#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 0.59 -0.96 0.27 5.85 -1.67 0.19 115.31 119.58 1m8t h LEU 2 Ca 0.00 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 1m8t h LEU 2 Cb 0.00 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1m8t h LEU 2 CO 0.00 0.33 -0.11 0.58 -0.34 0.00 0.00 178.44 178.89 1m8t h VAL 3 N 0.64 1.24 0.03 1.05 2.07 -1.97 -2.38 116.25 116.94 1m8t h VAL 3 Ca 0.39 -1.09 -0.22 0.00 0.82 0.00 0.00 66.70 66.60 1m8t h VAL 3 Cb 0.62 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1m8t h VAL 3 CO -0.15 0.36 -0.98 1.56 0.02 0.00 0.00 177.57 178.38 1m8t h GLN 4 N 0.58 0.17 -0.65 1.57 4.20 -1.31 -2.88 115.11 116.79 1m8t h GLN 4 Ca 0.10 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 1m8t h GLN 4 Cb 0.54 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.36 1m8t h GLN 4 CO 0.03 1.02 0.33 0.35 -0.67 0.00 0.00 178.83 179.89 1m8t h PHE 5 N 0.08 0.89 -0.65 2.96 -0.00 -0.52 -0.35 116.94 119.34 1m8t h PHE 5 Ca -0.06 -0.02 -0.03 0.00 -0.00 0.00 0.00 57.97 57.86 1m8t h PHE 5 Cb 1.66 -0.28 -0.03 0.00 -0.00 0.00 0.00 35.95 37.29 1m8t h PHE 5 CO 0.03 0.63 0.28 -0.97 -0.00 0.00 0.00 178.31 178.28 1m8t h ASN 6 N 0.91 0.89 -0.55 0.41 -1.24 -1.33 -1.56 115.58 113.11 1m8t h ASN 6 Ca 0.23 -0.16 -0.07 0.00 0.71 0.00 0.00 56.30 57.01 1m8t h ASN 6 Cb 0.06 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.85 1m8t h ASN 6 CO -0.03 0.80 0.06 1.23 -1.29 0.00 0.00 177.43 178.20 1m8t h GLY 7 N 0.92 1.01 0.92 1.57 0.00 -1.10 -2.33 103.07 104.06 1m8t h GLY 7 Ca 0.22 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 1m8t h GLY 7 CO -0.02 0.64 0.04 -0.33 0.00 0.00 0.00 176.54 176.87 1m8t h MET 8 N 0.82 0.11 -0.81 4.80 2.86 -0.87 -1.15 114.93 120.68 1m8t h MET 8 Ca 0.17 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.86 1m8t h MET 8 Cb 0.45 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.03 1m8t h MET 8 CO 0.02 0.16 0.49 0.82 1.06 0.00 0.00 176.91 179.46 1m8t h ILE 9 N 0.03 1.00 0.00 -1.22 2.04 -1.23 0.28 117.51 118.41 1m8t h ILE 9 Ca 0.03 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1m8t h ILE 9 Cb 0.08 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 1m8t h ILE 9 CO -0.00 0.16 0.00 -1.14 0.00 0.00 0.00 178.15 177.17 1m8t n ARG 10 N -4.68 0.48 0.12 2.37 0.63 -0.88 0.10 116.66 114.81 1m8t n ARG 10 Ca 0.12 0.02 -0.24 0.00 -0.92 0.00 0.00 57.85 56.83 1m8t n ARG 10 Cb 0.19 -1.50 -0.16 0.00 0.45 0.00 0.00 32.46 31.45 1m8t n ARG 10 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1m8t h THR 12 N 0.09 0.86 -2.93 0.00 1.35 -0.86 -3.37 112.91 108.06 1m8t h THR 12 Ca -0.28 -2.71 -0.61 0.00 -0.55 0.00 0.00 66.41 62.26 1m8t h THR 12 Cb 2.11 2.42 -0.41 0.00 -1.73 0.00 0.00 68.15 70.55 1m8t h THR 12 CO 0.24 0.49 -0.70 -0.63 -0.25 0.00 0.00 175.52 174.67 1m8t s ILE 13 N -2.61 2.04 0.34 6.82 1.01 0.29 -4.86 121.20 124.24 1m8t s ILE 13 Ca -0.04 -3.55 0.10 0.00 0.00 0.00 0.00 60.65 57.15 1m8t s ILE 13 Cb 0.08 -2.37 0.33 0.00 0.01 0.00 0.00 42.46 40.51 1m8t s ILE 13 CO 0.82 -1.02 1.81 -0.65 0.00 0.00 0.00 174.94 175.91 1m8t h PRO 14 N 5.76 0.64 -0.01 2.79 0.11 -1.77 -2.19 132.00 137.34 1m8t h PRO 14 Ca 0.13 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1m8t h PRO 14 Cb 0.83 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1m8t h PRO 14 CO 0.60 0.43 0.00 0.41 -0.21 0.00 0.00 178.00 179.22 1m8t n GLY 15 N -1.40 -0.95 3.87 -0.55 0.00 -1.26 -4.90 105.19 100.00 1m8t n GLY 15 Ca 0.21 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.58 6.58 -0.57 1.61 1.04 -0.82 -5.02 113.70 114.93 1m8t s SER 16 Ca 0.28 1.10 0.06 0.00 0.48 0.00 0.00 55.95 57.87 1m8t s SER 16 Cb 0.13 -2.31 0.22 0.00 0.10 0.00 0.00 66.02 64.17 1m8t s SER 16 CO 0.22 -0.31 0.60 -0.38 0.98 0.00 0.00 173.24 174.35 1m8t n ILE 17 N -0.95 1.14 -0.34 -1.02 5.41 -1.26 -4.88 119.36 117.46 1m8t n ILE 17 Ca 0.02 -4.69 -0.05 0.00 1.00 0.00 0.00 62.75 59.04 1m8t n ILE 17 Cb 0.54 -2.04 -0.01 0.00 -0.71 0.00 0.00 39.64 37.42 1m8t n ILE 17 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1m8t h PRO 18 N 4.54 -0.06 0.00 0.38 0.11 -1.94 0.32 132.00 135.35 1m8t h PRO 18 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1m8t h PRO 18 Cb 0.76 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1m8t h PRO 18 CO 0.68 -0.04 0.23 0.11 -0.21 0.00 0.00 178.00 178.77 1m8t h TRP 19 N -0.06 0.00 0.00 0.65 5.08 -1.95 -1.58 115.95 118.09 1m8t h TRP 19 Ca 0.27 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 60.16 1m8t h TRP 19 Cb 0.55 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.70 1m8t h TRP 19 CO -0.86 0.00 -1.05 1.87 -1.28 0.00 0.00 178.44 177.13 1m8t n TRP 20 N -2.69 0.00 -0.11 0.12 -0.00 -0.29 -4.23 117.44 110.24 1m8t n TRP 20 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 57.50 57.43 1m8t n TRP 20 Cb 0.28 -0.44 0.01 0.00 -0.00 0.00 0.00 31.31 31.15 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 -0.71 -0.61 -0.63 5.87 3.45 -0.31 -3.11 116.42 120.38 1m8t h ASP 21 Ca -0.12 0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.48 1m8t h ASP 21 Cb 0.89 0.33 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 1m8t h ASP 21 CO -0.07 -0.21 0.00 -1.22 -1.57 0.00 0.00 179.24 176.16 1m8t n TYR 22 N -5.36 0.83 0.59 4.55 4.01 -0.61 -4.54 117.16 116.63 1m8t n TYR 22 Ca 0.02 -0.47 0.13 0.00 -0.16 0.00 0.00 57.90 57.41 1m8t n TYR 22 Cb 0.27 -0.01 0.43 0.00 -0.31 0.00 0.00 39.34 39.72 1m8t n TYR 22 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1m8t n SER 23 N 1.41 0.77 -2.99 7.72 3.41 -1.18 -3.71 113.62 119.04 1m8t n SER 23 Ca 0.21 0.59 -0.13 0.00 -0.26 0.00 0.00 58.87 59.28 1m8t n SER 23 Cb 0.58 -0.79 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 1m8t n SER 23 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1m8t n ASP 24 N -2.24 -2.16 -3.90 4.04 4.64 -1.24 -3.95 116.55 111.75 1m8t n ASP 24 Ca 0.05 -2.78 -0.21 0.00 -1.38 0.00 0.00 54.79 50.47 1m8t n ASP 24 Cb 0.39 0.84 -0.16 0.00 -1.04 0.00 0.00 41.12 41.15 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 0.42 0.83 0.00 -0.67 6.14 -0.54 0.07 117.35 123.60 1m8t s TYR 25 Ca 0.32 -0.25 0.00 0.00 0.64 0.00 0.00 57.07 57.77 1m8t s TYR 25 Cb 0.06 -0.73 0.00 0.00 0.42 0.00 0.00 41.96 41.70 1m8t s TYR 25 CO -0.13 -0.22 0.00 0.41 0.64 0.00 0.00 175.55 176.25 1m8t n GLY 26 N 4.13 1.83 0.02 8.97 0.00 0.13 -1.74 105.19 118.53 1m8t n GLY 26 Ca -0.23 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.93 0.00 -2.80 0.00 4.01 -1.25 -2.94 117.16 112.25 1m8t n TYR 28 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 1m8t n TYR 28 Cb 0.44 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.44 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 4.20 -0.31 3.65 0.00 0.00 -1.24 -1.47 105.19 110.02 1m8t n GLY 30 Ca 0.07 -2.27 -0.48 0.00 0.00 0.00 0.00 46.02 43.34 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 0.00 2.72 -0.14 1.61 2.88 -1.26 -4.69 113.62 114.74 1m8t n SER 31 Ca 0.00 1.08 0.02 0.00 -1.33 0.00 0.00 58.87 58.64 1m8t n SER 31 Cb 0.00 -1.35 -0.00 0.00 -0.75 0.00 0.00 64.21 62.11 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 3.30 -2.23 0.00 0.46 0.00 -1.26 -5.03 105.19 100.43 1m8t n GLY 32 Ca 0.18 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.31 1.74 3.53 -0.02 0.00 -1.26 -4.64 105.19 103.23 1m8t n GLY 33 Ca 0.00 0.12 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 1m8t n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1m8t s SER 34 N 0.00 -0.34 0.00 1.61 0.15 -1.15 -5.03 113.70 108.95 1m8t s SER 34 Ca 0.00 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.61 1m8t s SER 34 Cb 0.00 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 1m8t s SER 34 CO 0.00 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.42 1m8t n GLY 35 N -0.26 -1.62 3.73 9.45 0.00 -1.26 -4.76 105.19 110.46 1m8t n GLY 35 Ca -0.08 -1.37 -0.37 0.00 0.00 0.00 0.00 46.02 44.20 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 0.78 -0.22 0.00 0.31 0.00 0.00 61.69 62.56 1m8t s THR 36 Cb 0.00 -3.74 -0.06 0.00 0.01 0.00 0.00 72.50 68.71 1m8t s THR 36 CO 0.00 0.36 1.30 -2.65 -0.69 0.00 0.00 174.62 172.94 1m8t n PRO 37 N 3.60 1.69 0.08 4.92 -0.02 -1.26 -4.82 135.00 139.19 1m8t n PRO 37 Ca -0.09 0.62 -0.13 0.00 -2.02 0.00 0.00 63.50 61.88 1m8t n PRO 37 Cb 0.52 -2.49 -0.13 0.00 -0.02 0.00 0.00 33.50 31.37 1m8t n PRO 37 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1m8t h VAL 38 N 1.53 1.46 -3.28 -1.45 -1.51 -1.94 -3.48 116.25 107.58 1m8t h VAL 38 Ca -0.50 -3.10 -0.16 0.00 -1.23 0.00 0.00 66.70 61.71 1m8t h VAL 38 Cb 1.31 2.85 -0.04 0.00 -2.13 0.00 0.00 31.29 33.28 1m8t h VAL 38 CO 0.57 0.88 -0.05 -0.90 -1.23 0.00 0.00 177.57 176.85 1m8t n ASP 39 N -3.43 -1.08 -0.30 4.19 3.85 -1.26 -5.03 116.55 113.47 1m8t n ASP 39 Ca -0.08 -2.29 -0.03 0.00 -0.71 0.00 0.00 54.79 51.68 1m8t n ASP 39 Cb 1.00 1.96 0.09 0.00 -1.35 0.00 0.00 41.12 42.82 1m8t n ASP 39 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1m8t h GLU 40 N 0.00 1.06 -0.67 0.11 4.81 -1.94 -1.06 114.58 116.89 1m8t h GLU 40 Ca -0.20 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.94 1m8t h GLU 40 Cb 0.84 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 1m8t h GLU 40 CO 0.27 0.70 0.32 1.25 -0.73 0.00 0.00 179.01 180.82 1m8t h LEU 41 N 1.09 0.88 -1.17 1.64 6.46 -1.91 -1.62 115.31 120.69 1m8t h LEU 41 Ca 0.31 -0.13 -0.05 0.00 -0.12 0.00 0.00 57.88 57.89 1m8t h LEU 41 Cb -0.08 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.61 1m8t h LEU 41 CO -0.08 0.77 0.05 -0.78 -0.62 0.00 0.00 178.44 177.78 1m8t h ASP 42 N 0.93 0.59 -0.33 1.25 3.58 -1.79 -1.54 116.42 119.10 1m8t h ASP 42 Ca 0.23 -0.11 -0.05 0.00 0.42 0.00 0.00 57.03 57.52 1m8t h ASP 42 Cb 0.12 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 1m8t h ASP 42 CO -0.03 0.62 0.04 0.03 -2.88 0.00 0.00 179.24 177.03 1m8t h ARG 43 N 0.61 0.66 -0.88 0.28 3.08 -0.35 -0.83 114.38 116.95 1m8t h ARG 43 Ca 0.13 -0.14 0.03 0.00 0.07 0.00 0.00 59.98 60.07 1m8t h ARG 43 Cb 0.30 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 1m8t h ARG 43 CO 0.00 0.65 0.57 0.00 -1.07 0.00 0.00 179.97 180.12 1m8t h GLN 46 N 0.00 0.45 -0.27 0.00 4.15 -0.26 0.28 115.11 119.46 1m8t h GLN 46 Ca -0.00 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.18 1m8t h GLN 46 Cb 1.05 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 1m8t h GLN 46 CO 0.06 0.78 0.12 0.28 -1.93 0.00 0.00 178.83 178.14 1m8t h VAL 47 N 0.13 1.16 -0.63 2.39 2.07 -1.27 -1.80 116.25 118.30 1m8t h VAL 47 Ca 0.04 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.10 1m8t h VAL 47 Cb 0.67 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1m8t h VAL 47 CO 0.04 0.16 0.40 -0.74 0.02 0.00 0.00 177.57 177.46 1m8t h HIS 48 N 0.29 0.76 -0.53 1.57 -0.00 -1.24 -0.60 115.15 115.41 1m8t h HIS 48 Ca 0.09 0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.54 1m8t h HIS 48 Cb 0.15 -0.26 -0.05 0.00 -0.00 0.00 0.00 27.41 27.25 1m8t h HIS 48 CO -0.01 0.46 0.24 -0.44 -0.00 0.00 0.00 177.93 178.18 1m8t h ASP 49 N 0.82 0.30 -0.50 3.26 3.45 -0.10 -1.60 116.42 122.04 1m8t h ASP 49 Ca 0.24 0.05 -0.09 0.00 0.43 0.00 0.00 57.03 57.66 1m8t h ASP 49 Cb -0.05 -0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.69 1m8t h ASP 49 CO -0.07 0.20 -0.00 -1.13 -1.57 0.00 0.00 179.24 176.67 1m8t h ASN 50 N 0.45 0.91 -0.43 6.45 -0.73 -0.73 -2.09 115.58 119.41 1m8t h ASN 50 Ca 0.25 -0.24 -0.04 0.00 1.87 0.00 0.00 56.30 58.13 1m8t h ASN 50 Cb 0.22 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.54 1m8t h ASN 50 CO -0.21 0.97 0.14 0.00 -0.37 0.00 0.00 177.43 177.96 1m8t h TYR 52 N 0.72 1.08 -0.04 0.00 -1.99 -1.03 -2.27 116.97 113.44 1m8t h TYR 52 Ca 0.17 -0.40 -0.03 0.00 2.00 0.00 0.00 58.73 60.47 1m8t h TYR 52 Cb 0.24 -0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.76 1m8t h TYR 52 CO 0.01 1.22 -0.11 1.15 -0.00 0.00 0.00 178.16 180.43 1m8t h THR 53 N 0.63 1.11 0.04 -2.88 2.02 -1.07 -2.16 112.91 110.59 1m8t h THR 53 Ca 0.01 -0.49 -0.23 0.00 0.77 0.00 0.00 66.41 66.47 1m8t h THR 53 Cb 1.17 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 1m8t h THR 53 CO 0.12 0.14 -1.07 1.56 0.37 0.00 0.00 175.52 176.65 1m8t h GLN 54 N 0.06 0.08 -0.11 6.66 4.20 -1.27 -3.23 115.11 121.49 1m8t h GLN 54 Ca 0.01 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1m8t h GLN 54 Cb 0.24 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1m8t h GLN 54 CO 0.02 1.06 -0.19 0.00 -0.67 0.00 0.00 178.83 179.04 1m8t h ALA 55 N 0.88 1.47 0.00 3.87 0.00 -0.80 -1.34 119.26 123.34 1m8t h ALA 55 Ca -0.04 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1m8t h ALA 55 Cb 1.83 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1m8t h ALA 55 CO 0.15 0.38 0.00 1.04 0.00 0.00 0.00 179.25 180.82 1m8t n GLN 56 N -4.23 0.30 0.03 0.00 6.02 -0.99 -2.33 117.38 116.17 1m8t n GLN 56 Ca -0.01 0.09 0.11 0.00 -0.01 0.00 0.00 57.00 57.18 1m8t n GLN 56 Cb 0.31 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.01 1m8t n GLN 56 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1m8t n GLN 57 N -1.27 0.46 -1.55 -1.09 1.13 -0.51 -4.91 117.38 109.65 1m8t n GLN 57 Ca 0.10 -0.04 -0.30 0.00 -1.94 0.00 0.00 57.00 54.82 1m8t n GLN 57 Cb 0.16 -1.62 0.10 0.00 0.11 0.00 0.00 30.24 28.98 1m8t n GLN 57 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1m8t s LEU 58 N -4.39 2.52 0.24 1.08 1.43 -0.99 -5.00 118.68 113.58 1m8t s LEU 58 Ca -0.01 1.26 -0.30 0.00 -1.03 0.00 0.00 54.13 54.06 1m8t s LEU 58 Cb 0.13 -3.84 -0.09 0.00 0.03 0.00 0.00 46.19 42.42 1m8t s LEU 58 CO 0.84 -2.05 1.05 0.42 0.23 0.00 0.00 176.35 176.84 1m8t s THR 59 N -3.17 3.77 -1.23 5.49 -4.23 -1.26 -3.93 115.64 111.08 1m8t s THR 59 Ca 0.61 1.71 -0.30 0.00 -1.18 0.00 0.00 61.69 62.53 1m8t s THR 59 Cb -0.14 -4.09 0.03 0.00 1.34 0.00 0.00 72.50 69.64 1m8t s THR 59 CO 0.54 0.38 0.65 -0.62 -0.54 0.00 0.00 174.62 175.03 1m8t n GLU 60 N 1.60 -0.51 -3.73 3.99 -0.58 -1.26 -4.87 120.64 115.28 1m8t n GLU 60 Ca -0.00 0.14 -0.26 0.00 -0.42 0.00 0.00 57.16 56.62 1m8t n GLU 60 Cb 0.46 -2.89 -0.17 0.00 -0.57 0.00 0.00 31.44 28.27 1m8t n GLU 60 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1m8t s SER 67 N 1.92 3.83 0.30 0.00 0.15 -1.26 -4.02 113.70 114.61 1m8t s SER 67 Ca 0.01 -1.06 0.24 0.00 0.70 0.00 0.00 55.95 55.84 1m8t s SER 67 Cb -0.15 -1.48 1.08 0.00 -1.71 0.00 0.00 66.02 63.75 1m8t s SER 67 CO -0.07 -0.11 1.72 1.55 1.20 0.00 0.00 173.24 177.53 1m8t h PRO 68 N 7.86 0.00 0.10 5.44 0.13 -1.88 -0.97 132.00 142.68 1m8t h PRO 68 Ca -0.30 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.69 1m8t h PRO 68 Cb 1.08 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.23 1m8t h PRO 68 CO 0.53 0.00 -0.62 1.88 -0.23 0.00 0.00 178.00 179.56 1m8t h TYR 69 N 0.00 0.42 0.00 1.56 0.05 -1.95 -3.37 116.97 113.69 1m8t h TYR 69 Ca 0.00 -0.31 -0.36 0.00 0.05 0.00 0.00 58.73 58.12 1m8t h TYR 69 Cb 0.27 -0.02 -0.07 0.00 1.01 0.00 0.00 36.73 37.93 1m8t h TYR 69 CO 0.00 1.23 -2.35 0.43 -1.05 0.00 0.00 178.16 176.42 1m8t n SER 70 N -4.24 0.63 -4.49 3.88 7.64 -1.17 -2.47 113.62 113.40 1m8t n SER 70 Ca -0.13 -0.03 -0.50 0.00 1.01 0.00 0.00 58.87 59.22 1m8t n SER 70 Cb 0.74 0.67 -0.06 0.00 -1.01 0.00 0.00 64.21 64.55 1m8t n SER 70 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1m8t n LYS 71 N -2.83 1.26 -3.11 1.43 3.00 -0.38 -4.69 118.16 112.84 1m8t n LYS 71 Ca -0.34 0.36 -0.39 0.00 -0.00 0.00 0.00 58.31 57.94 1m8t n LYS 71 Cb 1.09 -2.53 -0.05 0.00 0.00 0.00 0.00 35.03 33.54 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 5.89 4.40 0.45 1.64 0.52 -1.26 -1.32 118.95 129.27 1m8t s ARG 72 Ca 1.07 0.87 0.05 0.00 -0.52 0.00 0.00 55.73 57.19 1m8t s ARG 72 Cb -0.81 -3.36 -0.05 0.00 0.52 0.00 0.00 34.95 31.25 1m8t s ARG 72 CO 0.49 0.30 0.02 1.52 0.02 0.00 0.00 175.30 177.65 1m8t s TYR 73 N -0.02 2.27 -0.22 -0.53 -0.85 -1.26 -4.86 117.35 111.87 1m8t s TYR 73 Ca 0.34 -0.77 -0.06 0.00 -0.52 0.00 0.00 57.07 56.06 1m8t s TYR 73 Cb -0.19 -1.72 -0.03 0.00 0.38 0.00 0.00 41.96 40.40 1m8t s TYR 73 CO 0.19 0.35 0.04 0.45 -1.52 0.00 0.00 175.55 175.07 1m8t s SER 74 N -3.78 5.06 0.16 -0.18 0.15 -1.26 -4.96 113.70 108.89 1m8t s SER 74 Ca 0.24 -0.18 -0.07 0.00 0.70 0.00 0.00 55.95 56.64 1m8t s SER 74 Cb 0.07 -1.89 -0.02 0.00 -1.71 0.00 0.00 66.02 62.47 1m8t s SER 74 CO 0.13 0.02 0.24 -0.72 1.20 0.00 0.00 173.24 174.11 1m8t s TYR 75 N 1.27 0.51 0.02 3.44 1.13 -1.26 -2.12 117.35 120.34 1m8t s TYR 75 Ca 0.04 -0.87 0.02 0.00 -1.41 0.00 0.00 57.07 54.85 1m8t s TYR 75 Cb -0.15 -0.15 -0.01 0.00 -1.10 0.00 0.00 41.96 40.55 1m8t s TYR 75 CO 0.03 -0.69 -0.07 0.34 -2.51 0.00 0.00 175.55 172.65 1m8t s ASP 76 N -2.99 0.80 -0.50 -0.18 -1.08 -0.34 -4.92 116.67 107.46 1m8t s ASP 76 Ca 0.19 -0.31 0.04 0.00 -0.52 0.00 0.00 52.55 51.95 1m8t s ASP 76 Cb 0.04 -0.03 0.13 0.00 -1.46 0.00 0.00 42.92 41.60 1m8t s ASP 76 CO 0.01 -0.05 0.26 0.00 0.52 0.00 0.00 175.17 175.91 1m8t s SER 78 N -0.16 6.37 -1.17 0.00 0.01 -0.40 -4.72 113.70 113.62 1m8t s SER 78 Ca 0.17 -2.27 -0.02 0.00 1.31 0.00 0.00 55.95 55.15 1m8t s SER 78 Cb -0.25 -2.18 -0.02 0.00 0.21 0.00 0.00 66.02 63.78 1m8t s SER 78 CO -0.00 -0.69 0.95 -0.62 0.41 0.00 0.00 173.24 173.29 1m8t n GLU 79 N 4.55 -5.33 0.00 12.44 -0.58 -1.26 -2.68 120.64 127.77 1m8t n GLU 79 Ca 0.00 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 1m8t n GLU 79 Cb 0.43 -5.76 0.00 0.00 -0.57 0.00 0.00 31.44 25.54 1m8t n GLU 79 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1m8t n GLY 80 N -1.21 2.90 3.75 0.62 0.00 -1.26 -5.00 105.19 105.00 1m8t n GLY 80 Ca -0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1m8t n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1m8t s THR 81 N -1.87 5.31 -0.04 2.61 -1.32 -1.09 -4.67 115.64 114.57 1m8t s THR 81 Ca 0.00 0.52 0.00 0.00 -1.21 0.00 0.00 61.69 61.00 1m8t s THR 81 Cb 0.00 -3.61 -0.03 0.00 -1.51 0.00 0.00 72.50 67.35 1m8t s THR 81 CO 0.00 0.43 -0.01 -0.76 -2.21 0.00 0.00 174.62 172.07 1m8t s LEU 82 N 0.22 3.48 -0.13 9.08 1.43 -1.26 -1.27 118.68 130.23 1m8t s LEU 82 Ca 0.16 0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 1m8t s LEU 82 Cb -0.13 -1.90 0.06 0.00 0.03 0.00 0.00 46.19 44.25 1m8t s LEU 82 CO 0.04 0.32 0.27 -0.89 0.23 0.00 0.00 176.35 176.32 1m8t s THR 83 N -0.98 -0.33 -0.62 5.49 2.01 -0.31 -4.98 115.64 115.91 1m8t s THR 83 Ca 0.16 0.24 -0.26 0.00 0.31 0.00 0.00 61.69 62.15 1m8t s THR 83 Cb -0.11 -0.44 0.04 0.00 0.01 0.00 0.00 72.50 71.99 1m8t s THR 83 CO 0.06 0.10 1.12 0.00 -0.69 0.00 0.00 174.62 175.22 1m8t n LYS 85 N 8.34 -0.40 0.22 0.00 5.02 -0.90 -4.87 118.16 125.58 1m8t n LYS 85 Ca 0.04 -0.06 0.15 0.00 -2.02 0.00 0.00 58.31 56.42 1m8t n LYS 85 Cb 0.48 -2.12 0.72 0.00 -0.02 0.00 0.00 35.03 34.09 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 -1.75 1.00 0.00 7.82 0.00 -1.94 -3.32 119.26 121.08 1m8t h ALA 86 Ca -0.43 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.13 1m8t h ALA 86 Cb 1.28 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1m8t h ALA 86 CO 0.38 0.00 1.78 -0.25 0.00 0.00 0.00 179.25 181.16 1m8t n ASP 87 N -2.64 5.38 -3.81 0.00 8.00 -1.26 -4.84 116.55 117.37 1m8t n ASP 87 Ca -0.00 -2.34 -0.13 0.00 0.71 0.00 0.00 54.79 53.03 1m8t n ASP 87 Cb 0.17 -1.18 -0.14 0.00 -0.02 0.00 0.00 41.12 39.96 1m8t n ASP 87 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1m8t s ASN 88 N 2.66 -0.09 0.72 -2.24 0.02 -1.25 -4.35 114.94 110.42 1m8t s ASN 88 Ca 0.50 0.20 -0.07 0.00 -1.02 0.00 0.00 52.86 52.48 1m8t s ASN 88 Cb 0.17 0.17 0.07 0.00 0.02 0.00 0.00 41.25 41.69 1m8t s ASN 88 CO -0.03 -0.07 1.03 1.51 0.02 0.00 0.00 177.10 179.57 1m8t s ASP 89 N 0.37 4.67 0.26 -1.22 1.47 -1.26 -4.63 116.67 116.33 1m8t s ASP 89 Ca -0.03 0.38 -0.08 0.00 1.18 0.00 0.00 52.55 54.01 1m8t s ASP 89 Cb -0.04 -0.98 0.42 0.00 -0.34 0.00 0.00 42.92 41.98 1m8t s ASP 89 CO -0.01 -1.69 1.47 -1.84 0.68 0.00 0.00 175.17 173.77 1m8t n GLU 90 N -2.97 -0.09 0.09 2.11 0.28 -1.26 -0.81 120.64 117.99 1m8t n GLU 90 Ca 0.09 1.46 -0.12 0.00 -0.16 0.00 0.00 57.16 58.43 1m8t n GLU 90 Cb 0.60 -2.19 -0.08 0.00 1.43 0.00 0.00 31.44 31.21 1m8t n GLU 90 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1m8t h ALA 92 N -0.09 0.91 -0.32 0.00 0.00 -1.73 0.17 119.26 118.20 1m8t h ALA 92 Ca -0.03 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1m8t h ALA 92 Cb 0.50 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1m8t h ALA 92 CO 0.05 0.00 0.12 0.00 0.00 0.00 0.00 179.25 179.42 1m8t h ALA 93 N 1.37 0.41 0.12 0.00 0.00 -1.04 0.25 119.26 120.38 1m8t h ALA 93 Ca 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1m8t h ALA 93 Cb 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1m8t h ALA 93 CO -0.21 0.02 -0.06 0.35 0.00 0.00 0.00 179.25 179.35 1m8t h PHE 94 N 0.36 -0.15 -0.69 0.00 3.57 -0.94 -0.93 116.94 118.16 1m8t h PHE 94 Ca 0.11 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.62 1m8t h PHE 94 Cb 0.20 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 1m8t h PHE 94 CO -0.00 0.10 0.46 0.28 -2.23 0.00 0.00 178.31 176.92 1m8t h VAL 95 N -0.40 1.14 -0.04 1.41 2.07 -0.67 -0.71 116.25 119.03 1m8t h VAL 95 Ca -0.02 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1m8t h VAL 95 Cb 0.33 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1m8t h VAL 95 CO 0.03 0.16 0.01 0.00 0.02 0.00 0.00 177.57 177.79 1m8t h ASP 97 N -0.16 0.94 0.06 0.00 3.32 -0.79 0.68 116.42 120.48 1m8t h ASP 97 Ca 0.01 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.03 1m8t h ASP 97 Cb 0.25 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.51 1m8t h ASP 97 CO 0.00 0.73 -0.47 0.00 -1.72 0.00 0.00 179.24 177.78 1m8t h ASP 99 N -0.66 0.19 -0.47 0.00 3.32 -1.03 -2.44 116.42 115.34 1m8t h ASP 99 Ca 0.02 -0.15 0.08 0.00 0.02 0.00 0.00 57.03 57.00 1m8t h ASP 99 Cb 0.70 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 40.14 1m8t h ASP 99 CO -0.30 0.28 0.08 -0.09 -1.72 0.00 0.00 179.24 177.49 1m8t h ARG 100 N 0.08 0.20 -0.79 3.56 2.43 -0.63 0.27 114.38 119.50 1m8t h ARG 100 Ca 0.05 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1m8t h ARG 100 Cb 0.15 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 1m8t h ARG 100 CO -0.00 0.14 0.41 0.28 -1.51 0.00 0.00 179.97 179.28 1m8t h VAL 101 N 0.21 1.24 -0.43 0.20 2.07 -0.92 -1.95 116.25 116.67 1m8t h VAL 101 Ca 0.23 -0.65 -0.12 0.00 0.82 0.00 0.00 66.70 66.97 1m8t h VAL 101 Cb 0.31 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1m8t h VAL 101 CO -0.31 0.28 -0.22 0.00 0.02 0.00 0.00 177.57 177.33 1m8t h ALA 102 N 1.21 0.79 -0.59 1.67 0.00 -0.80 -1.05 119.26 120.49 1m8t h ALA 102 Ca 0.28 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1m8t h ALA 102 Cb 0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1m8t h ALA 102 CO -0.04 0.65 0.22 0.00 0.00 0.00 0.00 179.25 180.08 1m8t h ALA 103 N 0.98 0.77 -0.38 0.00 0.00 -0.25 0.81 119.26 121.20 1m8t h ALA 103 Ca 0.10 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1m8t h ALA 103 Cb 0.77 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1m8t h ALA 103 CO 0.06 0.41 -0.22 0.82 0.00 0.00 0.00 179.25 180.32 1m8t h ILE 104 N 0.83 1.27 -0.51 0.00 2.04 -1.26 -2.64 117.51 117.24 1m8t h ILE 104 Ca 0.20 -1.33 -0.04 0.00 1.00 0.00 0.00 64.86 64.69 1m8t h ILE 104 Cb 0.24 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1m8t h ILE 104 CO -0.01 0.44 0.15 0.00 0.00 0.00 0.00 178.15 178.73 1m8t h PHE 106 N 0.70 0.62 -0.22 0.00 -1.00 -0.75 -2.70 116.94 113.59 1m8t h PHE 106 Ca 0.16 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.93 1m8t h PHE 106 Cb 0.28 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.63 1m8t h PHE 106 CO 0.02 0.46 0.12 0.00 -1.61 0.00 0.00 178.31 177.29 1m8t h ALA 107 N 1.11 1.79 -0.01 2.45 0.00 -1.37 -2.83 119.26 120.40 1m8t h ALA 107 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1m8t h ALA 107 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1m8t h ALA 107 CO -0.03 0.18 -0.13 0.41 0.00 0.00 0.00 179.25 179.68 1m8t n GLY 108 N -1.43 -0.20 3.80 0.00 0.00 -1.04 -4.92 105.19 101.41 1m8t n GLY 108 Ca 0.00 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.24 3.64 0.38 4.61 0.00 -1.07 -5.08 121.76 122.01 1m8t s ALA 109 Ca 0.31 -0.93 -0.26 0.00 0.00 0.00 0.00 51.96 51.08 1m8t s ALA 109 Cb 0.20 -1.55 -0.09 0.00 0.00 0.00 0.00 23.12 21.68 1m8t s ALA 109 CO 0.42 0.74 1.15 -1.25 0.00 0.00 0.00 175.76 176.82 1m8t s PRO 110 N -2.17 4.16 -0.50 0.00 0.04 -1.26 -4.90 135.00 130.37 1m8t s PRO 110 Ca 0.28 1.81 -0.17 0.00 0.04 0.00 0.00 61.00 62.96 1m8t s PRO 110 Cb -0.12 -2.74 0.08 0.00 0.04 0.00 0.00 34.50 31.76 1m8t s PRO 110 CO 0.20 -0.22 0.48 -0.47 0.04 0.00 0.00 177.00 177.03 1m8t s TYR 111 N -1.40 3.19 -0.58 0.56 6.14 -1.26 -4.51 117.35 119.48 1m8t s TYR 111 Ca 0.55 -0.90 -0.17 0.00 0.64 0.00 0.00 57.07 57.19 1m8t s TYR 111 Cb -0.30 -3.39 0.13 0.00 0.42 0.00 0.00 41.96 38.82 1m8t s TYR 111 CO 0.38 -0.91 0.58 -0.80 0.64 0.00 0.00 175.55 175.44 1m8t s ASN 112 N 2.83 6.23 0.61 4.32 0.02 -1.26 -4.96 114.94 122.73 1m8t s ASN 112 Ca 0.07 -1.75 0.27 0.00 -1.02 0.00 0.00 52.86 50.43 1m8t s ASN 112 Cb -0.24 -2.24 1.34 0.00 0.02 0.00 0.00 41.25 40.13 1m8t s ASN 112 CO 0.07 -0.92 1.76 0.11 0.02 0.00 0.00 177.10 178.14 1m8t h LYS 113 N 8.90 0.00 0.00 -0.60 1.57 -1.99 0.20 116.57 124.65 1m8t h LYS 113 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1m8t h LYS 113 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1m8t h LYS 113 CO 1.04 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 179.07 1m8t n GLU 114 N -3.41 0.12 -0.31 3.15 0.00 -1.26 -2.67 120.64 116.26 1m8t n GLU 114 Ca 0.08 0.29 0.11 0.00 0.00 0.00 0.00 57.16 57.64 1m8t n GLU 114 Cb 0.77 -1.70 0.29 0.00 0.00 0.00 0.00 31.44 30.80 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 -1.92 3.57 -4.78 -1.84 3.02 0.69 -4.86 115.26 109.13 1m8t n ASN 115 Ca 0.04 -1.99 -0.39 0.00 -0.03 0.00 0.00 54.58 52.20 1m8t n ASN 115 Cb 0.26 -0.41 -0.06 0.00 -0.61 0.00 0.00 39.78 38.96 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 -1.17 4.62 -1.31 2.41 1.01 -1.09 0.18 121.20 125.86 1m8t s ILE 116 Ca 0.44 1.47 -0.16 0.00 0.00 0.00 0.00 60.65 62.41 1m8t s ILE 116 Cb 0.23 -4.03 0.01 0.00 0.01 0.00 0.00 42.46 38.69 1m8t s ILE 116 CO 0.31 0.49 0.52 -3.20 0.00 0.00 0.00 174.94 173.06 1m8t n ASN 117 N 2.00 -2.50 -4.86 3.58 4.05 0.11 -4.91 115.26 112.73 1m8t n ASN 117 Ca -0.07 -1.14 -0.31 0.00 0.45 0.00 0.00 54.58 53.51 1m8t n ASN 117 Cb 0.50 -2.49 -0.03 0.00 1.23 0.00 0.00 39.78 38.98 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 -3.78 4.70 -1.05 -1.44 -5.25 -1.26 -4.93 121.20 108.19 1m8t s ILE 118 Ca 0.27 0.82 -0.24 0.00 -0.99 0.00 0.00 60.65 60.51 1m8t s ILE 118 Cb -0.12 -3.72 -0.09 0.00 2.95 0.00 0.00 42.46 41.48 1m8t s ILE 118 CO 0.93 -0.55 1.99 -0.62 -1.79 0.00 0.00 174.94 174.90 1m8t s ASP 119 N -3.07 4.82 0.00 4.36 3.68 -1.26 -4.73 116.67 120.46 1m8t s ASP 119 Ca 0.54 -1.14 0.09 0.00 2.13 0.00 0.00 52.55 54.17 1m8t s ASP 119 Cb -0.10 -2.58 0.39 0.00 -1.45 0.00 0.00 42.92 39.18 1m8t s ASP 119 CO 0.30 -3.20 1.28 0.35 0.13 0.00 0.00 175.17 174.03 1m8t n THR 120 N 8.03 1.35 0.28 1.71 -2.24 -1.26 -2.17 114.28 119.99 1m8t n THR 120 Ca 0.43 0.34 0.15 0.00 -2.27 0.00 0.00 64.05 62.70 1m8t n THR 120 Cb 0.46 -1.18 0.48 0.00 -2.10 0.00 0.00 70.33 67.98 1m8t n THR 120 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1m8t h THR 121 N 0.00 0.00 0.00 4.28 1.35 -1.87 -2.98 112.91 113.69 1m8t h THR 121 Ca 0.00 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1m8t h THR 121 Cb 0.15 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1m8t h THR 121 CO 0.00 0.00 -0.02 0.35 -0.25 0.00 0.00 175.52 175.60 1m8t n THR 122 N -3.01 0.00 1.01 6.82 -2.24 -1.07 -4.74 114.28 111.05 1m8t n THR 122 Ca 0.02 -0.34 0.11 0.00 -2.27 0.00 0.00 64.05 61.56 1m8t n THR 122 Cb 0.39 0.99 -0.03 0.00 -2.10 0.00 0.00 70.33 69.57 1m8t n THR 122 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1m8t n ARG 123 N -0.71 0.29 0.00 -0.78 5.12 -0.92 -5.13 116.66 114.53 1m8t n ARG 123 Ca 0.00 -0.23 0.00 0.00 -1.93 0.00 0.00 57.85 55.69 1m8t n ARG 123 Cb 0.00 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.80 1m8t n ARG 123 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70