#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 -0.06 -0.40 1.69 -7.23 -1.26 -5.11 120.40 108.03 1p1d s VAL 19 Ca 0.00 0.19 0.03 0.00 -1.81 0.00 0.00 61.98 60.39 1p1d s VAL 19 Cb 0.00 -0.24 0.11 0.00 0.56 0.00 0.00 36.38 36.81 1p1d s VAL 19 CO 0.00 0.08 0.13 -0.69 -0.31 0.00 0.00 175.10 174.31 1p1d s VAL 20 N 1.20 2.09 -0.34 1.32 1.01 -1.26 -4.97 120.40 119.45 1p1d s VAL 20 Ca -0.09 -2.51 -0.13 0.00 0.00 0.00 0.00 61.98 59.25 1p1d s VAL 20 Cb -0.12 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 1p1d s VAL 20 CO -0.06 -0.69 0.24 -1.38 0.00 0.00 0.00 175.10 173.21 1p1d s HIS 21 N 0.61 3.23 0.02 5.22 -3.43 -1.26 -4.84 115.29 114.84 1p1d s HIS 21 Ca 0.13 -0.24 -0.35 0.00 -0.80 0.00 0.00 55.06 53.80 1p1d s HIS 21 Cb -0.21 -2.48 -0.14 0.00 -1.43 0.00 0.00 32.58 28.32 1p1d s HIS 21 CO -0.07 -0.37 1.66 0.25 -2.00 0.00 0.00 174.74 174.21 1p1d n THR 22 N 5.11 0.23 -4.50 -5.38 -2.24 -1.26 -3.96 114.28 102.28 1p1d n THR 22 Ca -0.13 -0.04 -0.25 0.00 -2.27 0.00 0.00 64.05 61.37 1p1d n THR 22 Cb 0.50 -1.51 -0.10 0.00 -2.10 0.00 0.00 70.33 67.12 1p1d n THR 22 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1p1d s GLU 23 N 2.20 1.73 -0.09 -0.78 -6.30 0.00 -4.96 118.70 110.50 1p1d s GLU 23 Ca 0.86 -1.85 0.01 0.00 -2.50 0.00 0.00 54.97 51.50 1p1d s GLU 23 Cb -0.77 -1.69 -0.02 0.00 0.00 0.00 0.00 34.13 31.65 1p1d s GLU 23 CO 0.47 0.22 -0.12 0.95 0.02 0.00 0.00 175.26 176.80 1p1d s THR 24 N -2.60 3.23 0.14 -1.70 -4.23 -1.26 -1.62 115.64 107.60 1p1d s THR 24 Ca 0.31 -0.63 0.04 0.00 -1.18 0.00 0.00 61.69 60.22 1p1d s THR 24 Cb -0.01 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 1p1d s THR 24 CO 0.15 0.56 -0.08 -0.89 -0.54 0.00 0.00 174.62 173.82 1p1d s THR 25 N -0.28 1.02 0.28 3.99 2.01 0.43 -4.98 115.64 118.11 1p1d s THR 25 Ca 0.03 -2.03 0.06 0.00 0.31 0.00 0.00 61.69 60.06 1p1d s THR 25 Cb -0.13 -1.84 -0.02 0.00 0.01 0.00 0.00 72.50 70.52 1p1d s THR 25 CO 0.03 -0.75 0.35 -1.83 -0.69 0.00 0.00 174.62 171.73 1p1d s GLU 26 N -3.78 3.17 -0.04 4.92 1.03 -1.26 0.07 118.70 122.81 1p1d s GLU 26 Ca 0.16 -0.95 -0.02 0.00 0.03 0.00 0.00 54.97 54.20 1p1d s GLU 26 Cb 0.04 -2.76 0.03 0.00 -0.80 0.00 0.00 34.13 30.63 1p1d s GLU 26 CO -0.00 0.28 0.09 0.08 -1.33 0.00 0.00 175.26 174.38 1p1d s VAL 27 N -2.10 -0.04 -0.26 1.83 1.01 0.24 -4.83 120.40 116.25 1p1d s VAL 27 Ca 0.38 0.14 -0.05 0.00 0.00 0.00 0.00 61.98 62.45 1p1d s VAL 27 Cb -0.09 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.15 1p1d s VAL 27 CO 0.29 0.06 0.01 0.54 0.00 0.00 0.00 175.10 176.00 1p1d s VAL 28 N 0.79 3.55 -0.09 2.92 0.11 -1.26 -0.96 120.40 125.47 1p1d s VAL 28 Ca -0.06 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.28 1p1d s VAL 28 Cb -0.09 -2.77 -0.02 0.00 -1.53 0.00 0.00 36.38 31.97 1p1d s VAL 28 CO -0.03 0.20 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.07 1p1d s LEU 29 N 1.45 2.91 0.28 2.54 1.43 -0.41 -4.95 118.68 121.92 1p1d s LEU 29 Ca 0.03 -0.17 0.12 0.00 -1.03 0.00 0.00 54.13 53.07 1p1d s LEU 29 Cb -0.16 -1.63 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 1p1d s LEU 29 CO -0.01 0.28 -0.19 0.42 0.23 0.00 0.00 176.35 177.09 1p1d s THR 30 N -0.35 2.53 -0.20 5.49 -4.23 -1.26 0.11 115.64 117.73 1p1d s THR 30 Ca 0.04 -2.37 -0.11 0.00 -1.18 0.00 0.00 61.69 58.07 1p1d s THR 30 Cb -0.12 -2.32 -0.05 0.00 1.34 0.00 0.00 72.50 71.34 1p1d s THR 30 CO 0.02 -0.39 0.18 0.00 -0.54 0.00 0.00 174.62 173.90 1p1d s ALA 31 N -2.47 3.65 0.13 3.99 0.00 -0.94 -4.58 121.76 121.54 1p1d s ALA 31 Ca 0.30 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.65 1p1d s ALA 31 Cb -0.05 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 1p1d s ALA 31 CO 0.15 0.08 0.06 -0.51 0.00 0.00 0.00 175.76 175.54 1p1d s ASP 32 N 0.51 5.24 -0.01 0.00 1.11 -1.19 -4.91 116.67 117.43 1p1d s ASP 32 Ca 0.10 -0.18 0.01 0.00 0.18 0.00 0.00 52.55 52.67 1p1d s ASP 32 Cb -0.12 -1.30 0.04 0.00 1.07 0.00 0.00 42.92 42.61 1p1d s ASP 32 CO 0.01 0.12 0.82 -0.81 1.18 0.00 0.00 175.17 176.48 1p1d n PRO 33 N 0.06 1.13 -0.03 8.23 -0.04 -1.26 -1.67 135.00 141.42 1p1d n PRO 33 Ca -0.09 -0.14 -0.07 0.00 -0.04 0.00 0.00 63.50 63.16 1p1d n PRO 33 Cb 0.54 -1.26 -0.03 0.00 -0.04 0.00 0.00 33.50 32.71 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 -0.21 0.38 -1.50 0.52 0.31 -1.26 -4.92 118.33 111.65 1p1d n VAL 34 Ca 0.01 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1p1d n VAL 34 Cb 0.15 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 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 -3.13 0.00 0.00 2.52 5.66 -1.25 -5.10 114.28 112.98 1p1d n THR 35 Ca -0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 1p1d n THR 35 Cb 0.60 0.53 0.00 0.00 -1.55 0.00 0.00 70.33 69.91 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 0.57 3.13 1.09 0.00 -0.67 -4.32 105.19 104.99 1p1d n GLY 36 Ca 0.00 0.60 -0.32 0.00 0.00 0.00 0.00 46.02 46.30 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 2.51 -0.37 1.61 0.40 -1.26 -3.18 117.98 117.69 1p1d s PHE 37 Ca 0.00 -1.29 0.05 0.00 -0.60 0.00 0.00 56.93 55.09 1p1d s PHE 37 Cb 0.00 -1.73 0.57 0.00 0.51 0.00 0.00 43.02 42.37 1p1d s PHE 37 CO 0.00 -0.61 1.71 0.41 0.70 0.00 0.00 175.22 177.43 1p1d n GLY 38 N 4.20 3.79 3.08 4.36 0.00 -1.26 -4.88 105.19 114.48 1p1d n GLY 38 Ca -0.20 -0.86 -0.24 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.64 1.18 0.05 -0.61 -4.36 -1.26 0.37 121.20 113.94 1p1d s ILE 39 Ca 0.46 -0.57 0.08 0.00 -0.26 0.00 0.00 60.65 60.35 1p1d s ILE 39 Cb 0.38 -1.03 -0.03 0.00 1.25 0.00 0.00 42.46 43.03 1p1d s ILE 39 CO 0.10 0.35 -0.22 0.00 0.24 0.00 0.00 174.94 175.41 1p1d s GLN 40 N 0.16 1.42 -0.02 0.37 -2.07 -0.54 -5.01 119.66 113.97 1p1d s GLN 40 Ca -0.05 -0.99 0.04 0.00 -1.82 0.00 0.00 55.36 52.55 1p1d s GLN 40 Cb -0.11 -1.56 -0.01 0.00 -1.09 0.00 0.00 33.01 30.24 1p1d s GLN 40 CO 0.02 0.40 -0.14 -0.48 -1.32 0.00 0.00 175.29 173.77 1p1d s LEU 41 N -1.26 1.97 0.84 2.60 0.05 -1.26 -0.21 118.68 121.42 1p1d s LEU 41 Ca 0.08 -0.26 -0.12 0.00 0.05 0.00 0.00 54.13 53.88 1p1d s LEU 41 Cb -0.09 -0.73 0.10 0.00 -2.05 0.00 0.00 46.19 43.42 1p1d s LEU 41 CO 0.02 0.15 1.16 -1.58 -0.55 0.00 0.00 176.35 175.56 1p1d s GLN 42 N -0.19 1.72 -0.01 1.48 0.74 0.31 -4.67 119.66 119.04 1p1d s GLN 42 Ca 0.03 0.18 -0.02 0.00 0.05 0.00 0.00 55.36 55.60 1p1d s GLN 42 Cb -0.07 -1.92 -0.01 0.00 1.10 0.00 0.00 33.01 32.12 1p1d s GLN 42 CO -0.00 -1.78 -0.04 0.41 -0.55 0.00 0.00 175.29 173.34 1p1d n GLY 43 N -2.94 -0.25 3.70 2.59 0.00 -1.26 -1.36 105.19 105.67 1p1d n GLY 43 Ca 0.07 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1p1d n GLY 43 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p1d n SER 44 N -2.78 2.38 0.00 1.61 2.88 -1.26 -4.68 113.62 111.77 1p1d n SER 44 Ca -0.01 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.57 1p1d n SER 44 Cb 0.05 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.01 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1p1d n VAL 45 N -0.58 0.00 -0.13 2.46 0.31 -1.26 -4.96 118.33 114.17 1p1d n VAL 45 Ca 0.08 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.35 1p1d n VAL 45 Cb 0.42 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.37 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 0.40 -5.75 3.52 -5.15 -1.95 -3.48 116.94 104.53 1p1d h PHE 46 Ca 0.00 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 1p1d h PHE 46 Cb 0.00 -0.12 -0.05 0.00 0.22 0.00 0.00 35.95 36.01 1p1d h PHE 46 CO 0.00 0.21 -0.54 0.00 -2.00 0.00 0.00 178.31 175.98 1p1d n ALA 47 N -2.28 -1.90 0.00 12.09 0.00 -1.26 -5.04 120.51 122.11 1p1d n ALA 47 Ca 0.02 0.82 0.00 0.00 0.00 0.00 0.00 53.44 54.28 1p1d n ALA 47 Cb 0.09 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.60 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 2.27 0.00 -2.98 0.00 5.66 -1.26 -4.96 114.28 113.01 1p1d n THR 48 Ca -0.14 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.66 1p1d n THR 48 Cb 0.22 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 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 -3.33 0.00 1.09 0.28 -1.26 -4.80 120.64 112.61 1p1d n GLU 49 Ca 0.00 0.63 0.00 0.00 -0.16 0.00 0.00 57.16 57.63 1p1d n GLU 49 Cb 0.00 -5.34 0.00 0.00 1.43 0.00 0.00 31.44 27.53 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 -3.92 0.00 -1.85 3.84 5.66 -1.26 -5.06 114.28 111.69 1p1d n THR 50 Ca -0.09 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.89 1p1d n THR 50 Cb 0.59 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.35 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 -0.30 -0.67 1.09 -0.00 -1.26 -4.35 117.00 111.51 1p1d n LEU 51 Ca 0.00 -1.12 0.00 0.00 -0.00 0.00 0.00 56.01 54.89 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 1.06 0.23 -1.20 -0.00 0.00 0.00 177.39 177.48 1p1d n SER 52 N 0.00 1.15 -4.77 1.45 7.64 -1.26 -4.34 113.62 113.49 1p1d n SER 52 Ca -0.08 -1.38 -0.41 0.00 1.01 0.00 0.00 58.87 58.01 1p1d n SER 52 Cb 0.49 -0.35 -0.02 0.00 -1.01 0.00 0.00 64.21 63.32 1p1d n SER 52 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1p1d s SER 53 N 0.12 6.65 0.67 6.43 0.15 -1.26 -4.81 113.70 121.65 1p1d s SER 53 Ca 0.00 2.79 -0.13 0.00 0.70 0.00 0.00 55.95 59.31 1p1d s SER 53 Cb 0.00 -2.65 -0.00 0.00 -1.71 0.00 0.00 66.02 61.65 1p1d s SER 53 CO 0.00 -0.63 1.07 -2.16 1.20 0.00 0.00 173.24 172.72 1p1d s PRO 54 N -1.86 2.94 0.77 5.44 0.04 -1.26 -4.66 135.00 136.42 1p1d s PRO 54 Ca 0.50 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.52 1p1d s PRO 54 Cb -0.42 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1p1d s PRO 54 CO 0.56 -1.11 0.40 -2.30 0.04 0.00 0.00 177.00 174.59 1p1d n PRO 55 N -2.71 0.15 -3.47 0.56 -0.02 -1.26 -4.84 135.00 123.40 1p1d n PRO 55 Ca 0.09 0.09 -0.12 0.00 -2.02 0.00 0.00 63.50 61.53 1p1d n PRO 55 Cb 0.53 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 32.16 1p1d n PRO 55 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1p1d s LEU 56 N 0.32 -0.43 0.37 2.45 2.34 -0.46 -2.94 118.68 120.34 1p1d s LEU 56 Ca 0.62 0.24 -0.26 0.00 0.06 0.00 0.00 54.13 54.78 1p1d s LEU 56 Cb -0.32 0.86 -0.11 0.00 -0.56 0.00 0.00 46.19 46.06 1p1d s LEU 56 CO 0.62 -0.29 1.14 -0.38 -1.06 0.00 0.00 176.35 176.38 1p1d n ILE 57 N 5.35 2.26 0.00 1.48 2.08 -1.26 0.12 119.36 129.39 1p1d n ILE 57 Ca -0.05 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.76 1p1d n ILE 57 Cb 0.50 -1.33 0.00 0.00 -0.75 0.00 0.00 39.64 38.06 1p1d n ILE 57 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1p1d n SER 58 N 0.65 2.90 -3.99 4.38 2.88 0.71 0.25 113.62 121.40 1p1d n SER 58 Ca 0.08 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.53 1p1d n SER 58 Cb 0.37 0.23 -0.10 0.00 -0.75 0.00 0.00 64.21 63.97 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 -1.61 0.32 0.11 0.66 5.04 -1.03 -4.76 117.35 116.08 1p1d s TYR 59 Ca 0.00 -0.71 0.01 0.00 -2.44 0.00 0.00 57.07 53.93 1p1d s TYR 59 Cb 0.00 -0.23 -0.04 0.00 0.35 0.00 0.00 41.96 42.03 1p1d s TYR 59 CO 0.00 -0.35 -0.04 0.42 -1.34 0.00 0.00 175.55 174.24 1p1d s ILE 60 N -2.92 0.60 0.09 3.14 -1.09 -1.26 -1.47 121.20 118.29 1p1d s ILE 60 Ca -0.02 -1.93 0.04 0.00 -2.23 0.00 0.00 60.65 56.51 1p1d s ILE 60 Cb 0.01 -1.78 -0.04 0.00 -1.58 0.00 0.00 42.46 39.07 1p1d s ILE 60 CO -0.06 -0.78 0.04 -0.70 -1.23 0.00 0.00 174.94 172.21 1p1d s GLU 61 N -3.87 2.71 -0.54 2.79 2.12 0.16 -4.93 118.70 117.14 1p1d s GLU 61 Ca 0.15 -0.78 -0.01 0.00 0.36 0.00 0.00 54.97 54.69 1p1d s GLU 61 Cb 0.06 -2.63 0.38 0.00 0.26 0.00 0.00 34.13 32.20 1p1d s GLU 61 CO -0.03 0.55 2.01 0.00 -0.54 0.00 0.00 175.26 177.25 1p1d n ALA 62 N 0.47 5.86 0.00 6.30 0.00 -1.26 -4.04 120.51 127.84 1p1d n ALA 62 Ca -0.10 -2.81 0.00 0.00 0.00 0.00 0.00 53.44 50.53 1p1d n ALA 62 Cb 0.52 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 -0.50 0.00 -4.11 0.00 -0.08 -1.26 -5.15 116.55 105.46 1p1d n ASP 63 Ca 0.51 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.56 1p1d n ASP 63 Cb 0.68 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.99 1p1d n ASP 63 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1p1d s SER 64 N 0.00 1.75 0.40 1.67 1.04 -1.26 -4.97 113.70 112.34 1p1d s SER 64 Ca 0.00 -0.27 0.24 0.00 0.48 0.00 0.00 55.95 56.40 1p1d s SER 64 Cb 0.00 -0.28 1.31 0.00 0.10 0.00 0.00 66.02 67.15 1p1d s SER 64 CO 0.00 0.16 1.72 1.55 0.98 0.00 0.00 173.24 177.65 1p1d h PRO 65 N 5.93 0.00 -0.02 4.02 0.13 -1.92 -1.25 132.00 138.89 1p1d h PRO 65 Ca -0.34 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.76 1p1d h PRO 65 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1p1d h PRO 65 CO 0.49 0.00 -0.10 0.00 -0.23 0.00 0.00 178.00 178.15 1p1d h ALA 66 N 1.77 0.04 -0.09 -0.56 0.00 -1.86 0.87 119.26 119.44 1p1d h ALA 66 Ca 0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 1p1d h ALA 66 Cb 0.18 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1p1d h ALA 66 CO 0.00 -0.05 -0.49 1.49 0.00 0.00 0.00 179.25 180.19 1p1d h GLU 67 N -0.53 0.23 -0.01 0.00 4.57 -1.56 -2.83 114.58 114.44 1p1d h GLU 67 Ca -0.01 -0.13 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1p1d h GLU 67 Cb 0.77 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.37 1p1d h GLU 67 CO 0.02 0.67 -0.38 0.54 -1.18 0.00 0.00 179.01 178.69 1p1d n ARG 68 N -3.96 0.88 -0.30 1.92 1.74 -0.57 -4.26 116.66 112.12 1p1d n ARG 68 Ca -0.02 -0.61 0.08 0.00 -0.77 0.00 0.00 57.85 56.53 1p1d n ARG 68 Cb 0.54 -1.49 0.23 0.00 -1.02 0.00 0.00 32.46 30.72 1p1d n ARG 68 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1p1d n GLY 70 N -1.33 1.33 2.46 0.00 0.00 -1.26 -4.41 105.19 101.99 1p1d n GLY 70 Ca 0.18 0.00 -0.19 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 -0.67 -3.65 1.61 0.24 -1.26 -4.25 118.33 110.35 1p1d n VAL 71 Ca 0.00 -2.81 -0.04 0.00 -2.04 0.00 0.00 64.34 59.45 1p1d n VAL 71 Cb 0.00 -0.75 -0.06 0.00 -1.47 0.00 0.00 33.84 31.56 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 -0.21 -0.97 0.00 1.34 1.43 -1.26 -4.89 118.68 114.12 1p1d s LEU 72 Ca 0.33 1.41 0.02 0.00 -1.03 0.00 0.00 54.13 54.86 1p1d s LEU 72 Cb 0.09 2.06 -0.01 0.00 0.03 0.00 0.00 46.19 48.37 1p1d s LEU 72 CO -0.15 -0.22 0.25 0.00 0.23 0.00 0.00 176.35 176.45 1p1d n GLN 73 N 5.25 0.36 -1.88 1.70 1.13 -1.26 -4.82 117.38 117.87 1p1d n GLN 73 Ca -0.13 -2.00 -0.42 0.00 -1.94 0.00 0.00 57.00 52.51 1p1d n GLN 73 Cb 0.51 1.77 -0.03 0.00 0.11 0.00 0.00 30.24 32.60 1p1d n GLN 73 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1p1d s ILE 74 N -2.78 2.79 -0.36 5.09 -1.09 -1.26 -3.94 121.20 119.64 1p1d s ILE 74 Ca 0.23 0.37 -0.10 0.00 -2.23 0.00 0.00 60.65 58.91 1p1d s ILE 74 Cb 0.00 -3.24 0.01 0.00 -1.58 0.00 0.00 42.46 37.66 1p1d s ILE 74 CO 0.16 0.01 0.33 0.61 -1.23 0.00 0.00 174.94 174.82 1p1d n GLY 75 N 3.98 -2.40 0.09 6.18 0.00 0.14 -4.93 105.19 108.25 1p1d n GLY 75 Ca 0.16 0.88 -0.10 0.00 0.00 0.00 0.00 46.02 46.96 1p1d n GLY 75 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p1d n ASP 76 N 0.19 0.53 -2.25 1.61 8.00 -1.25 -4.76 116.55 118.61 1p1d n ASP 76 Ca 0.05 0.20 -0.02 0.00 0.71 0.00 0.00 54.79 55.73 1p1d n ASP 76 Cb 0.29 0.41 -0.02 0.00 -0.02 0.00 0.00 41.12 41.78 1p1d n ASP 76 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1p1d n ARG 77 N -2.92 -4.18 -3.83 -1.24 0.63 -1.26 -4.23 116.66 99.63 1p1d n ARG 77 Ca -0.26 3.15 -0.32 0.00 -0.92 0.00 0.00 57.85 59.50 1p1d n ARG 77 Cb 1.10 -4.21 -0.05 0.00 0.45 0.00 0.00 32.46 29.76 1p1d n ARG 77 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1p1d s VAL 78 N -0.53 5.33 -0.06 5.15 0.11 -1.15 -3.66 120.40 125.59 1p1d s VAL 78 Ca -0.10 -0.15 0.11 0.00 -2.93 0.00 0.00 61.98 58.91 1p1d s VAL 78 Cb 0.01 -3.60 -0.16 0.00 -1.53 0.00 0.00 36.38 31.10 1p1d s VAL 78 CO 0.27 0.19 0.15 0.80 -3.33 0.00 0.00 175.10 173.18 1p1d n MET 79 N 0.50 1.28 -3.60 1.54 1.56 0.24 -4.34 117.12 114.30 1p1d n MET 79 Ca -0.06 -0.06 -0.16 0.00 -0.27 0.00 0.00 57.70 57.15 1p1d n MET 79 Cb 0.52 -1.28 -0.07 0.00 2.15 0.00 0.00 33.22 34.54 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 -2.54 -1.64 -0.16 -5.12 0.00 -1.26 -4.38 121.76 106.66 1p1d s ALA 80 Ca -0.05 1.51 -0.02 0.00 0.00 0.00 0.00 51.96 53.40 1p1d s ALA 80 Cb 0.05 -0.51 0.05 0.00 0.00 0.00 0.00 23.12 22.71 1p1d s ALA 80 CO 0.46 -0.34 0.01 0.42 0.00 0.00 0.00 175.76 176.31 1p1d s ILE 81 N -0.47 0.67 -1.44 0.00 1.01 0.12 -3.05 121.20 118.03 1p1d s ILE 81 Ca -0.06 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.12 1p1d s ILE 81 Cb -0.03 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.42 1p1d s ILE 81 CO 0.05 -0.03 0.00 0.59 0.00 0.00 0.00 174.94 175.55 1p1d n ASN 82 N 5.01 -4.15 0.00 3.58 3.02 -0.76 -0.60 115.26 121.37 1p1d n ASN 82 Ca -0.09 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1p1d n ASN 82 Cb 0.48 -3.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.98 1p1d n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p1d n GLY 83 N -0.52 1.60 3.60 7.41 0.00 -1.26 -5.06 105.19 110.96 1p1d n GLY 83 Ca -0.16 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.42 3.58 0.44 -0.61 -1.09 0.23 -4.87 121.20 117.46 1p1d s ILE 84 Ca 0.00 0.60 0.20 0.00 -2.23 0.00 0.00 60.65 59.22 1p1d s ILE 84 Cb 0.00 -3.76 0.23 0.00 -1.58 0.00 0.00 42.46 37.35 1p1d s ILE 84 CO 0.00 -0.47 2.03 1.55 -1.23 0.00 0.00 174.94 176.82 1p1d h PRO 85 N 12.20 0.00 0.00 2.79 0.13 -1.86 0.35 132.00 145.61 1p1d h PRO 85 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1p1d h PRO 85 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1p1d h PRO 85 CO 1.04 0.16 0.00 0.25 -0.23 0.00 0.00 178.00 179.21 1p1d n THR 86 N -4.05 0.00 0.63 1.56 -2.24 -1.26 -4.10 114.28 104.82 1p1d n THR 86 Ca -0.02 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.88 1p1d n THR 86 Cb 0.24 -0.23 0.24 0.00 -2.10 0.00 0.00 70.33 68.47 1p1d n THR 86 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1p1d n GLU 87 N -1.88 0.25 -2.30 -0.78 2.13 -1.26 -3.98 120.64 112.82 1p1d n GLU 87 Ca 0.00 0.10 -0.25 0.00 0.66 0.00 0.00 57.16 57.67 1p1d n GLU 87 Cb 0.04 -1.69 0.01 0.00 0.27 0.00 0.00 31.44 30.08 1p1d n GLU 87 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1p1d n ASP 88 N -2.07 4.65 -3.56 4.31 5.68 -1.26 -5.02 116.55 119.28 1p1d n ASP 88 Ca 0.04 -3.67 -0.10 0.00 -0.50 0.00 0.00 54.79 50.56 1p1d n ASP 88 Cb 0.43 -0.41 -0.04 0.00 -1.14 0.00 0.00 41.12 39.95 1p1d n ASP 88 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1p1d s SER 89 N -3.56 -0.35 1.03 -1.12 1.04 -1.26 -5.13 113.70 104.35 1p1d s SER 89 Ca 0.48 0.28 -0.11 0.00 0.48 0.00 0.00 55.95 57.08 1p1d s SER 89 Cb 0.40 0.31 0.21 0.00 0.10 0.00 0.00 66.02 67.04 1p1d s SER 89 CO -0.09 -0.40 1.10 -0.89 0.98 0.00 0.00 173.24 173.94 1p1d s THR 90 N -1.67 2.01 0.20 2.02 2.01 -1.26 -4.84 115.64 114.11 1p1d s THR 90 Ca 0.01 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.94 1p1d s THR 90 Cb -0.01 -2.01 0.09 0.00 0.01 0.00 0.00 72.50 70.58 1p1d s THR 90 CO -0.01 -0.01 1.69 2.19 -0.69 0.00 0.00 174.62 177.79 1p1d h PHE 91 N -2.24 1.11 -0.65 4.92 -5.15 -1.83 -2.79 116.94 110.31 1p1d h PHE 91 Ca -0.51 -0.17 0.14 0.00 -0.20 0.00 0.00 57.97 57.23 1p1d h PHE 91 Cb 1.30 -0.30 -0.04 0.00 0.22 0.00 0.00 35.95 37.13 1p1d h PHE 91 CO 0.40 0.96 0.44 0.93 -2.00 0.00 0.00 178.31 179.05 1p1d h GLU 92 N 0.95 0.29 0.32 6.09 5.08 -1.95 -1.74 114.58 123.63 1p1d h GLU 92 Ca 0.18 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1p1d h GLU 92 Cb 0.49 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1p1d h GLU 92 CO 0.02 0.19 -0.15 0.93 -1.00 0.00 0.00 179.01 179.00 1p1d h GLU 93 N 0.30 -0.41 -0.91 2.33 5.08 -1.85 -1.17 114.58 117.95 1p1d h GLU 93 Ca 0.31 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.83 1p1d h GLU 93 Cb 0.81 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.08 1p1d h GLU 93 CO -0.08 -0.24 0.58 0.00 -1.00 0.00 0.00 179.01 178.28 1p1d h ALA 94 N 0.18 1.72 -0.69 3.43 0.00 -1.42 0.37 119.26 122.84 1p1d h ALA 94 Ca -0.04 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1p1d h ALA 94 Cb 0.37 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1p1d h ALA 94 CO 0.07 0.06 0.46 -0.91 0.00 0.00 0.00 179.25 178.93 1p1d h ASN 95 N 0.80 0.79 -0.58 0.00 -0.26 -0.79 -1.35 115.58 114.19 1p1d h ASN 95 Ca 0.45 -0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 56.15 1p1d h ASN 95 Cb 0.59 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.63 1p1d h ASN 95 CO -0.21 0.57 0.29 1.56 -1.06 0.00 0.00 177.43 178.58 1p1d h GLN 96 N 0.94 0.83 -0.87 0.81 1.08 0.94 0.37 115.11 119.21 1p1d h GLN 96 Ca 0.26 -0.12 0.12 0.00 -1.45 0.00 0.00 58.65 57.46 1p1d h GLN 96 Cb -0.10 -0.15 -0.08 0.00 -0.05 0.00 0.00 27.48 27.09 1p1d h GLN 96 CO -0.06 0.67 0.49 -0.07 -0.95 0.00 0.00 178.83 178.92 1p1d h LEU 97 N 0.79 0.67 -0.02 1.46 3.38 -0.66 -0.21 115.31 120.71 1p1d h LEU 97 Ca 0.20 0.07 -0.14 0.00 0.09 0.00 0.00 57.88 58.10 1p1d h LEU 97 Cb 0.10 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.81 1p1d h LEU 97 CO -0.03 0.33 -0.52 -0.07 0.09 0.00 0.00 178.44 178.25 1p1d h LEU 98 N 0.76 0.50 -1.80 1.67 4.07 -1.00 0.22 115.31 119.73 1p1d h LEU 98 Ca 0.45 -0.73 0.25 0.00 0.08 0.00 0.00 57.88 57.93 1p1d h LEU 98 Cb 0.53 -0.15 -0.05 0.00 1.08 0.00 0.00 40.66 42.06 1p1d h LEU 98 CO -0.30 1.16 0.65 0.03 -1.08 0.00 0.00 178.44 178.90 1p1d h ARG 99 N -0.12 0.14 -0.82 1.13 3.08 0.54 -0.21 114.38 118.13 1p1d h ARG 99 Ca -0.06 -0.01 -0.45 0.00 0.07 0.00 0.00 59.98 59.53 1p1d h ARG 99 Cb 1.22 -0.03 -0.42 0.00 0.08 0.00 0.00 29.97 30.82 1p1d h ARG 99 CO 0.10 0.10 -0.93 -0.40 -1.07 0.00 0.00 179.97 177.77 1p1d n ASP 100 N -4.37 3.62 -0.08 7.04 5.68 -0.17 -4.81 116.55 123.46 1p1d n ASP 100 Ca 0.20 -3.17 0.06 0.00 -0.50 0.00 0.00 54.79 51.38 1p1d n ASP 100 Cb 0.90 -0.42 0.32 0.00 -1.14 0.00 0.00 41.12 40.79 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1p1d n SER 101 N -0.57 0.23 -0.92 -1.12 3.41 0.78 -3.36 113.62 112.06 1p1d n SER 101 Ca 0.29 -1.68 0.08 0.00 -0.26 0.00 0.00 58.87 57.31 1p1d n SER 101 Cb 0.85 -0.02 0.25 0.00 -0.26 0.00 0.00 64.21 65.04 1p1d n SER 101 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1p1d n SER 102 N -0.53 3.87 0.08 4.04 3.41 -1.26 -4.00 113.62 119.22 1p1d n SER 102 Ca 0.09 -2.87 -0.12 0.00 -0.26 0.00 0.00 58.87 55.72 1p1d n SER 102 Cb 0.08 -0.51 -0.08 0.00 -0.26 0.00 0.00 64.21 63.43 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 1.98 0.87 -0.38 -1.33 2.04 -1.88 -3.17 117.51 115.64 1p1d h ILE 103 Ca 0.00 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 64.88 1p1d h ILE 103 Cb 1.38 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 38.85 1p1d h ILE 103 CO 0.21 0.20 0.00 0.35 0.00 0.00 0.00 178.15 178.91 1p1d n THR 104 N -4.97 0.51 -1.65 -0.27 -2.24 -1.26 -4.89 114.28 99.50 1p1d n THR 104 Ca -0.08 -0.52 -0.20 0.00 -2.27 0.00 0.00 64.05 60.98 1p1d n THR 104 Cb 0.26 0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 68.70 1p1d n THR 104 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1p1d n SER 105 N 0.65 -5.27 -3.51 3.42 7.64 -1.20 -4.90 113.62 110.45 1p1d n SER 105 Ca 0.14 0.45 -0.09 0.00 1.01 0.00 0.00 58.87 60.37 1p1d n SER 105 Cb 0.34 -4.66 -0.03 0.00 -1.01 0.00 0.00 64.21 58.86 1p1d n SER 105 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1p1d s LYS 106 N -3.80 0.83 -0.28 1.43 1.02 -1.26 -2.20 119.74 115.48 1p1d s LYS 106 Ca 0.00 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1p1d s LYS 106 Cb 0.00 0.39 0.17 0.00 -0.52 0.00 0.00 37.83 37.86 1p1d s LYS 106 CO 0.00 -0.35 0.48 0.08 -0.92 0.00 0.00 175.35 174.64 1p1d s VAL 107 N -2.85 -0.78 -0.11 3.17 1.01 0.30 -4.82 120.40 116.31 1p1d s VAL 107 Ca 0.03 -0.09 -0.15 0.00 0.00 0.00 0.00 61.98 61.78 1p1d s VAL 107 Cb -0.01 -0.93 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1p1d s VAL 107 CO -0.07 -0.11 0.35 -0.89 0.00 0.00 0.00 175.10 174.38 1p1d s THR 108 N 2.68 5.23 0.11 3.92 2.01 -1.26 -1.29 115.64 127.05 1p1d s THR 108 Ca 0.14 0.69 -0.03 0.00 0.31 0.00 0.00 61.69 62.79 1p1d s THR 108 Cb -0.14 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 1p1d s THR 108 CO -0.22 0.43 0.09 -1.48 -0.69 0.00 0.00 174.62 172.75 1p1d s LEU 109 N 0.08 1.75 -0.11 4.42 2.34 -0.13 -1.82 118.68 125.21 1p1d s LEU 109 Ca 0.20 -1.04 0.04 0.00 0.06 0.00 0.00 54.13 53.38 1p1d s LEU 109 Cb -0.14 0.51 0.00 0.00 -0.56 0.00 0.00 46.19 46.00 1p1d s LEU 109 CO 0.07 -0.73 -0.23 -1.61 -1.06 0.00 0.00 176.35 172.79 1p1d s GLU 110 N -3.99 2.99 0.18 1.48 2.02 -1.17 0.83 118.70 121.04 1p1d s GLU 110 Ca 0.17 -0.85 0.11 0.00 0.02 0.00 0.00 54.97 54.42 1p1d s GLU 110 Cb 0.07 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.95 1p1d s GLU 110 CO -0.02 0.12 -0.23 0.96 0.02 0.00 0.00 175.26 176.11 1p1d s ILE 111 N 0.49 2.43 -0.18 -1.63 -4.36 0.11 0.83 121.20 118.89 1p1d s ILE 111 Ca -0.15 -1.96 0.01 0.00 -0.26 0.00 0.00 60.65 58.29 1p1d s ILE 111 Cb -0.17 -2.16 0.02 0.00 1.25 0.00 0.00 42.46 41.40 1p1d s ILE 111 CO 0.06 -0.09 -0.19 -0.70 0.24 0.00 0.00 174.94 174.26 1p1d s GLU 112 N -2.60 2.86 0.28 0.37 2.12 -1.24 -0.43 118.70 120.06 1p1d s GLU 112 Ca 0.20 -0.85 0.03 0.00 0.36 0.00 0.00 54.97 54.71 1p1d s GLU 112 Cb -0.08 -2.55 -0.04 0.00 0.26 0.00 0.00 34.13 31.72 1p1d s GLU 112 CO 0.10 -0.24 0.18 -0.59 -0.54 0.00 0.00 175.26 174.16 1p1d s PHE 113 N 1.29 1.51 0.08 5.30 -0.12 -0.64 -4.92 117.98 120.48 1p1d s PHE 113 Ca 0.04 -1.44 -0.15 0.00 -0.05 0.00 0.00 56.93 55.32 1p1d s PHE 113 Cb -0.14 -0.73 -0.06 0.00 -0.63 0.00 0.00 43.02 41.46 1p1d s PHE 113 CO -0.12 -0.64 0.50 -0.51 -0.05 0.00 0.00 175.22 174.40 1p1d s ASP 114 N -3.31 6.86 -0.49 1.98 1.01 -1.26 -0.82 116.67 120.65 1p1d s ASP 114 Ca 0.38 1.06 -0.24 0.00 0.71 0.00 0.00 52.55 54.46 1p1d s ASP 114 Cb 0.05 -2.28 0.03 0.00 1.01 0.00 0.00 42.92 41.73 1p1d s ASP 114 CO 0.18 0.22 0.86 0.68 0.21 0.00 0.00 175.17 177.33 1p1d s VAL 115 N -1.25 4.53 0.00 -1.27 -7.23 -1.25 -4.92 120.40 109.00 1p1d s VAL 115 Ca 0.31 0.39 0.00 0.00 -1.81 0.00 0.00 61.98 60.87 1p1d s VAL 115 Cb -0.17 -4.42 0.00 0.00 0.56 0.00 0.00 36.38 32.35 1p1d s VAL 115 CO 0.17 -0.89 0.00 0.00 -0.31 0.00 0.00 175.10 174.07 1p1d n ALA 116 N 7.05 0.00 -2.10 1.32 0.00 -0.07 -4.54 120.51 122.18 1p1d n ALA 116 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.46 1p1d n ALA 116 Cb 0.48 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.03 0.00 -1.19 0.00 -0.58 -1.25 -4.55 120.64 113.04 1p1d n GLU 117 Ca 0.00 -0.89 0.00 0.00 -0.42 0.00 0.00 57.16 55.85 1p1d n GLU 117 Cb 0.00 -0.06 0.00 0.00 -0.57 0.00 0.00 31.44 30.81 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 0.10 -1.63 -3.80 1.62 2.88 -1.26 -3.96 113.62 107.57 1p1d n SER 118 Ca -0.04 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.28 1p1d n SER 118 Cb 0.73 -0.82 -0.17 0.00 -0.75 0.00 0.00 64.21 63.20 1p1d n SER 118 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1p1d s VAL 119 N 0.00 0.40 -0.47 2.46 1.01 -1.26 -1.15 120.40 121.40 1p1d s VAL 119 Ca 0.00 0.06 -0.17 0.00 0.00 0.00 0.00 61.98 61.87 1p1d s VAL 119 Cb 0.00 -0.52 0.05 0.00 0.00 0.00 0.00 36.38 35.91 1p1d s VAL 119 CO 0.00 0.24 0.49 0.27 0.00 0.00 0.00 175.10 176.10 1p1d s ILE 120 N 1.65 5.06 -0.07 2.22 -5.25 0.06 -4.98 121.20 119.88 1p1d s ILE 120 Ca 0.00 -0.62 -0.13 0.00 -0.99 0.00 0.00 60.65 58.91 1p1d s ILE 120 Cb -0.13 -4.15 -0.05 0.00 2.95 0.00 0.00 42.46 41.08 1p1d s ILE 120 CO -0.04 -0.60 0.33 -2.16 -1.79 0.00 0.00 174.94 170.68 1p1d s PRO 121 N 2.15 3.92 0.00 0.37 0.04 -1.26 -2.42 135.00 137.80 1p1d s PRO 121 Ca 0.11 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.37 1p1d s PRO 121 Cb -0.20 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.06 1p1d s PRO 121 CO 0.11 0.57 0.00 -1.13 0.04 0.00 0.00 177.00 176.59 1p1d n SER 122 N 2.39 0.00 0.00 6.66 3.41 -1.26 -5.07 113.62 119.74 1p1d n SER 122 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 1p1d n SER 122 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.95 0.00 0.00 4.04 3.41 -1.26 -4.97 113.62 113.89 1p1d n SER 123 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1p1d n SER 123 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 0.00 2.81 2.60 5.00 0.00 -1.22 -4.91 105.19 109.47 1p1d n GLY 124 Ca 0.00 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.95 0.11 -0.26 2.61 2.01 -1.25 -2.20 115.64 114.72 1p1d s THR 125 Ca 0.00 -0.73 -0.09 0.00 0.31 0.00 0.00 61.69 61.18 1p1d s THR 125 Cb 0.00 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.46 1p1d s THR 125 CO 0.00 -0.60 0.12 0.12 -0.69 0.00 0.00 174.62 173.57 1p1d s PHE 126 N 2.02 3.16 -0.16 4.92 2.19 0.19 -4.26 117.98 126.03 1p1d s PHE 126 Ca 0.07 -0.15 -0.06 0.00 0.33 0.00 0.00 56.93 57.13 1p1d s PHE 126 Cb -0.16 -2.28 -0.04 0.00 -1.31 0.00 0.00 43.02 39.23 1p1d s PHE 126 CO -0.28 -0.22 0.02 -1.01 1.83 0.00 0.00 175.22 175.56 1p1d s HIS 127 N 1.55 3.17 -0.77 10.12 3.76 -1.01 0.05 115.29 132.16 1p1d s HIS 127 Ca 0.06 -0.04 -0.04 0.00 -0.15 0.00 0.00 55.06 54.89 1p1d s HIS 127 Cb -0.15 -2.01 0.20 0.00 1.11 0.00 0.00 32.58 31.72 1p1d s HIS 127 CO 0.06 0.12 0.64 0.08 -0.85 0.00 0.00 174.74 174.79 1p1d s VAL 128 N 0.25 4.32 -0.76 -0.90 1.01 -0.28 -0.76 120.40 123.28 1p1d s VAL 128 Ca 0.01 -3.24 -0.26 0.00 0.00 0.00 0.00 61.98 58.49 1p1d s VAL 128 Cb -0.13 -3.73 0.04 0.00 0.00 0.00 0.00 36.38 32.56 1p1d s VAL 128 CO 0.01 -0.99 1.25 -0.54 0.00 0.00 0.00 175.10 174.84 1p1d s LYS 129 N -0.56 3.22 -0.13 2.72 -0.14 -0.30 -2.16 119.74 122.40 1p1d s LYS 129 Ca 0.21 -0.42 0.03 0.00 -1.36 0.00 0.00 55.97 54.43 1p1d s LYS 129 Cb -0.14 -4.31 0.01 0.00 -1.68 0.00 0.00 37.83 31.71 1p1d s LYS 129 CO -0.08 -2.11 -0.21 -0.48 -0.76 0.00 0.00 175.35 171.71 1p1d s LEU 130 N 5.42 2.07 -0.10 3.17 0.05 -0.97 -4.09 118.68 124.23 1p1d s LEU 130 Ca 0.34 -0.58 -0.30 0.00 0.05 0.00 0.00 54.13 53.64 1p1d s LEU 130 Cb -0.08 -1.41 -0.08 0.00 -2.05 0.00 0.00 46.19 42.57 1p1d s LEU 130 CO 0.12 0.08 2.07 -0.81 -0.55 0.00 0.00 176.35 177.25 1p1d n PRO 131 N 4.05 2.32 -3.35 1.48 -0.04 -1.26 -1.89 135.00 136.31 1p1d n PRO 131 Ca -0.20 0.78 -0.31 0.00 -0.04 0.00 0.00 63.50 63.73 1p1d n PRO 131 Cb 0.52 -3.00 -0.05 0.00 -0.04 0.00 0.00 33.50 30.93 1p1d n PRO 131 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1p1d s LYS 132 N 5.22 3.77 0.00 0.54 2.20 -0.75 -4.85 119.74 125.87 1p1d s LYS 132 Ca 0.95 0.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.81 1p1d s LYS 132 Cb -0.47 -2.62 0.00 0.00 -1.51 0.00 0.00 37.83 33.23 1p1d s LYS 132 CO 0.42 0.26 0.00 1.63 -0.36 0.00 0.00 175.35 177.30 1p1d n LYS 133 N -0.40 0.43 0.07 4.03 5.02 -1.26 -3.75 118.16 122.30 1p1d n LYS 133 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.23 1p1d n LYS 133 Cb 0.53 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.63 1p1d n LYS 133 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1p1d h HIS 134 N -0.64 0.38 0.00 2.13 -0.00 -1.99 -3.27 115.15 111.76 1p1d h HIS 134 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 60.37 60.22 1p1d h HIS 134 Cb 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 27.35 1p1d h HIS 134 CO 0.00 0.85 0.00 0.43 -0.00 0.00 0.00 177.93 179.21 1p1d n SER 135 N -3.86 0.00 -4.77 3.26 7.64 -1.26 -4.92 113.62 109.71 1p1d n SER 135 Ca -0.03 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.55 1p1d n SER 135 Cb 0.64 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.94 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 0.00 3.21 0.87 0.44 1.01 -1.26 -4.98 120.40 119.68 1p1d s VAL 136 Ca 0.00 0.39 -0.14 0.00 0.00 0.00 0.00 61.98 62.23 1p1d s VAL 136 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1p1d s VAL 136 CO 0.00 -0.51 0.41 -1.84 0.00 0.00 0.00 175.10 173.16 1p1d n GLU 137 N -3.52 -0.06 -3.15 2.72 -0.00 -1.26 -4.98 120.64 110.39 1p1d n GLU 137 Ca 0.08 0.03 0.04 0.00 -0.00 0.00 0.00 57.16 57.31 1p1d n GLU 137 Cb 0.55 -1.82 -0.01 0.00 -0.00 0.00 0.00 31.44 30.16 1p1d n GLU 137 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1p1d s LEU 138 N -0.46 -1.08 -0.33 -1.84 2.96 -1.26 -4.79 118.68 111.88 1p1d s LEU 138 Ca 0.59 0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 55.05 1p1d s LEU 138 Cb -0.26 1.86 0.23 0.00 0.50 0.00 0.00 46.19 48.52 1p1d s LEU 138 CO 0.64 -0.20 1.99 0.61 -1.32 0.00 0.00 176.35 178.08 1p1d n GLY 139 N 5.42 4.14 3.67 7.98 0.00 -1.26 -4.92 105.19 120.22 1p1d n GLY 139 Ca -0.01 -1.12 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 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 -2.36 4.90 -0.02 -0.61 -1.09 -1.26 -1.61 121.20 119.15 1p1d s ILE 140 Ca 0.32 1.60 0.05 0.00 -2.23 0.00 0.00 60.65 60.39 1p1d s ILE 140 Cb 0.25 -4.12 -0.03 0.00 -1.58 0.00 0.00 42.46 36.98 1p1d s ILE 140 CO -0.00 0.05 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.69 1p1d s THR 141 N 2.02 2.81 0.32 2.92 2.01 0.14 -4.97 115.64 120.89 1p1d s THR 141 Ca 0.38 -0.93 0.09 0.00 0.31 0.00 0.00 61.69 61.54 1p1d s THR 141 Cb -0.17 -2.11 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 1p1d s THR 141 CO 0.13 0.51 0.04 -0.63 -0.69 0.00 0.00 174.62 173.98 1p1d s ILE 142 N -0.77 2.88 -0.04 1.82 1.01 -1.26 -0.57 121.20 124.26 1p1d s ILE 142 Ca 0.12 -1.90 -0.29 0.00 0.00 0.00 0.00 60.65 58.58 1p1d s ILE 142 Cb -0.10 -2.84 0.10 0.00 0.01 0.00 0.00 42.46 39.63 1p1d s ILE 142 CO 0.02 -0.23 0.88 -0.55 0.00 0.00 0.00 174.94 175.06 1p1d s SER 143 N -3.74 -0.40 0.03 3.58 0.15 0.35 -4.50 113.70 109.18 1p1d s SER 143 Ca 0.35 0.17 0.07 0.00 0.70 0.00 0.00 55.95 57.24 1p1d s SER 143 Cb -0.02 0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 64.64 1p1d s SER 143 CO 0.20 -0.56 -0.17 -0.55 1.20 0.00 0.00 173.24 173.36 1p1d s SER 144 N -2.00 3.90 1.11 5.45 0.15 -1.26 -0.11 113.70 120.93 1p1d s SER 144 Ca 0.01 -0.39 -0.16 0.00 0.70 0.00 0.00 55.95 56.12 1p1d s SER 144 Cb -0.01 -0.67 0.24 0.00 -1.71 0.00 0.00 66.02 63.87 1p1d s SER 144 CO -0.05 0.26 1.11 -2.16 1.20 0.00 0.00 173.24 173.61 1p1d s PRO 145 N -1.41 -0.46 -0.78 5.44 0.04 -1.26 -4.96 135.00 131.62 1p1d s PRO 145 Ca 0.15 0.15 -0.01 0.00 0.04 0.00 0.00 61.00 61.32 1p1d s PRO 145 Cb -0.11 -1.67 0.38 0.00 0.04 0.00 0.00 34.50 33.14 1p1d s PRO 145 CO 0.05 -3.25 1.95 0.43 0.04 0.00 0.00 177.00 176.23 1p1d n SER 146 N -4.47 7.33 -0.36 6.66 7.64 -1.26 -4.58 113.62 124.57 1p1d n SER 146 Ca 0.10 -3.82 0.12 0.00 1.01 0.00 0.00 58.87 56.27 1p1d n SER 146 Cb 0.59 -1.00 0.50 0.00 -1.01 0.00 0.00 64.21 63.29 1p1d n SER 146 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1p1d n SER 147 N -0.61 1.11 -3.41 6.43 2.88 -1.26 -4.92 113.62 113.83 1p1d n SER 147 Ca 0.55 -1.53 -0.20 0.00 -1.33 0.00 0.00 58.87 56.36 1p1d n SER 147 Cb 0.36 -0.05 0.08 0.00 -0.75 0.00 0.00 64.21 63.85 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 -0.08 -7.03 -4.40 -1.46 5.12 -1.26 -5.02 116.66 102.52 1p1d n ARG 148 Ca 0.17 0.81 -0.21 0.00 -1.93 0.00 0.00 57.85 56.69 1p1d n ARG 148 Cb 0.26 -5.76 -0.10 0.00 -1.16 0.00 0.00 32.46 25.70 1p1d n ARG 148 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 1p1d s LYS 149 N -5.78 1.49 -0.83 5.56 0.00 -1.26 -5.03 119.74 113.90 1p1d s LYS 149 Ca 0.27 -1.69 -0.08 0.00 0.00 0.00 0.00 55.97 54.47 1p1d s LYS 149 Cb -0.12 -1.34 -0.07 0.00 0.00 0.00 0.00 37.83 36.30 1p1d s LYS 149 CO 0.70 0.20 2.00 -0.35 0.00 0.00 0.00 175.35 177.91 1p1d n PRO 150 N -0.50 1.84 -4.02 1.78 -0.04 -1.26 -4.38 135.00 128.41 1p1d n PRO 150 Ca -0.07 -1.46 -0.32 0.00 -0.04 0.00 0.00 63.50 61.62 1p1d n PRO 150 Cb 0.61 -2.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 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 3.92 -0.44 0.51 0.55 0.00 -1.26 -4.81 105.19 103.66 1p1d n GLY 151 Ca 0.42 0.16 -0.19 0.00 0.00 0.00 0.00 46.02 46.42 1p1d n GLY 151 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1p1d h ASP 152 N -1.84 -1.39 -5.73 1.61 1.82 -1.90 -3.36 116.42 105.63 1p1d h ASP 152 Ca -0.59 0.11 -0.47 0.00 -0.39 0.00 0.00 57.03 55.69 1p1d h ASP 152 Cb 1.38 0.45 0.08 0.00 0.68 0.00 0.00 39.33 41.92 1p1d h ASP 152 CO 0.70 -0.69 0.09 -0.81 -1.61 0.00 0.00 179.24 176.92 1p1d n PRO 153 N -5.58 -0.01 -4.09 0.28 -0.04 -1.26 -4.65 135.00 119.65 1p1d n PRO 153 Ca -0.13 -2.80 -0.10 0.00 -0.04 0.00 0.00 63.50 60.43 1p1d n PRO 153 Cb 0.47 -0.60 -0.11 0.00 -0.04 0.00 0.00 33.50 33.22 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 2.39 0.13 1.53 2.01 -1.25 -4.78 118.68 118.70 1p1d s LEU 154 Ca 0.66 -0.79 -0.14 0.00 0.01 0.00 0.00 54.13 53.87 1p1d s LEU 154 Cb -0.04 -0.01 0.02 0.00 0.01 0.00 0.00 46.19 46.17 1p1d s LEU 154 CO 0.43 -0.39 0.35 -0.69 1.01 0.00 0.00 176.35 177.07 1p1d s VAL 155 N -2.68 0.08 0.21 -1.59 1.01 0.85 -0.90 120.40 117.38 1p1d s VAL 155 Ca -0.00 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 1p1d s VAL 155 Cb -0.01 -1.34 -0.05 0.00 0.00 0.00 0.00 36.38 34.98 1p1d s VAL 155 CO -0.04 -0.37 0.45 -0.63 0.00 0.00 0.00 175.10 174.52 1p1d s ILE 156 N -3.84 5.10 0.00 2.22 1.01 -1.26 0.13 121.20 124.56 1p1d s ILE 156 Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1p1d s ILE 156 Cb 0.02 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1p1d s ILE 156 CO -0.09 -0.12 0.00 -1.20 0.00 0.00 0.00 174.94 173.52 1p1d n SER 157 N -0.39 2.15 0.00 3.58 7.64 0.26 -4.58 113.62 122.28 1p1d n SER 157 Ca -0.02 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.75 1p1d n SER 157 Cb 0.53 0.64 0.00 0.00 -1.01 0.00 0.00 64.21 64.37 1p1d n SER 157 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1p1d n ASP 158 N -0.86 0.00 -3.93 6.43 2.03 -1.25 -4.95 116.55 114.02 1p1d n ASP 158 Ca 0.00 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.05 1p1d n ASP 158 Cb 0.00 0.00 -0.17 0.00 -0.72 0.00 0.00 41.12 40.23 1p1d n ASP 158 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1p1d s ILE 159 N -0.78 1.02 0.42 5.18 1.01 -1.22 0.27 121.20 127.10 1p1d s ILE 159 Ca 0.00 -0.32 -0.10 0.00 0.00 0.00 0.00 60.65 60.23 1p1d s ILE 159 Cb 0.00 -1.01 -0.06 0.00 0.01 0.00 0.00 42.46 41.40 1p1d s ILE 159 CO 0.00 0.36 0.78 -0.75 0.00 0.00 0.00 174.94 175.32 1p1d s LYS 160 N 1.41 3.74 1.01 2.79 2.36 -0.63 -4.99 119.74 125.43 1p1d s LYS 160 Ca -0.01 0.44 -0.17 0.00 -2.55 0.00 0.00 55.97 53.68 1p1d s LYS 160 Cb -0.13 -2.38 0.23 0.00 -1.05 0.00 0.00 37.83 34.49 1p1d s LYS 160 CO -0.05 -0.07 1.35 0.15 1.55 0.00 0.00 175.35 178.28 1p1d s LYS 161 N -4.00 0.26 0.00 4.03 1.02 -1.26 -4.29 119.74 115.49 1p1d s LYS 161 Ca 0.51 -0.52 0.00 0.00 0.02 0.00 0.00 55.97 55.98 1p1d s LYS 161 Cb -0.10 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.40 1p1d s LYS 161 CO 0.34 -2.66 0.00 0.41 -0.92 0.00 0.00 175.35 172.52 1p1d n GLY 162 N -3.75 1.55 3.74 -3.33 0.00 -1.26 -4.88 105.19 97.26 1p1d n GLY 162 Ca 0.17 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1p1d n GLY 162 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p1d n SER 163 N 3.44 2.92 0.31 1.61 7.64 -1.26 -4.83 113.62 123.45 1p1d n SER 163 Ca 0.00 1.06 0.19 0.00 1.01 0.00 0.00 58.87 61.12 1p1d n SER 163 Cb 0.00 -1.57 0.97 0.00 -1.01 0.00 0.00 64.21 62.60 1p1d n SER 163 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 1p1d h VAL 164 N 1.89 0.09 0.00 0.44 -1.51 -1.90 -2.08 116.25 113.18 1p1d h VAL 164 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 1p1d h VAL 164 Cb 1.29 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1p1d h VAL 164 CO 0.59 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.93 1p1d n ALA 165 N -2.04 -0.40 0.25 5.19 0.00 -1.26 -1.93 120.51 120.31 1p1d n ALA 165 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1p1d n ALA 165 Cb 0.26 0.01 0.65 0.00 0.00 0.00 0.00 19.45 20.38 1p1d n ALA 165 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1p1d h HIS 166 N 0.00 0.00 -0.79 0.00 6.17 -1.76 -2.72 115.15 116.05 1p1d h HIS 166 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 60.37 61.14 1p1d h HIS 166 Cb 0.00 0.00 -0.06 0.00 2.52 0.00 0.00 27.41 29.87 1p1d h HIS 166 CO 0.16 0.15 0.47 0.00 0.71 0.00 0.00 177.93 179.42 1p1d h ARG 167 N 0.00 0.83 -0.97 5.26 -0.00 -1.31 -0.85 114.38 117.35 1p1d h ARG 167 Ca -0.00 -0.05 0.28 0.00 -0.50 0.00 0.00 59.98 59.71 1p1d h ARG 167 Cb 0.44 -0.19 -0.04 0.00 0.00 0.00 0.00 29.97 30.18 1p1d h ARG 167 CO 0.02 0.55 0.70 0.00 0.00 0.00 0.00 179.97 181.24 1p1d h THR 168 N 0.86 0.52 -5.19 2.04 1.03 -1.05 -0.15 112.91 110.96 1p1d h THR 168 Ca 0.35 -0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.75 1p1d h THR 168 Cb 0.19 0.51 0.00 0.00 -1.07 0.00 0.00 68.15 67.78 1p1d h THR 168 CO -0.18 0.00 -0.96 0.61 -0.01 0.00 0.00 175.52 174.98 1p1d n GLY 169 N -1.73 -3.97 0.00 2.99 0.00 -0.32 -2.73 105.19 99.43 1p1d n GLY 169 Ca 0.20 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.74 1p1d n GLY 169 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1p1d n THR 170 N 0.64 0.00 -1.98 2.61 5.66 -1.26 -4.83 114.28 115.13 1p1d n THR 170 Ca 0.01 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.67 1p1d n THR 170 Cb 0.05 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 68.86 1p1d n THR 170 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1p1d s LEU 171 N -1.02 3.55 0.01 1.09 0.05 -1.26 -5.06 118.68 116.05 1p1d s LEU 171 Ca 0.00 2.10 -0.11 0.00 0.05 0.00 0.00 54.13 56.16 1p1d s LEU 171 Cb 0.00 -4.57 0.01 0.00 -2.05 0.00 0.00 46.19 39.59 1p1d s LEU 171 CO 0.00 -1.47 0.24 -1.61 -0.55 0.00 0.00 176.35 172.96 1p1d s GLU 172 N -3.71 0.64 -0.07 1.48 2.02 -1.26 -5.10 118.70 112.70 1p1d s GLU 172 Ca 0.70 -0.40 -0.28 0.00 0.02 0.00 0.00 54.97 55.02 1p1d s GLU 172 Cb -0.22 0.28 -0.02 0.00 0.10 0.00 0.00 34.13 34.26 1p1d s GLU 172 CO 0.35 -0.18 0.90 -0.51 0.02 0.00 0.00 175.26 175.84 1p1d s LEU 173 N -1.63 4.30 0.00 1.80 1.43 -1.26 -4.08 118.68 119.24 1p1d s LEU 173 Ca -0.11 1.44 0.00 0.00 -1.03 0.00 0.00 54.13 54.43 1p1d s LEU 173 Cb -0.04 -3.40 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1p1d s LEU 173 CO 0.01 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 176.90 1p1d n GLY 174 N 3.09 1.88 0.00 -3.19 0.00 -1.26 -5.09 105.19 100.62 1p1d n GLY 174 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1p1d n GLY 174 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p1d n ASP 175 N 0.00 1.62 -3.95 1.61 8.00 -1.26 -5.11 116.55 117.46 1p1d n ASP 175 Ca 0.00 -0.90 -0.28 0.00 0.71 0.00 0.00 54.79 54.32 1p1d n ASP 175 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 40.93 1p1d n ASP 175 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1p1d s LYS 176 N -1.65 1.81 0.34 -1.24 2.47 -1.26 -4.64 119.74 115.57 1p1d s LYS 176 Ca 0.00 -0.37 -0.26 0.00 -1.56 0.00 0.00 55.97 53.78 1p1d s LYS 176 Cb 0.00 -1.75 -0.10 0.00 -1.46 0.00 0.00 37.83 34.52 1p1d s LYS 176 CO 0.00 -0.23 0.99 -0.51 0.16 0.00 0.00 175.35 175.76 1p1d s LEU 177 N 1.54 4.29 0.00 5.43 1.43 -0.08 -0.41 118.68 130.89 1p1d s LEU 177 Ca 0.03 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.07 1p1d s LEU 177 Cb -0.13 -4.04 0.00 0.00 0.03 0.00 0.00 46.19 42.05 1p1d s LEU 177 CO -0.08 -0.21 0.00 -0.11 0.23 0.00 0.00 176.35 176.18 1p1d n LEU 178 N 0.41 2.54 -3.97 1.79 0.00 0.38 -3.94 117.00 114.22 1p1d n LEU 178 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 56.01 55.94 1p1d n LEU 178 Cb 0.49 0.00 -0.06 0.00 0.00 0.00 0.00 43.42 43.85 1p1d n LEU 178 CO 0.45 0.42 0.04 0.00 0.00 0.00 0.00 177.39 178.31 1p1d s ALA 179 N -1.99 -0.06 -0.07 1.96 0.00 -1.23 -1.30 121.76 119.07 1p1d s ALA 179 Ca 0.00 -0.88 -0.03 0.00 0.00 0.00 0.00 51.96 51.05 1p1d s ALA 179 Cb 0.00 0.95 0.04 0.00 0.00 0.00 0.00 23.12 24.11 1p1d s ALA 179 CO 0.00 -0.71 0.07 0.42 0.00 0.00 0.00 175.76 175.53 1p1d s ILE 180 N -3.99 -0.09 0.00 0.00 -1.09 0.16 -2.46 121.20 113.73 1p1d s ILE 180 Ca 0.19 0.28 0.00 0.00 -2.23 0.00 0.00 60.65 58.89 1p1d s ILE 180 Cb 0.02 -0.26 0.00 0.00 -1.58 0.00 0.00 42.46 40.64 1p1d s ILE 180 CO 0.03 0.08 0.00 -0.67 -1.23 0.00 0.00 174.94 173.14 1p1d n ASP 181 N 5.29 0.00 0.00 3.58 2.03 -0.32 -0.54 116.55 126.59 1p1d n ASP 181 Ca -0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1p1d n ASP 181 Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 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 2.08 1.23 -4.95 1.67 2.85 -1.26 -4.69 115.26 112.19 1p1d n ASN 182 Ca 0.00 -0.20 -0.23 0.00 -0.11 0.00 0.00 54.58 54.04 1p1d n ASN 182 Cb 0.00 0.64 -0.02 0.00 1.24 0.00 0.00 39.78 41.64 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 -0.88 5.17 -0.16 -1.44 -1.09 0.30 -5.10 121.20 118.00 1p1d s ILE 183 Ca 0.00 -0.63 0.01 0.00 -2.23 0.00 0.00 60.65 57.80 1p1d s ILE 183 Cb 0.00 -3.85 0.01 0.00 -1.58 0.00 0.00 42.46 37.04 1p1d s ILE 183 CO 0.00 -0.43 -0.19 -0.13 -1.23 0.00 0.00 174.94 172.96 1p1d s ARG 184 N -4.08 3.08 0.16 2.79 0.52 -1.26 0.37 118.95 120.53 1p1d s ARG 184 Ca 0.38 -0.81 0.26 0.00 -0.52 0.00 0.00 55.73 55.03 1p1d s ARG 184 Cb -0.10 -2.55 0.92 0.00 0.52 0.00 0.00 34.95 33.75 1p1d s ARG 184 CO 0.33 -0.06 1.78 1.28 0.02 0.00 0.00 175.30 178.64 1p1d n LEU 185 N 4.23 0.56 -0.34 2.53 4.77 -0.42 -3.13 117.00 125.21 1p1d n LEU 185 Ca -0.20 0.57 0.37 0.00 -0.03 0.00 0.00 56.01 56.72 1p1d n LEU 185 Cb 0.51 -0.42 0.73 0.00 -2.33 0.00 0.00 43.42 41.92 1p1d n LEU 185 CO 0.27 -0.22 1.34 -0.78 -1.33 0.00 0.00 177.39 176.67 1p1d h ASP 186 N 0.00 0.00 0.00 -1.43 3.58 -1.58 -0.30 116.42 116.68 1p1d h ASP 186 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1p1d h ASP 186 Cb 0.59 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.64 1p1d h ASP 186 CO 0.00 0.00 0.00 -1.54 -2.88 0.00 0.00 179.24 174.82 1p1d n SER 187 N -3.97 0.32 -4.77 2.28 3.41 -1.22 -4.91 113.62 104.76 1p1d n SER 187 Ca 0.27 -0.66 -0.37 0.00 -0.26 0.00 0.00 58.87 57.86 1p1d n SER 187 Cb 1.37 0.34 -0.07 0.00 -0.26 0.00 0.00 64.21 65.59 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 3.06 -3.60 0.26 0.00 2.88 -1.26 -4.62 113.62 110.34 1p1d n SER 189 Ca -0.13 -0.65 -0.14 0.00 -1.33 0.00 0.00 58.87 56.62 1p1d n SER 189 Cb 0.52 -0.79 -0.07 0.00 -0.75 0.00 0.00 64.21 63.12 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 -0.66 -0.88 -1.46 4.05 -1.87 -1.81 114.93 112.31 1p1d h MET 190 Ca -0.29 0.05 0.08 0.00 -0.28 0.00 0.00 59.70 59.26 1p1d h MET 190 Cb 0.99 0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 31.88 1p1d h MET 190 CO 0.18 -0.36 0.57 0.93 0.23 0.00 0.00 176.91 178.46 1p1d h GLU 191 N -1.00 0.88 -0.53 0.39 5.08 -1.96 -0.86 114.58 116.58 1p1d h GLU 191 Ca -0.07 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1p1d h GLU 191 Cb 0.61 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 1p1d h GLU 191 CO 0.12 0.58 0.35 -0.44 -1.00 0.00 0.00 179.01 178.61 1p1d h ASP 192 N 0.91 0.59 -0.74 1.42 5.19 -1.88 -1.58 116.42 120.32 1p1d h ASP 192 Ca 0.39 -0.01 0.05 0.00 -0.62 0.00 0.00 57.03 56.84 1p1d h ASP 192 Cb 0.33 -0.14 -0.05 0.00 0.18 0.00 0.00 39.33 39.65 1p1d h ASP 192 CO -0.16 0.42 0.45 0.00 -3.12 0.00 0.00 179.24 176.84 1p1d h ALA 193 N 1.20 0.99 -0.36 3.45 0.00 -0.27 0.13 119.26 124.41 1p1d h ALA 193 Ca 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1p1d h ALA 193 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1p1d h ALA 193 CO -0.05 0.20 0.20 0.28 0.00 0.00 0.00 179.25 179.87 1p1d h VAL 194 N 0.86 1.11 0.02 0.00 2.07 -0.79 0.63 116.25 120.15 1p1d h VAL 194 Ca 0.31 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 1p1d h VAL 194 Cb 0.10 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1p1d h VAL 194 CO -0.14 0.12 -0.01 1.56 0.02 0.00 0.00 177.57 179.12 1p1d h GLN 195 N 0.49 -0.02 0.00 1.57 4.20 -0.04 -1.36 115.11 119.95 1p1d h GLN 195 Ca 0.13 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 1p1d h GLN 195 Cb 0.01 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1p1d h GLN 195 CO -0.02 0.03 -0.32 0.82 -0.67 0.00 0.00 178.83 178.67 1p1d h ILE 196 N -0.07 0.69 0.00 2.54 5.03 -0.75 0.38 117.51 125.32 1p1d h ILE 196 Ca -0.00 -1.46 -0.04 0.00 -0.12 0.00 0.00 64.86 63.24 1p1d h ILE 196 Cb 0.06 1.96 -0.01 0.00 -3.03 0.00 0.00 36.82 35.81 1p1d h ILE 196 CO 0.00 0.31 -0.18 0.25 -0.68 0.00 0.00 178.15 177.85 1p1d h LEU 197 N 0.00 0.00 0.00 1.44 5.85 0.98 -1.87 115.31 121.72 1p1d h LEU 197 Ca -0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.40 1p1d h LEU 197 Cb 0.93 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.91 1p1d h LEU 197 CO 0.04 0.18 -2.18 0.00 -0.34 0.00 0.00 178.44 176.15 1p1d n GLN 198 N -4.09 0.99 0.19 1.25 6.02 -0.58 -4.33 117.38 116.83 1p1d n GLN 198 Ca -0.02 0.04 0.14 0.00 -0.01 0.00 0.00 57.00 57.15 1p1d n GLN 198 Cb 0.26 -1.43 0.66 0.00 1.02 0.00 0.00 30.24 30.75 1p1d n GLN 198 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 1p1d h GLN 199 N 0.00 0.00 -1.82 -1.09 -0.00 -0.15 -2.91 115.11 109.14 1p1d h GLN 199 Ca -0.46 0.00 -0.27 0.00 -0.00 0.00 0.00 58.65 57.92 1p1d h GLN 199 Cb 1.93 0.00 -0.10 0.00 0.00 0.00 0.00 27.48 29.30 1p1d h GLN 199 CO -0.01 0.00 0.18 0.00 0.00 0.00 0.00 178.83 179.00 1p1d n GLU 201 N 1.10 1.90 0.00 0.00 0.28 -1.10 -2.20 120.64 120.61 1p1d n GLU 201 Ca 0.30 -1.50 0.00 0.00 -0.16 0.00 0.00 57.16 55.79 1p1d n GLU 201 Cb 0.61 -2.53 0.00 0.00 1.43 0.00 0.00 31.44 30.95 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 4.88 0.00 -3.15 -1.84 8.00 -1.23 -4.55 116.55 118.66 1p1d n ASP 202 Ca 0.44 0.00 0.06 0.00 0.71 0.00 0.00 54.79 56.00 1p1d n ASP 202 Cb 0.18 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.27 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 -0.04 -0.23 -0.32 0.64 2.96 -0.94 -1.81 118.68 118.95 1p1d s LEU 203 Ca 0.00 0.11 -0.11 0.00 -0.22 0.00 0.00 54.13 53.90 1p1d s LEU 203 Cb 0.00 1.18 -0.01 0.00 0.50 0.00 0.00 46.19 47.85 1p1d s LEU 203 CO 0.00 -0.04 0.20 -0.69 -1.32 0.00 0.00 176.35 174.49 1p1d s VAL 204 N 2.98 4.97 -0.40 1.68 1.01 -0.79 -4.60 120.40 125.25 1p1d s VAL 204 Ca 0.04 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 1p1d s VAL 204 Cb -0.07 -3.53 0.04 0.00 0.00 0.00 0.00 36.38 32.82 1p1d s VAL 204 CO -0.13 0.04 0.24 -0.75 0.00 0.00 0.00 175.10 174.50 1p1d s LYS 205 N 1.67 2.78 -0.61 2.72 2.20 -1.25 -2.29 119.74 124.97 1p1d s LYS 205 Ca 0.05 -1.20 -0.23 0.00 -0.36 0.00 0.00 55.97 54.23 1p1d s LYS 205 Cb -0.17 -3.79 0.06 0.00 -1.51 0.00 0.00 37.83 32.42 1p1d s LYS 205 CO 0.09 -0.80 0.94 -0.51 -0.36 0.00 0.00 175.35 174.71 1p1d s LEU 206 N 1.53 4.26 -0.80 5.43 2.01 -0.92 -1.18 118.68 129.02 1p1d s LEU 206 Ca 0.02 -0.71 -0.18 0.00 0.01 0.00 0.00 54.13 53.27 1p1d s LEU 206 Cb -0.21 -2.59 0.13 0.00 0.01 0.00 0.00 46.19 43.54 1p1d s LEU 206 CO 0.06 -1.33 0.94 -0.75 1.01 0.00 0.00 176.35 176.28 1p1d s LYS 207 N 3.98 3.42 0.44 1.70 2.20 -1.03 -1.13 119.74 129.32 1p1d s LYS 207 Ca 0.25 -1.69 -0.00 0.00 -0.36 0.00 0.00 55.97 54.17 1p1d s LYS 207 Cb -0.15 -4.60 -0.01 0.00 -1.51 0.00 0.00 37.83 31.56 1p1d s LYS 207 CO 0.14 -1.64 0.66 0.42 -0.36 0.00 0.00 175.35 174.58 1p1d s ILE 208 N 2.37 4.21 -0.19 5.43 -1.09 0.11 -0.47 121.20 131.56 1p1d s ILE 208 Ca 0.24 -0.44 -0.05 0.00 -2.23 0.00 0.00 60.65 58.17 1p1d s ILE 208 Cb -0.12 -3.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.18 1p1d s ILE 208 CO -0.04 -0.40 0.00 -0.13 -1.23 0.00 0.00 174.94 173.15 1p1d s ARG 209 N -4.54 3.68 0.26 2.79 0.52 0.45 -0.64 118.95 121.47 1p1d s ARG 209 Ca 0.47 -0.50 0.10 0.00 -0.52 0.00 0.00 55.73 55.28 1p1d s ARG 209 Cb -0.10 -3.07 -0.04 0.00 0.52 0.00 0.00 34.95 32.26 1p1d s ARG 209 CO 0.38 0.09 -0.02 0.21 0.02 0.00 0.00 175.30 175.99 1p1d s LYS 210 N 0.79 2.27 0.00 3.54 2.20 -0.94 -4.21 119.74 123.40 1p1d s LYS 210 Ca 0.00 -1.41 0.00 0.00 -0.36 0.00 0.00 55.97 54.21 1p1d s LYS 210 Cb -0.14 -2.16 0.00 0.00 -1.51 0.00 0.00 37.83 34.02 1p1d s LYS 210 CO 0.02 0.37 0.00 -3.47 -0.36 0.00 0.00 175.35 171.91 1p1d n ASP 211 N -0.81 0.00 -4.43 1.43 2.03 -1.26 -3.39 116.55 110.13 1p1d n ASP 211 Ca -0.07 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 54.95 1p1d n ASP 211 Cb 0.59 0.00 0.23 0.00 -0.72 0.00 0.00 41.12 41.21 1p1d n ASP 211 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1p1d n GLU 212 N 0.00 -2.07 0.00 -0.67 0.28 -1.26 -5.14 120.64 111.78 1p1d n GLU 212 Ca 0.00 -0.57 0.14 0.00 -0.16 0.00 0.00 57.16 56.56 1p1d n GLU 212 Cb 0.00 -2.04 0.49 0.00 1.43 0.00 0.00 31.44 31.32 1p1d n GLU 212 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57