175.10 176.13 2cvx s ALA 222 N 0.33 3.50 -0.20 5.51 0.00 -1.26 -1.74 121.76 127.89 2cvx s ALA 222 Ca -0.05 -0.24 -0.35 0.00 0.00 0.00 0.00 51.96 51.32 2cvx s ALA 222 Cb -0.14 -2.81 -0.11 0.00 0.00 0.00 0.00 23.12 20.06 2cvx s ALA 222 CO 0.03 -0.28 1.98 -0.12 0.00 0.00 0.00 175.76 177.38 2cvx n MET 223 N 4.36 1.73 -0.14 0.00 1.56 -1.00 -4.58 117.12 119.04 2cvx n MET 223 Ca -0.04 0.59 -0.11 0.00 -0.27 0.00 0.00 57.70 57.86 2cvx n MET 223 Cb 0.51 -2.58 0.00 0.00 2.15 0.00 0.00 33.22 33.30 2cvx n MET 223 CO 0.00 0.00 0.00 0.87 -0.73 0.00 0.00 175.97 176.11 2cvx h LYS 224 N 10.40 0.96 -1.82 2.12 1.57 -1.92 -3.45 116.57 124.42 2cvx h LYS 224 Ca -0.42 -0.44 -0.00 0.00 -1.87 0.00 0.00 60.65 57.92 2cvx h LYS 224 Cb 1.29 -0.02 -0.21 0.00 0.08 0.00 0.00 32.23 33.37 2cvx h LYS 224 CO 0.97 1.10 0.33 -2.00 -0.57 0.00 0.00 179.45 179.28 2cvx s GLU 225 N -4.58 0.86 -0.96 3.15 2.12 -1.26 -4.83 118.70 113.19 2cvx s GLU 225 Ca -0.11 0.26 -0.18 0.00 0.36 0.00 0.00 54.97 55.30 2cvx s GLU 225 Cb 0.12 0.41 -0.10 0.00 0.26 0.00 0.00 34.13 34.81 2cvx s GLU 225 CO 0.87 -0.26 2.04 -3.47 -0.54 0.00 0.00 175.26 173.91 2cvx n ASP 226 N 0.95 3.28 -3.54 -1.70 4.64 -1.26 -3.52 116.55 115.40 2cvx n ASP 226 Ca -0.15 -2.67 -0.14 0.00 -1.38 0.00 0.00 54.79 50.45 2cvx n ASP 226 Cb 0.57 -1.24 -0.05 0.00 -1.04 0.00 0.00 41.12 39.36 2cvx n ASP 226 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 2cvx s SER 227 N 4.34 -0.52 0.27 1.67 1.04 -1.26 -4.95 113.70 114.29 2cvx s SER 227 Ca 0.53 0.52 -0.03 0.00 0.48 0.00 0.00 55.95 57.46 2cvx s SER 227 Cb 0.14 0.43 0.40 0.00 0.10 0.00 0.00 66.02 67.09 2cvx s SER 227 CO 0.05 -0.51 1.89 0.40 0.98 0.00 0.00 173.24 176.05 2cvx h ILE 228 N 2.72 1.11 -0.02 -1.02 1.08 -1.99 0.26 117.51 119.66 2cvx h ILE 228 Ca -0.23 -0.41 0.00 0.00 -0.39 0.00 0.00 64.86 63.83 2cvx h ILE 228 Cb 1.16 -0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.72 2cvx h ILE 228 CO 0.35 0.22 0.01 -0.08 -0.69 0.00 0.00 178.15 177.96 2cvx h GLU 229 N 1.20 0.02 -0.36 2.37 4.81 -1.96 -0.63 114.58 120.03 2cvx h GLU 229 Ca 0.42 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.53 2cvx h GLU 229 Cb 0.12 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2cvx h GLU 229 CO -0.16 0.02 -0.27 0.78 -0.73 0.00 0.00 179.01 178.64 2cvx h GLY 230 N 0.02 0.83 0.96 1.92 0.00 -1.53 -0.57 103.07 104.71 2cvx h GLY 230 Ca 0.01 -0.74 -0.03 0.00 0.00 0.00 0.00 47.33 46.56 2cvx h GLY 230 CO -0.00 0.68 0.18 -2.22 0.00 0.00 0.00 176.54 175.17 2cvx h ILE 231 N 0.65 1.21 0.00 2.60 2.04 -0.42 -1.40 117.51 122.20 2cvx h ILE 231 Ca 0.08 -0.67 -0.15 0.00 1.00 0.00 0.00 64.86 65.12 2cvx h ILE 231 Cb 0.80 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 2cvx h ILE 231 CO 0.07 0.25 -0.72 1.88 0.00 0.00 0.00 178.15 179.62 2cvx h TYR 232 N 0.63 0.00 -0.51 1.37 -1.99 -0.94 -1.45 116.97 114.08 2cvx h TYR 232 Ca 0.16 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.79 2cvx h TYR 232 Cb 0.21 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.92 2cvx h TYR 232 CO 0.01 0.72 -0.06 -0.44 -0.00 0.00 0.00 178.16 178.39 2cvx h ASP 233 N 0.00 0.89 -0.56 3.88 3.45 -1.04 -1.96 116.42 121.09 2cvx h ASP 233 Ca -0.01 -0.26 -0.09 0.00 0.43 0.00 0.00 57.03 57.10 2cvx h ASP 233 Cb 1.38 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 39.89 2cvx h ASP 233 CO 0.09 0.98 0.01 0.74 -1.57 0.00 0.00 179.24 179.50 2cvx h THR 234 N 0.83 1.26 -0.47 0.35 2.02 -1.12 -2.04 112.91 113.74 2cvx h THR 234 Ca 0.14 -1.11 -0.06 0.00 0.77 0.00 0.00 66.41 66.15 2cvx h THR 234 Cb 0.57 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2cvx h THR 234 CO 0.03 0.40 0.04 0.25 0.37 0.00 0.00 175.52 176.62 2cvx h LEU 235 N 0.92 0.77 -0.37 2.58 5.85 -1.11 -0.53 115.31 123.44 2cvx h LEU 235 Ca 0.17 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2cvx h LEU 235 Cb 0.52 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 2cvx h LEU 235 CO 0.03 0.86 0.23 0.50 -0.34 0.00 0.00 178.44 179.72 2cvx h LYS 236 N 0.66 0.49 -0.23 1.25 3.64 -1.35 -0.90 116.57 120.13 2cvx h LYS 236 Ca 0.14 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2cvx h LYS 236 Cb 0.44 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 2cvx h LYS 236 CO 0.02 0.35 0.04 1.49 -2.27 0.00 0.00 179.45 179.08 2cvx h GLU 237 N 0.48 0.12 -0.81 1.90 4.81 -0.97 0.11 114.58 120.22 2cvx h GLU 237 Ca 0.13 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2cvx h GLU 237 Cb -0.02 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 2cvx h GLU 237 CO -0.03 0.08 0.53 0.00 -0.73 0.00 0.00 179.01 178.87 2cvx h ALA 239 N 1.53 -0.11 -0.69 0.00 0.00 -0.24 0.40 119.26 120.14 2cvx h ALA 239 Ca 0.33 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.16 2cvx h ALA 239 Cb 0.06 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2cvx h ALA 239 CO -0.10 -0.47 0.44 -0.07 0.00 0.00 0.00 179.25 179.05 2cvx h LEU 240 N -0.28 0.74 -0.36 0.00 3.38 -0.28 -1.62 115.31 116.89 2cvx h LEU 240 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2cvx h LEU 240 Cb 0.24 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2cvx h LEU 240 CO 0.02 0.52 0.18 0.40 0.09 0.00 0.00 178.44 179.65 2cvx h ILE 241 N 0.88 1.15 0.00 1.22 2.04 -1.00 -3.21 117.51 118.59 2cvx h ILE 241 Ca 0.27 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 2cvx h ILE 241 Cb -0.02 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2cvx h ILE 241 CO -0.09 0.16 -0.14 -1.28 0.00 0.00 0.00 178.15 176.80 2cvx h SER 242 N 0.44 0.00 -0.68 1.72 0.87 -0.45 -2.68 113.55 112.76 2cvx h SER 242 Ca 0.12 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.73 2cvx h SER 242 Cb 0.09 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 2cvx h SER 242 CO -0.02 0.14 0.45 0.50 -0.53 0.00 0.00 176.83 177.37 2cvx h LYS 243 N 0.00 0.73 -0.65 2.24 3.64 -1.31 -3.01 116.57 118.21 2cvx h LYS 243 Ca -0.00 -0.04 -0.45 0.00 -1.27 0.00 0.00 60.65 58.88 2cvx h LYS 243 Cb 0.31 -0.16 -0.31 0.00 -0.41 0.00 0.00 32.23 31.65 2cvx h LYS 243 CO 0.02 0.48 -0.39 0.25 -2.27 0.00 0.00 179.45 177.54 2cvx n THR 244 N -4.47 2.68 -1.21 1.00 -2.24 -1.01 -2.29 114.28 106.75 2cvx n THR 244 Ca 0.09 -3.68 0.04 0.00 -2.27 0.00 0.00 64.05 58.24 2cvx n THR 244 Cb 0.18 -0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 67.47 2cvx n THR 244 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cvx n ALA 245 N -0.85 -2.06 0.00 6.98 0.00 -1.16 -4.88 120.51 118.54 2cvx n ALA 245 Ca 0.43 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.36 2cvx n ALA 245 Cb 0.90 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 19.09 2cvx n ALA 245 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cvx n GLY 246 N -2.83 3.55 3.89 0.00 0.00 -1.26 -4.79 105.19 103.76 2cvx n GLY 246 Ca -0.02 -1.46 -0.30 0.00 0.00 0.00 0.00 46.02 44.23 2cvx n GLY 246 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cvx s GLY 247 N 0.00 2.06 -0.07 -0.02 0.00 -0.60 -4.69 107.32 104.01 2cvx s GLY 247 Ca 0.00 -0.46 0.04 0.00 0.00 0.00 0.00 44.72 44.30 2cvx s GLY 247 CO 0.00 -0.35 -0.18 -0.42 0.00 0.00 0.00 173.10 172.15 2cvx s ILE 248 N -1.93 2.72 -0.20 0.90 1.01 -0.42 -2.00 121.20 121.28 2cvx s ILE 248 Ca 0.45 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 60.21 2cvx s ILE 248 Cb -0.11 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 2cvx s ILE 248 CO 0.26 0.57 0.03 -0.83 0.00 0.00 0.00 174.94 174.97 2cvx s GLY 249 N -0.33 1.78 -0.13 6.18 0.00 -0.06 0.00 107.32 114.77 2cvx s GLY 249 Ca 0.02 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 43.83 2cvx s GLY 249 CO 0.02 0.22 -0.18 -2.27 0.00 0.00 0.00 173.10 170.89 2cvx s LEU 250 N 0.90 1.90 -0.12 0.66 2.96 0.30 0.34 118.68 125.62 2cvx s LEU 250 Ca 0.02 -0.52 -0.10 0.00 -0.22 0.00 0.00 54.13 53.32 2cvx s LEU 250 Cb -0.14 -1.26 -0.05 0.00 0.50 0.00 0.00 46.19 45.24 2cvx s LEU 250 CO 0.02 0.04 0.20 -1.38 -1.32 0.00 0.00 176.35 173.91 2cvx s HIS 251 N 0.97 3.57 -0.15 5.38 -3.43 -0.71 -1.10 115.29 119.81 2cvx s HIS 251 Ca -0.05 0.58 0.15 0.00 -0.80 0.00 0.00 55.06 54.94 2cvx s HIS 251 Cb -0.15 -2.09 0.42 0.00 -1.43 0.00 0.00 32.58 29.33 2cvx s HIS 251 CO -0.03 0.58 1.20 0.44 -2.00 0.00 0.00 174.74 174.93 2cvx n ILE 252 N 2.44 1.58 0.22 -5.38 -5.35 -0.98 -2.39 119.36 109.50 2cvx n ILE 252 Ca -0.17 -2.62 0.07 0.00 -0.27 0.00 0.00 62.75 59.76 2cvx n ILE 252 Cb 0.54 0.11 0.49 0.00 -1.74 0.00 0.00 39.64 39.04 2cvx n ILE 252 CO 0.00 0.00 0.00 0.45 -1.76 0.00 0.00 176.55 175.24 2cvx h HIS 253 N 1.02 0.00 -0.01 4.28 -0.00 -1.95 -2.97 115.15 115.53 2cvx h HIS 253 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.31 2cvx h HIS 253 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.68 2cvx h HIS 253 CO 0.59 0.27 -0.01 0.27 -0.00 0.00 0.00 177.93 179.05 2cvx n ASN 254 N -3.78 0.90 -4.64 2.45 6.94 -1.26 -4.62 115.26 111.24 2cvx n ASN 254 Ca -0.01 -1.27 -0.41 0.00 -0.02 0.00 0.00 54.58 52.86 2cvx n ASN 254 Cb 0.36 -0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.74 2cvx n ASN 254 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2cvx s ILE 255 N -2.02 4.87 0.44 1.53 -1.09 -1.13 -4.47 121.20 119.33 2cvx s ILE 255 Ca 0.41 1.49 -0.25 0.00 -2.23 0.00 0.00 60.65 60.08 2cvx s ILE 255 Cb 0.21 -4.08 -0.09 0.00 -1.58 0.00 0.00 42.46 36.92 2cvx s ILE 255 CO 0.35 -0.05 1.30 -2.11 -1.23 0.00 0.00 174.94 173.21 2cvx n ARG 256 N 5.88 1.93 -2.32 2.79 1.85 -1.26 -4.66 116.66 120.87 2cvx n ARG 256 Ca 0.04 0.69 -0.27 0.00 -1.00 0.00 0.00 57.85 57.32 2cvx n ARG 256 Cb 0.48 -2.44 0.16 0.00 -1.05 0.00 0.00 32.46 29.61 2cvx n ARG 256 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2cvx s SER 257 N -0.58 3.58 0.18 2.89 1.04 -1.26 -4.53 113.70 115.02 2cvx s SER 257 Ca 0.62 -0.21 -0.33 0.00 0.48 0.00 0.00 55.95 56.51 2cvx s SER 257 Cb -0.48 0.08 -0.13 0.00 0.10 0.00 0.00 66.02 65.59 2cvx s SER 257 CO 0.57 -2.40 1.65 0.41 0.98 0.00 0.00 173.24 174.44 2cvx n THR 258 N -3.33 0.01 -0.00 2.02 -1.04 -1.26 -2.08 114.28 108.60 2cvx n THR 258 Ca 0.17 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 2cvx n THR 258 Cb 0.60 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 2cvx n THR 258 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2cvx n GLY 259 N 3.67 0.19 3.77 3.41 0.00 0.97 -4.93 105.19 112.27 2cvx n GLY 259 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2cvx n GLY 259 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cvx s SER 260 N -2.15 6.47 0.42 1.61 0.01 -0.88 -4.56 113.70 114.62 2cvx s SER 260 Ca 0.00 2.36 -0.26 0.00 1.31 0.00 0.00 55.95 59.36 2cvx s SER 260 Cb 0.00 -2.61 -0.08 0.00 0.21 0.00 0.00 66.02 63.53 2cvx s SER 260 CO 0.00 -0.71 1.35 -0.47 0.41 0.00 0.00 173.24 173.81 2cvx s TYR 261 N -1.42 2.69 -0.26 2.43 6.04 -1.26 -0.78 117.35 124.79 2cvx s TYR 261 Ca 0.58 1.36 0.02 0.00 0.04 0.00 0.00 57.07 59.07 2cvx s TYR 261 Cb -0.31 -3.76 0.06 0.00 -1.04 0.00 0.00 41.96 36.91 2cvx s TYR 261 CO 0.39 -2.39 -0.10 0.42 -1.54 0.00 0.00 175.55 172.33 2cvx s ILE 262 N -1.24 2.25 0.14 3.14 1.01 -0.42 -4.84 121.20 121.25 2cvx s ILE 262 Ca 0.58 -1.57 -0.11 0.00 0.00 0.00 0.00 60.65 59.55 2cvx s ILE 262 Cb -0.40 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2cvx s ILE 262 CO 0.51 -0.00 1.49 0.00 0.00 0.00 0.00 174.94 176.94 2cvx h ALA 263 N 7.80 0.58 -0.07 9.38 0.00 -1.96 -0.58 119.26 134.42 2cvx h ALA 263 Ca -0.21 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.30 2cvx h ALA 263 Cb 1.05 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2cvx h ALA 263 CO 0.48 0.63 0.07 0.78 0.00 0.00 0.00 179.25 181.21 2cvx h GLY 264 N 0.74 0.00 0.00 0.00 0.00 -1.98 -3.08 103.07 98.76 2cvx h GLY 264 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2cvx h GLY 264 CO 0.08 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.32 2cvx n THR 265 N -4.14 0.29 -3.08 4.70 -2.24 -1.22 -5.00 114.28 103.59 2cvx n THR 265 Ca -0.01 -0.39 -0.23 0.00 -2.27 0.00 0.00 64.05 61.16 2cvx n THR 265 Cb 0.17 1.06 0.03 0.00 -2.10 0.00 0.00 70.33 69.49 2cvx n THR 265 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2cvx n ASN 266 N -0.14 -5.84 -0.11 3.42 4.05 -0.31 -4.97 115.26 111.36 2cvx n ASN 266 Ca 0.00 -0.31 0.00 0.00 0.45 0.00 0.00 54.58 54.72 2cvx n ASN 266 Cb 0.28 -4.72 0.00 0.00 1.23 0.00 0.00 39.78 36.57 2cvx n ASN 266 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2cvx n GLY 267 N -1.50 4.45 2.98 8.20 0.00 -0.69 -4.91 105.19 113.73 2cvx n GLY 267 Ca -0.10 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.75 2cvx n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cvx s THR 268 N 1.48 -0.04 0.30 2.61 2.01 -1.26 -1.30 115.64 119.44 2cvx s THR 268 Ca 0.00 0.13 -0.27 0.00 0.31 0.00 0.00 61.69 61.86 2cvx s THR 268 Cb 0.00 -0.28 -0.10 0.00 0.01 0.00 0.00 72.50 72.14 2cvx s THR 268 CO 0.00 0.05 0.94 -0.55 -0.69 0.00 0.00 174.62 174.37 2cvx s SER 269 N 0.94 7.42 0.00 3.53 0.15 0.04 -4.88 113.70 120.90 2cvx s SER 269 Ca -0.07 1.86 0.21 0.00 0.70 0.00 0.00 55.95 58.66 2cvx s SER 269 Cb -0.09 -2.59 0.62 0.00 -1.71 0.00 0.00 66.02 62.26 2cvx s SER 269 CO -0.05 -0.00 1.49 0.59 1.20 0.00 0.00 173.24 176.46 2cvx n ASN 270 N 0.82 2.27 0.00 5.45 5.03 -1.26 -0.02 115.26 127.55 2cvx n ASN 270 Ca 0.01 -1.81 0.00 0.00 0.87 0.00 0.00 54.58 53.64 2cvx n ASN 270 Cb 0.49 -0.15 0.00 0.00 -1.02 0.00 0.00 39.78 39.10 2cvx n ASN 270 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2cvx n GLY 271 N 1.25 -1.18 0.18 7.41 0.00 -1.26 -4.53 105.19 107.06 2cvx n GLY 271 Ca 0.17 -1.32 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 2cvx n GLY 271 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cvx h LEU 272 N 0.00 0.65 -0.06 0.99 3.38 -1.91 -3.35 115.31 115.01 2cvx h LEU 272 Ca 0.00 -0.60 0.04 0.00 0.09 0.00 0.00 57.88 57.40 2cvx h LEU 272 Cb 0.00 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.50 2cvx h LEU 272 CO 0.00 1.14 -0.39 0.40 0.09 0.00 0.00 178.44 179.68 2cvx h ILE 273 N 0.19 0.18 0.00 1.22 1.08 -1.94 0.19 117.51 118.44 2cvx h ILE 273 Ca -0.02 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 2cvx h ILE 273 Cb 1.09 0.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.02 2cvx h ILE 273 CO 0.10 0.00 -0.03 -0.65 -0.69 0.00 0.00 178.15 176.87 2cvx h PRO 274 N -0.51 0.00 0.14 2.37 0.11 -1.81 0.51 132.00 132.81 2cvx h PRO 274 Ca 0.07 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.91 2cvx h PRO 274 Cb 0.62 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.76 2cvx h PRO 274 CO -0.34 0.03 -1.14 1.98 -0.21 0.00 0.00 178.00 178.32 2cvx h MET 275 N 0.00 0.52 -0.85 1.05 4.05 -1.45 -3.18 114.93 115.08 2cvx h MET 275 Ca -0.00 -0.75 0.05 0.00 -0.28 0.00 0.00 59.70 58.71 2cvx h MET 275 Cb 0.15 0.26 -0.05 0.00 -0.80 0.00 0.00 31.60 31.15 2cvx h MET 275 CO 0.00 1.34 0.54 0.82 0.23 0.00 0.00 176.91 179.84 2cvx h ILE 276 N 0.08 1.09 -0.39 1.77 1.08 0.10 -2.41 117.51 118.85 2cvx h ILE 276 Ca -0.18 -0.35 -0.03 0.00 -0.39 0.00 0.00 64.86 63.91 2cvx h ILE 276 Cb 1.85 -0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 35.57 2cvx h ILE 276 CO 0.22 0.18 0.10 0.03 -0.69 0.00 0.00 178.15 177.99 2cvx h ARG 277 N 1.01 0.57 -0.30 2.37 3.08 -1.05 0.32 114.38 120.38 2cvx h ARG 277 Ca 0.35 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.29 2cvx h ARG 277 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2cvx h ARG 277 CO -0.14 0.52 0.14 0.28 -1.07 0.00 0.00 179.97 179.70 2cvx h VAL 278 N 0.56 1.16 -0.48 2.04 2.07 -1.42 -1.87 116.25 118.32 2cvx h VAL 278 Ca 0.13 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 67.09 2cvx h VAL 278 Cb 0.21 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2cvx h VAL 278 CO -0.00 0.17 -0.05 -0.26 0.02 0.00 0.00 177.57 177.44 2cvx h PHE 279 N 0.34 0.89 -0.92 1.57 0.04 -1.05 -1.71 116.94 116.11 2cvx h PHE 279 Ca 0.10 -0.15 0.03 0.00 2.80 0.00 0.00 57.97 60.76 2cvx h PHE 279 Cb 0.14 -0.24 -0.05 0.00 2.20 0.00 0.00 35.95 38.00 2cvx h PHE 279 CO -0.02 0.85 0.60 -0.97 -0.60 0.00 0.00 178.31 178.17 2cvx h ASN 280 N 0.76 0.99 0.73 2.17 -1.24 -0.30 -0.09 115.58 118.59 2cvx h ASN 280 Ca 0.14 -0.01 -0.14 0.00 0.71 0.00 0.00 56.30 57.00 2cvx h ASN 280 Cb 0.53 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.34 2cvx h ASN 280 CO 0.03 0.68 -0.65 -1.13 -1.29 0.00 0.00 177.43 175.07 2cvx h ASN 281 N 1.15 0.00 -0.36 1.15 -0.73 -0.94 -2.02 115.58 113.82 2cvx h ASN 281 Ca 0.37 0.00 -0.15 0.00 1.87 0.00 0.00 56.30 58.39 2cvx h ASN 281 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.59 2cvx h ASN 281 CO -0.12 0.65 -0.35 0.74 -0.37 0.00 0.00 177.43 177.98 2cvx h THR 282 N 0.00 1.28 -0.60 -3.57 2.02 -0.61 -0.75 112.91 110.68 2cvx h THR 282 Ca -0.01 -1.53 0.01 0.00 0.77 0.00 0.00 66.41 65.65 2cvx h THR 282 Cb 1.19 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 68.99 2cvx h THR 282 CO 0.08 0.51 0.40 0.00 0.37 0.00 0.00 175.52 176.88 2cvx h ALA 283 N 0.76 0.76 -0.83 6.16 0.00 -0.71 -0.75 119.26 124.65 2cvx h ALA 283 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2cvx h ALA 283 Cb 0.94 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 2cvx h ALA 283 CO 0.09 0.20 0.44 0.00 0.00 0.00 0.00 179.25 179.98 2cvx h ARG 284 N 0.82 1.16 0.27 0.00 3.08 -1.26 0.04 114.38 118.49 2cvx h ARG 284 Ca 0.22 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2cvx h ARG 284 Cb -0.09 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.74 2cvx h ARG 284 CO -0.05 0.86 -0.13 -0.92 -1.07 0.00 0.00 179.97 178.66 2cvx h TYR 285 N 1.16 -0.34 -1.89 3.04 3.20 -0.43 -3.38 116.97 118.33 2cvx h TYR 285 Ca 0.29 -0.01 -0.73 0.00 3.14 0.00 0.00 58.73 61.42 2cvx h TYR 285 Cb 0.05 0.11 -0.16 0.00 1.54 0.00 0.00 36.73 38.27 2cvx h TYR 285 CO 0.01 0.03 1.56 0.28 -1.64 0.00 0.00 178.16 178.39 2cvx n VAL 286 N -5.04 4.22 -1.94 1.81 0.31 -0.35 -4.90 118.33 112.43 2cvx n VAL 286 Ca -0.08 -4.60 -0.42 0.00 -0.01 0.00 0.00 64.34 59.23 2cvx n VAL 286 Cb 0.26 -2.44 -0.00 0.00 -0.91 0.00 0.00 33.84 30.75 2cvx n VAL 286 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2cvx n ASP 287 N 5.80 4.97 -4.18 4.52 3.85 -1.26 -3.71 116.55 126.54 2cvx n ASP 287 Ca 0.39 -2.94 -0.36 0.00 -0.71 0.00 0.00 54.79 51.17 2cvx n ASP 287 Cb 0.42 -1.57 -0.05 0.00 -1.35 0.00 0.00 41.12 38.58 2cvx n ASP 287 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2cvx n GLN 288 N 4.79 -1.94 0.00 0.11 6.02 -0.73 -2.15 117.38 123.48 2cvx n GLN 288 Ca 0.50 0.24 0.00 0.00 -0.01 0.00 0.00 57.00 57.73 2cvx n GLN 288 Cb 0.36 -4.87 0.00 0.00 1.02 0.00 0.00 30.24 26.74 2cvx n GLN 288 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cvx n GLY 289 N -1.13 0.76 0.00 1.08 0.00 -0.97 -4.37 105.19 100.56 2cvx n GLY 289 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2cvx n GLY 289 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cvx n GLY 290 N 0.00 0.54 2.95 -0.02 0.00 -1.17 -4.87 105.19 102.62 2cvx n GLY 290 Ca 0.00 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.15 2cvx n GLY 290 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2cvx n ASN 291 N 0.00 -4.51 0.00 1.61 4.13 -1.25 -4.99 115.26 110.26 2cvx n ASN 291 Ca 0.00 -0.40 0.00 0.00 1.68 0.00 0.00 54.58 55.86 2cvx n ASN 291 Cb 0.00 -3.77 0.00 0.00 -1.54 0.00 0.00 39.78 34.47 2cvx n ASN 291 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2cvx n LYS 292 N -3.64 0.00 -3.78 3.52 5.02 -0.91 -5.08 118.16 113.29 2cvx n LYS 292 Ca -0.04 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.12 2cvx n LYS 292 Cb 0.56 -0.15 -0.13 0.00 -0.02 0.00 0.00 35.03 35.28 2cvx n LYS 292 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cvx s ARG 293 N -0.64 0.15 0.42 1.97 0.52 -1.10 -5.00 118.95 115.28 2cvx s ARG 293 Ca 0.00 0.33 -0.23 0.00 -0.52 0.00 0.00 55.73 55.30 2cvx s ARG 293 Cb 0.00 -0.04 -0.12 0.00 0.52 0.00 0.00 34.95 35.31 2cvx s ARG 293 CO 0.00 -0.10 0.74 -2.30 0.02 0.00 0.00 175.30 173.66 2cvx n PRO 294 N 3.64 0.86 -1.69 3.54 -0.02 -1.26 -1.78 135.00 138.28 2cvx n PRO 294 Ca -0.20 0.31 -0.40 0.00 -2.02 0.00 0.00 63.50 61.20 2cvx n PRO 294 Cb 0.55 -1.71 0.03 0.00 -0.02 0.00 0.00 33.50 32.35 2cvx n PRO 294 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cvx n GLY 295 N 1.55 0.42 2.83 -1.23 0.00 0.00 -4.75 105.19 104.01 2cvx n GLY 295 Ca 0.11 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2cvx n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cvx s ALA 296 N -1.28 1.73 -0.11 4.61 0.00 -1.26 -4.72 121.76 120.72 2cvx s ALA 296 Ca 0.67 -1.48 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2cvx s ALA 296 Cb -0.47 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2cvx s ALA 296 CO 0.53 -1.42 -0.23 -0.06 0.00 0.00 0.00 175.76 174.59 2cvx s PHE 297 N 1.51 2.52 -0.04 0.00 2.99 -1.26 -1.30 117.98 122.40 2cvx s PHE 297 Ca 0.03 -1.09 -0.09 0.00 0.00 0.00 0.00 56.93 55.78 2cvx s PHE 297 Cb -0.18 -1.70 -0.05 0.00 0.00 0.00 0.00 43.02 41.10 2cvx s PHE 297 CO -0.14 -0.46 0.27 0.00 -0.00 0.00 0.00 175.22 174.90 2cvx s ALA 298 N 0.47 3.81 -0.12 5.36 0.00 0.10 -1.53 121.76 129.86 2cvx s ALA 298 Ca -0.16 -0.49 -0.00 0.00 0.00 0.00 0.00 51.96 51.31 2cvx s ALA 298 Cb -0.17 -2.13 -0.02 0.00 0.00 0.00 0.00 23.12 20.79 2cvx s ALA 298 CO 0.06 0.59 -0.10 -0.51 0.00 0.00 0.00 175.76 175.80 2cvx s LEU 299 N -1.31 2.91 -0.16 0.00 1.43 0.94 -0.54 118.68 121.96 2cvx s LEU 299 Ca 0.22 -0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 53.04 2cvx s LEU 299 Cb -0.14 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 2cvx s LEU 299 CO 0.11 0.21 0.06 -0.31 0.23 0.00 0.00 176.35 176.65 2cvx s TYR 300 N 0.07 3.28 -0.05 0.29 1.51 -0.26 -0.58 117.35 121.60 2cvx s TYR 300 Ca -0.04 0.15 -0.04 0.00 -1.01 0.00 0.00 57.07 56.13 2cvx s TYR 300 Cb -0.14 -2.00 0.02 0.00 -0.11 0.00 0.00 41.96 39.72 2cvx s TYR 300 CO 0.04 0.29 0.12 -1.17 -1.11 0.00 0.00 175.55 173.72 2cvx s LEU 301 N -0.05 1.33 0.17 -1.29 0.20 -0.93 -2.31 118.68 115.80 2cvx s LEU 301 Ca 0.06 0.25 -0.30 0.00 0.69 0.00 0.00 54.13 54.83 2cvx s LEU 301 Cb -0.12 0.39 -0.07 0.00 -0.43 0.00 0.00 46.19 45.95 2cvx s LEU 301 CO 0.01 -0.07 0.98 -1.61 -0.29 0.00 0.00 176.35 175.37 2cvx s GLU 302 N 0.36 4.74 0.00 1.98 2.02 -1.26 -1.70 118.70 124.84 2cvx s GLU 302 Ca -0.02 1.51 0.04 0.00 0.02 0.00 0.00 54.97 56.51 2cvx s GLU 302 Cb -0.04 -3.32 0.18 0.00 0.10 0.00 0.00 34.13 31.05 2cvx s GLU 302 CO -0.01 0.30 1.02 -0.35 0.02 0.00 0.00 175.26 176.24 2cvx n PRO 303 N 2.22 0.03 0.01 0.39 -0.04 -1.26 -1.32 135.00 135.03 2cvx n PRO 303 Ca 0.01 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 63.93 2cvx n PRO 303 Cb 0.48 -1.50 0.56 0.00 -0.04 0.00 0.00 33.50 33.00 2cvx n PRO 303 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2cvx n TRP 304 N -1.38 0.06 -1.91 0.54 4.27 -1.26 -4.90 117.44 112.86 2cvx n TRP 304 Ca 0.01 0.02 -0.41 0.00 -3.89 0.00 0.00 57.50 53.23 2cvx n TRP 304 Cb 0.04 -0.53 -0.02 0.00 -1.36 0.00 0.00 31.31 29.44 2cvx n TRP 304 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 2cvx s HIS 305 N -3.01 2.91 0.46 -2.67 2.46 -0.43 -0.13 115.29 114.88 2cvx s HIS 305 Ca 0.13 0.91 0.41 0.00 0.47 0.00 0.00 55.06 56.98 2cvx s HIS 305 Cb 0.17 -3.93 2.06 0.00 -0.13 0.00 0.00 32.58 30.75 2cvx s HIS 305 CO 0.49 -3.07 2.24 0.00 -2.47 0.00 0.00 174.74 171.93 2cvx h ALA 306 N 5.00 1.00 -0.31 1.58 0.00 -1.54 -2.20 119.26 122.79 2cvx h ALA 306 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2cvx h ALA 306 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2cvx h ALA 306 CO 0.79 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.79 2cvx n ASP 307 N -3.08 2.44 0.23 0.00 8.00 -1.26 -4.61 116.55 118.27 2cvx n ASP 307 Ca -0.02 -2.19 0.09 0.00 0.71 0.00 0.00 54.79 53.39 2cvx n ASP 307 Cb 0.15 -0.39 0.55 0.00 -0.02 0.00 0.00 41.12 41.42 2cvx n ASP 307 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2cvx h ILE 308 N 1.96 0.76 -0.07 0.53 6.09 -1.74 -2.38 117.51 122.66 2cvx h ILE 308 Ca 0.00 -0.90 -0.19 0.00 -1.37 0.00 0.00 64.86 62.40 2cvx h ILE 308 Cb 0.78 1.55 -0.00 0.00 0.47 0.00 0.00 36.82 39.62 2cvx h ILE 308 CO 0.10 0.22 -0.76 -0.26 -3.07 0.00 0.00 178.15 174.38 2cvx h PHE 309 N 0.00 0.54 0.00 2.19 -1.00 -1.86 -2.57 116.94 114.25 2cvx h PHE 309 Ca -0.00 -0.25 -0.12 0.00 2.81 0.00 0.00 57.97 60.41 2cvx h PHE 309 Cb 0.53 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 40.00 2cvx h PHE 309 CO 0.00 1.01 -0.67 -0.44 -1.61 0.00 0.00 178.31 176.61 2cvx h ASP 310 N 0.26 0.00 0.02 2.17 3.32 -1.85 -3.34 116.42 117.00 2cvx h ASP 310 Ca -0.04 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2cvx h ASP 310 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2cvx h ASP 310 CO 0.13 0.56 -0.01 0.15 -1.72 0.00 0.00 179.24 178.35 2cvx h PHE 311 N 0.00 -0.02 0.00 4.55 3.57 -1.33 -3.15 116.94 120.56 2cvx h PHE 311 Ca -0.03 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.47 2cvx h PHE 311 Cb 1.45 0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.19 2cvx h PHE 311 CO 0.00 0.38 0.00 0.44 -2.23 0.00 0.00 178.31 176.90 2cvx n ILE 312 N -4.91 1.25 -0.22 1.41 -5.35 -0.98 -2.46 119.36 108.11 2cvx n ILE 312 Ca -0.08 0.60 0.07 0.00 -0.27 0.00 0.00 62.75 63.07 2cvx n ILE 312 Cb 0.21 -1.59 0.19 0.00 -1.74 0.00 0.00 39.64 36.71 2cvx n ILE 312 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2cvx n ASP 313 N -2.04 3.13 0.31 7.28 9.92 -1.19 -4.40 116.55 129.56 2cvx n ASP 313 Ca -0.00 -2.01 0.19 0.00 -0.53 0.00 0.00 54.79 52.44 2cvx n ASP 313 Cb 0.05 -0.28 0.99 0.00 -0.64 0.00 0.00 41.12 41.24 2cvx n ASP 313 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 2cvx h ILE 314 N 2.45 0.09 -0.01 0.53 6.09 -1.48 -1.69 117.51 123.48 2cvx h ILE 314 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2cvx h ILE 314 Cb 0.78 0.83 0.00 0.00 0.47 0.00 0.00 36.82 38.91 2cvx h ILE 314 CO 0.00 0.00 -0.54 0.54 -3.07 0.00 0.00 178.15 175.09 2cvx n ARG 315 N -3.13 1.58 -1.59 2.19 1.74 -1.26 -0.92 116.66 115.27 2cvx n ARG 315 Ca -0.02 -0.49 -0.40 0.00 -0.77 0.00 0.00 57.85 56.17 2cvx n ARG 315 Cb 0.25 -1.30 0.03 0.00 -1.02 0.00 0.00 32.46 30.41 2cvx n ARG 315 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2cvx n LYS 316 N -0.64 1.09 0.07 5.56 5.02 -0.64 -4.92 118.16 123.71 2cvx n LYS 316 Ca 0.05 0.40 -0.05 0.00 -2.02 0.00 0.00 58.31 56.70 2cvx n LYS 316 Cb 0.32 -2.01 -0.09 0.00 -0.02 0.00 0.00 35.03 33.22 2cvx n LYS 316 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 2cvx h ASN 317 N 1.06 0.00 -2.47 4.39 -0.00 -1.94 -3.48 115.58 113.13 2cvx h ASN 317 Ca -0.46 0.00 -0.46 0.00 -0.00 0.00 0.00 56.30 55.38 2cvx h ASN 317 Cb 1.35 0.00 0.09 0.00 -0.00 0.00 0.00 38.32 39.77 2cvx h ASN 317 CO 0.54 0.89 0.16 -1.38 -0.00 0.00 0.00 177.43 177.64 2cvx s HIS 318 N -2.76 1.62 1.05 0.67 -3.43 -1.26 -5.04 115.29 106.15 2cvx s HIS 318 Ca 0.01 -0.17 -0.14 0.00 -0.80 0.00 0.00 55.06 53.97 2cvx s HIS 318 Cb 0.09 -3.16 0.15 0.00 -1.43 0.00 0.00 32.58 28.23 2cvx s HIS 318 CO 0.81 -1.84 0.66 0.41 -2.00 0.00 0.00 174.74 172.77 2cvx n GLY 319 N -2.97 -1.76 0.20 -1.38 0.00 -1.26 -4.74 105.19 93.28 2cvx n GLY 319 Ca 0.15 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2cvx n GLY 319 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cvx n LYS 320 N -3.33 0.00 -0.28 1.61 4.01 -1.26 -5.03 118.16 113.88 2cvx n LYS 320 Ca 0.05 0.00 0.02 0.00 -0.51 0.00 0.00 58.31 57.87 2cvx n LYS 320 Cb 0.55 -0.23 0.22 0.00 -0.51 0.00 0.00 35.03 35.07 2cvx n LYS 320 CO 0.00 0.00 0.00 1.49 -1.11 0.00 0.00 177.40 177.78 2cvx h GLU 321 N 0.00 1.05 0.00 1.97 4.81 -1.96 -1.74 114.58 118.70 2cvx h GLU 321 Ca 0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2cvx h GLU 321 Cb 0.14 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2cvx h GLU 321 CO 0.00 0.69 0.00 -0.85 -0.73 0.00 0.00 179.01 178.12 2cvx n GLU 322 N -4.44 0.00 -0.04 1.92 0.28 -1.26 -2.41 120.64 114.69 2cvx n GLU 322 Ca 0.11 0.35 0.07 0.00 -0.16 0.00 0.00 57.16 57.53 2cvx n GLU 322 Cb 0.10 -1.50 0.09 0.00 1.43 0.00 0.00 31.44 31.55 2cvx n GLU 322 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 2cvx n ILE 323 N -1.50 0.19 -4.15 3.84 0.13 -0.66 -4.85 119.36 112.36 2cvx n ILE 323 Ca 0.02 -0.59 -0.23 0.00 -1.10 0.00 0.00 62.75 60.85 2cvx n ILE 323 Cb 0.10 1.15 -0.05 0.00 -0.84 0.00 0.00 39.64 40.00 2cvx n ILE 323 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 2cvx s ARG 324 N -1.17 2.76 -0.37 9.51 1.81 -1.01 -4.77 118.95 125.72 2cvx s ARG 324 Ca 0.19 -1.09 0.01 0.00 -1.72 0.00 0.00 55.73 53.12 2cvx s ARG 324 Cb 0.13 -2.49 0.15 0.00 -0.45 0.00 0.00 34.95 32.29 2cvx s ARG 324 CO 0.19 0.41 0.27 0.00 -0.68 0.00 0.00 175.30 175.49 2cvx s ALA 325 N -2.07 0.71 -0.70 2.13 0.00 -0.09 -4.86 121.76 116.88 2cvx s ALA 325 Ca 0.32 -1.78 0.26 0.00 0.00 0.00 0.00 51.96 50.75 2cvx s ALA 325 Cb -0.08 -1.70 0.68 0.00 0.00 0.00 0.00 23.12 22.03 2cvx s ALA 325 CO 0.23 -2.10 1.67 0.00 0.00 0.00 0.00 175.76 175.56 2cvx h ARG 326 N 6.75 0.00 -0.46 0.00 3.08 -1.93 -3.00 114.38 118.82 2cvx h ARG 326 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2cvx h ARG 326 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.03 2cvx h ARG 326 CO 0.26 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 178.91 2cvx n ASP 327 N -2.27 2.59 -4.45 7.04 8.00 -1.26 -4.92 116.55 121.28 2cvx n ASP 327 Ca 0.05 -1.97 -0.23 0.00 0.71 0.00 0.00 54.79 53.34 2cvx n ASP 327 Cb 0.44 -0.30 -0.10 0.00 -0.02 0.00 0.00 41.12 41.13 2cvx n ASP 327 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2cvx s LEU 328 N -1.08 2.59 -0.19 0.64 1.43 -1.13 -4.57 118.68 116.36 2cvx s LEU 328 Ca 0.33 -1.03 -0.00 0.00 -1.03 0.00 0.00 54.13 52.39 2cvx s LEU 328 Cb 0.17 -1.03 0.01 0.00 0.03 0.00 0.00 46.19 45.38 2cvx s LEU 328 CO 0.23 -0.00 -0.16 -0.36 0.23 0.00 0.00 176.35 176.29 2cvx s PHE 329 N -2.59 2.83 0.21 0.29 0.08 -0.58 -4.79 117.98 113.43 2cvx s PHE 329 Ca 0.29 -1.45 -0.30 0.00 0.12 0.00 0.00 56.93 55.59 2cvx s PHE 329 Cb -0.04 -1.97 -0.08 0.00 -0.57 0.00 0.00 43.02 40.36 2cvx s PHE 329 CO 0.14 -0.74 0.93 -1.25 -0.10 0.00 0.00 175.22 174.20 2cvx s PRO 330 N 1.34 4.80 -0.01 0.24 0.04 -1.26 -0.04 135.00 140.11 2cvx s PRO 330 Ca 0.05 1.45 0.01 0.00 0.04 0.00 0.00 61.00 62.55 2cvx s PRO 330 Cb -0.13 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2cvx s PRO 330 CO -0.10 0.47 -0.03 0.00 0.04 0.00 0.00 177.00 177.38 2cvx s ALA 331 N -0.96 0.31 -0.10 8.56 0.00 0.25 -1.89 121.76 127.93 2cvx s ALA 331 Ca 0.42 -0.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.11 2cvx s ALA 331 Cb -0.25 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2cvx s ALA 331 CO 0.31 0.04 0.47 -0.51 0.00 0.00 0.00 175.76 176.07 2cvx s LEU 332 N 0.17 4.30 -1.04 0.00 1.43 0.28 -2.18 118.68 121.65 2cvx s LEU 332 Ca -0.01 0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 53.85 2cvx s LEU 332 Cb -0.04 -2.69 0.26 0.00 0.03 0.00 0.00 46.19 43.75 2cvx s LEU 332 CO -0.00 0.04 1.01 0.86 0.23 0.00 0.00 176.35 178.49 2cvx s TRP 333 N 0.40 4.15 -0.28 0.29 -0.00 -0.69 -1.93 118.94 120.89 2cvx s TRP 333 Ca 0.26 -2.69 -0.25 0.00 -0.00 0.00 0.00 56.10 53.42 2cvx s TRP 333 Cb -0.15 -3.73 -0.00 0.00 -0.00 0.00 0.00 33.47 29.59 2cvx s TRP 333 CO 0.11 -0.92 0.84 0.42 -0.00 0.00 0.00 176.95 177.40 2cvx s ILE 334 N -1.13 4.78 0.54 5.86 1.01 -0.11 -4.25 121.20 127.90 2cvx s ILE 334 Ca 0.29 1.44 -0.17 0.00 0.00 0.00 0.00 60.65 62.20 2cvx s ILE 334 Cb -0.10 -4.16 -0.06 0.00 0.01 0.00 0.00 42.46 38.15 2cvx s ILE 334 CO -0.09 -0.19 1.03 -2.16 0.00 0.00 0.00 174.94 173.54 2cvx s PRO 335 N 2.98 3.63 0.24 2.79 0.04 -1.26 -1.58 135.00 141.84 2cvx s PRO 335 Ca 0.35 1.18 -0.05 0.00 0.04 0.00 0.00 61.00 62.52 2cvx s PRO 335 Cb -0.14 -2.08 0.32 0.00 0.04 0.00 0.00 34.50 32.63 2cvx s PRO 335 CO 0.10 -0.55 1.87 -0.44 0.04 0.00 0.00 177.00 178.02 2cvx h ASP 336 N 0.90 0.94 -1.00 6.66 3.32 -1.97 -2.30 116.42 122.96 2cvx h ASP 336 Ca -0.48 0.00 0.30 0.00 0.02 0.00 0.00 57.03 56.88 2cvx h ASP 336 Cb 1.21 -0.20 -0.14 0.00 0.22 0.00 0.00 39.33 40.42 2cvx h ASP 336 CO 0.59 0.62 0.57 0.25 -1.72 0.00 0.00 179.24 179.55 2cvx h LEU 337 N 1.09 0.55 -0.81 1.55 6.46 -1.95 0.38 115.31 122.57 2cvx h LEU 337 Ca 0.38 0.18 -0.04 0.00 -0.12 0.00 0.00 57.88 58.28 2cvx h LEU 337 Cb 0.09 0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.09 2cvx h LEU 337 CO -0.15 -0.08 0.36 0.15 -0.62 0.00 0.00 178.44 178.10 2cvx h PHE 338 N 0.38 1.20 -0.29 1.25 3.57 -1.80 -0.62 116.94 120.63 2cvx h PHE 338 Ca 0.71 -0.07 -0.19 0.00 3.53 0.00 0.00 57.97 61.95 2cvx h PHE 338 Cb 1.57 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.94 2cvx h PHE 338 CO -0.01 0.89 -0.54 0.52 -2.23 0.00 0.00 178.31 176.94 2cvx h MET 339 N 1.17 0.88 -0.50 1.11 2.86 -0.36 -1.34 114.93 118.75 2cvx h MET 339 Ca 0.27 -0.56 0.01 0.00 -2.06 0.00 0.00 59.70 57.37 2cvx h MET 339 Cb 0.17 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 2cvx h MET 339 CO -0.03 1.19 0.31 0.87 1.06 0.00 0.00 176.91 180.32 2cvx h LYS 340 N 0.67 0.62 -0.57 1.72 1.57 -0.97 -1.66 116.57 117.94 2cvx h LYS 340 Ca 0.01 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 2cvx h LYS 340 Cb 1.15 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 2cvx h LYS 340 CO 0.12 0.41 0.15 0.00 -0.57 0.00 0.00 179.45 179.56 2cvx h ARG 341 N 0.64 0.88 -0.17 3.15 2.47 -1.01 -0.09 114.38 120.24 2cvx h ARG 341 Ca 0.19 -0.18 -0.01 0.00 -1.26 0.00 0.00 59.98 58.72 2cvx h ARG 341 Cb -0.03 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 2cvx h ARG 341 CO -0.06 0.77 0.05 0.28 0.56 0.00 0.00 179.97 181.57 2cvx h VAL 342 N 0.85 1.19 -0.04 2.04 2.07 -1.00 0.17 116.25 121.53 2cvx h VAL 342 Ca 0.19 -0.59 -0.16 0.00 0.82 0.00 0.00 66.70 66.95 2cvx h VAL 342 Cb 0.28 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2cvx h VAL 342 CO -0.00 0.18 -0.69 1.05 0.02 0.00 0.00 177.57 178.13 2cvx h GLU 343 N 0.09 0.19 0.00 1.57 4.11 -1.17 -2.84 114.58 116.53 2cvx h GLU 343 Ca 0.05 -0.15 0.00 0.00 0.07 0.00 0.00 59.36 59.33 2cvx h GLU 343 Cb 0.24 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2cvx h GLU 343 CO -0.00 0.81 0.00 0.39 0.07 0.00 0.00 179.01 180.27 2cvx n GLU 344 N -3.79 0.17 -3.70 1.06 1.02 -0.06 -4.91 120.64 110.44 2cvx n GLU 344 Ca -0.02 0.13 -0.21 0.00 -0.02 0.00 0.00 57.16 57.03 2cvx n GLU 344 Cb 0.68 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.63 2cvx n GLU 344 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2cvx n ASN 345 N -1.37 -1.24 -0.63 1.62 5.15 -0.99 -5.01 115.26 112.80 2cvx n ASN 345 Ca 0.07 -0.81 0.00 0.00 -0.60 0.00 0.00 54.58 53.24 2cvx n ASN 345 Cb 0.18 -4.09 0.00 0.00 -0.53 0.00 0.00 39.78 35.34 2cvx n ASN 345 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2cvx n GLY 346 N -1.56 2.05 3.95 8.20 0.00 0.56 -4.95 105.19 113.44 2cvx n GLY 346 Ca -0.29 -2.07 -0.23 0.00 0.00 0.00 0.00 46.02 43.43 2cvx n GLY 346 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cvx s THR 347 N 1.65 3.41 -0.05 2.61 -4.23 -1.26 -1.96 115.64 115.82 2cvx s THR 347 Ca 0.00 -0.48 -0.04 0.00 -1.18 0.00 0.00 61.69 59.99 2cvx s THR 347 Cb 0.00 -3.29 0.02 0.00 1.34 0.00 0.00 72.50 70.57 2cvx s THR 347 CO 0.00 -0.22 0.12 0.86 -0.54 0.00 0.00 174.62 174.85 2cvx s TRP 348 N -2.71 -0.14 -0.13 3.99 -0.11 -0.19 -4.47 118.94 115.18 2cvx s TRP 348 Ca 0.53 0.35 -0.01 0.00 1.22 0.00 0.00 56.10 58.19 2cvx s TRP 348 Cb -0.10 0.02 -0.02 0.00 -1.50 0.00 0.00 33.47 31.86 2cvx s TRP 348 CO 0.39 -0.08 -0.10 0.99 -4.62 0.00 0.00 176.95 173.53 2cvx s THR 349 N 0.29 3.37 -0.17 5.86 2.01 -1.26 -0.51 115.64 125.23 2cvx s THR 349 Ca -0.02 -0.55 -0.13 0.00 0.31 0.00 0.00 61.69 61.29 2cvx s THR 349 Cb -0.03 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 70.01 2cvx s THR 349 CO -0.01 0.52 0.28 -0.76 -0.69 0.00 0.00 174.62 173.96 2cvx s LEU 350 N 0.19 4.22 0.05 4.42 1.43 0.16 -4.66 118.68 124.49 2cvx s LEU 350 Ca -0.06 0.46 0.07 0.00 -1.03 0.00 0.00 54.13 53.58 2cvx s LEU 350 Cb -0.15 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 2cvx s LEU 350 CO 0.04 0.09 -0.21 -0.36 0.23 0.00 0.00 176.35 176.14 2cvx s PHE 351 N 0.58 1.82 0.21 0.29 0.40 0.82 -0.74 117.98 121.37 2cvx s PHE 351 Ca 0.15 -0.38 -0.30 0.00 -0.60 0.00 0.00 56.93 55.80 2cvx s PHE 351 Cb -0.13 -1.07 -0.08 0.00 0.51 0.00 0.00 43.02 42.25 2cvx s PHE 351 CO 0.04 0.11 0.98 0.45 0.70 0.00 0.00 175.22 177.50 2cvx s SER 352 N -1.30 7.53 0.63 1.36 0.15 -1.26 -1.40 113.70 119.42 2cvx s SER 352 Ca 0.07 1.97 0.34 0.00 0.70 0.00 0.00 55.95 59.04 2cvx s SER 352 Cb -0.09 -2.61 1.90 0.00 -1.71 0.00 0.00 66.02 63.51 2cvx s SER 352 CO 0.02 0.04 2.15 1.55 1.20 0.00 0.00 173.24 178.20 2cvx h PRO 353 N 4.49 0.00 -0.16 5.44 0.13 -1.83 -1.35 132.00 138.72 2cvx h PRO 353 Ca -0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.56 2cvx h PRO 353 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2cvx h PRO 353 CO 0.69 0.00 -0.43 1.79 -0.23 0.00 0.00 178.00 179.82 2cvx h THR 354 N 0.00 1.31 0.00 1.56 1.35 -1.92 -2.82 112.91 112.40 2cvx h THR 354 Ca 0.03 -1.60 -0.14 0.00 -0.55 0.00 0.00 66.41 64.16 2cvx h THR 354 Cb 0.36 1.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.43 2cvx h THR 354 CO -0.00 0.49 -0.68 0.28 -0.25 0.00 0.00 175.52 175.35 2cvx h SER 355 N 0.31 0.00 -2.05 5.36 0.02 -1.59 -3.39 113.55 112.21 2cvx h SER 355 Ca 0.02 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.41 2cvx h SER 355 Cb 0.89 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 63.03 2cvx h SER 355 CO 0.07 0.68 -1.01 0.00 -1.14 0.00 0.00 176.83 175.43 2cvx n ALA 356 N -2.29 2.73 -1.68 3.77 0.00 -1.04 -4.95 120.51 117.05 2cvx n ALA 356 Ca 0.01 -3.63 -0.35 0.00 0.00 0.00 0.00 53.44 49.47 2cvx n ALA 356 Cb 0.78 -0.82 0.03 0.00 0.00 0.00 0.00 19.45 19.43 2cvx n ALA 356 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2cvx s PRO 357 N -1.36 3.04 0.00 0.00 0.04 -1.07 -4.13 135.00 131.52 2cvx s PRO 357 Ca 0.36 1.63 0.00 0.00 0.04 0.00 0.00 61.00 63.03 2cvx s PRO 357 Cb 0.16 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2cvx s PRO 357 CO -0.10 -1.11 0.00 0.41 0.04 0.00 0.00 177.00 176.24 2cvx n GLY 358 N 0.13 1.03 0.32 0.56 0.00 -1.26 -4.95 105.19 101.02 2cvx n GLY 358 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.17 2cvx n GLY 358 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cvx h LEU 359 N 0.00 0.55 0.00 0.99 4.07 -1.92 -1.80 115.31 117.20 2cvx h LEU 359 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2cvx h LEU 359 Cb 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.60 2cvx h LEU 359 CO 0.00 0.40 -0.44 -1.54 -1.08 0.00 0.00 178.44 175.78 2cvx n SER 360 N -4.46 0.47 -2.01 -0.43 3.41 -1.26 -3.71 113.62 105.63 2cvx n SER 360 Ca 0.04 -0.03 -0.07 0.00 -0.26 0.00 0.00 58.87 58.55 2cvx n SER 360 Cb 0.05 0.09 0.30 0.00 -0.26 0.00 0.00 64.21 64.40 2cvx n SER 360 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2cvx n ASP 361 N -1.66 4.75 -3.96 4.04 2.03 -0.68 -4.84 116.55 116.23 2cvx n ASP 361 Ca 0.05 -3.26 -0.09 0.00 0.52 0.00 0.00 54.79 52.01 2cvx n ASP 361 Cb 0.36 -0.75 -0.05 0.00 -0.72 0.00 0.00 41.12 39.96 2cvx n ASP 361 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cvx s TYR 363 N -3.99 0.70 0.00 0.00 -0.85 -1.26 -4.75 117.35 107.20 2cvx s TYR 363 Ca 0.20 -1.03 0.00 0.00 -0.52 0.00 0.00 57.07 55.72 2cvx s TYR 363 Cb -0.01 0.11 0.00 0.00 0.38 0.00 0.00 41.96 42.44 2cvx s TYR 363 CO 0.08 -1.12 0.00 0.41 -1.52 0.00 0.00 175.55 173.40 2cvx n GLY 364 N -0.48 1.83 0.38 5.49 0.00 -1.26 -2.44 105.19 108.70 2cvx n GLY 364 Ca -0.01 -0.52 -0.01 0.00 0.00 0.00 0.00 46.02 45.48 2cvx n GLY 364 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2cvx h ASP 365 N 9.40 1.13 -0.87 1.61 3.45 -2.00 -1.20 116.42 127.93 2cvx h ASP 365 Ca 0.00 -0.02 0.06 0.00 0.43 0.00 0.00 57.03 57.49 2cvx h ASP 365 Cb 0.00 -0.27 -0.05 0.00 -0.56 0.00 0.00 39.33 38.44 2cvx h ASP 365 CO 0.00 0.80 0.57 -0.08 -1.57 0.00 0.00 179.24 178.96 2cvx h GLU 366 N 1.32 0.98 -0.14 3.56 4.81 -1.98 0.24 114.58 123.38 2cvx h GLU 366 Ca 0.38 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.51 2cvx h GLU 366 Cb -0.09 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.06 2cvx h GLU 366 CO -0.10 0.65 -0.05 0.35 -0.73 0.00 0.00 179.01 179.13 2cvx h PHE 367 N 1.01 0.33 -0.95 0.92 3.04 -0.92 -2.71 116.94 117.65 2cvx h PHE 367 Ca 0.37 -0.08 0.02 0.00 3.98 0.00 0.00 57.97 62.26 2cvx h PHE 367 Cb 0.16 -0.08 -0.05 0.00 2.56 0.00 0.00 35.95 38.54 2cvx h PHE 367 CO -0.00 0.59 0.63 0.93 -2.02 0.00 0.00 178.31 178.44 2cvx h GLU 368 N -0.04 1.22 0.29 1.11 5.08 -0.71 0.51 114.58 122.06 2cvx h GLU 368 Ca 0.03 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2cvx h GLU 368 Cb 0.50 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2cvx h GLU 368 CO 0.02 0.81 -0.14 0.00 -1.00 0.00 0.00 179.01 178.70 2cvx h ALA 369 N 1.36 -0.39 0.30 3.43 0.00 -0.55 -0.94 119.26 122.47 2cvx h ALA 369 Ca 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2cvx h ALA 369 Cb -0.11 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2cvx h ALA 369 CO -0.09 -0.66 -0.21 1.25 0.00 0.00 0.00 179.25 179.54 2cvx h LEU 370 N -0.52 -0.55 -0.47 0.00 5.85 -1.21 -1.71 115.31 116.71 2cvx h LEU 370 Ca -0.04 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.81 2cvx h LEU 370 Cb 0.39 0.17 -0.09 0.00 0.37 0.00 0.00 40.66 41.50 2cvx h LEU 370 CO 0.07 -0.33 -0.12 0.22 -0.34 0.00 0.00 178.44 177.93 2cvx h TYR 371 N -0.51 -0.26 -0.87 1.25 3.20 -0.01 -1.05 116.97 118.73 2cvx h TYR 371 Ca -0.02 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 2cvx h TYR 371 Cb 0.44 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.86 2cvx h TYR 371 CO -0.11 -0.21 0.45 1.15 -1.64 0.00 0.00 178.16 177.81 2cvx h THR 372 N -0.00 1.26 0.32 1.81 2.02 -0.97 -0.59 112.91 116.75 2cvx h THR 372 Ca 0.23 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.72 2cvx h THR 372 Cb 0.35 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2cvx h THR 372 CO -0.49 0.30 -0.15 -0.09 0.37 0.00 0.00 175.52 175.46 2cvx h ARG 373 N 1.22 -0.42 -0.84 6.66 2.43 -0.89 -1.34 114.38 121.20 2cvx h ARG 373 Ca 0.30 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.59 2cvx h ARG 373 Cb 0.06 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.65 2cvx h ARG 373 CO -0.05 -0.22 0.55 1.88 -1.51 0.00 0.00 179.97 180.62 2cvx h TYR 374 N -0.52 0.88 -0.45 2.20 0.99 -0.97 0.87 116.97 119.97 2cvx h TYR 374 Ca -0.04 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.67 2cvx h TYR 374 Cb 0.39 -0.29 -0.02 0.00 1.00 0.00 0.00 36.73 37.81 2cvx h TYR 374 CO -0.03 0.42 0.14 1.49 -0.00 0.00 0.00 178.16 180.18 2cvx h GLU 375 N 0.83 0.70 -0.04 4.88 4.81 -0.98 -2.27 114.58 122.51 2cvx h GLU 375 Ca 0.38 -0.15 -0.16 0.00 -0.13 0.00 0.00 59.36 59.30 2cvx h GLU 375 Cb 0.38 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2cvx h GLU 375 CO -0.15 0.67 -0.70 0.87 -0.73 0.00 0.00 179.01 178.97 2cvx h LYS 376 N 0.59 0.20 0.00 1.92 1.57 -0.52 -2.91 116.57 117.42 2cvx h LYS 376 Ca 0.14 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2cvx h LYS 376 Cb 0.27 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2cvx h LYS 376 CO -0.00 0.82 0.00 0.39 -0.57 0.00 0.00 179.45 180.09 2cvx n GLU 377 N -3.79 0.59 -2.67 3.15 1.02 0.23 -4.87 120.64 114.31 2cvx n GLU 377 Ca -0.03 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.00 2cvx n GLU 377 Cb 0.68 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.62 2cvx n GLU 377 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2cvx n GLY 378 N 0.18 0.06 0.41 0.62 0.00 -1.10 -4.94 105.19 100.42 2cvx n GLY 378 Ca 0.14 -0.31 0.14 0.00 0.00 0.00 0.00 46.02 45.99 2cvx n GLY 378 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cvx n ARG 379 N -2.46 1.39 -0.22 1.61 1.74 -0.86 -4.93 116.66 112.92 2cvx n ARG 379 Ca -0.06 -0.82 0.00 0.00 -0.77 0.00 0.00 57.85 56.20 2cvx n ARG 379 Cb 0.56 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 2cvx n ARG 379 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cvx n GLY 380 N 1.24 5.46 3.03 -0.13 0.00 -1.26 -4.74 105.19 108.78 2cvx n GLY 380 Ca 0.17 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.33 2cvx n GLY 380 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cvx s LYS 381 N 0.67 2.36 0.06 1.61 2.20 0.08 -4.92 119.74 121.81 2cvx s LYS 381 Ca 0.00 -0.58 -0.19 0.00 -0.36 0.00 0.00 55.97 54.83 2cvx s LYS 381 Cb 0.00 -2.14 -0.06 0.00 -1.51 0.00 0.00 37.83 34.11 2cvx s LYS 381 CO 0.00 -0.23 0.57 0.99 -0.36 0.00 0.00 175.35 176.32 2cvx s THR 382 N 1.46 4.77 0.23 3.43 2.01 -1.26 -0.67 115.64 125.61 2cvx s THR 382 Ca 0.05 1.22 0.04 0.00 0.31 0.00 0.00 61.69 63.31 2cvx s THR 382 Cb -0.13 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.46 2cvx s THR 382 CO -0.11 0.54 0.16 0.00 -0.69 0.00 0.00 174.62 174.51 2cvx n ILE 383 N 1.87 0.00 -2.66 1.82 0.13 0.34 -4.98 119.36 115.88 2cvx n ILE 383 Ca -0.10 -1.58 -0.42 0.00 -1.10 0.00 0.00 62.75 59.56 2cvx n ILE 383 Cb 0.51 0.72 -0.03 0.00 -0.84 0.00 0.00 39.64 40.00 2cvx n ILE 383 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 2cvx s LYS 384 N -2.92 4.53 0.21 9.51 -0.14 -1.26 -1.03 119.74 128.64 2cvx s LYS 384 Ca 0.22 1.48 -0.09 0.00 -1.36 0.00 0.00 55.97 56.22 2cvx s LYS 384 Cb 0.01 -3.45 0.25 0.00 -1.68 0.00 0.00 37.83 32.96 2cvx s LYS 384 CO 0.16 -0.11 1.80 0.00 -0.76 0.00 0.00 175.35 176.44 2cvx h ALA 385 N 6.83 0.89 0.00 5.17 0.00 -1.61 -2.18 119.26 128.35 2cvx h ALA 385 Ca -0.40 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2cvx h ALA 385 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2cvx h ALA 385 CO 0.77 0.01 0.00 1.04 0.00 0.00 0.00 179.25 181.07 2cvx n GLN 386 N -4.82 0.07 -0.09 0.00 6.02 -1.26 -0.54 117.38 116.76 2cvx n GLN 386 Ca 0.09 0.34 -0.13 0.00 -0.01 0.00 0.00 57.00 57.29 2cvx n GLN 386 Cb 0.19 -1.64 -0.05 0.00 1.02 0.00 0.00 30.24 29.77 2cvx n GLN 386 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 2cvx h LYS 387 N 0.00 0.57 -0.22 -1.09 3.64 -1.79 -1.71 116.57 115.96 2cvx h LYS 387 Ca 0.00 -0.27 -0.05 0.00 -1.27 0.00 0.00 60.65 59.06 2cvx h LYS 387 Cb 0.26 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2cvx h LYS 387 CO 0.00 0.85 -0.05 1.25 -2.27 0.00 0.00 179.45 179.22 2cvx h LEU 388 N 0.29 0.43 -0.58 5.20 6.46 -0.88 -2.96 115.31 123.28 2cvx h LEU 388 Ca 0.05 -0.36 0.11 0.00 -0.12 0.00 0.00 57.88 57.56 2cvx h LEU 388 Cb 0.70 -0.12 -0.09 0.00 -0.73 0.00 0.00 40.66 40.42 2cvx h LEU 388 CO 0.05 0.70 0.05 -0.25 -0.62 0.00 0.00 178.44 178.36 2cvx h TRP 389 N 0.16 0.05 -0.43 1.25 2.91 -1.29 0.13 115.95 118.72 2cvx h TRP 389 Ca 0.06 0.04 -0.10 0.00 1.13 0.00 0.00 58.89 60.02 2cvx h TRP 389 Cb 0.51 0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 29.21 2cvx h TRP 389 CO 0.05 -0.10 -0.13 -0.92 -1.03 0.00 0.00 178.44 176.31 2cvx h TYR 390 N 0.16 0.87 -0.45 2.65 3.20 -1.32 -0.44 116.97 121.65 2cvx h TYR 390 Ca 0.30 -0.17 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 2cvx h TYR 390 Cb 0.46 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2cvx h TYR 390 CO -0.31 0.87 0.13 0.77 -1.64 0.00 0.00 178.16 177.98 2cvx h SER 391 N 0.71 0.67 0.04 -2.11 0.02 -1.18 -0.14 113.55 111.56 2cvx h SER 391 Ca 0.12 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2cvx h SER 391 Cb 0.62 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.93 2cvx h SER 391 CO 0.04 0.71 -0.34 0.40 -1.14 0.00 0.00 176.83 176.50 2cvx h ILE 392 N 0.60 0.27 -0.74 3.27 1.08 -0.31 -2.21 117.51 119.47 2cvx h ILE 392 Ca 0.14 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.63 2cvx h ILE 392 Cb 0.29 0.27 -0.04 0.00 -3.07 0.00 0.00 36.82 34.28 2cvx h ILE 392 CO -0.00 0.00 0.49 -0.07 -0.69 0.00 0.00 178.15 177.88 2cvx h LEU 393 N -0.52 0.82 -0.12 1.44 3.38 -1.01 -2.33 115.31 116.97 2cvx h LEU 393 Ca 0.05 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2cvx h LEU 393 Cb 0.59 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2cvx h LEU 393 CO -0.25 0.58 0.07 -0.08 0.09 0.00 0.00 178.44 178.85 2cvx h GLU 394 N 0.96 0.17 -0.27 1.13 4.81 -0.86 -2.45 114.58 118.07 2cvx h GLU 394 Ca 0.28 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 2cvx h GLU 394 Cb -0.05 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2cvx h GLU 394 CO -0.07 0.17 -0.07 0.00 -0.73 0.00 0.00 179.01 178.31 2cvx h ALA 395 N 0.98 1.38 -0.14 2.92 0.00 -0.92 -2.37 119.26 121.11 2cvx h ALA 395 Ca 0.04 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2cvx h ALA 395 Cb 0.05 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2cvx h ALA 395 CO -0.01 0.43 -0.14 1.96 0.00 0.00 0.00 179.25 181.49 2cvx h GLN 396 N 0.41 0.34 -0.74 0.00 4.20 -1.17 0.29 115.11 118.44 2cvx h GLN 396 Ca 0.08 -0.18 0.14 0.00 0.06 0.00 0.00 58.65 58.75 2cvx h GLN 396 Cb 0.39 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.08 2cvx h GLN 396 CO 0.02 0.73 0.29 1.15 -0.67 0.00 0.00 178.83 180.35 2cvx h THR 397 N -0.03 0.66 0.15 -0.54 2.02 -1.31 -0.86 112.91 113.00 2cvx h THR 397 Ca 0.02 -0.15 -0.32 0.00 0.77 0.00 0.00 66.41 66.74 2cvx h THR 397 Cb 0.67 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2cvx h THR 397 CO 0.04 0.08 -1.54 -0.33 0.37 0.00 0.00 175.52 174.14 2cvx h GLU 398 N 0.44 0.32 0.00 6.66 5.08 -1.25 -3.41 114.58 122.41 2cvx h GLU 398 Ca 0.41 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2cvx h GLU 398 Cb 0.61 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2cvx h GLU 398 CO -0.40 1.20 -0.11 0.25 -1.00 0.00 0.00 179.01 178.96 2cvx n THR 399 N -3.52 0.00 0.00 1.13 -2.24 0.08 -4.99 114.28 104.74 2cvx n THR 399 Ca -0.17 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2cvx n THR 399 Cb 1.06 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 70.22 2cvx n THR 399 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cvx n GLY 400 N 1.06 2.14 3.25 3.38 0.00 -0.33 -4.99 105.19 109.69 2cvx n GLY 400 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2cvx n GLY 400 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cvx s THR 401 N -2.70 1.29 0.44 2.61 -4.23 -1.26 -1.88 115.64 109.90 2cvx s THR 401 Ca 0.00 -1.86 -0.10 0.00 -1.18 0.00 0.00 61.69 58.55 2cvx s THR 401 Cb 0.00 -1.65 -0.06 0.00 1.34 0.00 0.00 72.50 72.13 2cvx s THR 401 CO 0.00 -0.54 0.80 -2.16 -0.54 0.00 0.00 174.62 172.18 2cvx s PRO 402 N -3.08 3.75 1.00 3.99 0.04 -1.26 -2.59 135.00 136.86 2cvx s PRO 402 Ca 0.12 0.49 -0.11 0.00 0.04 0.00 0.00 61.00 61.54 2cvx s PRO 402 Cb -0.02 -2.35 0.19 0.00 0.04 0.00 0.00 34.50 32.36 2cvx s PRO 402 CO 0.02 -0.11 1.09 -0.06 0.04 0.00 0.00 177.00 177.99 2cvx s PHE 403 N -2.48 1.61 -0.11 0.56 2.99 -0.79 -4.81 117.98 114.94 2cvx s PHE 403 Ca 0.52 1.51 -0.02 0.00 0.00 0.00 0.00 56.93 58.93 2cvx s PHE 403 Cb -0.10 -3.22 0.04 0.00 0.00 0.00 0.00 43.02 39.73 2cvx s PHE 403 CO 0.34 -3.15 0.03 0.08 -0.00 0.00 0.00 175.22 172.52 2cvx s VAL 404 N -2.61 0.25 -0.05 -0.44 1.01 0.15 -0.56 120.40 118.16 2cvx s VAL 404 Ca 0.67 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.65 2cvx s VAL 404 Cb -0.23 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.58 2cvx s VAL 404 CO 0.60 0.06 -0.10 -0.69 0.00 0.00 0.00 175.10 174.97 2cvx s VAL 405 N 2.01 0.95 -0.42 2.92 1.01 -0.81 -0.82 120.40 125.23 2cvx s VAL 405 Ca 0.03 -0.39 -0.22 0.00 0.00 0.00 0.00 61.98 61.40 2cvx s VAL 405 Cb -0.14 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.39 2cvx s VAL 405 CO -0.06 0.31 0.73 -0.31 0.00 0.00 0.00 175.10 175.76 2cvx s TYR 406 N 0.58 3.05 0.26 5.22 1.51 0.75 -0.93 117.35 127.79 2cvx s TYR 406 Ca -0.11 0.20 -0.03 0.00 -1.01 0.00 0.00 57.07 56.12 2cvx s TYR 406 Cb -0.14 -3.46 0.42 0.00 -0.11 0.00 0.00 41.96 38.67 2cvx s TYR 406 CO 0.02 -0.86 1.85 -0.22 -1.11 0.00 0.00 175.55 175.23 2cvx h LYS 407 N 8.80 0.97 -0.05 -0.62 3.64 -1.57 -2.25 116.57 125.49 2cvx h LYS 407 Ca -0.25 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 58.95 2cvx h LYS 407 Cb 1.09 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.70 2cvx h LYS 407 CO 0.92 0.64 -0.42 -0.44 -2.27 0.00 0.00 179.45 177.88 2cvx h ASP 408 N 1.00 0.46 -0.43 4.20 3.32 -1.93 -1.40 116.42 121.64 2cvx h ASP 408 Ca 0.43 -0.68 0.07 0.00 0.02 0.00 0.00 57.03 56.86 2cvx h ASP 408 Cb 0.29 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 39.64 2cvx h ASP 408 CO -0.21 1.08 0.07 0.00 -1.72 0.00 0.00 179.24 178.45 2cvx h ALA 409 N 0.40 0.45 -0.30 3.45 0.00 -1.87 0.33 119.26 121.72 2cvx h ALA 409 Ca -0.04 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2cvx h ALA 409 Cb 1.09 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 2cvx h ALA 409 CO 0.09 -0.34 0.07 0.00 0.00 0.00 0.00 179.25 179.07 2cvx h ASN 411 N 0.19 0.41 -0.52 0.00 2.35 -0.93 -3.17 115.58 113.91 2cvx h ASN 411 Ca 0.14 -0.68 -0.06 0.00 -0.55 0.00 0.00 56.30 55.14 2cvx h ASN 411 Cb 0.14 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 2cvx h ASN 411 CO -0.17 1.03 0.10 -0.09 -1.65 0.00 0.00 177.43 176.64 2cvx h ARG 412 N -0.18 0.91 -0.88 0.81 2.43 -0.35 -3.23 114.38 113.89 2cvx h ARG 412 Ca -0.03 -0.21 -0.58 0.00 -0.81 0.00 0.00 59.98 58.34 2cvx h ARG 412 Cb 1.04 -0.12 -0.31 0.00 -0.42 0.00 0.00 29.97 30.16 2cvx h ARG 412 CO 0.07 0.84 0.39 1.63 -1.51 0.00 0.00 179.97 181.39 2cvx n LYS 413 N -4.24 2.76 -5.15 0.20 5.02 -0.54 -4.97 118.16 111.23 2cvx n LYS 413 Ca 0.04 -3.44 -0.32 0.00 -2.02 0.00 0.00 58.31 52.57 2cvx n LYS 413 Cb 0.26 -2.23 -0.16 0.00 -0.02 0.00 0.00 35.03 32.88 2cvx n LYS 413 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2cvx s SER 414 N -2.22 3.27 0.37 4.39 0.15 -1.20 -4.90 113.70 113.56 2cvx s SER 414 Ca 0.59 -0.49 0.27 0.00 0.70 0.00 0.00 55.95 57.02 2cvx s SER 414 Cb 0.47 -1.22 1.26 0.00 -1.71 0.00 0.00 66.02 64.82 2cvx s SER 414 CO 0.02 0.20 1.81 -1.13 1.20 0.00 0.00 173.24 175.34 2cvx h ASN 415 N 6.42 0.00 -0.29 5.45 -1.24 -1.85 -2.58 115.58 121.49 2cvx h ASN 415 Ca -0.26 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.75 2cvx h ASN 415 Cb 1.21 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.26 2cvx h ASN 415 CO 0.48 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.62 2cvx n GLN 416 N -2.47 2.21 0.22 6.67 6.02 -1.26 -4.42 117.38 124.33 2cvx n GLN 416 Ca 0.00 -1.26 0.07 0.00 -0.01 0.00 0.00 57.00 55.80 2cvx n GLN 416 Cb 0.17 -1.53 0.50 0.00 1.02 0.00 0.00 30.24 30.40 2cvx n GLN 416 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 2cvx h LYS 417 N 1.82 0.00 0.00 -1.09 2.10 -1.73 -1.30 116.57 116.36 2cvx h LYS 417 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2cvx h LYS 417 Cb 0.77 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.10 2cvx h LYS 417 CO 0.10 0.26 0.00 0.27 -2.00 0.00 0.00 179.45 178.08 2cvx n ASN 418 N -3.80 0.00 0.03 7.07 6.94 -1.26 -3.12 115.26 121.11 2cvx n ASN 418 Ca -0.01 0.41 -0.07 0.00 -0.02 0.00 0.00 54.58 54.88 2cvx n ASN 418 Cb 0.35 -0.44 -0.12 0.00 -2.36 0.00 0.00 39.78 37.21 2cvx n ASN 418 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 2cvx h LEU 419 N 0.00 0.00 0.00 -4.53 3.38 -1.58 -3.51 115.31 109.07 2cvx h LEU 419 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2cvx h LEU 419 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2cvx h LEU 419 CO 0.00 0.95 0.00 0.61 0.09 0.00 0.00 178.44 180.09 2cvx n GLY 420 N 1.44 0.76 3.74 0.83 0.00 -1.18 -5.09 105.19 105.69 2cvx n GLY 420 Ca -0.08 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 2cvx n GLY 420 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cvx s VAL 421 N -2.05 4.84 -0.03 1.61 1.01 -1.26 -4.69 120.40 119.83 2cvx s VAL 421 Ca 0.00 1.54 -0.23 0.00 0.00 0.00 0.00 61.98 63.28 2cvx s VAL 421 Cb 0.00 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2cvx s VAL 421 CO 0.00 0.34 0.71 -0.63 0.00 0.00 0.00 175.10 175.51 2cvx s ILE 422 N 0.16 4.95 -0.63 2.22 1.01 -1.26 -4.76 121.20 122.88 2cvx s ILE 422 Ca 0.37 1.47 0.07 0.00 0.00 0.00 0.00 60.65 62.56 2cvx s ILE 422 Cb -0.19 -4.05 0.00 0.00 0.01 0.00 0.00 42.46 38.23 2cvx s ILE 422 CO 0.21 0.30 0.52 0.29 0.00 0.00 0.00 174.94 176.27 2cvx n LYS 423 N 3.38 2.20 -3.79 2.79 5.02 -1.26 -4.91 118.16 121.58 2cvx n LYS 423 Ca -0.02 -0.51 -0.08 0.00 -2.02 0.00 0.00 58.31 55.68 2cvx n LYS 423 Cb 0.51 -0.99 -0.02 0.00 -0.02 0.00 0.00 35.03 34.51 2cvx n LYS 423 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2cvx s SER 424 N -1.05 -0.30 0.00 4.39 1.04 -1.26 -4.82 113.70 111.70 2cvx s SER 424 Ca 0.06 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.97 2cvx s SER 424 Cb 0.05 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.88 2cvx s SER 424 CO 0.17 -1.29 0.00 -0.24 0.98 0.00 0.00 173.24 172.86 2cvx n SER 425 N -0.45 0.00 -1.20 7.02 2.88 -1.26 -4.43 113.62 116.18 2cvx n SER 425 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 2cvx n SER 425 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 2cvx n SER 425 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2cvx n ASN 426 N 0.00 1.43 -0.16 -3.46 6.94 -1.24 -4.53 115.26 114.24 2cvx n ASN 426 Ca 0.00 -0.70 0.12 0.00 -0.02 0.00 0.00 54.58 53.98 2cvx n ASN 426 Cb 0.00 0.00 0.46 0.00 -2.36 0.00 0.00 39.78 37.88 2cvx n ASN 426 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2cvx h LEU 427 N 0.00 0.47 -3.01 -4.53 5.85 -1.86 -2.89 115.31 109.34 2cvx h LEU 427 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2cvx h LEU 427 Cb 0.00 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2cvx h LEU 427 CO 0.00 0.26 0.00 0.00 -0.34 0.00 0.00 178.44 178.36 2cvx n GLU 430 N -2.95 2.34 -3.01 0.00 0.00 -1.26 -4.00 120.64 111.76 2cvx n GLU 430 Ca -0.16 -0.01 -0.40 0.00 0.00 0.00 0.00 57.16 56.59 2cvx n GLU 430 Cb 0.63 -1.08 -0.05 0.00 0.00 0.00 0.00 31.44 30.94 2cvx n GLU 430 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2cvx s ILE 431 N -2.13 4.95 -0.36 3.84 -1.09 -1.26 -1.21 121.20 123.93 2cvx s ILE 431 Ca -0.02 1.53 0.01 0.00 -2.23 0.00 0.00 60.65 59.94 2cvx s ILE 431 Cb 0.01 -4.08 0.11 0.00 -1.58 0.00 0.00 42.46 36.93 2cvx s ILE 431 CO 0.14 0.28 0.14 0.54 -1.23 0.00 0.00 174.94 174.81 2cvx s VAL 432 N 0.55 1.21 0.01 2.92 0.11 -1.26 -3.65 120.40 120.29 2cvx s VAL 432 Ca 0.39 -1.88 -0.02 0.00 -2.93 0.00 0.00 61.98 57.53 2cvx s VAL 432 Cb -0.19 -1.89 -0.01 0.00 -1.53 0.00 0.00 36.38 32.76 2cvx s VAL 432 CO 0.20 -0.74 0.02 -1.61 -3.33 0.00 0.00 175.10 169.64 2cvx s GLU 433 N 1.13 0.32 0.17 1.54 2.02 -1.26 -4.88 118.70 117.73 2cvx s GLU 433 Ca 0.12 -0.47 -0.30 0.00 0.02 0.00 0.00 54.97 54.34 2cvx s GLU 433 Cb -0.20 0.12 -0.08 0.00 0.10 0.00 0.00 34.13 34.08 2cvx s GLU 433 CO -0.15 -0.06 1.15 -0.47 0.02 0.00 0.00 175.26 175.75 2cvx s TYR 434 N -1.25 3.51 0.02 1.61 5.04 -1.26 -4.68 117.35 120.33 2cvx s TYR 434 Ca -0.14 1.50 0.02 0.00 -2.44 0.00 0.00 57.07 56.01 2cvx s TYR 434 Cb -0.08 -3.35 -0.01 0.00 0.35 0.00 0.00 41.96 38.86 2cvx s TYR 434 CO -0.00 -0.91 -0.06 -1.54 -1.34 0.00 0.00 175.55 171.70 2cvx s SER 435 N 0.11 0.62 0.19 4.32 1.04 -1.26 -4.23 113.70 114.49 2cvx s SER 435 Ca 0.52 -0.29 -0.01 0.00 0.48 0.00 0.00 55.95 56.64 2cvx s SER 435 Cb -0.31 -0.01 -0.04 0.00 0.10 0.00 0.00 66.02 65.77 2cvx s SER 435 CO 0.35 -0.07 0.12 0.00 0.98 0.00 0.00 173.24 174.62 2cvx s ALA 436 N -0.70 1.13 0.39 5.32 0.00 0.53 -4.80 121.76 123.63 2cvx s ALA 436 Ca -0.04 -1.67 0.21 0.00 0.00 0.00 0.00 51.96 50.46 2cvx s ALA 436 Cb -0.06 1.33 1.20 0.00 0.00 0.00 0.00 23.12 25.60 2cvx s ALA 436 CO -0.00 -0.58 1.68 -1.35 0.00 0.00 0.00 175.76 175.51 2cvx h PRO 437 N 2.65 0.26 -0.01 0.00 0.11 -1.87 0.92 132.00 134.05 2cvx h PRO 437 Ca -0.36 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2cvx h PRO 437 Cb 1.24 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2cvx h PRO 437 CO 0.54 0.17 -0.34 -0.40 -0.21 0.00 0.00 178.00 177.76 2cvx n ASP 438 N -4.82 1.72 -3.76 -2.05 3.85 -1.26 -4.85 116.55 105.38 2cvx n ASP 438 Ca 0.32 -1.33 -0.26 0.00 -0.71 0.00 0.00 54.79 52.80 2cvx n ASP 438 Cb 1.10 0.30 -0.17 0.00 -1.35 0.00 0.00 41.12 41.00 2cvx n ASP 438 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 2cvx s GLU 439 N -2.42 0.70 -0.31 0.11 2.02 0.32 -4.52 118.70 114.59 2cvx s GLU 439 Ca 0.22 -0.25 -0.09 0.00 0.02 0.00 0.00 54.97 54.87 2cvx s GLU 439 Cb 0.19 -1.73 -0.00 0.00 0.10 0.00 0.00 34.13 32.69 2cvx s GLU 439 CO 0.52 -0.51 0.15 0.99 0.02 0.00 0.00 175.26 176.43 2cvx s THR 440 N 1.88 4.53 0.46 3.63 2.01 -0.33 -0.35 115.64 127.47 2cvx s THR 440 Ca 0.01 -0.49 -0.23 0.00 0.31 0.00 0.00 61.69 61.29 2cvx s THR 440 Cb -0.15 -3.33 -0.07 0.00 0.01 0.00 0.00 72.50 68.95 2cvx s THR 440 CO -0.07 0.04 1.21 0.00 -0.69 0.00 0.00 174.62 175.11 2cvx s ALA 441 N 1.59 3.00 0.06 7.40 0.00 -0.93 -3.76 121.76 129.14 2cvx s ALA 441 Ca 0.04 1.03 0.03 0.00 0.00 0.00 0.00 51.96 53.06 2cvx s ALA 441 Cb -0.17 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 2cvx s ALA 441 CO 0.06 -0.76 -0.10 0.08 0.00 0.00 0.00 175.76 175.04 2cvx s VAL 442 N -1.46 0.77 -0.03 0.00 1.01 -1.26 -0.32 120.40 119.11 2cvx s VAL 442 Ca 0.63 -1.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 2cvx s VAL 442 Cb -0.32 -0.93 0.01 0.00 0.00 0.00 0.00 36.38 35.15 2cvx s VAL 442 CO 0.39 -0.40 0.18 0.00 0.00 0.00 0.00 175.10 175.27 2cvx s ASN 444 N -0.75 3.52 0.16 0.00 0.01 -1.26 -1.71 114.94 114.91 2cvx s ASN 444 Ca -0.08 -0.45 0.10 0.00 -0.71 0.00 0.00 52.86 51.71 2cvx s ASN 444 Cb -0.05 -1.50 -0.04 0.00 0.41 0.00 0.00 41.25 40.07 2cvx s ASN 444 CO 0.01 0.16 -0.21 -0.76 -1.51 0.00 0.00 177.10 174.79 2cvx s LEU 445 N 0.34 2.40 0.02 0.60 1.43 -1.26 -1.78 118.68 120.42 2cvx s LEU 445 Ca -0.15 -0.83 -0.21 0.00 -1.03 0.00 0.00 54.13 51.91 2cvx s LEU 445 Cb -0.17 -0.98 0.04 0.00 0.03 0.00 0.00 46.19 45.12 2cvx s LEU 445 CO 0.07 0.05 0.47 0.00 0.23 0.00 0.00 176.35 177.17 2cvx s ALA 446 N -1.70 -1.19 -0.02 4.21 0.00 -0.85 -2.13 121.76 120.09 2cvx s ALA 446 Ca 0.16 0.57 0.06 0.00 0.00 0.00 0.00 51.96 52.74 2cvx s ALA 446 Cb -0.07 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.28 2cvx s ALA 446 CO 0.07 -0.42 -0.19 -1.54 0.00 0.00 0.00 175.76 173.68 2cvx s SER 447 N -1.72 2.27 -0.02 0.00 1.04 -0.53 0.02 113.70 114.75 2cvx s SER 447 Ca -0.08 -0.35 -0.20 0.00 0.48 0.00 0.00 55.95 55.80 2cvx s SER 447 Cb -0.01 -0.30 -0.05 0.00 0.10 0.00 0.00 66.02 65.76 2cvx s SER 447 CO 0.01 0.23 0.57 -0.69 0.98 0.00 0.00 173.24 174.34 2cvx s VAL 448 N -0.40 4.97 -0.79 5.02 1.01 -0.18 -1.44 120.40 128.58 2cvx s VAL 448 Ca 0.06 1.19 -0.23 0.00 0.00 0.00 0.00 61.98 63.00 2cvx s VAL 448 Cb -0.08 -3.91 0.07 0.00 0.00 0.00 0.00 36.38 32.46 2cvx s VAL 448 CO -0.00 0.41 1.15 0.00 0.00 0.00 0.00 175.10 176.66 2cvx s ALA 449 N -0.07 3.01 0.43 5.51 0.00 -0.73 0.07 121.76 129.98 2cvx s ALA 449 Ca 0.30 -1.99 0.11 0.00 0.00 0.00 0.00 51.96 50.38 2cvx s ALA 449 Cb -0.18 -4.11 0.96 0.00 0.00 0.00 0.00 23.12 19.80 2cvx s ALA 449 CO 0.16 -3.08 2.03 -0.07 0.00 0.00 0.00 175.76 174.80 2cvx h LEU 450 N 11.80 0.39 -2.35 0.00 3.38 -1.54 -2.29 115.31 124.71 2cvx h LEU 450 Ca -0.11 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2cvx h LEU 450 Cb 1.05 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2cvx h LEU 450 CO 1.23 0.27 0.00 -0.65 0.09 0.00 0.00 178.44 179.38 2cvx h PRO 451 N 0.45 0.00 0.00 1.13 0.11 -1.78 -3.13 132.00 128.77 2cvx h PRO 451 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 2cvx h PRO 451 Cb 0.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.30 2cvx h PRO 451 CO -0.05 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.74 2cvx n ALA 452 N -2.01 1.94 -0.16 -0.75 0.00 -0.86 -2.76 120.51 115.91 2cvx n ALA 452 Ca -0.02 -0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.40 2cvx n ALA 452 Cb 0.11 -1.30 0.15 0.00 0.00 0.00 0.00 19.45 18.41 2cvx n ALA 452 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2cvx n PHE 453 N -1.37 0.46 -2.71 0.00 3.01 -1.18 -4.92 117.46 110.75 2cvx n PHE 453 Ca 0.07 -0.48 -0.42 0.00 1.01 0.00 0.00 57.45 57.63 2cvx n PHE 453 Cb 0.18 -0.03 -0.03 0.00 -0.01 0.00 0.00 39.48 39.59 2cvx n PHE 453 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2cvx s ILE 454 N -1.00 4.83 -0.11 4.37 1.01 -1.11 0.78 121.20 129.97 2cvx s ILE 454 Ca 0.24 2.03 0.02 0.00 0.00 0.00 0.00 60.65 62.94 2cvx s ILE 454 Cb 0.12 -4.31 0.01 0.00 0.01 0.00 0.00 42.46 38.30 2cvx s ILE 454 CO 0.16 0.08 -0.16 -1.61 0.00 0.00 0.00 174.94 173.41 2cvx s GLU 455 N 1.55 2.25 0.05 2.79 2.02 -0.59 -4.94 118.70 121.84 2cvx s GLU 455 Ca 0.50 -0.58 -0.31 0.00 0.02 0.00 0.00 54.97 54.60 2cvx s GLU 455 Cb -0.19 -1.90 -0.10 0.00 0.10 0.00 0.00 34.13 32.04 2cvx s GLU 455 CO 0.22 -0.04 1.90 2.41 0.02 0.00 0.00 175.26 179.77 2cvx n THR 456 N 4.14 0.57 -0.91 3.63 -1.04 -1.26 0.05 114.28 119.46 2cvx n THR 456 Ca -0.19 -0.10 -0.29 0.00 -2.04 0.00 0.00 64.05 61.42 2cvx n THR 456 Cb 0.51 -2.15 0.18 0.00 -1.82 0.00 0.00 70.33 67.06 2cvx n THR 456 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2cvx s SER 457 N 3.65 2.47 0.00 8.00 0.15 0.44 -4.78 113.70 123.62 2cvx s SER 457 Ca 0.87 1.58 -0.01 0.00 0.70 0.00 0.00 55.95 59.09 2cvx s SER 457 Cb -0.50 -2.24 -0.03 0.00 -1.71 0.00 0.00 66.02 61.54 2cvx s SER 457 CO 0.42 -3.28 0.80 1.21 1.20 0.00 0.00 173.24 173.58 2cvx n GLU 458 N -4.31 0.25 0.00 5.44 4.07 -1.26 -1.40 120.64 123.42 2cvx n GLU 458 Ca 0.06 -0.11 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 2cvx n GLU 458 Cb 0.55 -1.54 0.00 0.00 -0.06 0.00 0.00 31.44 30.39 2cvx n GLU 458 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 2cvx n ASP 459 N 2.71 0.00 -1.03 4.31 5.75 -1.26 -5.16 116.55 121.87 2cvx n ASP 459 Ca 0.05 -0.19 0.14 0.00 -0.01 0.00 0.00 54.79 54.78 2cvx n ASP 459 Cb 0.12 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.17 2cvx n ASP 459 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cvx n GLY 460 N 0.00 -1.82 5.00 6.12 0.00 -0.50 -4.85 105.19 109.15 2cvx n GLY 460 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 2cvx n GLY 460 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2cvx n LYS 461 N -3.38 0.00 -3.80 1.61 2.85 -1.26 -4.67 118.16 109.51 2cvx n LYS 461 Ca 0.00 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 56.89 2cvx n LYS 461 Cb 0.47 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.79 2cvx n LYS 461 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 2cvx s THR 462 N 0.00 5.42 -0.12 0.58 -1.32 -1.26 -5.00 115.64 113.95 2cvx s THR 462 Ca 0.00 0.32 -0.04 0.00 -1.21 0.00 0.00 61.69 60.76 2cvx s THR 462 Cb 0.00 -3.46 -0.03 0.00 -1.51 0.00 0.00 72.50 67.50 2cvx s THR 462 CO 0.00 0.60 0.02 -0.44 -2.21 0.00 0.00 174.62 172.59 2cvx s SER 463 N -0.95 5.32 0.49 8.08 0.01 -1.26 0.17 113.70 125.56 2cvx s SER 463 Ca 0.16 0.11 0.03 0.00 1.31 0.00 0.00 55.95 57.57 2cvx s SER 463 Cb -0.13 -1.66 -0.02 0.00 0.21 0.00 0.00 66.02 64.42 2cvx s SER 463 CO 0.05 0.31 0.07 0.42 0.41 0.00 0.00 173.24 174.50 2cvx s THR 464 N -0.46 1.46 -0.19 1.44 -4.23 0.11 -4.85 115.64 108.92 2cvx s THR 464 Ca 0.09 -1.91 -0.02 0.00 -1.18 0.00 0.00 61.69 58.66 2cvx s THR 464 Cb -0.12 -2.38 -0.01 0.00 1.34 0.00 0.00 72.50 71.34 2cvx s THR 464 CO 0.02 0.00 -0.09 -0.47 -0.54 0.00 0.00 174.62 173.54 2cvx s TYR 465 N -2.81 2.90 -1.09 3.99 5.04 -1.26 -1.54 117.35 122.57 2cvx s TYR 465 Ca 0.17 -0.97 -0.19 0.00 -2.44 0.00 0.00 57.07 53.65 2cvx s TYR 465 Cb 0.03 -2.01 0.10 0.00 0.35 0.00 0.00 41.96 40.43 2cvx s TYR 465 CO 0.09 -0.50 1.42 1.21 -1.34 0.00 0.00 175.55 176.43 2cvx s ASN 466 N 1.17 6.72 0.52 4.32 3.84 0.23 -4.80 114.94 126.94 2cvx s ASN 466 Ca 0.02 -2.14 0.31 0.00 0.21 0.00 0.00 52.86 51.25 2cvx s ASN 466 Cb -0.14 -2.49 1.33 0.00 -0.55 0.00 0.00 41.25 39.39 2cvx s ASN 466 CO -0.03 -1.16 1.98 -0.26 -2.79 0.00 0.00 177.10 174.84 2cvx h PHE 467 N 8.53 0.00 -0.21 0.43 -1.00 -1.97 -2.34 116.94 120.38 2cvx h PHE 467 Ca 0.26 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.88 2cvx h PHE 467 Cb 0.96 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.52 2cvx h PHE 467 CO 1.24 0.09 -0.51 0.87 -1.61 0.00 0.00 178.31 178.39 2cvx h LYS 468 N 0.00 0.72 -0.24 1.51 1.57 -1.98 -2.17 116.57 115.98 2cvx h LYS 468 Ca -0.00 -0.49 -0.05 0.00 -1.87 0.00 0.00 60.65 58.24 2cvx h LYS 468 Cb 0.52 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2cvx h LYS 468 CO 0.01 1.11 -0.05 0.87 -0.57 0.00 0.00 179.45 180.82 2cvx h LYS 469 N 0.43 0.45 -0.26 3.15 1.79 -1.93 -1.95 116.57 118.26 2cvx h LYS 469 Ca -0.00 -0.17 0.05 0.00 -2.18 0.00 0.00 60.65 58.35 2cvx h LYS 469 Cb 1.12 -0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 31.70 2cvx h LYS 469 CO 0.11 0.67 -0.04 1.25 -1.08 0.00 0.00 179.45 180.36 2cvx h LEU 470 N 0.20 -0.19 -0.50 2.94 5.85 -1.48 0.14 115.31 122.26 2cvx h LEU 470 Ca 0.06 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.95 2cvx h LEU 470 Cb 0.50 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.59 2cvx h LEU 470 CO 0.02 -0.06 -0.03 -0.74 -0.34 0.00 0.00 178.44 177.29 2cvx h HIS 471 N 0.02 -0.09 -0.15 1.25 2.76 -1.35 -0.03 115.15 117.56 2cvx h HIS 471 Ca 0.12 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 2cvx h HIS 471 Cb 0.18 0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 2cvx h HIS 471 CO -0.24 -0.14 0.09 1.49 -1.30 0.00 0.00 177.93 177.83 2cvx h GLU 472 N 0.08 0.19 -0.48 5.26 4.81 -0.57 -2.25 114.58 121.62 2cvx h GLU 472 Ca 0.25 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.43 2cvx h GLU 472 Cb 0.38 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 2cvx h GLU 472 CO -0.44 0.12 0.15 0.82 -0.73 0.00 0.00 179.01 178.93 2cvx h ILE 473 N 0.19 1.23 -0.09 2.32 5.03 -0.36 -2.01 117.51 123.81 2cvx h ILE 473 Ca 0.06 -0.75 -0.01 0.00 -0.12 0.00 0.00 64.86 64.04 2cvx h ILE 473 Cb -0.01 0.81 -0.01 0.00 -3.03 0.00 0.00 36.82 34.59 2cvx h ILE 473 CO -0.02 0.27 0.02 0.00 -0.68 0.00 0.00 178.15 177.74 2cvx h ALA 474 N 1.01 1.86 -0.19 1.87 0.00 -0.93 0.11 119.26 122.99 2cvx h ALA 474 Ca 0.15 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2cvx h ALA 474 Cb 0.27 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2cvx h ALA 474 CO -0.01 0.11 -0.16 0.87 0.00 0.00 0.00 179.25 180.07 2cvx h LYS 475 N 0.13 0.45 -0.40 0.00 1.79 -0.99 -1.07 116.57 116.48 2cvx h LYS 475 Ca 0.03 -0.22 0.07 0.00 -2.18 0.00 0.00 60.65 58.35 2cvx h LYS 475 Cb 0.06 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.65 2cvx h LYS 475 CO -0.00 0.78 0.04 0.28 -1.08 0.00 0.00 179.45 179.47 2cvx h VAL 476 N 0.12 0.75 -0.56 0.50 2.07 -0.41 -2.50 116.25 116.22 2cvx h VAL 476 Ca 0.04 -0.05 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 2cvx h VAL 476 Cb 0.68 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2cvx h VAL 476 CO 0.04 0.03 0.07 0.58 0.02 0.00 0.00 177.57 178.31 2cvx h VAL 477 N 0.16 1.26 -0.61 2.57 2.07 -0.79 -1.09 116.25 119.82 2cvx h VAL 477 Ca 0.20 -1.01 0.10 0.00 0.82 0.00 0.00 66.70 66.80 2cvx h VAL 477 Cb 0.26 0.82 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 2cvx h VAL 477 CO -0.29 0.37 0.20 0.74 0.02 0.00 0.00 177.57 178.61 2cvx h THR 478 N 0.83 0.74 -0.44 2.57 2.02 -1.05 -0.61 112.91 116.97 2cvx h THR 478 Ca 0.17 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.11 2cvx h THR 478 Cb 0.45 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 2cvx h THR 478 CO 0.02 0.07 -0.16 0.03 0.37 0.00 0.00 175.52 175.84 2cvx h ARG 479 N 0.37 0.84 0.04 6.66 3.08 -1.00 -1.77 114.38 122.61 2cvx h ARG 479 Ca 0.31 -0.31 0.01 0.00 0.07 0.00 0.00 59.98 60.06 2cvx h ARG 479 Cb 0.40 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 2cvx h ARG 479 CO -0.33 0.94 -0.11 -0.91 -1.07 0.00 0.00 179.97 178.50 2cvx h ASN 480 N 0.75 -0.30 -0.03 7.04 4.21 -0.47 -2.16 115.58 124.61 2cvx h ASN 480 Ca 0.11 0.04 -0.06 0.00 1.21 0.00 0.00 56.30 57.61 2cvx h ASN 480 Cb 0.68 0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.98 2cvx h ASN 480 CO 0.05 -0.16 -0.13 -0.07 -1.29 0.00 0.00 177.43 175.83 2cvx h LEU 481 N -0.20 0.31 -0.21 1.61 3.38 -1.02 -0.19 115.31 118.99 2cvx h LEU 481 Ca 0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2cvx h LEU 481 Cb 0.23 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2cvx h LEU 481 CO -0.08 0.47 0.08 0.78 0.09 0.00 0.00 178.44 179.78 2cvx h ASN 482 N 0.31 0.30 -0.71 -0.43 2.35 -1.18 -2.34 115.58 113.88 2cvx h ASN 482 Ca 0.06 -0.18 0.10 0.00 -0.55 0.00 0.00 56.30 55.73 2cvx h ASN 482 Cb 0.42 -0.08 -0.07 0.00 0.05 0.00 0.00 38.32 38.64 2cvx h ASN 482 CO 0.02 0.39 0.34 0.03 -1.65 0.00 0.00 177.43 176.57 2cvx h ARG 483 N 0.18 0.56 -0.81 0.81 2.47 -0.80 -2.29 114.38 114.51 2cvx h ARG 483 Ca 0.07 -0.03 0.06 0.00 -1.26 0.00 0.00 59.98 58.82 2cvx h ARG 483 Cb 0.19 -0.13 -0.06 0.00 -1.65 0.00 0.00 29.97 28.33 2cvx h ARG 483 CO -0.00 0.37 0.49 0.28 0.56 0.00 0.00 179.97 181.66 2cvx h VAL 484 N 0.58 1.01 -0.60 2.04 2.07 -0.77 -1.03 116.25 119.55 2cvx h VAL 484 Ca 0.35 -0.30 0.12 0.00 0.82 0.00 0.00 66.70 67.69 2cvx h VAL 484 Cb 0.39 0.05 -0.11 0.00 -1.52 0.00 0.00 31.29 30.11 2cvx h VAL 484 CO -0.28 0.16 -0.06 0.40 0.02 0.00 0.00 177.57 177.80 2cvx h ILE 485 N 0.88 0.46 0.00 4.57 2.04 -0.87 -0.50 117.51 124.09 2cvx h ILE 485 Ca 0.36 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 66.10 2cvx h ILE 485 Cb 0.20 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2cvx h ILE 485 CO -0.18 0.01 -0.47 0.44 0.00 0.00 0.00 178.15 177.95 2cvx h ASP 486 N 0.06 0.00 -0.00 1.72 3.45 -1.22 -3.27 116.42 117.16 2cvx h ASP 486 Ca 0.30 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.76 2cvx h ASP 486 Cb 0.48 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.25 2cvx h ASP 486 CO -0.55 0.47 -0.49 0.54 -1.57 0.00 0.00 179.24 177.64 2cvx n ARG 487 N -3.30 1.14 -2.30 3.56 1.74 -0.47 -4.97 116.66 112.06 2cvx n ARG 487 Ca 0.01 -0.94 -0.38 0.00 -0.77 0.00 0.00 57.85 55.78 2cvx n ARG 487 Cb 0.67 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.61 2cvx n ARG 487 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2cvx s ASN 488 N -2.50 6.51 -0.27 0.55 2.47 -0.23 -4.78 114.94 116.69 2cvx s ASN 488 Ca 0.18 2.33 -0.15 0.00 0.42 0.00 0.00 52.86 55.65 2cvx s ASN 488 Cb 0.18 -2.61 -0.04 0.00 -1.45 0.00 0.00 41.25 37.33 2cvx s ASN 488 CO 0.58 -0.68 0.36 -0.47 -3.72 0.00 0.00 177.10 173.17 2cvx s TYR 489 N -1.43 3.25 -0.18 0.43 5.04 0.16 -4.99 117.35 119.64 2cvx s TYR 489 Ca 0.57 0.39 -0.18 0.00 -2.44 0.00 0.00 57.07 55.42 2cvx s TYR 489 Cb -0.30 -2.56 -0.04 0.00 0.35 0.00 0.00 41.96 39.41 2cvx s TYR 489 CO 0.38 -0.22 0.49 0.71 -1.34 0.00 0.00 175.55 175.57 2cvx s TYR 490 N 2.03 3.41 0.38 4.97 2.02 -1.26 -4.31 117.35 124.59 2cvx s TYR 490 Ca 0.14 0.79 0.09 0.00 -0.37 0.00 0.00 57.07 57.72 2cvx s TYR 490 Cb -0.16 -2.61 0.75 0.00 -0.40 0.00 0.00 41.96 39.54 2cvx s TYR 490 CO 0.10 -0.01 1.90 -1.00 -1.57 0.00 0.00 175.55 174.97 2cvx h PRO 491 N 7.22 0.26 -4.00 -1.71 0.13 -1.95 -3.44 132.00 128.51 2cvx h PRO 491 Ca -0.36 -0.06 -0.16 0.00 -0.87 0.00 0.00 66.00 64.54 2cvx h PRO 491 Cb 1.16 -0.03 -0.20 0.00 0.13 0.00 0.00 31.00 32.06 2cvx h PRO 491 CO 0.74 0.40 -0.69 0.14 -0.23 0.00 0.00 178.00 178.36 2cvx s VAL 492 N -4.71 0.12 0.39 1.56 -7.23 -1.26 -4.80 120.40 104.47 2cvx s VAL 492 Ca -0.06 -1.01 0.06 0.00 -1.81 0.00 0.00 61.98 59.17 2cvx s VAL 492 Cb 0.15 -0.41 0.27 0.00 0.56 0.00 0.00 36.38 36.95 2cvx s VAL 492 CO 0.74 -0.55 2.03 -0.08 -0.31 0.00 0.00 175.10 176.93 2cvx h GLU 493 N 4.46 0.63 -0.44 4.82 4.57 -1.99 -2.65 114.58 123.98 2cvx h GLU 493 Ca -0.32 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 2cvx h GLU 493 Cb 1.20 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.63 2cvx h GLU 493 CO 0.44 0.42 0.29 0.93 -1.18 0.00 0.00 179.01 179.90 2cvx h GLU 494 N 0.65 0.58 -0.23 1.92 3.07 -1.93 -0.92 114.58 117.72 2cvx h GLU 494 Ca 0.19 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 2cvx h GLU 494 Cb -0.01 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 27.76 2cvx h GLU 494 CO -0.05 0.39 -0.17 0.00 -1.40 0.00 0.00 179.01 177.78 2cvx h ALA 495 N 1.72 0.33 -0.07 3.43 0.00 -1.56 -0.80 119.26 122.31 2cvx h ALA 495 Ca 0.16 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2cvx h ALA 495 Cb -0.06 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2cvx h ALA 495 CO -0.03 0.23 0.03 -0.09 0.00 0.00 0.00 179.25 179.40 2cvx h ARG 496 N 0.22 0.10 -0.32 0.00 2.43 -1.35 -1.74 114.38 113.71 2cvx h ARG 496 Ca 0.04 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 2cvx h ARG 496 Cb 0.70 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.18 2cvx h ARG 496 CO 0.05 0.17 -0.05 -0.22 -1.51 0.00 0.00 179.97 178.41 2cvx h LYS 497 N -0.00 0.03 0.53 0.20 3.64 -1.26 -2.03 116.57 117.68 2cvx h LYS 497 Ca 0.02 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2cvx h LYS 497 Cb 0.11 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2cvx h LYS 497 CO -0.00 0.02 -0.26 1.03 -2.27 0.00 0.00 179.45 177.97 2cvx h SER 498 N 0.04 -0.61 -0.70 4.20 0.87 -1.42 -2.76 113.55 113.17 2cvx h SER 498 Ca 0.15 0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.67 2cvx h SER 498 Cb 0.23 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 2cvx h SER 498 CO -0.30 -0.43 0.17 -1.13 -0.53 0.00 0.00 176.83 174.60 2cvx h ASN 499 N -0.71 1.07 0.24 6.23 -1.24 -1.19 -2.22 115.58 117.76 2cvx h ASN 499 Ca -0.07 -0.23 -0.13 0.00 0.71 0.00 0.00 56.30 56.58 2cvx h ASN 499 Cb 0.55 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 2cvx h ASN 499 CO 0.12 1.02 -0.51 0.24 -1.29 0.00 0.00 177.43 177.00 2cvx h MET 500 N 1.07 0.31 -0.17 6.67 2.86 -1.43 0.18 114.93 124.42 2cvx h MET 500 Ca 0.22 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 2cvx h MET 500 Cb 0.37 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 2cvx h MET 500 CO 0.00 0.75 -0.03 0.00 1.06 0.00 0.00 176.91 178.70 2cvx h ARG 501 N 0.24 0.32 0.00 1.72 3.08 -1.23 -3.41 114.38 115.10 2cvx h ARG 501 Ca 0.01 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2cvx h ARG 501 Cb 0.99 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.02 2cvx h ARG 501 CO 0.08 0.57 -1.29 0.72 -1.07 0.00 0.00 179.97 178.98 2cvx n HIS 502 N -4.69 0.00 -3.90 3.04 8.25 -0.86 -1.83 115.22 115.24 2cvx n HIS 502 Ca -0.05 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.14 2cvx n HIS 502 Cb 0.25 -0.16 0.01 0.00 1.12 0.00 0.00 29.99 31.22 2cvx n HIS 502 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2cvx n ARG 503 N -1.77 -4.59 -1.41 -0.41 1.74 0.64 -1.42 116.66 109.43 2cvx n ARG 503 Ca -0.02 0.54 -0.31 0.00 -0.77 0.00 0.00 57.85 57.28 2cvx n ARG 503 Cb 0.22 -5.15 0.07 0.00 -1.02 0.00 0.00 32.46 26.58 2cvx n ARG 503 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2cvx s PRO 504 N -6.46 2.54 0.10 5.56 0.04 -1.26 -3.71 135.00 131.82 2cvx s PRO 504 Ca 0.34 1.12 -0.03 0.00 0.04 0.00 0.00 61.00 62.47 2cvx s PRO 504 Cb -0.17 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2cvx s PRO 504 CO 0.85 -1.42 0.06 0.42 0.04 0.00 0.00 177.00 176.95 2cvx s ILE 505 N -2.90 0.14 -0.20 0.56 1.09 -0.35 -4.57 121.20 114.97 2cvx s ILE 505 Ca 0.61 -1.75 -0.04 0.00 -1.10 0.00 0.00 60.65 58.37 2cvx s ILE 505 Cb -0.16 -1.77 0.07 0.00 -1.06 0.00 0.00 42.46 39.53 2cvx s ILE 505 CO 0.54 -0.65 0.09 0.00 -0.10 0.00 0.00 174.94 174.82 2cvx s ALA 506 N -3.98 0.59 -0.01 9.38 0.00 -0.74 -3.44 121.76 123.57 2cvx s ALA 506 Ca 0.16 -0.56 -0.14 0.00 0.00 0.00 0.00 51.96 51.41 2cvx s ALA 506 Cb 0.07 -1.14 -0.06 0.00 0.00 0.00 0.00 23.12 21.99 2cvx s ALA 506 CO -0.04 -1.27 0.40 -0.51 0.00 0.00 0.00 175.76 174.33 2cvx s LEU 507 N 2.07 4.46 0.00 0.00 1.02 0.07 -2.00 118.68 124.31 2cvx s LEU 507 Ca 0.03 0.93 0.00 0.00 0.02 0.00 0.00 54.13 55.11 2cvx s LEU 507 Cb -0.16 -2.56 0.00 0.00 0.02 0.00 0.00 46.19 43.48 2cvx s LEU 507 CO -0.14 0.32 0.00 0.61 0.02 0.00 0.00 176.35 177.15 2cvx n GLY 508 N 1.89 4.71 3.08 -3.19 0.00 0.10 -1.67 105.19 110.13 2cvx n GLY 508 Ca -0.14 -1.80 -0.07 0.00 0.00 0.00 0.00 46.02 44.01 2cvx n GLY 508 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cvx s VAL 509 N -1.22 0.23 0.05 1.61 -7.23 -1.26 -1.01 120.40 111.57 2cvx s VAL 509 Ca 0.00 -1.75 -0.02 0.00 -1.81 0.00 0.00 61.98 58.40 2cvx s VAL 509 Cb 0.00 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.48 2cvx s VAL 509 CO 0.00 -0.96 -0.00 0.00 -0.31 0.00 0.00 175.10 173.83 2cvx s GLN 510 N -3.73 0.62 -0.95 4.82 -2.07 0.11 -3.91 119.66 114.55 2cvx s GLN 510 Ca 0.05 -1.14 -0.06 0.00 -1.82 0.00 0.00 55.36 52.39 2cvx s GLN 510 Cb 0.07 0.22 0.01 0.00 -1.09 0.00 0.00 33.01 32.21 2cvx s GLN 510 CO -0.09 -0.13 0.83 0.41 -1.32 0.00 0.00 175.29 174.99 2cvx n GLY 511 N 0.19 -0.10 0.26 2.60 0.00 -0.29 -1.58 105.19 106.26 2cvx n GLY 511 Ca -0.15 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 2cvx n GLY 511 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cvx h LEU 512 N -1.88 0.83 0.05 0.99 6.46 -1.74 -1.99 115.31 118.03 2cvx h LEU 512 Ca -0.40 -0.21 -0.00 0.00 -0.12 0.00 0.00 57.88 57.14 2cvx h LEU 512 Cb 1.26 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.97 2cvx h LEU 512 CO 0.39 0.82 -0.02 0.00 -0.62 0.00 0.00 178.44 179.01 2cvx h ALA 513 N 1.04 -0.07 -0.55 1.25 0.00 -1.80 -1.72 119.26 117.40 2cvx h ALA 513 Ca 0.18 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.12 2cvx h ALA 513 Cb 0.30 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2cvx h ALA 513 CO -0.00 -0.51 0.21 -0.44 0.00 0.00 0.00 179.25 178.51 2cvx h ASP 514 N -0.12 0.23 -0.92 0.00 3.45 -1.91 -0.79 116.42 116.36 2cvx h ASP 514 Ca -0.01 0.06 0.08 0.00 0.43 0.00 0.00 57.03 57.60 2cvx h ASP 514 Cb 0.10 0.04 -0.07 0.00 -0.56 0.00 0.00 39.33 38.84 2cvx h ASP 514 CO 0.01 0.15 0.57 0.74 -1.57 0.00 0.00 179.24 179.14 2cvx h THR 515 N 0.40 1.00 -0.33 0.35 2.02 -1.02 0.15 112.91 115.49 2cvx h THR 515 Ca 0.27 -0.34 -0.18 0.00 0.77 0.00 0.00 66.41 66.93 2cvx h THR 515 Cb 0.29 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.62 2cvx h THR 515 CO -0.26 0.18 -0.49 -0.26 0.37 0.00 0.00 175.52 175.07 2cvx h PHE 516 N 0.99 1.12 0.72 3.16 0.04 -0.67 -2.52 116.94 119.78 2cvx h PHE 516 Ca 0.42 -0.38 -0.04 0.00 2.80 0.00 0.00 57.97 60.78 2cvx h PHE 516 Cb 0.27 -0.22 0.01 0.00 2.20 0.00 0.00 35.95 38.21 2cvx h PHE 516 CO -0.02 1.21 -0.34 0.52 -0.60 0.00 0.00 178.31 179.07 2cvx h MET 517 N 0.71 -0.93 -0.88 1.51 2.86 -0.42 0.36 114.93 118.16 2cvx h MET 517 Ca 0.03 0.06 0.23 0.00 -2.06 0.00 0.00 59.70 57.97 2cvx h MET 517 Cb 1.09 0.21 -0.15 0.00 0.06 0.00 0.00 31.60 32.82 2cvx h MET 517 CO 0.11 -0.62 0.19 -0.07 1.06 0.00 0.00 176.91 177.58 2cvx h LEU 518 N -1.07 -0.10 0.00 1.22 -0.00 -0.79 0.55 115.31 115.12 2cvx h LEU 518 Ca -0.10 0.21 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 2cvx h LEU 518 Cb 0.74 0.30 0.00 0.00 -0.00 0.00 0.00 40.66 41.70 2cvx h LEU 518 CO 0.16 -0.19 0.00 0.18 -0.00 0.00 0.00 178.44 178.59 2cvx n LEU 519 N -5.28 0.00 -1.04 1.67 4.77 -0.95 -4.90 117.00 111.28 2cvx n LEU 519 Ca 0.21 0.10 -0.10 0.00 -0.03 0.00 0.00 56.01 56.19 2cvx n LEU 519 Cb 0.68 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.65 2cvx n LEU 519 CO 0.04 -0.01 -0.12 0.54 -1.33 0.00 0.00 177.39 176.52 2cvx n ARG 520 N -1.10 -0.75 -3.75 3.23 5.12 0.19 -5.01 116.66 114.58 2cvx n ARG 520 Ca 0.19 0.53 -0.37 0.00 -1.93 0.00 0.00 57.85 56.27 2cvx n ARG 520 Cb 0.15 -4.54 -0.13 0.00 -1.16 0.00 0.00 32.46 26.78 2cvx n ARG 520 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2cvx s LEU 521 N -2.67 3.60 0.54 0.55 1.43 0.12 -5.02 118.68 117.24 2cvx s LEU 521 Ca 0.00 -0.41 -0.20 0.00 -1.03 0.00 0.00 54.13 52.49 2cvx s LEU 521 Cb 0.00 -1.91 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 2cvx s LEU 521 CO 0.00 -0.10 1.20 -2.16 0.23 0.00 0.00 176.35 175.52 2cvx s PRO 522 N 1.57 3.27 0.27 1.29 0.04 -1.26 -4.11 135.00 136.06 2cvx s PRO 522 Ca 0.05 1.83 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 2cvx s PRO 522 Cb -0.16 -2.11 0.47 0.00 0.04 0.00 0.00 34.50 32.74 2cvx s PRO 522 CO 0.03 -0.97 1.83 0.35 0.04 0.00 0.00 177.00 178.29 2cvx h PHE 523 N 1.33 1.05 -0.01 0.56 3.04 -1.83 -1.91 116.94 119.18 2cvx h PHE 523 Ca -0.50 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.48 2cvx h PHE 523 Cb 1.28 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 39.46 2cvx h PHE 523 CO 0.49 0.45 -0.23 -0.40 -2.02 0.00 0.00 178.31 176.60 2cvx n ASP 524 N -4.64 0.86 -4.69 0.41 5.68 -1.26 -4.46 116.55 108.44 2cvx n ASP 524 Ca 0.16 -0.77 -0.32 0.00 -0.50 0.00 0.00 54.79 53.37 2cvx n ASP 524 Cb 0.30 0.08 0.15 0.00 -1.14 0.00 0.00 41.12 40.51 2cvx n ASP 524 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2cvx s SER 525 N -2.53 3.29 0.40 -1.12 1.04 -0.72 -4.83 113.70 109.24 2cvx s SER 525 Ca 0.25 2.19 0.11 0.00 0.48 0.00 0.00 55.95 58.98 2cvx s SER 525 Cb 0.19 -2.57 0.83 0.00 0.10 0.00 0.00 66.02 64.58 2cvx s SER 525 CO 0.52 -2.86 1.92 -0.08 0.98 0.00 0.00 173.24 173.72 2cvx h GLU 526 N -1.52 0.13 -0.02 4.02 4.57 -1.92 -1.58 114.58 118.26 2cvx h GLU 526 Ca -0.44 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2cvx h GLU 526 Cb 1.27 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.84 2cvx h GLU 526 CO 0.44 0.32 -0.00 0.93 -1.18 0.00 0.00 179.01 179.52 2cvx h GLU 527 N 0.12 0.04 -0.46 1.92 3.07 -1.91 -1.75 114.58 115.62 2cvx h GLU 527 Ca 0.02 -0.01 0.06 0.00 -0.50 0.00 0.00 59.36 58.93 2cvx h GLU 527 Cb 0.41 -0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.26 2cvx h GLU 527 CO 0.03 0.38 0.14 0.00 -1.40 0.00 0.00 179.01 178.16 2cvx h ALA 528 N 0.65 0.54 -0.78 3.43 0.00 -1.72 -0.16 119.26 121.22 2cvx h ALA 528 Ca 0.01 0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.13 2cvx h ALA 528 Cb 0.37 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.13 2cvx h ALA 528 CO 0.00 -0.26 0.33 -0.09 0.00 0.00 0.00 179.25 179.23 2cvx h ARG 529 N 0.30 0.46 -0.14 0.00 2.43 -1.25 -1.45 114.38 114.72 2cvx h ARG 529 Ca 0.22 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.21 2cvx h ARG 529 Cb 0.24 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2cvx h ARG 529 CO -0.24 0.30 -0.48 1.25 -1.51 0.00 0.00 179.97 179.29 2cvx h LEU 530 N 0.47 0.67 0.51 3.80 6.46 -0.65 -2.84 115.31 123.73 2cvx h LEU 530 Ca 0.43 -0.61 -0.02 0.00 -0.12 0.00 0.00 57.88 57.57 2cvx h LEU 530 Cb 0.65 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 2cvx h LEU 530 CO -0.40 1.16 -0.38 0.25 -0.62 0.00 0.00 178.44 178.45 2cvx h LEU 531 N 0.22 -0.99 -0.92 2.25 5.85 -0.73 -0.97 115.31 120.03 2cvx h LEU 531 Ca -0.02 0.07 0.17 0.00 0.84 0.00 0.00 57.88 58.94 2cvx h LEU 531 Cb 1.11 0.31 -0.17 0.00 0.37 0.00 0.00 40.66 42.28 2cvx h LEU 531 CO 0.10 -0.56 -0.27 -3.20 -0.34 0.00 0.00 178.44 174.18 2cvx n ASN 532 N -5.50 -0.41 -0.16 1.25 5.15 -0.58 -0.07 115.26 114.95 2cvx n ASN 532 Ca -0.12 1.59 -0.08 0.00 -0.60 0.00 0.00 54.58 55.37 2cvx n ASN 532 Cb 0.39 -0.45 0.00 0.00 -0.53 0.00 0.00 39.78 39.20 2cvx n ASN 532 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 2cvx h ILE 533 N 0.00 1.19 0.00 -1.44 2.04 -1.22 -2.69 117.51 115.39 2cvx h ILE 533 Ca 0.41 -0.57 -0.18 0.00 1.00 0.00 0.00 64.86 65.52 2cvx h ILE 533 Cb 0.64 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 2cvx h ILE 533 CO -0.94 0.22 -0.86 0.06 0.00 0.00 0.00 178.15 176.63 2cvx h GLN 534 N 0.59 0.00 0.23 2.37 3.07 0.50 -1.31 115.11 120.56 2cvx h GLN 534 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.88 2cvx h GLN 534 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.71 2cvx h GLN 534 CO -0.02 0.86 -0.11 0.82 0.09 0.00 0.00 178.83 180.47 2cvx h ILE 535 N 0.00 0.80 -0.09 1.86 2.04 -0.51 -1.60 117.51 120.01 2cvx h ILE 535 Ca -0.01 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 2cvx h ILE 535 Cb 1.56 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.54 2cvx h ILE 535 CO 0.11 0.04 -0.24 -0.26 0.00 0.00 0.00 178.15 177.81 2cvx h PHE 536 N -0.40 0.17 -0.47 1.37 0.04 -1.46 -1.28 116.94 114.91 2cvx h PHE 536 Ca -0.03 -0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.67 2cvx h PHE 536 Cb 0.31 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 2cvx h PHE 536 CO -0.04 0.39 0.13 1.49 -0.60 0.00 0.00 178.31 179.68 2cvx h GLU 537 N 0.15 0.74 -0.20 1.51 4.81 -1.09 -2.10 114.58 118.40 2cvx h GLU 537 Ca 0.02 -0.17 -0.15 0.00 -0.13 0.00 0.00 59.36 58.93 2cvx h GLU 537 Cb 0.50 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2cvx h GLU 537 CO 0.03 0.72 -0.46 0.00 -0.73 0.00 0.00 179.01 178.58 2cvx h THR 538 N 0.63 1.32 0.25 0.32 1.03 -0.92 -1.08 112.91 114.47 2cvx h THR 538 Ca 0.15 -1.69 0.00 0.00 -0.01 0.00 0.00 66.41 64.87 2cvx h THR 538 Cb 0.30 1.86 -0.02 0.00 -1.07 0.00 0.00 68.15 69.23 2cvx h THR 538 CO -0.00 0.53 -0.24 0.40 -0.01 0.00 0.00 175.52 176.20 2cvx h ILE 539 N 0.36 0.49 -0.77 0.00 2.04 -1.26 0.28 117.51 118.65 2cvx h ILE 539 Ca 0.00 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.93 2cvx h ILE 539 Cb 1.07 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 37.57 2cvx h ILE 539 CO 0.10 0.00 0.44 0.22 0.00 0.00 0.00 178.15 178.92 2cvx h TYR 540 N -0.52 0.82 0.06 1.37 3.20 -1.42 -0.21 116.97 120.26 2cvx h TYR 540 Ca -0.01 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2cvx h TYR 540 Cb 0.47 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.49 2cvx h TYR 540 CO -0.16 0.38 -0.03 1.25 -1.64 0.00 0.00 178.16 177.97 2cvx h HIS 541 N 0.80 -0.07 -0.20 -3.82 2.76 -0.91 -1.89 115.15 111.83 2cvx h HIS 541 Ca 0.35 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.57 2cvx h HIS 541 Cb 0.23 0.02 -0.06 0.00 1.55 0.00 0.00 27.41 29.15 2cvx h HIS 541 CO -0.06 0.13 -0.19 0.00 -1.30 0.00 0.00 177.93 176.51 2cvx h ALA 542 N 0.68 -0.07 -0.79 5.26 0.00 -0.26 -0.17 119.26 123.91 2cvx h ALA 542 Ca -0.01 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2cvx h ALA 542 Cb 0.23 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2cvx h ALA 542 CO 0.01 -0.62 0.44 0.66 0.00 0.00 0.00 179.25 179.74 2cvx h SER 543 N -0.20 0.98 0.24 0.00 4.64 -0.99 0.14 113.55 118.36 2cvx h SER 543 Ca 0.12 -0.09 -0.15 0.00 -0.47 0.00 0.00 61.79 61.20 2cvx h SER 543 Cb 0.39 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2cvx h SER 543 CO -0.32 0.79 -0.57 0.24 -0.87 0.00 0.00 176.83 176.10 2cvx h MET 544 N 1.09 0.34 -0.15 4.77 2.86 -1.20 0.54 114.93 123.18 2cvx h MET 544 Ca 0.28 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2cvx h MET 544 Cb 0.02 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2cvx h MET 544 CO -0.05 0.81 0.05 1.49 1.06 0.00 0.00 176.91 180.27 2cvx h GLU 545 N 0.26 0.24 -0.53 1.72 4.81 -0.49 0.16 114.58 120.76 2cvx h GLU 545 Ca 0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 2cvx h GLU 545 Cb 1.07 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 2cvx h GLU 545 CO 0.09 0.36 0.21 0.00 -0.73 0.00 0.00 179.01 178.94 2cvx h ALA 546 N 0.87 0.68 -0.34 2.92 0.00 -0.96 -0.10 119.26 122.34 2cvx h ALA 546 Ca 0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2cvx h ALA 546 Cb 0.22 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2cvx h ALA 546 CO -0.00 0.30 -0.02 1.03 0.00 0.00 0.00 179.25 180.55 2cvx h SER 547 N 0.71 0.50 -0.23 0.00 0.87 -0.78 -1.05 113.55 113.57 2cvx h SER 547 Ca 0.17 -0.10 -0.05 0.00 -1.23 0.00 0.00 61.79 60.59 2cvx h SER 547 Cb 0.20 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2cvx h SER 547 CO -0.01 0.59 -0.03 0.00 -0.53 0.00 0.00 176.83 176.84 2cvx h GLU 549 N 0.18 0.08 -0.43 0.00 5.08 -0.63 -1.60 114.58 117.26 2cvx h GLU 549 Ca 0.06 -0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2cvx h GLU 549 Cb 0.47 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2cvx h GLU 549 CO 0.02 0.05 -0.04 -0.07 -1.00 0.00 0.00 179.01 177.97 2cvx h LEU 550 N 0.08 0.69 -1.44 1.33 3.38 -1.04 -1.83 115.31 116.48 2cvx h LEU 550 Ca 0.33 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 2cvx h LEU 550 Cb 0.53 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2cvx h LEU 550 CO -0.58 0.79 -0.28 0.00 0.09 0.00 0.00 178.44 178.46 2cvx h ALA 551 N 1.29 1.51 -0.20 1.53 0.00 -1.06 0.62 119.26 122.95 2cvx h ALA 551 Ca 0.13 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 2cvx h ALA 551 Cb 0.47 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2cvx h ALA 551 CO 0.02 0.35 -0.38 1.96 0.00 0.00 0.00 179.25 181.21 2cvx h GLN 552 N 0.00 0.43 0.04 0.00 4.20 -0.45 -0.23 115.11 119.11 2cvx h GLN 552 Ca -0.00 -0.20 -0.09 0.00 0.06 0.00 0.00 58.65 58.42 2cvx h GLN 552 Cb 0.51 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2cvx h GLN 552 CO 0.04 0.75 -0.42 0.87 -0.67 0.00 0.00 178.83 179.39 2cvx h LYS 553 N 0.36 0.09 -0.02 1.46 1.57 -1.11 -3.41 116.57 115.50 2cvx h LYS 553 Ca 0.04 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 2cvx h LYS 553 Cb 0.83 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.20 2cvx h LYS 553 CO 0.07 1.07 0.00 -0.25 -0.57 0.00 0.00 179.45 179.77 2cvx n ASP 554 N -4.43 1.92 0.00 0.86 10.43 0.21 -5.11 116.55 120.44 2cvx n ASP 554 Ca -0.14 -1.46 0.00 0.00 2.57 0.00 0.00 54.79 55.75 2cvx n ASP 554 Cb 0.61 -0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.57 2cvx n ASP 554 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2cvx n GLY 555 N 0.61 -0.56 3.71 0.44 0.00 -0.10 -4.96 105.19 104.34 2cvx n GLY 555 Ca 0.06 -1.56 -0.29 0.00 0.00 0.00 0.00 46.02 44.23 2cvx n GLY 555 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2cvx s PRO 556 N -3.57 1.08 0.69 1.61 0.02 -1.26 -4.31 135.00 129.26 2cvx s PRO 556 Ca 0.00 0.74 -0.15 0.00 0.02 0.00 0.00 61.00 61.61 2cvx s PRO 556 Cb 0.00 -1.79 0.02 0.00 0.02 0.00 0.00 34.50 32.74 2cvx s PRO 556 CO 0.00 -2.34 1.17 1.52 -0.33 0.00 0.00 177.00 177.02 2cvx s TYR 557 N -2.95 2.27 0.57 6.54 -0.85 -0.93 -4.84 117.35 117.15 2cvx s TYR 557 Ca 0.64 1.58 0.29 0.00 -0.52 0.00 0.00 57.07 59.06 2cvx s TYR 557 Cb -0.18 -3.37 1.46 0.00 0.38 0.00 0.00 41.96 40.25 2cvx s TYR 557 CO 0.57 -2.26 1.89 0.93 -1.52 0.00 0.00 175.55 175.16 2cvx h GLU 558 N -0.06 0.00 -0.11 -3.49 5.08 -1.63 -2.02 114.58 112.36 2cvx h GLU 558 Ca -0.48 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 2cvx h GLU 558 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2cvx h GLU 558 CO 0.52 0.00 -0.07 -2.37 -1.00 0.00 0.00 179.01 176.09 2cvx n THR 559 N -3.95 2.12 -0.26 1.13 5.66 -1.24 -4.66 114.28 113.08 2cvx n THR 559 Ca 0.12 -2.34 -0.02 0.00 -3.05 0.00 0.00 64.05 58.77 2cvx n THR 559 Cb 0.78 -0.25 0.10 0.00 -1.55 0.00 0.00 70.33 69.40 2cvx n THR 559 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 2cvx h PHE 560 N 0.75 0.83 -3.22 1.09 3.04 -1.70 -3.41 116.94 114.32 2cvx h PHE 560 Ca 0.02 0.02 -0.54 0.00 3.98 0.00 0.00 57.97 61.46 2cvx h PHE 560 Cb 1.20 -0.27 -0.00 0.00 2.56 0.00 0.00 35.95 39.44 2cvx h PHE 560 CO 0.35 0.44 0.54 -0.65 -2.02 0.00 0.00 178.31 176.97 2cvx s GLN 561 N -6.09 4.45 0.00 1.11 -0.21 -1.26 -1.78 119.66 115.87 2cvx s GLN 561 Ca -0.13 1.72 0.00 0.00 0.02 0.00 0.00 55.36 56.97 2cvx s GLN 561 Cb 0.16 -3.37 0.00 0.00 1.00 0.00 0.00 33.01 30.80 2cvx s GLN 561 CO 0.77 -0.24 0.00 0.41 -2.12 0.00 0.00 175.29 174.11 2cvx n GLY 562 N 3.18 1.72 3.83 3.09 0.00 -1.26 -5.08 105.19 110.68 2cvx n GLY 562 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2cvx n GLY 562 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cvx s SER 563 N -1.57 6.78 0.22 1.61 1.04 -0.73 -4.74 113.70 116.31 2cvx s SER 563 Ca 0.00 1.63 -0.13 0.00 0.48 0.00 0.00 55.95 57.93 2cvx s SER 563 Cb 0.00 -2.52 0.27 0.00 0.10 0.00 0.00 66.02 63.86 2cvx s SER 563 CO 0.00 -0.48 1.61 -0.65 0.98 0.00 0.00 173.24 174.71 2cvx h PRO 564 N 1.42 -0.01 -0.93 4.02 0.11 -1.83 -0.94 132.00 133.84 2cvx h PRO 564 Ca -0.48 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.73 2cvx h PRO 564 Cb 1.18 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.22 2cvx h PRO 564 CO 0.61 -0.00 0.57 0.00 -0.21 0.00 0.00 178.00 178.97 2cvx h ALA 565 N 1.66 1.34 -0.00 -0.75 0.00 -1.73 0.26 119.26 120.05 2cvx h ALA 565 Ca 0.33 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2cvx h ALA 565 Cb 0.51 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2cvx h ALA 565 CO -0.71 0.24 0.00 0.66 0.00 0.00 0.00 179.25 179.44 2cvx h SER 566 N 0.96 0.00 -0.41 0.00 4.64 -1.39 -0.95 113.55 116.40 2cvx h SER 566 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 2cvx h SER 566 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2cvx h SER 566 CO -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.73 2cvx n GLN 567 N -3.30 2.50 -0.86 4.77 1.13 0.64 -4.79 117.38 117.47 2cvx n GLN 567 Ca -0.03 -2.30 0.00 0.00 -1.94 0.00 0.00 57.00 52.73 2cvx n GLN 567 Cb 0.08 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.92 2cvx n GLN 567 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2cvx n GLY 568 N 1.46 0.52 3.48 1.08 0.00 -0.36 -5.04 105.19 106.32 2cvx n GLY 568 Ca 0.19 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 2cvx n GLY 568 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cvx s ILE 569 N -2.00 5.05 0.44 -0.61 1.01 0.33 -4.95 121.20 120.47 2cvx s ILE 569 Ca 0.00 -0.44 0.08 0.00 0.00 0.00 0.00 60.65 60.29 2cvx s ILE 569 Cb 0.00 -3.67 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 2cvx s ILE 569 CO 0.00 -0.09 0.44 -0.76 0.00 0.00 0.00 174.94 174.53 2cvx s LEU 570 N 1.67 3.33 0.12 2.97 1.43 -1.26 -1.97 118.68 124.96 2cvx s LEU 570 Ca 0.05 -0.77 -0.30 0.00 -1.03 0.00 0.00 54.13 52.08 2cvx s LEU 570 Cb -0.18 -2.01 -0.08 0.00 0.03 0.00 0.00 46.19 43.96 2cvx s LEU 570 CO 0.09 -0.77 1.58 -0.61 0.23 0.00 0.00 176.35 176.87 2cvx h GLN 571 N 0.87 -0.54 -0.32 1.70 5.75 -1.95 -1.82 115.11 118.80 2cvx h GLN 571 Ca -0.40 0.04 0.09 0.00 -0.15 0.00 0.00 58.65 58.23 2cvx h GLN 571 Cb 1.27 0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.93 2cvx h GLN 571 CO 0.54 -0.36 0.23 0.27 -2.65 0.00 0.00 178.83 176.86 2cvx h PHE 572 N -0.56 0.04 -0.68 3.99 -0.00 -1.39 0.44 116.94 118.78 2cvx h PHE 572 Ca 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 58.02 2cvx h PHE 572 Cb 0.65 -0.01 -0.03 0.00 -0.00 0.00 0.00 35.95 36.56 2cvx h PHE 572 CO -0.44 0.02 0.41 -0.44 -0.00 0.00 0.00 178.31 177.85 2cvx h ASP 573 N 0.03 0.81 1.32 -0.68 5.19 -1.47 -0.47 116.42 121.15 2cvx h ASP 573 Ca 0.15 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.52 2cvx h ASP 573 Cb 0.56 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.87 2cvx h ASP 573 CO -0.01 0.62 0.00 0.24 -3.12 0.00 0.00 179.24 176.98 2cvx h MET 574 N 0.93 0.00 -0.14 3.56 2.86 0.05 0.39 114.93 122.58 2cvx h MET 574 Ca 0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2cvx h MET 574 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2cvx h MET 574 CO -0.05 0.00 0.00 0.91 1.06 0.00 0.00 176.91 178.83 2cvx n TRP 575 N -2.85 0.18 -3.82 -0.22 7.02 -0.88 -4.88 117.44 111.98 2cvx n TRP 575 Ca 0.02 -0.09 -0.26 0.00 -1.02 0.00 0.00 57.50 56.15 2cvx n TRP 575 Cb 0.37 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.29 2cvx n TRP 575 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2cvx n ASP 576 N 0.07 -3.16 -4.32 -0.99 8.00 0.14 -5.00 116.55 111.30 2cvx n ASP 576 Ca 0.15 -0.80 -0.23 0.00 0.71 0.00 0.00 54.79 54.61 2cvx n ASP 576 Cb 0.26 -3.94 -0.12 0.00 -0.02 0.00 0.00 41.12 37.30 2cvx n ASP 576 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2cvx s GLN 577 N -6.35 1.22 0.26 -1.24 -0.21 -0.24 -5.01 119.66 108.09 2cvx s GLN 577 Ca 0.37 -1.30 -0.29 0.00 0.02 0.00 0.00 55.36 54.16 2cvx s GLN 577 Cb -0.18 -1.40 -0.09 0.00 1.00 0.00 0.00 33.01 32.34 2cvx s GLN 577 CO 0.82 0.31 0.96 0.15 -2.12 0.00 0.00 175.29 175.40 2cvx s LYS 578 N -2.36 4.78 0.77 2.91 1.02 -1.26 -4.04 119.74 121.56 2cvx s LYS 578 Ca 0.12 1.49 -0.11 0.00 0.02 0.00 0.00 55.97 57.49 2cvx s LYS 578 Cb -0.08 -3.18 0.05 0.00 -0.52 0.00 0.00 37.83 34.11 2cvx s LYS 578 CO 0.06 0.44 1.08 -1.25 -0.92 0.00 0.00 175.35 174.76 2cvx s PRO 579 N -1.38 2.33 0.24 -1.68 0.04 -1.26 -4.94 135.00 128.35 2cvx s PRO 579 Ca 0.43 1.04 -0.06 0.00 0.04 0.00 0.00 61.00 62.46 2cvx s PRO 579 Cb -0.25 -1.91 0.33 0.00 0.04 0.00 0.00 34.50 32.70 2cvx s PRO 579 CO 0.31 -1.56 1.84 -0.92 0.04 0.00 0.00 177.00 176.72 2cvx h TYR 580 N -1.06 0.95 0.00 0.56 5.03 -1.97 -3.47 116.97 117.02 2cvx h TYR 580 Ca -0.44 0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.89 2cvx h TYR 580 Cb 1.23 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 39.21 2cvx h TYR 580 CO 0.57 0.47 0.00 0.41 -1.32 0.00 0.00 178.16 178.29 2cvx n GLY 581 N -1.32 0.89 0.34 1.82 0.00 -1.26 -4.95 105.19 100.70 2cvx n GLY 581 Ca 0.12 -0.07 0.19 0.00 0.00 0.00 0.00 46.02 46.26 2cvx n GLY 581 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2cvx h MET 582 N 2.23 0.00 -5.48 1.61 -1.53 -1.97 -3.44 114.93 106.35 2cvx h MET 582 Ca 0.00 0.00 -0.43 0.00 -3.44 0.00 0.00 59.70 55.83 2cvx h MET 582 Cb 0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 31.60 30.89 2cvx h MET 582 CO 0.00 0.00 -0.74 -1.58 0.14 0.00 0.00 176.91 174.73 2cvx s TRP 583 N -4.18 1.56 -0.99 1.39 0.52 -1.26 -5.08 118.94 110.91 2cvx s TRP 583 Ca -0.04 -0.59 -0.23 0.00 0.02 0.00 0.00 56.10 55.25 2cvx s TRP 583 Cb 0.11 -0.76 0.05 0.00 -1.15 0.00 0.00 33.47 31.72 2cvx s TRP 583 CO 0.37 0.25 1.43 0.34 0.02 0.00 0.00 176.95 179.36 2cvx s ASP 584 N -2.99 6.47 0.38 2.95 -1.08 -1.26 -4.81 116.67 116.32 2cvx s ASP 584 Ca 0.17 -1.35 0.20 0.00 -0.52 0.00 0.00 52.55 51.05 2cvx s ASP 584 Cb -0.02 -2.57 0.60 0.00 -1.46 0.00 0.00 42.92 39.48 2cvx s ASP 584 CO 0.05 -1.54 1.69 -0.50 0.52 0.00 0.00 175.17 175.38 2cvx h TRP 585 N 9.82 0.00 -0.18 -5.34 4.06 -1.98 -3.19 115.95 119.14 2cvx h TRP 585 Ca 0.15 0.00 -0.19 0.00 2.06 0.00 0.00 58.89 60.91 2cvx h TRP 585 Cb 1.01 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.18 2cvx h TRP 585 CO 1.27 0.33 -0.64 -0.44 -3.56 0.00 0.00 178.44 175.40 2cvx h ASP 586 N 0.00 0.88 -0.35 -3.49 3.45 -1.99 0.21 116.42 115.13 2cvx h ASP 586 Ca -0.00 -0.60 -0.01 0.00 0.43 0.00 0.00 57.03 56.85 2cvx h ASP 586 Cb 0.97 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.47 2cvx h ASP 586 CO 0.04 1.33 0.18 0.74 -1.57 0.00 0.00 179.24 179.96 2cvx h THR 587 N 0.48 1.15 -0.33 0.35 2.02 -1.99 0.87 112.91 115.47 2cvx h THR 587 Ca -0.03 -0.41 0.05 0.00 0.77 0.00 0.00 66.41 66.79 2cvx h THR 587 Cb 1.26 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 68.41 2cvx h THR 587 CO 0.13 0.16 0.04 0.25 0.37 0.00 0.00 175.52 176.47 2cvx h LEU 588 N 0.43 -0.04 -0.49 2.58 5.85 -1.52 0.47 115.31 122.59 2cvx h LEU 588 Ca 0.12 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2cvx h LEU 588 Cb 0.09 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 2cvx h LEU 588 CO -0.02 0.02 0.29 -0.09 -0.34 0.00 0.00 178.44 178.30 2cvx h ARG 589 N 0.15 0.67 -0.44 1.25 2.43 -0.76 0.31 114.38 117.99 2cvx h ARG 589 Ca 0.16 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.28 2cvx h ARG 589 Cb 0.19 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 2cvx h ARG 589 CO -0.23 0.50 0.26 -0.22 -1.51 0.00 0.00 179.97 178.77 2cvx h LYS 590 N 0.65 0.52 -0.41 0.20 3.64 -0.54 0.85 116.57 121.48 2cvx h LYS 590 Ca 0.17 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2cvx h LYS 590 Cb 0.01 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 2cvx h LYS 590 CO -0.03 0.34 0.21 -0.44 -2.27 0.00 0.00 179.45 177.26 2cvx h ASP 591 N 0.53 0.53 -0.38 4.20 3.32 -0.45 -1.82 116.42 122.35 2cvx h ASP 591 Ca 0.17 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 2cvx h ASP 591 Cb -0.00 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2cvx h ASP 591 CO -0.07 0.48 0.14 0.40 -1.72 0.00 0.00 179.24 178.47 2cvx h ILE 592 N 0.53 1.20 -0.07 0.35 2.04 -0.09 0.10 117.51 121.57 2cvx h ILE 592 Ca 0.14 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 2cvx h ILE 592 Cb 0.09 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2cvx h ILE 592 CO -0.02 0.22 -0.06 0.24 0.00 0.00 0.00 178.15 178.53 2cvx h MET 593 N 0.47 0.09 0.08 2.37 2.86 -0.77 0.14 114.93 120.16 2cvx h MET 593 Ca 0.13 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.58 2cvx h MET 593 Cb 0.21 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2cvx h MET 593 CO -0.01 0.16 -0.85 -0.22 1.06 0.00 0.00 176.91 177.05 2cvx h LYS 594 N 0.09 0.16 0.00 1.72 1.63 -0.93 -3.42 116.57 115.82 2cvx h LYS 594 Ca 0.02 -0.27 -0.06 0.00 -0.85 0.00 0.00 60.65 59.49 2cvx h LYS 594 Cb 0.17 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.89 2cvx h LYS 594 CO 0.01 1.13 -1.71 0.72 -3.45 0.00 0.00 179.45 176.15 2cvx n HIS 595 N -4.24 0.00 -0.12 1.91 8.25 0.31 -5.10 115.22 116.24 2cvx n HIS 595 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 2cvx n HIS 595 Cb 0.74 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2cvx n HIS 595 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cvx n GLY 596 N 1.80 -3.64 3.21 -1.41 0.00 0.48 -4.39 105.19 101.24 2cvx n GLY 596 Ca -0.07 -1.98 -0.15 0.00 0.00 0.00 0.00 46.02 43.82 2cvx n GLY 596 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cvx s VAL 597 N -0.86 1.10 -0.73 1.61 -7.23 -1.26 -4.35 120.40 108.68 2cvx s VAL 597 Ca 0.00 -1.76 0.25 0.00 -1.81 0.00 0.00 61.98 58.66 2cvx s VAL 597 Cb 0.00 -1.52 0.13 0.00 0.56 0.00 0.00 36.38 35.55 2cvx s VAL 597 CO 0.00 -0.56 1.52 -1.14 -0.31 0.00 0.00 175.10 174.60 2cvx n ARG 598 N 0.38 0.23 -4.44 4.82 3.00 -0.74 -2.19 116.66 117.71 2cvx n ARG 598 Ca -0.15 0.11 -0.22 0.00 -0.00 0.00 0.00 57.85 57.59 2cvx n ARG 598 Cb 0.58 -1.69 -0.16 0.00 0.00 0.00 0.00 32.46 31.19 2cvx n ARG 598 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2cvx s ASN 599 N -4.10 1.44 0.36 6.15 -0.87 -1.26 -4.08 114.94 112.57 2cvx s ASN 599 Ca 0.09 -0.23 0.11 0.00 -1.57 0.00 0.00 52.86 51.26 2cvx s ASN 599 Cb 0.14 -0.60 0.70 0.00 -0.02 0.00 0.00 41.25 41.46 2cvx s ASN 599 CO 0.67 0.02 1.82 0.77 -2.57 0.00 0.00 177.10 177.81 2cvx h SER 600 N 6.85 0.06 -5.01 -1.22 4.64 -1.32 -3.45 113.55 114.12 2cvx h SER 600 Ca -0.34 -0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 60.83 2cvx h SER 600 Cb 1.17 -0.02 -0.20 0.00 -0.31 0.00 0.00 62.40 63.05 2cvx h SER 600 CO 0.48 0.41 -0.43 -0.76 -0.87 0.00 0.00 176.83 175.66 2cvx s LEU 601 N -8.28 1.38 0.00 5.97 1.43 -1.26 -4.71 118.68 113.21 2cvx s LEU 601 Ca -0.03 -0.19 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 2cvx s LEU 601 Cb 0.14 0.85 0.00 0.00 0.03 0.00 0.00 46.19 47.21 2cvx s LEU 601 CO 0.73 -0.43 0.00 0.35 0.23 0.00 0.00 176.35 177.23 2cvx n THR 602 N 1.23 0.00 -4.93 5.49 -2.24 -1.22 -1.22 114.28 111.39 2cvx n THR 602 Ca -0.22 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.24 2cvx n THR 602 Cb 0.56 0.10 -0.17 0.00 -2.10 0.00 0.00 70.33 68.73 2cvx n THR 602 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2cvx s MET 603 N -1.03 3.07 -0.48 -0.78 -1.94 -1.24 -0.75 119.30 116.15 2cvx s MET 603 Ca 0.00 -0.85 0.06 0.00 -1.71 0.00 0.00 55.69 53.19 2cvx s MET 603 Cb 0.00 -2.39 0.28 0.00 2.01 0.00 0.00 34.83 34.72 2cvx s MET 603 CO 0.00 0.09 0.99 0.00 -0.01 0.00 0.00 175.02 176.09 2cvx n ALA 604 N 3.78 -1.12 -1.65 3.03 0.00 -0.67 -2.12 120.51 121.75 2cvx n ALA 604 Ca -0.19 -1.44 -0.50 0.00 0.00 0.00 0.00 53.44 51.31 2cvx n ALA 604 Cb 0.52 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.66 2cvx n ALA 604 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2cvx n PRO 605 N 1.07 1.69 -4.12 0.00 -0.02 -1.18 -4.65 135.00 127.79 2cvx n PRO 605 Ca 0.08 0.61 -0.24 0.00 -2.02 0.00 0.00 63.50 61.93 2cvx n PRO 605 Cb 0.66 -2.34 -0.07 0.00 -0.02 0.00 0.00 33.50 31.73 2cvx n PRO 605 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cvx s MET 606 N 1.69 2.27 0.57 -0.52 0.23 -1.26 -2.79 119.30 119.48 2cvx s MET 606 Ca 0.86 -1.71 0.26 0.00 -1.03 0.00 0.00 55.69 54.07 2cvx s MET 606 Cb -0.83 -2.06 1.54 0.00 -1.53 0.00 0.00 34.83 31.96 2cvx s MET 606 CO 0.47 0.00 2.08 -1.35 -2.03 0.00 0.00 175.02 174.19 2cvx h PRO 607 N 1.51 0.00 -6.70 3.16 0.11 -1.90 -3.41 132.00 124.77 2cvx h PRO 607 Ca -0.43 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.14 2cvx h PRO 607 Cb 1.25 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.19 2cvx h PRO 607 CO 0.66 0.00 -0.85 0.25 -0.21 0.00 0.00 178.00 177.86 2cvx n THR 608 N -4.03 -1.45 0.23 -1.15 -2.24 -1.26 -3.69 114.28 100.69 2cvx n THR 608 Ca 0.03 -0.12 0.08 0.00 -2.27 0.00 0.00 64.05 61.77 2cvx n THR 608 Cb 0.36 -1.88 0.55 0.00 -2.10 0.00 0.00 70.33 67.27 2cvx n THR 608 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cvx h ALA 609 N 0.90 1.41 0.00 6.98 0.00 -2.00 -2.42 119.26 124.13 2cvx h ALA 609 Ca -0.60 -0.19 -0.28 0.00 0.00 0.00 0.00 54.91 53.84 2cvx h ALA 609 Cb 1.38 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 2cvx h ALA 609 CO 0.75 0.26 -2.00 0.43 0.00 0.00 0.00 179.25 178.69 2cvx n SER 610 N -3.94 1.89 0.24 0.00 7.64 -1.26 -4.58 113.62 113.61 2cvx n SER 610 Ca -0.02 0.09 0.12 0.00 1.01 0.00 0.00 58.87 60.07 2cvx n SER 610 Cb 0.29 -0.42 0.55 0.00 -1.01 0.00 0.00 64.21 63.63 2cvx n SER 610 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2cvx h THR 611 N -0.37 0.43 -0.01 0.44 1.35 -1.94 -1.91 112.91 110.90 2cvx h THR 611 Ca -0.43 -0.89 -0.18 0.00 -0.55 0.00 0.00 66.41 64.36 2cvx h THR 611 Cb 1.48 1.64 -0.01 0.00 -1.73 0.00 0.00 68.15 69.53 2cvx h THR 611 CO -0.18 0.16 -0.82 0.77 -0.25 0.00 0.00 175.52 175.19 2cvx h SER 612 N 0.00 0.19 -0.26 5.36 4.64 -1.72 -2.71 113.55 119.06 2cvx h SER 612 Ca -0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2cvx h SER 612 Cb 0.63 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 2cvx h SER 612 CO 0.02 0.92 0.17 -0.61 -0.87 0.00 0.00 176.83 176.47 2cvx h GLN 613 N 0.09 0.34 -0.20 4.77 4.15 -1.56 -0.00 115.11 122.70 2cvx h GLN 613 Ca -0.03 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.39 2cvx h GLN 613 Cb 1.43 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 29.02 2cvx h GLN 613 CO 0.12 0.22 0.04 0.82 -1.93 0.00 0.00 178.83 178.11 2cvx h ILE 614 N 0.35 0.92 0.00 2.39 2.04 -1.38 -2.95 117.51 118.87 2cvx h ILE 614 Ca 0.09 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.91 2cvx h ILE 614 Cb -0.04 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2cvx h ILE 614 CO -0.02 0.02 0.00 0.18 0.00 0.00 0.00 178.15 178.33 2cvx n LEU 615 N -5.08 0.16 -0.86 1.44 4.77 -1.03 -4.66 117.00 111.74 2cvx n LEU 615 Ca -0.03 0.52 -0.03 0.00 -0.03 0.00 0.00 56.01 56.44 2cvx n LEU 615 Cb 0.09 -0.47 0.01 0.00 -2.33 0.00 0.00 43.42 40.72 2cvx n LEU 615 CO 0.29 -0.05 0.02 0.61 -1.33 0.00 0.00 177.39 176.93 2cvx n GLY 616 N 1.38 0.67 3.46 -0.72 0.00 -0.17 -4.93 105.19 104.87 2cvx n GLY 616 Ca 0.07 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.29 2cvx n GLY 616 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cvx s TYR 617 N -2.91 2.04 0.23 1.61 4.12 -0.28 -5.04 117.35 117.12 2cvx s TYR 617 Ca 0.07 -0.76 -0.30 0.00 0.02 0.00 0.00 57.07 56.10 2cvx s TYR 617 Cb -0.03 -1.25 -0.09 0.00 -1.52 0.00 0.00 41.96 39.07 2cvx s TYR 617 CO 0.09 0.23 1.10 1.21 0.02 0.00 0.00 175.55 178.20 2cvx s ASN 618 N -3.49 7.27 0.31 2.29 3.84 -1.26 -4.32 114.94 119.58 2cvx s ASN 618 Ca 0.32 2.19 -0.27 0.00 0.21 0.00 0.00 52.86 55.31 2cvx s ASN 618 Cb 0.06 -2.62 -0.13 0.00 -0.55 0.00 0.00 41.25 38.01 2cvx s ASN 618 CO 0.14 -0.18 1.01 -1.84 -2.79 0.00 0.00 177.10 173.44 2cvx n GLU 619 N 1.76 1.39 0.00 0.43 0.00 -1.26 -1.14 120.64 121.81 2cvx n GLU 619 Ca 0.01 0.49 0.00 0.00 0.00 0.00 0.00 57.16 57.65 2cvx n GLU 619 Cb 0.45 -1.89 0.00 0.00 0.00 0.00 0.00 31.44 30.00 2cvx n GLU 619 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2cvx n PHE 621 N 6.57 0.34 -3.43 0.00 1.16 -1.26 -2.67 117.46 118.18 2cvx n PHE 621 Ca 0.00 -0.95 -0.31 0.00 -1.87 0.00 0.00 57.45 54.33 2cvx n PHE 621 Cb 0.00 -0.21 -0.05 0.00 -1.61 0.00 0.00 39.48 37.62 2cvx n PHE 621 CO 0.00 0.00 0.00 -1.83 -1.87 0.00 0.00 176.76 173.06 2cvx s GLU 622 N -2.83 3.72 0.89 3.97 -1.05 -1.19 -4.88 118.70 117.32 2cvx s GLU 622 Ca 0.35 0.13 -0.11 0.00 -0.15 0.00 0.00 54.97 55.20 2cvx s GLU 622 Cb 0.30 -2.68 0.13 0.00 -0.44 0.00 0.00 34.13 31.44 2cvx s GLU 622 CO 0.05 0.30 1.10 -2.14 0.95 0.00 0.00 175.26 175.53 2cvx s PRO 623 N -3.04 1.30 0.52 -4.83 0.02 -1.26 -4.13 135.00 123.58 2cvx s PRO 623 Ca 0.45 1.14 -0.22 0.00 0.02 0.00 0.00 61.00 62.40 2cvx s PRO 623 Cb -0.11 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2cvx s PRO 623 CO 0.25 -2.31 1.27 0.14 -0.33 0.00 0.00 177.00 176.02 2cvx s VAL 624 N -2.80 2.50 -0.43 3.83 -7.23 -1.26 -4.64 120.40 110.37 2cvx s VAL 624 Ca 0.64 0.37 0.23 0.00 -1.81 0.00 0.00 61.98 61.41 2cvx s VAL 624 Cb -0.20 -3.18 0.07 0.00 0.56 0.00 0.00 36.38 33.63 2cvx s VAL 624 CO 0.58 -0.01 1.24 0.71 -0.31 0.00 0.00 175.10 177.30 2cvx h THR 625 N 1.51 0.00 -1.63 5.32 1.35 -1.94 0.31 112.91 117.84 2cvx h THR 625 Ca -0.50 -0.79 0.09 0.00 -0.55 0.00 0.00 66.41 64.66 2cvx h THR 625 Cb 1.28 1.39 -0.26 0.00 -1.73 0.00 0.00 68.15 68.83 2cvx h THR 625 CO 0.58 0.00 0.32 -0.55 -0.25 0.00 0.00 175.52 175.62 2cvx s SER 626 N -4.99 -0.58 0.00 5.36 0.15 -1.26 -4.60 113.70 107.77 2cvx s SER 626 Ca 0.03 0.95 0.13 0.00 0.70 0.00 0.00 55.95 57.76 2cvx s SER 626 Cb 0.11 1.21 0.79 0.00 -1.71 0.00 0.00 66.02 66.42 2cvx s SER 626 CO 0.74 -0.15 1.34 0.59 1.20 0.00 0.00 173.24 176.97 2cvx n ASN 627 N 3.67 0.00 -3.32 5.45 3.02 -0.55 -4.61 115.26 118.92 2cvx n ASN 627 Ca -0.18 -1.14 -0.08 0.00 -0.03 0.00 0.00 54.58 53.15 2cvx n ASN 627 Cb 0.58 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.68 2cvx n ASN 627 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2cvx s MET 628 N -2.00 0.39 -0.11 3.52 1.75 -1.26 -0.22 119.30 121.36 2cvx s MET 628 Ca 0.20 0.49 -0.09 0.00 -1.25 0.00 0.00 55.69 55.04 2cvx s MET 628 Cb 0.09 -0.33 -0.04 0.00 2.84 0.00 0.00 34.83 37.39 2cvx s MET 628 CO 0.15 -0.73 0.19 0.71 -0.65 0.00 0.00 175.02 174.69 2cvx s TYR 629 N 2.58 3.60 0.00 4.11 1.51 0.31 -4.70 117.35 124.75 2cvx s TYR 629 Ca 0.13 0.59 0.00 0.00 -1.01 0.00 0.00 57.07 56.78 2cvx s TYR 629 Cb -0.15 -2.03 0.00 0.00 -0.11 0.00 0.00 41.96 39.67 2cvx s TYR 629 CO -0.20 0.66 0.00 0.43 -1.11 0.00 0.00 175.55 175.33 2cvx n SER 630 N 2.16 0.00 0.00 2.29 7.64 -1.26 -1.37 113.62 123.08 2cvx n SER 630 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 2cvx n SER 630 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 2cvx n SER 630 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2cvx n PHE 638 N 14.00 0.00 -3.39 1.43 3.72 -1.26 -4.81 117.46 127.16 2cvx n PHE 638 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 2cvx n PHE 638 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 2cvx n PHE 638 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 2cvx s GLN 639 N 0.00 4.19 -0.09 -1.08 -0.44 -1.26 -5.09 119.66 115.89 2cvx s GLN 639 Ca 0.00 0.43 -0.02 0.00 -2.50 0.00 0.00 55.36 53.28 2cvx s GLN 639 Cb 0.00 -3.35 0.03 0.00 -1.64 0.00 0.00 33.01 28.05 2cvx s GLN 639 CO 0.00 0.37 0.01 0.08 0.50 0.00 0.00 175.29 176.24 2cvx s VAL 640 N -0.05 0.41 -0.15 1.34 1.01 -0.47 -5.01 120.40 117.49 2cvx s VAL 640 Ca 0.25 -0.00 -0.06 0.00 0.00 0.00 0.00 61.98 62.16 2cvx s VAL 640 Cb -0.16 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 2cvx s VAL 640 CO 0.11 0.18 0.08 0.54 0.00 0.00 0.00 175.10 176.02 2cvx s VAL 641 N 1.95 5.00 -0.43 2.92 0.11 -1.26 -0.53 120.40 128.15 2cvx s VAL 641 Ca 0.04 0.03 -0.23 0.00 -2.93 0.00 0.00 61.98 58.89 2cvx s VAL 641 Cb -0.13 -3.20 -0.12 0.00 -1.53 0.00 0.00 36.38 31.40 2cvx s VAL 641 CO -0.06 0.54 1.42 -3.20 -3.33 0.00 0.00 175.10 170.47 2cvx n ASN 642 N 2.76 0.32 0.28 3.54 2.85 0.69 -4.77 115.26 120.93 2cvx n ASN 642 Ca -0.18 0.27 0.14 0.00 -0.11 0.00 0.00 54.58 54.69 2cvx n ASN 642 Cb 0.53 -0.54 0.81 0.00 1.24 0.00 0.00 39.78 41.83 2cvx n ASN 642 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2cvx h PRO 643 N 6.16 0.00 0.06 1.20 0.11 -1.95 0.34 132.00 137.92 2cvx h PRO 643 Ca -0.05 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.82 2cvx h PRO 643 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2cvx h PRO 643 CO 0.73 0.06 -1.08 1.88 -0.21 0.00 0.00 178.00 179.39 2cvx h TYR 644 N 0.00 0.51 -0.04 0.65 0.99 -2.00 -2.37 116.97 114.71 2cvx h TYR 644 Ca -0.00 -0.32 -0.03 0.00 2.00 0.00 0.00 58.73 60.38 2cvx h TYR 644 Cb 0.17 -0.04 0.00 0.00 1.00 0.00 0.00 36.73 37.86 2cvx h TYR 644 CO 0.00 1.19 -0.09 1.25 -0.00 0.00 0.00 178.16 180.51 2cvx h LEU 645 N 0.14 0.16 -0.44 3.88 5.85 -1.43 -2.98 115.31 120.49 2cvx h LEU 645 Ca -0.10 -0.57 0.09 0.00 0.84 0.00 0.00 57.88 58.14 2cvx h LEU 645 Cb 1.76 -0.05 -0.09 0.00 0.37 0.00 0.00 40.66 42.65 2cvx h LEU 645 CO 0.18 0.70 -0.14 0.25 -0.34 0.00 0.00 178.44 179.08 2cvx h LEU 646 N -0.38 -0.51 -0.52 2.25 5.85 -0.49 -1.28 115.31 120.23 2cvx h LEU 646 Ca 0.00 0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.97 2cvx h LEU 646 Cb 0.67 0.31 -0.11 0.00 0.37 0.00 0.00 40.66 41.91 2cvx h LEU 646 CO 0.02 -0.18 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.62 2cvx h ARG 647 N -0.04 -0.10 -0.63 1.25 9.65 -1.49 -2.25 114.38 120.76 2cvx h ARG 647 Ca 0.21 0.01 0.01 0.00 -1.10 0.00 0.00 59.98 59.11 2cvx h ARG 647 Cb 0.37 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.94 2cvx h ARG 647 CO -0.48 -0.07 0.41 -0.44 2.80 0.00 0.00 179.97 182.20 2cvx h ASP 648 N -0.11 0.72 0.29 -3.80 5.19 -1.11 -2.09 116.42 115.50 2cvx h ASP 648 Ca 0.24 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.62 2cvx h ASP 648 Cb 0.49 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.82 2cvx h ASP 648 CO -0.59 0.52 -0.14 -0.07 -3.12 0.00 0.00 179.24 175.84 2cvx h LEU 649 N 0.85 -0.33 -0.87 1.55 3.38 -0.73 -1.55 115.31 117.61 2cvx h LEU 649 Ca 0.23 -0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.21 2cvx h LEU 649 Cb -0.10 0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.66 2cvx h LEU 649 CO -0.05 -0.11 0.51 0.58 0.09 0.00 0.00 178.44 179.46 2cvx h VAL 650 N -0.54 0.90 0.00 1.22 2.07 -1.44 -1.57 116.25 116.88 2cvx h VAL 650 Ca -0.04 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 2cvx h VAL 650 Cb 0.40 -0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2cvx h VAL 650 CO 0.06 0.15 -0.12 0.44 0.02 0.00 0.00 177.57 178.12 2cvx h ASP 651 N 0.83 0.00 -0.06 0.57 5.19 -1.11 -2.00 116.42 119.84 2cvx h ASP 651 Ca 0.43 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.84 2cvx h ASP 651 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 2cvx h ASP 651 CO -0.26 0.12 0.00 0.18 -3.12 0.00 0.00 179.24 176.16 2cvx n LEU 652 N -4.32 2.01 -2.99 1.55 4.77 -0.61 -4.94 117.00 112.48 2cvx n LEU 652 Ca -0.03 -0.70 -0.21 0.00 -0.03 0.00 0.00 56.01 55.04 2cvx n LEU 652 Cb 0.20 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.31 2cvx n LEU 652 CO 0.35 0.35 0.10 0.61 -1.33 0.00 0.00 177.39 177.48 2cvx n GLY 653 N 1.23 -0.40 0.00 -0.72 0.00 -0.75 -4.90 105.19 99.65 2cvx n GLY 653 Ca 0.17 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2cvx n GLY 653 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2cvx n ILE 654 N -4.57 0.00 -2.52 -0.61 -5.35 -0.69 -4.99 119.36 100.64 2cvx n ILE 654 Ca -0.05 -0.45 -0.42 0.00 -0.27 0.00 0.00 62.75 61.56 2cvx n ILE 654 Cb 0.58 1.04 -0.02 0.00 -1.74 0.00 0.00 39.64 39.50 2cvx n ILE 654 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 2cvx s TRP 655 N -0.56 2.50 0.00 4.28 -0.11 -1.17 -4.77 118.94 119.12 2cvx s TRP 655 Ca 0.00 0.43 0.00 0.00 1.22 0.00 0.00 56.10 57.75 2cvx s TRP 655 Cb 0.00 -4.48 0.00 0.00 -1.50 0.00 0.00 33.47 27.49 2cvx s TRP 655 CO 0.00 -1.72 0.00 -0.40 -4.62 0.00 0.00 176.95 170.21 2cvx n ASP 656 N 8.79 0.00 -0.01 5.86 5.68 -1.26 -4.85 116.55 130.76 2cvx n ASP 656 Ca 0.10 -0.64 -0.07 0.00 -0.50 0.00 0.00 54.79 53.68 2cvx n ASP 656 Cb 0.49 0.00 0.12 0.00 -1.14 0.00 0.00 41.12 40.59 2cvx n ASP 656 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2cvx h GLU 657 N 0.00 0.56 0.00 0.11 4.57 -2.00 -2.80 114.58 115.02 2cvx h GLU 657 Ca 0.00 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 57.90 2cvx h GLU 657 Cb 0.00 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.58 2cvx h GLU 657 CO 0.00 0.84 -0.05 0.78 -1.18 0.00 0.00 179.01 179.40 2cvx h GLY 658 N 1.05 0.00 0.85 1.92 0.00 -1.97 -1.92 103.07 103.00 2cvx h GLY 658 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.06 2cvx h GLY 658 CO 0.07 0.00 -1.81 1.03 0.00 0.00 0.00 176.54 175.84 2cvx n MET 659 N -3.34 0.67 0.10 4.80 2.81 -1.16 -3.51 117.12 117.49 2cvx n MET 659 Ca -0.02 0.28 -0.02 0.00 -1.81 0.00 0.00 57.70 56.14 2cvx n MET 659 Cb 0.20 -1.76 0.22 0.00 -0.71 0.00 0.00 33.22 31.17 2cvx n MET 659 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2cvx h LYS 660 N 0.02 0.20 -0.29 0.03 3.64 -1.22 -3.01 116.57 115.94 2cvx h LYS 660 Ca -0.33 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 58.89 2cvx h LYS 660 Cb 2.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.84 2cvx h LYS 660 CO 0.08 0.62 -0.02 0.37 -2.27 0.00 0.00 179.45 178.23 2cvx h GLN 661 N 0.17 0.53 -2.01 1.90 4.15 -1.51 -2.83 115.11 115.51 2cvx h GLN 661 Ca 0.01 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.24 2cvx h GLN 661 Cb 0.86 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.50 2cvx h GLN 661 CO 0.07 0.69 -0.02 0.98 -1.93 0.00 0.00 178.83 178.62 2cvx n TYR 662 N -4.56 0.00 0.00 3.99 4.19 -1.14 -3.12 117.16 116.53 2cvx n TYR 662 Ca -0.03 -0.88 0.00 0.00 3.31 0.00 0.00 57.90 60.30 2cvx n TYR 662 Cb 0.27 -0.53 0.00 0.00 0.49 0.00 0.00 39.34 39.58 2cvx n TYR 662 CO 0.00 0.00 0.00 1.28 0.91 0.00 0.00 176.86 179.05 2cvx n LEU 663 N 1.64 0.00 0.18 2.98 4.32 -1.14 -4.64 117.00 120.34 2cvx n LEU 663 Ca 0.02 0.00 0.02 0.00 -0.02 0.00 0.00 56.01 56.04 2cvx n LEU 663 Cb 0.45 0.00 0.33 0.00 -1.62 0.00 0.00 43.42 42.58 2cvx n LEU 663 CO 0.01 0.00 0.69 0.16 -1.22 0.00 0.00 177.39 177.02 2cvx h ILE 664 N 0.00 1.26 0.00 -0.08 3.07 -1.44 -2.69 117.51 117.63 2cvx h ILE 664 Ca 0.00 -1.43 -0.32 0.00 1.55 0.00 0.00 64.86 64.66 2cvx h ILE 664 Cb 0.00 1.78 -0.06 0.00 -0.27 0.00 0.00 36.82 38.27 2cvx h ILE 664 CO 0.00 0.40 -2.21 0.41 -1.05 0.00 0.00 178.15 175.71 2cvx n THR 665 N -3.99 1.21 0.47 0.16 -1.04 -1.23 -4.56 114.28 105.29 2cvx n THR 665 Ca -0.02 -0.73 -0.02 0.00 -2.04 0.00 0.00 64.05 61.24 2cvx n THR 665 Cb 0.45 -0.57 0.07 0.00 -1.82 0.00 0.00 70.33 68.47 2cvx n THR 665 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2cvx n GLN 666 N -2.67 1.66 -0.61 -2.82 1.13 -1.24 -4.82 117.38 108.01 2cvx n GLN 666 Ca -0.29 -0.79 0.00 0.00 -1.94 0.00 0.00 57.00 53.98 2cvx n GLN 666 Cb 1.06 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.92 2cvx n GLN 666 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2cvx n ASN 667 N 0.12 -1.64 -0.12 1.08 3.02 -1.25 -1.98 115.26 114.48 2cvx n ASN 667 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 2cvx n ASN 667 Cb 0.65 -2.64 0.00 0.00 -0.61 0.00 0.00 39.78 37.19 2cvx n ASN 667 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cvx n GLY 668 N -1.02 0.99 3.55 7.41 0.00 -1.01 -4.57 105.19 110.55 2cvx n GLY 668 Ca 0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2cvx n GLY 668 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cvx s SER 669 N -2.24 4.31 -0.04 1.61 0.15 -0.84 -1.49 113.70 115.16 2cvx s SER 669 Ca 0.00 -0.35 0.06 0.00 0.70 0.00 0.00 55.95 56.36 2cvx s SER 669 Cb 0.00 -0.83 0.11 0.00 -1.71 0.00 0.00 66.02 63.59 2cvx s SER 669 CO 0.00 0.21 1.06 2.30 1.20 0.00 0.00 173.24 178.02 2cvx n ILE 670 N 1.04 1.29 -2.45 6.45 -5.35 -1.26 -4.78 119.36 114.31 2cvx n ILE 670 Ca -0.14 -1.40 -0.36 0.00 -0.27 0.00 0.00 62.75 60.58 2cvx n ILE 670 Cb 0.52 0.26 -0.03 0.00 -1.74 0.00 0.00 39.64 38.66 2cvx n ILE 670 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2cvx s GLN 671 N -1.60 3.89 0.00 6.28 -1.52 -1.26 -3.72 119.66 121.74 2cvx s GLN 671 Ca 0.11 1.54 0.00 0.00 -1.95 0.00 0.00 55.36 55.06 2cvx s GLN 671 Cb 0.10 -2.33 0.00 0.00 -0.22 0.00 0.00 33.01 30.55 2cvx s GLN 671 CO 0.02 -0.38 0.00 0.41 -0.25 0.00 0.00 175.29 175.09 2cvx n GLY 672 N 0.18 1.94 3.46 3.09 0.00 -1.26 -4.96 105.19 107.64 2cvx n GLY 672 Ca 0.07 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.55 2cvx n GLY 672 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2cvx n LEU 673 N 0.00 -0.42 0.00 0.99 0.00 -1.24 -4.92 117.00 111.40 2cvx n LEU 673 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 56.01 57.16 2cvx n LEU 673 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 43.42 42.47 2cvx n LEU 673 CO 0.00 -2.30 0.32 -0.81 0.00 0.00 0.00 177.39 174.60 2cvx n PRO 674 N 1.32 0.00 -3.10 1.96 -0.04 -1.26 -4.07 135.00 129.80 2cvx n PRO 674 Ca 0.19 0.50 -0.41 0.00 -0.04 0.00 0.00 63.50 63.74 2cvx n PRO 674 Cb 0.16 -1.15 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 2cvx n PRO 674 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2cvx n ASN 675 N -1.39 5.93 -3.76 3.54 5.15 -1.26 -4.95 115.26 118.52 2cvx n ASN 675 Ca 0.00 -3.39 -0.20 0.00 -0.60 0.00 0.00 54.58 50.39 2cvx n ASN 675 Cb 0.00 -1.18 -0.17 0.00 -0.53 0.00 0.00 39.78 37.89 2cvx n ASN 675 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2cvx s VAL 676 N -2.62 0.16 0.46 3.44 1.01 -1.26 -5.00 120.40 116.59 2cvx s VAL 676 Ca 0.32 0.20 -0.23 0.00 0.00 0.00 0.00 61.98 62.27 2cvx s VAL 676 Cb 0.05 -0.32 -0.09 0.00 0.00 0.00 0.00 36.38 36.02 2cvx s VAL 676 CO 0.07 0.19 1.02 -2.65 0.00 0.00 0.00 175.10 173.73 2cvx n PRO 677 N 4.81 1.30 -0.26 2.72 -0.02 -1.26 -4.83 135.00 137.46 2cvx n PRO 677 Ca -0.13 0.47 0.13 0.00 -2.02 0.00 0.00 63.50 61.95 2cvx n PRO 677 Cb 0.50 -2.10 0.39 0.00 -0.02 0.00 0.00 33.50 32.28 2cvx n PRO 677 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2cvx h GLN 678 N 1.35 0.64 -0.42 -0.52 5.75 -2.00 -2.55 115.11 117.35 2cvx h GLN 678 Ca -0.46 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 57.96 2cvx h GLN 678 Cb 1.34 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 29.73 2cvx h GLN 678 CO 0.56 0.42 0.07 1.05 -2.65 0.00 0.00 178.83 178.28 2cvx h GLU 679 N 0.66 0.64 -0.13 1.69 4.11 -2.00 -1.30 114.58 118.25 2cvx h GLU 679 Ca 0.45 -0.13 -0.21 0.00 0.07 0.00 0.00 59.36 59.54 2cvx h GLU 679 Cb 0.76 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.92 2cvx h GLU 679 CO -0.20 0.61 -0.76 -0.07 0.07 0.00 0.00 179.01 178.66 2cvx h LEU 680 N 0.62 0.82 -0.96 3.06 3.38 -1.82 -2.14 115.31 118.27 2cvx h LEU 680 Ca 0.14 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 2cvx h LEU 680 Cb 0.29 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 2cvx h LEU 680 CO 0.00 1.32 0.57 0.11 0.09 0.00 0.00 178.44 180.53 2cvx h LYS 681 N 0.47 1.29 -0.09 1.13 1.57 -1.16 -0.89 116.57 118.89 2cvx h LYS 681 Ca -0.05 -0.12 -0.15 0.00 -1.87 0.00 0.00 60.65 58.47 2cvx h LYS 681 Cb 1.38 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2cvx h LYS 681 CO 0.15 0.90 -0.60 -0.44 -0.57 0.00 0.00 179.45 178.89 2cvx h ASP 682 N 1.31 0.35 0.64 0.86 5.19 -1.22 -3.15 116.42 120.39 2cvx h ASP 682 Ca 0.34 -0.20 -0.26 0.00 -0.62 0.00 0.00 57.03 56.29 2cvx h ASP 682 Cb -0.06 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 39.35 2cvx h ASP 682 CO -0.06 0.87 -1.16 0.25 -3.12 0.00 0.00 179.24 176.01 2cvx h LEU 683 N 0.23 0.38 -3.67 1.55 5.85 -1.15 -3.36 115.31 115.13 2cvx h LEU 683 Ca -0.01 -0.39 -0.43 0.00 0.84 0.00 0.00 57.88 57.90 2cvx h LEU 683 Cb 1.12 -0.12 -0.26 0.00 0.37 0.00 0.00 40.66 41.77 2cvx h LEU 683 CO 0.10 1.28 0.02 -1.22 -0.34 0.00 0.00 178.44 178.28 2cvx n TYR 684 N -3.54 2.22 -1.74 1.25 4.02 -0.36 -4.67 117.16 114.35 2cvx n TYR 684 Ca -0.07 -2.14 -0.42 0.00 -0.01 0.00 0.00 57.90 55.26 2cvx n TYR 684 Cb 0.98 -0.73 -0.01 0.00 -0.02 0.00 0.00 39.34 39.57 2cvx n TYR 684 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2cvx n LYS 685 N -0.97 2.52 -1.78 -0.72 5.02 -1.19 -4.67 118.16 116.38 2cvx n LYS 685 Ca 0.46 0.89 -0.32 0.00 -2.02 0.00 0.00 58.31 57.32 2cvx n LYS 685 Cb 0.99 -2.62 0.03 0.00 -0.02 0.00 0.00 35.03 33.42 2cvx n LYS 685 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2cvx s THR 686 N -0.43 3.95 0.54 -0.18 2.01 -1.26 -4.66 115.64 115.60 2cvx s THR 686 Ca 0.61 0.75 0.25 0.00 0.31 0.00 0.00 61.69 63.61 2cvx s THR 686 Cb -0.52 -3.40 0.39 0.00 0.01 0.00 0.00 72.50 68.98 2cvx s THR 686 CO 0.54 -0.71 2.01 1.62 -0.69 0.00 0.00 174.62 177.39 2cvx h VAL 687 N -0.23 0.72 0.00 3.82 3.04 -0.63 0.83 116.25 123.80 2cvx h VAL 687 Ca -0.45 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.24 2cvx h VAL 687 Cb 1.21 0.75 0.00 0.00 -2.01 0.00 0.00 31.29 31.24 2cvx h VAL 687 CO 0.57 0.00 0.00 0.79 -1.01 0.00 0.00 177.57 177.92 2cvx n TRP 688 N -4.33 0.00 -0.13 3.17 7.02 -1.26 -2.91 117.44 118.99 2cvx n TRP 688 Ca 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.57 2cvx n TRP 688 Cb 0.57 -0.18 0.00 0.00 -2.42 0.00 0.00 31.31 29.27 2cvx n TRP 688 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2cvx n GLU 689 N -1.18 1.04 -4.44 -0.99 1.02 0.27 -4.82 120.64 111.54 2cvx n GLU 689 Ca 0.13 -0.95 -0.34 0.00 -0.02 0.00 0.00 57.16 55.98 2cvx n GLU 689 Cb 0.14 -0.93 -0.10 0.00 -0.02 0.00 0.00 31.44 30.53 2cvx n GLU 689 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2cvx s ILE 690 N -0.48 4.06 0.19 -3.67 1.01 -1.13 -4.89 121.20 116.30 2cvx s ILE 690 Ca 0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 60.65 59.93 2cvx s ILE 690 Cb 0.00 -2.72 -0.09 0.00 0.01 0.00 0.00 42.46 39.67 2cvx s ILE 690 CO 0.00 0.55 1.33 -0.94 0.00 0.00 0.00 174.94 175.88 2cvx s SER 691 N -1.03 6.86 0.36 3.58 1.04 -1.26 -4.87 113.70 118.39 2cvx s SER 691 Ca 0.14 2.42 0.27 0.00 0.48 0.00 0.00 55.95 59.26 2cvx s SER 691 Cb -0.11 -2.61 1.23 0.00 0.10 0.00 0.00 66.02 64.63 2cvx s SER 691 CO 0.04 -0.56 1.80 1.56 0.98 0.00 0.00 173.24 177.06 2cvx h GLN 692 N 5.52 0.00 -0.05 4.02 1.08 -1.91 0.32 115.11 124.10 2cvx h GLN 692 Ca -0.44 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 56.66 2cvx h GLN 692 Cb 1.21 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 2cvx h GLN 692 CO 0.78 0.00 -0.40 -0.22 -0.95 0.00 0.00 178.83 178.04 2cvx h LYS 693 N 0.00 0.10 -0.03 1.46 3.64 -1.99 -0.42 116.57 119.33 2cvx h LYS 693 Ca 0.00 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.18 2cvx h LYS 693 Cb 0.26 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2cvx h LYS 693 CO 0.00 0.49 -0.57 1.15 -2.27 0.00 0.00 179.45 178.25 2cvx h THR 694 N 0.09 1.41 -0.31 1.00 2.02 -0.74 -2.22 112.91 114.16 2cvx h THR 694 Ca 0.01 -2.00 0.07 0.00 0.77 0.00 0.00 66.41 65.25 2cvx h THR 694 Cb 0.76 2.48 -0.07 0.00 -1.74 0.00 0.00 68.15 69.58 2cvx h THR 694 CO 0.06 0.59 -0.15 0.40 0.37 0.00 0.00 175.52 176.78 2cvx h ILE 695 N -0.04 0.54 -0.42 3.11 1.08 -1.36 -0.71 117.51 119.71 2cvx h ILE 695 Ca -0.06 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.36 2cvx h ILE 695 Cb 1.26 0.54 -0.02 0.00 -3.07 0.00 0.00 36.82 35.53 2cvx h ILE 695 CO 0.11 0.00 0.09 0.40 -0.69 0.00 0.00 178.15 178.06 2cvx h ILE 696 N -0.10 1.24 -0.17 -0.67 1.08 -1.11 0.89 117.51 118.66 2cvx h ILE 696 Ca 0.16 -0.83 0.04 0.00 -0.39 0.00 0.00 64.86 63.83 2cvx h ILE 696 Cb 0.35 0.98 -0.04 0.00 -3.07 0.00 0.00 36.82 35.04 2cvx h ILE 696 CO -0.38 0.29 -0.06 0.78 -0.69 0.00 0.00 178.15 178.09 2cvx h ASN 697 N 0.54 -0.22 0.08 1.72 2.35 -1.14 0.32 115.58 119.23 2cvx h ASN 697 Ca 0.13 0.06 -0.12 0.00 -0.55 0.00 0.00 56.30 55.82 2cvx h ASN 697 Cb 0.34 0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 2cvx h ASN 697 CO 0.00 -0.09 -0.39 0.24 -1.65 0.00 0.00 177.43 175.55 2cvx h MET 698 N -0.03 0.41 -0.56 0.81 2.86 -0.90 0.94 114.93 118.45 2cvx h MET 698 Ca 0.09 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 2cvx h MET 698 Cb 0.17 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 2cvx h MET 698 CO -0.20 0.74 0.26 0.00 1.06 0.00 0.00 176.91 178.78 2cvx h ALA 699 N 1.24 0.73 -0.17 6.32 0.00 -0.47 -1.39 119.26 125.52 2cvx h ALA 699 Ca 0.03 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 2cvx h ALA 699 Cb 0.84 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2cvx h ALA 699 CO 0.07 0.30 -0.45 0.00 0.00 0.00 0.00 179.25 179.17 2cvx h ALA 700 N 1.10 0.92 0.65 0.00 0.00 -0.03 -0.74 119.26 121.16 2cvx h ALA 700 Ca 0.19 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2cvx h ALA 700 Cb 0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2cvx h ALA 700 CO -0.02 0.64 -0.40 -0.44 0.00 0.00 0.00 179.25 179.03 2cvx h ASP 701 N 0.33 -0.99 0.44 0.00 3.32 -0.65 -3.19 116.42 115.68 2cvx h ASP 701 Ca 0.02 0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 2cvx h ASP 701 Cb 0.92 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 2cvx h ASP 701 CO 0.08 -0.62 -0.32 0.08 -1.72 0.00 0.00 179.24 176.74 2cvx h ARG 702 N -0.99 0.00 -0.36 3.56 0.11 -1.20 -3.19 114.38 112.32 2cvx h ARG 702 Ca -0.08 0.00 0.10 0.00 0.10 0.00 0.00 59.98 60.10 2cvx h ARG 702 Cb 0.80 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.86 2cvx h ARG 702 CO 0.08 0.32 0.34 0.77 0.10 0.00 0.00 179.97 181.59 2cvx h SER 703 N 0.00 0.00 0.65 0.08 0.02 -1.11 -0.53 113.55 112.67 2cvx h SER 703 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2cvx h SER 703 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2cvx h SER 703 CO 0.04 0.00 0.00 -0.37 -1.14 0.00 0.00 176.83 175.36 2cvx h VAL 704 N 0.00 0.00 -0.25 2.27 -1.51 -1.64 -2.19 116.25 112.93 2cvx h VAL 704 Ca 0.17 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 2cvx h VAL 704 Cb 0.85 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 2cvx h VAL 704 CO -0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 2cvx n TYR 705 N -2.41 0.33 -3.62 5.19 4.02 -0.21 -0.97 117.16 119.48 2cvx n TYR 705 Ca 0.01 -0.48 -0.40 0.00 -0.01 0.00 0.00 57.90 57.03 2cvx n TYR 705 Cb 0.21 -0.03 -0.10 0.00 -0.02 0.00 0.00 39.34 39.40 2cvx n TYR 705 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2cvx s ILE 706 N -0.99 4.17 0.29 -0.72 -1.09 -0.82 -4.62 121.20 117.41 2cvx s ILE 706 Ca 0.17 -1.38 0.02 0.00 -2.23 0.00 0.00 60.65 57.23 2cvx s ILE 706 Cb 0.09 -3.53 0.39 0.00 -1.58 0.00 0.00 42.46 37.82 2cvx s ILE 706 CO 0.12 -0.47 1.44 0.47 -1.23 0.00 0.00 174.94 175.26 2cvx n ASP 707 N 4.90 -0.10 0.00 3.58 8.00 -1.26 -4.65 116.55 127.03 2cvx n ASP 707 Ca -0.10 1.56 0.00 0.00 0.71 0.00 0.00 54.79 56.96 2cvx n ASP 707 Cb 0.43 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 2cvx n ASP 707 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cvx n GLN 708 N -5.35 0.00 -2.10 -1.24 6.02 -0.90 -4.59 117.38 109.23 2cvx n GLN 708 Ca 0.22 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 57.20 2cvx n GLN 708 Cb 0.72 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.98 2cvx n GLN 708 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2cvx n SER 709 N 0.00 0.50 -3.85 1.08 2.88 -0.35 -4.92 113.62 108.95 2cvx n SER 709 Ca 0.00 -1.09 -0.11 0.00 -1.33 0.00 0.00 58.87 56.34 2cvx n SER 709 Cb 0.00 0.05 -0.09 0.00 -0.75 0.00 0.00 64.21 63.42 2cvx n SER 709 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2cvx s HIS 710 N -1.81 0.02 -1.17 0.66 -3.43 -1.26 -3.49 115.29 104.81 2cvx s HIS 710 Ca 0.01 -0.13 -0.18 0.00 -0.80 0.00 0.00 55.06 53.97 2cvx s HIS 710 Cb 0.00 -0.03 -0.04 0.00 -1.43 0.00 0.00 32.58 31.08 2cvx s HIS 710 CO 0.01 -0.34 2.08 0.43 -2.00 0.00 0.00 174.74 174.92 2cvx n SER 711 N 1.19 3.34 -4.55 7.38 7.64 -1.12 -4.68 113.62 122.81 2cvx n SER 711 Ca -0.21 -2.77 -0.38 0.00 1.01 0.00 0.00 58.87 56.51 2cvx n SER 711 Cb 0.57 -1.44 -0.03 0.00 -1.01 0.00 0.00 64.21 62.29 2cvx n SER 711 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2cvx s LEU 712 N 2.05 3.28 0.35 -3.43 0.20 -1.26 -4.81 118.68 115.06 2cvx s LEU 712 Ca 0.52 -0.58 -0.28 0.00 0.69 0.00 0.00 54.13 54.48 2cvx s LEU 712 Cb 0.14 -2.56 -0.10 0.00 -0.43 0.00 0.00 46.19 43.24 2cvx s LEU 712 CO 0.00 -2.01 1.27 0.20 -0.29 0.00 0.00 176.35 175.52 2cvx s ASN 713 N 5.70 6.67 -0.04 3.68 0.02 -1.26 -0.32 114.94 129.39 2cvx s ASN 713 Ca 0.50 2.60 0.01 0.00 -1.02 0.00 0.00 52.86 54.96 2cvx s ASN 713 Cb -0.07 -2.64 -0.03 0.00 0.02 0.00 0.00 41.25 38.53 2cvx s ASN 713 CO 0.07 -0.59 -0.05 -0.76 0.02 0.00 0.00 177.10 175.78 2cvx s LEU 714 N -2.00 3.25 -0.14 0.60 1.02 -0.62 -4.91 118.68 115.87 2cvx s LEU 714 Ca 0.51 -0.05 0.01 0.00 0.02 0.00 0.00 54.13 54.63 2cvx s LEU 714 Cb -0.38 -1.79 0.02 0.00 0.02 0.00 0.00 46.19 44.06 2cvx s LEU 714 CO 0.49 0.33 -0.18 -0.36 0.02 0.00 0.00 176.35 176.65 2cvx s PHE 715 N -0.92 2.41 -0.08 0.29 0.40 -1.26 -0.37 117.98 118.45 2cvx s PHE 715 Ca 0.15 -1.29 -0.00 0.00 -0.60 0.00 0.00 56.93 55.19 2cvx s PHE 715 Cb -0.11 -1.70 0.02 0.00 0.51 0.00 0.00 43.02 41.75 2cvx s PHE 715 CO 0.05 -0.64 -0.05 -0.51 0.70 0.00 0.00 175.22 174.76 2cvx s LEU 716 N 1.14 1.08 0.00 -0.37 1.43 0.33 -4.88 118.68 117.41 2cvx s LEU 716 Ca -0.01 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2cvx s LEU 716 Cb -0.14 -0.65 0.00 0.00 0.03 0.00 0.00 46.19 45.42 2cvx s LEU 716 CO -0.07 -0.11 0.44 0.54 0.23 0.00 0.00 176.35 177.38 2cvx n ARG 717 N 4.72 0.00 -3.27 1.70 1.74 -1.26 -2.06 116.66 118.24 2cvx n ARG 717 Ca -0.14 0.26 -0.46 0.00 -0.77 0.00 0.00 57.85 56.74 2cvx n ARG 717 Cb 0.50 -1.05 -0.02 0.00 -1.02 0.00 0.00 32.46 30.88 2cvx n ARG 717 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cvx s ALA 718 N -2.93 4.08 -0.22 7.54 0.00 -1.26 -2.63 121.76 126.34 2cvx s ALA 718 Ca 0.00 -3.33 -0.25 0.00 0.00 0.00 0.00 51.96 48.38 2cvx s ALA 718 Cb 0.00 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 2cvx s ALA 718 CO 0.00 -2.37 0.85 -1.25 0.00 0.00 0.00 175.76 172.99 2cvx s PRO 719 N 0.33 4.22 0.21 0.00 0.04 -1.26 -5.01 135.00 133.52 2cvx s PRO 719 Ca 0.22 1.00 0.06 0.00 0.04 0.00 0.00 61.00 62.33 2cvx s PRO 719 Cb -0.09 -3.63 -0.05 0.00 0.04 0.00 0.00 34.50 30.77 2cvx s PRO 719 CO -0.09 -0.48 -0.10 0.95 0.04 0.00 0.00 177.00 177.32 2cvx s THR 720 N 2.71 1.51 0.20 1.26 -4.23 -1.26 -5.02 115.64 110.81 2cvx s THR 720 Ca 0.37 -2.14 -0.10 0.00 -1.18 0.00 0.00 61.69 58.64 2cvx s THR 720 Cb -0.16 -2.11 0.13 0.00 1.34 0.00 0.00 72.50 71.71 2cvx s THR 720 CO 0.08 -0.54 1.78 0.24 -0.54 0.00 0.00 174.62 175.64 2cvx h MET 721 N 2.55 0.53 0.00 3.99 2.86 -1.96 0.19 114.93 123.08 2cvx h MET 721 Ca -0.38 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.17 2cvx h MET 721 Cb 1.22 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 2cvx h MET 721 CO 0.64 0.35 -0.27 0.78 1.06 0.00 0.00 176.91 179.47 2cvx h GLY 722 N 0.54 0.00 0.15 8.32 0.00 -1.98 0.15 103.07 110.26 2cvx h GLY 722 Ca 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.62 2cvx h GLY 722 CO -0.23 0.00 -0.01 1.70 0.00 0.00 0.00 176.54 178.00 2cvx h LYS 723 N 0.00 -0.02 -0.53 4.80 1.63 -1.58 -2.72 116.57 118.15 2cvx h LYS 723 Ca -0.00 0.00 0.09 0.00 -0.85 0.00 0.00 60.65 59.89 2cvx h LYS 723 Cb 0.60 0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.16 2cvx h LYS 723 CO 0.03 0.74 0.13 -0.07 -3.45 0.00 0.00 179.45 176.84 2cvx h LEU 724 N -0.87 0.06 -0.59 5.20 3.38 -0.62 -1.98 115.31 119.88 2cvx h LEU 724 Ca -0.00 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2cvx h LEU 724 Cb 0.77 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 2cvx h LEU 724 CO 0.00 0.06 0.38 0.74 0.09 0.00 0.00 178.44 179.71 2cvx h THR 725 N 0.28 1.12 -0.39 0.22 2.02 -0.78 -1.30 112.91 114.08 2cvx h THR 725 Ca 0.27 -0.27 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 2cvx h THR 725 Cb 0.35 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 2cvx h THR 725 CO -0.32 0.14 -0.29 0.77 0.37 0.00 0.00 175.52 176.19 2cvx h SER 726 N 0.77 0.87 0.49 4.18 4.64 -1.26 -1.38 113.55 121.86 2cvx h SER 726 Ca 0.22 -0.35 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 2cvx h SER 726 Cb -0.05 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.78 2cvx h SER 726 CO -0.07 1.10 -0.41 0.24 -0.87 0.00 0.00 176.83 176.83 2cvx h MET 727 N 0.71 -0.86 -0.60 4.77 2.07 -0.86 0.78 114.93 120.95 2cvx h MET 727 Ca 0.08 0.06 0.10 0.00 -2.07 0.00 0.00 59.70 57.87 2cvx h MET 727 Cb 0.84 0.20 -0.07 0.00 -1.87 0.00 0.00 31.60 30.69 2cvx h MET 727 CO 0.07 -0.57 0.20 0.45 1.07 0.00 0.00 176.91 178.13 2cvx h HIS 728 N -0.89 0.35 -0.10 -0.22 3.86 -1.25 -1.76 115.15 115.13 2cvx h HIS 728 Ca -0.05 0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.04 2cvx h HIS 728 Cb 0.77 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.16 2cvx h HIS 728 CO -0.19 0.07 -0.60 0.74 0.86 0.00 0.00 177.93 178.81 2cvx h PHE 729 N 0.37 0.46 0.53 2.45 -1.00 -1.13 -0.33 116.94 118.28 2cvx h PHE 729 Ca 0.31 -0.17 -0.03 0.00 2.81 0.00 0.00 57.97 60.89 2cvx h PHE 729 Cb 0.40 -0.08 0.01 0.00 3.61 0.00 0.00 35.95 39.88 2cvx h PHE 729 CO -0.19 0.87 -0.26 -0.92 -1.61 0.00 0.00 178.31 176.21 2cvx h TYR 730 N 0.26 -0.66 -0.49 -0.55 3.20 -0.61 0.66 116.97 118.78 2cvx h TYR 730 Ca -0.01 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.95 2cvx h TYR 730 Cb 1.13 0.22 -0.10 0.00 1.54 0.00 0.00 36.73 39.52 2cvx h TYR 730 CO 0.03 -0.35 -0.25 0.78 -1.64 0.00 0.00 178.16 176.73 2cvx h GLY 731 N -0.87 0.05 0.57 1.82 0.00 -1.34 0.63 103.07 103.93 2cvx h GLY 731 Ca -0.07 0.32 0.06 0.00 0.00 0.00 0.00 47.33 47.63 2cvx h GLY 731 CO 0.12 -0.21 0.10 -0.25 0.00 0.00 0.00 176.54 176.29 2cvx h TRP 732 N -0.14 0.17 0.00 5.60 7.01 -0.97 -2.56 115.95 125.06 2cvx h TRP 732 Ca 0.22 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.19 2cvx h TRP 732 Cb 0.49 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 2cvx h TRP 732 CO -0.52 0.04 -0.29 0.87 -2.79 0.00 0.00 178.44 175.75 2cvx h LYS 733 N 0.24 0.00 0.00 2.65 1.57 -0.25 -1.41 116.57 119.36 2cvx h LYS 733 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2cvx h LYS 733 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2cvx h LYS 733 CO -0.23 0.29 0.00 0.87 -0.57 0.00 0.00 179.45 179.81 2cvx h LYS 734 N 0.00 0.00 0.00 3.15 1.79 -0.51 -3.47 116.57 117.54 2cvx h LYS 734 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2cvx h LYS 734 Cb 0.86 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.51 2cvx h LYS 734 CO 0.04 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.82 2cvx n GLY 735 N -0.47 0.64 3.72 3.86 0.00 -0.53 -4.99 105.19 107.42 2cvx n GLY 735 Ca 0.00 -0.58 -0.37 0.00 0.00 0.00 0.00 46.02 45.07 2cvx n GLY 735 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cvx n LEU 736 N 0.00 5.94 -0.07 0.99 4.77 -1.01 -4.93 117.00 122.69 2cvx n LEU 736 Ca 0.00 0.84 -0.04 0.00 -0.03 0.00 0.00 56.01 56.78 2cvx n LEU 736 Cb 0.00 -1.55 -0.01 0.00 -2.33 0.00 0.00 43.42 39.53 2cvx n LEU 736 CO 0.00 -1.01 -0.29 0.11 -1.33 0.00 0.00 177.39 174.87 2cvx h LYS 737 N 0.57 0.00 -5.45 3.23 1.57 -1.91 -3.42 116.57 111.16 2cvx h LYS 737 Ca -0.51 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 57.64 2cvx h LYS 737 Cb 1.34 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.51 2cvx h LYS 737 CO 0.53 0.00 0.56 0.99 -0.57 0.00 0.00 179.45 180.96 2cvx s THR 738 N -2.11 4.32 0.12 -0.16 2.01 -1.26 -0.18 115.64 118.38 2cvx s THR 738 Ca -0.12 -0.38 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 2cvx s THR 738 Cb 0.02 -4.69 -0.08 0.00 0.01 0.00 0.00 72.50 67.75 2cvx s THR 738 CO 0.18 -1.47 1.42 1.23 -0.69 0.00 0.00 174.62 175.29 2cvx h GLY 739 N 11.37 0.89 -5.33 4.40 0.00 -1.24 -3.43 103.07 109.72 2cvx h GLY 739 Ca -0.28 -0.97 -0.06 0.00 0.00 0.00 0.00 47.33 46.02 2cvx h GLY 739 CO 1.18 0.87 -0.15 -0.29 0.00 0.00 0.00 176.54 178.16 2cvx s MET 740 N -4.25 0.55 0.00 4.80 1.75 -0.81 -4.94 119.30 116.40 2cvx s MET 740 Ca -0.11 0.93 0.00 0.00 -1.25 0.00 0.00 55.69 55.25 2cvx s MET 740 Cb 0.10 0.10 0.00 0.00 2.84 0.00 0.00 34.83 37.86 2cvx s MET 740 CO 0.86 -0.14 0.00 0.98 -0.65 0.00 0.00 175.02 176.08 2cvx n TYR 741 N 3.97 0.00 -2.53 4.11 9.36 0.56 -0.67 117.16 131.96 2cvx n TYR 741 Ca -0.20 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.70 2cvx n TYR 741 Cb 0.57 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.24 2cvx n TYR 741 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 2cvx s TYR 742 N 0.30 3.45 -0.28 2.98 2.02 -1.26 -4.20 117.35 120.36 2cvx s TYR 742 Ca 0.00 1.36 -0.11 0.00 -0.37 0.00 0.00 57.07 57.95 2cvx s TYR 742 Cb 0.00 -2.70 -0.04 0.00 -0.40 0.00 0.00 41.96 38.82 2cvx s TYR 742 CO 0.00 -0.29 0.18 -1.17 -1.57 0.00 0.00 175.55 172.70 2cvx s LEU 743 N -3.98 4.00 -0.12 -1.29 1.98 -0.79 -1.59 118.68 116.89 2cvx s LEU 743 Ca 0.57 -0.11 -0.07 0.00 -2.89 0.00 0.00 54.13 51.64 2cvx s LEU 743 Cb -0.10 -2.09 -0.04 0.00 0.66 0.00 0.00 46.19 44.62 2cvx s LEU 743 CO 0.31 -0.07 0.12 -0.13 -1.89 0.00 0.00 176.35 174.69 2cvx s ARG 744 N 1.73 3.44 0.16 1.98 1.81 0.51 -4.30 118.95 124.28 2cvx s ARG 744 Ca 0.07 -0.17 0.01 0.00 -1.72 0.00 0.00 55.73 53.92 2cvx s ARG 744 Cb -0.16 -3.16 -0.05 0.00 -0.45 0.00 0.00 34.95 31.13 2cvx s ARG 744 CO 0.10 0.74 0.00 -0.08 -0.68 0.00 0.00 175.30 175.38 2cvx s THR 745 N -0.92 0.62 0.00 0.02 -1.32 -1.26 -0.51 115.64 112.27 2cvx s THR 745 Ca 0.14 -1.97 0.00 0.00 -1.21 0.00 0.00 61.69 58.65 2cvx s THR 745 Cb -0.12 -2.07 0.00 0.00 -1.51 0.00 0.00 72.50 68.80 2cvx s THR 745 CO 0.03 -0.51 0.00 0.00 -2.21 0.00 0.00 174.62 171.94