#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1d s VAL 19 N 0.00 -0.08 0.22 1.69 0.11 -1.26 -5.15 120.40 115.92 1p1d s VAL 19 Ca 0.00 0.25 -0.21 0.00 -2.93 0.00 0.00 61.98 59.09 1p1d s VAL 19 Cb 0.00 -0.16 0.04 0.00 -1.53 0.00 0.00 36.38 34.73 1p1d s VAL 19 CO 0.00 0.10 0.63 0.54 -3.33 0.00 0.00 175.10 173.04 1p1d s VAL 20 N 1.37 0.01 -0.07 2.04 0.11 -1.26 -5.15 120.40 117.44 1p1d s VAL 20 Ca -0.06 -0.59 -0.16 0.00 -2.93 0.00 0.00 61.98 58.24 1p1d s VAL 20 Cb -0.12 -1.54 -0.05 0.00 -1.53 0.00 0.00 36.38 33.14 1p1d s VAL 20 CO -0.04 -0.03 0.43 -2.28 -3.33 0.00 0.00 175.10 169.85 1p1d s HIS 21 N -3.85 3.60 1.17 1.54 2.46 -1.26 -4.97 115.29 113.97 1p1d s HIS 21 Ca 0.07 0.90 -0.17 0.00 0.47 0.00 0.00 55.06 56.34 1p1d s HIS 21 Cb -0.03 -2.42 0.27 0.00 -0.13 0.00 0.00 32.58 30.27 1p1d s HIS 21 CO -0.03 0.37 1.07 0.95 -2.47 0.00 0.00 174.74 174.64 1p1d s THR 22 N -0.11 1.73 -0.00 0.89 -4.23 -1.26 -3.32 115.64 109.34 1p1d s THR 22 Ca 0.24 0.00 -0.29 0.00 -1.18 0.00 0.00 61.69 60.46 1p1d s THR 22 Cb -0.16 -2.37 0.10 0.00 1.34 0.00 0.00 72.50 71.42 1p1d s THR 22 CO 0.11 0.00 0.96 -1.61 -0.54 0.00 0.00 174.62 173.54 1p1d s GLU 23 N -5.08 0.80 0.03 3.99 2.02 0.15 -4.81 118.70 115.80 1p1d s GLU 23 Ca 0.68 -0.33 0.04 0.00 0.02 0.00 0.00 54.97 55.38 1p1d s GLU 23 Cb -0.15 0.34 -0.02 0.00 0.10 0.00 0.00 34.13 34.40 1p1d s GLU 23 CO 0.58 -0.35 -0.12 0.95 0.02 0.00 0.00 175.26 176.33 1p1d s THR 24 N -3.03 0.98 0.12 3.63 -4.23 -1.26 -0.00 115.64 111.85 1p1d s THR 24 Ca 0.07 -0.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.73 1p1d s THR 24 Cb -0.01 -0.89 -0.01 0.00 1.34 0.00 0.00 72.50 72.93 1p1d s THR 24 CO -0.06 0.01 0.10 1.07 -0.54 0.00 0.00 174.62 175.19 1p1d n THR 25 N 2.05 0.00 -3.96 3.99 5.66 -0.32 -4.96 114.28 116.74 1p1d n THR 25 Ca -0.18 -0.88 -0.21 0.00 -3.05 0.00 0.00 64.05 59.74 1p1d n THR 25 Cb 0.55 0.43 -0.03 0.00 -1.55 0.00 0.00 70.33 69.73 1p1d n THR 25 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1p1d s GLU 26 N -2.49 3.11 -0.01 1.09 1.03 -1.26 -1.69 118.70 118.47 1p1d s GLU 26 Ca 0.14 -0.97 -0.11 0.00 0.03 0.00 0.00 54.97 54.06 1p1d s GLU 26 Cb 0.01 -2.70 0.01 0.00 -0.80 0.00 0.00 34.13 30.65 1p1d s GLU 26 CO 0.10 0.34 0.22 0.08 -1.33 0.00 0.00 175.26 174.67 1p1d s VAL 27 N -2.10 0.06 -0.18 1.83 1.01 0.29 -4.79 120.40 116.53 1p1d s VAL 27 Ca 0.35 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 1p1d s VAL 27 Cb -0.08 -0.50 0.05 0.00 0.00 0.00 0.00 36.38 35.84 1p1d s VAL 27 CO 0.27 -0.29 -0.04 -0.69 0.00 0.00 0.00 175.10 174.35 1p1d s VAL 28 N -1.23 1.06 -0.24 2.92 1.01 -1.26 -1.61 120.40 121.05 1p1d s VAL 28 Ca -0.13 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 1p1d s VAL 28 Cb -0.06 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 1p1d s VAL 28 CO 0.03 0.05 0.00 -0.76 0.00 0.00 0.00 175.10 174.42 1p1d s LEU 29 N 1.64 3.20 0.29 3.92 1.43 0.75 -4.93 118.68 124.97 1p1d s LEU 29 Ca -0.00 -0.42 0.09 0.00 -1.03 0.00 0.00 54.13 52.76 1p1d s LEU 29 Cb -0.16 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 1p1d s LEU 29 CO -0.07 -0.06 0.10 0.42 0.23 0.00 0.00 176.35 176.97 1p1d s THR 30 N 1.51 3.54 -0.26 5.49 -4.23 -1.26 0.10 115.64 120.53 1p1d s THR 30 Ca 0.05 -1.71 -0.09 0.00 -1.18 0.00 0.00 61.69 58.77 1p1d s THR 30 Cb -0.15 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.63 1p1d s THR 30 CO -0.01 -0.30 0.12 0.00 -0.54 0.00 0.00 174.62 173.89 1p1d s ALA 31 N -2.31 3.30 0.12 3.99 0.00 -0.93 -4.38 121.76 121.56 1p1d s ALA 31 Ca 0.34 -1.12 -0.19 0.00 0.00 0.00 0.00 51.96 51.00 1p1d s ALA 31 Cb -0.06 -2.24 -0.07 0.00 0.00 0.00 0.00 23.12 20.76 1p1d s ALA 31 CO 0.22 -0.52 0.61 0.34 0.00 0.00 0.00 175.76 176.41 1p1d s ASP 32 N 1.67 7.03 0.00 0.00 -1.08 -0.66 -4.79 116.67 118.84 1p1d s ASP 32 Ca 0.07 1.27 0.04 0.00 -0.52 0.00 0.00 52.55 53.41 1p1d s ASP 32 Cb -0.15 -2.36 0.24 0.00 -1.46 0.00 0.00 42.92 39.18 1p1d s ASP 32 CO 0.06 0.19 0.60 -0.81 0.52 0.00 0.00 175.17 175.74 1p1d n PRO 33 N 1.32 0.21 -0.11 4.34 -0.04 -1.26 0.93 135.00 140.38 1p1d n PRO 33 Ca -0.07 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.18 1p1d n PRO 33 Cb 0.51 -1.30 -0.07 0.00 -0.04 0.00 0.00 33.50 32.60 1p1d n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1p1d n VAL 34 N -0.80 1.45 -1.06 0.52 0.31 -1.26 -4.86 118.33 112.62 1p1d n VAL 34 Ca 0.03 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1p1d n VAL 34 Cb 0.01 -2.02 0.00 0.00 -0.91 0.00 0.00 33.84 30.92 1p1d n VAL 34 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1p1d n THR 35 N -4.26 0.00 0.00 2.52 5.66 -1.12 -5.10 114.28 111.98 1p1d n THR 35 Ca -0.37 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.63 1p1d n THR 35 Cb 0.72 1.27 0.00 0.00 -1.55 0.00 0.00 70.33 70.78 1p1d n THR 35 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1p1d n GLY 36 N 0.00 1.36 3.53 1.09 0.00 0.26 -4.55 105.19 106.89 1p1d n GLY 36 Ca 0.00 0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1p1d n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p1d s PHE 37 N 0.00 3.11 -0.40 1.61 0.40 -1.26 -1.66 117.98 119.78 1p1d s PHE 37 Ca 0.00 -0.20 0.05 0.00 -0.60 0.00 0.00 56.93 56.18 1p1d s PHE 37 Cb 0.00 -2.04 0.44 0.00 0.51 0.00 0.00 43.02 41.93 1p1d s PHE 37 CO 0.00 -0.03 1.40 0.41 0.70 0.00 0.00 175.22 177.70 1p1d n GLY 38 N 3.76 2.95 3.08 4.36 0.00 -1.26 -4.87 105.19 113.22 1p1d n GLY 38 Ca -0.17 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 44.99 1p1d n GLY 38 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 39 N -2.01 1.38 -0.33 -0.61 -5.25 -1.26 0.18 121.20 113.31 1p1d s ILE 39 Ca 0.33 -0.64 -0.14 0.00 -0.99 0.00 0.00 60.65 59.21 1p1d s ILE 39 Cb 0.27 -1.23 -0.02 0.00 2.95 0.00 0.00 42.46 44.43 1p1d s ILE 39 CO 0.08 0.41 0.32 0.00 -1.79 0.00 0.00 174.94 173.96 1p1d s GLN 40 N 0.48 3.63 0.04 0.37 -2.07 -0.34 -5.01 119.66 116.76 1p1d s GLN 40 Ca -0.14 -0.41 -0.06 0.00 -1.82 0.00 0.00 55.36 52.93 1p1d s GLN 40 Cb -0.16 -3.78 -0.05 0.00 -1.09 0.00 0.00 33.01 27.94 1p1d s GLN 40 CO 0.05 -0.45 0.30 -1.17 -1.32 0.00 0.00 175.29 172.69 1p1d s LEU 41 N 1.94 4.35 0.38 2.60 0.20 -1.26 -2.17 118.68 124.72 1p1d s LEU 41 Ca 0.10 0.58 0.06 0.00 0.69 0.00 0.00 54.13 55.57 1p1d s LEU 41 Cb -0.17 -2.81 -0.07 0.00 -0.43 0.00 0.00 46.19 42.71 1p1d s LEU 41 CO 0.11 0.21 0.02 -1.58 -0.29 0.00 0.00 176.35 174.82 1p1d s GLN 42 N -1.93 1.86 -0.05 1.98 0.74 -0.87 -4.94 119.66 116.45 1p1d s GLN 42 Ca 0.30 -2.04 -0.02 0.00 0.05 0.00 0.00 55.36 53.65 1p1d s GLN 42 Cb -0.13 -1.43 -0.02 0.00 1.10 0.00 0.00 33.01 32.52 1p1d s GLN 42 CO 0.18 -0.07 -0.06 0.41 -0.55 0.00 0.00 175.29 175.20 1p1d n GLY 43 N -0.88 -0.08 3.66 2.59 0.00 -1.26 -2.12 105.19 107.11 1p1d n GLY 43 Ca -0.04 -0.03 -0.57 0.00 0.00 0.00 0.00 46.02 45.39 1p1d n GLY 43 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p1d n SER 44 N -3.08 1.93 0.00 1.61 7.64 -1.26 -4.45 113.62 116.01 1p1d n SER 44 Ca -0.09 1.10 0.00 0.00 1.01 0.00 0.00 58.87 60.89 1p1d n SER 44 Cb 0.57 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1p1d n VAL 45 N 3.70 0.00 -0.34 0.44 0.31 -1.26 -4.92 118.33 116.26 1p1d n VAL 45 Ca 0.24 0.00 0.17 0.00 -0.01 0.00 0.00 64.34 64.74 1p1d n VAL 45 Cb 0.13 0.00 0.33 0.00 -0.91 0.00 0.00 33.84 33.40 1p1d n VAL 45 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 1p1d h PHE 46 N 0.00 0.09 -5.89 3.52 -0.00 -1.89 -3.46 116.94 109.31 1p1d h PHE 46 Ca 0.00 0.07 -0.19 0.00 -0.00 0.00 0.00 57.97 57.85 1p1d h PHE 46 Cb 0.00 0.12 0.00 0.00 -0.00 0.00 0.00 35.95 36.08 1p1d h PHE 46 CO 0.00 -0.43 -0.58 0.00 -0.00 0.00 0.00 178.31 177.30 1p1d n ALA 47 N -3.00 -2.66 0.00 12.09 0.00 -1.26 -4.99 120.51 120.69 1p1d n ALA 47 Ca 0.25 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1p1d n ALA 47 Cb 0.83 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1p1d n ALA 47 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1p1d n THR 48 N -1.44 0.00 -1.17 0.00 5.66 -1.26 -5.16 114.28 110.91 1p1d n THR 48 Ca -0.07 0.00 0.15 0.00 -3.05 0.00 0.00 64.05 61.08 1p1d n THR 48 Cb 0.57 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.31 1p1d n THR 48 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1p1d n GLU 49 N 0.00 -2.32 0.00 1.09 0.28 -1.26 -4.90 120.64 113.53 1p1d n GLU 49 Ca 0.00 1.61 0.00 0.00 -0.16 0.00 0.00 57.16 58.61 1p1d n GLU 49 Cb 0.00 -2.85 0.00 0.00 1.43 0.00 0.00 31.44 30.02 1p1d n GLU 49 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1p1d n THR 50 N -3.54 0.00 0.00 3.84 5.66 -1.26 -4.99 114.28 113.99 1p1d n THR 50 Ca -0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 1p1d n THR 50 Cb 0.63 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 1p1d n THR 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1p1d n LEU 51 N 0.00 0.00 -1.19 1.09 -0.00 -1.26 -4.98 117.00 110.66 1p1d n LEU 51 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 1p1d n LEU 51 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.37 1p1d n LEU 51 CO 0.00 0.00 -0.12 -0.24 -0.00 0.00 0.00 177.39 177.03 1p1d n SER 52 N 0.00 -3.91 -4.59 1.45 2.88 -1.26 -4.85 113.62 103.34 1p1d n SER 52 Ca 0.00 0.30 -0.42 0.00 -1.33 0.00 0.00 58.87 57.43 1p1d n SER 52 Cb 0.00 -3.39 -0.03 0.00 -0.75 0.00 0.00 64.21 60.04 1p1d n SER 52 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1p1d s SER 53 N -2.10 5.57 0.89 -3.46 0.01 -1.26 -4.92 113.70 108.43 1p1d s SER 53 Ca 0.00 1.32 -0.12 0.00 1.31 0.00 0.00 55.95 58.46 1p1d s SER 53 Cb 0.00 -2.52 0.13 0.00 0.21 0.00 0.00 66.02 63.84 1p1d s SER 53 CO 0.00 -1.96 1.11 -2.84 0.41 0.00 0.00 173.24 169.96 1p1d s PRO 54 N 6.24 1.29 0.14 12.44 0.02 -1.26 -4.45 135.00 149.42 1p1d s PRO 54 Ca 0.85 0.54 -0.31 0.00 0.02 0.00 0.00 61.00 62.10 1p1d s PRO 54 Cb -0.23 -1.84 -0.10 0.00 0.02 0.00 0.00 34.50 32.35 1p1d s PRO 54 CO 0.32 -2.15 1.62 -2.14 -0.33 0.00 0.00 177.00 174.31 1p1d s PRO 55 N -5.11 4.20 -0.28 5.54 0.02 -1.26 -4.67 135.00 133.43 1p1d s PRO 55 Ca 0.63 2.39 -0.01 0.00 0.02 0.00 0.00 61.00 64.03 1p1d s PRO 55 Cb -0.16 -3.27 0.13 0.00 0.02 0.00 0.00 34.50 31.22 1p1d s PRO 55 CO 0.55 -0.66 0.26 -0.48 -0.33 0.00 0.00 177.00 176.34 1p1d s LEU 56 N 1.57 -0.10 0.77 -5.54 2.34 -0.90 -3.06 118.68 113.76 1p1d s LEU 56 Ca 0.72 -0.81 -0.13 0.00 0.06 0.00 0.00 54.13 53.97 1p1d s LEU 56 Cb -0.44 0.35 0.06 0.00 -0.56 0.00 0.00 46.19 45.61 1p1d s LEU 56 CO 0.32 -0.39 1.15 -0.63 -1.06 0.00 0.00 176.35 175.74 1p1d s ILE 57 N 2.32 2.60 0.00 1.48 1.01 -1.26 -2.05 121.20 125.30 1p1d s ILE 57 Ca 0.09 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.99 1p1d s ILE 57 Cb -0.14 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.68 1p1d s ILE 57 CO -0.32 -0.21 0.43 -1.20 0.00 0.00 0.00 174.94 173.64 1p1d n SER 58 N -3.22 0.08 -3.65 3.58 7.64 -0.92 -2.71 113.62 114.42 1p1d n SER 58 Ca 0.12 -1.03 -0.00 0.00 1.01 0.00 0.00 58.87 58.96 1p1d n SER 58 Cb 0.52 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.65 1p1d n SER 58 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1p1d s TYR 59 N -0.03 -0.09 0.19 1.43 5.04 -1.25 -4.90 117.35 117.74 1p1d s TYR 59 Ca 0.00 0.19 0.03 0.00 -2.44 0.00 0.00 57.07 54.85 1p1d s TYR 59 Cb 0.00 0.23 0.03 0.00 0.35 0.00 0.00 41.96 42.57 1p1d s TYR 59 CO 0.00 -0.04 0.25 1.51 -1.34 0.00 0.00 175.55 175.93 1p1d n ILE 60 N 2.50 0.00 -4.47 3.14 3.06 -1.25 -1.20 119.36 121.14 1p1d n ILE 60 Ca -0.14 -0.65 -0.28 0.00 -2.50 0.00 0.00 62.75 59.17 1p1d n ILE 60 Cb 0.56 -0.80 -0.17 0.00 0.54 0.00 0.00 39.64 39.78 1p1d n ILE 60 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 1p1d s GLU 61 N -2.86 2.21 -0.34 9.51 2.12 0.48 -4.82 118.70 125.00 1p1d s GLU 61 Ca 0.19 -0.56 -0.33 0.00 0.36 0.00 0.00 54.97 54.63 1p1d s GLU 61 Cb -0.02 -1.87 -0.10 0.00 0.26 0.00 0.00 34.13 32.40 1p1d s GLU 61 CO 0.12 -0.06 2.22 0.00 -0.54 0.00 0.00 175.26 177.00 1p1d n ALA 62 N 4.18 1.21 -1.65 6.30 0.00 -1.26 -1.38 120.51 127.92 1p1d n ALA 62 Ca -0.19 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1p1d n ALA 62 Cb 0.51 -2.65 0.00 0.00 0.00 0.00 0.00 19.45 17.31 1p1d n ALA 62 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1p1d n ASP 63 N 10.50 -1.53 -4.29 0.00 -0.08 -1.26 -5.10 116.55 114.80 1p1d n ASP 63 Ca 0.39 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 53.47 1p1d n ASP 63 Cb 0.28 -0.38 -0.11 0.00 2.34 0.00 0.00 41.12 43.25 1p1d n ASP 63 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1p1d s SER 64 N -2.60 2.37 0.13 1.67 0.15 -0.48 -5.02 113.70 109.92 1p1d s SER 64 Ca 0.00 -0.82 0.12 0.00 0.70 0.00 0.00 55.95 55.96 1p1d s SER 64 Cb 0.00 -0.12 0.59 0.00 -1.71 0.00 0.00 66.02 64.79 1p1d s SER 64 CO 0.00 -0.07 1.38 -2.65 1.20 0.00 0.00 173.24 173.10 1p1d n PRO 65 N 0.50 0.07 0.12 5.44 -0.02 -1.26 -1.08 135.00 138.77 1p1d n PRO 65 Ca -0.15 0.48 -0.10 0.00 -2.02 0.00 0.00 63.50 61.71 1p1d n PRO 65 Cb 0.57 -1.68 -0.06 0.00 -0.02 0.00 0.00 33.50 32.30 1p1d n PRO 65 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p1d h ALA 66 N 2.14 -0.39 0.00 3.55 0.00 -1.88 0.52 119.26 123.19 1p1d h ALA 66 Ca 0.00 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 1p1d h ALA 66 Cb 0.10 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1p1d h ALA 66 CO 0.00 -0.42 -0.86 1.49 0.00 0.00 0.00 179.25 179.46 1p1d h GLU 67 N -0.99 0.00 -0.00 0.00 4.57 -1.82 -3.19 114.58 113.16 1p1d h GLU 67 Ca -0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1p1d h GLU 67 Cb 0.47 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1p1d h GLU 67 CO 0.07 0.86 -0.33 0.54 -1.18 0.00 0.00 179.01 178.97 1p1d n ARG 68 N -3.37 0.45 -0.26 1.92 5.12 -0.24 -4.24 116.66 116.03 1p1d n ARG 68 Ca 0.00 -0.25 0.06 0.00 -1.93 0.00 0.00 57.85 55.74 1p1d n ARG 68 Cb 0.86 -1.49 0.18 0.00 -1.16 0.00 0.00 32.46 30.85 1p1d n ARG 68 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1p1d n GLY 70 N -1.40 1.24 2.21 0.00 0.00 -1.26 -4.90 105.19 101.08 1p1d n GLY 70 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1p1d n GLY 70 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p1d n VAL 71 N 0.00 -0.26 -4.05 1.61 0.31 -1.26 -4.58 118.33 110.10 1p1d n VAL 71 Ca 0.00 -4.42 -0.10 0.00 -0.01 0.00 0.00 64.34 59.81 1p1d n VAL 71 Cb 0.00 -0.87 -0.07 0.00 -0.91 0.00 0.00 33.84 31.99 1p1d n VAL 71 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1p1d s LEU 72 N -2.03 0.59 0.09 7.52 1.43 -1.26 -4.84 118.68 120.18 1p1d s LEU 72 Ca 0.39 -1.05 -0.26 0.00 -1.03 0.00 0.00 54.13 52.18 1p1d s LEU 72 Cb 0.29 1.35 0.08 0.00 0.03 0.00 0.00 46.19 47.93 1p1d s LEU 72 CO -0.09 -1.04 0.78 -1.58 0.23 0.00 0.00 176.35 174.65 1p1d s GLN 73 N -4.05 1.10 -0.94 1.70 2.00 -1.26 -4.97 119.66 113.24 1p1d s GLN 73 Ca 0.27 -0.46 -0.26 0.00 -2.00 0.00 0.00 55.36 52.90 1p1d s GLN 73 Cb 0.02 0.47 -0.18 0.00 0.80 0.00 0.00 33.01 34.12 1p1d s GLN 73 CO 0.09 -0.49 2.25 0.42 -0.50 0.00 0.00 175.29 177.07 1p1d s ILE 74 N -3.42 3.03 0.00 -2.34 -1.09 -1.26 -3.81 121.20 112.31 1p1d s ILE 74 Ca 0.05 -0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.43 1p1d s ILE 74 Cb -0.01 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1p1d s ILE 74 CO -0.08 -0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.19 1p1d n GLY 75 N 6.48 -0.58 3.27 6.18 0.00 -1.10 -4.72 105.19 114.71 1p1d n GLY 75 Ca 0.44 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 1p1d n GLY 75 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1p1d s ASP 76 N 0.00 4.62 -0.67 1.61 1.47 -1.25 -4.78 116.67 117.67 1p1d s ASP 76 Ca 0.00 -0.75 -0.26 0.00 1.18 0.00 0.00 52.55 52.72 1p1d s ASP 76 Cb 0.00 -1.75 -0.13 0.00 -0.34 0.00 0.00 42.92 40.70 1p1d s ASP 76 CO 0.00 -0.14 2.44 0.54 0.68 0.00 0.00 175.17 178.69 1p1d n ARG 77 N 4.76 0.71 -2.28 2.11 5.12 -1.26 -4.56 116.66 121.25 1p1d n ARG 77 Ca -0.16 -0.23 -0.43 0.00 -1.93 0.00 0.00 57.85 55.10 1p1d n ARG 77 Cb 0.48 -3.11 -0.02 0.00 -1.16 0.00 0.00 32.46 28.64 1p1d n ARG 77 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1p1d s VAL 78 N 11.78 3.95 -0.05 1.55 1.01 -1.17 -2.77 120.40 134.70 1p1d s VAL 78 Ca 1.04 1.08 -0.16 0.00 0.00 0.00 0.00 61.98 63.94 1p1d s VAL 78 Cb -0.35 -3.94 -0.31 0.00 0.00 0.00 0.00 36.38 31.79 1p1d s VAL 78 CO 0.26 -0.36 0.76 -0.03 0.00 0.00 0.00 175.10 175.73 1p1d h MET 79 N 9.79 0.37 -2.68 2.72 4.05 -0.93 -3.40 114.93 124.85 1p1d h MET 79 Ca -0.30 -0.63 -0.10 0.00 -0.28 0.00 0.00 59.70 58.40 1p1d h MET 79 Cb 1.12 0.23 -0.20 0.00 -0.80 0.00 0.00 31.60 31.96 1p1d h MET 79 CO 1.01 1.30 -0.11 0.00 0.23 0.00 0.00 176.91 179.34 1p1d s ALA 80 N -2.52 -1.13 -0.10 0.39 0.00 -1.25 -4.41 121.76 112.74 1p1d s ALA 80 Ca -0.15 0.66 -0.01 0.00 0.00 0.00 0.00 51.96 52.46 1p1d s ALA 80 Cb 0.04 0.06 0.03 0.00 0.00 0.00 0.00 23.12 23.25 1p1d s ALA 80 CO 0.85 -0.31 -0.05 0.42 0.00 0.00 0.00 175.76 176.67 1p1d s ILE 81 N -1.33 0.81 -1.57 0.00 1.01 0.34 -1.80 121.20 118.66 1p1d s ILE 81 Ca -0.12 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1p1d s ILE 81 Cb -0.03 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.55 1p1d s ILE 81 CO 0.06 0.31 0.00 -3.20 0.00 0.00 0.00 174.94 172.11 1p1d n ASN 82 N 5.01 -4.32 0.00 3.58 2.85 0.66 -0.17 115.26 122.88 1p1d n ASN 82 Ca -0.11 0.30 0.00 0.00 -0.11 0.00 0.00 54.58 54.67 1p1d n ASN 82 Cb 0.50 -3.83 0.00 0.00 1.24 0.00 0.00 39.78 37.69 1p1d n ASN 82 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1p1d n GLY 83 N -0.48 2.91 3.70 8.20 0.00 -1.26 -5.06 105.19 113.20 1p1d n GLY 83 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1p1d n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 84 N -2.63 3.58 0.41 -0.61 1.01 0.77 -4.92 121.20 118.80 1p1d s ILE 84 Ca 0.00 1.07 0.12 0.00 0.00 0.00 0.00 60.65 61.83 1p1d s ILE 84 Cb 0.00 -3.68 0.17 0.00 0.01 0.00 0.00 42.46 38.95 1p1d s ILE 84 CO 0.00 0.04 1.94 1.55 0.00 0.00 0.00 174.94 178.48 1p1d h PRO 85 N 7.29 0.13 0.00 2.79 0.13 -1.86 0.99 132.00 141.47 1p1d h PRO 85 Ca -0.40 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1p1d h PRO 85 Cb 1.20 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1p1d h PRO 85 CO 0.88 0.30 0.00 0.25 -0.23 0.00 0.00 178.00 179.19 1p1d n THR 86 N -4.29 0.00 0.33 1.56 -2.24 -1.26 -4.28 114.28 104.10 1p1d n THR 86 Ca -0.01 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.87 1p1d n THR 86 Cb 0.26 0.00 0.46 0.00 -2.10 0.00 0.00 70.33 68.95 1p1d n THR 86 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1p1d n GLU 87 N 0.00 0.14 -1.51 -0.78 1.02 -1.26 -2.83 120.64 115.42 1p1d n GLU 87 Ca 0.00 0.46 -0.34 0.00 -0.02 0.00 0.00 57.16 57.26 1p1d n GLU 87 Cb 0.00 -1.82 0.05 0.00 -0.02 0.00 0.00 31.44 29.65 1p1d n GLU 87 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1p1d n ASP 88 N -2.10 7.42 0.00 1.62 -0.08 -1.26 -4.93 116.55 117.21 1p1d n ASP 88 Ca 0.01 -3.68 0.00 0.00 -1.51 0.00 0.00 54.79 49.61 1p1d n ASP 88 Cb 0.16 -1.04 0.00 0.00 2.34 0.00 0.00 41.12 42.58 1p1d n ASP 88 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1p1d n SER 89 N -0.49 0.00 -4.76 1.67 2.88 -1.13 -5.01 113.62 106.78 1p1d n SER 89 Ca 0.55 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.77 1p1d n SER 89 Cb 0.49 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.02 1p1d n SER 89 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1p1d s THR 90 N -2.41 3.11 0.25 2.46 2.01 -1.26 -4.66 115.64 115.14 1p1d s THR 90 Ca 0.00 0.46 0.09 0.00 0.31 0.00 0.00 61.69 62.55 1p1d s THR 90 Cb 0.00 -2.95 -0.05 0.00 0.01 0.00 0.00 72.50 69.50 1p1d s THR 90 CO 0.00 -0.37 1.56 2.19 -0.69 0.00 0.00 174.62 177.31 1p1d h PHE 91 N -0.43 0.08 -0.60 4.92 -0.00 -1.88 -3.13 116.94 115.90 1p1d h PHE 91 Ca -0.46 -0.03 0.12 0.00 -0.00 0.00 0.00 57.97 57.60 1p1d h PHE 91 Cb 1.25 -0.01 -0.03 0.00 -0.00 0.00 0.00 35.95 37.15 1p1d h PHE 91 CO 0.54 0.70 0.41 1.05 -0.00 0.00 0.00 178.31 181.02 1p1d h GLU 92 N 0.04 0.29 -0.38 6.09 4.11 -1.92 -0.09 114.58 122.72 1p1d h GLU 92 Ca -0.01 -0.02 -0.09 0.00 0.07 0.00 0.00 59.36 59.32 1p1d h GLU 92 Cb 1.17 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 1p1d h GLU 92 CO 0.09 0.19 -0.12 1.05 0.07 0.00 0.00 179.01 180.29 1p1d h GLU 93 N 0.30 0.66 -0.15 1.06 -0.00 -1.94 0.73 114.58 115.25 1p1d h GLU 93 Ca 0.29 -0.21 -0.15 0.00 -0.00 0.00 0.00 59.36 59.28 1p1d h GLU 93 Cb 0.72 -0.06 -0.01 0.00 -0.00 0.00 0.00 28.75 29.40 1p1d h GLU 93 CO -0.07 0.76 -0.55 0.00 -0.00 0.00 0.00 179.01 179.16 1p1d h ALA 94 N 1.27 0.78 -0.02 1.06 0.00 -1.18 -2.08 119.26 119.09 1p1d h ALA 94 Ca 0.11 -0.51 -0.17 0.00 0.00 0.00 0.00 54.91 54.34 1p1d h ALA 94 Cb 0.56 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1p1d h ALA 94 CO 0.03 0.69 -0.74 -0.91 0.00 0.00 0.00 179.25 178.33 1p1d h ASN 95 N 0.34 0.20 0.01 0.00 -0.26 -1.03 -2.37 115.58 112.47 1p1d h ASN 95 Ca 0.01 -0.14 -0.19 0.00 -0.56 0.00 0.00 56.30 55.42 1p1d h ASN 95 Cb 1.07 -0.06 -0.00 0.00 -1.06 0.00 0.00 38.32 38.26 1p1d h ASN 95 CO 0.10 0.87 -0.67 0.06 -1.06 0.00 0.00 177.43 176.73 1p1d h GLN 96 N 0.11 0.61 -0.30 0.81 -0.00 -0.71 0.18 115.11 115.81 1p1d h GLN 96 Ca -0.02 -0.45 -0.17 0.00 -0.00 0.00 0.00 58.65 58.01 1p1d h GLN 96 Cb 1.30 0.08 -0.00 0.00 -0.00 0.00 0.00 27.48 28.86 1p1d h GLN 96 CO 0.11 1.07 -0.48 1.37 -0.00 0.00 0.00 178.83 180.90 1p1d h LEU 97 N 0.44 0.88 0.19 0.06 8.10 -1.36 -1.51 115.31 122.10 1p1d h LEU 97 Ca -0.02 -0.44 -0.01 0.00 0.11 0.00 0.00 57.88 57.52 1p1d h LEU 97 Cb 1.25 -0.25 0.00 0.00 -0.44 0.00 0.00 40.66 41.22 1p1d h LEU 97 CO 0.13 1.21 -0.09 -0.07 -4.11 0.00 0.00 178.44 175.50 1p1d h LEU 98 N 0.63 -0.22 -2.00 0.17 3.38 -1.41 0.52 115.31 116.39 1p1d h LEU 98 Ca 0.03 -0.27 0.25 0.00 0.09 0.00 0.00 57.88 57.98 1p1d h LEU 98 Cb 1.06 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 1p1d h LEU 98 CO 0.11 0.32 0.63 0.08 0.09 0.00 0.00 178.44 179.67 1p1d h ARG 99 N -0.93 0.00 -0.62 1.13 -0.00 -0.72 0.31 114.38 113.54 1p1d h ARG 99 Ca -0.03 -0.00 -0.45 0.00 -0.00 0.00 0.00 59.98 59.51 1p1d h ARG 99 Cb 0.48 -0.00 -0.34 0.00 -0.00 0.00 0.00 29.97 30.11 1p1d h ARG 99 CO 0.04 0.00 -0.68 -0.25 -0.00 0.00 0.00 179.97 179.09 1p1d n ASP 100 N -4.27 4.40 -1.86 0.08 9.92 -0.57 -4.73 116.55 119.52 1p1d n ASP 100 Ca 0.18 -3.78 -0.11 0.00 -0.53 0.00 0.00 54.79 50.55 1p1d n ASP 100 Cb 0.94 -0.41 0.20 0.00 -0.64 0.00 0.00 41.12 41.22 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1p1d n SER 101 N -0.80 4.00 -0.08 -2.24 7.64 0.18 -4.06 113.62 118.26 1p1d n SER 101 Ca 0.40 -3.10 0.02 0.00 1.01 0.00 0.00 58.87 57.20 1p1d n SER 101 Cb 0.91 -0.73 0.04 0.00 -1.01 0.00 0.00 64.21 63.42 1p1d n SER 101 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1p1d n SER 102 N -0.37 2.17 -0.04 6.43 3.41 -1.26 -4.23 113.62 119.72 1p1d n SER 102 Ca 0.39 -2.22 -0.13 0.00 -0.26 0.00 0.00 58.87 56.65 1p1d n SER 102 Cb 1.30 -0.11 -0.08 0.00 -0.26 0.00 0.00 64.21 65.06 1p1d n SER 102 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1p1d h ILE 103 N 0.18 1.36 -0.01 -1.33 2.04 -1.92 -3.11 117.51 114.72 1p1d h ILE 103 Ca 0.00 -1.22 0.00 0.00 1.00 0.00 0.00 64.86 64.64 1p1d h ILE 103 Cb 0.63 1.98 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 1p1d h ILE 103 CO 0.00 0.34 -0.17 0.35 0.00 0.00 0.00 178.15 178.68 1p1d n THR 104 N -4.68 0.00 -2.10 -0.27 -2.24 -1.26 -4.93 114.28 98.80 1p1d n THR 104 Ca -0.07 -0.21 -0.18 0.00 -2.27 0.00 0.00 64.05 61.32 1p1d n THR 104 Cb 0.31 0.58 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 1p1d n THR 104 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1p1d n SER 105 N -0.18 -5.26 -3.56 3.42 2.88 -1.18 -4.94 113.62 104.80 1p1d n SER 105 Ca 0.14 0.12 -0.08 0.00 -1.33 0.00 0.00 58.87 57.73 1p1d n SER 105 Cb 0.38 -4.34 -0.04 0.00 -0.75 0.00 0.00 64.21 59.46 1p1d n SER 105 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1p1d s LYS 106 N -4.49 0.58 -0.12 -1.46 2.47 -1.26 -2.19 119.74 113.27 1p1d s LYS 106 Ca 0.00 -0.05 -0.22 0.00 -1.56 0.00 0.00 55.97 54.14 1p1d s LYS 106 Cb 0.00 0.27 0.05 0.00 -1.46 0.00 0.00 37.83 36.69 1p1d s LYS 106 CO 0.00 -0.22 0.55 0.08 0.16 0.00 0.00 175.35 175.92 1p1d s VAL 107 N -1.97 0.01 -0.15 4.02 1.01 0.29 -4.88 120.40 118.73 1p1d s VAL 107 Ca 0.03 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1p1d s VAL 107 Cb -0.01 -0.82 0.02 0.00 0.00 0.00 0.00 36.38 35.57 1p1d s VAL 107 CO -0.03 -0.05 -0.16 -0.89 0.00 0.00 0.00 175.10 173.96 1p1d s THR 108 N -0.48 1.69 0.06 3.92 2.01 -1.26 -0.18 115.64 121.39 1p1d s THR 108 Ca -0.06 -0.71 -0.03 0.00 0.31 0.00 0.00 61.69 61.19 1p1d s THR 108 Cb -0.03 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.89 1p1d s THR 108 CO 0.04 0.48 0.04 -1.48 -0.69 0.00 0.00 174.62 173.01 1p1d s LEU 109 N 1.40 2.15 0.01 4.42 2.34 -0.63 -0.24 118.68 128.12 1p1d s LEU 109 Ca 0.04 -0.84 0.01 0.00 0.06 0.00 0.00 54.13 53.40 1p1d s LEU 109 Cb -0.13 0.44 -0.04 0.00 -0.56 0.00 0.00 46.19 45.90 1p1d s LEU 109 CO -0.11 -0.60 0.06 -1.61 -1.06 0.00 0.00 176.35 173.03 1p1d s GLU 110 N -3.63 2.95 0.02 1.48 2.02 -0.74 0.11 118.70 120.89 1p1d s GLU 110 Ca 0.04 -0.55 0.06 0.00 0.02 0.00 0.00 54.97 54.54 1p1d s GLU 110 Cb 0.05 -2.78 -0.02 0.00 0.10 0.00 0.00 34.13 31.48 1p1d s GLU 110 CO -0.09 0.63 -0.19 0.96 0.02 0.00 0.00 175.26 176.58 1p1d s ILE 111 N -1.19 1.54 -0.17 -1.63 -4.36 -0.68 -0.23 121.20 114.47 1p1d s ILE 111 Ca 0.23 -1.00 -0.05 0.00 -0.26 0.00 0.00 60.65 59.58 1p1d s ILE 111 Cb -0.12 -1.31 -0.03 0.00 1.25 0.00 0.00 42.46 42.25 1p1d s ILE 111 CO 0.14 0.29 -0.01 -0.70 0.24 0.00 0.00 174.94 174.89 1p1d s GLU 112 N -0.83 3.72 0.31 0.37 2.12 -1.11 -1.18 118.70 122.11 1p1d s GLU 112 Ca 0.07 -0.49 -0.12 0.00 0.36 0.00 0.00 54.97 54.79 1p1d s GLU 112 Cb -0.08 -2.99 0.02 0.00 0.26 0.00 0.00 34.13 31.34 1p1d s GLU 112 CO 0.01 0.22 0.59 -0.59 -0.54 0.00 0.00 175.26 174.94 1p1d s PHE 113 N 0.43 0.42 -0.14 5.30 -0.12 0.99 -4.55 117.98 120.32 1p1d s PHE 113 Ca -0.02 -0.84 -0.10 0.00 -0.05 0.00 0.00 56.93 55.92 1p1d s PHE 113 Cb -0.14 0.34 -0.05 0.00 -0.63 0.00 0.00 43.02 42.55 1p1d s PHE 113 CO 0.02 -1.21 0.20 -0.51 -0.05 0.00 0.00 175.22 173.67 1p1d s ASP 114 N -3.08 6.40 -0.55 1.98 1.01 -1.26 0.35 116.67 121.51 1p1d s ASP 114 Ca 0.21 0.47 -0.28 0.00 0.71 0.00 0.00 52.55 53.67 1p1d s ASP 114 Cb -0.02 -2.12 0.01 0.00 1.01 0.00 0.00 42.92 41.80 1p1d s ASP 114 CO 0.12 0.28 1.46 0.68 0.21 0.00 0.00 175.17 177.93 1p1d s VAL 115 N -0.38 3.74 0.00 -1.27 -7.23 -1.21 -4.89 120.40 109.16 1p1d s VAL 115 Ca 0.14 0.63 0.00 0.00 -1.81 0.00 0.00 61.98 60.94 1p1d s VAL 115 Cb -0.12 -4.37 0.00 0.00 0.56 0.00 0.00 36.38 32.45 1p1d s VAL 115 CO 0.03 -1.12 0.00 0.00 -0.31 0.00 0.00 175.10 173.71 1p1d n ALA 116 N 9.82 0.00 -2.42 1.32 0.00 0.32 -4.49 120.51 125.06 1p1d n ALA 116 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.59 1p1d n ALA 116 Cb 0.49 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.00 1p1d n ALA 116 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1p1d n GLU 117 N 0.00 0.94 -1.45 0.00 -0.58 -1.26 -4.65 120.64 113.64 1p1d n GLU 117 Ca 0.00 -2.74 0.00 0.00 -0.42 0.00 0.00 57.16 54.00 1p1d n GLU 117 Cb 0.00 -0.82 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 1p1d n GLU 117 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1p1d n SER 118 N -0.11 -1.93 -4.01 1.62 2.88 -1.26 -4.20 113.62 106.62 1p1d n SER 118 Ca 0.11 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.39 1p1d n SER 118 Cb 0.98 -0.97 -0.17 0.00 -0.75 0.00 0.00 64.21 63.31 1p1d n SER 118 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1p1d s VAL 119 N 0.00 1.18 -0.51 2.46 -7.23 -1.26 -0.63 120.40 114.41 1p1d s VAL 119 Ca 0.00 -0.47 -0.06 0.00 -1.81 0.00 0.00 61.98 59.64 1p1d s VAL 119 Cb 0.00 -1.10 0.13 0.00 0.56 0.00 0.00 36.38 35.97 1p1d s VAL 119 CO 0.00 0.37 0.34 0.27 -0.31 0.00 0.00 175.10 175.78 1p1d s ILE 120 N 0.93 3.85 0.54 -0.62 -5.25 0.22 -4.99 121.20 115.89 1p1d s ILE 120 Ca -0.09 -2.20 -0.08 0.00 -0.99 0.00 0.00 60.65 57.29 1p1d s ILE 120 Cb -0.15 -3.55 -0.04 0.00 2.95 0.00 0.00 42.46 41.67 1p1d s ILE 120 CO 0.00 -0.79 0.89 -2.16 -1.79 0.00 0.00 174.94 171.10 1p1d s PRO 121 N 0.88 3.57 0.00 0.37 0.04 -1.26 -2.27 135.00 136.33 1p1d s PRO 121 Ca 0.10 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1p1d s PRO 121 Cb -0.23 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1p1d s PRO 121 CO -0.03 -0.36 0.71 0.45 0.04 0.00 0.00 177.00 177.81 1p1d n SER 122 N -2.46 -0.61 -2.19 6.66 2.88 -1.15 -4.98 113.62 111.77 1p1d n SER 122 Ca 0.03 -1.42 0.00 0.00 -1.33 0.00 0.00 58.87 56.14 1p1d n SER 122 Cb 0.55 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 64.19 1p1d n SER 122 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1p1d n SER 123 N 0.00 -8.39 0.00 -3.46 7.64 -1.26 -4.37 113.62 103.78 1p1d n SER 123 Ca -0.17 1.58 0.00 0.00 1.01 0.00 0.00 58.87 61.29 1p1d n SER 123 Cb 0.56 -4.84 0.00 0.00 -1.01 0.00 0.00 64.21 58.93 1p1d n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p1d n GLY 124 N 1.91 1.94 2.87 0.23 0.00 -0.51 -4.89 105.19 106.75 1p1d n GLY 124 Ca 0.00 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 1p1d n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1d s THR 125 N -0.39 1.45 -0.24 2.61 2.01 -1.26 -2.11 115.64 117.72 1p1d s THR 125 Ca 0.00 -1.61 -0.05 0.00 0.31 0.00 0.00 61.69 60.34 1p1d s THR 125 Cb 0.00 -1.98 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 1p1d s THR 125 CO 0.00 -0.49 0.00 0.12 -0.69 0.00 0.00 174.62 173.56 1p1d s PHE 126 N 1.35 3.02 -0.25 4.92 2.19 -0.79 -2.93 117.98 125.49 1p1d s PHE 126 Ca 0.06 -0.80 -0.08 0.00 0.33 0.00 0.00 56.93 56.44 1p1d s PHE 126 Cb -0.18 -2.16 -0.03 0.00 -1.31 0.00 0.00 43.02 39.34 1p1d s PHE 126 CO -0.15 -0.50 0.08 -1.01 1.83 0.00 0.00 175.22 175.47 1p1d s HIS 127 N 1.52 3.10 -0.67 10.12 3.76 -0.96 -1.25 115.29 130.91 1p1d s HIS 127 Ca 0.06 -0.35 -0.15 0.00 -0.15 0.00 0.00 55.06 54.46 1p1d s HIS 127 Cb -0.15 -2.23 0.17 0.00 1.11 0.00 0.00 32.58 31.48 1p1d s HIS 127 CO -0.01 -0.31 0.63 0.08 -0.85 0.00 0.00 174.74 174.28 1p1d s VAL 128 N 1.53 5.37 -0.66 -0.90 1.01 0.21 -0.61 120.40 126.35 1p1d s VAL 128 Ca 0.06 -1.92 -0.27 0.00 0.00 0.00 0.00 61.98 59.86 1p1d s VAL 128 Cb -0.15 -4.41 0.04 0.00 0.00 0.00 0.00 36.38 31.86 1p1d s VAL 128 CO 0.04 -0.95 1.18 -0.54 0.00 0.00 0.00 175.10 174.83 1p1d s LYS 129 N 1.01 3.31 -0.16 2.72 -0.14 0.20 -1.63 119.74 125.05 1p1d s LYS 129 Ca 0.10 -0.13 -0.00 0.00 -1.36 0.00 0.00 55.97 54.58 1p1d s LYS 129 Cb -0.21 -4.11 -0.00 0.00 -1.68 0.00 0.00 37.83 31.82 1p1d s LYS 129 CO -0.02 -1.88 -0.14 -0.51 -0.76 0.00 0.00 175.35 172.04 1p1d s LEU 130 N 5.11 2.55 -0.08 3.17 1.43 -0.55 -4.15 118.68 126.16 1p1d s LEU 130 Ca 0.36 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.72 1p1d s LEU 130 Cb -0.09 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 1p1d s LEU 130 CO 0.19 0.08 1.43 -2.16 0.23 0.00 0.00 176.35 176.11 1p1d s PRO 131 N 0.87 4.23 0.37 1.29 0.04 -1.26 -1.23 135.00 139.30 1p1d s PRO 131 Ca -0.04 1.92 -0.01 0.00 0.04 0.00 0.00 61.00 62.90 1p1d s PRO 131 Cb -0.15 -3.79 -0.04 0.00 0.04 0.00 0.00 34.50 30.56 1p1d s PRO 131 CO -0.01 -0.72 0.60 0.21 0.04 0.00 0.00 177.00 177.13 1p1d s LYS 132 N 3.39 3.51 0.00 4.56 2.20 -0.82 -4.84 119.74 127.75 1p1d s LYS 132 Ca 0.63 -0.17 0.00 0.00 -0.36 0.00 0.00 55.97 56.07 1p1d s LYS 132 Cb -0.28 -2.59 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 1p1d s LYS 132 CO 0.23 0.07 0.00 1.63 -0.36 0.00 0.00 175.35 176.92 1p1d n LYS 133 N -1.80 2.46 -0.10 4.03 4.01 -1.26 -4.47 118.16 121.04 1p1d n LYS 133 Ca -0.03 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.66 1p1d n LYS 133 Cb 0.56 0.00 0.02 0.00 -0.51 0.00 0.00 35.03 35.10 1p1d n LYS 133 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1p1d h HIS 134 N 0.21 1.00 0.00 2.13 -0.00 -1.99 -3.39 115.15 113.11 1p1d h HIS 134 Ca 0.00 -0.28 -0.08 0.00 -0.00 0.00 0.00 60.37 60.01 1p1d h HIS 134 Cb 0.00 -0.22 -0.13 0.00 -0.00 0.00 0.00 27.41 27.06 1p1d h HIS 134 CO 0.00 1.07 -0.07 0.43 -0.00 0.00 0.00 177.93 179.36 1p1d n SER 135 N -4.07 -1.41 -4.70 3.26 7.64 -1.26 -5.01 113.62 108.07 1p1d n SER 135 Ca -0.01 -1.91 -0.32 0.00 1.01 0.00 0.00 58.87 57.63 1p1d n SER 135 Cb 0.51 0.83 -0.08 0.00 -1.01 0.00 0.00 64.21 64.46 1p1d n SER 135 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1p1d s VAL 136 N 0.15 4.25 0.51 0.44 1.01 -1.26 -5.04 120.40 120.46 1p1d s VAL 136 Ca 0.26 -0.60 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 1p1d s VAL 136 Cb 0.21 -2.92 -0.06 0.00 0.00 0.00 0.00 36.38 33.62 1p1d s VAL 136 CO -0.10 0.35 1.35 -1.83 0.00 0.00 0.00 175.10 174.86 1p1d s GLU 137 N -1.67 3.33 -0.09 2.72 -1.05 -1.26 -4.95 118.70 115.73 1p1d s GLU 137 Ca 0.21 2.21 -0.12 0.00 -0.15 0.00 0.00 54.97 57.12 1p1d s GLU 137 Cb -0.12 -2.36 -0.04 0.00 -0.44 0.00 0.00 34.13 31.17 1p1d s GLU 137 CO 0.12 -1.03 -0.24 1.28 0.95 0.00 0.00 175.26 176.34 1p1d n LEU 138 N -0.78 1.63 0.00 1.83 4.77 -1.26 -4.74 117.00 118.45 1p1d n LEU 138 Ca 0.09 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1p1d n LEU 138 Cb 0.45 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1p1d n LEU 138 CO 0.53 -0.42 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 1p1d n GLY 139 N 2.07 0.74 3.90 -0.72 0.00 -1.26 -4.49 105.19 105.43 1p1d n GLY 139 Ca -0.09 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 1p1d n GLY 139 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 140 N -2.00 5.34 -0.09 -0.61 -4.36 -1.26 0.10 121.20 118.33 1p1d s ILE 140 Ca 0.00 -0.06 0.02 0.00 -0.26 0.00 0.00 60.65 60.36 1p1d s ILE 140 Cb 0.00 -3.58 0.01 0.00 1.25 0.00 0.00 42.46 40.14 1p1d s ILE 140 CO 0.00 0.26 -0.15 -0.89 0.24 0.00 0.00 174.94 174.40 1p1d s THR 141 N -1.40 1.40 0.30 8.37 2.01 0.28 -4.95 115.64 121.65 1p1d s THR 141 Ca 0.31 -0.62 0.06 0.00 0.31 0.00 0.00 61.69 61.75 1p1d s THR 141 Cb -0.13 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 71.09 1p1d s THR 141 CO 0.20 0.42 0.37 -0.63 -0.69 0.00 0.00 174.62 174.29 1p1d s ILE 142 N 0.73 4.36 -0.00 1.82 1.01 -1.26 0.74 121.20 128.59 1p1d s ILE 142 Ca -0.13 -1.11 -0.07 0.00 0.00 0.00 0.00 60.65 59.34 1p1d s ILE 142 Cb -0.16 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1p1d s ILE 142 CO 0.03 -0.23 0.14 -0.44 0.00 0.00 0.00 174.94 174.44 1p1d s SER 143 N -4.04 0.00 -0.47 3.58 0.01 0.36 -4.57 113.70 108.57 1p1d s SER 143 Ca 0.40 -0.16 -0.17 0.00 1.31 0.00 0.00 55.95 57.33 1p1d s SER 143 Cb -0.08 0.22 0.05 0.00 0.21 0.00 0.00 66.02 66.42 1p1d s SER 143 CO 0.29 -0.35 0.47 -0.55 0.41 0.00 0.00 173.24 173.51 1p1d s SER 144 N -1.26 6.18 0.82 2.44 0.15 -1.26 -1.48 113.70 119.29 1p1d s SER 144 Ca -0.13 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 55.49 1p1d s SER 144 Cb -0.07 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 62.02 1p1d s SER 144 CO 0.02 -0.70 0.00 -0.81 1.20 0.00 0.00 173.24 172.95 1p1d n PRO 145 N 5.59 0.19 -2.18 5.44 -0.04 -1.26 -4.94 135.00 137.80 1p1d n PRO 145 Ca -0.09 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.97 1p1d n PRO 145 Cb 0.45 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.88 1p1d n PRO 145 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1p1d s SER 146 N -1.00 5.55 0.00 3.54 0.01 -1.26 -4.91 113.70 115.62 1p1d s SER 146 Ca 0.00 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1p1d s SER 146 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1p1d s SER 146 CO 0.00 -2.20 0.36 -0.24 0.41 0.00 0.00 173.24 171.57 1p1d n SER 147 N 11.70 0.00 -2.26 2.44 2.88 -1.26 -4.88 113.62 122.25 1p1d n SER 147 Ca 0.16 0.36 -0.16 0.00 -1.33 0.00 0.00 58.87 57.89 1p1d n SER 147 Cb 0.51 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.00 1p1d n SER 147 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1p1d n ARG 148 N -0.48 -3.71 0.00 -1.46 1.74 -1.26 -4.74 116.66 106.75 1p1d n ARG 148 Ca 0.00 0.65 0.00 0.00 -0.77 0.00 0.00 57.85 57.73 1p1d n ARG 148 Cb 0.00 -4.97 0.00 0.00 -1.02 0.00 0.00 32.46 26.47 1p1d n ARG 148 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1p1d n LYS 149 N -3.15 0.00 -0.75 5.56 0.00 -1.26 -5.04 118.16 113.52 1p1d n LYS 149 Ca -0.07 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 57.98 1p1d n LYS 149 Cb 0.58 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.59 1p1d n LYS 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1p1d n PRO 150 N -0.05 1.68 0.05 -1.58 -0.04 -1.26 -3.30 135.00 130.50 1p1d n PRO 150 Ca 0.00 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 62.02 1p1d n PRO 150 Cb 0.00 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 30.94 1p1d n PRO 150 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p1d n GLY 151 N 4.00 -0.94 1.99 0.55 0.00 -1.26 -4.61 105.19 104.92 1p1d n GLY 151 Ca 0.41 0.28 -0.00 0.00 0.00 0.00 0.00 46.02 46.71 1p1d n GLY 151 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p1d n ASP 152 N -2.69 -7.40 -2.69 1.61 2.03 -1.21 -2.77 116.55 103.43 1p1d n ASP 152 Ca 0.00 1.36 0.00 0.00 0.52 0.00 0.00 54.79 56.67 1p1d n ASP 152 Cb 0.00 -4.09 0.00 0.00 -0.72 0.00 0.00 41.12 36.31 1p1d n ASP 152 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1p1d n PRO 153 N 1.34 -0.56 -4.22 -0.67 -0.04 -1.26 -4.52 135.00 125.06 1p1d n PRO 153 Ca -0.01 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.29 1p1d n PRO 153 Cb 0.01 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.36 1p1d n PRO 153 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1p1d s LEU 154 N 0.00 2.43 0.09 1.53 2.01 -1.20 -4.49 118.68 119.06 1p1d s LEU 154 Ca 0.00 -0.85 -0.03 0.00 0.01 0.00 0.00 54.13 53.26 1p1d s LEU 154 Cb 0.00 -0.42 -0.03 0.00 0.01 0.00 0.00 46.19 45.75 1p1d s LEU 154 CO 0.00 -0.22 0.07 -0.69 1.01 0.00 0.00 176.35 176.52 1p1d s VAL 155 N -2.47 0.15 0.33 -1.59 1.01 -0.55 -0.05 120.40 117.23 1p1d s VAL 155 Ca 0.09 -1.67 -0.08 0.00 0.00 0.00 0.00 61.98 60.32 1p1d s VAL 155 Cb -0.03 -1.68 -0.06 0.00 0.00 0.00 0.00 36.38 34.61 1p1d s VAL 155 CO 0.01 -0.69 0.64 -0.63 0.00 0.00 0.00 175.10 174.43 1p1d s ILE 156 N -3.95 4.92 0.00 2.22 -1.09 -1.25 0.13 121.20 122.18 1p1d s ILE 156 Ca 0.13 0.33 0.00 0.00 -2.23 0.00 0.00 60.65 58.88 1p1d s ILE 156 Cb 0.07 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 37.23 1p1d s ILE 156 CO -0.05 -0.37 0.00 -0.24 -1.23 0.00 0.00 174.94 173.05 1p1d n SER 157 N -0.98 1.89 0.00 3.58 2.88 0.23 -4.49 113.62 116.72 1p1d n SER 157 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1p1d n SER 157 Cb 0.54 0.36 0.00 0.00 -0.75 0.00 0.00 64.21 64.36 1p1d n SER 157 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1p1d n ASP 158 N -0.61 0.00 -4.31 -3.46 -0.08 -1.22 -4.95 116.55 101.91 1p1d n ASP 158 Ca 0.00 0.00 -0.25 0.00 -1.51 0.00 0.00 54.79 53.03 1p1d n ASP 158 Cb 0.02 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.35 1p1d n ASP 158 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1p1d s ILE 159 N -0.62 1.86 0.32 5.18 1.09 -1.25 0.10 121.20 127.88 1p1d s ILE 159 Ca 0.00 -1.56 0.07 0.00 -1.10 0.00 0.00 60.65 58.06 1p1d s ILE 159 Cb 0.00 -1.66 -0.03 0.00 -1.06 0.00 0.00 42.46 39.71 1p1d s ILE 159 CO 0.00 0.01 0.29 -0.75 -0.10 0.00 0.00 174.94 174.39 1p1d s LYS 160 N -1.86 2.78 0.41 2.79 2.36 0.29 -4.95 119.74 121.56 1p1d s LYS 160 Ca 0.09 -1.25 0.04 0.00 -2.55 0.00 0.00 55.97 52.30 1p1d s LYS 160 Cb -0.10 -2.51 0.00 0.00 -1.05 0.00 0.00 37.83 34.17 1p1d s LYS 160 CO 0.04 0.13 0.59 0.21 1.55 0.00 0.00 175.35 177.88 1p1d s LYS 161 N -3.99 2.99 0.00 4.03 2.20 -1.26 -4.04 119.74 119.67 1p1d s LYS 161 Ca 0.40 -0.83 0.00 0.00 -0.36 0.00 0.00 55.97 55.18 1p1d s LYS 161 Cb -0.06 -2.68 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 1p1d s LYS 161 CO 0.27 -0.19 0.00 0.41 -0.36 0.00 0.00 175.35 175.48 1p1d n GLY 162 N -1.90 2.78 3.91 5.54 0.00 -1.26 -5.01 105.19 109.24 1p1d n GLY 162 Ca 0.02 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1p1d n GLY 162 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p1d s SER 163 N 0.56 6.42 0.64 1.61 0.15 -1.26 -4.54 113.70 117.29 1p1d s SER 163 Ca 0.00 0.42 0.29 0.00 0.70 0.00 0.00 55.95 57.36 1p1d s SER 163 Cb 0.00 -2.02 1.54 0.00 -1.71 0.00 0.00 66.02 63.83 1p1d s SER 163 CO 0.00 0.13 1.89 -0.37 1.20 0.00 0.00 173.24 176.09 1p1d h VAL 164 N 2.13 0.11 0.06 4.45 -1.51 -1.88 -1.93 116.25 117.68 1p1d h VAL 164 Ca -0.46 0.00 0.01 0.00 -1.23 0.00 0.00 66.70 65.02 1p1d h VAL 164 Cb 1.16 0.64 -0.02 0.00 -2.13 0.00 0.00 31.29 30.94 1p1d h VAL 164 CO 0.74 0.00 -0.28 0.00 -1.23 0.00 0.00 177.57 176.80 1p1d h ALA 165 N 1.34 -0.79 0.00 5.19 0.00 -1.89 -2.14 119.26 120.96 1p1d h ALA 165 Ca 0.06 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1p1d h ALA 165 Cb 0.83 0.69 -0.02 0.00 0.00 0.00 0.00 17.79 19.30 1p1d h ALA 165 CO -0.00 -0.86 -0.70 1.25 0.00 0.00 0.00 179.25 178.94 1p1d h HIS 166 N -0.40 0.00 -0.97 0.00 6.17 -1.64 -3.32 115.15 114.99 1p1d h HIS 166 Ca -0.00 0.00 0.12 0.00 0.71 0.00 0.00 60.37 61.20 1p1d h HIS 166 Cb 0.40 0.00 -0.08 0.00 2.52 0.00 0.00 27.41 30.25 1p1d h HIS 166 CO -0.38 0.43 0.62 -0.09 0.71 0.00 0.00 177.93 179.21 1p1d h ARG 167 N 0.00 0.90 -0.29 5.26 9.65 -1.20 0.97 114.38 129.66 1p1d h ARG 167 Ca -0.04 -0.05 0.08 0.00 -1.10 0.00 0.00 59.98 58.87 1p1d h ARG 167 Cb 1.36 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.73 1p1d h ARG 167 CO 0.05 0.59 0.24 0.00 2.80 0.00 0.00 179.97 183.66 1p1d h THR 168 N 0.92 0.67 0.00 0.20 1.03 -1.49 0.93 112.91 115.17 1p1d h THR 168 Ca 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.88 1p1d h THR 168 Cb 0.54 0.82 0.00 0.00 -1.07 0.00 0.00 68.15 68.44 1p1d h THR 168 CO -0.25 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 175.87 1p1d n GLY 169 N -1.53 2.35 0.33 2.99 0.00 0.33 -3.50 105.19 106.17 1p1d n GLY 169 Ca 0.04 -0.52 0.17 0.00 0.00 0.00 0.00 46.02 45.71 1p1d n GLY 169 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1p1d h THR 170 N 0.00 0.45 -0.27 2.61 1.35 -1.88 -3.38 112.91 111.79 1p1d h THR 170 Ca 0.00 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.81 1p1d h THR 170 Cb 0.00 0.88 -0.01 0.00 -1.73 0.00 0.00 68.15 67.29 1p1d h THR 170 CO 0.00 0.00 0.15 -0.22 -0.25 0.00 0.00 175.52 175.20 1p1d s LEU 171 N -7.51 2.66 0.36 3.87 1.98 -1.26 -4.88 118.68 113.90 1p1d s LEU 171 Ca -0.05 -0.57 0.08 0.00 -2.89 0.00 0.00 54.13 50.71 1p1d s LEU 171 Cb 0.15 -2.57 -0.04 0.00 0.66 0.00 0.00 46.19 44.38 1p1d s LEU 171 CO 0.53 -4.18 0.15 -1.61 -1.89 0.00 0.00 176.35 169.36 1p1d s GLU 172 N 8.43 2.32 -0.32 1.98 2.02 -1.26 -4.89 118.70 126.98 1p1d s GLU 172 Ca 0.85 -1.64 -0.19 0.00 0.02 0.00 0.00 54.97 54.01 1p1d s GLU 172 Cb -0.08 -2.12 -0.01 0.00 0.10 0.00 0.00 34.13 32.02 1p1d s GLU 172 CO 0.12 0.04 0.55 -0.51 0.02 0.00 0.00 175.26 175.48 1p1d s LEU 173 N -3.87 4.22 0.00 1.80 1.43 -1.26 -4.21 118.68 116.78 1p1d s LEU 173 Ca 0.39 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.71 1p1d s LEU 173 Cb -0.01 -2.67 0.00 0.00 0.03 0.00 0.00 46.19 43.54 1p1d s LEU 173 CO 0.23 -0.44 0.00 0.61 0.23 0.00 0.00 176.35 176.97 1p1d n GLY 174 N 4.61 1.99 3.71 -3.19 0.00 -1.26 -5.05 105.19 106.00 1p1d n GLY 174 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1p1d n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p1d s ASP 175 N -2.00 5.50 -0.52 1.61 1.11 -1.26 -5.01 116.67 116.10 1p1d s ASP 175 Ca 0.00 0.19 -0.22 0.00 0.18 0.00 0.00 52.55 52.70 1p1d s ASP 175 Cb 0.00 -1.68 0.05 0.00 1.07 0.00 0.00 42.92 42.36 1p1d s ASP 175 CO 0.00 0.35 0.77 -0.75 1.18 0.00 0.00 175.17 176.72 1p1d s LYS 176 N -0.68 3.24 0.20 8.23 2.47 -1.26 -3.95 119.74 127.98 1p1d s LYS 176 Ca 0.11 -0.54 -0.30 0.00 -1.56 0.00 0.00 55.97 53.68 1p1d s LYS 176 Cb -0.12 -4.06 -0.09 0.00 -1.46 0.00 0.00 37.83 32.11 1p1d s LYS 176 CO 0.02 -1.32 1.27 -0.51 0.16 0.00 0.00 175.35 174.98 1p1d s LEU 177 N 3.25 4.43 0.01 5.43 1.43 0.92 -0.39 118.68 133.77 1p1d s LEU 177 Ca 0.23 2.36 0.00 0.00 -1.03 0.00 0.00 54.13 55.69 1p1d s LEU 177 Cb -0.16 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1p1d s LEU 177 CO 0.16 -0.47 0.00 -0.11 0.23 0.00 0.00 176.35 176.16 1p1d n LEU 178 N 2.50 0.15 -4.28 1.79 0.00 0.13 -3.24 117.00 114.04 1p1d n LEU 178 Ca 0.05 0.02 -0.18 0.00 0.00 0.00 0.00 56.01 55.90 1p1d n LEU 178 Cb 0.43 -0.05 -0.11 0.00 0.00 0.00 0.00 43.42 43.70 1p1d n LEU 178 CO 0.57 -0.11 -0.45 0.00 0.00 0.00 0.00 177.39 177.40 1p1d s ALA 179 N -2.00 1.70 -0.22 1.96 0.00 -0.89 -0.72 121.76 121.59 1p1d s ALA 179 Ca 0.00 -1.43 -0.04 0.00 0.00 0.00 0.00 51.96 50.48 1p1d s ALA 179 Cb 0.00 -0.08 0.08 0.00 0.00 0.00 0.00 23.12 23.11 1p1d s ALA 179 CO 0.00 0.10 0.10 0.42 0.00 0.00 0.00 175.76 176.38 1p1d s ILE 180 N -2.44 -0.04 0.00 0.00 -1.09 0.16 -1.04 121.20 116.76 1p1d s ILE 180 Ca 0.14 -0.44 0.00 0.00 -2.23 0.00 0.00 60.65 58.12 1p1d s ILE 180 Cb -0.03 -0.77 0.00 0.00 -1.58 0.00 0.00 42.46 40.07 1p1d s ILE 180 CO 0.04 -0.46 0.00 0.47 -1.23 0.00 0.00 174.94 173.76 1p1d n ASP 181 N 5.25 0.00 0.00 3.58 9.92 0.85 -1.71 116.55 134.44 1p1d n ASP 181 Ca -0.07 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.19 1p1d n ASP 181 Cb 0.46 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.94 1p1d n ASP 181 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1p1d n ASN 182 N 1.63 0.00 -4.83 -2.24 4.13 -1.26 -4.73 115.26 107.95 1p1d n ASN 182 Ca 0.00 0.00 -0.38 0.00 1.68 0.00 0.00 54.58 55.88 1p1d n ASN 182 Cb 0.00 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1p1d s ILE 183 N -0.41 5.05 -0.24 2.41 -1.09 -0.70 -5.07 121.20 121.15 1p1d s ILE 183 Ca 0.00 0.82 -0.09 0.00 -2.23 0.00 0.00 60.65 59.15 1p1d s ILE 183 Cb 0.00 -3.70 -0.04 0.00 -1.58 0.00 0.00 42.46 37.13 1p1d s ILE 183 CO 0.00 0.57 0.12 -0.13 -1.23 0.00 0.00 174.94 174.27 1p1d s ARG 184 N -1.03 3.91 0.00 2.79 0.52 -1.26 0.40 118.95 124.28 1p1d s ARG 184 Ca 0.23 -0.35 0.23 0.00 -0.52 0.00 0.00 55.73 55.32 1p1d s ARG 184 Cb -0.16 -3.43 1.15 0.00 0.52 0.00 0.00 34.95 33.02 1p1d s ARG 184 CO 0.13 -0.01 1.73 1.28 0.02 0.00 0.00 175.30 178.45 1p1d n LEU 185 N 4.46 0.00 -0.35 2.53 7.99 0.10 -3.57 117.00 128.16 1p1d n LEU 185 Ca -0.15 0.28 0.37 0.00 -0.01 0.00 0.00 56.01 56.49 1p1d n LEU 185 Cb 0.52 -0.28 0.73 0.00 -0.11 0.00 0.00 43.42 44.28 1p1d n LEU 185 CO 0.34 -0.07 1.34 -0.78 -1.51 0.00 0.00 177.39 176.70 1p1d h ASP 186 N 0.00 0.00 -0.69 -1.43 1.82 -1.84 0.70 116.42 114.98 1p1d h ASP 186 Ca 0.00 0.00 -0.35 0.00 -0.39 0.00 0.00 57.03 56.29 1p1d h ASP 186 Cb 0.21 0.00 -0.41 0.00 0.68 0.00 0.00 39.33 39.81 1p1d h ASP 186 CO 0.00 0.00 -1.04 -1.20 -1.61 0.00 0.00 179.24 175.39 1p1d n SER 187 N -3.95 2.48 -3.80 2.28 7.64 -1.23 -4.18 113.62 112.86 1p1d n SER 187 Ca 0.27 -2.64 -0.11 0.00 1.01 0.00 0.00 58.87 57.40 1p1d n SER 187 Cb 1.39 -0.46 -0.08 0.00 -1.01 0.00 0.00 64.21 64.05 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p1d n SER 189 N 0.81 -2.08 0.04 0.00 2.88 -1.24 -4.37 113.62 109.66 1p1d n SER 189 Ca -0.20 -0.97 -0.10 0.00 -1.33 0.00 0.00 58.87 56.27 1p1d n SER 189 Cb 0.58 -0.77 -0.08 0.00 -0.75 0.00 0.00 64.21 63.20 1p1d n SER 189 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1p1d h MET 190 N 0.00 -0.18 -0.83 -1.46 4.05 -1.85 -3.24 114.93 111.43 1p1d h MET 190 Ca -0.31 0.01 0.24 0.00 -0.28 0.00 0.00 59.70 59.36 1p1d h MET 190 Cb 0.97 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.78 1p1d h MET 190 CO 0.20 0.27 0.60 0.93 0.23 0.00 0.00 176.91 179.15 1p1d h GLU 191 N -0.88 0.00 0.21 0.39 5.08 -1.99 -0.02 114.58 117.37 1p1d h GLU 191 Ca -0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1p1d h GLU 191 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1p1d h GLU 191 CO 0.03 0.00 -0.10 0.22 -1.00 0.00 0.00 179.01 178.16 1p1d h ASP 192 N 0.00 -0.24 -0.96 1.42 3.58 -1.93 0.69 116.42 118.99 1p1d h ASP 192 Ca 0.39 -0.02 0.07 0.00 0.42 0.00 0.00 57.03 57.89 1p1d h ASP 192 Cb 1.60 0.06 -0.07 0.00 1.72 0.00 0.00 39.33 42.65 1p1d h ASP 192 CO -0.00 -0.14 0.61 0.00 -2.88 0.00 0.00 179.24 176.83 1p1d h ALA 193 N 0.46 1.33 -0.81 -0.78 0.00 -1.05 -0.02 119.26 118.38 1p1d h ALA 193 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1p1d h ALA 193 Cb 0.25 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1p1d h ALA 193 CO 0.05 0.39 0.39 0.28 0.00 0.00 0.00 179.25 180.35 1p1d h VAL 194 N 1.11 1.25 -0.33 0.00 2.07 -1.05 0.53 116.25 119.83 1p1d h VAL 194 Ca 0.42 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 67.24 1p1d h VAL 194 Cb 0.18 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1p1d h VAL 194 CO -0.18 0.30 0.20 -0.61 0.02 0.00 0.00 177.57 177.31 1p1d h GLN 195 N 1.16 0.40 0.00 1.57 4.15 0.97 -0.43 115.11 122.92 1p1d h GLN 195 Ca 0.28 -0.02 -0.06 0.00 0.77 0.00 0.00 58.65 59.61 1p1d h GLN 195 Cb 0.12 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1p1d h GLN 195 CO -0.04 0.26 -0.30 0.82 -1.93 0.00 0.00 178.83 177.65 1p1d h ILE 196 N 0.41 0.68 -0.66 2.39 1.08 -0.80 0.38 117.51 120.98 1p1d h ILE 196 Ca 0.13 -1.34 0.03 0.00 -0.39 0.00 0.00 64.86 63.29 1p1d h ILE 196 Cb -0.01 1.88 -0.04 0.00 -3.07 0.00 0.00 36.82 35.58 1p1d h ILE 196 CO -0.06 0.29 0.44 0.25 -0.69 0.00 0.00 178.15 178.38 1p1d h LEU 197 N 0.00 0.68 0.00 1.44 5.85 0.17 -1.86 115.31 121.60 1p1d h LEU 197 Ca -0.00 -0.01 -0.34 0.00 0.84 0.00 0.00 57.88 58.37 1p1d h LEU 197 Cb 0.85 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.67 1p1d h LEU 197 CO 0.04 0.47 -2.21 0.00 -0.34 0.00 0.00 178.44 176.40 1p1d n GLN 198 N -4.46 0.50 0.10 1.25 10.64 -0.81 -4.45 117.38 120.15 1p1d n GLN 198 Ca 0.08 0.16 0.20 0.00 -1.83 0.00 0.00 57.00 55.61 1p1d n GLN 198 Cb 0.12 -1.36 0.75 0.00 -0.86 0.00 0.00 30.24 28.90 1p1d n GLN 198 CO 0.00 0.00 0.00 0.37 -1.83 0.00 0.00 177.06 175.60 1p1d h GLN 199 N -0.36 0.00 -1.58 2.61 -0.00 -0.30 0.19 115.11 115.67 1p1d h GLN 199 Ca -0.51 0.00 -0.58 0.00 -0.00 0.00 0.00 58.65 57.56 1p1d h GLN 199 Cb 1.62 0.00 -0.22 0.00 0.00 0.00 0.00 27.48 28.87 1p1d h GLN 199 CO -0.20 0.00 0.71 0.00 0.00 0.00 0.00 178.83 179.34 1p1d n GLU 201 N -0.13 1.13 0.00 0.00 2.13 0.68 -2.59 120.64 121.85 1p1d n GLU 201 Ca 0.50 -0.71 0.00 0.00 0.66 0.00 0.00 57.16 57.61 1p1d n GLU 201 Cb 0.52 -1.93 0.00 0.00 0.27 0.00 0.00 31.44 30.30 1p1d n GLU 201 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1p1d n ASP 202 N 3.31 0.00 0.00 4.31 9.92 -1.26 -4.25 116.55 128.58 1p1d n ASP 202 Ca 0.24 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.50 1p1d n ASP 202 Cb 0.30 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 1p1d n ASP 202 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1p1d n LEU 203 N -0.30 0.00 -4.63 0.64 0.00 -1.07 -1.94 117.00 109.70 1p1d n LEU 203 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 56.01 55.66 1p1d n LEU 203 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.32 1p1d n LEU 203 CO 0.00 0.00 -0.28 0.68 0.00 0.00 0.00 177.39 177.79 1p1d s VAL 204 N 0.00 4.55 -0.37 1.96 -7.23 -0.37 -4.86 120.40 114.08 1p1d s VAL 204 Ca 0.00 -0.13 -0.08 0.00 -1.81 0.00 0.00 61.98 59.96 1p1d s VAL 204 Cb 0.00 -3.01 0.05 0.00 0.56 0.00 0.00 36.38 33.99 1p1d s VAL 204 CO 0.00 0.51 0.18 -0.75 -0.31 0.00 0.00 175.10 174.72 1p1d s LYS 205 N 0.04 2.62 -0.58 4.82 2.20 -1.25 -1.48 119.74 126.11 1p1d s LYS 205 Ca 0.04 -1.28 -0.24 0.00 -0.36 0.00 0.00 55.97 54.13 1p1d s LYS 205 Cb -0.12 -3.61 0.05 0.00 -1.51 0.00 0.00 37.83 32.63 1p1d s LYS 205 CO 0.01 -0.78 0.97 -0.51 -0.36 0.00 0.00 175.35 174.68 1p1d s LEU 206 N 1.43 4.10 -0.75 5.43 1.02 -0.65 -0.10 118.68 129.16 1p1d s LEU 206 Ca 0.01 -0.48 -0.16 0.00 0.02 0.00 0.00 54.13 53.52 1p1d s LEU 206 Cb -0.21 -2.74 0.17 0.00 0.02 0.00 0.00 46.19 43.44 1p1d s LEU 206 CO 0.03 -1.31 0.77 -0.75 0.02 0.00 0.00 176.35 175.11 1p1d s LYS 207 N 4.08 3.39 0.43 1.70 2.20 -0.21 -0.62 119.74 130.71 1p1d s LYS 207 Ca 0.29 -2.00 0.05 0.00 -0.36 0.00 0.00 55.97 53.95 1p1d s LYS 207 Cb -0.13 -4.46 0.05 0.00 -1.51 0.00 0.00 37.83 31.78 1p1d s LYS 207 CO 0.17 -1.42 0.41 0.44 -0.36 0.00 0.00 175.35 174.59 1p1d n ILE 208 N 4.74 0.00 -3.61 5.43 -0.00 -0.38 0.17 119.36 125.71 1p1d n ILE 208 Ca 0.06 -1.64 -0.36 0.00 -0.00 0.00 0.00 62.75 60.81 1p1d n ILE 208 Cb 0.45 -0.28 -0.08 0.00 -0.00 0.00 0.00 39.64 39.73 1p1d n ILE 208 CO 0.00 0.00 0.00 -0.60 -0.00 0.00 0.00 176.55 175.95 1p1d s ARG 209 N -3.84 4.15 0.27 6.28 6.06 0.48 -1.89 118.95 130.45 1p1d s ARG 209 Ca 0.31 -0.12 0.11 0.00 -2.50 0.00 0.00 55.73 53.53 1p1d s ARG 209 Cb -0.02 -3.49 -0.05 0.00 0.06 0.00 0.00 34.95 31.45 1p1d s ARG 209 CO 0.20 0.14 -0.09 0.21 -2.50 0.00 0.00 175.30 173.26 1p1d s LYS 210 N 0.80 2.02 -0.84 5.12 2.47 -0.89 -4.29 119.74 124.13 1p1d s LYS 210 Ca 0.11 -1.55 -0.00 0.00 -1.56 0.00 0.00 55.97 52.97 1p1d s LYS 210 Cb -0.13 -2.00 -0.00 0.00 -1.46 0.00 0.00 37.83 34.24 1p1d s LYS 210 CO 0.03 0.36 0.70 -0.25 0.16 0.00 0.00 175.35 176.35 1p1d n ASP 211 N -0.71 -2.11 -4.42 1.43 9.92 -1.26 -1.42 116.55 117.99 1p1d n ASP 211 Ca -0.06 -0.44 -0.32 0.00 -0.53 0.00 0.00 54.79 53.44 1p1d n ASP 211 Cb 0.59 -3.76 0.17 0.00 -0.64 0.00 0.00 41.12 37.48 1p1d n ASP 211 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1p1d n GLU 212 N -3.19 -1.21 0.00 -1.24 1.02 -1.26 -4.85 120.64 109.91 1p1d n GLU 212 Ca -0.20 -0.32 0.04 0.00 -0.02 0.00 0.00 57.16 56.66 1p1d n GLU 212 Cb 0.62 -1.94 0.22 0.00 -0.02 0.00 0.00 31.44 30.32 1p1d n GLU 212 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06