#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cx5 n ALA 2 N 0.00 1.15 -0.22 3.17 0.00 -1.26 -4.74 120.51 118.61 3cx5 n ALA 2 Ca 0.00 0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.65 3cx5 n ALA 2 Cb 0.00 -2.27 0.32 0.00 0.00 0.00 0.00 19.45 17.51 3cx5 n ALA 2 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3cx5 h PHE 3 N 1.45 0.84 0.00 0.00 3.04 -2.00 -0.19 116.94 120.06 3cx5 h PHE 3 Ca -0.49 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.47 3cx5 h PHE 3 Cb 1.31 -0.28 -0.00 0.00 2.56 0.00 0.00 35.95 39.55 3cx5 h PHE 3 CO 0.44 0.44 -0.03 0.07 -2.02 0.00 0.00 178.31 177.21 3cx5 h ARG 4 N 0.82 0.00 0.01 1.11 0.11 -1.91 0.20 114.38 114.72 3cx5 h ARG 4 Ca 0.34 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 60.06 3cx5 h ARG 4 Cb 0.26 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.27 3cx5 h ARG 4 CO -0.12 0.03 -2.27 1.63 0.10 0.00 0.00 179.97 179.34 3cx5 n LYS 5 N -3.42 0.68 0.00 0.08 5.02 -0.36 -2.00 118.16 118.16 3cx5 n LYS 5 Ca -0.02 0.09 -0.17 0.00 -2.02 0.00 0.00 58.31 56.18 3cx5 n LYS 5 Cb 0.15 -1.58 -0.11 0.00 -0.02 0.00 0.00 35.03 33.46 3cx5 n LYS 5 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3cx5 h SER 6 N 0.00 0.50 -3.33 4.39 0.87 -0.57 -3.41 113.55 112.00 3cx5 h SER 6 Ca -0.50 -0.78 -0.53 0.00 -1.23 0.00 0.00 61.79 58.75 3cx5 h SER 6 Cb 2.12 -0.15 0.07 0.00 -0.44 0.00 0.00 62.40 64.00 3cx5 h SER 6 CO 0.02 1.22 0.83 0.21 -0.53 0.00 0.00 176.83 178.57 3cx5 s ASN 7 N -6.73 6.51 0.32 6.23 3.84 0.01 -4.91 114.94 120.21 3cx5 s ASN 7 Ca -0.13 2.81 0.06 0.00 0.21 0.00 0.00 52.86 55.80 3cx5 s ASN 7 Cb 0.03 -2.63 0.70 0.00 -0.55 0.00 0.00 41.25 38.80 3cx5 s ASN 7 CO 0.82 -0.81 1.86 1.62 -2.79 0.00 0.00 177.10 177.79 3cx5 h VAL 8 N 3.48 0.87 0.03 -5.21 3.04 -1.90 -0.81 116.25 115.77 3cx5 h VAL 8 Ca -0.46 -0.28 -0.22 0.00 -1.01 0.00 0.00 66.70 64.73 3cx5 h VAL 8 Cb 1.22 -0.03 -0.02 0.00 -2.01 0.00 0.00 31.29 30.45 3cx5 h VAL 8 CO 0.79 0.15 -1.16 1.88 -1.01 0.00 0.00 177.57 178.22 3cx5 h TYR 9 N 0.83 0.13 -0.47 3.17 0.99 -1.96 -3.38 116.97 116.28 3cx5 h TYR 9 Ca 0.47 -0.09 0.03 0.00 2.00 0.00 0.00 58.73 61.14 3cx5 h TYR 9 Cb 0.61 -0.01 -0.03 0.00 1.00 0.00 0.00 36.73 38.31 3cx5 h TYR 9 CO -0.00 1.45 0.31 -0.07 -0.00 0.00 0.00 178.16 179.86 3cx5 h LEU 10 N -0.77 0.44 -1.30 3.88 4.07 -1.81 -2.31 115.31 117.51 3cx5 h LEU 10 Ca -0.29 -0.01 0.08 0.00 0.08 0.00 0.00 57.88 57.74 3cx5 h LEU 10 Cb 1.41 -0.10 -0.05 0.00 1.08 0.00 0.00 40.66 42.99 3cx5 h LEU 10 CO -0.10 0.31 0.53 0.77 -1.08 0.00 0.00 178.44 178.86 3cx5 h SER 11 N 0.52 0.73 -0.30 -0.43 4.64 -0.50 0.37 113.55 118.57 3cx5 h SER 11 Ca 0.19 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.45 3cx5 h SER 11 Cb 0.12 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3cx5 h SER 11 CO -0.05 0.45 -0.11 -0.07 -0.87 0.00 0.00 176.83 176.18 3cx5 h LEU 12 N 0.81 0.61 -0.29 5.97 -0.00 -1.60 0.17 115.31 120.99 3cx5 h LEU 12 Ca 0.36 -0.39 -0.00 0.00 -0.00 0.00 0.00 57.88 57.86 3cx5 h LEU 12 Cb 0.35 -0.17 -0.01 0.00 -0.00 0.00 0.00 40.66 40.83 3cx5 h LEU 12 CO -0.14 0.86 0.17 0.58 -0.00 0.00 0.00 178.44 179.92 3cx5 h VAL 13 N 0.36 1.10 -0.70 1.22 2.07 -1.25 -1.33 116.25 117.72 3cx5 h VAL 13 Ca 0.07 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 3cx5 h VAL 13 Cb 0.61 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3cx5 h VAL 13 CO 0.04 0.10 0.39 -1.13 0.02 0.00 0.00 177.57 176.99 3cx5 h ASN 14 N 0.37 0.88 -0.46 0.57 -0.73 -0.15 0.24 115.58 116.30 3cx5 h ASN 14 Ca 0.10 -0.09 -0.05 0.00 1.87 0.00 0.00 56.30 58.13 3cx5 h ASN 14 Cb 0.01 -0.22 -0.02 0.00 0.27 0.00 0.00 38.32 38.36 3cx5 h ASN 14 CO -0.02 0.72 0.11 -1.28 -0.37 0.00 0.00 177.43 176.59 3cx5 h SER 15 N 0.97 0.76 0.11 1.15 0.87 -0.40 0.15 113.55 117.16 3cx5 h SER 15 Ca 0.25 -0.14 -0.35 0.00 -1.23 0.00 0.00 61.79 60.32 3cx5 h SER 15 Cb 0.03 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 61.73 3cx5 h SER 15 CO -0.04 0.76 -2.22 -1.22 -0.53 0.00 0.00 176.83 173.57 3cx5 n TYR 16 N -4.27 0.23 0.01 2.24 4.02 -0.53 -3.67 117.16 115.19 3cx5 n TYR 16 Ca 0.04 0.08 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 3cx5 n TYR 16 Cb 0.23 -1.03 -0.00 0.00 -0.02 0.00 0.00 39.34 38.52 3cx5 n TYR 16 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 3cx5 n ILE 17 N -2.81 0.00 -0.00 -0.72 5.41 0.83 -4.70 119.36 117.37 3cx5 n ILE 17 Ca -0.29 -0.23 -0.03 0.00 1.00 0.00 0.00 62.75 63.20 3cx5 n ILE 17 Cb 1.12 0.73 -0.01 0.00 -0.71 0.00 0.00 39.64 40.77 3cx5 n ILE 17 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3cx5 n ILE 18 N -1.28 1.31 1.14 1.39 5.41 -0.95 -3.69 119.36 122.69 3cx5 n ILE 18 Ca -0.00 0.30 0.12 0.00 1.00 0.00 0.00 62.75 64.17 3cx5 n ILE 18 Cb 0.01 -1.85 0.21 0.00 -0.71 0.00 0.00 39.64 37.29 3cx5 n ILE 18 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3cx5 n ASP 19 N -3.83 1.64 -4.57 4.38 10.43 0.47 -1.00 116.55 124.07 3cx5 n ASP 19 Ca -0.05 -1.29 -0.56 0.00 2.57 0.00 0.00 54.79 55.46 3cx5 n ASP 19 Cb 0.20 0.26 -0.08 0.00 1.84 0.00 0.00 41.12 43.34 3cx5 n ASP 19 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 3cx5 n SER 20 N -0.17 2.12 -4.61 -2.24 2.88 -1.24 -4.59 113.62 105.77 3cx5 n SER 20 Ca 0.12 0.82 -0.43 0.00 -1.33 0.00 0.00 58.87 58.04 3cx5 n SER 20 Cb 0.42 -1.15 -0.03 0.00 -0.75 0.00 0.00 64.21 62.70 3cx5 n SER 20 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 3cx5 s PRO 21 N 4.71 3.52 -0.06 -1.46 0.02 -1.26 -1.64 135.00 138.83 3cx5 s PRO 21 Ca 1.05 1.46 -0.03 0.00 0.02 0.00 0.00 61.00 63.50 3cx5 s PRO 21 Cb -1.05 -4.13 -0.04 0.00 0.02 0.00 0.00 34.50 29.30 3cx5 s PRO 21 CO 0.61 -1.64 0.08 -1.14 -0.33 0.00 0.00 177.00 174.58 3cx5 s GLN 22 N 5.25 3.15 0.25 5.54 2.00 0.57 -4.85 119.66 131.58 3cx5 s GLN 22 Ca 0.75 -0.37 -0.31 0.00 -2.00 0.00 0.00 55.36 53.44 3cx5 s GLN 22 Cb -0.22 -2.93 -0.11 0.00 0.80 0.00 0.00 33.01 30.54 3cx5 s GLN 22 CO 0.32 0.70 1.57 -2.14 -0.50 0.00 0.00 175.29 175.24 3cx5 s PRO 23 N -1.33 4.17 0.61 1.67 0.02 -1.26 -0.90 135.00 137.99 3cx5 s PRO 23 Ca 0.18 2.48 0.37 0.00 0.02 0.00 0.00 61.00 64.06 3cx5 s PRO 23 Cb -0.12 -3.07 2.02 0.00 0.02 0.00 0.00 34.50 33.35 3cx5 s PRO 23 CO 0.08 -0.60 2.26 0.66 -0.33 0.00 0.00 177.00 179.07 3cx5 h SER 24 N 5.54 0.00 -0.32 2.53 4.64 -1.79 -3.19 113.55 120.96 3cx5 h SER 24 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3cx5 h SER 24 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3cx5 h SER 24 CO 0.84 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 175.28 3cx5 n SER 25 N -3.35 3.32 -4.75 4.97 3.41 -1.26 -4.98 113.62 110.97 3cx5 n SER 25 Ca -0.02 -1.97 -0.41 0.00 -0.26 0.00 0.00 58.87 56.20 3cx5 n SER 25 Cb 0.13 -0.20 -0.02 0.00 -0.26 0.00 0.00 64.21 63.86 3cx5 n SER 25 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3cx5 s ILE 26 N -1.51 2.11 0.36 -1.33 -4.36 -1.21 -4.51 121.20 110.76 3cx5 s ILE 26 Ca 0.35 0.09 0.02 0.00 -0.26 0.00 0.00 60.65 60.86 3cx5 s ILE 26 Cb 0.21 -3.06 0.07 0.00 1.25 0.00 0.00 42.46 40.93 3cx5 s ILE 26 CO 0.30 0.02 0.50 -0.46 0.24 0.00 0.00 174.94 175.53 3cx5 n ASN 27 N 2.09 0.90 0.32 4.36 0.23 -1.26 -4.96 115.26 116.93 3cx5 n ASN 27 Ca 0.08 -1.70 0.20 0.00 -0.53 0.00 0.00 54.58 52.62 3cx5 n ASN 27 Cb 0.38 -0.30 1.05 0.00 -2.08 0.00 0.00 39.78 38.83 3cx5 n ASN 27 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 3cx5 h TYR 28 N -0.27 0.00 0.00 -2.53 0.05 -2.01 -1.31 116.97 110.90 3cx5 h TYR 28 Ca -0.16 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.60 3cx5 h TYR 28 Cb 0.66 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.40 3cx5 h TYR 28 CO 0.00 0.00 -0.10 -1.49 -1.05 0.00 0.00 178.16 175.52 3cx5 h TRP 29 N 0.00 0.00 0.00 4.88 4.06 -2.01 -0.93 115.95 121.95 3cx5 h TRP 29 Ca 0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.96 3cx5 h TRP 29 Cb 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.41 3cx5 h TRP 29 CO 0.00 0.10 0.00 0.91 -3.56 0.00 0.00 178.44 175.89 3cx5 n TRP 30 N -3.78 0.00 0.98 0.49 8.01 -0.49 -3.02 117.44 119.63 3cx5 n TRP 30 Ca -0.02 0.00 0.12 0.00 -1.31 0.00 0.00 57.50 56.29 3cx5 n TRP 30 Cb 0.20 0.00 0.24 0.00 -2.01 0.00 0.00 31.31 29.74 3cx5 n TRP 30 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 3cx5 n ASN 31 N -0.91 0.51 0.02 -0.99 4.13 -0.35 -4.29 115.26 113.38 3cx5 n ASN 31 Ca 0.17 -0.24 0.00 0.00 1.68 0.00 0.00 54.58 56.19 3cx5 n ASN 31 Cb 0.08 0.26 0.32 0.00 -1.54 0.00 0.00 39.78 38.89 3cx5 n ASN 31 CO 0.00 0.00 0.00 0.24 0.28 0.00 0.00 177.26 177.78 3cx5 h MET 32 N 0.00 0.46 -0.50 3.52 2.86 -1.71 -2.87 114.93 116.70 3cx5 h MET 32 Ca 0.00 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 3cx5 h MET 32 Cb 0.51 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 3cx5 h MET 32 CO 0.00 0.51 0.32 0.78 1.06 0.00 0.00 176.91 179.59 3cx5 h GLY 33 N 0.81 0.71 1.53 8.32 0.00 -1.85 0.44 103.07 113.04 3cx5 h GLY 33 Ca 0.10 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 3cx5 h GLY 33 CO 0.01 0.27 -0.03 1.48 0.00 0.00 0.00 176.54 178.28 3cx5 h SER 34 N 0.68 0.54 -0.40 0.19 4.64 -1.80 -1.92 113.55 115.48 3cx5 h SER 34 Ca 0.18 -0.12 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 3cx5 h SER 34 Cb -0.05 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 3cx5 h SER 34 CO -0.04 0.63 -0.02 -0.07 -0.87 0.00 0.00 176.83 176.47 3cx5 h LEU 35 N 0.54 0.78 -0.93 5.97 4.07 -1.16 -1.23 115.31 123.36 3cx5 h LEU 35 Ca 0.11 -0.20 -0.09 0.00 0.08 0.00 0.00 57.88 57.79 3cx5 h LEU 35 Cb 0.39 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.90 3cx5 h LEU 35 CO 0.02 0.86 -0.15 -0.07 -1.08 0.00 0.00 178.44 178.01 3cx5 h LEU 36 N 0.75 0.61 -0.57 1.67 3.38 -0.21 -0.33 115.31 120.61 3cx5 h LEU 36 Ca 0.14 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3cx5 h LEU 36 Cb 0.48 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3cx5 h LEU 36 CO 0.02 0.78 0.08 1.23 0.09 0.00 0.00 178.44 180.63 3cx5 h GLY 37 N 0.97 1.02 0.98 0.83 0.00 -0.84 -1.64 103.07 104.38 3cx5 h GLY 37 Ca 0.09 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 3cx5 h GLY 37 CO 0.04 0.64 0.25 -2.00 0.00 0.00 0.00 176.54 175.47 3cx5 h LEU 38 N 0.84 0.58 -0.39 3.11 6.46 -0.89 -2.19 115.31 122.83 3cx5 h LEU 38 Ca 0.17 -0.09 0.02 0.00 -0.12 0.00 0.00 57.88 57.85 3cx5 h LEU 38 Cb 0.44 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.19 3cx5 h LEU 38 CO 0.01 0.51 0.22 0.00 -0.62 0.00 0.00 178.44 178.57 3cx5 h LEU 40 N 0.45 0.51 -0.16 0.00 5.85 -1.12 -0.56 115.31 120.28 3cx5 h LEU 40 Ca 0.16 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3cx5 h LEU 40 Cb 0.02 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3cx5 h LEU 40 CO -0.08 0.36 0.10 0.58 -0.34 0.00 0.00 178.44 179.07 3cx5 h VAL 41 N 0.62 1.05 -0.29 1.05 2.07 -0.97 -0.77 116.25 119.00 3cx5 h VAL 41 Ca 0.19 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.66 3cx5 h VAL 41 Cb -0.02 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 3cx5 h VAL 41 CO -0.07 0.05 0.04 0.40 0.02 0.00 0.00 177.57 178.00 3cx5 h ILE 42 N 0.21 0.83 -0.08 4.57 2.04 -0.59 -0.80 117.51 123.69 3cx5 h ILE 42 Ca 0.06 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 3cx5 h ILE 42 Cb -0.01 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3cx5 h ILE 42 CO -0.01 0.02 0.05 1.56 0.00 0.00 0.00 178.15 179.77 3cx5 h GLN 43 N 0.13 0.10 -0.43 2.37 1.08 -0.87 -1.05 115.11 116.45 3cx5 h GLN 43 Ca 0.14 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.32 3cx5 h GLN 43 Cb 0.16 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 3cx5 h GLN 43 CO -0.20 0.10 0.24 0.82 -0.95 0.00 0.00 178.83 178.84 3cx5 h ILE 44 N 0.07 1.16 -0.05 2.54 2.04 -0.92 0.15 117.51 122.51 3cx5 h ILE 44 Ca 0.03 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 3cx5 h ILE 44 Cb 0.02 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3cx5 h ILE 44 CO -0.01 0.16 -0.02 0.58 0.00 0.00 0.00 178.15 178.87 3cx5 h VAL 45 N 0.56 1.31 -0.58 1.67 2.07 -1.05 -0.95 116.25 119.28 3cx5 h VAL 45 Ca 0.15 -0.96 -0.06 0.00 0.82 0.00 0.00 66.70 66.66 3cx5 h VAL 45 Cb 0.05 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 3cx5 h VAL 45 CO -0.02 0.26 0.14 0.71 0.02 0.00 0.00 177.57 178.68 3cx5 h THR 46 N -0.26 1.24 -0.15 2.57 1.35 -1.19 -2.43 112.91 114.04 3cx5 h THR 46 Ca 0.01 -0.86 -0.00 0.00 -0.55 0.00 0.00 66.41 65.02 3cx5 h THR 46 Cb 0.43 0.64 -0.01 0.00 -1.73 0.00 0.00 68.15 67.48 3cx5 h THR 46 CO 0.01 0.32 0.09 1.23 -0.25 0.00 0.00 175.52 176.92 3cx5 h GLY 47 N 1.01 0.21 0.99 5.82 0.00 -0.54 -1.51 103.07 109.05 3cx5 h GLY 47 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 3cx5 h GLY 47 CO -0.00 0.08 0.31 -2.22 0.00 0.00 0.00 176.54 174.72 3cx5 h ILE 48 N 0.17 1.18 -0.19 2.60 2.04 -1.00 0.17 117.51 122.47 3cx5 h ILE 48 Ca 0.05 -0.43 -0.06 0.00 1.00 0.00 0.00 64.86 65.43 3cx5 h ILE 48 Cb 0.02 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3cx5 h ILE 48 CO -0.01 0.19 -0.15 -0.26 0.00 0.00 0.00 178.15 177.92 3cx5 h PHE 49 N 0.73 0.33 0.01 1.37 -1.00 -1.33 -2.23 116.94 114.82 3cx5 h PHE 49 Ca 0.19 -0.04 -0.22 0.00 2.81 0.00 0.00 57.97 60.71 3cx5 h PHE 49 Cb 0.02 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.49 3cx5 h PHE 49 CO -0.02 0.46 -0.93 0.52 -1.61 0.00 0.00 178.31 176.73 3cx5 h MET 50 N 0.29 0.32 -0.38 1.51 2.86 -0.78 -3.19 114.93 115.56 3cx5 h MET 50 Ca 0.06 -0.35 0.11 0.00 -2.06 0.00 0.00 59.70 57.46 3cx5 h MET 50 Cb 0.44 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 3cx5 h MET 50 CO 0.03 1.05 0.28 0.00 1.06 0.00 0.00 176.91 179.32 3cx5 h ALA 51 N 0.83 2.34 0.00 6.32 0.00 -0.06 0.09 119.26 128.79 3cx5 h ALA 51 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3cx5 h ALA 51 Cb 1.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.38 3cx5 h ALA 51 CO 0.15 -0.45 0.00 0.52 0.00 0.00 0.00 179.25 179.47 3cx5 h MET 52 N 0.02 0.00 0.00 0.00 2.86 -1.50 -2.77 114.93 113.54 3cx5 h MET 52 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 3cx5 h MET 52 Cb 0.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.37 3cx5 h MET 52 CO -0.00 0.00 0.00 0.72 1.06 0.00 0.00 176.91 178.69 3cx5 n HIS 53 N -2.88 0.00 -4.04 -0.22 8.25 -0.00 -5.06 115.22 111.27 3cx5 n HIS 53 Ca -0.02 -0.46 -0.33 0.00 -0.26 0.00 0.00 57.72 56.65 3cx5 n HIS 53 Cb 0.13 -0.05 -0.06 0.00 1.12 0.00 0.00 29.99 31.13 3cx5 n HIS 53 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3cx5 s TYR 54 N -0.93 3.37 -0.10 4.41 5.04 -1.05 -4.80 117.35 123.29 3cx5 s TYR 54 Ca 0.00 0.26 0.03 0.00 -2.44 0.00 0.00 57.07 54.92 3cx5 s TYR 54 Cb 0.00 -1.77 0.01 0.00 0.35 0.00 0.00 41.96 40.55 3cx5 s TYR 54 CO 0.00 0.58 -0.19 -1.12 -1.34 0.00 0.00 175.55 173.49 3cx5 s SER 55 N -1.74 2.62 0.08 4.32 0.01 -1.26 -5.00 113.70 112.72 3cx5 s SER 55 Ca 0.23 -0.47 0.26 0.00 1.31 0.00 0.00 55.95 57.28 3cx5 s SER 55 Cb -0.12 -1.20 0.68 0.00 0.21 0.00 0.00 66.02 65.60 3cx5 s SER 55 CO 0.15 0.08 1.57 -1.54 0.41 0.00 0.00 173.24 173.91 3cx5 n SER 56 N 3.85 0.51 -4.69 2.44 3.41 -1.26 -3.23 113.62 114.65 3cx5 n SER 56 Ca -0.20 0.20 -0.44 0.00 -0.26 0.00 0.00 58.87 58.16 3cx5 n SER 56 Cb 0.52 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.29 3cx5 n SER 56 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3cx5 n ASN 57 N -1.83 3.22 -0.11 4.04 4.13 -1.26 -3.93 115.26 119.51 3cx5 n ASN 57 Ca 0.05 1.11 0.26 0.00 1.68 0.00 0.00 54.58 57.68 3cx5 n ASN 57 Cb 0.39 -1.48 0.72 0.00 -1.54 0.00 0.00 39.78 37.87 3cx5 n ASN 57 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 3cx5 h ILE 58 N 3.38 0.57 0.00 2.41 2.10 -1.91 0.31 117.51 124.37 3cx5 h ILE 58 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.49 3cx5 h ILE 58 Cb 1.25 0.60 0.00 0.00 -1.09 0.00 0.00 36.82 37.58 3cx5 h ILE 58 CO 0.83 0.00 -0.41 -0.62 -1.08 0.00 0.00 178.15 176.87 3cx5 n GLU 59 N -4.22 0.27 -0.01 2.19 4.71 -1.26 -4.11 120.64 118.22 3cx5 n GLU 59 Ca 0.15 0.13 0.05 0.00 -0.01 0.00 0.00 57.16 57.48 3cx5 n GLU 59 Cb 0.85 -1.72 -0.08 0.00 -1.01 0.00 0.00 31.44 29.48 3cx5 n GLU 59 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3cx5 n LEU 60 N -2.14 0.00 0.03 -4.62 4.32 0.78 -4.78 117.00 110.58 3cx5 n LEU 60 Ca 0.04 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.95 3cx5 n LEU 60 Cb 0.43 0.01 -0.05 0.00 -1.62 0.00 0.00 43.42 42.19 3cx5 n LEU 60 CO 0.34 0.01 0.51 0.00 -1.22 0.00 0.00 177.39 177.02 3cx5 h ALA 61 N 0.93 -0.75 -0.47 -1.18 0.00 -0.60 0.11 119.26 117.31 3cx5 h ALA 61 Ca -0.01 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.94 3cx5 h ALA 61 Cb 0.50 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 3cx5 h ALA 61 CO 0.00 -0.83 0.05 0.35 0.00 0.00 0.00 179.25 178.82 3cx5 h PHE 62 N -0.36 0.06 -0.41 0.00 3.57 -1.78 -1.52 116.94 116.50 3cx5 h PHE 62 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3cx5 h PHE 62 Cb 0.38 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 3cx5 h PHE 62 CO -0.43 -0.05 0.11 0.77 -2.23 0.00 0.00 178.31 176.48 3cx5 h SER 63 N 0.17 0.55 -0.05 0.41 0.02 -1.82 -2.04 113.55 110.80 3cx5 h SER 63 Ca 0.23 -0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 61.01 3cx5 h SER 63 Cb 0.33 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 3cx5 h SER 63 CO -0.35 0.55 -0.26 0.77 -1.14 0.00 0.00 176.83 176.40 3cx5 h SER 64 N 0.59 0.48 -0.30 3.07 4.64 0.21 0.11 113.55 122.36 3cx5 h SER 64 Ca 0.14 -0.17 -0.12 0.00 -0.47 0.00 0.00 61.79 61.18 3cx5 h SER 64 Cb 0.21 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3cx5 h SER 64 CO -0.01 0.74 -0.22 0.58 -0.87 0.00 0.00 176.83 177.05 3cx5 h VAL 65 N 0.42 1.27 -0.36 0.95 2.07 -0.95 -0.37 116.25 119.28 3cx5 h VAL 65 Ca 0.06 -1.34 -0.09 0.00 0.82 0.00 0.00 66.70 66.16 3cx5 h VAL 65 Cb 0.68 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 3cx5 h VAL 65 CO 0.05 0.45 -0.13 -0.33 0.02 0.00 0.00 177.57 177.63 3cx5 h GLU 66 N 0.68 0.63 -0.72 1.57 4.39 -0.85 -0.25 114.58 120.03 3cx5 h GLU 66 Ca 0.09 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.55 3cx5 h GLU 66 Cb 0.74 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.30 3cx5 h GLU 66 CO 0.06 0.75 0.28 1.25 -1.16 0.00 0.00 179.01 180.18 3cx5 h HIS 67 N 0.58 1.10 -0.52 4.33 -0.00 -0.24 0.32 115.15 120.72 3cx5 h HIS 67 Ca 0.10 -0.08 -0.09 0.00 -0.00 0.00 0.00 60.37 60.29 3cx5 h HIS 67 Cb 0.56 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 3cx5 h HIS 67 CO 0.02 0.84 -0.05 0.82 -0.00 0.00 0.00 177.93 179.57 3cx5 h ILE 68 N 1.05 1.27 -0.55 6.26 2.04 -0.43 0.22 117.51 127.37 3cx5 h ILE 68 Ca 0.24 -1.17 -0.11 0.00 1.00 0.00 0.00 64.86 64.82 3cx5 h ILE 68 Cb 0.22 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3cx5 h ILE 68 CO -0.02 0.41 -0.09 0.24 0.00 0.00 0.00 178.15 178.69 3cx5 h MET 69 N 0.81 1.02 0.01 2.37 2.86 -0.33 -3.26 114.93 118.42 3cx5 h MET 69 Ca 0.14 -0.37 -0.40 0.00 -2.06 0.00 0.00 59.70 57.01 3cx5 h MET 69 Cb 0.59 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.12 3cx5 h MET 69 CO 0.04 1.06 -2.32 0.54 1.06 0.00 0.00 176.91 177.29 3cx5 n ARG 70 N -4.15 0.62 -0.05 1.72 1.74 0.11 -4.13 116.66 112.52 3cx5 n ARG 70 Ca 0.02 0.27 -0.13 0.00 -0.77 0.00 0.00 57.85 57.23 3cx5 n ARG 70 Cb 0.39 -1.55 -0.14 0.00 -1.02 0.00 0.00 32.46 30.14 3cx5 n ARG 70 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3cx5 n ASP 71 N -3.89 1.13 -4.71 0.55 10.43 0.73 -4.93 116.55 115.86 3cx5 n ASP 71 Ca -0.47 0.21 -0.42 0.00 2.57 0.00 0.00 54.79 56.68 3cx5 n ASP 71 Cb 0.91 -0.07 -0.03 0.00 1.84 0.00 0.00 41.12 43.77 3cx5 n ASP 71 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3cx5 s VAL 72 N -2.56 3.94 0.00 2.53 1.01 -0.97 -4.96 120.40 119.41 3cx5 s VAL 72 Ca -0.14 1.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.92 3cx5 s VAL 72 Cb 0.07 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.49 3cx5 s VAL 72 CO 0.79 0.07 1.92 -1.00 0.00 0.00 0.00 175.10 176.88 3cx5 s HIS 73 N 1.43 1.41 -0.63 5.22 3.76 -1.26 -0.58 115.29 124.65 3cx5 s HIS 73 Ca 0.60 -0.27 0.00 0.00 -0.15 0.00 0.00 55.06 55.23 3cx5 s HIS 73 Cb -0.30 -4.17 0.00 0.00 1.11 0.00 0.00 32.58 29.23 3cx5 s HIS 73 CO 0.28 -5.15 0.00 0.09 -0.85 0.00 0.00 174.74 169.11 3cx5 n ASN 74 N 7.72 -4.63 -0.35 1.40 3.02 -1.26 -4.90 115.26 116.26 3cx5 n ASN 74 Ca 0.20 0.15 0.01 0.00 -0.03 0.00 0.00 54.58 54.90 3cx5 n ASN 74 Cb 0.42 -2.65 0.17 0.00 -0.61 0.00 0.00 39.78 37.10 3cx5 n ASN 74 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3cx5 h GLY 75 N 0.00 1.40 1.87 7.41 0.00 -0.98 -1.61 103.07 111.16 3cx5 h GLY 75 Ca -0.12 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 3cx5 h GLY 75 CO 0.18 0.41 -0.20 0.10 0.00 0.00 0.00 176.54 177.03 3cx5 h TYR 76 N 1.21 0.16 -0.29 5.60 -0.00 -1.71 -0.85 116.97 121.09 3cx5 h TYR 76 Ca 0.38 -0.02 -0.10 0.00 0.00 0.00 0.00 58.73 58.99 3cx5 h TYR 76 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 36.73 36.69 3cx5 h TYR 76 CO -0.00 0.35 -0.22 0.82 -0.00 0.00 0.00 178.16 179.11 3cx5 h ILE 77 N 0.15 1.30 -0.28 -0.90 2.04 -1.69 -0.53 117.51 117.60 3cx5 h ILE 77 Ca 0.03 -1.36 -0.00 0.00 1.00 0.00 0.00 64.86 64.52 3cx5 h ILE 77 Cb 0.44 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 3cx5 h ILE 77 CO 0.03 0.43 0.17 -0.07 0.00 0.00 0.00 178.15 178.72 3cx5 h LEU 78 N 0.40 0.34 -0.17 1.44 3.38 -0.78 0.15 115.31 120.07 3cx5 h LEU 78 Ca 0.05 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3cx5 h LEU 78 Cb 0.77 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 3cx5 h LEU 78 CO 0.06 0.28 0.00 -0.09 0.09 0.00 0.00 178.44 178.78 3cx5 h ARG 79 N 0.36 0.30 -0.14 1.13 1.12 -1.13 -0.80 114.38 115.21 3cx5 h ARG 79 Ca 0.10 -0.09 -0.09 0.00 -1.11 0.00 0.00 59.98 58.79 3cx5 h ARG 79 Cb 0.01 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 29.93 3cx5 h ARG 79 CO -0.02 0.51 -0.30 1.88 -3.11 0.00 0.00 179.97 178.93 3cx5 h TYR 80 N 0.05 0.31 -0.38 2.20 0.05 -1.05 0.61 116.97 118.76 3cx5 h TYR 80 Ca 0.05 -0.06 -0.08 0.00 0.05 0.00 0.00 58.73 58.68 3cx5 h TYR 80 Cb 0.38 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 3cx5 h TYR 80 CO 0.03 0.55 -0.09 1.25 -1.05 0.00 0.00 178.16 178.86 3cx5 h LEU 81 N 0.24 0.73 -0.25 3.88 6.46 -0.83 0.03 115.31 125.57 3cx5 h LEU 81 Ca 0.03 -0.36 -0.06 0.00 -0.12 0.00 0.00 57.88 57.37 3cx5 h LEU 81 Cb 0.66 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 3cx5 h LEU 81 CO 0.05 0.92 -0.08 -0.74 -0.62 0.00 0.00 178.44 177.97 3cx5 h HIS 82 N 0.53 0.57 0.21 1.25 2.76 -0.78 0.40 115.15 120.09 3cx5 h HIS 82 Ca 0.10 -0.13 -0.01 0.00 -2.20 0.00 0.00 60.37 58.13 3cx5 h HIS 82 Cb 0.60 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 29.43 3cx5 h HIS 82 CO 0.05 0.74 -0.10 0.00 -1.30 0.00 0.00 177.93 177.31 3cx5 h ALA 83 N 0.75 -0.28 -0.21 5.26 0.00 -0.88 -2.13 119.26 121.77 3cx5 h ALA 83 Ca 0.06 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3cx5 h ALA 83 Cb 0.56 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3cx5 h ALA 83 CO 0.03 -0.48 -0.40 -0.91 0.00 0.00 0.00 179.25 177.49 3cx5 h ASN 84 N -0.64 0.52 -0.92 0.00 2.35 -1.07 -2.79 115.58 113.03 3cx5 h ASN 84 Ca -0.03 -0.23 0.07 0.00 -0.55 0.00 0.00 56.30 55.56 3cx5 h ASN 84 Cb 0.46 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.63 3cx5 h ASN 84 CO 0.05 0.87 0.60 1.23 -1.65 0.00 0.00 177.43 178.52 3cx5 h GLY 85 N 1.09 1.34 1.00 2.83 0.00 -0.19 -0.79 103.07 108.35 3cx5 h GLY 85 Ca 0.04 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 3cx5 h GLY 85 CO 0.07 0.30 0.29 0.00 0.00 0.00 0.00 176.54 177.21 3cx5 h ALA 86 N 1.51 0.83 -0.55 3.60 0.00 -1.11 0.82 119.26 124.36 3cx5 h ALA 86 Ca 0.40 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3cx5 h ALA 86 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3cx5 h ALA 86 CO -0.15 0.41 0.23 0.77 0.00 0.00 0.00 179.25 180.51 3cx5 h SER 87 N 0.89 0.75 -0.34 0.00 0.02 -1.11 -2.31 113.55 111.45 3cx5 h SER 87 Ca 0.22 -0.16 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 3cx5 h SER 87 Cb 0.14 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 3cx5 h SER 87 CO -0.02 0.70 -0.03 -0.26 -1.14 0.00 0.00 176.83 176.08 3cx5 h PHE 88 N 0.75 0.76 -0.46 3.45 0.05 -0.91 -1.56 116.94 119.02 3cx5 h PHE 88 Ca 0.18 -0.11 0.05 0.00 3.82 0.00 0.00 57.97 61.92 3cx5 h PHE 88 Cb 0.18 -0.21 -0.04 0.00 2.00 0.00 0.00 35.95 37.88 3cx5 h PHE 88 CO 0.00 0.73 0.20 0.35 -0.18 0.00 0.00 178.31 179.42 3cx5 h PHE 89 N 0.67 0.37 -0.20 -0.55 3.04 -0.43 -0.51 116.94 119.34 3cx5 h PHE 89 Ca 0.13 0.02 -0.15 0.00 3.98 0.00 0.00 57.97 61.96 3cx5 h PHE 89 Cb 0.45 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.86 3cx5 h PHE 89 CO 0.02 0.16 -0.49 0.74 -2.02 0.00 0.00 178.31 176.73 3cx5 h PHE 90 N 0.40 0.64 -0.04 0.41 0.04 -0.98 -0.85 116.94 116.57 3cx5 h PHE 90 Ca 0.21 -0.21 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 3cx5 h PHE 90 Cb 0.16 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.18 3cx5 h PHE 90 CO -0.12 0.91 0.00 1.98 -0.60 0.00 0.00 178.31 180.48 3cx5 h MET 91 N 0.41 0.06 -0.88 1.51 4.05 -0.88 -0.33 114.93 118.88 3cx5 h MET 91 Ca 0.02 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 3cx5 h MET 91 Cb 1.01 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.76 3cx5 h MET 91 CO 0.09 0.32 0.50 0.28 0.23 0.00 0.00 176.91 178.33 3cx5 h VAL 92 N -0.20 1.25 -0.52 -5.77 2.07 -1.09 -1.57 116.25 110.41 3cx5 h VAL 92 Ca 0.01 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 3cx5 h VAL 92 Cb 0.29 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 3cx5 h VAL 92 CO 0.00 0.28 0.20 -0.03 0.02 0.00 0.00 177.57 178.04 3cx5 h MET 93 N 1.22 0.79 -0.84 1.57 -1.53 -0.90 0.12 114.93 115.36 3cx5 h MET 93 Ca 0.31 -0.15 0.02 0.00 -3.44 0.00 0.00 59.70 56.44 3cx5 h MET 93 Cb 0.00 -0.12 -0.05 0.00 -0.55 0.00 0.00 31.60 30.88 3cx5 h MET 93 CO -0.05 0.70 0.55 0.74 0.14 0.00 0.00 176.91 178.98 3cx5 h PHE 94 N 0.71 1.03 -0.52 1.39 0.04 -0.64 0.92 116.94 119.87 3cx5 h PHE 94 Ca 0.17 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.88 3cx5 h PHE 94 Cb 0.21 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 3cx5 h PHE 94 CO 0.01 0.62 -0.02 0.52 -0.60 0.00 0.00 178.31 178.84 3cx5 h MET 95 N 1.09 0.94 -0.48 1.51 2.86 -0.81 0.12 114.93 120.16 3cx5 h MET 95 Ca 0.32 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 3cx5 h MET 95 Cb -0.07 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.49 3cx5 h MET 95 CO -0.09 0.97 0.27 1.25 1.06 0.00 0.00 176.91 180.37 3cx5 h HIS 96 N 0.81 0.66 -0.50 -0.22 -0.00 -0.32 0.10 115.15 115.68 3cx5 h HIS 96 Ca 0.15 -0.01 -0.12 0.00 -0.00 0.00 0.00 60.37 60.38 3cx5 h HIS 96 Cb 0.55 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.74 3cx5 h HIS 96 CO 0.04 0.49 -0.17 0.52 -0.00 0.00 0.00 177.93 178.81 3cx5 h MET 97 N 0.64 1.00 -0.47 5.26 2.07 -0.65 -2.44 114.93 120.34 3cx5 h MET 97 Ca 0.17 -0.41 -0.08 0.00 -2.07 0.00 0.00 59.70 57.31 3cx5 h MET 97 Cb 0.04 -0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 29.71 3cx5 h MET 97 CO -0.03 1.09 -0.03 0.00 1.07 0.00 0.00 176.91 179.01 3cx5 h ALA 98 N 0.89 1.06 -0.26 6.32 0.00 -0.47 -1.53 119.26 125.27 3cx5 h ALA 98 Ca 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3cx5 h ALA 98 Cb 0.74 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3cx5 h ALA 98 CO 0.06 0.58 0.17 -0.22 0.00 0.00 0.00 179.25 179.84 3cx5 h LYS 99 N 0.74 0.34 -0.89 0.00 3.11 -0.68 -0.41 116.57 118.79 3cx5 h LYS 99 Ca 0.14 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.95 3cx5 h LYS 99 Cb 0.49 -0.08 -0.04 0.00 -1.00 0.00 0.00 32.23 31.60 3cx5 h LYS 99 CO 0.03 0.23 0.54 0.78 -2.81 0.00 0.00 179.45 178.21 3cx5 h GLY 100 N 0.35 1.29 0.85 5.01 0.00 -0.93 -1.52 103.07 108.12 3cx5 h GLY 100 Ca 0.09 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 3cx5 h GLY 100 CO -0.02 0.52 0.04 1.41 0.00 0.00 0.00 176.54 178.48 3cx5 h LEU 101 N 1.22 0.14 -0.45 3.11 4.07 -0.94 0.21 115.31 122.68 3cx5 h LEU 101 Ca 0.32 -0.18 -0.01 0.00 0.08 0.00 0.00 57.88 58.09 3cx5 h LEU 101 Cb -0.06 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 3cx5 h LEU 101 CO -0.06 0.28 0.22 0.22 -1.08 0.00 0.00 178.44 178.02 3cx5 h TYR 102 N -0.00 0.64 -0.43 1.13 3.20 -0.88 -3.09 116.97 117.53 3cx5 h TYR 102 Ca 0.03 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3cx5 h TYR 102 Cb 0.19 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3cx5 h TYR 102 CO -0.01 0.51 0.00 0.66 -1.64 0.00 0.00 178.16 177.68 3cx5 n TYR 103 N -4.66 0.57 -3.53 -3.82 4.02 -0.59 -0.81 117.16 108.35 3cx5 n TYR 103 Ca 0.01 -0.29 -0.24 0.00 -0.01 0.00 0.00 57.90 57.37 3cx5 n TYR 103 Cb 0.11 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.50 3cx5 n TYR 103 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3cx5 n GLY 104 N 1.21 -0.54 0.26 2.72 0.00 -0.71 -3.11 105.19 105.02 3cx5 n GLY 104 Ca 0.15 0.24 0.15 0.00 0.00 0.00 0.00 46.02 46.56 3cx5 n GLY 104 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3cx5 h SER 105 N -2.49 0.00 1.42 1.61 0.02 -0.90 -2.83 113.55 110.38 3cx5 h SER 105 Ca -0.56 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 3cx5 h SER 105 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 3cx5 h SER 105 CO 0.57 0.07 0.00 0.10 -1.14 0.00 0.00 176.83 176.43 3cx5 h TYR 106 N 0.00 0.00 -4.28 3.45 -0.00 -1.85 -3.42 116.97 110.87 3cx5 h TYR 106 Ca -0.00 0.00 -0.51 0.00 0.00 0.00 0.00 58.73 58.22 3cx5 h TYR 106 Cb 0.54 0.00 0.13 0.00 0.00 0.00 0.00 36.73 37.40 3cx5 h TYR 106 CO 0.00 0.00 0.33 1.03 -0.00 0.00 0.00 178.16 179.52 3cx5 s ARG 107 N -3.24 2.31 0.39 0.10 0.52 -1.07 -3.69 118.95 114.27 3cx5 s ARG 107 Ca 0.07 1.28 -0.25 0.00 -0.52 0.00 0.00 55.73 56.31 3cx5 s ARG 107 Cb 0.09 -1.90 -0.11 0.00 0.52 0.00 0.00 34.95 33.55 3cx5 s ARG 107 CO 0.57 -1.61 1.05 0.45 0.02 0.00 0.00 175.30 175.78 3cx5 n SER 108 N -3.25 1.48 -1.49 0.23 2.88 -1.26 -0.68 113.62 111.54 3cx5 n SER 108 Ca 0.10 1.08 -0.06 0.00 -1.33 0.00 0.00 58.87 58.65 3cx5 n SER 108 Cb 0.53 -1.36 0.14 0.00 -0.75 0.00 0.00 64.21 62.77 3cx5 n SER 108 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3cx5 n PRO 109 N 0.27 2.24 -0.82 -1.46 -0.04 -1.26 -4.94 135.00 128.99 3cx5 n PRO 109 Ca 0.09 -1.63 -0.05 0.00 -0.04 0.00 0.00 63.50 61.87 3cx5 n PRO 109 Cb 0.38 -1.74 0.22 0.00 -0.04 0.00 0.00 33.50 32.32 3cx5 n PRO 109 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3cx5 n ARG 110 N -0.09 2.38 -0.16 0.54 1.74 0.15 -4.68 116.66 116.54 3cx5 n ARG 110 Ca 0.25 -3.07 -0.09 0.00 -0.77 0.00 0.00 57.85 54.17 3cx5 n ARG 110 Cb 0.98 -1.93 0.00 0.00 -1.02 0.00 0.00 32.46 30.49 3cx5 n ARG 110 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3cx5 h VAL 111 N 1.39 1.21 -0.77 1.55 2.07 -1.68 -1.78 116.25 118.24 3cx5 h VAL 111 Ca 0.25 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 67.09 3cx5 h VAL 111 Cb 1.89 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 32.41 3cx5 h VAL 111 CO 0.51 0.25 0.51 0.74 0.02 0.00 0.00 177.57 179.60 3cx5 h THR 112 N 0.62 1.20 -0.41 2.57 2.02 -1.90 0.94 112.91 117.94 3cx5 h THR 112 Ca 0.15 -0.36 0.02 0.00 0.77 0.00 0.00 66.41 67.00 3cx5 h THR 112 Cb 0.22 0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 3cx5 h THR 112 CO -0.01 0.19 0.23 0.25 0.37 0.00 0.00 175.52 176.56 3cx5 h LEU 113 N 1.04 0.38 -0.20 2.58 5.85 -1.82 -0.79 115.31 122.35 3cx5 h LEU 113 Ca 0.28 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 3cx5 h LEU 113 Cb -0.12 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3cx5 h LEU 113 CO -0.06 0.27 0.07 -0.25 -0.34 0.00 0.00 178.44 178.12 3cx5 h TRP 114 N 0.48 0.31 -0.95 1.25 2.91 -0.67 -1.49 115.95 117.80 3cx5 h TRP 114 Ca 0.16 -0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 3cx5 h TRP 114 Cb 0.02 -0.09 -0.05 0.00 -0.51 0.00 0.00 29.16 28.53 3cx5 h TRP 114 CO -0.08 0.39 0.57 -0.91 -1.03 0.00 0.00 178.44 177.38 3cx5 h ASN 115 N 0.15 1.14 -0.36 2.65 2.35 -0.59 -0.56 115.58 120.36 3cx5 h ASN 115 Ca 0.06 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 3cx5 h ASN 115 Cb 0.22 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 3cx5 h ASN 115 CO -0.00 0.88 0.01 0.58 -1.65 0.00 0.00 177.43 177.25 3cx5 h VAL 116 N 1.31 1.23 -0.68 2.81 2.07 -1.03 -2.39 116.25 119.57 3cx5 h VAL 116 Ca 0.34 -0.94 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3cx5 h VAL 116 Cb -0.05 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 3cx5 h VAL 116 CO -0.06 0.33 0.45 1.23 0.02 0.00 0.00 177.57 179.54 3cx5 h GLY 117 N 0.95 0.96 1.01 2.17 0.00 -0.07 -1.33 103.07 106.76 3cx5 h GLY 117 Ca 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3cx5 h GLY 117 CO 0.02 0.35 0.56 -2.08 0.00 0.00 0.00 176.54 175.38 3cx5 h VAL 118 N 0.92 1.24 -0.60 4.60 2.07 -0.75 -0.74 116.25 122.99 3cx5 h VAL 118 Ca 0.25 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 3cx5 h VAL 118 Cb -0.11 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 29.61 3cx5 h VAL 118 CO -0.05 0.24 0.28 0.40 0.02 0.00 0.00 177.57 178.46 3cx5 h ILE 119 N 1.21 1.21 -0.80 4.57 2.04 -0.95 -1.72 117.51 123.07 3cx5 h ILE 119 Ca 0.32 -0.61 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 3cx5 h ILE 119 Cb -0.09 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 3cx5 h ILE 119 CO -0.06 0.25 0.44 0.40 0.00 0.00 0.00 178.15 179.17 3cx5 h ILE 120 N 0.82 1.24 -0.30 -0.67 2.04 -0.73 -1.09 117.51 118.81 3cx5 h ILE 120 Ca 0.21 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.49 3cx5 h ILE 120 Cb 0.13 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.35 3cx5 h ILE 120 CO -0.02 0.27 0.15 0.15 0.00 0.00 0.00 178.15 178.69 3cx5 h PHE 121 N 1.11 0.27 -0.61 1.37 3.57 -0.63 0.88 116.94 122.91 3cx5 h PHE 121 Ca 0.28 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.77 3cx5 h PHE 121 Cb 0.04 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 3cx5 h PHE 121 CO 0.00 0.14 0.30 0.82 -2.23 0.00 0.00 178.31 177.34 3cx5 h ILE 122 N 0.31 1.21 -0.36 1.41 2.04 -0.99 -1.32 117.51 119.81 3cx5 h ILE 122 Ca 0.13 -0.59 -0.10 0.00 1.00 0.00 0.00 64.86 65.30 3cx5 h ILE 122 Cb 0.05 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 3cx5 h ILE 122 CO -0.09 0.24 -0.18 -0.07 0.00 0.00 0.00 178.15 178.05 3cx5 h LEU 123 N 0.83 0.67 -0.43 1.44 3.38 -0.72 -1.35 115.31 119.13 3cx5 h LEU 123 Ca 0.21 -0.21 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 3cx5 h LEU 123 Cb 0.11 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3cx5 h LEU 123 CO -0.03 0.85 -0.29 0.74 0.09 0.00 0.00 178.44 179.81 3cx5 h THR 124 N 0.60 1.27 -0.20 0.22 2.02 -0.54 0.05 112.91 116.33 3cx5 h THR 124 Ca 0.09 -1.45 -0.01 0.00 0.77 0.00 0.00 66.41 65.81 3cx5 h THR 124 Cb 0.63 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 3cx5 h THR 124 CO 0.04 0.49 0.08 0.40 0.37 0.00 0.00 175.52 176.91 3cx5 h ILE 125 N 0.78 1.16 -0.68 3.11 2.04 -1.06 -1.41 117.51 121.45 3cx5 h ILE 125 Ca 0.09 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.47 3cx5 h ILE 125 Cb 0.87 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 3cx5 h ILE 125 CO 0.08 0.15 0.43 0.00 0.00 0.00 0.00 178.15 178.81 3cx5 h ALA 126 N 0.93 0.86 -0.26 1.87 0.00 -1.13 -1.11 119.26 120.43 3cx5 h ALA 126 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3cx5 h ALA 126 Cb 0.17 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3cx5 h ALA 126 CO -0.01 0.32 0.17 1.15 0.00 0.00 0.00 179.25 180.89 3cx5 h THR 127 N 0.92 1.07 -0.52 0.00 2.02 -0.79 -1.44 112.91 114.17 3cx5 h THR 127 Ca 0.25 -0.13 -0.04 0.00 0.77 0.00 0.00 66.41 67.25 3cx5 h THR 127 Cb -0.06 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 3cx5 h THR 127 CO -0.05 0.07 0.15 0.00 0.37 0.00 0.00 175.52 176.06 3cx5 h ALA 128 N 1.09 1.29 0.07 6.16 0.00 -0.92 -0.82 119.26 126.14 3cx5 h ALA 128 Ca 0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3cx5 h ALA 128 Cb -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3cx5 h ALA 128 CO -0.02 0.50 -0.04 0.35 0.00 0.00 0.00 179.25 180.05 3cx5 h PHE 129 N 0.76 -0.09 -0.65 0.00 3.57 -0.82 -1.36 116.94 118.35 3cx5 h PHE 129 Ca 0.17 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.71 3cx5 h PHE 129 Cb 0.24 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 3cx5 h PHE 129 CO 0.01 -0.00 0.39 -0.07 -2.23 0.00 0.00 178.31 176.41 3cx5 h LEU 130 N -0.16 0.62 -0.68 0.59 3.38 -0.91 -1.80 115.31 116.36 3cx5 h LEU 130 Ca -0.01 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3cx5 h LEU 130 Cb 0.13 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3cx5 h LEU 130 CO 0.02 0.43 0.32 1.23 0.09 0.00 0.00 178.44 180.52 3cx5 h GLY 131 N 0.76 1.06 1.37 0.83 0.00 -0.98 -2.57 103.07 103.55 3cx5 h GLY 131 Ca 0.27 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 3cx5 h GLY 131 CO -0.12 0.51 0.24 -1.82 0.00 0.00 0.00 176.54 175.35 3cx5 h TYR 132 N 0.95 0.81 -0.33 5.60 3.20 -0.73 -1.79 116.97 124.68 3cx5 h TYR 132 Ca 0.23 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 3cx5 h TYR 132 Cb 0.14 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 3cx5 h TYR 132 CO 0.01 0.62 0.08 0.00 -1.64 0.00 0.00 178.16 177.22 3cx5 h VAL 135 N 0.00 1.20 -5.89 0.00 2.07 -1.63 -3.42 116.25 108.59 3cx5 h VAL 135 Ca 0.01 -0.90 -0.40 0.00 0.82 0.00 0.00 66.70 66.23 3cx5 h VAL 135 Cb 0.04 1.24 0.12 0.00 -1.52 0.00 0.00 31.29 31.16 3cx5 h VAL 135 CO -0.00 0.28 -0.72 0.00 0.02 0.00 0.00 177.57 177.16 3cx5 n TYR 136 N -4.23 -2.63 -2.28 1.57 9.36 -0.77 -2.94 117.16 115.25 3cx5 n TYR 136 Ca -0.00 0.98 -0.07 0.00 3.32 0.00 0.00 57.90 62.12 3cx5 n TYR 136 Cb 0.30 -4.88 0.04 0.00 -0.63 0.00 0.00 39.34 34.17 3cx5 n TYR 136 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3cx5 n GLY 137 N -1.78 0.58 0.27 2.98 0.00 -1.26 -1.27 105.19 104.71 3cx5 n GLY 137 Ca -0.06 -1.96 -0.06 0.00 0.00 0.00 0.00 46.02 43.94 3cx5 n GLY 137 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3cx5 h GLN 138 N 0.00 0.92 -0.11 1.61 1.08 -0.30 -2.16 115.11 116.14 3cx5 h GLN 138 Ca -0.11 -0.11 -0.07 0.00 -1.45 0.00 0.00 58.65 56.91 3cx5 h GLN 138 Cb 0.38 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 3cx5 h GLN 138 CO 0.11 0.70 -0.24 0.52 -0.95 0.00 0.00 178.83 178.98 3cx5 h MET 139 N 0.90 0.19 0.15 1.46 2.86 -1.86 -2.53 114.93 116.09 3cx5 h MET 139 Ca 0.23 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 3cx5 h MET 139 Cb 0.06 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.70 3cx5 h MET 139 CO -0.04 0.43 -0.07 0.77 1.06 0.00 0.00 176.91 179.06 3cx5 h SER 140 N 0.18 -0.17 -0.32 1.22 0.02 -1.69 0.75 113.55 113.54 3cx5 h SER 140 Ca 0.03 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3cx5 h SER 140 Cb 0.52 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 3cx5 h SER 140 CO 0.04 0.10 0.19 -0.74 -1.14 0.00 0.00 176.83 175.28 3cx5 h HIS 141 N -0.44 0.42 -0.04 3.45 6.17 -1.32 -0.56 115.15 122.82 3cx5 h HIS 141 Ca -0.02 -0.00 -0.16 0.00 0.71 0.00 0.00 60.37 60.90 3cx5 h HIS 141 Cb 0.35 -0.14 -0.01 0.00 2.52 0.00 0.00 27.41 30.13 3cx5 h HIS 141 CO 0.01 0.31 -0.68 -1.49 0.71 0.00 0.00 177.93 176.79 3cx5 h TRP 142 N 0.41 0.25 -0.45 5.26 4.06 -1.48 -1.07 115.95 122.93 3cx5 h TRP 142 Ca 0.11 -0.11 -0.11 0.00 2.06 0.00 0.00 58.89 60.85 3cx5 h TRP 142 Cb 0.01 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.12 3cx5 h TRP 142 CO -0.04 0.81 -0.13 0.78 -3.56 0.00 0.00 178.44 176.29 3cx5 h GLY 143 N 1.64 0.95 0.99 1.49 0.00 -0.72 -0.39 103.07 107.04 3cx5 h GLY 143 Ca -0.01 -0.80 -0.02 0.00 0.00 0.00 0.00 47.33 46.49 3cx5 h GLY 143 CO 0.10 0.73 0.30 0.00 0.00 0.00 0.00 176.54 177.67 3cx5 h ALA 144 N 0.86 0.77 0.27 3.60 0.00 -0.93 -0.04 119.26 123.79 3cx5 h ALA 144 Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3cx5 h ALA 144 Cb 0.68 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3cx5 h ALA 144 CO 0.05 0.32 -0.13 1.15 0.00 0.00 0.00 179.25 180.64 3cx5 h THR 145 N 0.81 0.77 -0.14 0.00 2.02 -0.96 -1.64 112.91 113.77 3cx5 h THR 145 Ca 0.21 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 3cx5 h THR 145 Cb 0.09 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 3cx5 h THR 145 CO -0.03 0.05 0.06 0.58 0.37 0.00 0.00 175.52 176.55 3cx5 h VAL 146 N -0.47 1.14 -0.39 3.16 2.07 -0.97 -2.08 116.25 118.72 3cx5 h VAL 146 Ca -0.04 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 3cx5 h VAL 146 Cb 0.35 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3cx5 h VAL 146 CO 0.06 0.13 0.17 0.40 0.02 0.00 0.00 177.57 178.36 3cx5 h ILE 147 N 0.07 1.18 -0.50 4.57 1.08 -1.02 -2.45 117.51 120.44 3cx5 h ILE 147 Ca 0.05 -0.54 -0.06 0.00 -0.39 0.00 0.00 64.86 63.91 3cx5 h ILE 147 Cb 0.16 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 34.70 3cx5 h ILE 147 CO -0.00 0.20 0.06 0.71 -0.69 0.00 0.00 178.15 178.43 3cx5 h THR 148 N 0.49 1.23 0.00 -0.27 1.35 -1.32 -2.36 112.91 112.02 3cx5 h THR 148 Ca 0.13 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 3cx5 h THR 148 Cb 0.15 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 67.35 3cx5 h THR 148 CO -0.01 0.32 0.00 0.78 -0.25 0.00 0.00 175.52 176.36 3cx5 h ASN 149 N 0.76 0.00 -0.70 5.36 2.35 -0.98 -2.63 115.58 119.75 3cx5 h ASN 149 Ca 0.16 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 56.02 3cx5 h ASN 149 Cb 0.37 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.69 3cx5 h ASN 149 CO 0.01 0.00 0.46 -0.07 -1.65 0.00 0.00 177.43 176.18 3cx5 h LEU 150 N 0.00 0.44 -0.29 1.61 4.07 -0.97 -0.50 115.31 119.67 3cx5 h LEU 150 Ca 0.00 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3cx5 h LEU 150 Cb 0.23 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.90 3cx5 h LEU 150 CO 0.00 0.25 0.00 0.49 -1.08 0.00 0.00 178.44 178.10 3cx5 n PHE 151 N -4.48 0.86 0.53 1.13 3.72 -0.99 -2.86 117.46 115.37 3cx5 n PHE 151 Ca 0.12 0.29 0.07 0.00 -0.05 0.00 0.00 57.45 57.87 3cx5 n PHE 151 Cb 0.42 -0.96 0.31 0.00 -0.94 0.00 0.00 39.48 38.30 3cx5 n PHE 151 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3cx5 n SER 152 N -2.23 0.00 0.18 4.37 3.41 -0.20 -1.86 113.62 117.28 3cx5 n SER 152 Ca 0.04 0.36 0.12 0.00 -0.26 0.00 0.00 58.87 59.14 3cx5 n SER 152 Cb 0.34 -0.43 0.24 0.00 -0.26 0.00 0.00 64.21 64.11 3cx5 n SER 152 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cx5 h ALA 153 N 2.53 0.98 -2.30 7.33 0.00 -1.67 -3.40 119.26 122.74 3cx5 h ALA 153 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 3cx5 h ALA 153 Cb 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3cx5 h ALA 153 CO 0.00 0.00 1.08 0.42 0.00 0.00 0.00 179.25 180.75 3cx5 s ILE 154 N -3.18 3.48 0.44 0.00 1.01 -0.78 -4.91 121.20 117.26 3cx5 s ILE 154 Ca 0.08 0.64 -0.26 0.00 0.00 0.00 0.00 60.65 61.11 3cx5 s ILE 154 Cb 0.08 -3.41 -0.09 0.00 0.01 0.00 0.00 42.46 39.05 3cx5 s ILE 154 CO 0.65 -0.05 1.45 -0.81 0.00 0.00 0.00 174.94 176.19 3cx5 n PRO 155 N 6.91 2.35 0.00 2.79 -0.04 -1.26 -0.85 135.00 144.91 3cx5 n PRO 155 Ca 0.17 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.47 3cx5 n PRO 155 Cb 0.42 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 3cx5 n PRO 155 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3cx5 n PHE 156 N -0.09 0.00 0.89 0.54 3.01 -1.26 -4.21 117.46 116.33 3cx5 n PHE 156 Ca 0.04 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.62 3cx5 n PHE 156 Cb 0.41 0.00 0.11 0.00 -0.01 0.00 0.00 39.48 39.99 3cx5 n PHE 156 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 3cx5 n VAL 157 N 0.00 0.06 -0.06 -4.37 0.24 -1.26 -4.67 118.33 108.27 3cx5 n VAL 157 Ca 0.00 -0.53 -0.07 0.00 -2.04 0.00 0.00 64.34 61.70 3cx5 n VAL 157 Cb 0.00 1.43 -0.01 0.00 -1.47 0.00 0.00 33.84 33.79 3cx5 n VAL 157 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3cx5 h GLY 158 N 4.53 -0.04 1.43 7.63 0.00 -1.16 -1.59 103.07 113.87 3cx5 h GLY 158 Ca 0.00 0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.53 3cx5 h GLY 158 CO 0.00 -0.18 0.13 3.43 0.00 0.00 0.00 176.54 179.92 3cx5 h ASN 159 N -0.18 0.67 -0.61 0.19 2.35 -1.81 -2.19 115.58 114.00 3cx5 h ASN 159 Ca 0.15 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.69 3cx5 h ASN 159 Cb 0.40 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 3cx5 h ASN 159 CO -0.37 0.65 -0.01 0.44 -1.65 0.00 0.00 177.43 176.49 3cx5 h ASP 160 N 0.71 1.06 -0.79 5.81 3.45 -1.77 -1.43 116.42 123.46 3cx5 h ASP 160 Ca 0.16 -0.31 -0.04 0.00 0.43 0.00 0.00 57.03 57.27 3cx5 h ASP 160 Cb 0.24 -0.29 -0.04 0.00 -0.56 0.00 0.00 39.33 38.69 3cx5 h ASP 160 CO -0.01 1.12 0.35 0.40 -1.57 0.00 0.00 179.24 179.53 3cx5 h ILE 161 N 0.98 1.25 -0.44 0.35 2.04 -0.99 -1.28 117.51 119.42 3cx5 h ILE 161 Ca 0.17 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 3cx5 h ILE 161 Cb 0.58 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 3cx5 h ILE 161 CO 0.03 0.31 0.07 0.58 0.00 0.00 0.00 178.15 179.15 3cx5 h VAL 162 N 1.12 1.25 -0.29 1.67 2.07 -1.06 -0.36 116.25 120.65 3cx5 h VAL 162 Ca 0.27 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 3cx5 h VAL 162 Cb 0.16 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3cx5 h VAL 162 CO -0.03 0.31 -0.00 0.28 0.02 0.00 0.00 177.57 178.15 3cx5 h SER 163 N 0.59 0.41 -0.20 0.57 0.02 -1.02 -0.58 113.55 113.34 3cx5 h SER 163 Ca 0.13 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 3cx5 h SER 163 Cb 0.39 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.81 3cx5 h SER 163 CO 0.01 0.48 -0.14 -0.25 -1.14 0.00 0.00 176.83 175.79 3cx5 h TRP 164 N 0.43 0.52 -0.85 3.45 7.01 -0.91 -0.72 115.95 124.88 3cx5 h TRP 164 Ca 0.10 -0.14 -0.01 0.00 2.11 0.00 0.00 58.89 60.94 3cx5 h TRP 164 Cb 0.29 -0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.19 3cx5 h TRP 164 CO 0.01 0.76 0.48 -0.07 -2.79 0.00 0.00 178.44 176.83 3cx5 h LEU 165 N 0.12 1.06 -0.51 0.65 3.38 -0.54 -2.93 115.31 116.53 3cx5 h LEU 165 Ca 0.04 -0.09 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 3cx5 h LEU 165 Cb 0.65 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3cx5 h LEU 165 CO 0.04 0.84 -0.56 -0.50 0.09 0.00 0.00 178.44 178.35 3cx5 h TRP 166 N 1.19 0.68 -0.46 1.13 6.55 -1.04 -3.44 115.95 120.56 3cx5 h TRP 166 Ca 0.30 -0.25 -0.10 0.00 0.95 0.00 0.00 58.89 59.79 3cx5 h TRP 166 Cb 0.01 -0.13 -0.03 0.00 -0.86 0.00 0.00 29.16 28.16 3cx5 h TRP 166 CO 0.00 0.98 -0.11 0.41 -1.05 0.00 0.00 178.44 178.67 3cx5 n GLY 167 N 0.27 0.51 0.00 1.49 0.00 -0.28 -2.80 105.19 104.38 3cx5 n GLY 167 Ca -0.03 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3cx5 n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cx5 n GLY 168 N -1.78 -0.61 0.03 -0.02 0.00 -1.19 -4.83 105.19 96.79 3cx5 n GLY 168 Ca -0.06 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.50 3cx5 n GLY 168 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3cx5 n PHE 169 N 1.86 0.25 -3.90 1.61 3.72 -1.26 -4.74 117.46 114.99 3cx5 n PHE 169 Ca 0.00 0.07 -0.03 0.00 -0.05 0.00 0.00 57.45 57.45 3cx5 n PHE 169 Cb 0.00 -0.52 0.02 0.00 -0.94 0.00 0.00 39.48 38.04 3cx5 n PHE 169 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3cx5 s SER 170 N -3.47 0.01 -0.23 4.37 1.04 -1.26 -5.09 113.70 109.07 3cx5 s SER 170 Ca 0.11 -0.65 -0.29 0.00 0.48 0.00 0.00 55.95 55.60 3cx5 s SER 170 Cb 0.16 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 3cx5 s SER 170 CO 0.63 -0.94 1.93 -0.69 0.98 0.00 0.00 173.24 175.15 3cx5 s VAL 171 N -2.10 3.31 0.00 5.02 1.01 -1.26 -4.82 120.40 121.57 3cx5 s VAL 171 Ca 0.23 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.54 3cx5 s VAL 171 Cb -0.03 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.98 3cx5 s VAL 171 CO 0.05 -0.21 0.00 -1.54 0.00 0.00 0.00 175.10 173.40 3cx5 n SER 172 N 10.14 0.00 -0.16 3.32 3.41 -1.26 -5.01 113.62 124.06 3cx5 n SER 172 Ca 0.24 -0.28 -0.03 0.00 -0.26 0.00 0.00 58.87 58.54 3cx5 n SER 172 Cb 0.45 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.44 3cx5 n SER 172 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 3cx5 h ASN 173 N 0.00 -0.51 -0.81 4.04 -0.73 -1.92 -1.60 115.58 114.05 3cx5 h ASN 173 Ca 0.00 0.16 0.07 0.00 1.87 0.00 0.00 56.30 58.40 3cx5 h ASN 173 Cb 0.00 0.33 -0.05 0.00 0.27 0.00 0.00 38.32 38.86 3cx5 h ASN 173 CO 0.00 -0.18 0.53 -0.65 -0.37 0.00 0.00 177.43 176.76 3cx5 h PRO 174 N -0.01 0.84 -0.09 6.67 0.11 -1.88 -1.64 132.00 136.00 3cx5 h PRO 174 Ca 0.24 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 3cx5 h PRO 174 Cb 0.38 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 3cx5 h PRO 174 CO -0.53 0.56 0.01 1.15 -0.21 0.00 0.00 178.00 178.98 3cx5 h THR 175 N 0.87 1.22 -0.53 -1.15 2.02 -1.13 -1.83 112.91 112.37 3cx5 h THR 175 Ca 0.36 -0.69 -0.07 0.00 0.77 0.00 0.00 66.41 66.78 3cx5 h THR 175 Cb 0.27 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 3cx5 h THR 175 CO -0.13 0.19 0.05 0.40 0.37 0.00 0.00 175.52 176.40 3cx5 h ILE 176 N -0.10 1.26 -0.45 3.11 1.08 -1.07 -0.31 117.51 121.03 3cx5 h ILE 176 Ca 0.03 -1.02 -0.08 0.00 -0.39 0.00 0.00 64.86 63.40 3cx5 h ILE 176 Cb 0.29 0.89 -0.02 0.00 -3.07 0.00 0.00 36.82 34.91 3cx5 h ILE 176 CO 0.00 0.37 -0.04 1.56 -0.69 0.00 0.00 178.15 179.35 3cx5 h GLN 177 N 0.78 0.77 0.01 2.37 4.20 -1.31 -1.24 115.11 120.68 3cx5 h GLN 177 Ca 0.16 -0.22 -0.20 0.00 0.06 0.00 0.00 58.65 58.44 3cx5 h GLN 177 Cb 0.46 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 3cx5 h GLN 177 CO 0.02 0.80 -0.90 0.07 -0.67 0.00 0.00 178.83 178.15 3cx5 h ARG 178 N 0.71 0.23 -0.73 1.46 0.11 -1.21 -2.69 114.38 112.26 3cx5 h ARG 178 Ca 0.13 -0.25 -0.06 0.00 0.10 0.00 0.00 59.98 59.90 3cx5 h ARG 178 Cb 0.49 0.07 -0.03 0.00 1.11 0.00 0.00 29.97 31.61 3cx5 h ARG 178 CO 0.02 0.98 0.20 0.74 0.10 0.00 0.00 179.97 182.02 3cx5 h PHE 179 N 0.12 1.20 -0.50 4.08 -1.00 -0.59 -0.55 116.94 119.70 3cx5 h PHE 179 Ca -0.05 -0.13 -0.06 0.00 2.81 0.00 0.00 57.97 60.54 3cx5 h PHE 179 Cb 1.53 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 40.73 3cx5 h PHE 179 CO 0.03 0.96 0.07 0.35 -1.61 0.00 0.00 178.31 178.12 3cx5 h PHE 180 N 1.10 0.90 -0.70 -0.55 3.04 -1.22 0.29 116.94 119.80 3cx5 h PHE 180 Ca 0.23 -0.13 0.01 0.00 3.98 0.00 0.00 57.97 62.06 3cx5 h PHE 180 Cb 0.34 -0.24 -0.03 0.00 2.56 0.00 0.00 35.95 38.57 3cx5 h PHE 180 CO 0.03 0.82 0.46 0.00 -2.02 0.00 0.00 178.31 177.60 3cx5 h ALA 181 N 0.97 0.89 -0.08 2.41 0.00 -1.13 -1.88 119.26 120.44 3cx5 h ALA 181 Ca 0.15 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 3cx5 h ALA 181 Cb 0.41 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3cx5 h ALA 181 CO 0.01 0.32 -0.60 -0.07 0.00 0.00 0.00 179.25 178.91 3cx5 h LEU 182 N 0.95 0.31 -1.42 0.00 4.07 -0.87 -2.66 115.31 115.69 3cx5 h LEU 182 Ca 0.26 -0.17 -0.05 0.00 0.08 0.00 0.00 57.88 58.00 3cx5 h LEU 182 Cb -0.10 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.54 3cx5 h LEU 182 CO -0.05 0.83 -0.12 -0.74 -1.08 0.00 0.00 178.44 177.28 3cx5 h HIS 183 N 0.20 0.24 -0.17 1.13 2.76 0.15 -1.73 115.15 117.73 3cx5 h HIS 183 Ca -0.01 -0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 57.98 3cx5 h HIS 183 Cb 1.11 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 30.00 3cx5 h HIS 183 CO 0.02 0.36 -0.52 -0.92 -1.30 0.00 0.00 177.93 175.57 3cx5 h TYR 184 N 0.22 0.86 0.33 5.26 -0.00 -1.16 -3.38 116.97 119.10 3cx5 h TYR 184 Ca 0.05 -0.34 -0.02 0.00 -0.00 0.00 0.00 58.73 58.42 3cx5 h TYR 184 Cb 0.36 -0.15 0.00 0.00 -0.00 0.00 0.00 36.73 36.94 3cx5 h TYR 184 CO 0.01 1.13 -0.16 1.25 -0.00 0.00 0.00 178.16 180.39 3cx5 h LEU 185 N 0.34 -0.37 -1.10 2.82 6.46 -1.10 -3.36 115.31 119.01 3cx5 h LEU 185 Ca -0.02 -0.17 0.22 0.00 -0.12 0.00 0.00 57.88 57.79 3cx5 h LEU 185 Cb 1.15 0.10 -0.11 0.00 -0.73 0.00 0.00 40.66 41.06 3cx5 h LEU 185 CO 0.11 0.02 0.62 0.58 -0.62 0.00 0.00 178.44 179.15 3cx5 h VAL 186 N -0.82 0.62 -0.39 1.05 2.07 -1.50 -0.28 116.25 117.00 3cx5 h VAL 186 Ca -0.04 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.33 3cx5 h VAL 186 Cb 0.52 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 3cx5 h VAL 186 CO 0.07 0.11 0.27 -0.65 0.02 0.00 0.00 177.57 177.39 3cx5 h PRO 187 N 0.62 0.21 -0.00 1.57 0.11 -1.74 0.22 132.00 133.00 3cx5 h PRO 187 Ca 0.60 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 66.52 3cx5 h PRO 187 Cb 1.13 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3cx5 h PRO 187 CO -0.39 0.14 -0.80 0.74 -0.21 0.00 0.00 178.00 177.48 3cx5 h PHE 188 N 0.22 0.13 -0.27 0.65 -1.00 -1.24 -1.42 116.94 114.01 3cx5 h PHE 188 Ca 0.18 -0.07 -0.16 0.00 2.81 0.00 0.00 57.97 60.73 3cx5 h PHE 188 Cb 0.42 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 3cx5 h PHE 188 CO -0.00 0.85 -0.47 0.82 -1.61 0.00 0.00 178.31 177.90 3cx5 h ILE 189 N 0.05 1.29 -0.45 -0.55 2.04 -0.85 -1.82 117.51 117.23 3cx5 h ILE 189 Ca -0.02 -1.67 -0.01 0.00 1.00 0.00 0.00 64.86 64.15 3cx5 h ILE 189 Cb 1.41 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.06 3cx5 h ILE 189 CO 0.11 0.54 0.23 0.40 0.00 0.00 0.00 178.15 179.43 3cx5 h ILE 190 N 0.56 1.18 -0.61 -0.67 2.04 -0.50 0.11 117.51 119.62 3cx5 h ILE 190 Ca 0.03 -0.49 0.07 0.00 1.00 0.00 0.00 64.86 65.47 3cx5 h ILE 190 Cb 1.03 0.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.72 3cx5 h ILE 190 CO 0.10 0.19 0.30 0.00 0.00 0.00 0.00 178.15 178.74 3cx5 h ALA 191 N 1.07 0.80 -0.80 1.87 0.00 -1.03 0.20 119.26 121.37 3cx5 h ALA 191 Ca 0.16 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3cx5 h ALA 191 Cb 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3cx5 h ALA 191 CO -0.02 -0.06 0.37 0.00 0.00 0.00 0.00 179.25 179.54 3cx5 h ALA 192 N 1.35 1.03 0.00 0.00 0.00 -0.79 -1.89 119.26 118.96 3cx5 h ALA 192 Ca 0.28 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3cx5 h ALA 192 Cb 0.23 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3cx5 h ALA 192 CO -0.21 0.61 -0.37 0.52 0.00 0.00 0.00 179.25 179.80 3cx5 h MET 193 N 1.14 0.00 -0.18 0.00 2.07 0.17 -2.05 114.93 116.08 3cx5 h MET 193 Ca 0.27 0.00 -0.16 0.00 -2.07 0.00 0.00 59.70 57.75 3cx5 h MET 193 Cb 0.14 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.87 3cx5 h MET 193 CO -0.03 0.37 -0.53 0.28 1.07 0.00 0.00 176.91 178.07 3cx5 h VAL 194 N 0.00 1.32 -0.41 -2.22 2.07 -0.05 0.74 116.25 117.71 3cx5 h VAL 194 Ca -0.00 -1.78 -0.03 0.00 0.82 0.00 0.00 66.70 65.70 3cx5 h VAL 194 Cb 0.70 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 3cx5 h VAL 194 CO 0.05 0.55 0.12 0.40 0.02 0.00 0.00 177.57 178.71 3cx5 h ILE 195 N 0.41 1.22 -0.52 4.57 2.04 -0.91 0.24 117.51 124.56 3cx5 h ILE 195 Ca 0.01 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 3cx5 h ILE 195 Cb 1.07 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 3cx5 h ILE 195 CO 0.10 0.26 0.16 0.24 0.00 0.00 0.00 178.15 178.91 3cx5 h MET 196 N 0.52 0.77 -0.08 2.37 2.86 -1.09 -0.41 114.93 119.87 3cx5 h MET 196 Ca 0.13 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3cx5 h MET 196 Cb 0.27 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 3cx5 h MET 196 CO -0.00 0.67 0.03 1.25 1.06 0.00 0.00 176.91 179.92 3cx5 h HIS 197 N 0.75 0.13 -0.42 -0.22 6.17 -0.17 -2.11 115.15 119.28 3cx5 h HIS 197 Ca 0.17 -0.01 -0.04 0.00 0.71 0.00 0.00 60.37 61.21 3cx5 h HIS 197 Cb 0.22 -0.04 -0.02 0.00 2.52 0.00 0.00 27.41 30.09 3cx5 h HIS 197 CO 0.01 0.25 0.10 -0.07 0.71 0.00 0.00 177.93 178.93 3cx5 h LEU 198 N -0.03 0.58 -0.54 0.26 3.38 -0.16 -1.64 115.31 117.16 3cx5 h LEU 198 Ca 0.03 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 3cx5 h LEU 198 Cb 0.18 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3cx5 h LEU 198 CO -0.00 0.58 0.16 0.24 0.09 0.00 0.00 178.44 179.51 3cx5 h MET 199 N 0.61 0.83 -0.52 1.13 2.86 -0.84 -0.19 114.93 118.82 3cx5 h MET 199 Ca 0.14 -0.18 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 3cx5 h MET 199 Cb 0.24 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 3cx5 h MET 199 CO -0.00 0.77 -0.05 0.00 1.06 0.00 0.00 176.91 178.68 3cx5 h ALA 200 N 1.03 0.94 -0.37 6.32 0.00 -0.98 -3.03 119.26 123.16 3cx5 h ALA 200 Ca 0.17 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3cx5 h ALA 200 Cb 0.28 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3cx5 h ALA 200 CO -0.00 0.63 0.08 1.25 0.00 0.00 0.00 179.25 181.21 3cx5 h LEU 201 N 0.83 0.58 -1.59 0.00 5.85 -1.06 -3.25 115.31 116.67 3cx5 h LEU 201 Ca 0.15 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.65 3cx5 h LEU 201 Cb 0.56 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 3cx5 h LEU 201 CO 0.03 0.67 0.32 -0.74 -0.34 0.00 0.00 178.44 178.38 3cx5 h HIS 202 N 0.46 0.51 0.00 1.25 2.76 -0.91 0.40 115.15 119.62 3cx5 h HIS 202 Ca 0.12 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.27 3cx5 h HIS 202 Cb 0.32 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 29.11 3cx5 h HIS 202 CO 0.02 0.30 -0.11 -0.84 -1.30 0.00 0.00 177.93 176.00 3cx5 h ILE 203 N 0.53 0.26 0.00 6.26 3.07 -1.57 -3.28 117.51 122.78 3cx5 h ILE 203 Ca 0.19 -0.91 0.00 0.00 1.55 0.00 0.00 64.86 65.69 3cx5 h ILE 203 Cb 0.10 1.73 0.00 0.00 -0.27 0.00 0.00 36.82 38.38 3cx5 h ILE 203 CO -0.05 0.11 -0.62 1.41 -1.05 0.00 0.00 178.15 177.95 3cx5 n HIS 204 N -3.22 0.00 -0.23 0.16 8.25 -1.08 -5.13 115.22 113.97 3cx5 n HIS 204 Ca 0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.50 3cx5 n HIS 204 Cb 0.41 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 31.49 3cx5 n HIS 204 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3cx5 n GLY 205 N 1.82 -1.65 3.81 -1.41 0.00 0.14 -4.91 105.19 102.99 3cx5 n GLY 205 Ca -0.00 -1.46 -0.32 0.00 0.00 0.00 0.00 46.02 44.24 3cx5 n GLY 205 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cx5 s SER 206 N -3.85 5.84 0.55 1.61 0.01 -1.26 -4.88 113.70 111.73 3cx5 s SER 206 Ca 0.00 1.73 0.00 0.00 1.31 0.00 0.00 55.95 58.99 3cx5 s SER 206 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 3cx5 s SER 206 CO 0.00 -1.12 0.00 -0.24 0.41 0.00 0.00 173.24 172.29 3cx5 n SER 207 N -2.20 0.00 -4.07 2.44 2.88 -1.26 -4.82 113.62 106.59 3cx5 n SER 207 Ca 0.08 -0.80 -0.10 0.00 -1.33 0.00 0.00 58.87 56.72 3cx5 n SER 207 Cb 0.53 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.92 3cx5 n SER 207 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3cx5 s ASN 208 N -1.00 0.02 0.49 -3.46 4.22 -1.26 -4.84 114.94 109.10 3cx5 s ASN 208 Ca 0.00 -1.10 0.33 0.00 -2.14 0.00 0.00 52.86 49.95 3cx5 s ASN 208 Cb 0.00 0.49 1.63 0.00 1.28 0.00 0.00 41.25 44.64 3cx5 s ASN 208 CO 0.00 -0.99 2.00 1.55 -2.04 0.00 0.00 177.10 177.61 3cx5 h PRO 209 N 2.43 0.00 0.00 3.55 0.13 -1.96 -2.31 132.00 133.84 3cx5 h PRO 209 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3cx5 h PRO 209 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3cx5 h PRO 209 CO 0.44 0.00 -0.37 -0.07 -0.23 0.00 0.00 178.00 177.77 3cx5 h LEU 210 N 0.00 0.00 0.00 1.56 3.38 -1.93 -3.43 115.31 114.89 3cx5 h LEU 210 Ca 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3cx5 h LEU 210 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3cx5 h LEU 210 CO 0.00 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.19 3cx5 n GLY 211 N 1.30 0.47 3.60 0.83 0.00 -0.87 -4.91 105.19 105.60 3cx5 n GLY 211 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 3cx5 n GLY 211 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3cx5 n ILE 212 N -2.51 0.00 -1.78 -0.61 -5.35 -1.26 -4.25 119.36 103.60 3cx5 n ILE 212 Ca 0.00 -2.04 -0.41 0.00 -0.27 0.00 0.00 62.75 60.02 3cx5 n ILE 212 Cb 0.10 -0.08 -0.01 0.00 -1.74 0.00 0.00 39.64 37.91 3cx5 n ILE 212 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 3cx5 s THR 213 N -2.57 2.05 -2.16 7.28 -1.32 -1.26 -4.69 115.64 112.97 3cx5 s THR 213 Ca 0.31 0.04 0.21 0.00 -1.21 0.00 0.00 61.69 61.05 3cx5 s THR 213 Cb -0.02 -3.03 0.42 0.00 -1.51 0.00 0.00 72.50 68.36 3cx5 s THR 213 CO 0.20 0.01 1.36 0.61 -2.21 0.00 0.00 174.62 174.59 3cx5 n GLY 214 N 1.51 1.81 0.29 6.08 0.00 -1.26 -4.58 105.19 109.04 3cx5 n GLY 214 Ca 0.05 -0.68 0.18 0.00 0.00 0.00 0.00 46.02 45.58 3cx5 n GLY 214 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3cx5 h ASN 215 N 4.03 0.00 1.05 1.61 2.35 -1.99 -3.10 115.58 119.54 3cx5 h ASN 215 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3cx5 h ASN 215 Cb 0.93 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.30 3cx5 h ASN 215 CO 0.00 0.02 -0.34 0.18 -1.65 0.00 0.00 177.43 175.63 3cx5 n LEU 216 N -3.14 0.66 -3.19 1.61 4.32 -1.26 -4.67 117.00 111.33 3cx5 n LEU 216 Ca -0.01 0.35 -0.11 0.00 -0.02 0.00 0.00 56.01 56.22 3cx5 n LEU 216 Cb 0.24 -0.26 -0.04 0.00 -1.62 0.00 0.00 43.42 41.73 3cx5 n LEU 216 CO 0.26 -0.08 -0.05 -0.62 -1.22 0.00 0.00 177.39 175.68 3cx5 s ASP 217 N -4.10 -0.07 0.20 -1.43 2.15 -1.17 -5.15 116.67 107.10 3cx5 s ASP 217 Ca 0.09 -1.64 0.06 0.00 0.43 0.00 0.00 52.55 51.49 3cx5 s ASP 217 Cb 0.14 1.08 -0.04 0.00 -0.30 0.00 0.00 42.92 43.80 3cx5 s ASP 217 CO 0.66 -0.17 0.13 -0.13 -0.17 0.00 0.00 175.17 175.49 3cx5 s ARG 218 N 1.20 2.82 0.02 4.34 1.81 -1.26 -2.42 118.95 125.46 3cx5 s ARG 218 Ca 0.22 -0.99 0.02 0.00 -1.72 0.00 0.00 55.73 53.26 3cx5 s ARG 218 Cb -0.06 -2.56 -0.01 0.00 -0.45 0.00 0.00 34.95 31.86 3cx5 s ARG 218 CO -0.06 0.45 -0.06 0.96 -0.68 0.00 0.00 175.30 175.90 3cx5 s ILE 219 N -1.91 0.41 0.49 1.52 -4.36 -0.07 -4.88 121.20 112.40 3cx5 s ILE 219 Ca 0.31 -0.64 -0.24 0.00 -0.26 0.00 0.00 60.65 59.82 3cx5 s ILE 219 Cb -0.09 -0.43 -0.07 0.00 1.25 0.00 0.00 42.46 43.13 3cx5 s ILE 219 CO 0.23 -0.17 1.38 -2.84 0.24 0.00 0.00 174.94 173.79 3cx5 s PRO 220 N -0.87 3.46 0.18 0.37 0.02 -1.26 -0.31 135.00 136.58 3cx5 s PRO 220 Ca -0.05 2.31 -0.13 0.00 0.02 0.00 0.00 61.00 63.14 3cx5 s PRO 220 Cb -0.06 -2.48 0.08 0.00 0.02 0.00 0.00 34.50 32.06 3cx5 s PRO 220 CO 0.00 -0.96 1.81 1.98 -0.33 0.00 0.00 177.00 179.50 3cx5 h MET 221 N 1.95 0.77 -6.46 5.54 1.85 -1.19 -3.38 114.93 114.01 3cx5 h MET 221 Ca -0.51 -0.07 -0.54 0.00 -0.61 0.00 0.00 59.70 57.98 3cx5 h MET 221 Cb 1.28 -0.16 0.01 0.00 0.43 0.00 0.00 31.60 33.16 3cx5 h MET 221 CO 0.59 0.56 0.83 -1.58 -0.40 0.00 0.00 176.91 176.91 3cx5 s HIS 222 N -5.98 2.92 0.00 1.39 5.65 -0.17 -1.28 115.29 117.82 3cx5 s HIS 222 Ca -0.13 0.77 0.00 0.00 0.25 0.00 0.00 55.06 55.95 3cx5 s HIS 222 Cb 0.13 -3.74 0.00 0.00 -1.18 0.00 0.00 32.58 27.79 3cx5 s HIS 222 CO 0.76 -2.73 0.00 0.43 -0.65 0.00 0.00 174.74 172.55 3cx5 n SER 223 N 4.84 0.00 -0.03 9.88 7.64 -1.26 -4.80 113.62 129.88 3cx5 n SER 223 Ca 0.13 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.96 3cx5 n SER 223 Cb 0.42 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.59 3cx5 n SER 223 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 3cx5 h TYR 224 N 0.00 -0.60 0.00 1.43 -1.99 -1.74 0.22 116.97 114.30 3cx5 h TYR 224 Ca 0.00 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 3cx5 h TYR 224 Cb 0.00 0.28 -0.00 0.00 2.00 0.00 0.00 36.73 39.00 3cx5 h TYR 224 CO 0.00 -0.18 -0.51 0.74 -0.00 0.00 0.00 178.16 178.20 3cx5 h PHE 225 N -0.17 0.00 -0.38 4.88 -1.00 -1.38 -2.13 116.94 116.76 3cx5 h PHE 225 Ca 0.02 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.73 3cx5 h PHE 225 Cb 0.22 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.77 3cx5 h PHE 225 CO -0.59 0.08 -0.04 0.82 -1.61 0.00 0.00 178.31 176.97 3cx5 h ILE 226 N 0.00 1.27 0.00 -0.55 1.08 -1.16 0.34 117.51 118.49 3cx5 h ILE 226 Ca -0.01 -1.08 -0.12 0.00 -0.39 0.00 0.00 64.86 63.26 3cx5 h ILE 226 Cb 1.07 1.20 -0.02 0.00 -3.07 0.00 0.00 36.82 36.01 3cx5 h ILE 226 CO 0.01 0.36 -0.56 -0.26 -0.69 0.00 0.00 178.15 177.01 3cx5 h PHE 227 N 0.51 0.00 -0.22 1.37 -1.00 -0.59 -2.84 116.94 114.17 3cx5 h PHE 227 Ca 0.10 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.68 3cx5 h PHE 227 Cb 0.53 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.10 3cx5 h PHE 227 CO 0.04 0.56 -0.65 -0.22 -1.61 0.00 0.00 178.31 176.43 3cx5 h LYS 228 N 0.00 0.80 -0.08 1.51 3.64 -1.26 -2.96 116.57 118.22 3cx5 h LYS 228 Ca -0.01 -0.57 -0.04 0.00 -1.27 0.00 0.00 60.65 58.77 3cx5 h LYS 228 Cb 1.41 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.31 3cx5 h LYS 228 CO 0.07 1.19 -0.12 -0.44 -2.27 0.00 0.00 179.45 177.89 3cx5 h ASP 229 N 0.59 0.12 -0.32 4.20 3.32 -0.91 -2.36 116.42 121.05 3cx5 h ASP 229 Ca -0.01 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 3cx5 h ASP 229 Cb 1.26 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 3cx5 h ASP 229 CO 0.14 0.26 0.03 0.25 -1.72 0.00 0.00 179.24 178.20 3cx5 h LEU 230 N 0.12 0.61 -0.09 1.55 5.85 -1.34 -0.84 115.31 121.17 3cx5 h LEU 230 Ca 0.03 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.65 3cx5 h LEU 230 Cb 0.30 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3cx5 h LEU 230 CO 0.02 0.66 -0.05 0.58 -0.34 0.00 0.00 178.44 179.31 3cx5 h VAL 231 N 0.62 0.84 0.00 1.05 2.07 -1.37 -1.17 116.25 118.28 3cx5 h VAL 231 Ca 0.13 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.60 3cx5 h VAL 231 Cb 0.34 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 3cx5 h VAL 231 CO 0.01 0.00 -0.26 0.71 0.02 0.00 0.00 177.57 178.05 3cx5 h THR 232 N -0.05 0.50 -0.36 2.57 1.35 -1.57 -2.15 112.91 113.21 3cx5 h THR 232 Ca 0.06 -1.47 -0.07 0.00 -0.55 0.00 0.00 66.41 64.38 3cx5 h THR 232 Cb 0.13 2.05 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 3cx5 h THR 232 CO -0.13 0.26 -0.03 0.58 -0.25 0.00 0.00 175.52 175.95 3cx5 h VAL 233 N 0.00 1.27 -0.46 6.82 2.07 -0.70 -0.11 116.25 125.14 3cx5 h VAL 233 Ca -0.00 -1.05 -0.14 0.00 0.82 0.00 0.00 66.70 66.33 3cx5 h VAL 233 Cb 1.03 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 3cx5 h VAL 233 CO 0.03 0.35 -0.25 -0.26 0.02 0.00 0.00 177.57 177.47 3cx5 h PHE 234 N 0.46 1.14 -0.69 1.57 0.05 -1.15 -0.87 116.94 117.45 3cx5 h PHE 234 Ca 0.10 -0.29 -0.03 0.00 3.82 0.00 0.00 57.97 61.57 3cx5 h PHE 234 Cb 0.51 -0.26 -0.03 0.00 2.00 0.00 0.00 35.95 38.17 3cx5 h PHE 234 CO 0.04 1.12 0.31 1.25 -0.18 0.00 0.00 178.31 180.85 3cx5 h LEU 235 N 0.83 0.92 -0.21 1.54 5.85 -1.31 0.47 115.31 123.40 3cx5 h LEU 235 Ca 0.10 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 3cx5 h LEU 235 Cb 0.83 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3cx5 h LEU 235 CO 0.07 0.81 0.12 0.15 -0.34 0.00 0.00 178.44 179.25 3cx5 h PHE 236 N 0.96 0.29 -0.67 1.25 3.57 -0.84 -1.28 116.94 120.22 3cx5 h PHE 236 Ca 0.23 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 3cx5 h PHE 236 Cb 0.16 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 3cx5 h PHE 236 CO 0.01 0.25 0.23 0.52 -2.23 0.00 0.00 178.31 177.10 3cx5 h MET 237 N 0.24 1.00 0.37 1.11 2.86 -0.82 -0.36 114.93 119.33 3cx5 h MET 237 Ca 0.07 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 3cx5 h MET 237 Cb 0.06 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.56 3cx5 h MET 237 CO -0.01 0.84 -0.18 1.25 1.06 0.00 0.00 176.91 179.87 3cx5 h LEU 238 N 0.97 -0.42 -0.63 1.22 6.46 -0.66 0.77 115.31 123.02 3cx5 h LEU 238 Ca 0.22 -0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.93 3cx5 h LEU 238 Cb 0.24 0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 3cx5 h LEU 238 CO -0.01 -0.22 0.36 0.40 -0.62 0.00 0.00 178.44 178.34 3cx5 h ILE 239 N -0.59 1.19 -0.65 4.05 2.04 -1.10 -1.30 117.51 121.15 3cx5 h ILE 239 Ca -0.05 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 3cx5 h ILE 239 Cb 0.44 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 3cx5 h ILE 239 CO 0.08 0.21 0.33 0.25 0.00 0.00 0.00 178.15 179.02 3cx5 h LEU 240 N 0.86 0.84 -1.22 1.44 5.85 -0.98 -2.24 115.31 119.86 3cx5 h LEU 240 Ca 0.22 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 3cx5 h LEU 240 Cb 0.01 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 3cx5 h LEU 240 CO -0.04 0.71 0.09 0.00 -0.34 0.00 0.00 178.44 178.87 3cx5 h ALA 241 N 1.16 1.37 -0.80 1.25 0.00 -0.38 0.71 119.26 122.57 3cx5 h ALA 241 Ca 0.23 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3cx5 h ALA 241 Cb 0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3cx5 h ALA 241 CO -0.03 0.45 0.46 -0.07 0.00 0.00 0.00 179.25 180.06 3cx5 h LEU 242 N 0.62 0.98 0.01 0.00 3.38 -0.65 -0.54 115.31 119.10 3cx5 h LEU 242 Ca 0.14 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3cx5 h LEU 242 Cb 0.25 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3cx5 h LEU 242 CO -0.00 0.77 -0.00 -0.26 0.09 0.00 0.00 178.44 179.04 3cx5 h PHE 243 N 1.10 -0.01 -0.60 1.13 -1.00 -1.08 -0.86 116.94 115.62 3cx5 h PHE 243 Ca 0.28 -0.00 0.09 0.00 2.81 0.00 0.00 57.97 61.15 3cx5 h PHE 243 Cb -0.00 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 39.49 3cx5 h PHE 243 CO -0.00 0.60 0.23 0.28 -1.61 0.00 0.00 178.31 177.80 3cx5 h VAL 244 N -0.63 0.78 0.00 -0.55 2.07 -0.76 0.29 116.25 117.46 3cx5 h VAL 244 Ca -0.00 -0.14 -0.32 0.00 0.82 0.00 0.00 66.70 67.06 3cx5 h VAL 244 Cb 0.61 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 3cx5 h VAL 244 CO 0.00 0.07 -1.97 0.49 0.02 0.00 0.00 177.57 176.19 3cx5 n PHE 245 N -4.99 0.62 -0.03 1.57 3.01 -0.22 -4.24 117.46 113.18 3cx5 n PHE 245 Ca 0.08 0.23 0.01 0.00 1.01 0.00 0.00 57.45 58.78 3cx5 n PHE 245 Cb 0.26 -1.12 -0.10 0.00 -0.01 0.00 0.00 39.48 38.51 3cx5 n PHE 245 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3cx5 n TYR 246 N -2.93 0.00 -2.99 1.38 4.02 -0.34 -4.81 117.16 111.49 3cx5 n TYR 246 Ca -0.23 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.52 3cx5 n TYR 246 Cb 1.09 -0.45 0.02 0.00 -0.02 0.00 0.00 39.34 39.98 3cx5 n TYR 246 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3cx5 n SER 247 N -2.20 -0.65 0.30 7.72 2.88 -0.21 -5.00 113.62 116.46 3cx5 n SER 247 Ca -0.11 -3.28 0.20 0.00 -1.33 0.00 0.00 58.87 54.35 3cx5 n SER 247 Cb 0.61 0.52 0.95 0.00 -0.75 0.00 0.00 64.21 65.53 3cx5 n SER 247 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3cx5 h PRO 248 N 3.11 0.00 -0.18 -1.46 0.13 -0.68 -3.18 132.00 129.73 3cx5 h PRO 248 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3cx5 h PRO 248 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 3cx5 h PRO 248 CO 0.34 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.20 3cx5 n ASN 249 N -3.05 2.39 -0.09 1.44 3.02 -1.26 -4.67 115.26 113.04 3cx5 n ASN 249 Ca -0.01 -1.86 -0.02 0.00 -0.03 0.00 0.00 54.58 52.66 3cx5 n ASN 249 Cb 0.18 -0.12 0.23 0.00 -0.61 0.00 0.00 39.78 39.46 3cx5 n ASN 249 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3cx5 h THR 250 N 1.31 1.21 -0.01 3.41 2.02 -1.93 -2.65 112.91 116.27 3cx5 h THR 250 Ca 0.00 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.39 3cx5 h THR 250 Cb 0.58 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3cx5 h THR 250 CO 0.00 0.29 -0.22 0.18 0.37 0.00 0.00 175.52 176.14 3cx5 n LEU 251 N -4.28 0.73 0.00 2.58 4.77 -1.26 -4.92 117.00 114.62 3cx5 n LEU 251 Ca 0.03 -0.11 -0.11 0.00 -0.03 0.00 0.00 56.01 55.79 3cx5 n LEU 251 Cb 0.23 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.18 3cx5 n LEU 251 CO 0.40 0.14 0.19 0.61 -1.33 0.00 0.00 177.39 177.39 3cx5 n GLY 252 N 1.34 2.01 3.26 -0.72 0.00 -1.00 -4.69 105.19 105.39 3cx5 n GLY 252 Ca 0.12 -2.19 -0.33 0.00 0.00 0.00 0.00 46.02 43.63 3cx5 n GLY 252 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3cx5 s HIS 253 N -1.00 2.73 0.43 1.61 2.46 -1.26 -5.02 115.29 115.24 3cx5 s HIS 253 Ca 0.32 -1.01 0.17 0.00 0.47 0.00 0.00 55.06 55.01 3cx5 s HIS 253 Cb -0.03 -1.84 1.09 0.00 -0.13 0.00 0.00 32.58 31.68 3cx5 s HIS 253 CO 0.20 -0.44 1.90 -1.35 -2.47 0.00 0.00 174.74 172.59 3cx5 h PRO 254 N 7.09 0.37 -0.02 2.88 0.11 -1.99 -0.93 132.00 139.51 3cx5 h PRO 254 Ca -0.29 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.81 3cx5 h PRO 254 Cb 1.20 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3cx5 h PRO 254 CO 0.55 0.25 0.03 -0.44 -0.21 0.00 0.00 178.00 178.17 3cx5 h ASP 255 N 0.38 0.00 0.00 -2.05 3.32 -1.95 -1.34 116.42 114.79 3cx5 h ASP 255 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 3cx5 h ASP 255 Cb 0.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.54 3cx5 h ASP 255 CO -0.13 0.00 0.00 -3.20 -1.72 0.00 0.00 179.24 174.19 3cx5 n ASN 256 N -3.67 0.00 -1.20 6.45 5.15 -0.35 -1.91 115.26 119.73 3cx5 n ASN 256 Ca -0.02 -1.37 0.09 0.00 -0.60 0.00 0.00 54.58 52.68 3cx5 n ASN 256 Cb 0.12 0.00 0.28 0.00 -0.53 0.00 0.00 39.78 39.65 3cx5 n ASN 256 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 3cx5 n TYR 257 N -0.72 0.98 -4.56 1.20 4.02 -0.50 -4.46 117.16 113.12 3cx5 n TYR 257 Ca 0.09 -0.55 -0.33 0.00 -0.01 0.00 0.00 57.90 57.10 3cx5 n TYR 257 Cb 0.04 -0.09 -0.15 0.00 -0.02 0.00 0.00 39.34 39.11 3cx5 n TYR 257 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3cx5 s ILE 258 N -1.34 2.58 0.44 -0.72 1.01 -0.80 -5.04 121.20 117.34 3cx5 s ILE 258 Ca 0.42 -0.80 -0.24 0.00 0.00 0.00 0.00 60.65 60.03 3cx5 s ILE 258 Cb 0.25 -2.08 -0.09 0.00 0.01 0.00 0.00 42.46 40.54 3cx5 s ILE 258 CO 0.25 0.52 1.20 -2.65 0.00 0.00 0.00 174.94 174.26 3cx5 n PRO 259 N 4.04 1.72 -1.65 2.79 -0.02 -1.26 0.08 135.00 140.70 3cx5 n PRO 259 Ca -0.19 0.62 -0.45 0.00 -2.02 0.00 0.00 63.50 61.46 3cx5 n PRO 259 Cb 0.52 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 3cx5 n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cx5 n GLY 260 N 0.92 0.38 2.82 -1.23 0.00 -0.40 -4.24 105.19 103.44 3cx5 n GLY 260 Ca 0.08 0.41 -0.29 0.00 0.00 0.00 0.00 46.02 46.22 3cx5 n GLY 260 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3cx5 s ASN 261 N -0.13 3.46 0.35 1.61 3.84 -1.26 -4.93 114.94 117.87 3cx5 s ASN 261 Ca 0.63 -1.10 0.24 0.00 0.21 0.00 0.00 52.86 52.84 3cx5 s ASN 261 Cb -0.66 -0.87 1.27 0.00 -0.55 0.00 0.00 41.25 40.43 3cx5 s ASN 261 CO 0.56 -0.30 1.74 -0.65 -2.79 0.00 0.00 177.10 175.67 3cx5 h PRO 262 N 8.10 0.00 0.00 0.43 0.11 -1.96 -2.59 132.00 136.09 3cx5 h PRO 262 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3cx5 h PRO 262 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3cx5 h PRO 262 CO 0.39 0.00 -0.99 1.28 -0.21 0.00 0.00 178.00 178.47 3cx5 n LEU 263 N -2.35 0.98 -3.74 2.35 4.77 -1.26 -4.92 117.00 112.83 3cx5 n LEU 263 Ca -0.01 -0.48 -0.20 0.00 -0.03 0.00 0.00 56.01 55.28 3cx5 n LEU 263 Cb 0.07 -0.01 -0.17 0.00 -2.33 0.00 0.00 43.42 40.98 3cx5 n LEU 263 CO 0.13 0.25 -0.36 -0.69 -1.33 0.00 0.00 177.39 175.38 3cx5 s VAL 264 N -3.00 0.13 -0.30 4.08 1.01 -0.98 -5.11 120.40 116.24 3cx5 s VAL 264 Ca 0.08 0.24 -0.11 0.00 0.00 0.00 0.00 61.98 62.19 3cx5 s VAL 264 Cb 0.16 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 3cx5 s VAL 264 CO 0.86 0.20 0.18 -0.89 0.00 0.00 0.00 175.10 175.45 3cx5 s THR 265 N 1.83 4.98 0.41 3.92 2.01 -1.26 -4.64 115.64 122.89 3cx5 s THR 265 Ca 0.02 -0.13 -0.26 0.00 0.31 0.00 0.00 61.69 61.62 3cx5 s THR 265 Cb -0.12 -3.46 -0.09 0.00 0.01 0.00 0.00 72.50 68.84 3cx5 s THR 265 CO -0.04 0.15 1.40 -2.84 -0.69 0.00 0.00 174.62 172.61 3cx5 s PRO 266 N 1.69 3.90 0.48 4.92 0.02 -1.26 -4.89 135.00 139.86 3cx5 s PRO 266 Ca 0.06 2.38 0.17 0.00 0.02 0.00 0.00 61.00 63.64 3cx5 s PRO 266 Cb -0.16 -2.78 1.16 0.00 0.02 0.00 0.00 34.50 32.73 3cx5 s PRO 266 CO 0.09 -0.63 2.05 0.00 -0.33 0.00 0.00 177.00 178.17 3cx5 h ALA 267 N 2.64 1.68 -0.12 -1.55 0.00 -2.06 -2.37 119.26 117.49 3cx5 h ALA 267 Ca -0.50 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3cx5 h ALA 267 Cb 1.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3cx5 h ALA 267 CO 0.62 0.17 0.00 -1.13 0.00 0.00 0.00 179.25 178.91 3cx5 n SER 268 N -4.24 1.34 -4.72 0.00 3.41 -1.26 -4.93 113.62 103.22 3cx5 n SER 268 Ca -0.02 -2.09 -0.42 0.00 -0.26 0.00 0.00 58.87 56.07 3cx5 n SER 268 Cb 0.21 -0.33 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 3cx5 n SER 268 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 3cx5 s ILE 269 N -1.55 2.09 -0.12 -1.33 2.07 -0.90 -5.01 121.20 116.46 3cx5 s ILE 269 Ca 0.10 0.04 -0.08 0.00 -1.41 0.00 0.00 60.65 59.29 3cx5 s ILE 269 Cb 0.06 -3.03 0.04 0.00 0.13 0.00 0.00 42.46 39.67 3cx5 s ILE 269 CO 0.04 0.00 0.30 -0.69 -1.91 0.00 0.00 174.94 172.69 3cx5 s VAL 270 N 1.28 -0.02 0.82 4.00 1.01 -1.26 -5.12 120.40 121.10 3cx5 s VAL 270 Ca 0.75 0.06 -0.11 0.00 0.00 0.00 0.00 61.98 62.69 3cx5 s VAL 270 Cb -0.49 -0.44 0.08 0.00 0.00 0.00 0.00 36.38 35.53 3cx5 s VAL 270 CO 0.32 0.03 1.10 -2.84 0.00 0.00 0.00 175.10 173.71 3cx5 s PRO 271 N 0.72 1.90 0.46 2.72 0.02 -1.26 -4.96 135.00 134.60 3cx5 s PRO 271 Ca -0.05 1.18 -0.24 0.00 0.02 0.00 0.00 61.00 61.92 3cx5 s PRO 271 Cb -0.06 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.52 3cx5 s PRO 271 CO -0.05 -1.90 1.14 0.39 -0.33 0.00 0.00 177.00 176.25 3cx5 n GLU 272 N -3.70 1.55 -0.32 5.54 4.71 -1.26 -4.78 120.64 122.38 3cx5 n GLU 272 Ca 0.09 0.56 0.11 0.00 -0.01 0.00 0.00 57.16 57.91 3cx5 n GLU 272 Cb 0.53 -2.25 0.28 0.00 -1.01 0.00 0.00 31.44 28.99 3cx5 n GLU 272 CO 0.00 0.00 0.00 0.11 0.09 0.00 0.00 177.13 177.33 3cx5 h TRP 273 N 1.59 0.87 0.00 -0.32 5.08 -1.93 -1.22 115.95 120.02 3cx5 h TRP 273 Ca -0.47 0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.54 3cx5 h TRP 273 Cb 1.32 -0.25 0.00 0.00 -3.00 0.00 0.00 29.16 27.23 3cx5 h TRP 273 CO 0.44 0.16 0.00 2.48 -1.28 0.00 0.00 178.44 180.24 3cx5 n TYR 274 N -4.86 0.60 0.99 0.12 0.18 -1.26 -2.16 117.16 110.77 3cx5 n TYR 274 Ca 0.21 0.26 0.10 0.00 1.88 0.00 0.00 57.90 60.34 3cx5 n TYR 274 Cb 0.54 -0.91 -0.11 0.00 -0.38 0.00 0.00 39.34 38.48 3cx5 n TYR 274 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3cx5 n LEU 275 N -2.06 1.07 -0.28 -3.48 4.77 -0.47 -4.60 117.00 111.95 3cx5 n LEU 275 Ca 0.01 -0.52 0.04 0.00 -0.03 0.00 0.00 56.01 55.52 3cx5 n LEU 275 Cb 0.16 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.43 3cx5 n LEU 275 CO 0.15 0.26 1.11 -0.07 -1.33 0.00 0.00 177.39 177.51 3cx5 h LEU 276 N 0.19 0.57 -0.84 2.23 3.38 -1.35 -1.55 115.31 117.95 3cx5 h LEU 276 Ca 0.00 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3cx5 h LEU 276 Cb 0.52 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 3cx5 h LEU 276 CO 0.00 0.30 0.52 -0.65 0.09 0.00 0.00 178.44 178.70 3cx5 h PRO 277 N 0.69 1.13 -0.06 1.13 0.11 -1.80 0.45 132.00 133.65 3cx5 h PRO 277 Ca 0.41 -0.09 -0.13 0.00 0.11 0.00 0.00 66.00 66.30 3cx5 h PRO 277 Cb 0.47 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 3cx5 h PRO 277 CO -0.30 0.78 -0.57 0.74 -0.21 0.00 0.00 178.00 178.44 3cx5 h PHE 278 N 1.15 0.24 -0.41 0.65 -1.00 -1.80 -2.25 116.94 113.53 3cx5 h PHE 278 Ca 0.30 -0.09 -0.03 0.00 2.81 0.00 0.00 57.97 60.97 3cx5 h PHE 278 Cb -0.08 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.42 3cx5 h PHE 278 CO -0.01 0.72 0.15 -0.92 -1.61 0.00 0.00 178.31 176.64 3cx5 h TYR 279 N 0.15 0.64 -0.78 -0.55 3.20 -0.68 -1.73 116.97 117.21 3cx5 h TYR 279 Ca -0.00 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.76 3cx5 h TYR 279 Cb 1.04 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 39.09 3cx5 h TYR 279 CO 0.02 0.58 0.29 0.00 -1.64 0.00 0.00 178.16 177.40 3cx5 h ALA 280 N 0.99 1.03 -0.50 1.82 0.00 -0.73 -1.37 119.26 120.51 3cx5 h ALA 280 Ca 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3cx5 h ALA 280 Cb 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3cx5 h ALA 280 CO -0.01 0.67 0.26 0.82 0.00 0.00 0.00 179.25 180.99 3cx5 h ILE 281 N 1.15 1.18 -0.26 0.00 2.04 -1.14 -1.40 117.51 119.08 3cx5 h ILE 281 Ca 0.26 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 3cx5 h ILE 281 Cb 0.25 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 3cx5 h ILE 281 CO -0.02 0.19 0.11 0.25 0.00 0.00 0.00 178.15 178.68 3cx5 h LEU 282 N 0.66 0.35 -2.37 1.44 6.46 -1.02 -2.60 115.31 118.23 3cx5 h LEU 282 Ca 0.17 -0.15 -0.00 0.00 -0.12 0.00 0.00 57.88 57.78 3cx5 h LEU 282 Cb 0.07 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 39.91 3cx5 h LEU 282 CO -0.03 0.41 -0.02 0.03 -0.62 0.00 0.00 178.44 178.21 3cx5 h ARG 283 N 0.27 0.00 0.00 1.25 3.08 -1.01 -2.50 114.38 115.48 3cx5 h ARG 283 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3cx5 h ARG 283 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3cx5 h ARG 283 CO -0.01 0.02 0.00 0.77 -1.07 0.00 0.00 179.97 179.68 3cx5 h SER 284 N 0.00 0.00 -3.62 7.04 0.02 -0.85 -3.42 113.55 112.73 3cx5 h SER 284 Ca -0.00 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.26 3cx5 h SER 284 Cb 0.20 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 62.49 3cx5 h SER 284 CO 0.00 0.00 -0.55 -0.63 -1.14 0.00 0.00 176.83 174.51 3cx5 s ILE 285 N -3.30 4.44 -0.92 3.27 -1.09 -0.94 -4.80 121.20 117.86 3cx5 s ILE 285 Ca 0.05 -0.68 -0.07 0.00 -2.23 0.00 0.00 60.65 57.72 3cx5 s ILE 285 Cb 0.10 -3.37 -0.12 0.00 -1.58 0.00 0.00 42.46 37.49 3cx5 s ILE 285 CO 0.46 -0.06 2.80 -0.81 -1.23 0.00 0.00 174.94 176.09 3cx5 n PRO 286 N 4.96 2.64 -3.64 2.79 -0.04 -1.26 -4.54 135.00 135.90 3cx5 n PRO 286 Ca -0.13 -1.57 -0.04 0.00 -0.04 0.00 0.00 63.50 61.72 3cx5 n PRO 286 Cb 0.47 -2.42 -0.07 0.00 -0.04 0.00 0.00 33.50 31.44 3cx5 n PRO 286 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3cx5 s ASP 287 N 2.48 -0.53 0.08 3.54 2.15 -1.26 -5.07 116.67 118.05 3cx5 s ASP 287 Ca 0.58 0.88 -0.35 0.00 0.43 0.00 0.00 52.55 54.08 3cx5 s ASP 287 Cb 0.19 1.16 -0.18 0.00 -0.30 0.00 0.00 42.92 43.80 3cx5 s ASP 287 CO -0.03 -0.14 1.54 0.50 -0.17 0.00 0.00 175.17 176.87 3cx5 h LYS 288 N 5.83 -1.03 -0.19 4.34 3.64 -1.98 -1.08 116.57 126.09 3cx5 h LYS 288 Ca -0.28 0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 3cx5 h LYS 288 Cb 1.19 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 33.24 3cx5 h LYS 288 CO 0.18 -0.69 0.11 1.25 -2.27 0.00 0.00 179.45 178.04 3cx5 h LEU 289 N -1.07 0.22 -1.20 5.20 5.85 -1.97 -2.60 115.31 119.74 3cx5 h LEU 289 Ca -0.08 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 3cx5 h LEU 289 Cb 0.89 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3cx5 h LEU 289 CO 0.01 0.20 -0.39 -0.07 -0.34 0.00 0.00 178.44 177.85 3cx5 h LEU 290 N 0.23 0.03 -0.38 2.25 3.38 -1.95 -1.31 115.31 117.55 3cx5 h LEU 290 Ca 0.07 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3cx5 h LEU 290 Cb 0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3cx5 h LEU 290 CO -0.01 0.41 0.00 1.23 0.09 0.00 0.00 178.44 180.16 3cx5 h GLY 291 N 1.16 0.72 0.75 0.83 0.00 -1.02 -0.67 103.07 104.84 3cx5 h GLY 291 Ca -0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 3cx5 h GLY 291 CO 0.05 0.49 0.00 -2.08 0.00 0.00 0.00 176.54 175.01 3cx5 h VAL 292 N 0.49 1.22 -0.63 4.60 2.07 -1.22 -1.94 116.25 120.84 3cx5 h VAL 292 Ca 0.11 -0.68 0.04 0.00 0.82 0.00 0.00 66.70 66.98 3cx5 h VAL 292 Cb 0.47 1.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.79 3cx5 h VAL 292 CO 0.02 0.18 0.37 0.40 0.02 0.00 0.00 177.57 178.57 3cx5 h ILE 293 N -0.19 1.04 -0.68 4.57 2.04 -1.24 -2.39 117.51 120.66 3cx5 h ILE 293 Ca 0.01 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 3cx5 h ILE 293 Cb 0.29 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 3cx5 h ILE 293 CO 0.00 0.13 0.27 0.74 0.00 0.00 0.00 178.15 179.30 3cx5 h THR 294 N 0.72 1.24 -0.00 -0.27 2.02 -1.01 -0.09 112.91 115.52 3cx5 h THR 294 Ca 0.26 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.69 3cx5 h THR 294 Cb 0.08 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 3cx5 h THR 294 CO -0.13 0.30 0.00 -0.03 0.37 0.00 0.00 175.52 176.03 3cx5 h MET 295 N 0.96 0.01 -0.53 6.66 1.85 -1.10 -1.53 114.93 121.25 3cx5 h MET 295 Ca 0.23 -0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.30 3cx5 h MET 295 Cb 0.20 -0.00 -0.03 0.00 0.43 0.00 0.00 31.60 32.21 3cx5 h MET 295 CO -0.02 0.16 0.26 0.74 -0.40 0.00 0.00 176.91 177.66 3cx5 h PHE 296 N -0.15 0.72 0.00 1.39 -1.00 -1.33 -1.08 116.94 115.49 3cx5 h PHE 296 Ca 0.00 -0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.73 3cx5 h PHE 296 Cb 0.16 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.48 3cx5 h PHE 296 CO -0.02 0.52 -0.17 0.00 -1.61 0.00 0.00 178.31 177.03 3cx5 h ALA 297 N 1.56 1.54 0.00 2.45 0.00 -0.71 -1.70 119.26 122.40 3cx5 h ALA 297 Ca 0.19 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3cx5 h ALA 297 Cb 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3cx5 h ALA 297 CO -0.03 0.21 -0.13 0.00 0.00 0.00 0.00 179.25 179.30 3cx5 h ALA 298 N 1.83 1.41 0.03 0.00 0.00 -0.14 0.12 119.26 122.52 3cx5 h ALA 298 Ca -0.00 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 3cx5 h ALA 298 Cb 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3cx5 h ALA 298 CO 0.02 0.16 -1.12 0.82 0.00 0.00 0.00 179.25 179.13 3cx5 h ILE 299 N 0.00 1.06 0.00 0.00 2.04 -1.39 -3.38 117.51 115.85 3cx5 h ILE 299 Ca -0.00 -2.25 -0.01 0.00 1.00 0.00 0.00 64.86 63.59 3cx5 h ILE 299 Cb 0.30 2.52 -0.00 0.00 -0.74 0.00 0.00 36.82 38.90 3cx5 h ILE 299 CO 0.02 0.47 -0.07 -0.07 0.00 0.00 0.00 178.15 178.49 3cx5 h LEU 300 N -0.81 0.00 -2.52 1.44 3.38 -1.17 -2.25 115.31 113.38 3cx5 h LEU 300 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3cx5 h LEU 300 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3cx5 h LEU 300 CO -0.11 0.07 0.00 1.62 0.09 0.00 0.00 178.44 180.11 3cx5 h VAL 301 N 0.00 0.00 -0.07 1.22 3.04 -0.93 -0.78 116.25 118.73 3cx5 h VAL 301 Ca -0.00 -0.04 0.02 0.00 -1.01 0.00 0.00 66.70 65.67 3cx5 h VAL 301 Cb 0.14 0.93 -0.00 0.00 -2.01 0.00 0.00 31.29 30.34 3cx5 h VAL 301 CO 0.01 0.00 0.05 -0.07 -1.01 0.00 0.00 177.57 176.55 3cx5 h LEU 302 N 0.00 0.00 -1.15 3.16 4.07 -1.63 -2.21 115.31 117.55 3cx5 h LEU 302 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3cx5 h LEU 302 Cb 0.04 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.78 3cx5 h LEU 302 CO 0.00 0.00 0.00 -0.07 -1.08 0.00 0.00 178.44 177.29 3cx5 h LEU 303 N 0.00 0.00 0.00 1.67 3.38 -1.35 -3.14 115.31 115.87 3cx5 h LEU 303 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3cx5 h LEU 303 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3cx5 h LEU 303 CO -0.00 0.00 -0.42 -0.37 0.09 0.00 0.00 178.44 177.74 3cx5 h VAL 304 N 0.00 0.00 -0.97 1.22 -1.51 -1.58 -3.39 116.25 110.03 3cx5 h VAL 304 Ca 0.00 -0.71 0.22 0.00 -1.23 0.00 0.00 66.70 64.98 3cx5 h VAL 304 Cb 0.42 1.46 -0.12 0.00 -2.13 0.00 0.00 31.29 30.93 3cx5 h VAL 304 CO 0.00 0.00 0.55 0.25 -1.23 0.00 0.00 177.57 177.14 3cx5 h LEU 305 N 0.00 0.63 -2.19 4.19 5.85 -1.69 0.17 115.31 122.28 3cx5 h LEU 305 Ca 0.00 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3cx5 h LEU 305 Cb 0.85 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 3cx5 h LEU 305 CO 0.00 0.14 -0.06 -0.65 -0.34 0.00 0.00 178.44 177.53 3cx5 h PRO 306 N 0.60 0.00 0.00 5.25 0.11 -1.83 -2.24 132.00 133.89 3cx5 h PRO 306 Ca 0.60 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 66.40 3cx5 h PRO 306 Cb 1.06 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.11 3cx5 h PRO 306 CO -0.45 0.06 -1.94 1.19 -0.21 0.00 0.00 178.00 176.65 3cx5 n PHE 307 N -3.56 0.63 0.39 0.65 3.01 0.48 -4.37 117.46 114.68 3cx5 n PHE 307 Ca -0.02 0.23 0.12 0.00 1.01 0.00 0.00 57.45 58.78 3cx5 n PHE 307 Cb 0.18 -1.11 0.13 0.00 -0.01 0.00 0.00 39.48 38.67 3cx5 n PHE 307 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 3cx5 h THR 308 N 0.00 0.00 -3.00 4.37 1.35 -1.00 -3.43 112.91 111.20 3cx5 h THR 308 Ca -0.37 -0.70 -0.57 0.00 -0.55 0.00 0.00 66.41 64.22 3cx5 h THR 308 Cb 2.07 1.31 -0.09 0.00 -1.73 0.00 0.00 68.15 69.71 3cx5 h THR 308 CO 0.06 0.00 0.87 -0.62 -0.25 0.00 0.00 175.52 175.57 3cx5 s ASP 309 N -4.79 6.35 0.00 5.36 -1.08 -0.86 -2.83 116.67 118.81 3cx5 s ASP 309 Ca 0.04 -0.18 0.27 0.00 -0.52 0.00 0.00 52.55 52.17 3cx5 s ASP 309 Cb 0.11 -2.52 0.90 0.00 -1.46 0.00 0.00 42.92 39.96 3cx5 s ASP 309 CO 0.73 -1.49 1.65 0.54 0.52 0.00 0.00 175.17 177.13 3cx5 n ARG 310 N 8.34 1.25 -1.61 4.34 5.12 -1.26 -4.96 116.66 127.87 3cx5 n ARG 310 Ca 0.05 -0.73 -0.37 0.00 -1.93 0.00 0.00 57.85 54.88 3cx5 n ARG 310 Cb 0.48 -1.48 0.08 0.00 -1.16 0.00 0.00 32.46 30.38 3cx5 n ARG 310 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3cx5 n SER 311 N -0.24 1.63 -0.31 0.55 2.88 -1.26 -4.81 113.62 112.06 3cx5 n SER 311 Ca 0.16 0.78 0.12 0.00 -1.33 0.00 0.00 58.87 58.60 3cx5 n SER 311 Cb 0.35 -1.52 0.19 0.00 -0.75 0.00 0.00 64.21 62.49 3cx5 n SER 311 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 3cx5 n VAL 312 N -2.12 0.00 -4.69 2.46 3.14 -1.26 -4.87 118.33 110.99 3cx5 n VAL 312 Ca 0.15 -0.16 -0.27 0.00 -2.96 0.00 0.00 64.34 61.09 3cx5 n VAL 312 Cb 0.48 0.76 -0.14 0.00 -1.06 0.00 0.00 33.84 33.88 3cx5 n VAL 312 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 3cx5 s VAL 313 N -2.55 1.90 -0.08 1.55 -7.23 -1.26 -5.12 120.40 107.61 3cx5 s VAL 313 Ca 0.20 -1.35 -0.23 0.00 -1.81 0.00 0.00 61.98 58.79 3cx5 s VAL 313 Cb 0.18 -1.65 -0.03 0.00 0.56 0.00 0.00 36.38 35.44 3cx5 s VAL 313 CO 0.57 0.24 0.70 -0.60 -0.31 0.00 0.00 175.10 175.70 3cx5 s ARG 314 N -1.34 4.41 0.00 4.82 3.52 -1.26 -4.94 118.95 124.16 3cx5 s ARG 314 Ca 0.10 0.87 0.00 0.00 -0.13 0.00 0.00 55.73 56.56 3cx5 s ARG 314 Cb -0.09 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.83 3cx5 s ARG 314 CO 0.02 0.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.94 3cx5 n GLY 315 N 3.19 0.23 0.18 8.12 0.00 -1.18 -4.22 105.19 111.51 3cx5 n GLY 315 Ca -0.01 -1.74 0.11 0.00 0.00 0.00 0.00 46.02 44.38 3cx5 n GLY 315 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3cx5 n ASN 316 N -0.85 1.16 -0.33 1.61 3.02 0.01 -4.61 115.26 115.28 3cx5 n ASN 316 Ca 0.00 -0.95 0.21 0.00 -0.03 0.00 0.00 54.58 53.81 3cx5 n ASN 316 Cb 0.00 0.53 0.42 0.00 -0.61 0.00 0.00 39.78 40.12 3cx5 n ASN 316 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3cx5 h THR 317 N 0.87 0.31 -0.49 3.41 2.02 -1.84 -0.46 112.91 116.73 3cx5 h THR 317 Ca 0.00 -0.10 -0.16 0.00 0.77 0.00 0.00 66.41 66.91 3cx5 h THR 317 Cb 0.57 -0.02 -0.10 0.00 -1.74 0.00 0.00 68.15 66.86 3cx5 h THR 317 CO 0.00 0.06 0.11 0.49 0.37 0.00 0.00 175.52 176.55 3cx5 n PHE 318 N -5.09 1.61 -3.95 3.16 3.01 -1.26 -4.91 117.46 110.03 3cx5 n PHE 318 Ca 0.29 -1.28 -0.31 0.00 1.01 0.00 0.00 57.45 57.16 3cx5 n PHE 318 Cb 0.90 -0.53 -0.15 0.00 -0.01 0.00 0.00 39.48 39.68 3cx5 n PHE 318 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3cx5 s LYS 319 N -3.05 1.48 0.10 -1.08 1.02 -0.18 -5.01 119.74 113.01 3cx5 s LYS 319 Ca 0.48 -1.40 -0.33 0.00 0.02 0.00 0.00 55.97 54.75 3cx5 s LYS 319 Cb 0.40 -2.76 -0.13 0.00 -0.52 0.00 0.00 37.83 34.83 3cx5 s LYS 319 CO 0.07 -0.80 1.59 0.28 -0.92 0.00 0.00 175.35 175.57 3cx5 h VAL 320 N 6.63 0.14 -0.32 3.17 2.07 -1.91 -0.64 116.25 125.39 3cx5 h VAL 320 Ca -0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3cx5 h VAL 320 Cb 1.04 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3cx5 h VAL 320 CO 0.47 0.00 0.16 -0.07 0.02 0.00 0.00 177.57 178.15 3cx5 h LEU 321 N -0.78 0.41 -1.00 2.57 4.07 -1.96 -2.36 115.31 116.26 3cx5 h LEU 321 Ca -0.01 -0.12 0.00 0.00 0.08 0.00 0.00 57.88 57.83 3cx5 h LEU 321 Cb 0.73 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 42.32 3cx5 h LEU 321 CO -0.15 0.41 0.60 0.28 -1.08 0.00 0.00 178.44 178.50 3cx5 h SER 322 N 0.39 1.12 -0.52 -0.43 0.02 -1.89 -1.56 113.55 110.67 3cx5 h SER 322 Ca 0.11 -0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 3cx5 h SER 322 Cb 0.10 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 3cx5 h SER 322 CO -0.02 0.84 0.18 0.11 -1.14 0.00 0.00 176.83 176.81 3cx5 h LYS 323 N 1.30 0.80 0.20 3.45 1.57 -0.98 -0.61 116.57 122.30 3cx5 h LYS 323 Ca 0.34 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 3cx5 h LYS 323 Cb -0.10 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 3cx5 h LYS 323 CO -0.07 0.73 -0.12 0.35 -0.57 0.00 0.00 179.45 179.76 3cx5 h PHE 324 N 0.71 -0.32 0.00 -1.35 3.04 -0.94 -2.64 116.94 115.45 3cx5 h PHE 324 Ca 0.17 -0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.05 3cx5 h PHE 324 Cb 0.24 0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.86 3cx5 h PHE 324 CO 0.01 -0.20 -0.31 0.74 -2.02 0.00 0.00 178.31 176.54 3cx5 h PHE 325 N -0.32 0.00 -0.37 0.41 -1.00 -1.22 -2.26 116.94 112.19 3cx5 h PHE 325 Ca -0.02 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 3cx5 h PHE 325 Cb 0.26 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.81 3cx5 h PHE 325 CO -0.08 0.31 0.20 0.35 -1.61 0.00 0.00 178.31 177.47 3cx5 h PHE 326 N 0.00 0.52 0.00 -0.55 3.57 -0.86 -0.04 116.94 119.58 3cx5 h PHE 326 Ca -0.00 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 3cx5 h PHE 326 Cb 0.64 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 3cx5 h PHE 326 CO 0.00 0.41 -0.28 0.74 -2.23 0.00 0.00 178.31 176.95 3cx5 h PHE 327 N 0.47 0.00 -0.31 0.41 -1.00 -1.21 -0.41 116.94 114.90 3cx5 h PHE 327 Ca 0.13 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.85 3cx5 h PHE 327 Cb 0.07 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.62 3cx5 h PHE 327 CO -0.02 0.28 -0.06 0.82 -1.61 0.00 0.00 178.31 177.72 3cx5 h ILE 328 N 0.00 1.28 -0.41 -0.55 1.08 -0.82 -1.53 117.51 116.56 3cx5 h ILE 328 Ca -0.00 -1.08 -0.01 0.00 -0.39 0.00 0.00 64.86 63.38 3cx5 h ILE 328 Cb 0.71 1.36 -0.02 0.00 -3.07 0.00 0.00 36.82 35.79 3cx5 h ILE 328 CO 0.04 0.35 0.20 0.15 -0.69 0.00 0.00 178.15 178.20 3cx5 h PHE 329 N 0.35 0.59 0.44 1.37 3.57 -0.34 -0.23 116.94 122.69 3cx5 h PHE 329 Ca 0.08 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 3cx5 h PHE 329 Cb 0.54 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 3cx5 h PHE 329 CO 0.05 0.48 -0.24 0.28 -2.23 0.00 0.00 178.31 176.65 3cx5 h VAL 330 N 0.52 0.51 0.00 1.41 2.07 -0.95 -1.00 116.25 118.82 3cx5 h VAL 330 Ca 0.14 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.62 3cx5 h VAL 330 Cb 0.11 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3cx5 h VAL 330 CO -0.02 0.00 -0.19 -0.26 0.02 0.00 0.00 177.57 177.12 3cx5 h PHE 331 N -0.63 0.00 -0.35 1.57 -1.00 -1.25 -0.96 116.94 114.33 3cx5 h PHE 331 Ca -0.05 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.63 3cx5 h PHE 331 Cb 0.50 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.04 3cx5 h PHE 331 CO -0.07 0.19 -0.19 -0.97 -1.61 0.00 0.00 178.31 175.66 3cx5 h ASN 332 N 0.00 0.64 -0.44 2.17 -0.73 -0.68 -0.18 115.58 116.36 3cx5 h ASN 332 Ca -0.00 -0.21 -0.12 0.00 1.87 0.00 0.00 56.30 57.84 3cx5 h ASN 332 Cb 0.39 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.79 3cx5 h ASN 332 CO 0.02 0.83 -0.19 0.15 -0.37 0.00 0.00 177.43 177.88 3cx5 h PHE 333 N 0.58 1.04 -0.58 0.67 3.04 0.13 -1.05 116.94 120.76 3cx5 h PHE 333 Ca 0.09 -0.25 -0.06 0.00 3.98 0.00 0.00 57.97 61.73 3cx5 h PHE 333 Cb 0.64 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.88 3cx5 h PHE 333 CO 0.03 1.04 0.15 0.28 -2.02 0.00 0.00 178.31 177.79 3cx5 h VAL 334 N 0.74 1.25 -0.62 1.41 2.07 -1.08 -2.25 116.25 117.77 3cx5 h VAL 334 Ca 0.10 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 3cx5 h VAL 334 Cb 0.76 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3cx5 h VAL 334 CO 0.06 0.33 0.35 0.25 0.02 0.00 0.00 177.57 178.58 3cx5 h LEU 335 N 0.84 0.76 -0.87 2.57 7.12 -0.82 -0.60 115.31 124.31 3cx5 h LEU 335 Ca 0.18 -0.08 0.09 0.00 0.13 0.00 0.00 57.88 58.20 3cx5 h LEU 335 Cb 0.34 -0.19 -0.07 0.00 -0.53 0.00 0.00 40.66 40.20 3cx5 h LEU 335 CO 0.00 0.63 0.52 0.25 -0.13 0.00 0.00 178.44 179.70 3cx5 h LEU 336 N 0.84 0.76 -0.54 2.25 5.85 -0.96 0.26 115.31 123.77 3cx5 h LEU 336 Ca 0.22 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 3cx5 h LEU 336 Cb 0.03 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 3cx5 h LEU 336 CO -0.04 0.44 0.17 1.23 -0.34 0.00 0.00 178.44 179.91 3cx5 h GLY 337 N 0.87 0.90 1.04 3.75 0.00 -0.65 -0.28 103.07 108.70 3cx5 h GLY 337 Ca 0.41 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 47.15 3cx5 h GLY 337 CO -0.23 0.49 0.13 -1.61 0.00 0.00 0.00 176.54 175.32 3cx5 h GLN 338 N 0.75 1.02 -0.81 4.80 5.75 0.07 -2.26 115.11 124.43 3cx5 h GLN 338 Ca 0.17 -0.26 -0.04 0.00 -0.15 0.00 0.00 58.65 58.37 3cx5 h GLN 338 Cb 0.27 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.66 3cx5 h GLN 338 CO -0.01 0.93 0.34 0.82 -2.65 0.00 0.00 178.83 178.26 3cx5 h ILE 339 N 0.94 1.26 0.00 2.39 1.08 -0.26 -1.53 117.51 121.39 3cx5 h ILE 339 Ca 0.20 -0.81 -0.02 0.00 -0.39 0.00 0.00 64.86 63.84 3cx5 h ILE 339 Cb 0.39 0.28 -0.00 0.00 -3.07 0.00 0.00 36.82 34.41 3cx5 h ILE 339 CO 0.01 0.33 -0.08 1.23 -0.69 0.00 0.00 178.15 178.95 3cx5 h GLY 340 N 1.18 0.00 1.41 5.37 0.00 -0.65 -0.96 103.07 109.42 3cx5 h GLY 340 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 3cx5 h GLY 340 CO -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 176.54 176.46 3cx5 n ALA 341 N -2.43 2.60 -2.33 3.60 0.00 -0.59 -4.85 120.51 116.51 3cx5 n ALA 341 Ca -0.03 -0.18 -0.19 0.00 0.00 0.00 0.00 53.44 53.04 3cx5 n ALA 341 Cb 0.16 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3cx5 n ALA 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cx5 s HIS 343 N -2.31 3.34 -0.95 0.00 3.76 -1.26 -4.95 115.29 112.92 3cx5 s HIS 343 Ca 0.48 1.05 -0.24 0.00 -0.15 0.00 0.00 55.06 56.20 3cx5 s HIS 343 Cb -0.10 -3.03 0.02 0.00 1.11 0.00 0.00 32.58 30.58 3cx5 s HIS 343 CO 0.33 -1.13 1.57 0.08 -0.85 0.00 0.00 174.74 174.74 3cx5 s VAL 344 N -3.33 3.77 0.12 -0.90 1.01 -1.26 -4.84 120.40 114.95 3cx5 s VAL 344 Ca 0.58 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.91 3cx5 s VAL 344 Cb -0.11 -4.75 0.01 0.00 0.00 0.00 0.00 36.38 31.53 3cx5 s VAL 344 CO 0.52 -1.65 0.28 -1.61 0.00 0.00 0.00 175.10 172.64 3cx5 s GLU 345 N 5.62 0.98 0.28 2.72 2.02 -1.26 -5.02 118.70 124.05 3cx5 s GLU 345 Ca 0.52 -0.91 -0.29 0.00 0.02 0.00 0.00 54.97 54.31 3cx5 s GLU 345 Cb -0.03 0.39 -0.10 0.00 0.10 0.00 0.00 34.13 34.50 3cx5 s GLU 345 CO -0.05 -0.35 1.13 0.08 0.02 0.00 0.00 175.26 176.10 3cx5 s VAL 346 N -3.86 3.39 -0.69 2.63 1.01 -1.26 -0.47 120.40 121.15 3cx5 s VAL 346 Ca 0.06 1.38 0.16 0.00 0.00 0.00 0.00 61.98 63.59 3cx5 s VAL 346 Cb 0.03 -3.88 0.75 0.00 0.00 0.00 0.00 36.38 33.28 3cx5 s VAL 346 CO -0.09 0.32 1.66 -0.81 0.00 0.00 0.00 175.10 176.18 3cx5 n PRO 347 N 1.25 4.17 0.08 2.72 -0.04 -1.26 -4.91 135.00 137.00 3cx5 n PRO 347 Ca -0.01 -2.99 0.05 0.00 -0.04 0.00 0.00 63.50 60.51 3cx5 n PRO 347 Cb 0.44 -2.04 0.49 0.00 -0.04 0.00 0.00 33.50 32.36 3cx5 n PRO 347 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3cx5 h TYR 348 N 3.86 0.35 -0.08 0.54 0.99 -1.12 -1.84 116.97 119.67 3cx5 h TYR 348 Ca 0.00 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 3cx5 h TYR 348 Cb 1.67 -0.12 -0.00 0.00 1.00 0.00 0.00 36.73 39.27 3cx5 h TYR 348 CO 0.88 0.22 0.03 0.28 -0.00 0.00 0.00 178.16 179.58 3cx5 h VAL 349 N 0.38 1.14 -0.51 -2.88 2.07 -1.77 0.40 116.25 115.07 3cx5 h VAL 349 Ca 0.10 -0.42 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 3cx5 h VAL 349 Cb -0.04 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3cx5 h VAL 349 CO -0.02 0.12 -0.00 0.25 0.02 0.00 0.00 177.57 177.94 3cx5 h LEU 350 N -0.02 0.90 -0.79 2.57 6.46 -1.82 -1.68 115.31 120.93 3cx5 h LEU 350 Ca 0.03 -0.31 0.03 0.00 -0.12 0.00 0.00 57.88 57.51 3cx5 h LEU 350 Cb 0.17 -0.24 -0.05 0.00 -0.73 0.00 0.00 40.66 39.81 3cx5 h LEU 350 CO -0.00 0.99 0.50 0.24 -0.62 0.00 0.00 178.44 179.54 3cx5 h MET 351 N 0.78 0.95 -0.56 1.25 2.86 -1.18 0.10 114.93 119.13 3cx5 h MET 351 Ca 0.15 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.66 3cx5 h MET 351 Cb 0.53 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3cx5 h MET 351 CO 0.03 0.63 0.09 0.78 1.06 0.00 0.00 176.91 179.50 3cx5 h GLY 352 N 0.97 0.99 1.12 8.32 0.00 -0.70 0.51 103.07 114.29 3cx5 h GLY 352 Ca 0.31 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 3cx5 h GLY 352 CO -0.11 0.61 0.10 1.46 0.00 0.00 0.00 176.54 178.60 3cx5 h GLN 353 N 0.81 1.07 -0.19 4.80 4.20 -0.82 0.86 115.11 125.85 3cx5 h GLN 353 Ca 0.17 -0.28 -0.09 0.00 0.06 0.00 0.00 58.65 58.51 3cx5 h GLN 353 Cb 0.41 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 3cx5 h GLN 353 CO 0.01 0.99 -0.23 0.82 -0.67 0.00 0.00 178.83 179.75 3cx5 h ILE 354 N 1.01 1.33 -0.45 2.54 2.04 -0.79 -1.93 117.51 121.26 3cx5 h ILE 354 Ca 0.20 -1.41 -0.04 0.00 1.00 0.00 0.00 64.86 64.61 3cx5 h ILE 354 Cb 0.43 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 3cx5 h ILE 354 CO 0.01 0.43 0.11 0.00 0.00 0.00 0.00 178.15 178.70 3cx5 h ALA 355 N 0.63 1.36 -0.59 1.87 0.00 -0.75 -0.60 119.26 121.18 3cx5 h ALA 355 Ca 0.03 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 3cx5 h ALA 355 Cb 0.78 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3cx5 h ALA 355 CO 0.05 0.46 0.11 1.15 0.00 0.00 0.00 179.25 181.03 3cx5 h THR 356 N 0.65 1.26 -0.55 0.00 2.02 -0.73 -0.91 112.91 114.64 3cx5 h THR 356 Ca 0.15 -0.96 -0.04 0.00 0.77 0.00 0.00 66.41 66.33 3cx5 h THR 356 Cb 0.24 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 3cx5 h THR 356 CO -0.00 0.35 0.18 0.15 0.37 0.00 0.00 175.52 176.57 3cx5 h PHE 357 N 0.87 0.88 -0.73 3.16 3.57 -0.63 -2.69 116.94 121.37 3cx5 h PHE 357 Ca 0.18 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 3cx5 h PHE 357 Cb 0.40 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 3cx5 h PHE 357 CO 0.03 0.74 0.34 0.82 -2.23 0.00 0.00 178.31 178.01 3cx5 h ILE 358 N 0.77 1.23 0.13 1.41 2.04 -0.81 0.22 117.51 122.50 3cx5 h ILE 358 Ca 0.18 -0.67 0.01 0.00 1.00 0.00 0.00 64.86 65.38 3cx5 h ILE 358 Cb 0.26 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 3cx5 h ILE 358 CO -0.01 0.28 -0.16 0.22 0.00 0.00 0.00 178.15 178.48 3cx5 h TYR 359 N 1.04 -0.43 -0.26 1.37 3.20 -0.86 -1.14 116.97 119.89 3cx5 h TYR 359 Ca 0.25 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.96 3cx5 h TYR 359 Cb 0.12 0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.56 3cx5 h TYR 359 CO 0.01 -0.25 -0.49 0.74 -1.64 0.00 0.00 178.16 176.53 3cx5 h PHE 360 N -0.34 1.01 -0.42 -3.82 -1.00 -1.32 -3.11 116.94 107.93 3cx5 h PHE 360 Ca 0.01 -0.36 0.07 0.00 2.81 0.00 0.00 57.97 60.51 3cx5 h PHE 360 Cb 0.34 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.69 3cx5 h PHE 360 CO -0.15 1.17 0.29 0.00 -1.61 0.00 0.00 178.31 178.00 3cx5 h ALA 361 N 0.66 2.08 0.02 2.45 0.00 -0.42 -1.94 119.26 122.10 3cx5 h ALA 361 Ca 0.01 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3cx5 h ALA 361 Cb 1.10 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 3cx5 h ALA 361 CO 0.11 -0.17 -0.17 -0.92 0.00 0.00 0.00 179.25 178.10 3cx5 h TYR 362 N 0.24 -0.44 -0.12 0.00 3.20 -1.13 0.29 116.97 119.01 3cx5 h TYR 362 Ca 0.19 0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.86 3cx5 h TYR 362 Cb 0.44 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.90 3cx5 h TYR 362 CO -0.00 -0.25 -0.77 0.74 -1.64 0.00 0.00 178.16 176.24 3cx5 h PHE 363 N -0.29 0.87 0.00 -3.82 -1.00 -1.54 0.05 116.94 111.20 3cx5 h PHE 363 Ca 0.05 -0.39 0.00 0.00 2.81 0.00 0.00 57.97 60.44 3cx5 h PHE 363 Cb 0.35 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.78 3cx5 h PHE 363 CO -0.21 1.19 -1.29 1.28 -1.61 0.00 0.00 178.31 177.68 3cx5 n LEU 364 N -3.89 0.58 0.06 1.54 4.77 -0.78 -4.61 117.00 114.67 3cx5 n LEU 364 Ca -0.06 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3cx5 n LEU 364 Cb 0.74 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 3cx5 n LEU 364 CO 0.51 -0.11 -0.09 -0.38 -1.33 0.00 0.00 177.39 175.99 3cx5 n ILE 365 N -2.47 0.35 0.04 -0.08 5.41 0.73 -4.80 119.36 118.53 3cx5 n ILE 365 Ca -0.01 0.11 -0.11 0.00 1.00 0.00 0.00 62.75 63.75 3cx5 n ILE 365 Cb 0.54 -0.99 -0.05 0.00 -0.71 0.00 0.00 39.64 38.43 3cx5 n ILE 365 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3cx5 h ILE 366 N 0.00 0.83 0.13 1.39 2.04 -0.73 -1.67 117.51 119.50 3cx5 h ILE 366 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3cx5 h ILE 366 Cb 0.18 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3cx5 h ILE 366 CO 0.00 0.00 -0.06 0.58 0.00 0.00 0.00 178.15 178.67 3cx5 h VAL 367 N -0.10 0.92 -0.63 1.67 2.07 -1.20 -0.60 116.25 118.39 3cx5 h VAL 367 Ca 0.03 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 3cx5 h VAL 367 Cb 0.14 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 3cx5 h VAL 367 CO -0.08 0.05 0.20 1.55 0.02 0.00 0.00 177.57 179.31 3cx5 h PRO 368 N -0.26 0.94 0.22 1.57 0.13 -1.52 -0.41 132.00 132.68 3cx5 h PRO 368 Ca -0.02 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.92 3cx5 h PRO 368 Cb 0.21 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.19 3cx5 h PRO 368 CO 0.03 0.81 -0.11 0.28 -0.23 0.00 0.00 178.00 178.78 3cx5 h VAL 369 N 0.92 0.81 -0.91 1.56 2.07 -1.25 -2.55 116.25 116.90 3cx5 h VAL 369 Ca 0.21 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.87 3cx5 h VAL 369 Cb 0.25 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3cx5 h VAL 369 CO -0.01 0.17 0.59 0.40 0.02 0.00 0.00 177.57 178.74 3cx5 h ILE 370 N -0.78 1.24 -0.36 4.57 1.08 -1.09 -1.82 117.51 120.35 3cx5 h ILE 370 Ca -0.03 -0.45 -0.10 0.00 -0.39 0.00 0.00 64.86 63.89 3cx5 h ILE 370 Cb 0.51 -0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.15 3cx5 h ILE 370 CO 0.05 0.23 -0.20 0.77 -0.69 0.00 0.00 178.15 178.31 3cx5 h SER 371 N 1.23 0.70 -0.40 1.72 4.64 -1.12 -0.67 113.55 119.66 3cx5 h SER 371 Ca 0.33 -0.24 -0.06 0.00 -0.47 0.00 0.00 61.79 61.35 3cx5 h SER 371 Cb -0.13 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.76 3cx5 h SER 371 CO -0.07 0.90 0.02 0.74 -0.87 0.00 0.00 176.83 177.55 3cx5 h THR 372 N 0.62 1.25 -0.37 2.95 2.02 -1.07 -1.70 112.91 116.61 3cx5 h THR 372 Ca 0.09 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 3cx5 h THR 372 Cb 0.68 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 3cx5 h THR 372 CO 0.05 0.33 0.21 0.40 0.37 0.00 0.00 175.52 176.88 3cx5 h ILE 373 N 0.53 1.13 -0.65 3.11 2.04 -1.15 -2.59 117.51 119.93 3cx5 h ILE 373 Ca 0.12 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 3cx5 h ILE 373 Cb 0.44 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3cx5 h ILE 373 CO 0.02 0.13 0.27 -0.33 0.00 0.00 0.00 178.15 178.24 3cx5 h GLU 374 N 0.47 0.95 -0.44 2.37 5.08 -0.98 -0.58 114.58 121.46 3cx5 h GLU 374 Ca 0.13 -0.15 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 3cx5 h GLU 374 Cb 0.02 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 3cx5 h GLU 374 CO -0.02 0.77 0.19 -0.91 -1.00 0.00 0.00 179.01 178.03 3cx5 h ASN 375 N 0.94 0.23 -0.46 1.42 2.35 -0.97 -1.00 115.58 118.09 3cx5 h ASN 375 Ca 0.22 0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.90 3cx5 h ASN 375 Cb 0.17 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 3cx5 h ASN 375 CO -0.02 0.17 -0.13 0.58 -1.65 0.00 0.00 177.43 176.38 3cx5 h VAL 376 N 0.38 1.27 -0.75 2.81 2.07 -1.05 -2.67 116.25 118.30 3cx5 h VAL 376 Ca 0.20 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.47 3cx5 h VAL 376 Cb 0.16 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 3cx5 h VAL 376 CO -0.18 0.43 0.50 -0.07 0.02 0.00 0.00 177.57 178.27 3cx5 h LEU 377 N 0.75 0.85 -1.24 2.57 4.07 -0.64 0.25 115.31 121.92 3cx5 h LEU 377 Ca 0.12 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.04 3cx5 h LEU 377 Cb 0.68 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.18 3cx5 h LEU 377 CO 0.05 0.61 0.29 -0.26 -1.08 0.00 0.00 178.44 178.06 3cx5 h PHE 378 N 1.01 0.80 0.36 1.13 0.04 -1.11 -0.47 116.94 118.69 3cx5 h PHE 378 Ca 0.28 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 61.01 3cx5 h PHE 378 Cb -0.10 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 37.80 3cx5 h PHE 378 CO -0.02 0.58 -0.17 -0.92 -0.60 0.00 0.00 178.31 177.17 3cx5 h TYR 379 N 0.82 -0.45 0.00 -0.55 3.20 -0.91 -3.34 116.97 115.74 3cx5 h TYR 379 Ca 0.21 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 3cx5 h TYR 379 Cb 0.07 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.48 3cx5 h TYR 379 CO 0.01 -0.28 -0.05 -0.84 -1.64 0.00 0.00 178.16 175.36 3cx5 h ILE 380 N -0.92 0.21 0.00 1.81 3.07 -1.02 -2.36 117.51 118.29 3cx5 h ILE 380 Ca -0.05 -0.40 0.00 0.00 1.55 0.00 0.00 64.86 65.96 3cx5 h ILE 380 Cb 0.37 1.32 0.00 0.00 -0.27 0.00 0.00 36.82 38.24 3cx5 h ILE 380 CO 0.08 0.05 0.00 0.61 -1.05 0.00 0.00 178.15 177.84 3cx5 n GLY 381 N -0.51 -0.68 1.24 0.16 0.00 -0.19 -4.20 105.19 101.01 3cx5 n GLY 381 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3cx5 n GLY 381 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3cx5 n ARG 382 N -1.00 0.00 -1.82 1.61 1.85 -1.13 -5.07 116.66 111.11 3cx5 n ARG 382 Ca 0.16 0.00 -0.40 0.00 -1.00 0.00 0.00 57.85 56.61 3cx5 n ARG 382 Cb 0.07 -0.17 0.01 0.00 -1.05 0.00 0.00 32.46 31.33 3cx5 n ARG 382 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3cx5 s VAL 383 N -1.62 2.10 -0.08 8.89 1.01 -0.90 -4.98 120.40 124.82 3cx5 s VAL 383 Ca 0.00 0.09 -0.14 0.00 0.00 0.00 0.00 61.98 61.94 3cx5 s VAL 383 Cb 0.00 -3.06 -0.10 0.00 0.00 0.00 0.00 36.38 33.22 3cx5 s VAL 383 CO 0.00 0.01 0.48 0.78 0.00 0.00 0.00 175.10 176.38 3cx5 h ASN 384 N 2.43 -0.13 0.00 3.32 2.35 -1.90 -3.45 115.58 118.20 3cx5 h ASN 384 Ca -0.51 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 54.97 3cx5 h ASN 384 Cb 1.26 0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.66 3cx5 h ASN 384 CO 0.62 0.47 0.00 1.17 -1.65 0.00 0.00 177.43 178.03