#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1arx s VAL 10 N 0.00 3.90 -0.06 0.44 1.01 -1.26 -4.99 120.40 119.44 1arx s VAL 10 Ca 0.00 0.85 0.00 0.00 0.00 0.00 0.00 61.98 62.84 1arx s VAL 10 Cb 0.00 -4.42 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1arx s VAL 10 CO 0.00 -1.03 -0.05 0.42 0.00 0.00 0.00 175.10 174.44 1arx s THR 11 N 5.53 3.86 0.09 3.92 -4.23 -1.26 -1.37 115.64 122.18 1arx s THR 11 Ca 0.54 -0.45 -0.01 0.00 -1.18 0.00 0.00 61.69 60.58 1arx s THR 11 Cb -0.11 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 1arx s THR 11 CO 0.28 0.57 0.26 0.00 -0.54 0.00 0.00 174.62 175.20 1arx n PRO 13 N 0.20 -0.04 -0.37 0.00 -0.02 -1.26 0.13 135.00 133.64 1arx n PRO 13 Ca -0.04 0.95 0.04 0.00 -2.02 0.00 0.00 63.50 62.43 1arx n PRO 13 Cb 0.51 -1.72 0.18 0.00 -0.02 0.00 0.00 33.50 32.46 1arx n PRO 13 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1arx n GLY 14 N -1.20 1.80 2.47 -1.23 0.00 -1.26 -4.91 105.19 100.86 1arx n GLY 14 Ca 0.27 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1arx n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1arx n GLY 15 N 0.50 0.94 3.85 -0.02 0.00 0.12 -5.03 105.19 105.54 1arx n GLY 15 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1arx n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1arx s GLN 16 N -0.18 3.91 -0.15 1.61 1.11 -1.24 -4.78 119.66 119.95 1arx s GLN 16 Ca 0.00 0.88 -0.04 0.00 0.01 0.00 0.00 55.36 56.20 1arx s GLN 16 Cb 0.00 -2.17 -0.03 0.00 -1.01 0.00 0.00 33.01 29.80 1arx s GLN 16 CO 0.00 -0.25 0.00 -1.12 0.01 0.00 0.00 175.29 173.93 1arx s SER 17 N -3.14 5.17 0.33 5.90 0.01 -1.26 -0.64 113.70 120.07 1arx s SER 17 Ca 0.58 0.00 0.03 0.00 1.31 0.00 0.00 55.95 57.87 1arx s SER 17 Cb -0.10 -1.77 -0.04 0.00 0.21 0.00 0.00 66.02 64.32 1arx s SER 17 CO 0.32 0.22 0.14 0.28 0.41 0.00 0.00 173.24 174.62 1arx s THR 18 N 0.07 0.48 -0.01 1.44 -1.32 -0.47 -4.99 115.64 110.84 1arx s THR 18 Ca 0.02 -2.00 0.11 0.00 -1.21 0.00 0.00 61.69 58.62 1arx s THR 18 Cb -0.13 -2.51 -0.16 0.00 -1.51 0.00 0.00 72.50 68.19 1arx s THR 18 CO 0.02 0.00 1.04 0.77 -2.21 0.00 0.00 174.62 174.24 1arx h SER 19 N 2.11 0.00 -4.51 8.08 4.64 -1.90 -3.40 113.55 118.57 1arx h SER 19 Ca -0.35 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.79 1arx h SER 19 Cb 1.25 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.11 1arx h SER 19 CO 0.55 0.86 -0.66 0.21 -0.87 0.00 0.00 176.83 176.92 1arx s ASN 20 N -6.34 0.10 0.49 4.97 3.84 -1.26 -4.90 114.94 111.85 1arx s ASN 20 Ca -0.01 -0.24 0.22 0.00 0.21 0.00 0.00 52.86 53.05 1arx s ASN 20 Cb 0.09 0.11 1.29 0.00 -0.55 0.00 0.00 41.25 42.19 1arx s ASN 20 CO 0.81 -0.20 2.05 0.77 -2.79 0.00 0.00 177.10 177.73 1arx h SER 21 N 5.13 0.00 0.24 -4.21 4.64 -1.97 -1.83 113.55 115.56 1arx h SER 21 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1arx h SER 21 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1arx h SER 21 CO 0.44 0.14 0.00 1.56 -0.87 0.00 0.00 176.83 178.10 1arx h GLN 22 N 0.00 0.00 0.00 4.77 4.20 -2.00 -2.45 115.11 119.63 1arx h GLN 22 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1arx h GLN 22 Cb 0.32 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1arx h GLN 22 CO 0.02 0.00 -0.20 0.00 -0.67 0.00 0.00 178.83 177.98 1arx h VAL 25 N 1.08 0.78 0.00 0.00 3.04 -1.80 -2.01 116.25 117.34 1arx h VAL 25 Ca 0.38 -0.43 -0.01 0.00 -1.01 0.00 0.00 66.70 65.63 1arx h VAL 25 Cb 0.11 1.26 -0.00 0.00 -2.01 0.00 0.00 31.29 30.65 1arx h VAL 25 CO -0.13 0.11 -0.04 -0.50 -1.01 0.00 0.00 177.57 176.00 1arx h TRP 26 N 0.00 0.00 -0.01 3.17 4.06 -1.52 0.28 115.95 121.93 1arx h TRP 26 Ca -0.00 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.86 1arx h TRP 26 Cb 0.25 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.39 1arx h TRP 26 CO 0.00 0.04 -0.43 0.74 -3.56 0.00 0.00 178.44 175.22 1arx h PHE 27 N 0.00 0.02 0.04 0.49 0.04 -1.46 0.85 116.94 116.92 1arx h PHE 27 Ca -0.00 -0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.63 1arx h PHE 27 Cb 0.32 -0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.48 1arx h PHE 27 CO 0.00 0.45 -0.57 -0.44 -0.60 0.00 0.00 178.31 177.15 1arx h ASP 28 N 0.01 0.43 0.48 2.17 3.32 -1.10 -2.75 116.42 118.98 1arx h ASP 28 Ca -0.00 -0.84 -0.06 0.00 0.02 0.00 0.00 57.03 56.15 1arx h ASP 28 Cb 0.77 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 1arx h ASP 28 CO 0.06 1.21 -0.28 1.62 -1.72 0.00 0.00 179.24 180.13 1arx h VAL 29 N -0.31 0.94 0.09 -1.35 3.04 -1.39 -1.82 116.25 115.46 1arx h VAL 29 Ca -0.08 -1.06 0.01 0.00 -1.01 0.00 0.00 66.70 64.56 1arx h VAL 29 Cb 1.34 1.62 -0.02 0.00 -2.01 0.00 0.00 31.29 32.22 1arx h VAL 29 CO 0.11 0.28 -0.15 0.25 -1.01 0.00 0.00 177.57 177.04 1arx h LEU 30 N 0.00 -0.42 -0.62 3.16 5.85 -0.71 -1.19 115.31 121.37 1arx h LEU 30 Ca -0.00 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1arx h LEU 30 Cb 0.60 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.76 1arx h LEU 30 CO 0.04 -0.22 0.37 0.44 -0.34 0.00 0.00 178.44 178.72 1arx h ASP 31 N -0.30 0.75 0.18 1.25 3.32 -1.18 -1.36 116.42 119.07 1arx h ASP 31 Ca 0.02 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 1arx h ASP 31 Cb 0.32 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1arx h ASP 31 CO -0.08 0.59 -0.12 -0.78 -1.72 0.00 0.00 179.24 177.13 1arx h ASP 32 N 0.84 -0.31 -0.34 6.45 1.82 -1.15 -2.06 116.42 121.68 1arx h ASP 32 Ca 0.22 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.88 1arx h ASP 32 Cb -0.02 0.10 -0.02 0.00 0.68 0.00 0.00 39.33 40.08 1arx h ASP 32 CO -0.04 -0.19 0.18 -0.07 -1.61 0.00 0.00 179.24 177.50 1arx h LEU 33 N -0.30 0.43 -0.58 2.28 3.38 -0.98 -0.19 115.31 119.35 1arx h LEU 33 Ca -0.01 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1arx h LEU 33 Cb 0.26 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1arx h LEU 33 CO 0.00 0.41 0.36 1.56 0.09 0.00 0.00 178.44 180.87 1arx h GLN 34 N 0.41 0.78 -0.12 1.13 1.08 -1.18 0.79 115.11 118.01 1arx h GLN 34 Ca 0.12 -0.06 -0.20 0.00 -1.45 0.00 0.00 58.65 57.05 1arx h GLN 34 Cb 0.08 -0.17 0.01 0.00 -0.05 0.00 0.00 27.48 27.35 1arx h GLN 34 CO -0.02 0.55 -0.70 1.15 -0.95 0.00 0.00 178.83 178.86 1arx h THR 35 N 0.79 1.31 0.00 -0.54 2.02 -1.31 0.21 112.91 115.39 1arx h THR 35 Ca 0.21 -1.95 0.00 0.00 0.77 0.00 0.00 66.41 65.44 1arx h THR 35 Cb -0.04 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 1arx h THR 35 CO -0.04 0.61 0.00 0.59 0.37 0.00 0.00 175.52 177.04 1arx n ASN 36 N -4.04 0.00 -0.27 4.18 4.13 -0.09 -2.97 115.26 116.20 1arx n ASN 36 Ca -0.08 0.00 0.07 0.00 1.68 0.00 0.00 54.58 56.25 1arx n ASN 36 Cb 0.71 -0.33 0.22 0.00 -1.54 0.00 0.00 39.78 38.84 1arx n ASN 36 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1arx h PHE 37 N 0.00 0.51 -0.54 3.10 3.57 -1.41 0.42 116.94 122.60 1arx h PHE 37 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1arx h PHE 37 Cb 0.00 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.64 1arx h PHE 37 CO 0.00 0.01 0.00 0.66 -2.23 0.00 0.00 178.31 176.75 1arx n TYR 38 N -5.04 0.71 -3.85 0.41 4.01 0.19 -4.85 117.16 108.74 1arx n TYR 38 Ca 0.16 -0.36 -0.25 0.00 -0.16 0.00 0.00 57.90 57.30 1arx n TYR 38 Cb 0.49 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.53 1arx n TYR 38 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1arx n GLN 39 N 1.17 -4.32 -1.24 -0.72 6.02 0.14 -1.07 117.38 117.35 1arx n GLN 39 Ca 0.19 0.53 0.00 0.00 -0.01 0.00 0.00 57.00 57.71 1arx n GLN 39 Cb 0.49 -4.98 0.00 0.00 1.02 0.00 0.00 30.24 26.77 1arx n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1arx n GLY 40 N -1.73 0.59 3.80 1.08 0.00 0.57 -4.47 105.19 105.04 1arx n GLY 40 Ca -0.24 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 1arx n GLY 40 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1arx n SER 41 N -0.23 -5.24 -4.94 1.61 7.64 -0.16 -5.00 113.62 107.31 1arx n SER 41 Ca 0.00 -0.70 -0.24 0.00 1.01 0.00 0.00 58.87 58.94 1arx n SER 41 Cb 0.29 -4.30 0.00 0.00 -1.01 0.00 0.00 64.21 59.20 1arx n SER 41 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1arx s LYS 42 N -6.49 3.26 -0.81 1.43 1.02 -0.23 -4.78 119.74 113.15 1arx s LYS 42 Ca 0.62 -0.25 0.02 0.00 0.02 0.00 0.00 55.97 56.37 1arx s LYS 42 Cb -0.30 -2.52 0.25 0.00 -0.52 0.00 0.00 37.83 34.75 1arx s LYS 42 CO 0.79 -0.19 0.93 0.00 -0.92 0.00 0.00 175.35 175.96 1arx n GLU 44 N 1.32 2.52 -0.31 0.00 1.02 -1.26 -4.82 120.64 119.11 1arx n GLU 44 Ca 0.27 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.57 1arx n GLU 44 Cb 0.38 0.00 0.33 0.00 -0.02 0.00 0.00 31.44 32.13 1arx n GLU 44 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1arx h SER 45 N 0.00 -0.01 -0.88 1.62 0.87 -1.64 -2.26 113.55 111.25 1arx h SER 45 Ca 0.00 0.22 0.16 0.00 -1.23 0.00 0.00 61.79 60.94 1arx h SER 45 Cb 0.00 0.29 -0.10 0.00 -0.44 0.00 0.00 62.40 62.15 1arx h SER 45 CO 0.00 -0.22 0.45 -0.65 -0.53 0.00 0.00 176.83 175.89 1arx h PRO 46 N 0.16 0.59 -0.09 2.24 0.11 -1.90 -1.21 132.00 131.90 1arx h PRO 46 Ca 0.60 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.67 1arx h PRO 46 Cb 1.29 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1arx h PRO 46 CO -0.71 0.39 0.03 0.28 -0.21 0.00 0.00 178.00 177.79 1arx h VAL 47 N 0.61 1.14 -0.77 3.15 2.07 -1.72 -1.70 116.25 119.02 1arx h VAL 47 Ca 0.49 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1arx h VAL 47 Cb 0.74 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1arx h VAL 47 CO -0.39 0.12 0.51 0.03 0.02 0.00 0.00 177.57 177.87 1arx h ARG 48 N -0.02 1.02 -0.38 1.57 3.08 -1.33 -0.79 114.38 117.53 1arx h ARG 48 Ca 0.03 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1arx h ARG 48 Cb 0.17 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1arx h ARG 48 CO -0.00 0.67 0.13 0.87 -1.07 0.00 0.00 179.97 180.57 1arx h LYS 49 N 1.05 0.58 -0.61 0.04 1.79 -1.24 -2.68 116.57 115.51 1arx h LYS 49 Ca 0.28 -0.12 -0.04 0.00 -2.18 0.00 0.00 60.65 58.59 1arx h LYS 49 Cb -0.12 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.42 1arx h LYS 49 CO -0.06 0.58 0.20 0.97 -1.08 0.00 0.00 179.45 180.06 1arx h ILE 50 N 0.47 1.23 -0.31 1.86 -0.00 -0.90 -1.22 117.51 118.64 1arx h ILE 50 Ca 0.12 -0.77 -0.05 0.00 -0.00 0.00 0.00 64.86 64.16 1arx h ILE 50 Cb 0.23 0.55 -0.02 0.00 -0.00 0.00 0.00 36.82 37.58 1arx h ILE 50 CO -0.01 0.30 -0.01 -0.07 -0.00 0.00 0.00 178.15 178.36 1arx h LEU 51 N 0.89 0.44 -0.26 2.19 3.38 -0.84 -0.65 115.31 120.47 1arx h LEU 51 Ca 0.20 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 1arx h LEU 51 Cb 0.24 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1arx h LEU 51 CO -0.01 0.52 -0.09 0.03 0.09 0.00 0.00 178.44 178.98 1arx h ARG 52 N 0.46 0.52 -0.37 1.13 3.08 -1.03 -3.08 114.38 115.08 1arx h ARG 52 Ca 0.10 -0.21 0.01 0.00 0.07 0.00 0.00 59.98 59.95 1arx h ARG 52 Cb 0.32 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1arx h ARG 52 CO 0.01 0.75 0.22 0.82 -1.07 0.00 0.00 179.97 180.71 1arx h ILE 53 N 0.26 1.05 -0.76 2.04 2.04 -0.57 -0.08 117.51 121.48 1arx h ILE 53 Ca 0.06 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1arx h ILE 53 Cb 0.58 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 1arx h ILE 53 CO 0.03 0.08 0.50 1.62 0.00 0.00 0.00 178.15 180.38 1arx h VAL 54 N 0.46 1.17 0.70 1.67 3.04 -1.19 0.12 116.25 122.22 1arx h VAL 54 Ca 0.15 -0.35 -0.03 0.00 -1.01 0.00 0.00 66.70 65.46 1arx h VAL 54 Cb -0.01 0.07 0.01 0.00 -2.01 0.00 0.00 31.29 29.35 1arx h VAL 54 CO -0.06 0.18 -0.34 0.15 -1.01 0.00 0.00 177.57 176.49 1arx h PHE 55 N 1.01 -0.88 0.00 3.17 3.57 -1.39 -1.51 116.94 120.91 1arx h PHE 55 Ca 0.29 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 1arx h PHE 55 Cb -0.07 0.29 -0.00 0.00 2.79 0.00 0.00 35.95 38.95 1arx h PHE 55 CO -0.02 -0.52 -0.09 0.45 -2.23 0.00 0.00 178.31 175.89 1arx h HIS 56 N -1.08 0.00 0.00 0.41 3.86 -0.83 0.77 115.15 118.28 1arx h HIS 56 Ca -0.10 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1arx h HIS 56 Cb 0.75 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.22 1arx h HIS 56 CO -0.01 0.09 -0.00 0.22 0.86 0.00 0.00 177.93 179.10 1arx h ASP 57 N 0.00 -0.01 -0.09 2.45 3.58 -0.67 -3.36 116.42 118.32 1arx h ASP 57 Ca -0.00 -0.61 -0.18 0.00 0.42 0.00 0.00 57.03 56.66 1arx h ASP 57 Cb 0.22 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.27 1arx h ASP 57 CO 0.01 0.61 -0.60 0.00 -2.88 0.00 0.00 179.24 176.38 1arx h ALA 58 N 0.37 0.54 0.00 -0.78 0.00 -0.61 -3.23 119.26 115.55 1arx h ALA 58 Ca -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1arx h ALA 58 Cb 0.61 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1arx h ALA 58 CO 0.00 0.69 0.00 1.51 0.00 0.00 0.00 179.25 181.45 1arx n ILE 59 N -3.96 0.99 -2.04 0.00 0.13 0.20 -4.02 119.36 110.67 1arx n ILE 59 Ca -0.04 0.25 -0.42 0.00 -1.10 0.00 0.00 62.75 61.43 1arx n ILE 59 Cb 0.65 -1.05 0.00 0.00 -0.84 0.00 0.00 39.64 38.40 1arx n ILE 59 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1arx n GLY 60 N -0.30 4.25 3.15 4.50 0.00 -1.22 -4.73 105.19 110.83 1arx n GLY 60 Ca 0.04 -1.72 -0.08 0.00 0.00 0.00 0.00 46.02 44.26 1arx n GLY 60 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1arx s PHE 61 N 2.53 -0.87 -0.27 1.61 5.36 -1.25 -1.91 117.98 123.18 1arx s PHE 61 Ca 0.46 1.32 -0.02 0.00 -0.96 0.00 0.00 56.93 57.73 1arx s PHE 61 Cb 0.11 0.23 0.09 0.00 -0.34 0.00 0.00 43.02 43.11 1arx s PHE 61 CO -0.04 -0.59 0.07 0.45 -1.46 0.00 0.00 175.22 173.65 1arx s SER 62 N 2.61 3.67 0.31 6.13 0.15 0.44 -4.45 113.70 122.56 1arx s SER 62 Ca 0.04 -1.36 0.04 0.00 0.70 0.00 0.00 55.95 55.38 1arx s SER 62 Cb -0.13 -0.77 0.65 0.00 -1.71 0.00 0.00 66.02 64.06 1arx s SER 62 CO -0.14 -0.38 1.84 -0.65 1.20 0.00 0.00 173.24 175.11 1arx h PRO 63 N 8.15 0.86 -0.62 5.44 0.11 -1.87 -2.47 132.00 141.60 1arx h PRO 63 Ca -0.15 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1arx h PRO 63 Cb 1.05 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.93 1arx h PRO 63 CO 0.43 0.57 0.40 0.00 -0.21 0.00 0.00 178.00 179.19 1arx h ALA 64 N 1.57 0.78 -0.59 -0.75 0.00 -1.94 0.34 119.26 118.66 1arx h ALA 64 Ca 0.49 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.30 1arx h ALA 64 Cb 0.60 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1arx h ALA 64 CO -0.26 0.22 0.16 -0.07 0.00 0.00 0.00 179.25 179.30 1arx h LEU 65 N 0.84 0.89 -0.44 0.00 3.38 -1.79 -2.01 115.31 116.18 1arx h LEU 65 Ca 0.23 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1arx h LEU 65 Cb -0.09 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 1arx h LEU 65 CO -0.05 0.88 0.24 0.74 0.09 0.00 0.00 178.44 180.34 1arx h THR 66 N 0.85 1.01 -0.12 0.22 2.02 -1.02 0.48 112.91 116.34 1arx h THR 66 Ca 0.19 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 1arx h THR 66 Cb 0.33 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1arx h THR 66 CO -0.00 0.09 0.07 0.00 0.37 0.00 0.00 175.52 176.05 1arx h ALA 67 N 1.21 1.90 -0.44 6.16 0.00 -0.45 -0.18 119.26 127.46 1arx h ALA 67 Ca 0.18 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 1arx h ALA 67 Cb 0.06 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.71 1arx h ALA 67 CO -0.11 0.09 0.19 0.00 0.00 0.00 0.00 179.25 179.42 1arx n ALA 68 N -2.52 3.76 -2.20 0.00 0.00 -0.80 -4.88 120.51 113.88 1arx n ALA 68 Ca -0.01 -1.34 -0.14 0.00 0.00 0.00 0.00 53.44 51.94 1arx n ALA 68 Cb 0.09 -1.16 -0.01 0.00 0.00 0.00 0.00 19.45 18.36 1arx n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1arx n GLY 69 N -0.04 -0.07 3.52 0.00 0.00 -0.08 -5.02 105.19 103.50 1arx n GLY 69 Ca 0.25 -0.29 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 1arx n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1arx s GLN 70 N -4.59 1.87 0.05 1.61 -1.52 0.11 -5.00 119.66 112.20 1arx s GLN 70 Ca 0.00 -1.42 -0.31 0.00 -1.95 0.00 0.00 55.36 51.69 1arx s GLN 70 Cb 0.00 -2.02 -0.08 0.00 -0.22 0.00 0.00 33.01 30.69 1arx s GLN 70 CO 0.00 0.41 1.59 0.12 -0.25 0.00 0.00 175.29 177.16 1arx s PHE 71 N -1.84 2.52 -1.28 0.91 5.36 -1.26 -3.20 117.98 119.20 1arx s PHE 71 Ca 0.25 0.44 0.24 0.00 -0.96 0.00 0.00 56.93 56.90 1arx s PHE 71 Cb -0.08 -3.89 0.33 0.00 -0.34 0.00 0.00 43.02 39.04 1arx s PHE 71 CO 0.14 -3.52 1.29 0.41 -1.46 0.00 0.00 175.22 172.08 1arx n GLY 72 N 3.91 -0.91 0.00 13.12 0.00 -1.26 -4.71 105.19 115.33 1arx n GLY 72 Ca 0.15 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1arx n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1arx n GLY 73 N 1.46 2.60 1.22 -0.02 0.00 -1.26 -0.42 105.19 108.76 1arx n GLY 73 Ca 0.07 -1.81 0.11 0.00 0.00 0.00 0.00 46.02 44.39 1arx n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1arx n GLY 74 N 0.97 2.08 7.00 -0.02 0.00 -1.19 -4.64 105.19 109.39 1arx n GLY 74 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1arx n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1arx n GLY 75 N 1.55 1.53 2.69 -0.02 0.00 -0.80 -3.96 105.19 106.18 1arx n GLY 75 Ca 0.22 -0.67 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 1arx n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1arx n ALA 76 N 8.17 5.43 0.20 4.61 0.00 -0.75 -4.08 120.51 134.09 1arx n ALA 76 Ca 0.00 -3.42 0.08 0.00 0.00 0.00 0.00 53.44 50.10 1arx n ALA 76 Cb 0.00 -3.45 0.14 0.00 0.00 0.00 0.00 19.45 16.14 1arx n ALA 76 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1arx n ASP 77 N 5.54 2.83 -0.62 0.00 5.75 -1.25 -4.69 116.55 124.11 1arx n ASP 77 Ca 0.57 -1.83 -0.08 0.00 -0.01 0.00 0.00 54.79 53.43 1arx n ASP 77 Cb 0.32 -0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 1arx n ASP 77 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1arx n GLY 78 N 0.92 1.00 0.25 6.12 0.00 -1.26 -3.87 105.19 108.34 1arx n GLY 78 Ca 0.13 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.66 1arx n GLY 78 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1arx h SER 79 N 0.00 0.00 0.27 1.61 4.64 -1.89 -0.89 113.55 117.30 1arx h SER 79 Ca -0.17 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.14 1arx h SER 79 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1arx h SER 79 CO 0.24 0.16 -0.08 -0.29 -0.87 0.00 0.00 176.83 175.99 1arx h ILE 80 N 0.00 0.49 0.00 0.95 2.10 -1.90 0.44 117.51 119.59 1arx h ILE 80 Ca -0.00 -0.36 -0.18 0.00 1.08 0.00 0.00 64.86 65.40 1arx h ILE 80 Cb 0.55 1.24 -0.03 0.00 -1.09 0.00 0.00 36.82 37.49 1arx h ILE 80 CO 0.02 0.07 -1.27 -0.38 -1.08 0.00 0.00 178.15 175.51 1arx n ILE 81 N -3.63 1.50 0.23 2.19 5.41 -0.41 -3.33 119.36 121.32 1arx n ILE 81 Ca -0.02 -0.01 0.10 0.00 1.00 0.00 0.00 62.75 63.82 1arx n ILE 81 Cb 0.19 -2.15 0.67 0.00 -0.71 0.00 0.00 39.64 37.63 1arx n ILE 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1arx h ALA 82 N -0.80 2.02 -1.04 -1.39 0.00 -1.30 -2.48 119.26 114.28 1arx h ALA 82 Ca -0.28 -0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.14 1arx h ALA 82 Cb 1.10 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 18.48 1arx h ALA 82 CO -0.17 -0.08 -0.89 0.72 0.00 0.00 0.00 179.25 178.84 1arx n HIS 83 N -4.47 2.54 0.09 0.00 8.25 0.14 -4.81 115.22 116.96 1arx n HIS 83 Ca -0.02 -2.64 0.03 0.00 -0.26 0.00 0.00 57.72 54.84 1arx n HIS 83 Cb 0.15 -0.23 0.42 0.00 1.12 0.00 0.00 29.99 31.45 1arx n HIS 83 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1arx h SER 84 N 2.52 0.30 -0.81 0.41 4.64 -1.44 -0.62 113.55 118.55 1arx h SER 84 Ca 0.20 -0.04 0.13 0.00 -0.47 0.00 0.00 61.79 61.61 1arx h SER 84 Cb 1.21 -0.08 -0.06 0.00 -0.31 0.00 0.00 62.40 63.17 1arx h SER 84 CO 0.67 0.34 0.53 -0.55 -0.87 0.00 0.00 176.83 176.95 1arx h ASN 85 N 0.33 0.57 0.02 4.97 -0.00 -1.87 -0.73 115.58 118.87 1arx h ASN 85 Ca 0.08 0.03 -0.23 0.00 -0.00 0.00 0.00 56.30 56.17 1arx h ASN 85 Cb 0.19 -0.09 -0.03 0.00 -0.00 0.00 0.00 38.32 38.39 1arx h ASN 85 CO 0.00 0.31 -1.26 0.40 -0.00 0.00 0.00 177.43 176.89 1arx h ILE 86 N 0.62 0.96 -0.03 6.14 2.04 -1.66 -3.40 117.51 122.18 1arx h ILE 86 Ca 0.39 -2.23 -0.14 0.00 1.00 0.00 0.00 64.86 63.88 1arx h ILE 86 Cb 0.66 2.38 -0.02 0.00 -0.74 0.00 0.00 36.82 39.11 1arx h ILE 86 CO -0.16 0.43 -0.65 -0.33 0.00 0.00 0.00 178.15 177.45 1arx h GLU 87 N -0.82 0.12 0.00 2.37 5.08 -1.00 -2.94 114.58 117.38 1arx h GLU 87 Ca -0.33 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1arx h GLU 87 Cb 1.40 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1arx h GLU 87 CO -0.14 0.72 0.00 1.28 -1.00 0.00 0.00 179.01 179.87 1arx n LEU 88 N -3.81 0.00 0.02 1.33 4.77 -0.29 -1.90 117.00 117.11 1arx n LEU 88 Ca -0.02 0.12 0.13 0.00 -0.03 0.00 0.00 56.01 56.21 1arx n LEU 88 Cb 0.64 -0.12 0.41 0.00 -2.33 0.00 0.00 43.42 42.02 1arx n LEU 88 CO 0.44 -0.02 0.69 0.00 -1.33 0.00 0.00 177.39 177.17 1arx n ALA 89 N -1.12 2.86 -1.77 -1.18 0.00 -1.11 -4.55 120.51 113.64 1arx n ALA 89 Ca 0.17 -0.21 -0.39 0.00 0.00 0.00 0.00 53.44 53.02 1arx n ALA 89 Cb 0.14 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.29 1arx n ALA 89 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1arx s PHE 90 N -3.03 2.85 0.46 0.00 0.08 -0.80 -4.94 117.98 112.61 1arx s PHE 90 Ca 0.12 1.45 0.13 0.00 0.12 0.00 0.00 56.93 58.75 1arx s PHE 90 Cb 0.17 -3.60 1.08 0.00 -0.57 0.00 0.00 43.02 40.11 1arx s PHE 90 CO 0.62 -1.92 2.06 -1.00 -0.10 0.00 0.00 175.22 174.88 1arx h PRO 91 N 2.58 0.29 -0.00 0.24 0.13 -1.90 -2.22 132.00 131.11 1arx h PRO 91 Ca -0.49 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1arx h PRO 91 Cb 1.25 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1arx h PRO 91 CO 0.62 0.19 -0.01 0.00 -0.23 0.00 0.00 178.00 178.57 1arx n ALA 92 N -2.52 2.66 -0.97 -0.56 0.00 -1.26 -4.07 120.51 113.79 1arx n ALA 92 Ca 0.04 -0.26 0.08 0.00 0.00 0.00 0.00 53.44 53.30 1arx n ALA 92 Cb 0.21 -1.42 0.31 0.00 0.00 0.00 0.00 19.45 18.55 1arx n ALA 92 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1arx n ASN 93 N -0.76 4.54 -4.83 0.00 3.02 -0.84 -5.02 115.26 111.37 1arx n ASN 93 Ca 0.21 -2.99 -0.32 0.00 -0.03 0.00 0.00 54.58 51.45 1arx n ASN 93 Cb 0.19 -0.59 0.01 0.00 -0.61 0.00 0.00 39.78 38.78 1arx n ASN 93 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1arx s GLY 94 N -1.54 1.89 -0.11 7.41 0.00 -1.26 -3.80 107.32 109.92 1arx s GLY 94 Ca 0.47 0.16 0.00 0.00 0.00 0.00 0.00 44.72 45.35 1arx s GLY 94 CO 0.11 0.46 0.00 0.61 0.00 0.00 0.00 173.10 174.28 1arx n GLY 95 N -1.75 0.49 0.00 0.20 0.00 -1.26 -4.88 105.19 98.00 1arx n GLY 95 Ca 0.07 -0.43 0.05 0.00 0.00 0.00 0.00 46.02 45.71 1arx n GLY 95 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1arx n LEU 96 N -0.11 0.12 -0.28 0.99 4.77 -1.25 -4.73 117.00 116.50 1arx n LEU 96 Ca -0.01 -0.12 0.05 0.00 -0.03 0.00 0.00 56.01 55.90 1arx n LEU 96 Cb 0.06 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.30 1arx n LEU 96 CO 0.02 0.03 0.76 0.74 -1.33 0.00 0.00 177.39 177.61 1arx h THR 97 N 0.00 0.23 -0.52 -5.08 2.02 -1.90 -1.14 112.91 106.52 1arx h THR 97 Ca 0.00 -0.01 -0.08 0.00 0.77 0.00 0.00 66.41 67.09 1arx h THR 97 Cb 0.43 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1arx h THR 97 CO 0.00 0.01 0.01 0.44 0.37 0.00 0.00 175.52 176.35 1arx h ASP 98 N 0.04 0.83 -0.23 4.18 3.32 -2.01 -2.07 116.42 120.48 1arx h ASP 98 Ca 0.43 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 57.21 1arx h ASP 98 Cb 0.73 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1arx h ASP 98 CO -0.78 0.89 -0.11 0.74 -1.72 0.00 0.00 179.24 178.27 1arx h THR 99 N 0.80 1.30 -0.99 0.35 2.02 -1.57 -2.71 112.91 112.11 1arx h THR 99 Ca 0.15 -1.17 0.10 0.00 0.77 0.00 0.00 66.41 66.26 1arx h THR 99 Cb 0.47 1.58 -0.08 0.00 -1.74 0.00 0.00 68.15 68.38 1arx h THR 99 CO 0.02 0.36 0.63 0.40 0.37 0.00 0.00 175.52 177.31 1arx h ILE 100 N 0.20 0.99 -0.40 3.11 1.08 -1.18 0.44 117.51 121.74 1arx h ILE 100 Ca 0.05 -0.36 -0.14 0.00 -0.39 0.00 0.00 64.86 64.02 1arx h ILE 100 Cb 0.60 -0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 1arx h ILE 100 CO 0.03 0.19 -0.30 -0.33 -0.69 0.00 0.00 178.15 177.06 1arx h GLU 101 N 1.06 0.91 -0.73 2.37 4.39 -1.33 0.17 114.58 121.42 1arx h GLU 101 Ca 0.46 -0.44 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 1arx h GLU 101 Cb 0.36 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1arx h GLU 101 CO -0.22 1.10 0.38 0.00 -1.16 0.00 0.00 179.01 179.11 1arx h ALA 102 N 0.80 0.94 -0.30 3.43 0.00 -1.10 -2.36 119.26 120.67 1arx h ALA 102 Ca 0.08 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 1arx h ALA 102 Cb 0.88 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1arx h ALA 102 CO 0.08 0.47 -0.40 -0.07 0.00 0.00 0.00 179.25 179.33 1arx h LEU 103 N 1.01 0.75 -0.29 0.00 3.38 -0.70 -2.92 115.31 116.54 1arx h LEU 103 Ca 0.25 -0.34 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1arx h LEU 103 Cb 0.07 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1arx h LEU 103 CO -0.04 1.06 0.05 -0.09 0.09 0.00 0.00 178.44 179.52 1arx h ARG 104 N 0.58 0.15 -0.49 1.13 2.43 -0.49 -1.83 114.38 115.86 1arx h ARG 104 Ca 0.05 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1arx h ARG 104 Cb 0.94 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.42 1arx h ARG 104 CO 0.09 0.10 0.28 0.00 -1.51 0.00 0.00 179.97 178.93 1arx h ALA 105 N 1.22 0.63 -0.68 2.80 0.00 -1.38 -1.15 119.26 120.69 1arx h ALA 105 Ca 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1arx h ALA 105 Cb 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1arx h ALA 105 CO -0.18 -0.04 0.30 0.28 0.00 0.00 0.00 179.25 179.61 1arx h VAL 106 N 0.56 1.24 -0.55 0.00 2.07 -1.24 -0.39 116.25 117.94 1arx h VAL 106 Ca 0.20 -0.70 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 1arx h VAL 106 Cb 0.05 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1arx h VAL 106 CO -0.11 0.29 0.24 1.23 0.02 0.00 0.00 177.57 179.24 1arx h GLY 107 N 0.96 0.86 1.16 2.17 0.00 -0.94 -0.62 103.07 106.66 1arx h GLY 107 Ca 0.23 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 46.96 1arx h GLY 107 CO -0.02 0.43 -0.32 -2.22 0.00 0.00 0.00 176.54 174.40 1arx h ILE 108 N 0.74 1.27 -0.18 2.60 2.04 -1.02 -0.32 117.51 122.65 1arx h ILE 108 Ca 0.19 -1.49 -0.15 0.00 1.00 0.00 0.00 64.86 64.40 1arx h ILE 108 Cb 0.16 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1arx h ILE 108 CO -0.02 0.50 -0.53 0.78 0.00 0.00 0.00 178.15 178.88 1arx h ASN 109 N 0.78 0.57 0.41 1.72 -0.26 -0.80 -3.16 115.58 114.83 1arx h ASN 109 Ca 0.08 -0.29 0.00 0.00 -0.56 0.00 0.00 56.30 55.52 1arx h ASN 109 Cb 0.90 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 38.00 1arx h ASN 109 CO 0.08 0.99 -0.66 1.41 -1.06 0.00 0.00 177.43 178.19 1arx n HIS 110 N -3.96 0.05 -2.82 1.19 8.25 -0.26 -4.97 115.22 112.70 1arx n HIS 110 Ca -0.03 0.02 -0.13 0.00 -0.26 0.00 0.00 57.72 57.32 1arx n HIS 110 Cb 0.59 -0.24 0.03 0.00 1.12 0.00 0.00 29.99 31.49 1arx n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1arx n GLY 111 N 1.48 0.05 3.72 -1.41 0.00 -0.18 -5.04 105.19 103.82 1arx n GLY 111 Ca 0.05 -0.24 -0.28 0.00 0.00 0.00 0.00 46.02 45.55 1arx n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1arx s VAL 112 N -2.99 4.11 0.59 1.61 -7.23 -0.93 -5.05 120.40 110.52 1arx s VAL 112 Ca 0.22 -1.15 -0.18 0.00 -1.81 0.00 0.00 61.98 59.06 1arx s VAL 112 Cb -0.10 -3.04 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 1arx s VAL 112 CO 0.27 -0.03 1.16 -0.94 -0.31 0.00 0.00 175.10 175.25 1arx s SER 113 N -2.78 5.35 0.31 4.85 1.04 -1.26 -4.69 113.70 116.51 1arx s SER 113 Ca 0.28 2.24 0.00 0.00 0.48 0.00 0.00 55.95 58.96 1arx s SER 113 Cb -0.10 -2.58 0.50 0.00 0.10 0.00 0.00 66.02 63.93 1arx s SER 113 CO 0.20 -1.47 1.91 -0.26 0.98 0.00 0.00 173.24 174.59 1arx h PHE 114 N 0.84 0.83 -0.27 5.02 0.04 -1.87 -1.15 116.94 120.38 1arx h PHE 114 Ca -0.50 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.21 1arx h PHE 114 Cb 1.28 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 39.16 1arx h PHE 114 CO 0.50 0.62 0.04 0.78 -0.60 0.00 0.00 178.31 179.65 1arx h GLY 115 N 0.93 0.48 0.96 -1.45 0.00 -1.84 -1.91 103.07 100.24 1arx h GLY 115 Ca 0.20 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 1arx h GLY 115 CO -0.02 0.30 0.12 -0.55 0.00 0.00 0.00 176.54 176.39 1arx h ASP 116 N 0.26 0.70 -0.67 0.19 3.32 -1.81 -3.03 116.42 115.37 1arx h ASP 116 Ca 0.08 -0.23 0.06 0.00 0.02 0.00 0.00 57.03 56.96 1arx h ASP 116 Cb 0.34 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.65 1arx h ASP 116 CO 0.01 0.74 0.38 0.25 -1.72 0.00 0.00 179.24 178.89 1arx h LEU 117 N 0.62 0.56 -0.99 1.55 5.85 -1.07 -0.78 115.31 121.05 1arx h LEU 117 Ca 0.15 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 1arx h LEU 117 Cb 0.31 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 1arx h LEU 117 CO 0.00 0.37 0.37 0.40 -0.34 0.00 0.00 178.44 179.24 1arx h ILE 118 N 0.70 1.24 -0.49 4.05 2.04 -1.31 -0.01 117.51 123.73 1arx h ILE 118 Ca 0.30 -0.67 -0.12 0.00 1.00 0.00 0.00 64.86 65.37 1arx h ILE 118 Cb 0.18 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1arx h ILE 118 CO -0.18 0.29 -0.18 1.56 0.00 0.00 0.00 178.15 179.64 1arx h GLN 119 N 1.09 0.97 0.28 2.37 1.08 -1.16 -2.21 115.11 117.52 1arx h GLN 119 Ca 0.26 -0.39 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 1arx h GLN 119 Cb 0.10 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1arx h GLN 119 CO -0.03 1.07 -0.13 0.35 -0.95 0.00 0.00 178.83 179.13 1arx h PHE 120 N 0.85 -0.34 -0.43 2.96 3.57 -0.97 -1.82 116.94 120.75 1arx h PHE 120 Ca 0.12 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 1arx h PHE 120 Cb 0.75 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 1arx h PHE 120 CO 0.05 -0.10 0.29 0.00 -2.23 0.00 0.00 178.31 176.31 1arx h ALA 121 N 0.14 1.82 -0.10 2.41 0.00 -0.98 -0.92 119.26 121.64 1arx h ALA 121 Ca -0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1arx h ALA 121 Cb 0.40 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1arx h ALA 121 CO 0.06 0.12 0.01 1.15 0.00 0.00 0.00 179.25 180.59 1arx h THR 122 N 0.46 1.24 0.01 0.00 2.02 -1.11 0.38 112.91 115.91 1arx h THR 122 Ca 0.17 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 1arx h THR 122 Cb 0.12 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 1arx h THR 122 CO -0.04 0.21 -0.00 0.00 0.37 0.00 0.00 175.52 176.06 1arx h ALA 123 N 0.75 -0.01 -0.53 6.16 0.00 -0.52 -1.74 119.26 123.37 1arx h ALA 123 Ca 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1arx h ALA 123 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1arx h ALA 123 CO 0.00 -0.50 0.25 0.28 0.00 0.00 0.00 179.25 179.28 1arx h VAL 124 N -0.02 1.20 -0.31 0.00 2.07 -1.25 -2.16 116.25 115.79 1arx h VAL 124 Ca -0.00 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 66.97 1arx h VAL 124 Cb 0.02 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1arx h VAL 124 CO 0.00 0.22 0.16 1.23 0.02 0.00 0.00 177.57 179.21 1arx h GLY 125 N 0.71 0.41 1.94 2.17 0.00 -0.78 -2.01 103.07 105.51 1arx h GLY 125 Ca 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1arx h GLY 125 CO -0.02 0.09 0.01 -0.33 0.00 0.00 0.00 176.54 176.29 1arx h MET 126 N 0.33 0.08 0.00 4.80 2.86 -1.19 -1.06 114.93 120.76 1arx h MET 126 Ca 0.13 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1arx h MET 126 Cb 0.03 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1arx h MET 126 CO -0.08 0.09 0.00 0.66 1.06 0.00 0.00 176.91 178.64 1arx h SER 127 N 0.09 0.00 0.47 1.22 4.64 -0.69 -1.37 113.55 117.91 1arx h SER 127 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1arx h SER 127 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1arx h SER 127 CO -0.00 0.00 -0.19 0.59 -0.87 0.00 0.00 176.83 176.35 1arx n ASN 128 N -2.64 0.48 -4.49 4.97 5.03 -0.40 -4.03 115.26 114.18 1arx n ASN 128 Ca 0.00 -0.39 -0.36 0.00 0.87 0.00 0.00 54.58 54.70 1arx n ASN 128 Cb 0.19 -0.04 -0.12 0.00 -1.02 0.00 0.00 39.78 38.79 1arx n ASN 128 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1arx n PRO 130 N 4.70 2.20 -0.03 0.00 -0.02 -1.25 -2.64 135.00 137.96 1arx n PRO 130 Ca -0.16 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1arx n PRO 130 Cb 0.52 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1arx n PRO 130 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1arx n GLY 131 N 1.44 0.92 3.77 -1.23 0.00 -0.27 -0.66 105.19 109.17 1arx n GLY 131 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1arx n GLY 131 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1arx s SER 132 N -2.66 6.65 0.86 1.61 0.01 -1.08 -4.74 113.70 114.35 1arx s SER 132 Ca 0.00 2.21 -0.12 0.00 1.31 0.00 0.00 55.95 59.36 1arx s SER 132 Cb 0.00 -2.60 0.11 0.00 0.21 0.00 0.00 66.02 63.74 1arx s SER 132 CO 0.00 -0.58 1.10 -2.16 0.41 0.00 0.00 173.24 172.01 1arx s PRO 133 N -2.33 1.54 -0.43 12.44 0.04 -1.26 -4.52 135.00 140.49 1arx s PRO 133 Ca 0.57 0.68 -0.21 0.00 0.04 0.00 0.00 61.00 62.08 1arx s PRO 133 Cb -0.27 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.44 1arx s PRO 133 CO 0.34 -2.01 0.68 1.03 0.04 0.00 0.00 177.00 177.08 1arx s ARG 134 N -5.06 3.38 0.46 4.56 0.52 -1.26 -4.77 118.95 116.78 1arx s ARG 134 Ca 0.62 -0.23 -0.21 0.00 -0.52 0.00 0.00 55.73 55.39 1arx s ARG 134 Cb -0.16 -3.92 -0.09 0.00 0.52 0.00 0.00 34.95 31.30 1arx s ARG 134 CO 0.56 -0.99 1.02 -0.51 0.02 0.00 0.00 175.30 175.40 1arx s LEU 135 N 2.92 3.93 0.58 2.53 1.02 -1.26 -5.03 118.68 123.37 1arx s LEU 135 Ca 0.25 1.91 -0.19 0.00 0.02 0.00 0.00 54.13 56.11 1arx s LEU 135 Cb -0.14 -4.47 -0.04 0.00 0.02 0.00 0.00 46.19 41.56 1arx s LEU 135 CO 0.19 -0.64 1.23 -0.70 0.02 0.00 0.00 176.35 176.45 1arx s GLU 136 N -3.05 3.03 -0.05 1.70 2.12 -1.26 -4.93 118.70 116.26 1arx s GLU 136 Ca 0.64 1.89 -0.01 0.00 0.36 0.00 0.00 54.97 57.85 1arx s GLU 136 Cb -0.16 -2.00 0.03 0.00 0.26 0.00 0.00 34.13 32.25 1arx s GLU 136 CO 0.20 -1.18 0.04 0.12 -0.54 0.00 0.00 175.26 173.90 1arx s PHE 137 N -1.53 0.24 0.11 5.30 5.36 -1.26 -4.93 117.98 121.26 1arx s PHE 137 Ca 0.76 0.12 0.11 0.00 -0.96 0.00 0.00 56.93 56.95 1arx s PHE 137 Cb -0.32 -0.54 -0.04 0.00 -0.34 0.00 0.00 43.02 41.79 1arx s PHE 137 CO 0.35 -0.21 -0.27 -0.51 -1.46 0.00 0.00 175.22 173.13 1arx s LEU 138 N 1.93 2.28 0.16 6.12 2.01 -1.26 -0.54 118.68 129.38 1arx s LEU 138 Ca 0.03 -0.71 0.07 0.00 0.01 0.00 0.00 54.13 53.53 1arx s LEU 138 Cb -0.12 -1.24 -0.04 0.00 0.01 0.00 0.00 46.19 44.79 1arx s LEU 138 CO -0.03 0.20 -0.15 0.28 1.01 0.00 0.00 176.35 177.66 1arx s THR 139 N -0.99 1.57 0.00 5.49 -1.32 0.42 -4.87 115.64 115.94 1arx s THR 139 Ca 0.13 -1.95 0.00 0.00 -1.21 0.00 0.00 61.69 58.66 1arx s THR 139 Cb -0.10 -1.80 0.00 0.00 -1.51 0.00 0.00 72.50 69.09 1arx s THR 139 CO 0.05 -0.47 0.00 0.61 -2.21 0.00 0.00 174.62 172.60 1arx n GLY 140 N 0.13 1.04 3.74 6.08 0.00 -1.26 -0.66 105.19 114.25 1arx n GLY 140 Ca -0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1arx n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1arx s ARG 141 N 0.00 4.17 0.47 1.61 0.52 -1.26 -4.93 118.95 119.53 1arx s ARG 141 Ca 0.00 2.50 -0.24 0.00 -0.52 0.00 0.00 55.73 57.46 1arx s ARG 141 Cb 0.00 -3.07 -0.08 0.00 0.52 0.00 0.00 34.95 32.32 1arx s ARG 141 CO 0.00 -0.62 1.38 0.45 0.02 0.00 0.00 175.30 176.53 1arx n SER 142 N 2.97 2.97 0.24 0.23 2.88 -1.26 -4.71 113.62 116.95 1arx n SER 142 Ca 0.11 1.07 0.14 0.00 -1.33 0.00 0.00 58.87 58.86 1arx n SER 142 Cb 0.38 -1.57 0.39 0.00 -0.75 0.00 0.00 64.21 62.66 1arx n SER 142 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1arx h ASN 143 N 2.00 0.00 -3.30 -3.46 -1.24 -1.91 -3.44 115.58 104.21 1arx h ASN 143 Ca -0.50 0.00 -0.53 0.00 0.71 0.00 0.00 56.30 55.98 1arx h ASN 143 Cb 1.28 0.00 0.02 0.00 0.73 0.00 0.00 38.32 40.35 1arx h ASN 143 CO 0.60 0.01 0.61 -0.55 -1.29 0.00 0.00 177.43 176.80 1arx s SER 144 N -5.99 7.00 0.16 1.15 0.15 -1.26 -4.80 113.70 110.11 1arx s SER 144 Ca 0.04 2.22 -0.14 0.00 0.70 0.00 0.00 55.95 58.77 1arx s SER 144 Cb 0.07 -2.60 0.02 0.00 -1.71 0.00 0.00 66.02 61.80 1arx s SER 144 CO 0.62 -0.48 0.40 -0.94 1.20 0.00 0.00 173.24 174.04 1arx s SER 145 N 0.59 -0.15 0.21 5.45 1.04 -1.26 -5.03 113.70 114.54 1arx s SER 145 Ca 0.57 -0.55 0.10 0.00 0.48 0.00 0.00 55.95 56.56 1arx s SER 145 Cb -0.33 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.24 1arx s SER 145 CO 0.34 -0.93 -0.15 -1.10 0.98 0.00 0.00 173.24 172.38 1arx s GLN 146 N -3.88 1.86 0.40 4.02 -0.21 -1.26 -5.04 119.66 115.55 1arx s GLN 146 Ca 0.09 -1.46 -0.27 0.00 0.02 0.00 0.00 55.36 53.74 1arx s GLN 146 Cb 0.01 -1.99 -0.10 0.00 1.00 0.00 0.00 33.01 31.93 1arx s GLN 146 CO -0.05 0.40 1.48 -1.25 -2.12 0.00 0.00 175.29 173.75 1arx s PRO 147 N -3.02 3.98 0.48 2.91 0.04 -1.26 -4.73 135.00 133.40 1arx s PRO 147 Ca 0.25 2.56 -0.23 0.00 0.04 0.00 0.00 61.00 63.62 1arx s PRO 147 Cb -0.07 -2.88 -0.07 0.00 0.04 0.00 0.00 34.50 31.52 1arx s PRO 147 CO 0.14 -0.63 1.31 0.45 0.04 0.00 0.00 177.00 178.31 1arx s SER 148 N -0.21 5.80 0.75 6.66 0.15 -1.26 -4.85 113.70 120.73 1arx s SER 148 Ca 0.55 2.65 -0.15 0.00 0.70 0.00 0.00 55.95 59.71 1arx s SER 148 Cb -0.46 -2.63 0.05 0.00 -1.71 0.00 0.00 66.02 61.26 1arx s SER 148 CO 0.62 -1.20 1.22 -2.84 1.20 0.00 0.00 173.24 172.24 1arx s PRO 149 N -2.64 2.01 0.94 5.44 0.02 -1.26 -4.95 135.00 134.56 1arx s PRO 149 Ca 0.65 1.80 -0.13 0.00 0.02 0.00 0.00 61.00 63.34 1arx s PRO 149 Cb -0.38 -1.81 0.16 0.00 0.02 0.00 0.00 34.50 32.49 1arx s PRO 149 CO 0.46 -1.94 1.16 -1.25 -0.33 0.00 0.00 177.00 175.09 1arx s PRO 150 N -3.92 0.90 -2.00 5.54 0.04 -1.26 -4.42 135.00 129.88 1arx s PRO 150 Ca 0.75 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1arx s PRO 150 Cb -0.30 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1arx s PRO 150 CO 0.46 -2.34 0.00 0.43 0.04 0.00 0.00 177.00 175.60 1arx n SER 151 N -3.84 -5.61 -0.85 6.66 7.64 -1.26 -4.88 113.62 111.47 1arx n SER 151 Ca 0.08 0.29 0.10 0.00 1.01 0.00 0.00 58.87 60.35 1arx n SER 151 Cb 0.59 -4.80 0.12 0.00 -1.01 0.00 0.00 64.21 59.11 1arx n SER 151 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1arx n LEU 152 N -2.58 2.83 -4.64 -3.43 4.77 -1.26 -4.91 117.00 107.78 1arx n LEU 152 Ca -0.22 -1.19 -0.37 0.00 -0.03 0.00 0.00 56.01 54.19 1arx n LEU 152 Cb 0.68 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.59 1arx n LEU 152 CO 0.30 0.54 -0.11 -0.63 -1.33 0.00 0.00 177.39 176.17 1arx s ILE 153 N -1.51 5.30 0.33 -0.08 1.01 -1.26 -4.75 121.20 120.24 1arx s ILE 153 Ca 0.26 0.30 -0.29 0.00 0.00 0.00 0.00 60.65 60.93 1arx s ILE 153 Cb 0.17 -3.56 -0.12 0.00 0.01 0.00 0.00 42.46 38.96 1arx s ILE 153 CO 0.25 0.29 1.39 -2.65 0.00 0.00 0.00 174.94 174.22 1arx n PRO 154 N 4.62 2.31 -4.37 2.79 -0.02 -1.26 -5.00 135.00 134.06 1arx n PRO 154 Ca -0.13 0.81 -0.24 0.00 -2.02 0.00 0.00 63.50 61.93 1arx n PRO 154 Cb 0.52 -2.46 -0.09 0.00 -0.02 0.00 0.00 33.50 31.45 1arx n PRO 154 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1arx s GLY 155 N -0.09 1.82 0.61 -1.23 0.00 -1.26 -5.01 107.32 102.16 1arx s GLY 155 Ca 0.58 -1.80 0.39 0.00 0.00 0.00 0.00 44.72 43.89 1arx s GLY 155 CO 0.59 -1.85 2.17 -0.56 0.00 0.00 0.00 173.10 173.45 1arx h PRO 156 N 2.02 0.00 -0.10 2.90 0.13 -1.97 -2.75 132.00 132.23 1arx h PRO 156 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1arx h PRO 156 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1arx h PRO 156 CO 0.61 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 1arx n GLY 157 N -0.48 0.60 3.81 1.56 0.00 -1.26 -2.48 105.19 106.95 1arx n GLY 157 Ca -0.01 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.13 1arx n GLY 157 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1arx s ASN 158 N -1.85 6.17 0.83 1.61 0.02 -1.04 -5.03 114.94 115.65 1arx s ASN 158 Ca 0.34 1.75 -0.12 0.00 -1.02 0.00 0.00 52.86 53.81 1arx s ASN 158 Cb 0.20 -2.53 0.09 0.00 0.02 0.00 0.00 41.25 39.03 1arx s ASN 158 CO 0.31 -0.90 1.11 0.42 0.02 0.00 0.00 177.10 178.06 1arx s THR 159 N -2.43 2.75 0.23 1.60 -4.23 -1.26 -4.77 115.64 107.53 1arx s THR 159 Ca 0.63 0.24 -0.08 0.00 -1.18 0.00 0.00 61.69 61.30 1arx s THR 159 Cb -0.14 -2.99 0.20 0.00 1.34 0.00 0.00 72.50 70.91 1arx s THR 159 CO 0.32 -0.32 1.88 0.58 -0.54 0.00 0.00 174.62 176.54 1arx h VAL 160 N -1.21 1.24 -0.28 2.29 2.07 -1.96 -1.96 116.25 116.44 1arx h VAL 160 Ca -0.48 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 66.56 1arx h VAL 160 Cb 1.29 -0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 1arx h VAL 160 CO 0.60 0.25 0.05 0.74 0.02 0.00 0.00 177.57 179.23 1arx h THR 161 N 1.21 0.85 -0.52 2.57 2.02 -1.98 0.16 112.91 117.22 1arx h THR 161 Ca 0.32 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.45 1arx h THR 161 Cb -0.06 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1arx h THR 161 CO -0.06 0.03 0.33 0.00 0.37 0.00 0.00 175.52 176.18 1arx h ALA 162 N 1.22 0.66 -0.06 6.16 0.00 -1.86 0.73 119.26 126.11 1arx h ALA 162 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1arx h ALA 162 Cb 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1arx h ALA 162 CO -0.18 0.13 0.02 0.82 0.00 0.00 0.00 179.25 180.04 1arx h ILE 163 N 0.70 1.18 -0.52 0.00 2.04 -0.89 -1.56 117.51 118.47 1arx h ILE 163 Ca 0.19 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 1arx h ILE 163 Cb -0.04 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 1arx h ILE 163 CO -0.04 0.15 0.17 -0.07 0.00 0.00 0.00 178.15 178.36 1arx h LEU 164 N -0.10 0.70 -0.40 1.44 3.38 -0.42 -0.06 115.31 119.84 1arx h LEU 164 Ca 0.02 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1arx h LEU 164 Cb 0.23 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1arx h LEU 164 CO -0.00 0.67 -0.17 0.44 0.09 0.00 0.00 178.44 179.46 1arx h ASP 165 N 0.75 0.85 -0.31 -0.43 3.32 -0.67 0.16 116.42 120.10 1arx h ASP 165 Ca 0.17 -0.40 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 1arx h ASP 165 Cb 0.21 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1arx h ASP 165 CO -0.01 1.06 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.37 1arx h ARG 166 N 0.65 0.62 -0.52 3.56 9.65 -0.92 -1.55 114.38 125.86 1arx h ARG 166 Ca 0.09 -0.25 -0.12 0.00 -1.10 0.00 0.00 59.98 58.60 1arx h ARG 166 Cb 0.73 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.26 1arx h ARG 166 CO 0.06 0.82 -0.14 0.52 2.80 0.00 0.00 179.97 184.03 1arx h MET 167 N 0.38 1.01 -0.76 0.20 2.86 -0.98 -2.52 114.93 115.12 1arx h MET 167 Ca 0.07 -0.39 -0.04 0.00 -2.06 0.00 0.00 59.70 57.29 1arx h MET 167 Cb 0.62 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1arx h MET 167 CO 0.04 1.07 0.33 0.78 1.06 0.00 0.00 176.91 180.19 1arx h GLY 168 N 0.92 1.21 0.98 8.32 0.00 -0.57 -0.07 103.07 113.85 1arx h GLY 168 Ca 0.13 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 1arx h GLY 168 CO 0.05 0.60 0.28 -1.80 0.00 0.00 0.00 176.54 175.68 1arx h ASP 169 N 1.09 0.69 -0.05 0.19 3.58 -1.06 -1.32 116.42 119.54 1arx h ASP 169 Ca 0.26 -0.11 0.01 0.00 0.42 0.00 0.00 57.03 57.61 1arx h ASP 169 Cb 0.17 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 1arx h ASP 169 CO -0.03 0.60 0.04 0.00 -2.88 0.00 0.00 179.24 176.97 1arx h ALA 170 N 1.12 2.01 0.00 -0.78 0.00 -1.22 -3.39 119.26 117.00 1arx h ALA 170 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1arx h ALA 170 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1arx h ALA 170 CO -0.03 -0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1arx n GLY 171 N -1.54 -0.11 3.82 0.00 0.00 -0.50 -4.96 105.19 101.90 1arx n GLY 171 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1arx n GLY 171 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1arx s PHE 172 N -0.77 3.49 0.67 1.61 0.08 -0.10 -4.94 117.98 118.01 1arx s PHE 172 Ca 0.00 0.43 -0.11 0.00 0.12 0.00 0.00 56.93 57.37 1arx s PHE 172 Cb 0.00 -1.94 -0.01 0.00 -0.57 0.00 0.00 43.02 40.50 1arx s PHE 172 CO 0.00 0.63 1.06 -1.54 -0.10 0.00 0.00 175.22 175.27 1arx s SER 173 N -0.83 5.81 0.32 1.36 1.04 -1.26 -3.01 113.70 117.13 1arx s SER 173 Ca 0.14 1.29 0.08 0.00 0.48 0.00 0.00 55.95 57.93 1arx s SER 173 Cb -0.12 -2.21 0.80 0.00 0.10 0.00 0.00 66.02 64.59 1arx s SER 173 CO 0.03 -1.12 1.77 -0.65 0.98 0.00 0.00 173.24 174.25 1arx h PRO 174 N -0.50 0.68 -0.78 4.02 0.11 -1.92 -0.99 132.00 132.61 1arx h PRO 174 Ca -0.44 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 1arx h PRO 174 Cb 1.22 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 1arx h PRO 174 CO 0.63 0.45 0.37 -0.44 -0.21 0.00 0.00 178.00 178.80 1arx h ASP 175 N 0.70 1.03 0.83 -2.05 5.19 -1.93 -2.65 116.42 117.54 1arx h ASP 175 Ca 0.59 -0.14 -0.06 0.00 -0.62 0.00 0.00 57.03 56.81 1arx h ASP 175 Cb 1.01 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 1arx h ASP 175 CO -0.39 0.88 -0.27 -0.33 -3.12 0.00 0.00 179.24 176.01 1arx h GLU 176 N 1.11 0.00 -0.14 3.56 5.08 -1.56 -1.46 114.58 121.17 1arx h GLU 176 Ca 0.27 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 1arx h GLU 176 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1arx h GLU 176 CO -0.03 0.27 0.00 0.28 -1.00 0.00 0.00 179.01 178.53 1arx h VAL 177 N 0.00 1.25 -0.44 3.13 2.07 -1.11 -1.35 116.25 119.81 1arx h VAL 177 Ca -0.00 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1arx h VAL 177 Cb 0.76 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1arx h VAL 177 CO 0.04 0.24 0.23 0.58 0.02 0.00 0.00 177.57 178.67 1arx h VAL 178 N -0.01 1.17 -0.85 2.57 2.07 -1.21 -2.42 116.25 117.57 1arx h VAL 178 Ca 0.04 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.13 1arx h VAL 178 Cb 0.36 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.75 1arx h VAL 178 CO 0.01 0.18 0.55 0.44 0.02 0.00 0.00 177.57 178.77 1arx h ASP 179 N 0.57 0.92 -0.08 0.57 3.32 -1.15 -2.21 116.42 118.36 1arx h ASP 179 Ca 0.15 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 1arx h ASP 179 Cb 0.08 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1arx h ASP 179 CO -0.02 0.64 -0.03 0.25 -1.72 0.00 0.00 179.24 178.36 1arx h LEU 180 N 1.09 0.26 0.00 1.55 5.85 -0.93 -2.64 115.31 120.49 1arx h LEU 180 Ca 0.33 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1arx h LEU 180 Cb -0.02 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.94 1arx h LEU 180 CO -0.11 0.34 0.00 0.18 -0.34 0.00 0.00 178.44 178.51 1arx n LEU 181 N -4.35 0.00 0.30 2.25 4.77 -0.83 -2.71 117.00 116.43 1arx n LEU 181 Ca -0.00 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.16 1arx n LEU 181 Cb 0.20 0.00 0.89 0.00 -2.33 0.00 0.00 43.42 42.19 1arx n LEU 181 CO 0.37 0.00 1.06 0.00 -1.33 0.00 0.00 177.39 177.49 1arx h ALA 182 N 3.10 1.10 0.00 -1.18 0.00 -1.56 -2.02 119.26 118.71 1arx h ALA 182 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1arx h ALA 182 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1arx h ALA 182 CO 0.00 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.30 1arx h ALA 183 N 1.96 1.00 0.00 0.00 0.00 -1.77 -0.02 119.26 120.42 1arx h ALA 183 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1arx h ALA 183 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1arx h ALA 183 CO 0.01 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.98 1arx n HIS 184 N -2.63 0.00 0.57 0.00 -0.00 -0.76 -1.33 115.22 111.08 1arx n HIS 184 Ca -0.01 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.84 1arx n HIS 184 Cb 0.10 0.00 0.41 0.00 -0.00 0.00 0.00 29.99 30.50 1arx n HIS 184 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1arx h SER 185 N 0.00 0.00 -2.16 0.41 0.87 -1.19 -3.29 113.55 108.19 1arx h SER 185 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.97 1arx h SER 185 Cb 0.00 0.00 -0.41 0.00 -0.44 0.00 0.00 62.40 61.55 1arx h SER 185 CO 0.00 0.00 -0.72 0.18 -0.53 0.00 0.00 176.83 175.76 1arx n LEU 186 N -2.32 3.05 -3.73 2.23 7.99 -0.44 -4.30 117.00 119.48 1arx n LEU 186 Ca 0.05 -5.31 -0.10 0.00 -0.01 0.00 0.00 56.01 50.64 1arx n LEU 186 Cb 0.41 -0.35 -0.06 0.00 -0.11 0.00 0.00 43.42 43.31 1arx n LEU 186 CO 0.29 2.10 0.07 0.00 -1.51 0.00 0.00 177.39 178.35 1arx s ALA 187 N -2.34 -0.64 0.35 -1.18 0.00 -1.24 -4.71 121.76 111.99 1arx s ALA 187 Ca 0.40 -0.30 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 1arx s ALA 187 Cb 0.17 0.65 0.03 0.00 0.00 0.00 0.00 23.12 23.97 1arx s ALA 187 CO -0.05 -0.61 0.63 -1.54 0.00 0.00 0.00 175.76 174.20 1arx s SER 188 N -2.84 0.32 0.16 0.00 1.04 -1.26 -1.51 113.70 109.61 1arx s SER 188 Ca 0.05 -1.21 0.10 0.00 0.48 0.00 0.00 55.95 55.37 1arx s SER 188 Cb 0.03 0.74 -0.04 0.00 0.10 0.00 0.00 66.02 66.85 1arx s SER 188 CO -0.10 -1.46 -0.24 0.00 0.98 0.00 0.00 173.24 172.42 1arx s GLN 189 N -2.90 1.39 -0.01 4.02 1.03 -1.00 -4.91 119.66 117.28 1arx s GLN 189 Ca 0.22 -1.40 -0.00 0.00 0.04 0.00 0.00 55.36 54.21 1arx s GLN 189 Cb -0.03 -1.72 -0.01 0.00 0.03 0.00 0.00 33.01 31.28 1arx s GLN 189 CO 0.14 0.38 -0.01 0.39 -2.54 0.00 0.00 175.29 173.65 1arx n GLU 190 N 0.58 0.03 0.00 9.60 1.02 -1.26 -1.04 120.64 129.58 1arx n GLU 190 Ca -0.15 0.01 0.11 0.00 -0.02 0.00 0.00 57.16 57.10 1arx n GLU 190 Cb 0.55 -0.96 0.01 0.00 -0.02 0.00 0.00 31.44 31.02 1arx n GLU 190 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1arx n GLY 191 N 3.37 -0.94 0.10 0.62 0.00 -1.26 -3.87 105.19 103.21 1arx n GLY 191 Ca -0.02 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 1arx n GLY 191 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1arx h LEU 192 N 0.31 0.35 -6.39 0.99 4.07 -1.89 -3.42 115.31 109.33 1arx h LEU 192 Ca 0.00 -0.42 -0.36 0.00 0.08 0.00 0.00 57.88 57.18 1arx h LEU 192 Cb 0.53 -0.11 -0.31 0.00 1.08 0.00 0.00 40.66 41.84 1arx h LEU 192 CO 0.00 1.34 -0.67 0.21 -1.08 0.00 0.00 178.44 178.24 1arx s ASN 193 N -6.99 1.26 0.00 -0.43 3.04 -1.26 -2.16 114.94 108.40 1arx s ASN 193 Ca -0.06 -1.37 0.19 0.00 0.04 0.00 0.00 52.86 51.67 1arx s ASN 193 Cb 0.07 0.56 0.89 0.00 -1.54 0.00 0.00 41.25 41.23 1arx s ASN 193 CO 0.86 -0.29 1.61 -1.54 -3.04 0.00 0.00 177.10 174.71 1arx n SER 194 N 4.51 0.00 0.24 -4.21 3.41 -1.25 -1.95 113.62 114.37 1arx n SER 194 Ca 0.08 0.29 0.13 0.00 -0.26 0.00 0.00 58.87 59.11 1arx n SER 194 Cb 0.45 -0.41 0.54 0.00 -0.26 0.00 0.00 64.21 64.53 1arx n SER 194 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1arx h ALA 195 N 2.77 1.02 -2.18 7.33 0.00 -1.95 -3.16 119.26 123.09 1arx h ALA 195 Ca 0.00 -0.12 -0.56 0.00 0.00 0.00 0.00 54.91 54.23 1arx h ALA 195 Cb 0.27 -0.02 -0.41 0.00 0.00 0.00 0.00 17.79 17.63 1arx h ALA 195 CO 0.00 0.17 -0.83 0.44 0.00 0.00 0.00 179.25 179.03 1arx n ILE 196 N -3.28 1.82 -1.68 0.00 -5.35 -0.82 -4.95 119.36 105.09 1arx n ILE 196 Ca 0.00 -5.16 -0.44 0.00 -0.27 0.00 0.00 62.75 56.88 1arx n ILE 196 Cb 0.38 -1.17 -0.03 0.00 -1.74 0.00 0.00 39.64 37.08 1arx n ILE 196 CO 0.00 0.00 0.00 0.33 -1.76 0.00 0.00 176.55 175.12 1arx n PHE 197 N 0.13 2.29 -2.60 4.28 7.35 -1.20 -1.96 117.46 125.75 1arx n PHE 197 Ca 0.29 0.37 -0.21 0.00 -0.76 0.00 0.00 57.45 57.14 1arx n PHE 197 Cb 0.48 -2.50 0.01 0.00 0.35 0.00 0.00 39.48 37.82 1arx n PHE 197 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1arx n ARG 198 N 2.32 -2.72 -1.90 -4.13 1.74 -0.21 -4.80 116.66 106.96 1arx n ARG 198 Ca 0.12 0.94 -0.42 0.00 -0.77 0.00 0.00 57.85 57.72 1arx n ARG 198 Cb 0.32 -5.62 -0.03 0.00 -1.02 0.00 0.00 32.46 26.11 1arx n ARG 198 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1arx s SER 199 N -2.31 6.59 0.67 0.55 1.04 -0.83 -0.68 113.70 118.72 1arx s SER 199 Ca 0.10 2.49 -0.16 0.00 0.48 0.00 0.00 55.95 58.86 1arx s SER 199 Cb -0.05 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.52 1arx s SER 199 CO 0.13 -0.91 1.15 -2.84 0.98 0.00 0.00 173.24 171.75 1arx s PRO 200 N 2.96 2.64 0.16 4.02 0.02 -1.25 -2.37 135.00 141.18 1arx s PRO 200 Ca 0.75 1.57 0.23 0.00 0.02 0.00 0.00 61.00 63.57 1arx s PRO 200 Cb -0.40 -1.91 -0.00 0.00 0.02 0.00 0.00 34.50 32.21 1arx s PRO 200 CO 0.33 -1.40 1.00 1.28 -0.33 0.00 0.00 177.00 177.88 1arx n LEU 201 N -2.35 0.73 -4.19 -5.54 4.32 -0.57 -0.91 117.00 108.50 1arx n LEU 201 Ca 0.12 0.26 -0.13 0.00 -0.02 0.00 0.00 56.01 56.23 1arx n LEU 201 Cb 0.51 -0.07 -0.09 0.00 -1.62 0.00 0.00 43.42 42.15 1arx n LEU 201 CO 0.47 -0.14 -0.16 1.51 -1.22 0.00 0.00 177.39 177.85 1arx s ASP 202 N -5.05 0.38 0.00 -1.43 -4.77 -1.26 -4.83 116.67 99.71 1arx s ASP 202 Ca -0.00 -1.40 0.19 0.00 -3.30 0.00 0.00 52.55 48.04 1arx s ASP 202 Cb 0.11 0.44 1.00 0.00 -1.09 0.00 0.00 42.92 43.38 1arx s ASP 202 CO 0.80 -0.92 1.58 -1.54 0.70 0.00 0.00 175.17 175.78 1arx n SER 203 N -0.51 0.00 -3.28 2.11 3.41 -1.26 -3.85 113.62 110.24 1arx n SER 203 Ca 0.02 -0.12 -0.25 0.00 -0.26 0.00 0.00 58.87 58.26 1arx n SER 203 Cb 0.65 -0.22 -0.07 0.00 -0.26 0.00 0.00 64.21 64.31 1arx n SER 203 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1arx n THR 204 N -1.22 1.17 0.16 6.66 -2.24 -1.26 -4.95 114.28 112.59 1arx n THR 204 Ca 0.10 -4.78 0.10 0.00 -2.27 0.00 0.00 64.05 57.19 1arx n THR 204 Cb 0.13 -1.85 0.51 0.00 -2.10 0.00 0.00 70.33 67.02 1arx n THR 204 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1arx n PRO 205 N 0.90 0.12 -0.33 -0.78 -0.04 -1.25 -1.67 135.00 131.96 1arx n PRO 205 Ca 0.27 0.61 0.08 0.00 -0.04 0.00 0.00 63.50 64.42 1arx n PRO 205 Cb 0.47 -1.98 0.23 0.00 -0.04 0.00 0.00 33.50 32.19 1arx n PRO 205 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1arx n GLN 206 N -2.18 3.02 -4.41 0.54 6.02 -1.26 -4.15 117.38 114.96 1arx n GLN 206 Ca -0.01 -2.43 -0.24 0.00 -0.01 0.00 0.00 57.00 54.31 1arx n GLN 206 Cb 0.10 -1.52 -0.17 0.00 1.02 0.00 0.00 30.24 29.68 1arx n GLN 206 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1arx s VAL 207 N -1.45 1.03 -0.80 5.09 1.01 -0.67 -3.93 120.40 120.68 1arx s VAL 207 Ca 0.35 -0.39 -0.23 0.00 0.00 0.00 0.00 61.98 61.71 1arx s VAL 207 Cb 0.21 -0.97 0.07 0.00 0.00 0.00 0.00 36.38 35.70 1arx s VAL 207 CO 0.19 0.34 1.15 0.12 0.00 0.00 0.00 175.10 176.90 1arx s PHE 208 N 0.88 2.66 0.24 5.22 5.36 0.17 -4.69 117.98 127.82 1arx s PHE 208 Ca -0.11 -0.68 0.05 0.00 -0.96 0.00 0.00 56.93 55.24 1arx s PHE 208 Cb -0.15 -4.43 -0.02 0.00 -0.34 0.00 0.00 43.02 38.08 1arx s PHE 208 CO 0.01 -1.76 0.19 -0.40 -1.46 0.00 0.00 175.22 171.81 1arx n ASP 209 N 8.02 -0.39 0.24 6.13 5.68 -1.26 -4.50 116.55 130.46 1arx n ASP 209 Ca 0.10 -2.53 0.15 0.00 -0.50 0.00 0.00 54.79 52.00 1arx n ASP 209 Cb 0.48 1.14 0.45 0.00 -1.14 0.00 0.00 41.12 42.05 1arx n ASP 209 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 1arx h THR 210 N 1.73 0.00 -1.10 2.12 2.02 -1.89 -3.37 112.91 112.41 1arx h THR 210 Ca -0.17 -0.69 0.33 0.00 0.77 0.00 0.00 66.41 66.65 1arx h THR 210 Cb 0.84 1.68 -0.12 0.00 -1.74 0.00 0.00 68.15 68.80 1arx h THR 210 CO 0.25 0.00 0.69 1.56 0.37 0.00 0.00 175.52 178.38 1arx h GLN 211 N 0.00 0.29 -0.88 6.66 1.08 -1.92 -0.79 115.11 119.56 1arx h GLN 211 Ca 0.00 -0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.23 1arx h GLN 211 Cb 0.71 -0.07 -0.06 0.00 -0.05 0.00 0.00 27.48 28.02 1arx h GLN 211 CO 0.00 0.19 0.56 0.35 -0.95 0.00 0.00 178.83 178.98 1arx h PHE 212 N 0.30 1.04 -0.30 2.96 3.57 -1.89 0.31 116.94 122.92 1arx h PHE 212 Ca 0.70 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 62.08 1arx h PHE 212 Cb 1.83 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 40.22 1arx h PHE 212 CO -0.01 0.57 -0.42 1.88 -2.23 0.00 0.00 178.31 178.10 1arx h TYR 213 N 1.05 0.91 0.24 0.41 0.05 -1.46 -2.47 116.97 115.70 1arx h TYR 213 Ca 0.36 -0.28 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 1arx h TYR 213 Cb 0.08 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 37.63 1arx h TYR 213 CO -0.02 1.04 -0.12 0.82 -1.05 0.00 0.00 178.16 178.83 1arx h ILE 214 N 0.61 0.82 0.00 -2.88 2.04 -1.36 -3.29 117.51 113.45 1arx h ILE 214 Ca 0.04 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.20 1arx h ILE 214 Cb 0.98 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1arx h ILE 214 CO 0.09 0.13 -0.34 -0.33 0.00 0.00 0.00 178.15 177.70 1arx h GLU 215 N -0.66 0.00 0.00 2.37 5.08 -0.97 -2.49 114.58 117.91 1arx h GLU 215 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1arx h GLU 215 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1arx h GLU 215 CO 0.05 0.34 0.00 1.79 -1.00 0.00 0.00 179.01 180.20 1arx h THR 216 N 0.00 0.00 0.00 1.13 1.35 -1.53 -3.11 112.91 110.76 1arx h THR 216 Ca -0.00 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1arx h THR 216 Cb 0.62 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1arx h THR 216 CO 0.04 0.00 -0.58 -0.11 -0.25 0.00 0.00 175.52 174.63 1arx n LEU 217 N -2.45 0.70 -4.77 3.87 7.94 -0.94 -4.83 117.00 116.52 1arx n LEU 217 Ca 0.03 0.25 -0.37 0.00 -1.11 0.00 0.00 56.01 54.81 1arx n LEU 217 Cb 0.30 -0.19 -0.02 0.00 0.53 0.00 0.00 43.42 44.04 1arx n LEU 217 CO 0.24 -0.06 0.80 -0.22 -1.11 0.00 0.00 177.39 177.04 1arx s LEU 218 N -4.21 4.06 0.19 -1.96 2.96 -1.17 -0.76 118.68 117.78 1arx s LEU 218 Ca 0.07 2.22 -0.32 0.00 -0.22 0.00 0.00 54.13 55.88 1arx s LEU 218 Cb 0.13 -4.22 -0.12 0.00 0.50 0.00 0.00 46.19 42.49 1arx s LEU 218 CO 0.71 -0.78 1.75 0.29 -1.32 0.00 0.00 176.35 177.01 1arx n LYS 219 N -0.34 2.79 -2.14 1.98 5.02 0.00 -4.77 118.16 120.70 1arx n LYS 219 Ca 0.06 1.01 -0.43 0.00 -2.02 0.00 0.00 58.31 56.94 1arx n LYS 219 Cb 0.48 -2.87 -0.03 0.00 -0.02 0.00 0.00 35.03 32.60 1arx n LYS 219 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1arx s GLY 220 N 1.47 1.49 -0.02 0.72 0.00 -1.26 -4.26 107.32 105.46 1arx s GLY 220 Ca 0.76 0.70 0.00 0.00 0.00 0.00 0.00 44.72 46.19 1arx s GLY 220 CO 0.33 2.89 -0.01 2.41 0.00 0.00 0.00 173.10 178.72 1arx n THR 221 N 5.68 0.09 -4.50 0.90 -1.04 0.27 -4.81 114.28 110.86 1arx n THR 221 Ca 0.17 -0.04 -0.34 0.00 -2.04 0.00 0.00 64.05 61.79 1arx n THR 221 Cb 0.44 -0.66 -0.11 0.00 -1.82 0.00 0.00 70.33 68.18 1arx n THR 221 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1arx s THR 222 N -2.03 3.95 -0.34 12.58 2.01 0.30 -4.92 115.64 127.19 1arx s THR 222 Ca -0.02 -0.38 -0.13 0.00 0.31 0.00 0.00 61.69 61.47 1arx s THR 222 Cb 0.01 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.85 1arx s THR 222 CO 0.04 0.59 0.25 -1.58 -0.69 0.00 0.00 174.62 173.23 1arx s GLN 223 N -0.69 3.50 0.31 4.92 0.74 -1.26 -1.16 119.66 126.02 1arx s GLN 223 Ca 0.11 -0.63 0.25 0.00 0.05 0.00 0.00 55.36 55.14 1arx s GLN 223 Cb -0.12 -3.81 0.71 0.00 1.10 0.00 0.00 33.01 30.89 1arx s GLN 223 CO 0.02 -0.45 1.73 -1.00 -0.55 0.00 0.00 175.29 175.03 1arx h PRO 224 N 8.49 0.00 -5.06 1.67 0.13 -1.89 -3.48 132.00 131.86 1arx h PRO 224 Ca -0.31 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.23 1arx h PRO 224 Cb 1.16 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.15 1arx h PRO 224 CO 0.64 0.00 -0.51 0.20 -0.23 0.00 0.00 178.00 178.10 1arx s GLY 225 N -3.81 2.72 0.50 1.56 0.00 -1.26 -4.63 107.32 102.39 1arx s GLY 225 Ca 0.08 -1.05 0.21 0.00 0.00 0.00 0.00 44.72 43.96 1arx s GLY 225 CO 0.60 -1.90 2.01 -2.55 0.00 0.00 0.00 173.10 171.25 1arx h PRO 226 N 1.69 0.13 -4.07 2.90 0.11 -1.92 -3.44 132.00 127.39 1arx h PRO 226 Ca -0.36 -0.01 -0.26 0.00 0.11 0.00 0.00 66.00 65.48 1arx h PRO 226 Cb 1.28 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 1arx h PRO 226 CO 0.59 0.08 -0.17 -1.54 -0.21 0.00 0.00 178.00 176.75 1arx s SER 227 N -6.31 0.85 -0.07 -2.05 1.04 -1.26 -5.16 113.70 100.75 1arx s SER 227 Ca -0.06 -1.46 -0.10 0.00 0.48 0.00 0.00 55.95 54.82 1arx s SER 227 Cb 0.19 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.93 1arx s SER 227 CO 0.73 -1.31 0.25 -0.76 0.98 0.00 0.00 173.24 173.13 1arx s LEU 228 N -3.22 4.42 0.00 2.42 2.01 -1.26 -4.93 118.68 118.12 1arx s LEU 228 Ca 0.30 0.67 0.00 0.00 0.01 0.00 0.00 54.13 55.10 1arx s LEU 228 Cb -0.01 -2.30 0.00 0.00 0.01 0.00 0.00 46.19 43.89 1arx s LEU 228 CO 0.20 0.37 0.00 0.61 1.01 0.00 0.00 176.35 178.53 1arx n GLY 229 N 1.87 0.36 3.73 -3.19 0.00 -1.26 -4.97 105.19 101.73 1arx n GLY 229 Ca -0.17 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 1arx n GLY 229 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1arx s PHE 230 N -0.02 3.15 -1.30 1.61 5.36 -0.92 -2.88 117.98 122.99 1arx s PHE 230 Ca 0.00 0.97 -0.08 0.00 -0.96 0.00 0.00 56.93 56.85 1arx s PHE 230 Cb 0.00 -3.75 0.06 0.00 -0.34 0.00 0.00 43.02 38.99 1arx s PHE 230 CO 0.00 -2.55 0.47 0.00 -1.46 0.00 0.00 175.22 171.67 1arx n ALA 231 N 3.24 -1.03 -2.79 11.12 0.00 -1.26 -4.86 120.51 124.93 1arx n ALA 231 Ca 0.10 0.11 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 1arx n ALA 231 Cb 0.41 -2.82 -0.06 0.00 0.00 0.00 0.00 19.45 16.98 1arx n ALA 231 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1arx s GLU 232 N -5.90 3.57 0.34 0.00 2.12 -1.14 -0.13 118.70 117.56 1arx s GLU 232 Ca 0.36 0.00 0.09 0.00 0.36 0.00 0.00 54.97 55.78 1arx s GLU 232 Cb -0.18 -3.20 -0.06 0.00 0.26 0.00 0.00 34.13 30.95 1arx s GLU 232 CO 0.44 0.75 -0.01 -1.21 -0.54 0.00 0.00 175.26 174.68 1arx s GLU 233 N -1.01 2.03 0.31 4.30 0.41 -0.64 -4.83 118.70 119.26 1arx s GLU 233 Ca 0.17 -1.77 -0.29 0.00 -0.41 0.00 0.00 54.97 52.67 1arx s GLU 233 Cb -0.13 -1.89 -0.10 0.00 -1.78 0.00 0.00 34.13 30.23 1arx s GLU 233 CO 0.06 0.15 1.30 -0.51 -0.49 0.00 0.00 175.26 175.77 1arx s LEU 234 N -3.69 4.43 0.53 1.80 1.02 -1.26 -4.26 118.68 117.26 1arx s LEU 234 Ca 0.34 2.63 0.05 0.00 0.02 0.00 0.00 54.13 57.17 1arx s LEU 234 Cb 0.00 -3.64 0.03 0.00 0.02 0.00 0.00 46.19 42.59 1arx s LEU 234 CO 0.19 -0.52 0.33 -0.94 0.02 0.00 0.00 176.35 175.43 1arx s SER 235 N -0.37 4.55 0.29 2.29 1.04 -0.31 -4.34 113.70 116.85 1arx s SER 235 Ca 0.50 -1.30 0.24 0.00 0.48 0.00 0.00 55.95 55.87 1arx s SER 235 Cb -0.39 0.39 0.45 0.00 0.10 0.00 0.00 66.02 66.57 1arx s SER 235 CO 0.50 -1.04 1.55 1.55 0.98 0.00 0.00 173.24 176.78 1arx h PRO 236 N 0.88 0.00 -3.05 4.02 0.13 -1.85 0.16 132.00 132.29 1arx h PRO 236 Ca -0.38 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.70 1arx h PRO 236 Cb 1.30 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.29 1arx h PRO 236 CO 0.60 0.00 0.02 -0.59 -0.23 0.00 0.00 178.00 177.80 1arx s PHE 237 N -3.19 -0.36 0.29 1.56 -0.12 -1.26 -4.69 117.98 110.22 1arx s PHE 237 Ca 0.07 0.22 -0.29 0.00 -0.05 0.00 0.00 56.93 56.89 1arx s PHE 237 Cb 0.09 0.34 -0.14 0.00 -0.63 0.00 0.00 43.02 42.69 1arx s PHE 237 CO 0.67 -0.69 1.13 -2.30 -0.05 0.00 0.00 175.22 173.98 1arx n PRO 238 N 0.05 1.61 0.00 1.99 -0.02 -1.23 -2.35 135.00 135.06 1arx n PRO 238 Ca -0.17 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1arx n PRO 238 Cb 0.62 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 1arx n PRO 238 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1arx n GLY 239 N 1.24 3.05 3.82 -1.23 0.00 -1.26 -0.61 105.19 110.19 1arx n GLY 239 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1arx n GLY 239 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1arx s GLU 240 N -0.33 3.99 -0.05 1.61 2.12 -0.99 -3.78 118.70 121.27 1arx s GLU 240 Ca 0.00 0.39 -0.03 0.00 0.36 0.00 0.00 54.97 55.69 1arx s GLU 240 Cb 0.00 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 1arx s GLU 240 CO 0.00 0.60 0.12 0.12 -0.54 0.00 0.00 175.26 175.56 1arx s PHE 241 N -0.77 3.44 -0.13 5.30 2.19 -0.08 -4.66 117.98 123.27 1arx s PHE 241 Ca 0.23 0.35 -0.00 0.00 0.33 0.00 0.00 56.93 57.84 1arx s PHE 241 Cb -0.16 -1.83 0.02 0.00 -1.31 0.00 0.00 43.02 39.74 1arx s PHE 241 CO 0.12 0.63 -0.11 0.50 1.83 0.00 0.00 175.22 178.19 1arx s ARG 242 N -1.46 1.91 0.18 10.12 3.52 -1.26 -4.43 118.95 127.52 1arx s ARG 242 Ca 0.20 -0.42 -0.08 0.00 -0.13 0.00 0.00 55.73 55.30 1arx s ARG 242 Cb -0.12 -1.87 -0.06 0.00 -1.56 0.00 0.00 34.95 31.34 1arx s ARG 242 CO 0.11 -0.26 0.48 0.00 -0.81 0.00 0.00 175.30 174.81 1arx s MET 243 N 1.59 3.75 0.23 5.12 0.23 -1.26 -1.62 119.30 127.35 1arx s MET 243 Ca 0.05 0.16 -0.06 0.00 -1.03 0.00 0.00 55.69 54.81 1arx s MET 243 Cb -0.13 -2.78 0.36 0.00 -1.53 0.00 0.00 34.83 30.75 1arx s MET 243 CO -0.09 0.41 1.78 -0.09 -2.03 0.00 0.00 175.02 175.00 1arx h ARG 244 N 2.86 0.61 -0.87 3.16 2.43 -0.71 -2.03 114.38 119.84 1arx h ARG 244 Ca -0.47 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1arx h ARG 244 Cb 1.17 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.54 1arx h ARG 244 CO 0.70 0.41 0.53 0.66 -1.51 0.00 0.00 179.97 180.75 1arx h SER 245 N 0.63 1.04 -0.29 -3.80 4.64 -1.77 -0.21 113.55 113.80 1arx h SER 245 Ca 0.36 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.58 1arx h SER 245 Cb 0.39 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1arx h SER 245 CO -0.27 0.80 0.01 0.44 -0.87 0.00 0.00 176.83 176.93 1arx h ASP 246 N 1.19 0.49 -0.63 4.97 3.32 -1.81 -1.07 116.42 122.89 1arx h ASP 246 Ca 0.31 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1arx h ASP 246 Cb -0.05 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1arx h ASP 246 CO -0.06 0.67 0.41 0.00 -1.72 0.00 0.00 179.24 178.54 1arx h ALA 247 N 0.84 0.80 -0.32 3.45 0.00 -0.86 -2.62 119.26 120.55 1arx h ALA 247 Ca 0.08 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1arx h ALA 247 Cb 0.42 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1arx h ALA 247 CO 0.01 0.24 -0.17 -0.07 0.00 0.00 0.00 179.25 179.26 1arx h LEU 248 N 0.85 0.69 -1.25 0.00 4.07 -0.86 -3.03 115.31 115.79 1arx h LEU 248 Ca 0.23 -0.42 -0.06 0.00 0.08 0.00 0.00 57.88 57.71 1arx h LEU 248 Cb -0.08 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.45 1arx h LEU 248 CO -0.05 0.96 -0.14 -0.07 -1.08 0.00 0.00 178.44 178.06 1arx h LEU 249 N 0.43 0.33 -1.12 1.67 3.38 -1.16 0.45 115.31 119.29 1arx h LEU 249 Ca 0.07 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1arx h LEU 249 Cb 0.70 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1arx h LEU 249 CO 0.05 0.50 0.50 0.00 0.09 0.00 0.00 178.44 179.58 1arx h ALA 250 N 1.54 1.35 0.00 1.53 0.00 -1.41 -3.29 119.26 118.98 1arx h ALA 250 Ca 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1arx h ALA 250 Cb 0.44 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1arx h ALA 250 CO 0.03 0.57 -1.59 0.54 0.00 0.00 0.00 179.25 178.79 1arx n ARG 251 N -4.38 0.52 -2.19 0.00 1.74 -0.79 -4.36 116.66 107.19 1arx n ARG 251 Ca 0.09 -0.10 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 1arx n ARG 251 Cb 0.06 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 29.89 1arx n ARG 251 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1arx s ASP 252 N -4.39 6.87 0.59 0.55 -1.08 0.08 -4.83 116.67 114.46 1arx s ASP 252 Ca -0.03 2.49 0.29 0.00 -0.52 0.00 0.00 52.55 54.78 1arx s ASP 252 Cb 0.14 -2.62 1.78 0.00 -1.46 0.00 0.00 42.92 40.76 1arx s ASP 252 CO 0.87 -0.51 2.23 0.77 0.52 0.00 0.00 175.17 179.05 1arx h SER 253 N 4.70 0.00 0.91 -0.34 4.64 -1.91 0.16 113.55 121.70 1arx h SER 253 Ca -0.46 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.79 1arx h SER 253 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1arx h SER 253 CO 0.73 0.00 -0.34 0.03 -0.87 0.00 0.00 176.83 176.39 1arx h ARG 254 N 0.00 0.00 0.00 4.77 -0.00 -1.93 -3.37 114.38 113.85 1arx h ARG 254 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.49 1arx h ARG 254 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.04 1arx h ARG 254 CO -0.00 0.34 -0.33 0.25 0.00 0.00 0.00 179.97 180.23 1arx n THR 255 N -3.47 0.00 -0.19 2.04 -2.24 -0.89 -4.84 114.28 104.68 1arx n THR 255 Ca 0.00 -0.23 0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1arx n THR 255 Cb 0.50 0.75 0.35 0.00 -2.10 0.00 0.00 70.33 69.83 1arx n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1arx h ALA 256 N 0.00 1.69 -0.14 6.98 0.00 -0.80 -1.68 119.26 125.31 1arx h ALA 256 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1arx h ALA 256 Cb 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1arx h ALA 256 CO 0.00 0.19 -0.67 0.00 0.00 0.00 0.00 179.25 178.76 1arx h ARG 258 N 0.42 0.94 -0.26 0.00 9.65 -1.85 -0.98 114.38 122.30 1arx h ARG 258 Ca -0.02 -0.34 0.00 0.00 -1.10 0.00 0.00 59.98 58.52 1arx h ARG 258 Cb 1.25 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.76 1arx h ARG 258 CO 0.13 1.00 0.16 2.35 2.80 0.00 0.00 179.97 186.42 1arx h TRP 259 N 0.84 0.31 -0.65 2.20 2.91 -1.25 -2.63 115.95 117.68 1arx h TRP 259 Ca 0.13 0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.11 1arx h TRP 259 Cb 0.67 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 29.18 1arx h TRP 259 CO 0.04 0.19 0.22 0.37 -1.03 0.00 0.00 178.44 178.24 1arx h GLN 260 N 0.34 0.98 0.00 2.65 4.15 -0.91 -2.36 115.11 119.96 1arx h GLN 260 Ca 0.10 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1arx h GLN 260 Cb -0.03 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.50 1arx h GLN 260 CO -0.03 0.83 0.00 0.66 -1.93 0.00 0.00 178.83 178.36 1arx h SER 261 N 0.95 0.00 0.46 -0.69 4.64 -0.92 -2.53 113.55 115.47 1arx h SER 261 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1arx h SER 261 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1arx h SER 261 CO -0.01 0.00 -0.17 0.23 -0.87 0.00 0.00 176.83 176.01 1arx n MET 262 N -2.58 0.51 0.13 4.77 2.81 -0.89 -4.29 117.12 117.58 1arx n MET 262 Ca 0.01 -0.19 0.02 0.00 -1.81 0.00 0.00 57.70 55.73 1arx n MET 262 Cb 0.25 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.27 1arx n MET 262 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1arx h THR 263 N 0.47 0.93 -0.02 2.03 1.35 -1.50 -3.39 112.91 112.79 1arx h THR 263 Ca 0.00 -2.32 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 1arx h THR 263 Cb 0.41 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.29 1arx h THR 263 CO 0.00 0.53 -0.17 -1.54 -0.25 0.00 0.00 175.52 174.09 1arx n SER 264 N -3.23 2.11 -3.59 5.36 3.41 -1.26 -4.84 113.62 111.57 1arx n SER 264 Ca 0.02 -1.55 -0.16 0.00 -0.26 0.00 0.00 58.87 56.91 1arx n SER 264 Cb 0.76 0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 64.80 1arx n SER 264 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1arx s SER 265 N -1.74 0.89 0.24 4.04 0.15 -1.26 -4.84 113.70 111.18 1arx s SER 265 Ca 0.18 0.18 -0.03 0.00 0.70 0.00 0.00 55.95 56.98 1arx s SER 265 Cb 0.14 0.46 0.27 0.00 -1.71 0.00 0.00 66.02 65.18 1arx s SER 265 CO 0.32 -0.28 1.72 0.78 1.20 0.00 0.00 173.24 176.99 1arx h ASN 266 N 8.32 0.80 -0.45 5.45 2.35 -1.91 -1.57 115.58 128.57 1arx h ASN 266 Ca -0.15 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.35 1arx h ASN 266 Cb 1.13 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.27 1arx h ASN 266 CO 0.20 0.89 0.16 -0.08 -1.65 0.00 0.00 177.43 176.95 1arx h GLU 267 N 0.75 0.68 -0.16 0.81 4.81 -1.96 -0.95 114.58 118.56 1arx h GLU 267 Ca 0.14 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1arx h GLU 267 Cb 0.52 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1arx h GLU 267 CO 0.03 0.65 0.06 0.28 -0.73 0.00 0.00 179.01 179.29 1arx h VAL 268 N 0.58 1.17 -0.57 0.32 2.07 -1.92 -2.20 116.25 115.70 1arx h VAL 268 Ca 0.15 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.16 1arx h VAL 268 Cb 0.23 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1arx h VAL 268 CO -0.01 0.16 0.35 -0.03 0.02 0.00 0.00 177.57 178.07 1arx h MET 269 N 0.10 0.68 -0.86 1.57 1.85 -1.24 -2.16 114.93 114.87 1arx h MET 269 Ca 0.05 -0.04 0.02 0.00 -0.61 0.00 0.00 59.70 59.12 1arx h MET 269 Cb 0.21 -0.15 -0.04 0.00 0.43 0.00 0.00 31.60 32.04 1arx h MET 269 CO -0.00 0.45 0.56 0.78 -0.40 0.00 0.00 176.91 178.30 1arx h GLY 270 N 0.70 1.22 0.96 1.39 0.00 -0.95 -0.26 103.07 106.13 1arx h GLY 270 Ca 0.23 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 47.03 1arx h GLY 270 CO -0.09 0.42 -0.12 1.46 0.00 0.00 0.00 176.54 178.21 1arx h GLN 271 N 1.14 0.72 -0.51 4.80 1.08 -1.13 -1.81 115.11 119.40 1arx h GLN 271 Ca 0.32 -0.29 -0.07 0.00 -1.45 0.00 0.00 58.65 57.16 1arx h GLN 271 Cb -0.10 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 1arx h GLN 271 CO -0.08 0.89 0.05 0.00 -0.95 0.00 0.00 178.83 178.74 1arx h ARG 272 N 0.51 0.88 0.14 1.46 3.08 -1.23 -1.95 114.38 117.27 1arx h ARG 272 Ca 0.09 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1arx h ARG 272 Cb 0.65 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1arx h ARG 272 CO 0.04 0.88 -0.07 -0.92 -1.07 0.00 0.00 179.97 178.84 1arx h TYR 273 N 0.75 -0.17 -0.64 3.04 3.20 -1.00 -1.11 116.97 121.03 1arx h TYR 273 Ca 0.15 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.08 1arx h TYR 273 Cb 0.46 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.73 1arx h TYR 273 CO 0.03 -0.06 0.34 -0.09 -1.64 0.00 0.00 178.16 176.74 1arx h ARG 274 N -0.24 0.61 -0.02 1.82 2.43 -1.24 0.98 114.38 118.72 1arx h ARG 274 Ca -0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1arx h ARG 274 Cb 0.19 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1arx h ARG 274 CO 0.03 0.40 0.01 0.00 -1.51 0.00 0.00 179.97 178.90 1arx h ALA 275 N 1.35 0.02 -0.32 2.80 0.00 -1.18 -0.16 119.26 121.77 1arx h ALA 275 Ca 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1arx h ALA 275 Cb 0.21 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1arx h ALA 275 CO -0.20 -0.48 0.15 0.00 0.00 0.00 0.00 179.25 178.73 1arx h ALA 276 N 1.01 0.42 -0.62 0.00 0.00 -0.78 -2.55 119.26 116.73 1arx h ALA 276 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1arx h ALA 276 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1arx h ALA 276 CO -0.01 -0.02 0.39 0.52 0.00 0.00 0.00 179.25 180.14 1arx h MET 277 N 0.39 0.82 -0.19 0.00 2.07 -0.65 -1.92 114.93 115.45 1arx h MET 277 Ca 0.11 -0.06 -0.06 0.00 -2.07 0.00 0.00 59.70 57.62 1arx h MET 277 Cb 0.13 -0.18 -0.01 0.00 -1.87 0.00 0.00 31.60 29.66 1arx h MET 277 CO -0.01 0.56 -0.17 0.00 1.07 0.00 0.00 176.91 178.36 1arx h ALA 278 N 1.59 1.36 -0.14 6.32 0.00 -0.65 -1.26 119.26 126.49 1arx h ALA 278 Ca 0.22 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1arx h ALA 278 Cb -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1arx h ALA 278 CO -0.05 0.43 -0.40 -0.22 0.00 0.00 0.00 179.25 179.02 1arx h LYS 279 N 0.30 0.52 -0.11 0.00 3.64 -1.00 -3.05 116.57 116.87 1arx h LYS 279 Ca 0.06 -0.37 -0.05 0.00 -1.27 0.00 0.00 60.65 59.02 1arx h LYS 279 Cb 0.48 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1arx h LYS 279 CO 0.03 0.99 -0.15 1.98 -2.27 0.00 0.00 179.45 180.03 1arx h MET 280 N 0.14 0.17 0.00 1.90 4.05 -1.18 -2.88 114.93 117.14 1arx h MET 280 Ca -0.01 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1arx h MET 280 Cb 1.01 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.79 1arx h MET 280 CO 0.09 0.33 0.00 0.66 0.23 0.00 0.00 176.91 178.21 1arx h SER 281 N 0.17 0.00 -0.14 1.39 4.64 -1.11 -2.92 113.55 115.58 1arx h SER 281 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1arx h SER 281 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1arx h SER 281 CO 0.02 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.31 1arx n VAL 282 N -2.86 1.67 -1.76 0.95 0.24 -1.09 -4.75 118.33 110.74 1arx n VAL 282 Ca 0.00 -1.67 -0.42 0.00 -2.04 0.00 0.00 64.34 60.21 1arx n VAL 282 Cb 0.24 0.03 -0.03 0.00 -1.47 0.00 0.00 33.84 32.61 1arx n VAL 282 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1arx s LEU 283 N -2.15 4.38 0.00 1.34 1.02 -1.10 -1.07 118.68 121.10 1arx s LEU 283 Ca 0.27 2.76 0.00 0.00 0.02 0.00 0.00 54.13 57.18 1arx s LEU 283 Cb 0.21 -3.58 0.00 0.00 0.02 0.00 0.00 46.19 42.84 1arx s LEU 283 CO 0.06 -0.97 0.00 0.61 0.02 0.00 0.00 176.35 176.08 1arx n GLY 284 N 4.08 0.71 3.18 -3.19 0.00 -1.26 -1.82 105.19 106.89 1arx n GLY 284 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 1arx n GLY 284 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1arx s PHE 285 N -2.52 0.97 -0.38 1.61 0.40 -0.23 -4.93 117.98 112.90 1arx s PHE 285 Ca 0.00 -1.11 -0.14 0.00 -0.60 0.00 0.00 56.93 55.08 1arx s PHE 285 Cb 0.00 -0.56 0.01 0.00 0.51 0.00 0.00 43.02 42.97 1arx s PHE 285 CO 0.00 -0.36 0.26 0.34 0.70 0.00 0.00 175.22 176.16 1arx s ASP 286 N -3.09 6.04 0.56 1.36 2.15 -1.26 -4.93 116.67 117.50 1arx s ASP 286 Ca 0.22 -0.71 0.28 0.00 0.43 0.00 0.00 52.55 52.77 1arx s ASP 286 Cb 0.07 -2.13 1.63 0.00 -0.30 0.00 0.00 42.92 42.19 1arx s ASP 286 CO 0.01 -0.35 2.16 0.08 -0.17 0.00 0.00 175.17 176.90 1arx h ARG 287 N 8.55 0.00 0.00 4.34 0.11 -1.96 -0.45 114.38 124.97 1arx h ARG 287 Ca -0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.79 1arx h ARG 287 Cb 1.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.21 1arx h ARG 287 CO 0.68 0.06 0.00 0.09 0.10 0.00 0.00 179.97 180.91 1arx n ASN 288 N -3.75 0.00 -1.01 0.08 3.02 -1.26 -2.00 115.26 110.34 1arx n ASN 288 Ca -0.02 -0.04 0.12 0.00 -0.03 0.00 0.00 54.58 54.60 1arx n ASN 288 Cb 0.16 -0.28 0.14 0.00 -0.61 0.00 0.00 39.78 39.18 1arx n ASN 288 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1arx n ALA 289 N -1.28 2.45 -2.88 5.41 0.00 -0.18 -4.98 120.51 119.04 1arx n ALA 289 Ca 0.11 -0.79 -0.22 0.00 0.00 0.00 0.00 53.44 52.54 1arx n ALA 289 Cb 0.18 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 1arx n ALA 289 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1arx s LEU 290 N -1.81 4.03 -0.13 0.00 1.43 -0.85 -4.94 118.68 116.41 1arx s LEU 290 Ca 0.31 -0.10 -0.06 0.00 -1.03 0.00 0.00 54.13 53.25 1arx s LEU 290 Cb 0.21 -2.57 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 1arx s LEU 290 CO 0.30 -0.04 0.08 -0.89 0.23 0.00 0.00 176.35 176.03 1arx s THR 291 N -2.04 4.95 -0.25 5.49 2.01 0.16 -4.89 115.64 121.07 1arx s THR 291 Ca 0.33 0.00 -0.24 0.00 0.31 0.00 0.00 61.69 62.09 1arx s THR 291 Cb -0.09 -3.15 -0.01 0.00 0.01 0.00 0.00 72.50 69.27 1arx s THR 291 CO 0.27 0.57 0.81 -0.62 -0.69 0.00 0.00 174.62 174.95 1arx s ASP 292 N -0.60 6.79 -0.18 3.53 -1.08 -1.26 -0.44 116.67 123.44 1arx s ASP 292 Ca 0.11 0.97 0.16 0.00 -0.52 0.00 0.00 52.55 53.28 1arx s ASP 292 Cb -0.12 -2.42 0.44 0.00 -1.46 0.00 0.00 42.92 39.36 1arx s ASP 292 CO 0.02 -0.51 1.19 0.00 0.52 0.00 0.00 175.17 176.39 1arx h SER 294 N 1.46 0.00 0.64 0.00 0.02 -1.83 -0.91 113.55 112.92 1arx h SER 294 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1arx h SER 294 Cb 1.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1arx h SER 294 CO 0.20 0.01 0.00 -2.24 -1.14 0.00 0.00 176.83 173.67 1arx h ASP 295 N 0.00 0.00 0.76 3.07 3.04 -1.90 -1.34 116.42 120.05 1arx h ASP 295 Ca -0.00 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.75 1arx h ASP 295 Cb 0.03 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.31 1arx h ASP 295 CO 0.00 0.00 -0.21 0.58 -2.04 0.00 0.00 179.24 177.57 1arx h VAL 296 N 0.00 0.58 -3.03 4.15 2.07 -1.56 -3.43 116.25 115.03 1arx h VAL 296 Ca 0.00 -0.99 -0.56 0.00 0.82 0.00 0.00 66.70 65.97 1arx h VAL 296 Cb 0.32 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 1arx h VAL 296 CO 0.00 0.20 0.77 -0.63 0.02 0.00 0.00 177.57 177.93 1arx s ILE 297 N -3.80 4.29 0.66 4.57 -1.09 -0.51 -5.03 121.20 120.30 1arx s ILE 297 Ca -0.00 1.60 -0.11 0.00 -2.23 0.00 0.00 60.65 59.90 1arx s ILE 297 Cb 0.11 -4.03 -0.01 0.00 -1.58 0.00 0.00 42.46 36.95 1arx s ILE 297 CO 0.62 -0.05 1.05 -2.16 -1.23 0.00 0.00 174.94 173.17 1arx s PRO 298 N 2.68 3.22 0.53 2.79 0.04 -1.26 -5.03 135.00 137.97 1arx s PRO 298 Ca 0.55 0.58 -0.18 0.00 0.04 0.00 0.00 61.00 61.99 1arx s PRO 298 Cb -0.23 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.18 1arx s PRO 298 CO 0.19 -0.79 1.04 -1.12 0.04 0.00 0.00 177.00 176.36 1arx s SER 299 N -4.27 6.18 0.41 6.66 0.01 -1.26 -4.81 113.70 116.62 1arx s SER 299 Ca 0.56 1.84 0.01 0.00 1.31 0.00 0.00 55.95 59.67 1arx s SER 299 Cb -0.11 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.56 1arx s SER 299 CO 0.52 -0.90 0.62 0.00 0.41 0.00 0.00 173.24 173.90 1arx s ALA 300 N -2.24 3.76 0.51 1.44 0.00 -1.26 -4.90 121.76 119.08 1arx s ALA 300 Ca 0.65 -1.02 -0.19 0.00 0.00 0.00 0.00 51.96 51.40 1arx s ALA 300 Cb -0.15 -2.11 -0.07 0.00 0.00 0.00 0.00 23.12 20.79 1arx s ALA 300 CO 0.27 -0.23 1.03 0.14 0.00 0.00 0.00 175.76 176.97 1arx s VAL 301 N -2.45 3.90 0.42 0.00 -7.23 -1.26 -4.86 120.40 108.91 1arx s VAL 301 Ca 0.45 1.08 -0.19 0.00 -1.81 0.00 0.00 61.98 61.51 1arx s VAL 301 Cb -0.10 -3.46 -0.10 0.00 0.56 0.00 0.00 36.38 33.28 1arx s VAL 301 CO 0.37 -0.35 0.90 -0.44 -0.31 0.00 0.00 175.10 175.27 1arx s SER 302 N -2.30 6.85 -0.36 4.85 0.01 -1.26 -1.11 113.70 120.37 1arx s SER 302 Ca 0.65 1.56 -0.16 0.00 1.31 0.00 0.00 55.95 59.32 1arx s SER 302 Cb -0.15 -2.49 -0.00 0.00 0.21 0.00 0.00 66.02 63.58 1arx s SER 302 CO 0.25 -0.36 0.38 0.21 0.41 0.00 0.00 173.24 174.13 1arx s ASN 303 N -2.36 6.19 0.00 2.44 2.47 -1.26 -4.60 114.94 117.82 1arx s ASN 303 Ca 0.60 -0.33 0.24 0.00 0.42 0.00 0.00 52.86 53.79 1arx s ASN 303 Cb -0.09 -2.20 0.32 0.00 -1.45 0.00 0.00 41.25 37.82 1arx s ASN 303 CO 0.17 -0.40 1.30 0.59 -3.72 0.00 0.00 177.10 175.04 1arx n ASN 304 N 5.44 1.95 -4.81 -4.21 5.03 -1.26 -4.96 115.26 112.44 1arx n ASN 304 Ca -0.09 -1.47 -0.34 0.00 0.87 0.00 0.00 54.58 53.55 1arx n ASN 304 Cb 0.49 0.25 -0.06 0.00 -1.02 0.00 0.00 39.78 39.44 1arx n ASN 304 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1arx s ALA 305 N -2.34 3.07 0.41 5.41 0.00 -1.26 -5.04 121.76 122.01 1arx s ALA 305 Ca 0.24 0.47 -0.19 0.00 0.00 0.00 0.00 51.96 52.48 1arx s ALA 305 Cb 0.19 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 20.03 1arx s ALA 305 CO 0.48 0.07 0.90 0.00 0.00 0.00 0.00 175.76 177.21 1arx s ALA 306 N -1.98 3.12 0.28 0.00 0.00 -1.26 -5.04 121.76 116.88 1arx s ALA 306 Ca 0.59 0.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 1arx s ALA 306 Cb -0.13 -3.04 -0.12 0.00 0.00 0.00 0.00 23.12 19.83 1arx s ALA 306 CO 0.17 0.14 1.50 -2.30 0.00 0.00 0.00 175.76 175.28 1arx n PRO 307 N -0.68 2.42 -4.05 0.00 -0.02 -1.26 -5.03 135.00 126.38 1arx n PRO 307 Ca 0.06 0.86 -0.08 0.00 -2.02 0.00 0.00 63.50 62.32 1arx n PRO 307 Cb 0.54 -2.58 -0.10 0.00 -0.02 0.00 0.00 33.50 31.34 1arx n PRO 307 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1arx s VAL 308 N -0.18 0.21 -0.26 -1.45 -7.23 -1.26 -3.72 120.40 106.50 1arx s VAL 308 Ca 0.64 -1.44 -0.15 0.00 -1.81 0.00 0.00 61.98 59.22 1arx s VAL 308 Cb -0.55 -1.01 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 1arx s VAL 308 CO 0.51 -0.78 0.37 -0.63 -0.31 0.00 0.00 175.10 174.26 1arx s ILE 309 N -2.87 5.18 0.91 -0.62 1.01 0.14 -4.94 121.20 120.00 1arx s ILE 309 Ca -0.02 0.58 -0.12 0.00 0.00 0.00 0.00 60.65 61.09 1arx s ILE 309 Cb 0.00 -3.70 0.14 0.00 0.01 0.00 0.00 42.46 38.91 1arx s ILE 309 CO -0.06 0.16 1.09 -2.84 0.00 0.00 0.00 174.94 173.30 1arx s PRO 310 N 2.02 1.16 -0.67 2.79 0.02 -1.26 -3.36 135.00 135.69 1arx s PRO 310 Ca 0.15 0.77 -0.13 0.00 0.02 0.00 0.00 61.00 61.81 1arx s PRO 310 Cb -0.16 -1.80 0.02 0.00 0.02 0.00 0.00 34.50 32.58 1arx s PRO 310 CO 0.10 -2.30 0.24 0.41 -0.33 0.00 0.00 177.00 175.12 1arx n GLY 311 N -1.16 -0.31 3.10 0.52 0.00 -1.26 -2.04 105.19 104.04 1arx n GLY 311 Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1arx n GLY 311 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1arx n GLY 312 N -1.62 2.86 3.75 -0.02 0.00 -0.70 -3.64 105.19 105.81 1arx n GLY 312 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1arx n GLY 312 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1arx s LEU 313 N 0.00 3.31 0.00 0.99 1.43 -0.86 -4.93 118.68 118.62 1arx s LEU 313 Ca 0.00 2.14 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 1arx s LEU 313 Cb 0.00 -4.56 -0.00 0.00 0.03 0.00 0.00 46.19 41.65 1arx s LEU 313 CO 0.00 -1.98 0.01 0.35 0.23 0.00 0.00 176.35 174.96 1arx n THR 314 N -2.69 0.00 0.30 5.49 -2.24 -1.26 -4.72 114.28 109.16 1arx n THR 314 Ca 0.12 -0.35 0.18 0.00 -2.27 0.00 0.00 64.05 61.72 1arx n THR 314 Cb 0.51 0.10 0.92 0.00 -2.10 0.00 0.00 70.33 69.77 1arx n THR 314 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1arx h VAL 315 N 1.07 0.23 0.00 2.28 3.04 -1.96 -0.48 116.25 120.43 1arx h VAL 315 Ca -0.05 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 1arx h VAL 315 Cb 0.18 1.22 0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1arx h VAL 315 CO 0.09 0.04 0.00 0.47 -1.01 0.00 0.00 177.57 177.15 1arx n ASP 316 N -3.33 0.34 -0.77 3.17 8.00 -1.26 -2.11 116.55 120.59 1arx n ASP 316 Ca -0.02 0.58 0.13 0.00 0.71 0.00 0.00 54.79 56.19 1arx n ASP 316 Cb 0.18 -0.65 0.26 0.00 -0.02 0.00 0.00 41.12 40.88 1arx n ASP 316 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1arx n ASP 317 N -1.87 2.42 -4.79 -2.24 8.00 -0.19 -4.88 116.55 113.00 1arx n ASP 317 Ca 0.03 -1.80 -0.38 0.00 0.71 0.00 0.00 54.79 53.35 1arx n ASP 317 Cb 0.22 0.01 -0.06 0.00 -0.02 0.00 0.00 41.12 41.27 1arx n ASP 317 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1arx s ILE 318 N -2.01 5.00 -1.12 0.53 2.07 -0.90 -0.82 121.20 123.95 1arx s ILE 318 Ca 0.32 0.98 -0.14 0.00 -1.41 0.00 0.00 60.65 60.40 1arx s ILE 318 Cb 0.20 -3.80 0.18 0.00 0.13 0.00 0.00 42.46 39.17 1arx s ILE 318 CO 0.32 0.49 1.31 -1.61 -1.91 0.00 0.00 174.94 173.53 1arx s GLU 319 N -0.50 3.99 -0.01 3.50 2.02 0.06 -4.93 118.70 122.83 1arx s GLU 319 Ca 0.26 -2.49 -0.30 0.00 0.02 0.00 0.00 54.97 52.46 1arx s GLU 319 Cb -0.17 -4.95 -0.08 0.00 0.10 0.00 0.00 34.13 29.04 1arx s GLU 319 CO 0.14 -1.68 1.93 0.08 0.02 0.00 0.00 175.26 175.75 1arx s VAL 320 N 1.39 3.14 -0.89 2.63 1.01 -1.26 -4.87 120.40 121.54 1arx s VAL 320 Ca 0.38 0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.60 1arx s VAL 320 Cb -0.04 -3.11 0.06 0.00 0.00 0.00 0.00 36.38 33.29 1arx s VAL 320 CO -0.03 -0.02 0.75 -1.20 0.00 0.00 0.00 175.10 174.59 1arx n SER 321 N 7.94 1.65 -4.36 3.32 7.64 -1.26 -4.91 113.62 123.64 1arx n SER 321 Ca 0.20 -1.33 -0.42 0.00 1.01 0.00 0.00 58.87 58.33 1arx n SER 321 Cb 0.42 -0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.52 1arx n SER 321 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1arx h PRO 323 N 8.55 0.00 0.07 0.00 0.13 -1.97 -3.29 132.00 135.49 1arx h PRO 323 Ca -0.26 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.51 1arx h PRO 323 Cb 1.10 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 1arx h PRO 323 CO 0.77 0.00 -2.09 -1.13 -0.23 0.00 0.00 178.00 175.32 1arx n SER 324 N -2.63 1.82 -4.54 1.44 3.41 -1.26 -4.90 113.62 106.95 1arx n SER 324 Ca 0.02 0.15 -0.34 0.00 -0.26 0.00 0.00 58.87 58.44 1arx n SER 324 Cb 0.30 -0.56 -0.12 0.00 -0.26 0.00 0.00 64.21 63.57 1arx n SER 324 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1arx s GLU 325 N -2.55 3.21 0.61 4.33 -1.05 -1.24 -5.10 118.70 116.91 1arx s GLU 325 Ca -0.22 -0.53 -0.18 0.00 -0.15 0.00 0.00 54.97 53.89 1arx s GLU 325 Cb 0.07 -2.75 -0.02 0.00 -0.44 0.00 0.00 34.13 30.98 1arx s GLU 325 CO 0.74 0.46 1.17 -1.25 0.95 0.00 0.00 175.26 177.33 1arx s PRO 326 N -0.25 2.93 0.28 -4.83 0.04 -1.26 -4.77 135.00 127.14 1arx s PRO 326 Ca 0.04 1.67 -0.30 0.00 0.04 0.00 0.00 61.00 62.45 1arx s PRO 326 Cb -0.13 -1.94 -0.11 0.00 0.04 0.00 0.00 34.50 32.36 1arx s PRO 326 CO 0.02 -1.20 1.55 0.12 0.04 0.00 0.00 177.00 177.53 1arx s PHE 327 N -1.85 2.84 0.42 0.56 5.36 -1.26 -4.95 117.98 119.10 1arx s PHE 327 Ca 0.74 0.85 -0.25 0.00 -0.96 0.00 0.00 56.93 57.31 1arx s PHE 327 Cb -0.26 -3.99 -0.10 0.00 -0.34 0.00 0.00 43.02 38.32 1arx s PHE 327 CO 0.35 -3.32 1.08 -2.30 -1.46 0.00 0.00 175.22 169.58 1arx n PRO 328 N 2.29 1.50 -2.62 10.12 -0.02 -1.26 -4.91 135.00 140.10 1arx n PRO 328 Ca 0.08 0.54 -0.43 0.00 -2.02 0.00 0.00 63.50 61.67 1arx n PRO 328 Cb 0.38 -2.13 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 1arx n PRO 328 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1arx s GLU 329 N -2.07 3.60 0.23 -0.52 0.41 -1.26 -4.98 118.70 114.11 1arx s GLU 329 Ca 0.63 0.35 0.08 0.00 -0.41 0.00 0.00 54.97 55.62 1arx s GLU 329 Cb -0.55 -3.96 -0.04 0.00 -1.78 0.00 0.00 34.13 27.80 1arx s GLU 329 CO 0.57 -1.50 0.09 0.42 -0.49 0.00 0.00 175.26 174.35 1arx s ILE 330 N 4.58 4.01 0.54 -1.63 1.01 -1.26 -5.09 121.20 123.36 1arx s ILE 330 Ca 0.44 -1.54 -0.18 0.00 0.00 0.00 0.00 60.65 59.37 1arx s ILE 330 Cb -0.08 -3.12 -0.06 0.00 0.01 0.00 0.00 42.46 39.21 1arx s ILE 330 CO 0.28 -0.29 1.05 0.00 0.00 0.00 0.00 174.94 175.98 1arx s ALA 331 N -2.09 2.80 0.36 9.38 0.00 -1.24 -4.89 121.76 126.07 1arx s ALA 331 Ca 0.31 0.53 0.08 0.00 0.00 0.00 0.00 51.96 52.88 1arx s ALA 331 Cb -0.08 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.75 1arx s ALA 331 CO 0.22 -0.56 0.14 0.99 0.00 0.00 0.00 175.76 176.55 1arx s THR 332 N -2.17 2.78 -0.03 0.00 2.01 -1.26 -0.68 115.64 116.29 1arx s THR 332 Ca 0.66 -1.72 0.04 0.00 0.31 0.00 0.00 61.69 60.98 1arx s THR 332 Cb -0.17 -2.96 -0.00 0.00 0.01 0.00 0.00 72.50 69.38 1arx s THR 332 CO 0.28 -0.13 -0.13 0.00 -0.69 0.00 0.00 174.62 173.94 1arx s ALA 333 N -2.48 1.17 -1.59 7.40 0.00 -1.21 -4.86 121.76 120.19 1arx s ALA 333 Ca 0.39 -0.54 -0.10 0.00 0.00 0.00 0.00 51.96 51.71 1arx s ALA 333 Cb -0.01 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.68 1arx s ALA 333 CO 0.22 0.23 2.87 0.43 0.00 0.00 0.00 175.76 179.51 1arx n SER 334 N 3.05 8.45 -4.27 0.00 7.64 -1.26 -1.73 113.62 125.50 1arx n SER 334 Ca -0.17 -2.65 -0.23 0.00 1.01 0.00 0.00 58.87 56.84 1arx n SER 334 Cb 0.54 -1.54 -0.09 0.00 -1.01 0.00 0.00 64.21 62.10 1arx n SER 334 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1arx s GLY 335 N 2.03 2.29 0.79 0.23 0.00 -1.26 -4.93 107.32 106.46 1arx s GLY 335 Ca 0.67 -1.63 -0.12 0.00 0.00 0.00 0.00 44.72 43.64 1arx s GLY 335 CO -0.06 -1.79 1.12 2.56 0.00 0.00 0.00 173.10 174.92 1arx s PRO 336 N -3.82 2.18 0.20 2.90 0.04 -1.26 -3.04 135.00 132.20 1arx s PRO 336 Ca 0.30 0.39 -0.31 0.00 0.04 0.00 0.00 61.00 61.42 1arx s PRO 336 Cb 0.06 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 1arx s PRO 336 CO 0.15 -1.50 1.55 -1.17 0.04 0.00 0.00 177.00 176.07 1arx s LEU 337 N -5.62 4.37 0.71 -3.56 2.96 -1.24 -4.33 118.68 111.97 1arx s LEU 337 Ca 0.61 2.68 -0.14 0.00 -0.22 0.00 0.00 54.13 57.06 1arx s LEU 337 Cb -0.12 -3.61 0.03 0.00 0.50 0.00 0.00 46.19 42.99 1arx s LEU 337 CO 0.52 -0.81 1.13 -2.16 -1.32 0.00 0.00 176.35 173.71 1arx s PRO 338 N 0.58 2.41 -0.12 0.98 0.04 -1.26 -4.98 135.00 132.65 1arx s PRO 338 Ca 0.67 1.46 0.02 0.00 0.04 0.00 0.00 61.00 63.19 1arx s PRO 338 Cb -0.44 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.21 1arx s PRO 338 CO 0.36 -1.56 -0.18 0.45 0.04 0.00 0.00 177.00 176.10 1arx s SER 339 N -2.59 2.75 -0.09 6.66 0.15 -1.26 -3.48 113.70 115.85 1arx s SER 339 Ca 0.68 -0.51 -0.16 0.00 0.70 0.00 0.00 55.95 56.66 1arx s SER 339 Cb -0.22 -1.26 -0.05 0.00 -1.71 0.00 0.00 66.02 62.78 1arx s SER 339 CO 0.46 0.05 0.40 -0.76 1.20 0.00 0.00 173.24 174.58 1arx s LEU 340 N 0.88 4.34 0.67 3.45 1.43 0.22 -4.94 118.68 124.74 1arx s LEU 340 Ca -0.07 0.78 -0.11 0.00 -1.03 0.00 0.00 54.13 53.69 1arx s LEU 340 Cb -0.15 -2.56 -0.00 0.00 0.03 0.00 0.00 46.19 43.51 1arx s LEU 340 CO -0.01 0.15 1.05 0.00 0.23 0.00 0.00 176.35 177.77 1arx s ALA 341 N -0.06 2.75 0.72 4.21 0.00 -1.26 -4.45 121.76 123.68 1arx s ALA 341 Ca 0.22 0.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.11 1arx s ALA 341 Cb -0.15 -3.17 -0.00 0.00 0.00 0.00 0.00 23.12 19.80 1arx s ALA 341 CO 0.09 -1.09 0.86 -2.30 0.00 0.00 0.00 175.76 173.32 1arx n PRO 342 N -2.96 0.45 -2.41 0.00 -0.02 -1.26 -4.59 135.00 124.21 1arx n PRO 342 Ca 0.07 0.20 -0.39 0.00 -2.02 0.00 0.00 63.50 61.37 1arx n PRO 342 Cb 0.54 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.86 1arx n PRO 342 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1arx s ALA 343 N -1.85 3.26 -2.00 3.55 0.00 0.14 -4.95 121.76 119.91 1arx s ALA 343 Ca 0.71 0.90 0.16 0.00 0.00 0.00 0.00 51.96 53.73 1arx s ALA 343 Cb -0.35 -3.34 0.96 0.00 0.00 0.00 0.00 23.12 20.40 1arx s ALA 343 CO 0.52 -0.32 1.37 -0.35 0.00 0.00 0.00 175.76 176.98