#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m8t h LEU 2 N 0.00 0.49 -0.66 0.27 3.38 -1.72 0.56 115.31 117.63 1m8t h LEU 2 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1m8t h LEU 2 Cb 0.00 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1m8t h LEU 2 CO 0.00 0.32 0.38 0.58 0.09 0.00 0.00 178.44 179.80 1m8t h VAL 3 N 0.56 1.20 -0.22 1.22 2.07 -1.97 -1.53 116.25 117.58 1m8t h VAL 3 Ca 0.27 -0.49 -0.17 0.00 0.82 0.00 0.00 66.70 67.14 1m8t h VAL 3 Cb 0.33 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1m8t h VAL 3 CO -0.08 0.22 -0.54 1.56 0.02 0.00 0.00 177.57 178.75 1m8t h GLN 4 N 0.90 0.64 -0.63 1.57 4.20 -1.53 -2.52 115.11 117.74 1m8t h GLN 4 Ca 0.23 -0.40 0.10 0.00 0.06 0.00 0.00 58.65 58.65 1m8t h GLN 4 Cb 0.02 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 1m8t h GLN 4 CO -0.04 1.01 0.42 0.35 -0.67 0.00 0.00 178.83 179.90 1m8t h PHE 5 N 0.49 0.48 -0.68 2.96 -0.00 -0.53 0.19 116.94 119.84 1m8t h PHE 5 Ca 0.01 0.01 -0.07 0.00 -0.00 0.00 0.00 57.97 57.93 1m8t h PHE 5 Cb 1.10 -0.16 -0.03 0.00 -0.00 0.00 0.00 35.95 36.86 1m8t h PHE 5 CO 0.05 0.23 0.17 -0.97 -0.00 0.00 0.00 178.31 177.79 1m8t h ASN 6 N 0.45 1.03 0.07 0.41 -1.24 -0.85 -2.17 115.58 113.27 1m8t h ASN 6 Ca 0.29 -0.23 -0.15 0.00 0.71 0.00 0.00 56.30 56.92 1m8t h ASN 6 Cb 0.54 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 1m8t h ASN 6 CO -0.09 0.99 -0.52 1.23 -1.29 0.00 0.00 177.43 177.76 1m8t h GLY 7 N 1.02 0.54 0.93 1.57 0.00 -0.52 -2.10 103.07 104.51 1m8t h GLY 7 Ca 0.21 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1m8t h GLY 7 CO 0.00 0.54 0.14 -0.33 0.00 0.00 0.00 176.54 176.90 1m8t h MET 8 N 0.39 0.48 -0.42 4.80 2.86 -0.84 -0.92 114.93 121.28 1m8t h MET 8 Ca 0.01 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 1m8t h MET 8 Cb 1.04 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.60 1m8t h MET 8 CO 0.09 0.47 -0.07 0.82 1.06 0.00 0.00 176.91 179.29 1m8t h ILE 9 N 0.38 1.24 0.00 -1.22 2.04 -1.38 -1.00 117.51 117.57 1m8t h ILE 9 Ca 0.11 -1.06 -0.05 0.00 1.00 0.00 0.00 64.86 64.86 1m8t h ILE 9 Cb 0.16 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1m8t h ILE 9 CO -0.01 0.36 -0.23 0.03 0.00 0.00 0.00 178.15 178.30 1m8t h ARG 10 N 0.66 0.00 -0.56 2.37 3.08 -1.11 0.32 114.38 119.14 1m8t h ARG 10 Ca 0.12 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.06 1m8t h ARG 10 Cb 0.50 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1m8t h ARG 10 CO 0.03 0.23 -0.09 0.00 -1.07 0.00 0.00 179.97 179.07 1m8t n THR 12 N -4.15 1.16 -3.46 0.00 -2.24 -1.00 -4.10 114.28 100.49 1m8t n THR 12 Ca 0.02 -0.72 -0.27 0.00 -2.27 0.00 0.00 64.05 60.81 1m8t n THR 12 Cb 0.40 -0.63 -0.09 0.00 -2.10 0.00 0.00 70.33 67.90 1m8t n THR 12 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1m8t n ILE 13 N -2.81 1.30 -0.15 2.28 5.41 0.11 -4.87 119.36 120.63 1m8t n ILE 13 Ca -0.16 -4.76 0.27 0.00 1.00 0.00 0.00 62.75 59.10 1m8t n ILE 13 Cb 0.91 -2.05 0.70 0.00 -0.71 0.00 0.00 39.64 38.50 1m8t n ILE 13 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1m8t h PRO 14 N 4.49 0.03 -0.20 0.38 0.11 -1.61 -2.28 132.00 132.92 1m8t h PRO 14 Ca 0.17 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1m8t h PRO 14 Cb 0.74 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1m8t h PRO 14 CO 0.70 0.02 0.00 0.41 -0.21 0.00 0.00 178.00 178.92 1m8t n GLY 15 N -1.69 -0.35 3.75 -0.55 0.00 -1.26 -4.90 105.19 100.19 1m8t n GLY 15 Ca 0.17 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1m8t n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1m8t s SER 16 N -0.86 4.55 -0.57 1.61 1.04 -0.86 -5.07 113.70 113.54 1m8t s SER 16 Ca 0.04 -0.97 0.05 0.00 0.48 0.00 0.00 55.95 55.55 1m8t s SER 16 Cb 0.02 -0.54 0.19 0.00 0.10 0.00 0.00 66.02 65.80 1m8t s SER 16 CO 0.03 -0.50 0.50 -0.38 0.98 0.00 0.00 173.24 173.87 1m8t n ILE 17 N -1.25 0.69 -0.31 -1.02 5.41 -1.26 -4.92 119.36 116.70 1m8t n ILE 17 Ca -0.01 -4.43 -0.05 0.00 1.00 0.00 0.00 62.75 59.27 1m8t n ILE 17 Cb 0.63 -1.99 -0.02 0.00 -0.71 0.00 0.00 39.64 37.55 1m8t n ILE 17 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1m8t n PRO 18 N 1.93 -0.26 0.19 0.38 -0.02 -1.26 -1.04 135.00 134.91 1m8t n PRO 18 Ca 0.25 1.16 0.11 0.00 -2.02 0.00 0.00 63.50 63.00 1m8t n PRO 18 Cb 0.42 -1.72 0.58 0.00 -0.02 0.00 0.00 33.50 32.76 1m8t n PRO 18 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 1m8t h TRP 19 N 0.00 0.00 0.00 6.00 5.08 -1.96 -1.73 115.95 123.35 1m8t h TRP 19 Ca 0.19 0.00 -0.18 0.00 1.08 0.00 0.00 58.89 59.99 1m8t h TRP 19 Cb 0.38 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.52 1m8t h TRP 19 CO -0.73 0.00 -1.44 1.87 -1.28 0.00 0.00 178.44 176.86 1m8t n TRP 20 N -2.30 0.00 0.27 0.12 -0.00 -0.21 -4.27 117.44 111.05 1m8t n TRP 20 Ca -0.01 0.00 0.13 0.00 -0.00 0.00 0.00 57.50 57.62 1m8t n TRP 20 Cb 0.16 -0.47 0.76 0.00 -0.00 0.00 0.00 31.31 31.76 1m8t n TRP 20 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 177.69 177.25 1m8t h ASP 21 N -0.57 0.00 0.00 5.87 3.32 -1.05 -3.21 116.42 120.78 1m8t h ASP 21 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1m8t h ASP 21 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1m8t h ASP 21 CO -0.16 0.09 -0.02 -1.22 -1.72 0.00 0.00 179.24 176.22 1m8t n TYR 22 N -3.71 0.00 0.51 4.55 4.01 -0.66 -4.71 117.16 117.15 1m8t n TYR 22 Ca -0.02 -0.54 0.12 0.00 -0.16 0.00 0.00 57.90 57.30 1m8t n TYR 22 Cb 0.20 -0.07 0.13 0.00 -0.31 0.00 0.00 39.34 39.30 1m8t n TYR 22 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1m8t h SER 23 N 0.00 0.00 -1.55 7.72 4.64 -1.67 -3.35 113.55 119.34 1m8t h SER 23 Ca 0.00 -0.20 -0.42 0.00 -0.47 0.00 0.00 61.79 60.70 1m8t h SER 23 Cb 0.68 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.48 1m8t h SER 23 CO 0.00 0.10 -0.82 -0.67 -0.87 0.00 0.00 176.83 174.57 1m8t n ASP 24 N -2.18 -1.41 -3.81 4.97 4.64 -1.21 -3.95 116.55 113.60 1m8t n ASP 24 Ca 0.03 -2.74 -0.18 0.00 -1.38 0.00 0.00 54.79 50.51 1m8t n ASP 24 Cb 0.45 0.36 -0.16 0.00 -1.04 0.00 0.00 41.12 40.73 1m8t n ASP 24 CO 0.00 0.00 0.00 -0.47 -0.82 0.00 0.00 177.20 175.91 1m8t s TYR 25 N 0.03 0.39 0.00 -0.67 6.14 -0.58 -0.08 117.35 122.58 1m8t s TYR 25 Ca 0.33 -0.02 0.00 0.00 0.64 0.00 0.00 57.07 58.01 1m8t s TYR 25 Cb 0.10 -0.49 0.00 0.00 0.42 0.00 0.00 41.96 41.99 1m8t s TYR 25 CO -0.15 -0.16 0.00 0.41 0.64 0.00 0.00 175.55 176.28 1m8t n GLY 26 N 4.33 0.79 0.08 8.97 0.00 -0.38 -1.71 105.19 117.28 1m8t n GLY 26 Ca -0.22 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 44.97 1m8t n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m8t n TYR 28 N -3.12 0.00 -2.24 0.00 4.01 -1.26 -3.62 117.16 110.93 1m8t n TYR 28 Ca -0.16 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.18 1m8t n TYR 28 Cb 1.04 -0.73 -0.03 0.00 -0.31 0.00 0.00 39.34 39.31 1m8t n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1m8t n GLY 30 N 5.49 0.69 3.63 0.00 0.00 -1.25 -1.53 105.19 112.22 1m8t n GLY 30 Ca 0.15 -2.08 -0.46 0.00 0.00 0.00 0.00 46.02 43.63 1m8t n GLY 30 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1m8t n SER 31 N 1.10 3.41 -0.23 1.61 2.88 -1.26 -4.67 113.62 116.46 1m8t n SER 31 Ca 0.00 0.73 0.00 0.00 -1.33 0.00 0.00 58.87 58.27 1m8t n SER 31 Cb 0.00 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.03 1m8t n SER 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1m8t n GLY 32 N 4.99 -1.17 0.00 0.46 0.00 -1.26 -5.03 105.19 103.17 1m8t n GLY 32 Ca 0.26 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1m8t n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m8t n GLY 33 N 0.00 2.93 3.71 -0.02 0.00 -1.26 -4.62 105.19 105.93 1m8t n GLY 33 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 1m8t n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1m8t s SER 34 N 0.00 -0.24 0.05 1.61 1.04 -1.24 -4.98 113.70 109.94 1m8t s SER 34 Ca 0.00 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1m8t s SER 34 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1m8t s SER 34 CO 0.00 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.91 1m8t n GLY 35 N -0.43 -1.66 3.70 7.32 0.00 -1.25 -4.72 105.19 108.15 1m8t n GLY 35 Ca -0.07 -1.34 -0.37 0.00 0.00 0.00 0.00 46.02 44.24 1m8t n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m8t s THR 36 N 0.00 5.24 0.52 2.61 2.01 -1.26 -5.05 115.64 119.71 1m8t s THR 36 Ca 0.00 0.67 -0.19 0.00 0.31 0.00 0.00 61.69 62.48 1m8t s THR 36 Cb 0.00 -3.70 -0.10 0.00 0.01 0.00 0.00 72.50 68.71 1m8t s THR 36 CO 0.00 0.32 0.52 -2.65 -0.69 0.00 0.00 174.62 172.11 1m8t n PRO 37 N 4.02 0.54 -0.18 4.92 -0.02 -1.26 -4.88 135.00 138.14 1m8t n PRO 37 Ca -0.10 0.21 0.10 0.00 -2.02 0.00 0.00 63.50 61.69 1m8t n PRO 37 Cb 0.51 -1.63 0.19 0.00 -0.02 0.00 0.00 33.50 32.56 1m8t n PRO 37 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1m8t n VAL 38 N -1.41 0.55 0.00 -1.45 0.24 -1.26 -5.00 118.33 110.00 1m8t n VAL 38 Ca 0.11 -0.78 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 1m8t n VAL 38 Cb 0.45 0.92 0.00 0.00 -1.47 0.00 0.00 33.84 33.74 1m8t n VAL 38 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1m8t n ASP 39 N 1.28 0.00 -0.29 -1.34 5.68 -1.26 -5.00 116.55 115.62 1m8t n ASP 39 Ca 0.17 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.54 1m8t n ASP 39 Cb 0.55 0.00 0.23 0.00 -1.14 0.00 0.00 41.12 40.76 1m8t n ASP 39 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1m8t h GLU 40 N 0.00 0.51 -0.71 0.11 4.81 -1.95 -0.21 114.58 117.15 1m8t h GLU 40 Ca 0.00 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1m8t h GLU 40 Cb 0.00 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.23 1m8t h GLU 40 CO 0.00 0.34 0.47 1.25 -0.73 0.00 0.00 179.01 180.33 1m8t h LEU 41 N 0.52 0.80 -0.98 1.64 5.85 -1.90 0.58 115.31 121.83 1m8t h LEU 41 Ca 0.47 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 59.07 1m8t h LEU 41 Cb 0.74 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1m8t h LEU 41 CO -0.41 0.58 -0.45 -0.78 -0.34 0.00 0.00 178.44 177.04 1m8t h ASP 42 N 0.95 0.13 -0.53 1.25 3.58 -1.44 -2.44 116.42 117.92 1m8t h ASP 42 Ca 0.26 -0.06 -0.08 0.00 0.42 0.00 0.00 57.03 57.58 1m8t h ASP 42 Cb -0.10 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1m8t h ASP 42 CO -0.06 0.57 0.03 -0.09 -2.88 0.00 0.00 179.24 176.81 1m8t h ARG 43 N 0.10 0.91 -0.39 0.28 2.43 0.25 -1.44 114.38 116.53 1m8t h ARG 43 Ca 0.01 -0.27 0.06 0.00 -0.81 0.00 0.00 59.98 58.96 1m8t h ARG 43 Cb 0.84 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.25 1m8t h ARG 43 CO 0.06 0.92 0.07 0.00 -1.51 0.00 0.00 179.97 179.51 1m8t h GLN 46 N 0.00 0.05 0.00 0.00 4.15 -0.11 0.21 115.11 119.41 1m8t h GLN 46 Ca -0.00 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.31 1m8t h GLN 46 Cb 0.65 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 1m8t h GLN 46 CO 0.03 0.53 -0.37 -0.39 -1.93 0.00 0.00 178.83 176.70 1m8t h VAL 47 N -0.43 0.86 -0.31 2.39 -1.51 -1.37 -2.19 116.25 113.69 1m8t h VAL 47 Ca 0.00 -1.55 -0.15 0.00 -1.23 0.00 0.00 66.70 63.77 1m8t h VAL 47 Cb 0.53 1.96 -0.01 0.00 -2.13 0.00 0.00 31.29 31.63 1m8t h VAL 47 CO 0.01 0.37 -0.42 -0.74 -1.23 0.00 0.00 177.57 175.55 1m8t h HIS 48 N 0.00 0.93 -0.67 5.19 -0.00 -1.29 0.11 115.15 119.43 1m8t h HIS 48 Ca -0.00 -0.29 -0.02 0.00 -0.00 0.00 0.00 60.37 60.06 1m8t h HIS 48 Cb 0.93 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 28.11 1m8t h HIS 48 CO 0.00 1.06 0.34 -0.44 -0.00 0.00 0.00 177.93 178.89 1m8t h ASP 49 N 0.63 0.86 -0.23 3.26 5.19 -0.64 -1.10 116.42 124.39 1m8t h ASP 49 Ca 0.05 -0.12 -0.07 0.00 -0.62 0.00 0.00 57.03 56.26 1m8t h ASP 49 Cb 0.98 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 40.26 1m8t h ASP 49 CO 0.09 0.74 -0.09 0.78 -3.12 0.00 0.00 179.24 177.64 1m8t h ASN 50 N 0.92 0.58 -0.46 6.45 -0.26 -0.94 0.69 115.58 122.56 1m8t h ASN 50 Ca 0.23 -0.15 -0.11 0.00 -0.56 0.00 0.00 56.30 55.71 1m8t h ASN 50 Cb 0.09 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 37.18 1m8t h ASN 50 CO -0.03 0.71 -0.12 0.00 -1.06 0.00 0.00 177.43 176.92 1m8t h TYR 52 N 0.84 0.24 -0.19 0.00 -1.99 -0.68 0.47 116.97 115.66 1m8t h TYR 52 Ca 0.13 -0.07 -0.15 0.00 2.00 0.00 0.00 58.73 60.64 1m8t h TYR 52 Cb 0.67 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.34 1m8t h TYR 52 CO 0.04 0.63 -0.49 1.15 -0.00 0.00 0.00 178.16 179.49 1m8t h THR 53 N 0.17 1.32 -0.03 -2.88 2.02 -0.35 -2.40 112.91 110.75 1m8t h THR 53 Ca 0.01 -1.72 -0.24 0.00 0.77 0.00 0.00 66.41 65.24 1m8t h THR 53 Cb 0.88 1.71 0.01 0.00 -1.74 0.00 0.00 68.15 69.01 1m8t h THR 53 CO 0.07 0.53 -0.94 1.56 0.37 0.00 0.00 175.52 177.11 1m8t h GLN 54 N 0.40 0.59 0.00 6.66 4.20 -0.58 -3.18 115.11 123.20 1m8t h GLN 54 Ca 0.02 -0.59 -0.02 0.00 0.06 0.00 0.00 58.65 58.11 1m8t h GLN 54 Cb 1.01 0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.94 1m8t h GLN 54 CO 0.09 1.21 -0.10 0.00 -0.67 0.00 0.00 178.83 179.36 1m8t h ALA 55 N 0.59 1.64 0.00 3.87 0.00 -0.83 -1.36 119.26 123.16 1m8t h ALA 55 Ca -0.09 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1m8t h ALA 55 Cb 1.58 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1m8t h ALA 55 CO 0.18 0.12 0.00 1.04 0.00 0.00 0.00 179.25 180.59 1m8t n GLN 56 N -4.13 0.21 -0.39 0.00 6.02 -0.91 -2.67 117.38 115.51 1m8t n GLN 56 Ca -0.03 0.37 0.09 0.00 -0.01 0.00 0.00 57.00 57.42 1m8t n GLN 56 Cb 0.18 -1.85 0.27 0.00 1.02 0.00 0.00 30.24 29.86 1m8t n GLN 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1m8t n GLN 57 N -2.25 2.74 -3.65 -1.09 10.64 -0.51 -4.76 117.38 118.50 1m8t n GLN 57 Ca 0.03 -2.19 -0.30 0.00 -1.83 0.00 0.00 57.00 52.71 1m8t n GLN 57 Cb 0.28 -1.60 -0.04 0.00 -0.86 0.00 0.00 30.24 28.03 1m8t n GLN 57 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1m8t s LEU 58 N -1.26 4.23 0.15 2.61 1.43 -1.09 -5.03 118.68 119.72 1m8t s LEU 58 Ca 0.40 0.54 -0.31 0.00 -1.03 0.00 0.00 54.13 53.72 1m8t s LEU 58 Cb 0.23 -3.28 -0.09 0.00 0.03 0.00 0.00 46.19 43.08 1m8t s LEU 58 CO 0.24 -0.01 1.44 0.28 0.23 0.00 0.00 176.35 178.53 1m8t s THR 59 N -1.78 3.05 -1.52 5.49 -1.32 -1.26 -3.15 115.64 115.16 1m8t s THR 59 Ca 0.40 0.77 -0.13 0.00 -1.21 0.00 0.00 61.69 61.52 1m8t s THR 59 Cb -0.12 -3.50 0.08 0.00 -1.51 0.00 0.00 72.50 67.46 1m8t s THR 59 CO 0.27 0.07 1.01 -0.62 -2.21 0.00 0.00 174.62 173.14 1m8t n GLU 60 N 3.70 -5.80 -3.98 7.08 1.02 -1.26 -4.92 120.64 116.48 1m8t n GLU 60 Ca 0.11 0.62 -0.34 0.00 -0.02 0.00 0.00 57.16 57.53 1m8t n GLU 60 Cb 0.41 -5.53 -0.15 0.00 -0.02 0.00 0.00 31.44 26.15 1m8t n GLU 60 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1m8t s SER 67 N 1.34 4.17 0.30 0.00 0.15 -1.26 -4.27 113.70 114.13 1m8t s SER 67 Ca 0.02 -1.34 0.23 0.00 0.70 0.00 0.00 55.95 55.55 1m8t s SER 67 Cb -0.16 -1.36 1.10 0.00 -1.71 0.00 0.00 66.02 63.89 1m8t s SER 67 CO -0.05 -0.23 1.70 -0.81 1.20 0.00 0.00 173.24 175.05 1m8t n PRO 68 N 4.54 0.17 0.12 5.44 -0.04 -1.26 -0.63 135.00 143.35 1m8t n PRO 68 Ca -0.12 0.54 -0.21 0.00 -0.04 0.00 0.00 63.50 63.67 1m8t n PRO 68 Cb 0.43 -1.93 -0.15 0.00 -0.04 0.00 0.00 33.50 31.81 1m8t n PRO 68 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1m8t h TYR 69 N 0.00 0.80 0.00 0.54 -1.99 -1.95 -3.33 116.97 111.03 1m8t h TYR 69 Ca 0.00 -0.57 -0.36 0.00 2.00 0.00 0.00 58.73 59.80 1m8t h TYR 69 Cb 0.19 -0.04 -0.06 0.00 2.00 0.00 0.00 36.73 38.82 1m8t h TYR 69 CO 0.00 1.44 -2.37 0.45 -0.00 0.00 0.00 178.16 177.67 1m8t n SER 70 N -3.66 2.11 -4.66 3.88 2.88 -1.00 -2.84 113.62 110.33 1m8t n SER 70 Ca -0.13 -0.11 -0.52 0.00 -1.33 0.00 0.00 58.87 56.78 1m8t n SER 70 Cb 1.06 -0.40 -0.06 0.00 -0.75 0.00 0.00 64.21 64.06 1m8t n SER 70 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1m8t n LYS 71 N -3.25 1.58 -3.59 -1.46 3.00 0.20 -4.56 118.16 110.08 1m8t n LYS 71 Ca -0.43 0.58 -0.37 0.00 -0.00 0.00 0.00 58.31 58.09 1m8t n LYS 71 Cb 0.95 -2.30 -0.07 0.00 0.00 0.00 0.00 35.03 33.61 1m8t n LYS 71 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1m8t s ARG 72 N 2.34 4.07 0.39 1.64 1.81 -1.26 -0.10 118.95 127.84 1m8t s ARG 72 Ca 0.90 0.11 0.06 0.00 -1.72 0.00 0.00 55.73 55.08 1m8t s ARG 72 Cb -0.88 -3.35 -0.08 0.00 -0.45 0.00 0.00 34.95 30.19 1m8t s ARG 72 CO 0.52 0.40 0.02 1.52 -0.68 0.00 0.00 175.30 177.08 1m8t s TYR 73 N -0.04 2.41 -0.22 -0.53 -0.85 -1.26 -4.82 117.35 112.03 1m8t s TYR 73 Ca 0.17 -0.72 -0.08 0.00 -0.52 0.00 0.00 57.07 55.92 1m8t s TYR 73 Cb -0.13 -1.67 -0.04 0.00 0.38 0.00 0.00 41.96 40.49 1m8t s TYR 73 CO 0.05 0.36 0.09 0.45 -1.52 0.00 0.00 175.55 174.99 1m8t s SER 74 N -3.66 5.53 0.16 -0.18 0.15 -1.26 -4.98 113.70 109.45 1m8t s SER 74 Ca 0.35 -0.03 -0.06 0.00 0.70 0.00 0.00 55.95 56.91 1m8t s SER 74 Cb 0.10 -1.98 -0.02 0.00 -1.71 0.00 0.00 66.02 62.41 1m8t s SER 74 CO 0.17 0.06 0.21 -0.72 1.20 0.00 0.00 173.24 174.16 1m8t s TYR 75 N 1.05 0.58 0.03 3.44 1.13 -1.26 -1.96 117.35 120.36 1m8t s TYR 75 Ca 0.05 -0.94 0.02 0.00 -1.41 0.00 0.00 57.07 54.79 1m8t s TYR 75 Cb -0.14 -0.21 -0.02 0.00 -1.10 0.00 0.00 41.96 40.49 1m8t s TYR 75 CO 0.03 -0.66 -0.07 0.34 -2.51 0.00 0.00 175.55 172.69 1m8t s ASP 76 N -3.00 0.71 -0.22 -0.18 2.15 -0.88 -4.91 116.67 110.33 1m8t s ASP 76 Ca 0.20 -0.47 0.02 0.00 0.43 0.00 0.00 52.55 52.73 1m8t s ASP 76 Cb 0.05 0.03 0.05 0.00 -0.30 0.00 0.00 42.92 42.75 1m8t s ASP 76 CO 0.01 -0.18 -0.11 0.00 -0.17 0.00 0.00 175.17 174.73 1m8t s SER 78 N 1.29 4.36 -1.16 0.00 0.01 -0.96 -4.84 113.70 112.39 1m8t s SER 78 Ca -0.04 -1.81 -0.03 0.00 1.31 0.00 0.00 55.95 55.38 1m8t s SER 78 Cb -0.18 -1.29 -0.02 0.00 0.21 0.00 0.00 66.02 64.74 1m8t s SER 78 CO -0.07 -0.37 0.92 -0.62 0.41 0.00 0.00 173.24 173.51 1m8t n GLU 79 N 4.53 -4.72 -1.73 12.44 1.02 -1.26 -3.08 120.64 127.83 1m8t n GLU 79 Ca -0.01 0.81 -0.13 0.00 -0.02 0.00 0.00 57.16 57.80 1m8t n GLU 79 Cb 0.42 -5.68 -0.04 0.00 -0.02 0.00 0.00 31.44 26.13 1m8t n GLU 79 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1m8t n GLY 80 N -1.25 0.78 3.00 0.62 0.00 -1.26 -5.01 105.19 102.07 1m8t n GLY 80 Ca -0.21 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.18 1m8t n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m8t s THR 81 N -2.57 1.19 0.28 2.61 2.01 -1.18 -4.65 115.64 113.34 1m8t s THR 81 Ca 0.00 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.48 1m8t s THR 81 Cb 0.00 -1.12 -0.05 0.00 0.01 0.00 0.00 72.50 71.34 1m8t s THR 81 CO 0.00 0.38 0.55 -0.76 -0.69 0.00 0.00 174.62 174.10 1m8t s LEU 82 N 1.03 4.07 -0.21 4.42 2.01 -1.26 -2.27 118.68 126.47 1m8t s LEU 82 Ca -0.07 0.73 -0.15 0.00 0.01 0.00 0.00 54.13 54.65 1m8t s LEU 82 Cb -0.15 -3.54 0.06 0.00 0.01 0.00 0.00 46.19 42.58 1m8t s LEU 82 CO -0.01 -0.18 0.52 0.28 1.01 0.00 0.00 176.35 177.97 1m8t s THR 83 N -2.05 -0.01 -0.44 5.49 -1.32 -1.03 -5.01 115.64 111.27 1m8t s THR 83 Ca 0.44 0.03 -0.19 0.00 -1.21 0.00 0.00 61.69 60.76 1m8t s THR 83 Cb -0.11 -0.75 0.03 0.00 -1.51 0.00 0.00 72.50 70.16 1m8t s THR 83 CO 0.29 0.01 0.55 0.00 -2.21 0.00 0.00 174.62 173.27 1m8t n LYS 85 N 5.97 -1.20 0.20 0.00 5.02 -0.83 -4.94 118.16 122.38 1m8t n LYS 85 Ca -0.05 -0.30 0.14 0.00 -2.02 0.00 0.00 58.31 56.09 1m8t n LYS 85 Cb 0.47 -2.30 0.71 0.00 -0.02 0.00 0.00 35.03 33.89 1m8t n LYS 85 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m8t h ALA 86 N -2.20 1.00 -0.38 7.82 0.00 -1.96 -3.25 119.26 120.30 1m8t h ALA 86 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1m8t h ALA 86 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1m8t h ALA 86 CO 0.44 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.29 1m8t n ASP 87 N -2.47 3.11 -4.78 0.00 3.85 -1.26 -4.98 116.55 110.03 1m8t n ASP 87 Ca -0.01 -1.94 -0.36 0.00 -0.71 0.00 0.00 54.79 51.77 1m8t n ASP 87 Cb 0.09 -0.24 -0.02 0.00 -1.35 0.00 0.00 41.12 39.60 1m8t n ASP 87 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.20 176.39 1m8t s ASN 88 N -1.44 6.17 0.59 -1.12 0.01 -1.23 -4.98 114.94 112.94 1m8t s ASN 88 Ca 0.38 2.16 -0.01 0.00 -0.71 0.00 0.00 52.86 54.68 1m8t s ASN 88 Cb 0.22 -2.59 0.08 0.00 0.41 0.00 0.00 41.25 39.37 1m8t s ASN 88 CO 0.30 -0.91 0.53 -0.90 -1.51 0.00 0.00 177.10 174.61 1m8t n ASP 89 N -0.74 0.66 -0.23 -1.22 3.85 -1.26 -4.63 116.55 112.98 1m8t n ASP 89 Ca 0.09 -1.57 -0.05 0.00 -0.71 0.00 0.00 54.79 52.55 1m8t n ASP 89 Cb 0.50 -0.35 0.01 0.00 -1.35 0.00 0.00 41.12 39.93 1m8t n ASP 89 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1m8t h GLU 90 N 0.00 -0.14 0.05 0.11 4.57 -1.99 0.50 114.58 117.68 1m8t h GLU 90 Ca -0.17 0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1m8t h GLU 90 Cb 0.63 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 1m8t h GLU 90 CO 0.18 -0.09 -0.02 0.00 -1.18 0.00 0.00 179.01 177.89 1m8t h ALA 92 N 0.14 0.20 -0.86 0.00 0.00 -1.85 0.21 119.26 117.11 1m8t h ALA 92 Ca -0.01 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1m8t h ALA 92 Cb 0.61 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 1m8t h ALA 92 CO 0.01 -0.46 0.52 0.00 0.00 0.00 0.00 179.25 179.32 1m8t h ALA 93 N 1.28 1.19 -0.16 0.00 0.00 -1.02 0.21 119.26 120.77 1m8t h ALA 93 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 1m8t h ALA 93 Cb 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1m8t h ALA 93 CO -0.29 0.23 -0.46 0.35 0.00 0.00 0.00 179.25 179.08 1m8t h PHE 94 N 0.93 0.78 -0.11 0.00 3.04 -1.36 -2.69 116.94 117.53 1m8t h PHE 94 Ca 0.38 -0.31 -0.08 0.00 3.98 0.00 0.00 57.97 61.95 1m8t h PHE 94 Cb 0.23 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.59 1m8t h PHE 94 CO -0.04 1.08 -0.28 0.28 -2.02 0.00 0.00 178.31 177.33 1m8t h VAL 95 N 0.25 1.24 -0.37 1.41 2.07 -0.63 -2.13 116.25 118.10 1m8t h VAL 95 Ca -0.01 -1.16 -0.13 0.00 0.82 0.00 0.00 66.70 66.23 1m8t h VAL 95 Cb 1.08 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 1m8t h VAL 95 CO 0.10 0.35 -0.26 0.00 0.02 0.00 0.00 177.57 177.77 1m8t h ASP 97 N 0.62 0.20 0.16 0.00 3.58 -1.19 -1.53 116.42 118.26 1m8t h ASP 97 Ca 0.07 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1m8t h ASP 97 Cb 0.83 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.83 1m8t h ASP 97 CO 0.07 0.62 -0.08 0.00 -2.88 0.00 0.00 179.24 176.98 1m8t h ASP 99 N -0.25 0.79 -0.30 0.00 3.32 -1.40 -2.68 116.42 115.90 1m8t h ASP 99 Ca -0.02 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1m8t h ASP 99 Cb 0.19 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1m8t h ASP 99 CO 0.04 0.71 0.15 -0.09 -1.72 0.00 0.00 179.24 178.33 1m8t h ARG 100 N 0.82 0.43 -0.42 3.56 2.43 -1.18 0.33 114.38 120.35 1m8t h ARG 100 Ca 0.20 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1m8t h ARG 100 Cb 0.13 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1m8t h ARG 100 CO -0.02 0.38 0.03 0.28 -1.51 0.00 0.00 179.97 179.13 1m8t h VAL 101 N 0.36 1.21 -0.08 0.20 2.07 -1.36 -1.53 116.25 117.13 1m8t h VAL 101 Ca 0.10 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 1m8t h VAL 101 Cb 0.09 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1m8t h VAL 101 CO -0.01 0.30 -0.29 0.00 0.02 0.00 0.00 177.57 177.58 1m8t h ALA 102 N 1.41 0.14 -0.85 1.67 0.00 -1.12 -0.33 119.26 120.19 1m8t h ALA 102 Ca 0.13 -0.43 0.06 0.00 0.00 0.00 0.00 54.91 54.67 1m8t h ALA 102 Cb 0.35 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1m8t h ALA 102 CO 0.01 0.17 0.56 0.00 0.00 0.00 0.00 179.25 179.99 1m8t h ALA 103 N 0.45 1.55 -0.08 0.00 0.00 -0.17 0.30 119.26 121.32 1m8t h ALA 103 Ca -0.01 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1m8t h ALA 103 Cb 0.93 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1m8t h ALA 103 CO 0.06 0.33 -0.20 0.82 0.00 0.00 0.00 179.25 180.27 1m8t h ILE 104 N 0.97 1.42 -0.89 0.00 2.04 -1.28 -2.72 117.51 117.05 1m8t h ILE 104 Ca 0.36 -1.54 0.05 0.00 1.00 0.00 0.00 64.86 64.73 1m8t h ILE 104 Cb 0.18 2.23 -0.06 0.00 -0.74 0.00 0.00 36.82 38.43 1m8t h ILE 104 CO -0.13 0.44 0.56 0.00 0.00 0.00 0.00 178.15 179.02 1m8t h PHE 106 N 1.05 0.79 -0.31 0.00 -1.00 -0.46 -2.76 116.94 114.26 1m8t h PHE 106 Ca 0.37 -0.10 -0.02 0.00 2.81 0.00 0.00 57.97 61.04 1m8t h PHE 106 Cb 0.10 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.43 1m8t h PHE 106 CO -0.02 0.73 0.12 0.00 -1.61 0.00 0.00 178.31 177.53 1m8t h ALA 107 N 1.31 1.63 -0.23 2.45 0.00 -0.92 -2.95 119.26 120.55 1m8t h ALA 107 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1m8t h ALA 107 Cb 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1m8t h ALA 107 CO 0.02 0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.97 1m8t n GLY 108 N -1.25 1.27 3.79 0.00 0.00 -1.05 -4.94 105.19 103.01 1m8t n GLY 108 Ca 0.02 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 1m8t n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m8t s ALA 109 N -1.72 3.73 0.62 4.61 0.00 -1.07 -5.06 121.76 122.86 1m8t s ALA 109 Ca 0.35 -0.58 -0.18 0.00 0.00 0.00 0.00 51.96 51.55 1m8t s ALA 109 Cb 0.21 -2.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 1m8t s ALA 109 CO 0.31 0.33 1.22 -2.14 0.00 0.00 0.00 175.76 175.47 1m8t s PRO 110 N -0.21 2.80 -0.38 0.00 0.02 -1.26 -4.88 135.00 131.09 1m8t s PRO 110 Ca 0.14 1.85 -0.10 0.00 0.02 0.00 0.00 61.00 62.90 1m8t s PRO 110 Cb -0.12 -1.90 0.04 0.00 0.02 0.00 0.00 34.50 32.53 1m8t s PRO 110 CO 0.03 -1.34 0.20 -0.47 -0.33 0.00 0.00 177.00 175.09 1m8t s TYR 111 N -1.63 3.26 -0.37 6.54 6.14 -1.26 -4.52 117.35 125.52 1m8t s TYR 111 Ca 0.78 -1.16 -0.14 0.00 0.64 0.00 0.00 57.07 57.19 1m8t s TYR 111 Cb -0.31 -2.51 -0.00 0.00 0.42 0.00 0.00 41.96 39.55 1m8t s TYR 111 CO 0.36 -0.71 0.29 -0.80 0.64 0.00 0.00 175.55 175.33 1m8t s ASN 112 N 1.64 6.10 0.16 4.32 0.01 -1.26 -4.99 114.94 120.92 1m8t s ASN 112 Ca 0.01 -0.56 -0.15 0.00 -0.71 0.00 0.00 52.86 51.45 1m8t s ASN 112 Cb -0.20 -2.16 0.08 0.00 0.41 0.00 0.00 41.25 39.38 1m8t s ASN 112 CO 0.05 -0.34 1.78 0.11 -1.51 0.00 0.00 177.10 177.19 1m8t h LYS 113 N 8.55 0.41 0.00 -0.60 1.57 -1.98 -1.79 116.57 122.72 1m8t h LYS 113 Ca -0.29 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1m8t h LYS 113 Cb 1.14 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1m8t h LYS 113 CO 0.68 0.27 0.09 -0.85 -0.57 0.00 0.00 179.45 179.07 1m8t n GLU 114 N -4.92 0.07 -0.08 3.15 -0.00 -1.26 0.07 120.64 117.67 1m8t n GLU 114 Ca 0.02 0.54 0.12 0.00 -0.00 0.00 0.00 57.16 57.84 1m8t n GLU 114 Cb 0.11 -1.83 0.29 0.00 -0.00 0.00 0.00 31.44 30.01 1m8t n GLU 114 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1m8t n ASN 115 N -1.88 2.51 -4.74 -1.84 3.02 -0.67 -4.84 115.26 106.81 1m8t n ASN 115 Ca -0.01 -1.83 -0.40 0.00 -0.03 0.00 0.00 54.58 52.31 1m8t n ASN 115 Cb 0.10 -0.10 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 1m8t n ASN 115 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1m8t s ILE 116 N -1.80 4.17 -1.08 2.41 1.01 0.11 -1.25 121.20 124.78 1m8t s ILE 116 Ca 0.34 2.05 -0.22 0.00 0.00 0.00 0.00 60.65 62.83 1m8t s ILE 116 Cb 0.20 -4.31 0.02 0.00 0.01 0.00 0.00 42.46 38.39 1m8t s ILE 116 CO 0.30 0.44 0.69 -3.20 0.00 0.00 0.00 174.94 173.16 1m8t n ASN 117 N 1.88 -4.73 -4.51 3.58 4.05 0.89 -4.92 115.26 111.50 1m8t n ASN 117 Ca -0.01 -1.11 -0.26 0.00 0.45 0.00 0.00 54.58 53.66 1m8t n ASN 117 Cb 0.48 -2.16 0.13 0.00 1.23 0.00 0.00 39.78 39.46 1m8t n ASN 117 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1m8t s ILE 118 N -3.35 2.11 -0.79 -1.44 -4.36 -1.26 -4.98 121.20 107.13 1m8t s ILE 118 Ca 0.34 -0.37 -0.23 0.00 -0.26 0.00 0.00 60.65 60.14 1m8t s ILE 118 Cb -0.17 -2.74 0.07 0.00 1.25 0.00 0.00 42.46 40.87 1m8t s ILE 118 CO 0.92 0.00 1.13 -0.62 0.24 0.00 0.00 174.94 176.62 1m8t s ASP 119 N -4.77 6.32 0.35 4.36 2.15 -1.26 -4.84 116.67 118.98 1m8t s ASP 119 Ca 0.68 -1.18 0.15 0.00 0.43 0.00 0.00 52.55 52.64 1m8t s ASP 119 Cb -0.05 -2.46 0.62 0.00 -0.30 0.00 0.00 42.92 40.73 1m8t s ASP 119 CO 0.47 -1.45 1.73 0.71 -0.17 0.00 0.00 175.17 176.46 1m8t h THR 120 N 6.08 1.14 0.00 1.71 1.35 -1.93 0.12 112.91 121.37 1m8t h THR 120 Ca -0.12 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.13 1m8t h THR 120 Cb 1.05 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 1m8t h THR 120 CO 1.22 0.43 0.00 0.35 -0.25 0.00 0.00 175.52 177.28 1m8t n THR 121 N -3.76 0.92 0.00 6.82 -2.24 -1.26 -2.88 114.28 111.88 1m8t n THR 121 Ca -0.01 0.33 0.00 0.00 -2.27 0.00 0.00 64.05 62.10 1m8t n THR 121 Cb 0.51 -1.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.48 1m8t n THR 121 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1m8t n THR 122 N -2.14 0.00 1.07 4.28 -2.24 -1.14 -4.79 114.28 109.32 1m8t n THR 122 Ca 0.02 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.90 1m8t n THR 122 Cb 0.18 -0.51 0.34 0.00 -2.10 0.00 0.00 70.33 68.24 1m8t n THR 122 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1m8t n ARG 123 N -1.72 1.88 0.00 -0.78 0.63 0.39 -5.12 116.66 111.94 1m8t n ARG 123 Ca 0.00 -1.32 0.00 0.00 -0.92 0.00 0.00 57.85 55.61 1m8t n ARG 123 Cb 0.32 -1.42 0.00 0.00 0.45 0.00 0.00 32.46 31.81 1m8t n ARG 123 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12