#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 0.17 -0.78 0.27 4.07 -1.68 0.40 115.31 117.75 1m8t h LEU 2 Ca 0.00 0.01 -0.10 0.00 0.08 0.00 0.00 57.88 57.86 1m8t h LEU 2 Cb 0.00 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.70 1m8t h LEU 2 CO 0.00 0.10 -0.19 0.58 -1.08 0.00 0.00 178.44 177.85 1m8t h VAL 3 N 0.18 1.26 -0.01 1.22 2.07 -1.98 -2.00 116.25 117.01 1m8t h VAL 3 Ca 0.25 -1.26 -0.17 0.00 0.82 0.00 0.00 66.70 66.34 1m8t h VAL 3 Cb 0.74 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1m8t h VAL 3 CO -0.04 0.42 -0.78 1.56 0.02 0.00 0.00 177.57 178.75 1m8t h GLN 4 N 0.64 0.08 -0.48 1.57 4.20 -1.39 -2.86 115.11 116.86 1m8t h GLN 4 Ca 0.10 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.68 1m8t h GLN 4 Cb 0.67 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.45 1m8t h GLN 4 CO 0.05 0.81 0.09 0.35 -0.67 0.00 0.00 178.83 179.47 1m8t h PHE 5 N 0.05 0.77 -0.03 2.96 -0.00 -0.88 -1.21 116.94 118.59 1m8t h PHE 5 Ca -0.02 -0.07 -0.08 0.00 -0.00 0.00 0.00 57.97 57.80 1m8t h PHE 5 Cb 1.37 -0.22 -0.01 0.00 -0.00 0.00 0.00 35.95 37.08 1m8t h PHE 5 CO 0.01 0.67 -0.37 -0.97 -0.00 0.00 0.00 178.31 177.65 1m8t h ASN 6 N 0.72 0.07 1.09 0.41 -1.24 -1.20 -2.23 115.58 113.20 1m8t h ASN 6 Ca 0.16 -0.02 -0.14 0.00 0.71 0.00 0.00 56.30 57.00 1m8t h ASN 6 Cb 0.30 -0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.31 1m8t h ASN 6 CO 0.00 0.43 -0.67 1.23 -1.29 0.00 0.00 177.43 177.14 1m8t h GLY 7 N 1.13 0.00 0.45 1.57 0.00 -1.04 -2.38 103.07 102.79 1m8t h GLY 7 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1m8t h GLY 7 CO 0.05 0.00 -0.03 -0.33 0.00 0.00 0.00 176.54 176.23 1m8t h MET 8 N 0.00 -0.07 -0.83 4.80 2.86 -0.95 -0.78 114.93 119.95 1m8t h MET 8 Ca -0.01 0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.70 1m8t h MET 8 Cb 1.39 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 33.02 1m8t h MET 8 CO 0.09 0.44 0.54 0.82 1.06 0.00 0.00 176.91 179.85 1m8t h ILE 9 N -0.63 1.07 0.00 -1.22 2.04 -1.49 0.38 117.51 117.65 1m8t h ILE 9 Ca -0.01 -0.32 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 1m8t h ILE 9 Cb 0.54 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1m8t h ILE 9 CO 0.01 0.17 -0.31 0.03 0.00 0.00 0.00 178.15 178.06 1m8t h ARG 10 N 0.93 0.00 0.10 2.37 2.47 -1.33 1.22 114.38 120.14 1m8t h ARG 10 Ca 0.35 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.06 1m8t h ARG 10 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 1m8t h ARG 10 CO -0.12 0.31 -0.05 0.00 0.56 0.00 0.00 179.97 180.67 1m8t h THR 12 N -0.73 0.99 -2.98 0.00 1.35 -0.54 -3.35 112.91 107.65 1m8t h THR 12 Ca -0.01 -1.74 -0.60 0.00 -0.55 0.00 0.00 66.41 63.51 1m8t h THR 12 Cb 0.55 2.04 -0.40 0.00 -1.73 0.00 0.00 68.15 68.61 1m8t h THR 12 CO 0.02 0.44 -0.76 -0.63 -0.25 0.00 0.00 175.52 174.34 1m8t s ILE 13 N -3.51 1.08 0.23 6.82 1.01 0.42 -4.82 121.20 122.43 1m8t s ILE 13 Ca 0.00 -2.12 -0.07 0.00 0.00 0.00 0.00 60.65 58.47 1m8t s ILE 13 Cb 0.11 -1.78 0.19 0.00 0.01 0.00 0.00 42.46 40.99 1m8t s ILE 13 CO 0.71 -0.85 1.84 -0.65 0.00 0.00 0.00 174.94 175.99 1m8t h PRO 14 N 7.14 0.86 0.00 2.79 0.11 -1.78 -2.65 132.00 138.48 1m8t h PRO 14 Ca -0.03 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1m8t h PRO 14 Cb 0.96 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1m8t h PRO 14 CO 0.45 0.57 0.00 0.41 -0.21 0.00 0.00 178.00 179.22 1m8t n GLY 15 N -1.31 -1.01 3.86 -0.55 0.00 -1.26 -4.90 105.19 100.02 1m8t n GLY 15 Ca 0.11 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.83 6.70 -0.69 1.61 1.04 -1.00 -5.03 113.70 113.51 1m8t s SER 16 Ca 0.12 1.11 0.05 0.00 0.48 0.00 0.00 55.95 57.71 1m8t s SER 16 Cb 0.12 -2.30 0.23 0.00 0.10 0.00 0.00 66.02 64.16 1m8t s SER 16 CO 0.30 -0.15 0.70 -0.38 0.98 0.00 0.00 173.24 174.68 1m8t n ILE 17 N -0.29 2.28 -0.30 -1.02 5.41 -1.26 -4.85 119.36 119.34 1m8t n ILE 17 Ca 0.02 -5.14 -0.06 0.00 1.00 0.00 0.00 62.75 58.57 1m8t n ILE 17 Cb 0.53 -2.14 -0.04 0.00 -0.71 0.00 0.00 39.64 37.28 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 1.26 -0.27 0.00 0.38 -0.02 -1.26 -1.02 135.00 134.06 1m8t n PRO 18 Ca 0.26 1.12 0.00 0.00 -2.02 0.00 0.00 63.50 62.86 1m8t n PRO 18 Cb 0.39 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1m8t n PRO 18 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1m8t n TRP 19 N -4.97 0.00 -0.03 6.00 4.27 -1.26 -1.77 117.44 119.68 1m8t n TRP 19 Ca 0.03 0.00 -0.07 0.00 -3.89 0.00 0.00 57.50 53.58 1m8t n TRP 19 Cb 0.23 -0.37 -0.03 0.00 -1.36 0.00 0.00 31.31 29.78 1m8t n TRP 19 CO 0.00 0.00 0.00 1.87 -2.29 0.00 0.00 177.69 177.27 1m8t n TRP 20 N -1.36 0.00 -0.09 -2.67 -0.00 -0.19 -4.44 117.44 108.68 1m8t n TRP 20 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.39 1m8t n TRP 20 Cb 0.02 -0.26 0.02 0.00 -0.00 0.00 0.00 31.31 31.09 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 -0.18 0.89 -0.44 5.87 3.32 -0.73 -3.31 116.42 121.85 1m8t h ASP 21 Ca -0.17 -0.39 -0.15 0.00 0.02 0.00 0.00 57.03 56.33 1m8t h ASP 21 Cb 1.18 -0.25 -0.09 0.00 0.22 0.00 0.00 39.33 40.39 1m8t h ASP 21 CO -0.08 1.16 0.07 -1.22 -1.72 0.00 0.00 179.24 177.44 1m8t n TYR 22 N -4.06 1.42 0.78 4.55 4.01 -0.73 -4.65 117.16 118.49 1m8t n TYR 22 Ca -0.02 -1.32 0.11 0.00 -0.16 0.00 0.00 57.90 56.51 1m8t n TYR 22 Cb 0.52 -0.50 0.11 0.00 -0.31 0.00 0.00 39.34 39.16 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 -0.77 2.87 -2.71 7.72 3.41 -1.25 -4.15 113.62 118.74 1m8t n SER 23 Ca 0.33 -1.90 -0.07 0.00 -0.26 0.00 0.00 58.87 56.97 1m8t n SER 23 Cb 1.10 -0.04 0.07 0.00 -0.26 0.00 0.00 64.21 65.08 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 1.22 -2.20 -4.01 4.04 4.64 -1.14 -4.28 116.55 114.82 1m8t n ASP 24 Ca 0.13 -2.78 -0.27 0.00 -1.38 0.00 0.00 54.79 50.49 1m8t n ASP 24 Cb 0.54 1.46 -0.17 0.00 -1.04 0.00 0.00 41.12 41.91 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 0.41 1.76 0.00 -0.67 6.14 -0.04 0.79 117.35 125.74 1m8t s TYR 25 Ca 0.28 -0.82 0.00 0.00 0.64 0.00 0.00 57.07 57.17 1m8t s TYR 25 Cb 0.24 -1.31 0.00 0.00 0.42 0.00 0.00 41.96 41.30 1m8t s TYR 25 CO -0.17 -0.46 0.00 0.41 0.64 0.00 0.00 175.55 175.97 1m8t n GLY 26 N 4.34 2.23 0.08 8.97 0.00 0.15 -1.82 105.19 119.15 1m8t n GLY 26 Ca -0.18 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.69 0.00 -2.95 0.00 4.01 -1.25 -3.32 117.16 110.96 1m8t n TYR 28 Ca -0.10 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.21 1m8t n TYR 28 Cb 0.77 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.76 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 5.19 2.13 3.65 0.00 0.00 -1.26 -0.86 105.19 114.04 1m8t n GLY 30 Ca -0.03 -2.05 -0.54 0.00 0.00 0.00 0.00 46.02 43.40 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 2.03 0.00 1.61 2.88 -1.26 -4.56 113.62 114.31 1m8t n SER 31 Ca 0.00 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 1m8t n SER 31 Cb 0.00 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.29 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 3.33 -0.89 0.00 0.46 0.00 -1.26 -5.05 105.19 101.78 1m8t n GLY 32 Ca 0.22 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 45.06 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 3.29 0.00 -0.02 0.00 -1.26 -4.73 105.19 102.46 1m8t n GLY 33 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1m8t n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1m8t n SER 34 N 0.00 0.00 0.00 1.61 3.41 -1.21 -5.02 113.62 112.41 1m8t n SER 34 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1m8t n SER 34 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1m8t n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1m8t n GLY 35 N -0.04 0.31 3.09 5.00 0.00 -1.26 -4.70 105.19 107.58 1m8t n GLY 35 Ca 0.00 -0.94 -0.27 0.00 0.00 0.00 0.00 46.02 44.80 1m8t n GLY 35 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1m8t s THR 36 N 0.00 1.48 -0.31 2.61 -1.32 -1.26 -5.07 115.64 111.76 1m8t s THR 36 Ca 0.00 -0.68 -0.38 0.00 -1.21 0.00 0.00 61.69 59.42 1m8t s THR 36 Cb 0.00 -1.32 -0.14 0.00 -1.51 0.00 0.00 72.50 69.53 1m8t s THR 36 CO 0.00 0.43 1.96 -2.65 -2.21 0.00 0.00 174.62 172.16 1m8t n PRO 37 N 3.75 1.10 0.25 7.08 -0.02 -1.26 -4.80 135.00 141.09 1m8t n PRO 37 Ca -0.21 0.36 0.08 0.00 -2.02 0.00 0.00 63.50 61.71 1m8t n PRO 37 Cb 0.52 -2.23 0.63 0.00 -0.02 0.00 0.00 33.50 32.40 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 6.13 0.96 -0.15 -1.45 -1.51 -1.95 -3.46 116.25 114.83 1m8t h VAL 38 Ca -0.36 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 1m8t h VAL 38 Cb 1.32 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 31.64 1m8t h VAL 38 CO 0.99 0.08 0.00 -0.90 -1.23 0.00 0.00 177.57 176.51 1m8t n ASP 39 N -4.30 0.00 0.02 4.19 3.85 -1.26 -5.05 116.55 114.00 1m8t n ASP 39 Ca -0.03 0.00 -0.19 0.00 -0.71 0.00 0.00 54.79 53.86 1m8t n ASP 39 Cb 0.16 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 39.79 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 0.23 -0.40 0.11 4.81 -1.90 -3.19 114.58 114.24 1m8t h GLU 40 Ca 0.00 -0.39 -0.01 0.00 -0.13 0.00 0.00 59.36 58.83 1m8t h GLU 40 Cb 0.00 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1m8t h GLU 40 CO 0.00 1.19 0.22 1.25 -0.73 0.00 0.00 179.01 180.93 1m8t h LEU 41 N -0.50 0.50 -0.64 1.64 5.85 -1.91 -2.44 115.31 117.81 1m8t h LEU 41 Ca -0.15 -0.09 0.13 0.00 0.84 0.00 0.00 57.88 58.60 1m8t h LEU 41 Cb 1.54 -0.13 -0.10 0.00 0.37 0.00 0.00 40.66 42.34 1m8t h LEU 41 CO 0.10 0.45 0.12 -0.78 -0.34 0.00 0.00 178.44 177.98 1m8t h ASP 42 N 0.51 -0.04 -0.57 1.25 1.82 -1.89 0.16 116.42 117.66 1m8t h ASP 42 Ca 0.14 0.13 0.02 0.00 -0.39 0.00 0.00 57.03 56.93 1m8t h ASP 42 Cb 0.06 0.18 -0.03 0.00 0.68 0.00 0.00 39.33 40.23 1m8t h ASP 42 CO -0.02 -0.02 0.38 -0.09 -1.61 0.00 0.00 179.24 177.87 1m8t h ARG 43 N 0.24 0.69 -0.93 0.28 9.65 -1.44 -0.07 114.38 122.80 1m8t h ARG 43 Ca 0.34 -0.04 0.02 0.00 -1.10 0.00 0.00 59.98 59.20 1m8t h ARG 43 Cb 0.54 -0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 28.91 1m8t h ARG 43 CO -0.45 0.45 0.62 0.00 2.80 0.00 0.00 179.97 183.39 1m8t h GLN 46 N 0.00 0.10 -0.54 0.00 4.15 -0.07 -0.40 115.11 118.35 1m8t h GLN 46 Ca -0.00 -0.09 0.03 0.00 0.77 0.00 0.00 58.65 59.36 1m8t h GLN 46 Cb 0.94 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.62 1m8t h GLN 46 CO 0.01 0.76 0.32 0.28 -1.93 0.00 0.00 178.83 178.28 1m8t h VAL 47 N -0.53 1.05 -0.38 2.39 2.07 -1.28 -2.37 116.25 117.21 1m8t h VAL 47 Ca -0.01 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.31 1m8t h VAL 47 Cb 0.78 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1m8t h VAL 47 CO 0.02 0.12 0.20 -0.74 0.02 0.00 0.00 177.57 177.19 1m8t h HIS 48 N 0.64 0.38 -0.31 1.57 -0.00 -1.25 -1.22 115.15 114.96 1m8t h HIS 48 Ca 0.22 0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.65 1m8t h HIS 48 Cb 0.03 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.29 1m8t h HIS 48 CO -0.06 0.21 0.06 -0.44 -0.00 0.00 0.00 177.93 177.70 1m8t h ASP 49 N 0.41 0.02 -0.57 3.26 5.19 -0.59 -1.87 116.42 122.28 1m8t h ASP 49 Ca 0.15 0.05 -0.08 0.00 -0.62 0.00 0.00 57.03 56.53 1m8t h ASP 49 Cb 0.04 0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 1m8t h ASP 49 CO -0.09 0.05 0.04 0.78 -3.12 0.00 0.00 179.24 176.89 1m8t h ASN 50 N 0.18 0.95 -0.86 6.45 2.35 -1.28 0.08 115.58 123.44 1m8t h ASN 50 Ca 0.14 -0.29 0.10 0.00 -0.55 0.00 0.00 56.30 55.70 1m8t h ASN 50 Cb 0.15 -0.25 -0.08 0.00 0.05 0.00 0.00 38.32 38.19 1m8t h ASN 50 CO -0.18 1.00 0.51 0.00 -1.65 0.00 0.00 177.43 177.10 1m8t h TYR 52 N 0.84 0.68 0.00 0.00 -1.99 -0.92 -2.30 116.97 113.28 1m8t h TYR 52 Ca 0.42 -0.15 -0.02 0.00 2.00 0.00 0.00 58.73 60.98 1m8t h TYR 52 Cb 0.39 -0.17 -0.00 0.00 2.00 0.00 0.00 36.73 38.95 1m8t h TYR 52 CO -0.05 0.79 -0.10 1.15 -0.00 0.00 0.00 178.16 179.95 1m8t h THR 53 N 0.53 0.26 0.00 -2.88 2.02 0.15 -2.77 112.91 110.21 1m8t h THR 53 Ca 0.08 -0.80 -0.10 0.00 0.77 0.00 0.00 66.41 66.35 1m8t h THR 53 Cb 0.70 1.64 -0.02 0.00 -1.74 0.00 0.00 68.15 68.73 1m8t h THR 53 CO 0.05 0.10 -0.72 1.56 0.37 0.00 0.00 175.52 176.88 1m8t h GLN 54 N 0.00 0.00 0.00 6.66 4.20 0.41 -3.16 115.11 123.22 1m8t h GLN 54 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1m8t h GLN 54 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 1m8t h GLN 54 CO 0.01 0.37 0.00 0.00 -0.67 0.00 0.00 178.83 178.54 1m8t h ALA 55 N 1.56 1.00 -0.23 3.87 0.00 -1.21 -2.99 119.26 121.26 1m8t h ALA 55 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1m8t h ALA 55 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1m8t h ALA 55 CO 0.05 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.34 1m8t n GLN 56 N -2.94 1.60 0.00 0.00 6.02 -1.07 -2.77 117.38 118.22 1m8t n GLN 56 Ca 0.04 -0.86 0.00 0.00 -0.01 0.00 0.00 57.00 56.17 1m8t n GLN 56 Cb 0.51 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.55 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 0.19 6.37 -2.51 -1.09 6.02 -1.13 -5.02 117.38 120.21 1m8t n GLN 57 Ca 0.08 -0.01 -0.30 0.00 -0.01 0.00 0.00 57.00 56.76 1m8t n GLN 57 Cb 0.23 -0.48 -0.01 0.00 1.02 0.00 0.00 30.24 30.99 1m8t n GLN 57 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1m8t s LEU 58 N -1.83 3.61 0.14 1.08 1.43 -1.11 -5.02 118.68 116.99 1m8t s LEU 58 Ca 0.00 1.20 -0.31 0.00 -1.03 0.00 0.00 54.13 53.99 1m8t s LEU 58 Cb 0.00 -4.15 -0.08 0.00 0.03 0.00 0.00 46.19 41.99 1m8t s LEU 58 CO 0.00 -0.58 1.38 0.42 0.23 0.00 0.00 176.35 177.80 1m8t s THR 59 N -2.69 3.23 -0.09 5.49 -4.23 -1.26 -4.15 115.64 111.93 1m8t s THR 59 Ca 0.52 0.92 -0.08 0.00 -1.18 0.00 0.00 61.69 61.86 1m8t s THR 59 Cb -0.10 -3.59 0.01 0.00 1.34 0.00 0.00 72.50 70.16 1m8t s THR 59 CO 0.40 0.09 0.14 1.21 -0.54 0.00 0.00 174.62 175.92 1m8t n GLU 60 N 3.54 -0.52 -3.67 3.99 4.07 -1.26 -4.94 120.64 121.84 1m8t n GLU 60 Ca 0.10 0.67 -0.13 0.00 -0.06 0.00 0.00 57.16 57.74 1m8t n GLU 60 Cb 0.42 -0.89 -0.08 0.00 -0.06 0.00 0.00 31.44 30.83 1m8t n GLU 60 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1m8t s SER 67 N 0.49 3.03 0.51 0.00 0.15 -1.26 -4.64 113.70 111.99 1m8t s SER 67 Ca -0.01 -0.98 0.28 0.00 0.70 0.00 0.00 55.95 55.94 1m8t s SER 67 Cb -0.04 -0.44 1.40 0.00 -1.71 0.00 0.00 66.02 65.23 1m8t s SER 67 CO -0.02 -0.37 1.90 1.55 1.20 0.00 0.00 173.24 177.50 1m8t h PRO 68 N 8.33 0.07 0.02 5.44 0.13 -1.87 -1.15 132.00 142.98 1m8t h PRO 68 Ca -0.17 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1m8t h PRO 68 Cb 1.09 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1m8t h PRO 68 CO 0.37 0.05 -0.01 1.88 -0.23 0.00 0.00 178.00 180.05 1m8t h TYR 69 N 0.08 -0.03 0.09 1.56 0.05 -1.95 -3.34 116.97 113.43 1m8t h TYR 69 Ca 0.41 -0.00 -0.36 0.00 0.05 0.00 0.00 58.73 58.83 1m8t h TYR 69 Cb 1.53 0.01 -0.03 0.00 1.01 0.00 0.00 36.73 39.25 1m8t h TYR 69 CO -0.00 0.54 -2.04 -1.13 -1.05 0.00 0.00 178.16 174.48 1m8t n SER 70 N -4.83 1.93 -4.43 3.88 3.41 -1.09 -2.32 113.62 110.17 1m8t n SER 70 Ca -0.09 0.18 -0.48 0.00 -0.26 0.00 0.00 58.87 58.23 1m8t n SER 70 Cb 0.29 -0.68 -0.10 0.00 -0.26 0.00 0.00 64.21 63.47 1m8t n SER 70 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1m8t n LYS 71 N -3.39 0.51 -2.65 4.33 3.00 -0.45 -4.39 118.16 115.11 1m8t n LYS 71 Ca -0.32 0.09 -0.41 0.00 -0.00 0.00 0.00 58.31 57.68 1m8t n LYS 71 Cb 1.04 -2.11 -0.05 0.00 0.00 0.00 0.00 35.03 33.92 1m8t n LYS 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1m8t s ARG 72 N 7.33 4.73 0.38 1.64 3.52 -1.26 -0.97 118.95 134.31 1m8t s ARG 72 Ca 1.18 1.58 0.04 0.00 -0.13 0.00 0.00 55.73 58.40 1m8t s ARG 72 Cb -1.02 -3.29 -0.05 0.00 -1.56 0.00 0.00 34.95 29.03 1m8t s ARG 72 CO 0.49 0.31 0.05 1.52 -0.81 0.00 0.00 175.30 176.87 1m8t s TYR 73 N -0.70 2.03 -0.14 5.12 -0.85 -1.26 -4.78 117.35 116.77 1m8t s TYR 73 Ca 0.45 -0.96 -0.04 0.00 -0.52 0.00 0.00 57.07 56.00 1m8t s TYR 73 Cb -0.27 -1.40 -0.03 0.00 0.38 0.00 0.00 41.96 40.64 1m8t s TYR 73 CO 0.33 0.07 -0.02 -1.54 -1.52 0.00 0.00 175.55 172.87 1m8t s SER 74 N -3.59 4.94 0.18 -0.18 1.04 -1.26 -4.99 113.70 109.85 1m8t s SER 74 Ca 0.31 -0.06 -0.18 0.00 0.48 0.00 0.00 55.95 56.50 1m8t s SER 74 Cb 0.07 -1.73 0.03 0.00 0.10 0.00 0.00 66.02 64.49 1m8t s SER 74 CO 0.15 0.21 0.51 -0.72 0.98 0.00 0.00 173.24 174.37 1m8t s TYR 75 N 0.14 -0.17 0.16 5.02 1.13 -1.26 -1.90 117.35 120.47 1m8t s TYR 75 Ca -0.00 -0.16 0.08 0.00 -1.41 0.00 0.00 57.07 55.58 1m8t s TYR 75 Cb -0.13 0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 41.07 1m8t s TYR 75 CO 0.02 -0.88 -0.18 0.34 -2.51 0.00 0.00 175.55 172.34 1m8t s ASP 76 N -2.85 2.60 -0.37 -0.18 -1.08 0.16 -4.87 116.67 110.08 1m8t s ASP 76 Ca 0.08 -0.86 0.01 0.00 -0.52 0.00 0.00 52.55 51.26 1m8t s ASP 76 Cb -0.01 -0.15 0.12 0.00 -1.46 0.00 0.00 42.92 41.42 1m8t s ASP 76 CO -0.05 -0.05 0.16 0.00 0.52 0.00 0.00 175.17 175.75 1m8t s SER 78 N 0.96 5.67 -0.60 0.00 0.01 -0.64 -4.78 113.70 114.32 1m8t s SER 78 Ca 0.14 -2.06 -0.23 0.00 1.31 0.00 0.00 55.95 55.11 1m8t s SER 78 Cb -0.21 -1.99 0.03 0.00 0.21 0.00 0.00 66.02 64.07 1m8t s SER 78 CO -0.12 -0.64 0.64 -1.84 0.41 0.00 0.00 173.24 171.69 1m8t n GLU 79 N 4.70 -1.78 -0.59 12.44 0.28 -1.26 -2.08 120.64 132.35 1m8t n GLU 79 Ca -0.05 1.17 0.00 0.00 -0.16 0.00 0.00 57.16 58.12 1m8t n GLU 79 Cb 0.41 -2.19 0.00 0.00 1.43 0.00 0.00 31.44 31.09 1m8t n GLU 79 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1m8t n GLY 80 N -0.78 1.35 3.44 -1.84 0.00 -1.26 -5.01 105.19 101.10 1m8t n GLY 80 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 1m8t n GLY 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m8t s THR 81 N -3.11 3.40 -0.14 2.61 -4.23 -0.88 -4.59 115.64 108.70 1m8t s THR 81 Ca 0.00 -0.55 -0.10 0.00 -1.18 0.00 0.00 61.69 59.86 1m8t s THR 81 Cb 0.00 -2.44 -0.05 0.00 1.34 0.00 0.00 72.50 71.35 1m8t s THR 81 CO 0.00 0.53 0.21 -0.76 -0.54 0.00 0.00 174.62 174.05 1m8t s LEU 82 N 0.16 4.32 -0.09 4.79 1.02 -1.26 -1.62 118.68 125.99 1m8t s LEU 82 Ca -0.05 0.48 -0.01 0.00 0.02 0.00 0.00 54.13 54.57 1m8t s LEU 82 Cb -0.14 -2.21 0.03 0.00 0.02 0.00 0.00 46.19 43.88 1m8t s LEU 82 CO 0.04 0.27 -0.00 -0.89 0.02 0.00 0.00 176.35 175.78 1m8t s THR 83 N -0.32 0.48 -0.69 5.49 2.01 -0.84 -4.95 115.64 116.82 1m8t s THR 83 Ca 0.15 -0.00 -0.23 0.00 0.31 0.00 0.00 61.69 61.92 1m8t s THR 83 Cb -0.13 -0.65 0.07 0.00 0.01 0.00 0.00 72.50 71.80 1m8t s THR 83 CO 0.04 0.22 1.01 0.00 -0.69 0.00 0.00 174.62 175.19 1m8t n LYS 85 N 7.80 -2.38 -2.31 0.00 5.02 -0.80 -4.92 118.16 120.58 1m8t n LYS 85 Ca -0.01 -0.70 -0.41 0.00 -2.02 0.00 0.00 58.31 55.17 1m8t n LYS 85 Cb 0.46 -1.59 0.01 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 n ALA 86 N -4.58 6.41 0.00 7.82 0.00 -1.26 -3.91 120.51 124.99 1m8t n ALA 86 Ca 0.05 -4.34 0.00 0.00 0.00 0.00 0.00 53.44 49.16 1m8t n ALA 86 Cb 0.46 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.39 1m8t n ALA 86 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1m8t n ASP 87 N 1.02 0.00 -4.67 0.00 10.43 -1.26 -5.12 116.55 116.95 1m8t n ASP 87 Ca 0.54 0.00 -0.46 0.00 2.57 0.00 0.00 54.79 57.45 1m8t n ASP 87 Cb 0.26 0.00 -0.04 0.00 1.84 0.00 0.00 41.12 43.18 1m8t n ASP 87 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1m8t n ASN 88 N -0.47 2.97 -2.10 -2.24 3.02 -1.25 -5.00 115.26 110.18 1m8t n ASN 88 Ca 0.00 1.10 0.00 0.00 -0.03 0.00 0.00 54.58 55.65 1m8t n ASN 88 Cb 0.00 -1.43 0.00 0.00 -0.61 0.00 0.00 39.78 37.74 1m8t n ASN 88 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1m8t n ASP 89 N 2.95 0.00 -0.03 6.41 5.75 -1.26 -4.55 116.55 125.81 1m8t n ASP 89 Ca 0.15 -0.90 -0.08 0.00 -0.01 0.00 0.00 54.79 53.95 1m8t n ASP 89 Cb 0.30 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.36 1m8t n ASP 89 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1m8t h GLU 90 N 0.00 -0.06 0.36 0.11 4.81 -2.00 -2.02 114.58 115.77 1m8t h GLU 90 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1m8t h GLU 90 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1m8t h GLU 90 CO 0.00 -0.04 -0.17 0.00 -0.73 0.00 0.00 179.01 178.06 1m8t h ALA 92 N -0.70 0.99 0.09 0.00 0.00 -1.86 0.18 119.26 117.95 1m8t h ALA 92 Ca -0.05 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1m8t h ALA 92 Cb 0.52 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1m8t h ALA 92 CO 0.08 -0.25 -0.04 0.00 0.00 0.00 0.00 179.25 179.04 1m8t h ALA 93 N 1.55 -0.12 0.36 0.00 0.00 -1.47 0.30 119.26 119.88 1m8t h ALA 93 Ca 0.40 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1m8t h ALA 93 Cb 0.62 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1m8t h ALA 93 CO -0.42 -0.55 -0.19 0.35 0.00 0.00 0.00 179.25 178.44 1m8t h PHE 94 N -0.16 -0.48 -0.47 0.00 3.57 -1.21 -0.32 116.94 117.88 1m8t h PHE 94 Ca -0.01 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.51 1m8t h PHE 94 Cb 0.12 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 1m8t h PHE 94 CO -0.06 -0.30 0.31 0.28 -2.23 0.00 0.00 178.31 176.31 1m8t h VAL 95 N -0.50 1.05 -0.45 1.41 2.07 -0.61 -0.18 116.25 119.04 1m8t h VAL 95 Ca -0.05 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.18 1m8t h VAL 95 Cb 0.39 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1m8t h VAL 95 CO 0.07 0.10 -0.17 0.00 0.02 0.00 0.00 177.57 177.59 1m8t h ASP 97 N 0.74 0.65 -0.44 0.00 3.58 0.36 0.34 116.42 121.66 1m8t h ASP 97 Ca 0.11 -0.09 0.08 0.00 0.42 0.00 0.00 57.03 57.54 1m8t h ASP 97 Cb 0.73 -0.17 -0.07 0.00 1.72 0.00 0.00 39.33 41.55 1m8t h ASP 97 CO 0.06 0.56 0.05 0.00 -2.88 0.00 0.00 179.24 177.02 1m8t h ASP 99 N 0.17 0.48 -0.10 0.00 3.32 -1.24 -2.39 116.42 116.67 1m8t h ASP 99 Ca 0.22 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 1m8t h ASP 99 Cb 0.30 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 1m8t h ASP 99 CO -0.32 1.02 0.04 -0.09 -1.72 0.00 0.00 179.24 178.17 1m8t h ARG 100 N 0.30 0.14 -0.73 3.56 2.43 -0.32 0.13 114.38 119.89 1m8t h ARG 100 Ca -0.02 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 1m8t h ARG 100 Cb 1.22 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.72 1m8t h ARG 100 CO 0.12 0.23 0.35 0.28 -1.51 0.00 0.00 179.97 179.44 1m8t h VAL 101 N 0.02 1.24 0.16 0.20 2.07 -1.11 -1.75 116.25 117.08 1m8t h VAL 101 Ca 0.03 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1m8t h VAL 101 Cb 0.14 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1m8t h VAL 101 CO -0.00 0.28 -0.08 0.00 0.02 0.00 0.00 177.57 177.79 1m8t h ALA 102 N 1.17 -0.22 -0.94 1.67 0.00 -1.25 -0.75 119.26 118.94 1m8t h ALA 102 Ca 0.25 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.13 1m8t h ALA 102 Cb 0.12 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 1m8t h ALA 102 CO -0.03 -0.47 0.56 0.00 0.00 0.00 0.00 179.25 179.31 1m8t h ALA 103 N 0.25 1.44 0.00 0.00 0.00 -0.66 0.79 119.26 121.09 1m8t h ALA 103 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1m8t h ALA 103 Cb 0.40 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1m8t h ALA 103 CO 0.04 0.09 -0.05 -0.84 0.00 0.00 0.00 179.25 178.49 1m8t h ILE 104 N 0.84 0.00 0.02 0.00 3.07 -1.28 -2.99 117.51 117.18 1m8t h ILE 104 Ca 0.49 -0.91 -0.19 0.00 1.55 0.00 0.00 64.86 65.81 1m8t h ILE 104 Cb 0.57 1.88 0.02 0.00 -0.27 0.00 0.00 36.82 39.02 1m8t h ILE 104 CO -0.30 0.00 -0.74 0.00 -1.05 0.00 0.00 178.15 176.06 1m8t h PHE 106 N -0.02 0.24 -0.04 0.00 -1.00 -0.90 -1.68 116.94 113.54 1m8t h PHE 106 Ca -0.10 0.01 0.01 0.00 2.81 0.00 0.00 57.97 60.71 1m8t h PHE 106 Cb 1.45 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 40.94 1m8t h PHE 106 CO 0.14 0.13 0.15 0.00 -1.61 0.00 0.00 178.31 177.13 1m8t h ALA 107 N 1.14 1.32 0.00 2.45 0.00 -1.56 -2.07 119.26 120.54 1m8t h ALA 107 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1m8t h ALA 107 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1m8t h ALA 107 CO -0.08 -0.18 -1.79 0.41 0.00 0.00 0.00 179.25 177.61 1m8t n GLY 108 N -1.21 -1.06 3.85 0.00 0.00 -0.70 -4.96 105.19 101.11 1m8t n GLY 108 Ca -0.02 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.18 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 -3.45 3.46 0.27 4.61 0.00 -0.78 -5.06 121.76 120.81 1m8t s ALA 109 Ca -0.06 -0.08 -0.29 0.00 0.00 0.00 0.00 51.96 51.54 1m8t s ALA 109 Cb 0.14 -2.62 -0.09 0.00 0.00 0.00 0.00 23.12 20.55 1m8t s ALA 109 CO 0.89 0.41 0.96 -1.25 0.00 0.00 0.00 175.76 176.78 1m8t s PRO 110 N -2.59 4.76 -0.46 0.00 0.04 -1.26 -4.90 135.00 130.59 1m8t s PRO 110 Ca 0.47 1.50 -0.21 0.00 0.04 0.00 0.00 61.00 62.80 1m8t s PRO 110 Cb -0.12 -3.15 0.03 0.00 0.04 0.00 0.00 34.50 31.30 1m8t s PRO 110 CO 0.19 0.41 0.69 -0.47 0.04 0.00 0.00 177.00 177.87 1m8t s TYR 111 N -1.28 3.03 -0.52 0.56 6.14 -1.26 -4.45 117.35 119.57 1m8t s TYR 111 Ca 0.44 -0.07 -0.15 0.00 0.64 0.00 0.00 57.07 57.93 1m8t s TYR 111 Cb -0.25 -3.49 0.12 0.00 0.42 0.00 0.00 41.96 38.76 1m8t s TYR 111 CO 0.31 -0.95 0.46 -0.80 0.64 0.00 0.00 175.55 175.21 1m8t s ASN 112 N 2.18 6.09 0.55 4.32 0.01 -1.26 -4.94 114.94 121.89 1m8t s ASN 112 Ca 0.24 -1.77 0.36 0.00 -0.71 0.00 0.00 52.86 50.97 1m8t s ASN 112 Cb -0.14 -2.17 1.51 0.00 0.41 0.00 0.00 41.25 40.86 1m8t s ASN 112 CO 0.19 -0.81 1.78 0.11 -1.51 0.00 0.00 177.10 176.86 1m8t h LYS 113 N 8.79 0.00 0.00 -0.60 6.56 -1.99 0.27 116.57 129.61 1m8t h LYS 113 Ca -0.28 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.31 1m8t h LYS 113 Cb 1.10 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1m8t h LYS 113 CO 0.99 0.00 0.00 0.93 -2.06 0.00 0.00 179.45 179.31 1m8t h GLU 114 N 0.00 0.00 -0.64 3.15 3.07 -2.04 -2.86 114.58 115.26 1m8t h GLU 114 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1m8t h GLU 114 Cb 2.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.12 1m8t h GLU 114 CO -0.01 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.69 1m8t n ASN 115 N -2.45 3.96 -4.80 1.42 3.02 0.95 -4.86 115.26 112.50 1m8t n ASN 115 Ca 0.02 -2.26 -0.37 0.00 -0.03 0.00 0.00 54.58 51.93 1m8t n ASN 115 Cb 0.24 -0.50 -0.06 0.00 -0.61 0.00 0.00 39.78 38.85 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 -1.59 5.21 -1.36 2.41 1.01 -1.08 0.29 121.20 126.09 1m8t s ILE 116 Ca 0.44 0.66 -0.02 0.00 0.00 0.00 0.00 60.65 61.73 1m8t s ILE 116 Cb 0.27 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 39.10 1m8t s ILE 116 CO 0.24 0.50 0.71 -3.20 0.00 0.00 0.00 174.94 173.19 1m8t n ASN 117 N 2.55 -1.62 -4.83 3.58 4.05 0.24 -4.94 115.26 114.29 1m8t n ASN 117 Ca -0.14 -0.84 -0.34 0.00 0.45 0.00 0.00 54.58 53.72 1m8t n ASN 117 Cb 0.53 -3.91 -0.06 0.00 1.23 0.00 0.00 39.78 37.57 1m8t n ASN 117 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 1m8t s ILE 118 N -3.65 4.57 -1.12 -1.44 -1.16 -1.26 -4.97 121.20 112.18 1m8t s ILE 118 Ca 0.11 1.17 -0.22 0.00 -0.51 0.00 0.00 60.65 61.20 1m8t s ILE 118 Cb -0.05 -3.69 -0.01 0.00 0.61 0.00 0.00 42.46 39.32 1m8t s ILE 118 CO 0.82 -0.11 1.79 -0.62 -2.81 0.00 0.00 174.94 174.02 1m8t s ASP 119 N -2.08 5.84 0.13 4.50 2.15 -1.26 -4.82 116.67 121.12 1m8t s ASP 119 Ca 0.53 -1.63 -0.25 0.00 0.43 0.00 0.00 52.55 51.63 1m8t s ASP 119 Cb -0.12 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 39.89 1m8t s ASP 119 CO 0.18 -2.18 1.64 0.71 -0.17 0.00 0.00 175.17 175.35 1m8t h THR 120 N 6.37 0.43 -0.93 1.71 1.35 -1.93 -2.50 112.91 117.41 1m8t h THR 120 Ca 0.25 0.00 0.27 0.00 -0.55 0.00 0.00 66.41 66.38 1m8t h THR 120 Cb 0.95 0.43 -0.04 0.00 -1.73 0.00 0.00 68.15 67.76 1m8t h THR 120 CO 1.33 0.00 0.94 0.35 -0.25 0.00 0.00 175.52 177.88 1m8t n THR 121 N -5.37 0.00 -0.04 6.82 -2.24 -1.26 -0.03 114.28 112.16 1m8t n THR 121 Ca -0.04 0.97 -0.05 0.00 -2.27 0.00 0.00 64.05 62.65 1m8t n THR 121 Cb 0.28 -1.70 -0.04 0.00 -2.10 0.00 0.00 70.33 66.77 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 -2.88 0.49 1.15 4.28 -2.24 -1.16 -4.72 114.28 109.19 1m8t n THR 122 Ca 0.21 -0.21 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 1m8t n THR 122 Cb 1.22 -0.81 0.62 0.00 -2.10 0.00 0.00 70.33 69.26 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 -2.64 0.17 0.00 -0.78 1.74 0.96 -5.16 116.66 110.94 1m8t n ARG 123 Ca -0.14 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 1m8t n ARG 123 Cb 0.67 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1m8t n ARG 123 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11