#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 -0.55 -0.47 5.09 -7.23 -1.26 -5.11 120.40 110.87 1p1d s VAL 19 Ca 0.00 0.12 0.00 0.00 -1.81 0.00 0.00 61.98 60.29 1p1d s VAL 19 Cb 0.00 -0.64 0.12 0.00 0.56 0.00 0.00 36.38 36.42 1p1d s VAL 19 CO 0.00 0.02 0.24 -0.69 -0.31 0.00 0.00 175.10 174.36 1p1d s VAL 20 N 2.52 3.02 -0.27 1.32 1.01 -1.26 -4.83 120.40 121.91 1p1d s VAL 20 Ca 0.03 -2.60 -0.02 0.00 0.00 0.00 0.00 61.98 59.39 1p1d s VAL 20 Cb -0.13 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.21 1p1d s VAL 20 CO -0.12 -0.74 -0.02 -1.38 0.00 0.00 0.00 175.10 172.83 1p1d s HIS 21 N 0.50 3.14 0.31 5.22 -3.43 -1.26 -4.87 115.29 114.90 1p1d s HIS 21 Ca 0.13 -1.60 -0.28 0.00 -0.80 0.00 0.00 55.06 52.51 1p1d s HIS 21 Cb -0.22 -2.10 -0.13 0.00 -1.43 0.00 0.00 32.58 28.70 1p1d s HIS 21 CO -0.04 -0.74 1.11 0.25 -2.00 0.00 0.00 174.74 173.32 1p1d n THR 22 N 4.68 2.01 -4.18 -5.38 -2.24 -1.26 -4.17 114.28 103.73 1p1d n THR 22 Ca -0.15 -0.50 -0.11 0.00 -2.27 0.00 0.00 64.05 61.02 1p1d n THR 22 Cb 0.46 -1.20 -0.10 0.00 -2.10 0.00 0.00 70.33 67.39 1p1d n THR 22 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1p1d s GLU 23 N -1.68 0.86 -0.10 -0.78 2.02 0.04 -4.98 118.70 114.09 1p1d s GLU 23 Ca 0.57 -1.35 -0.01 0.00 0.02 0.00 0.00 54.97 54.21 1p1d s GLU 23 Cb -0.65 -0.26 -0.03 0.00 0.10 0.00 0.00 34.13 33.29 1p1d s GLU 23 CO 0.61 -0.01 -0.06 0.95 0.02 0.00 0.00 175.26 176.77 1p1d s THR 24 N -3.58 3.76 0.27 3.63 -4.23 -1.26 -1.96 115.64 112.26 1p1d s THR 24 Ca 0.12 -0.44 0.02 0.00 -1.18 0.00 0.00 61.69 60.22 1p1d s THR 24 Cb 0.05 -2.58 -0.05 0.00 1.34 0.00 0.00 72.50 71.26 1p1d s THR 24 CO -0.04 0.56 0.08 -0.89 -0.54 0.00 0.00 174.62 173.79 1p1d s THR 25 N -0.38 0.76 0.25 3.99 2.01 -0.05 -4.96 115.64 117.26 1p1d s THR 25 Ca 0.06 -2.00 0.06 0.00 0.31 0.00 0.00 61.69 60.11 1p1d s THR 25 Cb -0.12 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 1p1d s THR 25 CO 0.02 -0.03 0.33 -1.83 -0.69 0.00 0.00 174.62 172.42 1p1d s GLU 26 N -3.98 3.26 -0.02 4.92 1.03 -1.26 -0.83 118.70 121.82 1p1d s GLU 26 Ca 0.37 -0.87 -0.11 0.00 0.03 0.00 0.00 54.97 54.39 1p1d s GLU 26 Cb 0.08 -2.79 0.01 0.00 -0.80 0.00 0.00 34.13 30.64 1p1d s GLU 26 CO 0.14 0.38 0.23 0.08 -1.33 0.00 0.00 175.26 174.76 1p1d s VAL 27 N -2.05 0.06 -0.23 1.83 1.01 0.85 -4.82 120.40 117.04 1p1d s VAL 27 Ca 0.35 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1p1d s VAL 27 Cb -0.09 -0.50 0.06 0.00 0.00 0.00 0.00 36.38 35.85 1p1d s VAL 27 CO 0.28 -0.26 -0.04 -0.69 0.00 0.00 0.00 175.10 174.39 1p1d s VAL 28 N -1.09 1.36 -0.24 2.92 1.01 -1.26 -2.06 120.40 121.04 1p1d s VAL 28 Ca -0.12 -1.11 -0.07 0.00 0.00 0.00 0.00 61.98 60.68 1p1d s VAL 28 Cb -0.06 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 1p1d s VAL 28 CO 0.03 -0.12 0.05 -0.76 0.00 0.00 0.00 175.10 174.30 1p1d s LEU 29 N 1.47 3.38 0.27 3.92 1.43 0.82 -4.81 118.68 125.16 1p1d s LEU 29 Ca -0.05 -0.22 0.10 0.00 -1.03 0.00 0.00 54.13 52.93 1p1d s LEU 29 Cb -0.19 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1p1d s LEU 29 CO -0.06 -0.02 -0.00 0.42 0.23 0.00 0.00 176.35 176.91 1p1d s THR 30 N 1.52 3.36 -0.07 5.49 -4.23 -1.26 0.13 115.64 120.58 1p1d s THR 30 Ca 0.06 -1.92 -0.19 0.00 -1.18 0.00 0.00 61.69 58.46 1p1d s THR 30 Cb -0.15 -2.83 -0.05 0.00 1.34 0.00 0.00 72.50 70.81 1p1d s THR 30 CO 0.03 -0.36 0.54 0.00 -0.54 0.00 0.00 174.62 174.28 1p1d s ALA 31 N -2.34 3.47 0.05 3.99 0.00 -0.94 -3.77 121.76 122.22 1p1d s ALA 31 Ca 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1p1d s ALA 31 Cb -0.06 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 1p1d s ALA 31 CO 0.20 0.06 0.16 0.34 0.00 0.00 0.00 175.76 176.52 1p1d s ASP 32 N 0.31 6.08 -0.00 0.00 2.15 -1.26 -4.80 116.67 119.14 1p1d s ASP 32 Ca 0.29 0.20 0.01 0.00 0.43 0.00 0.00 52.55 53.47 1p1d s ASP 32 Cb -0.16 -1.81 0.02 0.00 -0.30 0.00 0.00 42.92 40.67 1p1d s ASP 32 CO 0.13 0.20 0.80 -0.81 -0.17 0.00 0.00 175.17 175.32 1p1d n PRO 33 N 0.53 1.09 -0.01 4.34 -0.04 -1.26 -1.68 135.00 137.97 1p1d n PRO 33 Ca -0.08 -0.10 -0.01 0.00 -0.04 0.00 0.00 63.50 63.27 1p1d n PRO 33 Cb 0.52 -1.25 -0.01 0.00 -0.04 0.00 0.00 33.50 32.72 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 -0.22 0.08 0.00 0.52 0.31 -1.26 -4.93 118.33 112.83 1p1d n VAL 34 Ca 0.01 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1p1d n VAL 34 Cb 0.14 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 1p1d n VAL 34 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1p1d n THR 35 N -3.01 0.00 -2.11 2.52 -2.24 -1.25 -5.09 114.28 103.11 1p1d n THR 35 Ca -0.03 -0.08 -0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1p1d n THR 35 Cb 0.52 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1p1d n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p1d n GLY 36 N 1.19 -0.81 3.28 3.38 0.00 -0.68 -3.92 105.19 107.64 1p1d n GLY 36 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1p1d n GLY 36 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1p1d n PHE 37 N -0.90 0.00 -1.29 1.61 3.01 -1.25 -4.43 117.46 114.22 1p1d n PHE 37 Ca 0.02 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.38 1p1d n PHE 37 Cb 0.36 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.78 1p1d n PHE 37 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1p1d n GLY 38 N -0.82 0.97 3.05 1.37 0.00 -1.25 -3.57 105.19 104.94 1p1d n GLY 38 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.85 0.68 -0.17 -0.61 -5.25 -1.26 -0.28 121.20 112.45 1p1d s ILE 39 Ca 0.00 -0.70 -0.05 0.00 -0.99 0.00 0.00 60.65 58.90 1p1d s ILE 39 Cb 0.00 -0.64 -0.03 0.00 2.95 0.00 0.00 42.46 44.74 1p1d s ILE 39 CO 0.00 -0.05 0.01 -1.10 -1.79 0.00 0.00 174.94 172.01 1p1d s GLN 40 N -0.83 3.78 -0.33 0.37 -0.21 -1.05 -5.02 119.66 116.37 1p1d s GLN 40 Ca -0.01 -0.45 -0.16 0.00 0.02 0.00 0.00 55.36 54.76 1p1d s GLN 40 Cb -0.06 -3.06 -0.01 0.00 1.00 0.00 0.00 33.01 30.87 1p1d s GLN 40 CO 0.00 0.21 0.41 -0.51 -2.12 0.00 0.00 175.29 173.29 1p1d s LEU 41 N 0.48 4.34 0.70 2.90 1.43 -1.26 -0.91 118.68 126.36 1p1d s LEU 41 Ca -0.00 -0.08 -0.13 0.00 -1.03 0.00 0.00 54.13 52.89 1p1d s LEU 41 Cb -0.14 -2.43 0.02 0.00 0.03 0.00 0.00 46.19 43.67 1p1d s LEU 41 CO 0.02 -0.36 1.10 -1.58 0.23 0.00 0.00 176.35 175.76 1p1d s GLN 42 N 2.15 2.60 -0.40 1.70 0.74 0.23 -4.83 119.66 121.84 1p1d s GLN 42 Ca 0.15 1.28 -0.09 0.00 0.05 0.00 0.00 55.36 56.74 1p1d s GLN 42 Cb -0.16 -1.93 0.06 0.00 1.10 0.00 0.00 33.01 32.08 1p1d s GLN 42 CO 0.12 -1.39 0.23 0.20 -0.55 0.00 0.00 175.29 173.90 1p1d s GLY 43 N -2.97 1.95 0.02 2.59 0.00 -1.26 -2.44 107.32 105.20 1p1d s GLY 43 Ca 0.64 -2.03 0.00 0.00 0.00 0.00 0.00 44.72 43.33 1p1d s GLY 43 CO 0.48 0.93 0.00 -1.14 0.00 0.00 0.00 173.10 173.36 1p1d n SER 44 N 4.92 -3.88 0.00 1.64 3.41 -1.26 -5.00 113.62 113.45 1p1d n SER 44 Ca -0.11 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1p1d n SER 44 Cb 0.44 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1p1d n VAL 45 N -1.38 0.00 -0.22 -3.33 0.31 -1.26 -4.88 118.33 107.57 1p1d n VAL 45 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1p1d n VAL 45 Cb 0.03 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.00 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 -0.66 -6.26 3.52 -0.00 -1.97 -3.46 116.94 108.10 1p1d h PHE 46 Ca 0.00 0.07 -0.31 0.00 -0.00 0.00 0.00 57.97 57.73 1p1d h PHE 46 Cb 0.00 0.39 0.01 0.00 -0.00 0.00 0.00 35.95 36.35 1p1d h PHE 46 CO 0.00 -0.34 -1.00 0.00 -0.00 0.00 0.00 178.31 176.97 1p1d n ALA 47 N -3.16 -2.52 -3.28 12.09 0.00 -1.26 -5.00 120.51 117.38 1p1d n ALA 47 Ca 0.07 0.43 -0.07 0.00 0.00 0.00 0.00 53.44 53.87 1p1d n ALA 47 Cb 0.36 -2.37 -0.05 0.00 0.00 0.00 0.00 19.45 17.40 1p1d n ALA 47 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1p1d s THR 48 N -1.96 -0.69 0.14 0.00 -4.23 -1.26 -4.99 115.64 102.65 1p1d s THR 48 Ca 0.29 -0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 1p1d s THR 48 Cb -0.04 -0.78 0.00 0.00 1.34 0.00 0.00 72.50 73.02 1p1d s THR 48 CO 0.85 -0.26 0.00 -1.84 -0.54 0.00 0.00 174.62 172.83 1p1d n GLU 49 N 5.01 -4.26 0.00 3.99 0.28 -1.26 -4.30 120.64 120.11 1p1d n GLU 49 Ca 0.05 3.01 0.00 0.00 -0.16 0.00 0.00 57.16 60.05 1p1d n GLU 49 Cb 0.50 -3.44 0.00 0.00 1.43 0.00 0.00 31.44 29.93 1p1d n GLU 49 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1p1d n THR 50 N 1.87 0.00 0.00 3.84 -1.04 -1.26 -4.92 114.28 112.77 1p1d n THR 50 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1p1d n THR 50 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1p1d n THR 50 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1p1d n LEU 51 N 0.00 0.00 0.00 -4.42 -0.00 -1.26 -4.84 117.00 106.48 1p1d n LEU 51 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1p1d n LEU 51 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1p1d n LEU 51 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 177.39 177.15 1p1d n SER 52 N 0.68 0.00 -4.60 1.45 2.88 -1.26 -4.90 113.62 107.87 1p1d n SER 52 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1p1d n SER 52 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1p1d n SER 52 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1p1d s SER 53 N -2.16 6.43 0.64 -3.46 1.04 -1.26 -4.99 113.70 109.94 1p1d s SER 53 Ca 0.00 0.72 -0.11 0.00 0.48 0.00 0.00 55.95 57.04 1p1d s SER 53 Cb 0.00 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 1p1d s SER 53 CO 0.00 -1.38 1.04 -2.16 0.98 0.00 0.00 173.24 171.72 1p1d s PRO 54 N 4.79 3.40 0.54 4.02 0.04 -1.26 -4.09 135.00 142.44 1p1d s PRO 54 Ca 0.57 0.77 -0.20 0.00 0.04 0.00 0.00 61.00 62.18 1p1d s PRO 54 Cb -0.12 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.30 1p1d s PRO 54 CO 0.32 -0.72 0.90 -0.35 0.04 0.00 0.00 177.00 177.19 1p1d n PRO 55 N -2.85 0.97 -3.66 0.56 -0.04 -1.26 -4.16 135.00 124.57 1p1d n PRO 55 Ca 0.06 0.37 -0.06 0.00 -0.04 0.00 0.00 63.50 63.83 1p1d n PRO 55 Cb 0.54 -2.05 -0.07 0.00 -0.04 0.00 0.00 33.50 31.88 1p1d n PRO 55 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1p1d s LEU 56 N -1.08 -0.82 0.22 1.53 0.05 -1.02 -4.24 118.68 113.32 1p1d s LEU 56 Ca 0.71 1.32 -0.32 0.00 0.05 0.00 0.00 54.13 55.89 1p1d s LEU 56 Cb -0.46 1.95 -0.12 0.00 -2.05 0.00 0.00 46.19 45.52 1p1d s LEU 56 CO 0.51 -0.22 1.69 -0.63 -0.55 0.00 0.00 176.35 177.15 1p1d s ILE 57 N 2.30 2.10 -0.95 1.48 1.01 -1.26 0.74 121.20 126.62 1p1d s ILE 57 Ca -0.06 0.07 0.12 0.00 0.00 0.00 0.00 60.65 60.78 1p1d s ILE 57 Cb -0.10 -3.05 0.35 0.00 0.01 0.00 0.00 42.46 39.67 1p1d s ILE 57 CO -0.17 0.01 1.29 -0.24 0.00 0.00 0.00 174.94 175.83 1p1d n SER 58 N 3.71 3.08 -3.64 3.58 2.88 -0.09 0.11 113.62 123.25 1p1d n SER 58 Ca 0.14 -2.07 -0.06 0.00 -1.33 0.00 0.00 58.87 55.56 1p1d n SER 58 Cb 0.36 -0.27 -0.07 0.00 -0.75 0.00 0.00 64.21 63.48 1p1d n SER 58 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1p1d s TYR 59 N -1.12 -0.61 0.01 0.66 5.04 -1.25 -4.97 117.35 115.10 1p1d s TYR 59 Ca 0.26 1.31 0.08 0.00 -2.44 0.00 0.00 57.07 56.29 1p1d s TYR 59 Cb 0.15 0.39 -0.02 0.00 0.35 0.00 0.00 41.96 42.82 1p1d s TYR 59 CO 0.17 -0.30 -0.25 0.42 -1.34 0.00 0.00 175.55 174.25 1p1d s ILE 60 N 0.93 1.98 0.24 3.14 -1.09 -1.26 -2.54 121.20 122.60 1p1d s ILE 60 Ca -0.04 -1.18 -0.02 0.00 -2.23 0.00 0.00 60.65 57.18 1p1d s ILE 60 Cb -0.04 -1.67 -0.04 0.00 -1.58 0.00 0.00 42.46 39.12 1p1d s ILE 60 CO -0.12 0.46 0.45 -0.70 -1.23 0.00 0.00 174.94 173.80 1p1d s GLU 61 N -0.86 3.55 -0.55 2.79 -6.30 0.61 -4.98 118.70 112.96 1p1d s GLU 61 Ca 0.10 -0.23 -0.02 0.00 -2.50 0.00 0.00 54.97 52.31 1p1d s GLU 61 Cb -0.10 -2.77 0.26 0.00 0.00 0.00 0.00 34.13 31.53 1p1d s GLU 61 CO 0.00 0.32 2.24 0.00 0.02 0.00 0.00 175.26 177.84 1p1d n ALA 62 N -0.84 6.09 0.00 6.30 0.00 -1.26 -4.12 120.51 126.68 1p1d n ALA 62 Ca -0.04 -3.00 0.00 0.00 0.00 0.00 0.00 53.44 50.40 1p1d n ALA 62 Cb 0.54 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 -0.01 0.00 -3.92 0.00 2.03 -1.26 -5.16 116.55 108.23 1p1d n ASP 63 Ca 0.48 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.66 1p1d n ASP 63 Cb 0.52 0.00 -0.14 0.00 -0.72 0.00 0.00 41.12 40.78 1p1d n ASP 63 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1p1d s SER 64 N 0.00 0.35 0.14 1.67 0.01 -1.26 -4.82 113.70 109.79 1p1d s SER 64 Ca 0.00 -0.07 0.08 0.00 1.31 0.00 0.00 55.95 57.27 1p1d s SER 64 Cb 0.00 -0.03 0.44 0.00 0.21 0.00 0.00 66.02 66.63 1p1d s SER 64 CO 0.00 0.02 1.18 -2.65 0.41 0.00 0.00 173.24 172.20 1p1d n PRO 65 N 2.94 0.05 0.27 12.44 -0.02 -1.26 -1.53 135.00 147.88 1p1d n PRO 65 Ca -0.13 0.50 -0.14 0.00 -2.02 0.00 0.00 63.50 61.72 1p1d n PRO 65 Cb 0.59 -1.77 -0.07 0.00 -0.02 0.00 0.00 33.50 32.22 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 1.67 -0.72 0.00 3.55 0.00 -1.80 0.17 119.26 122.14 1p1d h ALA 66 Ca 0.00 -0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.51 1p1d h ALA 66 Cb 0.20 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1p1d h ALA 66 CO 0.00 -0.73 -0.97 1.49 0.00 0.00 0.00 179.25 179.03 1p1d h GLU 67 N -1.05 0.01 0.00 0.00 4.57 -1.73 -3.12 114.58 113.26 1p1d h GLU 67 Ca -0.07 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1p1d h GLU 67 Cb 0.62 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 1p1d h GLU 67 CO 0.12 0.97 0.00 0.00 -1.18 0.00 0.00 179.01 178.92 1p1d h ARG 68 N 0.00 0.00 -0.57 1.92 -0.00 -1.33 -3.23 114.38 111.18 1p1d h ARG 68 Ca -0.01 0.00 0.11 0.00 -0.50 0.00 0.00 59.98 59.58 1p1d h ARG 68 Cb 1.71 0.00 -0.11 0.00 0.00 0.00 0.00 29.97 31.57 1p1d h ARG 68 CO 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 179.97 179.93 1p1d n GLY 70 N -1.41 0.62 2.69 0.00 0.00 -1.22 -4.72 105.19 101.14 1p1d n GLY 70 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 1p1d n GLY 70 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p1d n VAL 71 N 0.00 0.40 -4.18 1.61 0.24 -1.26 -4.42 118.33 110.72 1p1d n VAL 71 Ca 0.00 -2.04 -0.16 0.00 -2.04 0.00 0.00 64.34 60.10 1p1d n VAL 71 Cb 0.00 0.91 -0.14 0.00 -1.47 0.00 0.00 33.84 33.15 1p1d n VAL 71 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1p1d s LEU 72 N -3.31 2.07 0.00 1.34 1.43 -1.26 -5.01 118.68 113.93 1p1d s LEU 72 Ca 0.23 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1p1d s LEU 72 Cb 0.42 -0.29 -0.01 0.00 0.03 0.00 0.00 46.19 46.33 1p1d s LEU 72 CO -0.05 0.01 0.18 0.00 0.23 0.00 0.00 176.35 176.72 1p1d n GLN 73 N 2.57 0.26 -0.96 1.70 3.00 -1.26 -4.79 117.38 117.91 1p1d n GLN 73 Ca -0.15 -1.82 -0.36 0.00 -0.01 0.00 0.00 57.00 54.65 1p1d n GLN 73 Cb 0.57 1.54 -0.05 0.00 0.00 0.00 0.00 30.24 32.30 1p1d n GLN 73 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1p1d n ILE 74 N -0.35 1.78 0.00 5.09 2.08 -1.26 -3.70 119.36 123.00 1p1d n ILE 74 Ca 0.04 -1.39 0.00 0.00 0.56 0.00 0.00 62.75 61.96 1p1d n ILE 74 Cb 0.34 -2.22 0.00 0.00 -0.75 0.00 0.00 39.64 37.01 1p1d n ILE 74 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1p1d n GLY 75 N 4.35 0.51 3.49 7.39 0.00 0.31 -4.70 105.19 116.54 1p1d n GLY 75 Ca 0.46 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1p1d n GLY 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1p1d s ASP 76 N 0.00 6.18 0.41 1.61 -1.08 -1.24 -4.69 116.67 117.86 1p1d s ASP 76 Ca 0.00 -0.60 -0.25 0.00 -0.52 0.00 0.00 52.55 51.18 1p1d s ASP 76 Cb 0.00 -2.21 -0.08 0.00 -1.46 0.00 0.00 42.92 39.17 1p1d s ASP 76 CO 0.00 -0.52 1.21 -0.13 0.52 0.00 0.00 175.17 176.26 1p1d s ARG 77 N 2.07 3.96 -0.05 4.34 3.00 -1.26 -4.48 118.95 126.53 1p1d s ARG 77 Ca 0.11 1.93 0.04 0.00 0.00 0.00 0.00 55.73 57.81 1p1d s ARG 77 Cb -0.17 -2.65 0.00 0.00 0.00 0.00 0.00 34.95 32.13 1p1d s ARG 77 CO 0.13 -0.42 -0.16 0.14 0.00 0.00 0.00 175.30 174.98 1p1d s VAL 78 N -1.38 1.37 -0.12 3.52 -7.23 -1.26 -4.16 120.40 111.13 1p1d s VAL 78 Ca 0.58 -0.66 0.19 0.00 -1.81 0.00 0.00 61.98 60.29 1p1d s VAL 78 Cb -0.33 -1.19 -0.24 0.00 0.56 0.00 0.00 36.38 35.18 1p1d s VAL 78 CO 0.41 0.40 0.44 0.80 -0.31 0.00 0.00 175.10 176.84 1p1d n MET 79 N 3.35 0.66 -3.69 4.82 1.56 -0.53 -4.77 117.12 118.52 1p1d n MET 79 Ca -0.19 -0.01 -0.11 0.00 -0.27 0.00 0.00 57.70 57.11 1p1d n MET 79 Cb 0.53 -1.60 -0.09 0.00 2.15 0.00 0.00 33.22 34.20 1p1d n MET 79 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1p1d s ALA 80 N -3.00 -1.29 -0.21 -5.12 0.00 -1.26 -3.21 121.76 107.67 1p1d s ALA 80 Ca -0.07 1.67 0.01 0.00 0.00 0.00 0.00 51.96 53.57 1p1d s ALA 80 Cb 0.10 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 22.27 1p1d s ALA 80 CO 0.85 -0.28 -0.12 0.42 0.00 0.00 0.00 175.76 176.63 1p1d s ILE 81 N 1.04 1.83 -1.34 0.00 1.01 0.79 -2.28 121.20 122.25 1p1d s ILE 81 Ca -0.06 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 59.47 1p1d s ILE 81 Cb -0.06 -1.86 0.00 0.00 0.01 0.00 0.00 42.46 40.55 1p1d s ILE 81 CO -0.09 0.21 0.00 0.59 0.00 0.00 0.00 174.94 175.65 1p1d n ASN 82 N 4.62 -3.85 0.00 3.58 4.13 0.28 -0.05 115.26 123.97 1p1d n ASN 82 Ca -0.16 0.27 0.00 0.00 1.68 0.00 0.00 54.58 56.37 1p1d n ASN 82 Cb 0.46 -3.44 0.00 0.00 -1.54 0.00 0.00 39.78 35.26 1p1d n ASN 82 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1p1d n GLY 83 N -0.49 2.32 3.72 7.41 0.00 -1.26 -5.06 105.19 111.83 1p1d n GLY 83 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.38 3.46 0.00 -0.61 1.01 0.93 -5.02 121.20 118.60 1p1d s ILE 84 Ca 0.00 1.08 0.00 0.00 0.00 0.00 0.00 60.65 61.73 1p1d s ILE 84 Cb 0.00 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.78 1p1d s ILE 84 CO 0.00 0.10 0.00 -2.65 0.00 0.00 0.00 174.94 172.39 1p1d n PRO 85 N 3.63 1.39 0.05 2.79 -0.02 -1.26 -0.15 135.00 141.43 1p1d n PRO 85 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1p1d n PRO 85 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.91 1p1d n PRO 85 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1p1d n THR 86 N -0.72 0.00 0.46 3.45 -2.24 -1.20 -4.28 114.28 109.75 1p1d n THR 86 Ca 0.00 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 1p1d n THR 86 Cb 0.00 -0.01 0.37 0.00 -2.10 0.00 0.00 70.33 68.60 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 -2.71 0.07 -1.46 -0.78 1.02 -1.26 -2.91 120.64 112.61 1p1d n GLU 87 Ca 0.00 0.31 -0.36 0.00 -0.02 0.00 0.00 57.16 57.09 1p1d n GLU 87 Cb 0.00 -1.63 0.07 0.00 -0.02 0.00 0.00 31.44 29.86 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 -1.76 7.67 0.00 1.62 -0.08 -1.26 -4.94 116.55 117.80 1p1d n ASP 88 Ca 0.03 -3.80 0.00 0.00 -1.51 0.00 0.00 54.79 49.51 1p1d n ASP 88 Cb 0.19 -1.00 0.00 0.00 2.34 0.00 0.00 41.12 42.65 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 -0.84 0.00 -4.67 1.67 2.88 -1.14 -5.01 113.62 106.51 1p1d n SER 89 Ca 0.61 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.73 1p1d n SER 89 Cb 0.57 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.00 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 -2.00 3.81 0.56 2.46 2.01 -1.26 -4.87 115.64 116.35 1p1d s THR 90 Ca 0.00 1.06 0.32 0.00 0.31 0.00 0.00 61.69 63.38 1p1d s THR 90 Cb 0.00 -3.68 0.47 0.00 0.01 0.00 0.00 72.50 69.30 1p1d s THR 90 CO 0.00 -0.07 1.82 2.19 -0.69 0.00 0.00 174.62 177.87 1p1d h PHE 91 N 8.63 0.00 -0.85 4.92 -0.00 -1.85 0.11 116.94 127.90 1p1d h PHE 91 Ca -0.35 0.00 0.13 0.00 -0.00 0.00 0.00 57.97 57.75 1p1d h PHE 91 Cb 1.16 0.00 -0.06 0.00 -0.00 0.00 0.00 35.95 37.04 1p1d h PHE 91 CO 0.82 0.00 0.55 0.93 -0.00 0.00 0.00 178.31 180.61 1p1d h GLU 92 N 0.00 0.65 -0.80 6.09 5.08 -1.94 -0.62 114.58 123.04 1p1d h GLU 92 Ca 0.41 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.72 1p1d h GLU 92 Cb 1.83 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.89 1p1d h GLU 92 CO -0.00 0.43 0.43 1.05 -1.00 0.00 0.00 179.01 179.92 1p1d h GLU 93 N 0.67 1.12 -0.61 2.33 -0.00 -1.16 -1.44 114.58 115.49 1p1d h GLU 93 Ca 0.41 -0.13 -0.04 0.00 -0.00 0.00 0.00 59.36 59.60 1p1d h GLU 93 Cb 0.65 -0.22 -0.03 0.00 -0.00 0.00 0.00 28.75 29.16 1p1d h GLU 93 CO -0.17 0.83 0.22 0.00 -0.00 0.00 0.00 179.01 179.88 1p1d h ALA 94 N 1.23 1.23 -0.80 1.06 0.00 -1.25 -1.90 119.26 118.83 1p1d h ALA 94 Ca 0.28 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1p1d h ALA 94 Cb 0.04 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1p1d h ALA 94 CO -0.04 0.55 0.43 -0.91 0.00 0.00 0.00 179.25 179.27 1p1d h ASN 95 N 0.89 1.01 0.57 0.00 -0.26 -0.78 -1.77 115.58 115.23 1p1d h ASN 95 Ca 0.21 -0.11 -0.03 0.00 -0.56 0.00 0.00 56.30 55.81 1p1d h ASN 95 Cb 0.21 -0.26 0.01 0.00 -1.06 0.00 0.00 38.32 37.22 1p1d h ASN 95 CO -0.01 0.83 -0.27 1.56 -1.06 0.00 0.00 177.43 178.47 1p1d h GLN 96 N 1.12 -0.73 -0.63 0.81 1.08 -0.57 0.15 115.11 116.33 1p1d h GLN 96 Ca 0.28 0.05 0.18 0.00 -1.45 0.00 0.00 58.65 57.71 1p1d h GLN 96 Cb 0.05 0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 27.62 1p1d h GLN 96 CO -0.04 -0.44 0.45 1.37 -0.95 0.00 0.00 178.83 179.22 1p1d h LEU 97 N -0.90 0.01 0.00 1.46 8.10 -1.28 -0.78 115.31 121.92 1p1d h LEU 97 Ca -0.08 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.86 1p1d h LEU 97 Cb 0.63 -0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.86 1p1d h LEU 97 CO 0.13 0.01 -0.21 -0.07 -4.11 0.00 0.00 178.44 174.19 1p1d h LEU 98 N 0.02 0.18 -1.89 0.17 3.38 -0.99 -0.30 115.31 115.87 1p1d h LEU 98 Ca 0.30 -0.80 0.28 0.00 0.09 0.00 0.00 57.88 57.75 1p1d h LEU 98 Cb 1.18 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.83 1p1d h LEU 98 CO -0.01 0.95 0.70 0.03 0.09 0.00 0.00 178.44 180.21 1p1d h ARG 99 N -0.58 0.07 -0.62 1.13 3.08 0.72 0.37 114.38 118.55 1p1d h ARG 99 Ca -0.03 -0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.57 1p1d h ARG 99 Cb 0.99 -0.02 -0.36 0.00 0.08 0.00 0.00 29.97 30.66 1p1d h ARG 99 CO 0.04 0.05 -0.78 -0.40 -1.07 0.00 0.00 179.97 177.81 1p1d n ASP 100 N -4.30 4.32 -1.91 7.04 5.68 -0.75 -4.78 116.55 121.85 1p1d n ASP 100 Ca 0.21 -3.73 -0.19 0.00 -0.50 0.00 0.00 54.79 50.59 1p1d n ASP 100 Cb 1.01 -0.37 0.09 0.00 -1.14 0.00 0.00 41.12 40.71 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1p1d n SER 101 N -0.77 4.90 -0.11 -1.12 7.64 0.13 -3.92 113.62 120.37 1p1d n SER 101 Ca 0.39 -3.16 0.01 0.00 1.01 0.00 0.00 58.87 57.12 1p1d n SER 101 Cb 0.92 -0.85 0.02 0.00 -1.01 0.00 0.00 64.21 63.29 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 -0.38 0.87 -0.06 6.43 3.41 -1.26 -4.44 113.62 118.19 1p1d n SER 102 Ca 0.40 -1.76 -0.13 0.00 -0.26 0.00 0.00 58.87 57.12 1p1d n SER 102 Cb 1.00 -0.10 -0.07 0.00 -0.26 0.00 0.00 64.21 64.78 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 2.57 1.34 -0.01 -1.33 2.04 -1.92 -3.05 117.51 117.14 1p1d h ILE 103 Ca 0.00 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.60 1p1d h ILE 103 Cb 0.94 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.85 1p1d h ILE 103 CO 0.00 0.37 -0.13 0.35 0.00 0.00 0.00 178.15 178.74 1p1d n THR 104 N -4.57 0.00 -2.00 -0.27 -2.24 -1.26 -4.93 114.28 99.01 1p1d n THR 104 Ca -0.06 -0.24 -0.18 0.00 -2.27 0.00 0.00 64.05 61.30 1p1d n THR 104 Cb 0.35 0.65 -0.04 0.00 -2.10 0.00 0.00 70.33 69.19 1p1d n THR 104 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1p1d n SER 105 N 0.02 -5.31 -3.55 3.42 3.41 -1.15 -4.94 113.62 105.52 1p1d n SER 105 Ca 0.15 0.19 -0.10 0.00 -0.26 0.00 0.00 58.87 58.85 1p1d n SER 105 Cb 0.39 -4.40 -0.04 0.00 -0.26 0.00 0.00 64.21 59.90 1p1d n SER 105 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1p1d s LYS 106 N -4.34 0.70 -0.20 4.33 2.47 -1.26 -2.20 119.74 119.25 1p1d s LYS 106 Ca 0.00 0.00 -0.17 0.00 -1.56 0.00 0.00 55.97 54.25 1p1d s LYS 106 Cb 0.00 0.33 0.06 0.00 -1.46 0.00 0.00 37.83 36.75 1p1d s LYS 106 CO 0.00 -0.25 0.53 0.08 0.16 0.00 0.00 175.35 175.86 1p1d s VAL 107 N -1.80 -0.00 -0.17 4.02 1.01 0.34 -4.87 120.40 118.93 1p1d s VAL 107 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1p1d s VAL 107 Cb -0.01 -0.74 -0.00 0.00 0.00 0.00 0.00 36.38 35.63 1p1d s VAL 107 CO -0.01 0.01 -0.12 -0.89 0.00 0.00 0.00 175.10 174.08 1p1d s THR 108 N 0.58 2.86 0.03 3.92 2.01 -1.26 -0.13 115.64 123.65 1p1d s THR 108 Ca -0.02 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.27 1p1d s THR 108 Cb -0.05 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 1p1d s THR 108 CO -0.03 0.49 -0.01 -1.48 -0.69 0.00 0.00 174.62 172.90 1p1d s LEU 109 N 1.02 2.26 -0.12 4.42 0.05 -0.87 -0.56 118.68 124.88 1p1d s LEU 109 Ca -0.01 -0.66 -0.05 0.00 0.05 0.00 0.00 54.13 53.46 1p1d s LEU 109 Cb -0.15 0.20 -0.04 0.00 -2.05 0.00 0.00 46.19 44.15 1p1d s LEU 109 CO -0.02 -0.42 0.05 -1.83 -0.55 0.00 0.00 176.35 173.58 1p1d s GLU 110 N -2.38 3.38 0.01 1.48 -1.05 -0.97 -0.11 118.70 119.06 1p1d s GLU 110 Ca -0.07 -0.32 0.07 0.00 -0.15 0.00 0.00 54.97 54.50 1p1d s GLU 110 Cb -0.03 -3.01 -0.03 0.00 -0.44 0.00 0.00 34.13 30.62 1p1d s GLU 110 CO -0.04 0.60 -0.20 0.96 0.95 0.00 0.00 175.26 177.53 1p1d s ILE 111 N -0.58 2.59 -0.23 1.83 -4.36 -0.01 -1.45 121.20 119.00 1p1d s ILE 111 Ca 0.11 -1.10 -0.03 0.00 -0.26 0.00 0.00 60.65 59.37 1p1d s ILE 111 Cb -0.12 -2.03 0.00 0.00 1.25 0.00 0.00 42.46 41.57 1p1d s ILE 111 CO 0.02 0.45 -0.05 -0.70 0.24 0.00 0.00 174.94 174.90 1p1d s GLU 112 N -1.07 3.21 0.29 0.37 2.12 -1.26 -0.87 118.70 121.48 1p1d s GLU 112 Ca 0.12 -0.73 0.03 0.00 0.36 0.00 0.00 54.97 54.75 1p1d s GLU 112 Cb -0.10 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.25 1p1d s GLU 112 CO 0.02 -0.26 0.17 -0.59 -0.54 0.00 0.00 175.26 174.06 1p1d s PHE 113 N 1.43 1.55 0.16 5.30 -0.12 -0.83 -4.90 117.98 120.58 1p1d s PHE 113 Ca 0.04 -1.40 0.04 0.00 -0.05 0.00 0.00 56.93 55.56 1p1d s PHE 113 Cb -0.15 -0.80 -0.04 0.00 -0.63 0.00 0.00 43.02 41.41 1p1d s PHE 113 CO -0.04 -0.57 0.23 0.16 -0.05 0.00 0.00 175.22 174.95 1p1d s ASP 114 N -3.34 6.02 -0.47 1.98 1.47 -1.26 -0.78 116.67 120.29 1p1d s ASP 114 Ca 0.37 0.05 -0.16 0.00 1.18 0.00 0.00 52.55 53.99 1p1d s ASP 114 Cb 0.05 -1.73 0.06 0.00 -0.34 0.00 0.00 42.92 40.97 1p1d s ASP 114 CO 0.18 0.05 0.42 0.68 0.68 0.00 0.00 175.17 177.18 1p1d s VAL 115 N -1.76 5.18 0.00 2.11 -7.23 -1.26 -4.91 120.40 112.54 1p1d s VAL 115 Ca 0.33 -0.93 0.00 0.00 -1.81 0.00 0.00 61.98 59.57 1p1d s VAL 115 Cb -0.11 -4.13 0.00 0.00 0.56 0.00 0.00 36.38 32.71 1p1d s VAL 115 CO 0.27 -0.58 0.00 0.00 -0.31 0.00 0.00 175.10 174.48 1p1d n ALA 116 N 5.34 0.00 -1.31 1.32 0.00 -0.28 -4.44 120.51 121.14 1p1d n ALA 116 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1p1d n ALA 116 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.06 0.00 -1.13 0.00 4.71 -1.26 -4.73 120.64 118.17 1p1d n GLU 117 Ca 0.00 -0.63 0.00 0.00 -0.01 0.00 0.00 57.16 56.52 1p1d n GLU 117 Cb 0.00 -0.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.94 1p1d n GLU 117 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1p1d n SER 118 N 0.00 -1.51 -4.63 1.62 2.88 -1.26 -4.39 113.62 106.33 1p1d n SER 118 Ca 0.00 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.22 1p1d n SER 118 Cb 0.56 -0.76 -0.10 0.00 -0.75 0.00 0.00 64.21 63.16 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 -0.13 3.78 -0.42 2.46 -7.23 -1.26 -1.96 120.40 115.64 1p1d s VAL 119 Ca 0.00 -0.84 0.02 0.00 -1.81 0.00 0.00 61.98 59.35 1p1d s VAL 119 Cb 0.00 -2.69 0.13 0.00 0.56 0.00 0.00 36.38 34.38 1p1d s VAL 119 CO 0.00 0.31 0.22 0.27 -0.31 0.00 0.00 175.10 175.59 1p1d s ILE 120 N -1.09 1.28 0.29 -0.62 -5.25 0.37 -4.96 121.20 111.22 1p1d s ILE 120 Ca 0.20 -2.39 -0.01 0.00 -0.99 0.00 0.00 60.65 57.46 1p1d s ILE 120 Cb -0.11 -1.91 0.06 0.00 2.95 0.00 0.00 42.46 43.45 1p1d s ILE 120 CO 0.11 -0.88 0.40 -0.81 -1.79 0.00 0.00 174.94 171.97 1p1d n PRO 121 N 3.70 0.26 0.00 0.37 -0.04 -1.26 -1.99 135.00 136.04 1p1d n PRO 121 Ca 0.08 -1.04 0.00 0.00 -0.04 0.00 0.00 63.50 62.50 1p1d n PRO 121 Cb 0.35 -0.28 0.00 0.00 -0.04 0.00 0.00 33.50 33.53 1p1d n PRO 121 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1p1d n SER 122 N -3.00 0.00 -2.08 3.54 3.41 -1.11 -4.88 113.62 109.50 1p1d n SER 122 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1p1d n SER 122 Cb 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 1p1d n SER 122 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1p1d n SER 123 N 0.00 -6.74 0.00 4.04 3.41 -1.26 -4.42 113.62 108.65 1p1d n SER 123 Ca 0.00 1.44 0.00 0.00 -0.26 0.00 0.00 58.87 60.05 1p1d n SER 123 Cb 0.00 -4.19 0.00 0.00 -0.26 0.00 0.00 64.21 59.76 1p1d n SER 123 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p1d n GLY 124 N 1.87 2.64 2.85 5.00 0.00 -1.23 -4.91 105.19 111.42 1p1d n GLY 124 Ca 0.00 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.58 1.38 -0.33 2.61 2.01 -1.26 -2.08 115.64 117.40 1p1d s THR 125 Ca 0.00 -1.60 -0.12 0.00 0.31 0.00 0.00 61.69 60.28 1p1d s THR 125 Cb 0.00 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 1p1d s THR 125 CO 0.00 -0.53 0.22 0.12 -0.69 0.00 0.00 174.62 173.75 1p1d s PHE 126 N 1.38 3.22 -0.06 4.92 2.19 0.15 -2.75 117.98 127.03 1p1d s PHE 126 Ca 0.07 -0.21 -0.13 0.00 0.33 0.00 0.00 56.93 57.00 1p1d s PHE 126 Cb -0.18 -2.45 -0.05 0.00 -1.31 0.00 0.00 43.02 39.03 1p1d s PHE 126 CO -0.16 -0.34 0.32 -1.01 1.83 0.00 0.00 175.22 175.86 1p1d s HIS 127 N 1.71 3.64 -0.35 10.12 3.76 -0.84 0.42 115.29 133.76 1p1d s HIS 127 Ca 0.06 0.80 0.02 0.00 -0.15 0.00 0.00 55.06 55.79 1p1d s HIS 127 Cb -0.17 -2.21 0.11 0.00 1.11 0.00 0.00 32.58 31.41 1p1d s HIS 127 CO 0.10 0.59 0.11 0.54 -0.85 0.00 0.00 174.74 175.23 1p1d s VAL 128 N -0.76 1.54 -0.58 -0.90 0.11 -0.25 -0.48 120.40 119.08 1p1d s VAL 128 Ca 0.20 -1.99 -0.25 0.00 -2.93 0.00 0.00 61.98 57.01 1p1d s VAL 128 Cb -0.15 -2.13 0.04 0.00 -1.53 0.00 0.00 36.38 32.61 1p1d s VAL 128 CO 0.09 -0.68 1.04 -0.54 -3.33 0.00 0.00 175.10 171.68 1p1d s LYS 129 N 1.09 3.36 -0.17 1.54 -0.14 -0.83 -2.37 119.74 122.23 1p1d s LYS 129 Ca 0.12 -0.15 -0.02 0.00 -1.36 0.00 0.00 55.97 54.56 1p1d s LYS 129 Cb -0.19 -4.06 -0.01 0.00 -1.68 0.00 0.00 37.83 31.88 1p1d s LYS 129 CO -0.14 -1.61 -0.10 -0.51 -0.76 0.00 0.00 175.35 172.23 1p1d s LEU 130 N 4.38 2.77 -0.16 3.17 1.43 -0.18 -4.15 118.68 125.95 1p1d s LEU 130 Ca 0.34 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.79 1p1d s LEU 130 Cb -0.11 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 1p1d s LEU 130 CO 0.20 0.09 1.81 -2.84 0.23 0.00 0.00 176.35 175.83 1p1d s PRO 131 N 0.83 3.76 0.33 1.29 0.02 -1.26 -0.86 135.00 139.11 1p1d s PRO 131 Ca -0.03 1.95 -0.00 0.00 0.02 0.00 0.00 61.00 62.94 1p1d s PRO 131 Cb -0.15 -4.12 -0.04 0.00 0.02 0.00 0.00 34.50 30.21 1p1d s PRO 131 CO 0.01 -1.36 0.54 0.15 -0.33 0.00 0.00 177.00 176.00 1p1d s LYS 132 N 4.92 3.50 0.00 5.54 3.01 -0.77 -4.85 119.74 131.10 1p1d s LYS 132 Ca 0.81 -0.30 0.00 0.00 -1.01 0.00 0.00 55.97 55.46 1p1d s LYS 132 Cb -0.30 -2.67 0.00 0.00 -1.01 0.00 0.00 37.83 33.84 1p1d s LYS 132 CO 0.33 0.17 0.00 0.36 0.51 0.00 0.00 175.35 176.72 1p1d n LYS 133 N -1.62 2.51 0.00 1.68 0.00 -1.26 -3.69 118.16 115.78 1p1d n LYS 133 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.27 1p1d n LYS 133 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.59 1p1d n LYS 133 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1p1d n HIS 134 N -0.19 0.00 -3.06 5.58 8.25 -1.26 -4.04 115.22 120.50 1p1d n HIS 134 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.34 1p1d n HIS 134 Cb 0.00 -0.31 -0.03 0.00 1.12 0.00 0.00 29.99 30.77 1p1d n HIS 134 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1p1d s SER 135 N -2.09 -0.31 0.15 0.41 0.01 -1.26 -4.91 113.70 105.70 1p1d s SER 135 Ca 0.00 -1.99 0.05 0.00 1.31 0.00 0.00 55.95 55.32 1p1d s SER 135 Cb 0.00 1.08 -0.04 0.00 0.21 0.00 0.00 66.02 67.27 1p1d s SER 135 CO 0.00 -0.12 -0.11 -0.69 0.41 0.00 0.00 173.24 172.72 1p1d s VAL 136 N 0.82 1.28 0.64 3.43 1.01 -1.26 -4.99 120.40 121.32 1p1d s VAL 136 Ca 0.28 -2.03 -0.17 0.00 0.00 0.00 0.00 61.98 60.05 1p1d s VAL 136 Cb -0.02 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.47 1p1d s VAL 136 CO -0.09 -0.67 0.55 1.21 0.00 0.00 0.00 175.10 176.10 1p1d n GLU 137 N -0.12 0.45 0.04 2.72 2.13 -1.26 -4.94 120.64 119.67 1p1d n GLU 137 Ca -0.11 0.19 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1p1d n GLU 137 Cb 0.60 -1.79 0.00 0.00 0.27 0.00 0.00 31.44 30.52 1p1d n GLU 137 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1p1d n LEU 138 N 0.10 -0.03 -0.16 4.31 4.77 -1.26 -4.87 117.00 119.86 1p1d n LEU 138 Ca 0.11 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1p1d n LEU 138 Cb 0.48 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1p1d n LEU 138 CO 0.50 -0.56 0.00 0.61 -1.33 0.00 0.00 177.39 176.61 1p1d n GLY 139 N 1.61 1.05 3.44 -0.72 0.00 -1.26 -4.53 105.19 104.78 1p1d n GLY 139 Ca 0.00 -0.38 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 1p1d n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 140 N -2.32 3.78 -0.07 -0.61 1.01 -1.26 -1.73 121.20 120.01 1p1d s ILE 140 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.30 1p1d s ILE 140 Cb 0.00 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.79 1p1d s ILE 140 CO 0.00 0.46 -0.16 -0.89 0.00 0.00 0.00 174.94 174.35 1p1d s THR 141 N 0.81 1.39 0.31 2.92 2.01 -0.56 -4.98 115.64 117.53 1p1d s THR 141 Ca -0.01 -0.64 0.07 0.00 0.31 0.00 0.00 61.69 61.42 1p1d s THR 141 Cb -0.14 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.11 1p1d s THR 141 CO 0.02 0.41 0.26 -0.63 -0.69 0.00 0.00 174.62 173.99 1p1d s ILE 142 N 0.43 3.87 -0.00 1.82 1.01 -1.26 0.56 121.20 127.63 1p1d s ILE 142 Ca -0.12 -1.37 -0.29 0.00 0.00 0.00 0.00 60.65 58.87 1p1d s ILE 142 Cb -0.15 -3.27 0.10 0.00 0.01 0.00 0.00 42.46 39.15 1p1d s ILE 142 CO 0.04 -0.24 0.88 -0.44 0.00 0.00 0.00 174.94 175.19 1p1d s SER 143 N -3.95 -0.37 -0.12 3.58 0.01 0.12 -4.51 113.70 108.46 1p1d s SER 143 Ca 0.38 0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.65 1p1d s SER 143 Cb -0.07 0.39 -0.01 0.00 0.21 0.00 0.00 66.02 66.54 1p1d s SER 143 CO 0.26 -0.63 -0.15 -0.94 0.41 0.00 0.00 173.24 172.19 1p1d s SER 144 N -2.47 3.87 0.06 2.44 1.04 -1.26 -1.30 113.70 116.07 1p1d s SER 144 Ca 0.05 -0.36 -0.26 0.00 0.48 0.00 0.00 55.95 55.86 1p1d s SER 144 Cb -0.01 -1.57 -0.17 0.00 0.10 0.00 0.00 66.02 64.37 1p1d s SER 144 CO -0.09 0.17 1.57 1.55 0.98 0.00 0.00 173.24 177.42 1p1d h PRO 145 N 6.68 -0.24 -1.91 4.02 0.13 -1.97 -3.46 132.00 135.25 1p1d h PRO 145 Ca -0.25 0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.88 1p1d h PRO 145 Cb 1.22 0.06 -0.22 0.00 0.13 0.00 0.00 31.00 32.18 1p1d h PRO 145 CO 0.54 -0.07 0.21 -1.12 -0.23 0.00 0.00 178.00 177.33 1p1d s SER 146 N -5.07 -0.68 -0.42 1.44 0.01 -1.26 -5.04 113.70 102.68 1p1d s SER 146 Ca -0.15 1.27 0.05 0.00 1.31 0.00 0.00 55.95 58.44 1p1d s SER 146 Cb 0.04 1.28 0.60 0.00 0.21 0.00 0.00 66.02 68.16 1p1d s SER 146 CO 0.64 -0.25 1.79 -0.24 0.41 0.00 0.00 173.24 175.59 1p1d n SER 147 N 2.47 3.76 -2.50 2.44 2.88 -1.26 -4.59 113.62 116.82 1p1d n SER 147 Ca -0.14 -3.68 -0.33 0.00 -1.33 0.00 0.00 58.87 53.39 1p1d n SER 147 Cb 0.55 -0.79 0.04 0.00 -0.75 0.00 0.00 64.21 63.27 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 -1.12 3.01 -3.63 -1.46 3.00 -1.26 -4.96 116.66 110.25 1p1d n ARG 148 Ca 0.53 -3.75 -0.03 0.00 -0.01 0.00 0.00 57.85 54.59 1p1d n ARG 148 Cb 1.41 -2.27 -0.04 0.00 0.00 0.00 0.00 32.46 31.55 1p1d n ARG 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1p1d s LYS 149 N -3.82 0.12 0.00 5.56 0.00 -1.26 -5.01 119.74 115.33 1p1d s LYS 149 Ca 0.55 0.01 0.14 0.00 0.00 0.00 0.00 55.97 56.67 1p1d s LYS 149 Cb 0.45 0.06 0.63 0.00 0.00 0.00 0.00 37.83 38.96 1p1d s LYS 149 CO -0.17 -0.04 1.44 -0.35 0.00 0.00 0.00 175.35 176.23 1p1d n PRO 150 N 0.41 0.04 -1.02 1.78 -0.04 -1.26 -2.78 135.00 132.12 1p1d n PRO 150 Ca -0.00 0.24 -0.11 0.00 -0.04 0.00 0.00 63.50 63.58 1p1d n PRO 150 Cb 0.58 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.79 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 -0.04 3.77 3.49 0.55 0.00 -1.26 -4.67 105.19 107.02 1p1d n GLY 151 Ca 0.04 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 1p1d n GLY 151 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p1d n ASP 152 N -0.42 1.16 -4.77 1.61 8.00 -1.12 -4.84 116.55 116.17 1p1d n ASP 152 Ca 0.44 0.06 -0.23 0.00 0.71 0.00 0.00 54.79 55.76 1p1d n ASP 152 Cb 1.42 -1.15 0.09 0.00 -0.02 0.00 0.00 41.12 41.45 1p1d n ASP 152 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1p1d s PRO 153 N 8.17 1.94 0.06 -0.24 0.04 -1.26 -1.51 135.00 142.20 1p1d s PRO 153 Ca 1.20 -0.88 0.08 0.00 0.04 0.00 0.00 61.00 61.44 1p1d s PRO 153 Cb -0.92 -2.33 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 1p1d s PRO 153 CO 0.44 -1.26 -0.23 -0.51 0.04 0.00 0.00 177.00 175.48 1p1d s LEU 154 N -5.08 2.19 0.27 -3.56 1.02 -1.24 -4.38 118.68 107.89 1p1d s LEU 154 Ca 0.63 -0.58 -0.08 0.00 0.02 0.00 0.00 54.13 54.12 1p1d s LEU 154 Cb -0.07 -1.09 -0.01 0.00 0.02 0.00 0.00 46.19 45.04 1p1d s LEU 154 CO 0.43 0.19 0.43 0.68 0.02 0.00 0.00 176.35 178.10 1p1d s VAL 155 N -0.85 0.00 0.45 -1.59 -7.23 -0.42 0.11 120.40 110.87 1p1d s VAL 155 Ca 0.09 -1.54 -0.17 0.00 -1.81 0.00 0.00 61.98 58.55 1p1d s VAL 155 Cb -0.09 -2.39 -0.09 0.00 0.56 0.00 0.00 36.38 34.37 1p1d s VAL 155 CO 0.02 0.00 0.92 -0.63 -0.31 0.00 0.00 175.10 175.10 1p1d s ILE 156 N -3.74 4.55 0.00 -0.62 1.09 -1.26 0.15 121.20 121.37 1p1d s ILE 156 Ca 0.27 1.18 0.00 0.00 -1.10 0.00 0.00 60.65 61.00 1p1d s ILE 156 Cb 0.00 -3.67 0.00 0.00 -1.06 0.00 0.00 42.46 37.73 1p1d s ILE 156 CO 0.13 -0.50 0.00 -0.24 -0.10 0.00 0.00 174.94 174.23 1p1d n SER 157 N -1.13 0.43 -3.65 3.58 2.88 0.19 -4.66 113.62 111.27 1p1d n SER 157 Ca 0.06 -0.26 -0.03 0.00 -1.33 0.00 0.00 58.87 57.31 1p1d n SER 157 Cb 0.54 0.61 -0.07 0.00 -0.75 0.00 0.00 64.21 64.55 1p1d n SER 157 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1p1d s ASP 158 N -0.70 -0.18 0.02 -3.46 1.01 -1.24 -4.97 116.67 107.14 1p1d s ASP 158 Ca 0.00 0.33 0.04 0.00 0.71 0.00 0.00 52.55 53.62 1p1d s ASP 158 Cb 0.00 0.61 -0.02 0.00 1.01 0.00 0.00 42.92 44.53 1p1d s ASP 158 CO 0.00 -0.05 -0.11 -0.63 0.21 0.00 0.00 175.17 174.58 1p1d s ILE 159 N 0.48 0.88 0.58 0.77 1.01 -1.25 -1.50 121.20 122.16 1p1d s ILE 159 Ca 0.01 -0.73 0.09 0.00 0.00 0.00 0.00 60.65 60.02 1p1d s ILE 159 Cb -0.04 -0.78 0.08 0.00 0.01 0.00 0.00 42.46 41.73 1p1d s ILE 159 CO -0.12 0.06 0.74 -0.75 0.00 0.00 0.00 174.94 174.86 1p1d s LYS 160 N -0.76 2.28 0.16 2.79 2.20 -0.70 -5.02 119.74 120.69 1p1d s LYS 160 Ca 0.01 -1.72 0.09 0.00 -0.36 0.00 0.00 55.97 54.00 1p1d s LYS 160 Cb -0.06 -2.56 -0.04 0.00 -1.51 0.00 0.00 37.83 33.66 1p1d s LYS 160 CO 0.00 -0.84 -0.16 0.15 -0.36 0.00 0.00 175.35 174.14 1p1d s LYS 161 N -4.62 1.85 0.00 4.03 -0.14 -1.26 -4.61 119.74 114.99 1p1d s LYS 161 Ca 0.58 -1.29 0.00 0.00 -1.36 0.00 0.00 55.97 53.89 1p1d s LYS 161 Cb -0.05 -2.08 0.00 0.00 -1.68 0.00 0.00 37.83 34.02 1p1d s LYS 161 CO 0.36 0.44 0.00 0.41 -0.76 0.00 0.00 175.35 175.81 1p1d n GLY 162 N 0.35 2.82 3.77 -3.33 0.00 -1.26 -4.93 105.19 102.60 1p1d n GLY 162 Ca -0.13 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 1p1d n GLY 162 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p1d s SER 163 N 0.64 7.47 0.63 1.61 0.01 -1.26 -4.81 113.70 117.99 1p1d s SER 163 Ca 0.00 1.74 0.25 0.00 1.31 0.00 0.00 55.95 59.26 1p1d s SER 163 Cb 0.00 -2.53 1.27 0.00 0.21 0.00 0.00 66.02 64.97 1p1d s SER 163 CO 0.00 0.19 1.71 -0.37 0.41 0.00 0.00 173.24 175.19 1p1d h VAL 164 N 3.26 0.15 -0.12 3.43 -1.51 -1.91 -2.81 116.25 116.74 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 1.20 0.47 -0.02 0.00 -2.13 0.00 0.00 31.29 30.81 1p1d h VAL 164 CO 0.67 0.00 -0.14 0.00 -1.23 0.00 0.00 177.57 176.87 1p1d h ALA 165 N 1.11 -0.37 0.00 5.19 0.00 -1.92 -0.53 119.26 122.75 1p1d h ALA 165 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 1p1d h ALA 165 Cb 1.36 0.85 -0.02 0.00 0.00 0.00 0.00 17.79 19.98 1p1d h ALA 165 CO -0.00 -0.44 -0.94 1.25 0.00 0.00 0.00 179.25 179.12 1p1d h HIS 166 N -0.08 0.00 -0.14 0.00 6.17 -1.78 -3.30 115.15 116.02 1p1d h HIS 166 Ca 0.02 0.00 0.04 0.00 0.71 0.00 0.00 60.37 61.14 1p1d h HIS 166 Cb 0.14 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.06 1p1d h HIS 166 CO -0.68 0.66 0.10 0.00 0.71 0.00 0.00 177.93 178.72 1p1d h ARG 167 N 0.00 0.00 -0.02 5.26 -0.00 -1.29 -0.02 114.38 118.32 1p1d h ARG 167 Ca -0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.41 1p1d h ARG 167 Cb 1.56 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 31.53 1p1d h ARG 167 CO 0.07 0.00 0.06 0.00 0.00 0.00 0.00 179.97 180.11 1p1d h THR 168 N 0.00 0.12 -1.61 2.04 1.03 -1.17 -0.74 112.91 112.58 1p1d h THR 168 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.47 1p1d h THR 168 Cb 0.28 0.94 0.00 0.00 -1.07 0.00 0.00 68.15 68.30 1p1d h THR 168 CO -0.00 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.12 1p1d n GLY 169 N -1.16 0.46 2.04 2.99 0.00 -0.02 -4.08 105.19 105.41 1p1d n GLY 169 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1p1d n GLY 169 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p1d n THR 170 N -0.82 0.00 -1.54 2.61 -2.24 -1.26 -5.04 114.28 105.99 1p1d n THR 170 Ca 0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 1p1d n THR 170 Cb 0.40 -0.23 -0.09 0.00 -2.10 0.00 0.00 70.33 68.31 1p1d n THR 170 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1p1d n LEU 171 N -2.79 1.40 -3.92 3.22 4.32 -1.26 -4.87 117.00 113.10 1p1d n LEU 171 Ca 0.00 -0.86 -0.12 0.00 -0.02 0.00 0.00 56.01 55.01 1p1d n LEU 171 Cb 0.00 -1.42 -0.13 0.00 -1.62 0.00 0.00 43.42 40.25 1p1d n LEU 171 CO 0.00 -1.93 -0.37 -1.61 -1.22 0.00 0.00 177.39 172.26 1p1d s GLU 172 N 8.48 0.16 -0.17 3.23 2.02 -1.26 -4.73 118.70 126.43 1p1d s GLU 172 Ca 1.04 -0.21 -0.31 0.00 0.02 0.00 0.00 54.97 55.51 1p1d s GLU 172 Cb -0.36 -0.06 -0.09 0.00 0.10 0.00 0.00 34.13 33.73 1p1d s GLU 172 CO 0.25 0.01 2.09 1.28 0.02 0.00 0.00 175.26 178.90 1p1d n LEU 173 N 2.64 3.26 0.00 1.80 4.77 -1.26 -2.71 117.00 125.50 1p1d n LEU 173 Ca -0.15 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1p1d n LEU 173 Cb 0.58 -1.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.23 1p1d n LEU 173 CO 0.24 -0.38 0.00 0.61 -1.33 0.00 0.00 177.39 176.54 1p1d n GLY 174 N 5.35 1.76 3.89 -0.72 0.00 -1.26 -5.11 105.19 109.11 1p1d n GLY 174 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.92 6.24 -0.16 1.61 1.11 -1.10 -5.06 116.67 117.38 1p1d s ASP 175 Ca 0.00 0.26 -0.05 0.00 0.18 0.00 0.00 52.55 52.95 1p1d s ASP 175 Cb 0.00 -1.91 -0.03 0.00 1.07 0.00 0.00 42.92 42.05 1p1d s ASP 175 CO 0.00 0.21 -0.00 -0.75 1.18 0.00 0.00 175.17 175.81 1p1d s LYS 176 N -2.22 3.75 -0.17 8.23 2.47 -1.26 -4.12 119.74 126.42 1p1d s LYS 176 Ca 0.31 -0.46 -0.16 0.00 -1.56 0.00 0.00 55.97 54.10 1p1d s LYS 176 Cb -0.13 -3.01 -0.04 0.00 -1.46 0.00 0.00 37.83 33.19 1p1d s LYS 176 CO 0.23 0.27 0.40 -0.51 0.16 0.00 0.00 175.35 175.90 1p1d s LEU 177 N 0.31 4.21 -0.05 5.43 1.02 0.30 -0.58 118.68 129.33 1p1d s LEU 177 Ca -0.01 0.60 -0.01 0.00 0.02 0.00 0.00 54.13 54.73 1p1d s LEU 177 Cb -0.13 -2.53 -0.02 0.00 0.02 0.00 0.00 46.19 43.52 1p1d s LEU 177 CO 0.02 -0.01 -0.05 -0.11 0.02 0.00 0.00 176.35 176.22 1p1d n LEU 178 N 4.02 1.68 -4.09 1.79 0.00 -0.47 -3.70 117.00 116.24 1p1d n LEU 178 Ca -0.09 0.02 -0.10 0.00 0.00 0.00 0.00 56.01 55.84 1p1d n LEU 178 Cb 0.51 -0.15 -0.11 0.00 0.00 0.00 0.00 43.42 43.68 1p1d n LEU 178 CO 0.41 0.34 -0.38 0.00 0.00 0.00 0.00 177.39 177.76 1p1d s ALA 179 N -2.09 0.62 -0.03 1.96 0.00 -1.19 -2.85 121.76 118.19 1p1d s ALA 179 Ca -0.06 -1.02 -0.00 0.00 0.00 0.00 0.00 51.96 50.88 1p1d s ALA 179 Cb 0.02 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.31 1p1d s ALA 179 CO 0.09 -0.18 0.02 0.42 0.00 0.00 0.00 175.76 176.11 1p1d s ILE 180 N -2.64 0.01 -1.57 0.00 1.01 0.25 -0.52 121.20 117.74 1p1d s ILE 180 Ca -0.00 0.20 -0.13 0.00 0.00 0.00 0.00 60.65 60.72 1p1d s ILE 180 Cb -0.01 -0.15 0.10 0.00 0.01 0.00 0.00 42.46 42.41 1p1d s ILE 180 CO -0.04 0.12 0.77 -0.67 0.00 0.00 0.00 174.94 175.12 1p1d n ASP 181 N 4.28 -3.07 0.00 3.58 2.03 0.13 0.37 116.55 123.86 1p1d n ASP 181 Ca -0.25 -0.93 0.00 0.00 0.52 0.00 0.00 54.79 54.13 1p1d n ASP 181 Cb 0.50 -3.23 0.00 0.00 -0.72 0.00 0.00 41.12 37.67 1p1d n ASP 181 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1p1d n ASN 182 N -2.80 0.00 -4.82 1.67 2.85 -1.26 -4.98 115.26 105.92 1p1d n ASN 182 Ca -0.03 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.12 1p1d n ASN 182 Cb 0.55 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.57 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1p1d s ILE 183 N -0.90 4.13 -0.08 -1.44 -1.09 0.16 -5.06 121.20 116.93 1p1d s ILE 183 Ca 0.00 0.94 0.02 0.00 -2.23 0.00 0.00 60.65 59.37 1p1d s ILE 183 Cb 0.00 -3.53 0.02 0.00 -1.58 0.00 0.00 42.46 37.37 1p1d s ILE 183 CO 0.00 -0.67 -0.11 -0.13 -1.23 0.00 0.00 174.94 172.80 1p1d s ARG 184 N -4.31 1.70 0.14 2.79 0.52 -1.26 0.85 118.95 119.38 1p1d s ARG 184 Ca 0.61 -0.39 0.23 0.00 -0.52 0.00 0.00 55.73 55.66 1p1d s ARG 184 Cb -0.13 -1.49 0.14 0.00 0.52 0.00 0.00 34.95 33.99 1p1d s ARG 184 CO 0.39 -0.05 1.14 1.28 0.02 0.00 0.00 175.30 178.08 1p1d n LEU 185 N 4.12 0.74 0.00 2.53 4.77 -1.13 -4.95 117.00 123.08 1p1d n LEU 185 Ca -0.20 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1p1d n LEU 185 Cb 0.51 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1p1d n LEU 185 CO 0.23 -0.09 0.00 -0.67 -1.33 0.00 0.00 177.39 175.53 1p1d n ASP 186 N -2.32 0.00 -2.74 -1.43 -0.08 -1.22 -2.59 116.55 106.16 1p1d n ASP 186 Ca 0.02 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.21 1p1d n ASP 186 Cb 0.49 0.00 0.09 0.00 2.34 0.00 0.00 41.12 44.04 1p1d n ASP 186 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1p1d n SER 187 N 0.98 -1.91 0.00 1.67 3.41 -1.26 -4.87 113.62 111.65 1p1d n SER 187 Ca 0.00 -3.22 0.00 0.00 -0.26 0.00 0.00 58.87 55.39 1p1d n SER 187 Cb 0.00 1.41 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1p1d n SER 189 N 0.99 -3.55 0.36 0.00 7.64 -1.26 -4.67 113.62 113.12 1p1d n SER 189 Ca 0.00 -0.32 -0.18 0.00 1.01 0.00 0.00 58.87 59.38 1p1d n SER 189 Cb 0.00 -3.07 -0.09 0.00 -1.01 0.00 0.00 64.21 60.04 1p1d n SER 189 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1p1d h MET 190 N -1.35 -0.96 -0.21 1.43 4.05 -1.95 1.04 114.93 116.97 1p1d h MET 190 Ca -0.32 0.07 -0.05 0.00 -0.28 0.00 0.00 59.70 59.11 1p1d h MET 190 Cb 1.20 0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 32.21 1p1d h MET 190 CO 0.30 -0.64 -0.11 0.93 0.23 0.00 0.00 176.91 177.62 1p1d h GLU 191 N -1.00 0.33 -0.48 0.39 5.08 -2.00 -2.19 114.58 114.71 1p1d h GLU 191 Ca -0.08 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 1p1d h GLU 191 Cb 0.82 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1p1d h GLU 191 CO 0.07 0.45 0.16 -0.44 -1.00 0.00 0.00 179.01 178.25 1p1d h ASP 192 N 0.31 0.69 -0.67 1.42 5.19 -1.79 -2.08 116.42 119.49 1p1d h ASP 192 Ca 0.06 -0.20 0.04 0.00 -0.62 0.00 0.00 57.03 56.32 1p1d h ASP 192 Cb 0.39 -0.18 -0.05 0.00 0.18 0.00 0.00 39.33 39.67 1p1d h ASP 192 CO 0.02 0.71 0.40 0.00 -3.12 0.00 0.00 179.24 177.25 1p1d h ALA 193 N 1.01 0.89 -0.92 3.45 0.00 0.17 -0.55 119.26 123.31 1p1d h ALA 193 Ca 0.16 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1p1d h ALA 193 Cb 0.26 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1p1d h ALA 193 CO -0.01 0.13 0.60 0.28 0.00 0.00 0.00 179.25 180.25 1p1d h VAL 194 N 0.77 1.11 -0.10 0.00 2.07 -1.10 0.24 116.25 119.24 1p1d h VAL 194 Ca 0.28 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1p1d h VAL 194 Cb 0.09 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 29.74 1p1d h VAL 194 CO -0.14 0.20 -0.07 -0.61 0.02 0.00 0.00 177.57 176.97 1p1d h GLN 195 N 1.10 -0.07 0.00 1.57 5.75 -0.43 0.92 115.11 123.95 1p1d h GLN 195 Ca 0.38 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.85 1p1d h GLN 195 Cb 0.11 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 1p1d h GLN 195 CO -0.13 -0.05 -0.18 0.82 -2.65 0.00 0.00 178.83 176.64 1p1d h ILE 196 N -0.08 0.58 -0.26 2.39 2.04 -0.75 0.36 117.51 121.79 1p1d h ILE 196 Ca 0.06 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1p1d h ILE 196 Cb 0.17 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1p1d h ILE 196 CO -0.14 0.17 0.11 0.25 0.00 0.00 0.00 178.15 178.54 1p1d h LEU 197 N 0.00 0.31 0.00 1.44 5.85 0.19 -1.82 115.31 121.28 1p1d h LEU 197 Ca -0.00 -0.02 -0.37 0.00 0.84 0.00 0.00 57.88 58.32 1p1d h LEU 197 Cb 0.53 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.42 1p1d h LEU 197 CO 0.02 0.28 -2.40 0.00 -0.34 0.00 0.00 178.44 176.01 1p1d n GLN 198 N -4.44 0.68 0.21 1.25 10.64 -0.68 -4.17 117.38 120.86 1p1d n GLN 198 Ca 0.01 0.05 0.14 0.00 -1.83 0.00 0.00 57.00 55.37 1p1d n GLN 198 Cb 0.12 -1.53 0.74 0.00 -0.86 0.00 0.00 30.24 28.71 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 0.00 0.00 -1.83 2.61 -0.00 -0.11 -2.68 115.11 113.10 1p1d h GLN 199 Ca -0.55 0.00 -0.17 0.00 -0.00 0.00 0.00 58.65 57.93 1p1d h GLN 199 Cb 2.14 0.00 -0.07 0.00 0.00 0.00 0.00 27.48 29.55 1p1d h GLN 199 CO -0.00 0.00 0.13 0.00 0.00 0.00 0.00 178.83 178.96 1p1d n GLU 201 N 1.17 2.46 0.00 0.00 0.28 -1.01 -2.51 120.64 121.03 1p1d n GLU 201 Ca 0.19 -1.59 0.00 0.00 -0.16 0.00 0.00 57.16 55.60 1p1d n GLU 201 Cb 0.58 -2.49 0.00 0.00 1.43 0.00 0.00 31.44 30.96 1p1d n GLU 201 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1p1d n ASP 202 N 3.91 0.00 -3.15 -1.84 8.00 -1.24 -4.63 116.55 117.60 1p1d n ASP 202 Ca 0.52 0.00 0.06 0.00 0.71 0.00 0.00 54.79 56.08 1p1d n ASP 202 Cb 0.20 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.28 1p1d n ASP 202 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1p1d s LEU 203 N -0.37 -0.02 -0.24 0.64 0.20 -1.04 -1.85 118.68 115.99 1p1d s LEU 203 Ca 0.00 0.01 -0.12 0.00 0.69 0.00 0.00 54.13 54.71 1p1d s LEU 203 Cb 0.00 1.02 -0.05 0.00 -0.43 0.00 0.00 46.19 46.73 1p1d s LEU 203 CO 0.00 -0.00 0.21 0.54 -0.29 0.00 0.00 176.35 176.81 1p1d s VAL 204 N 3.00 5.32 -0.35 1.68 0.11 -0.04 -4.86 120.40 125.26 1p1d s VAL 204 Ca 0.03 0.28 -0.05 0.00 -2.93 0.00 0.00 61.98 59.30 1p1d s VAL 204 Cb -0.05 -3.55 0.06 0.00 -1.53 0.00 0.00 36.38 31.31 1p1d s VAL 204 CO -0.11 0.31 0.12 -0.75 -3.33 0.00 0.00 175.10 171.34 1p1d s LYS 205 N 1.22 2.49 -0.21 1.54 2.20 -1.26 -1.01 119.74 124.72 1p1d s LYS 205 Ca 0.10 -1.33 -0.10 0.00 -0.36 0.00 0.00 55.97 54.28 1p1d s LYS 205 Cb -0.14 -3.47 -0.05 0.00 -1.51 0.00 0.00 37.83 32.66 1p1d s LYS 205 CO 0.06 -0.76 0.13 -0.51 -0.36 0.00 0.00 175.35 173.92 1p1d s LEU 206 N 1.34 4.17 -0.76 5.43 2.01 -1.00 0.19 118.68 130.06 1p1d s LEU 206 Ca -0.00 0.19 -0.16 0.00 0.01 0.00 0.00 54.13 54.17 1p1d s LEU 206 Cb -0.21 -2.09 0.17 0.00 0.01 0.00 0.00 46.19 44.08 1p1d s LEU 206 CO 0.01 0.15 0.78 -0.75 1.01 0.00 0.00 176.35 177.55 1p1d s LYS 207 N 0.53 3.42 0.59 1.70 2.20 0.33 -1.09 119.74 127.41 1p1d s LYS 207 Ca 0.08 -2.03 -0.01 0.00 -0.36 0.00 0.00 55.97 53.64 1p1d s LYS 207 Cb -0.12 -4.47 0.04 0.00 -1.51 0.00 0.00 37.83 31.77 1p1d s LYS 207 CO -0.00 -1.43 0.85 0.42 -0.36 0.00 0.00 175.35 174.83 1p1d s ILE 208 N 1.27 2.66 -0.15 5.43 -1.09 0.17 -1.36 121.20 128.13 1p1d s ILE 208 Ca 0.17 -0.51 -0.04 0.00 -2.23 0.00 0.00 60.65 58.05 1p1d s ILE 208 Cb -0.15 -3.05 -0.03 0.00 -1.58 0.00 0.00 42.46 37.66 1p1d s ILE 208 CO -0.05 -0.04 -0.03 -0.13 -1.23 0.00 0.00 174.94 173.47 1p1d s ARG 209 N -4.91 3.62 -0.06 2.79 0.52 0.25 0.30 118.95 121.46 1p1d s ARG 209 Ca 0.58 -0.50 -0.03 0.00 -0.52 0.00 0.00 55.73 55.25 1p1d s ARG 209 Cb -0.10 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.41 1p1d s ARG 209 CO 0.41 0.29 0.08 0.21 0.02 0.00 0.00 175.30 176.30 1p1d s LYS 210 N 0.24 3.17 0.00 3.54 2.36 -0.88 -4.30 119.74 123.87 1p1d s LYS 210 Ca -0.02 -0.35 0.00 0.00 -2.55 0.00 0.00 55.97 53.05 1p1d s LYS 210 Cb -0.14 -2.95 0.00 0.00 -1.05 0.00 0.00 37.83 33.70 1p1d s LYS 210 CO 0.03 0.71 0.00 -0.40 1.55 0.00 0.00 175.35 177.23 1p1d n ASP 211 N 1.71 0.00 -4.39 1.43 5.75 -1.26 -3.48 116.55 116.31 1p1d n ASP 211 Ca -0.17 0.00 -0.33 0.00 -0.01 0.00 0.00 54.79 54.28 1p1d n ASP 211 Cb 0.54 0.00 0.13 0.00 -1.03 0.00 0.00 41.12 40.75 1p1d n ASP 211 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1p1d n GLU 212 N 0.00 -0.47 0.00 0.11 1.02 -1.26 -5.17 120.64 114.87 1p1d n GLU 212 Ca 0.00 -0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1p1d n GLU 212 Cb 0.00 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 29.61 1p1d n GLU 212 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91