#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 -0.42 -0.04 5.09 0.11 -1.26 -5.15 120.40 118.73 1p1d s VAL 19 Ca 0.00 0.22 0.01 0.00 -2.93 0.00 0.00 61.98 59.27 1p1d s VAL 19 Cb 0.00 -0.52 0.02 0.00 -1.53 0.00 0.00 36.38 34.35 1p1d s VAL 19 CO 0.00 0.09 -0.03 -0.69 -3.33 0.00 0.00 175.10 171.14 1p1d s VAL 20 N 2.29 0.41 -0.22 2.04 1.01 -1.26 -4.95 120.40 119.72 1p1d s VAL 20 Ca -0.02 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.94 1p1d s VAL 20 Cb -0.12 -0.47 0.04 0.00 0.00 0.00 0.00 36.38 35.83 1p1d s VAL 20 CO -0.10 0.20 -0.14 -1.38 0.00 0.00 0.00 175.10 173.68 1p1d s HIS 21 N 1.05 3.01 -0.25 5.22 -3.43 -1.26 -4.96 115.29 114.67 1p1d s HIS 21 Ca -0.09 -1.87 -0.36 0.00 -0.80 0.00 0.00 55.06 51.94 1p1d s HIS 21 Cb -0.14 -1.95 -0.12 0.00 -1.43 0.00 0.00 32.58 28.94 1p1d s HIS 21 CO -0.01 -0.82 1.97 0.25 -2.00 0.00 0.00 174.74 174.13 1p1d n THR 22 N 4.56 0.35 -4.32 -5.38 -2.24 -1.26 -4.34 114.28 101.65 1p1d n THR 22 Ca -0.18 -0.16 -0.26 0.00 -2.27 0.00 0.00 64.05 61.19 1p1d n THR 22 Cb 0.47 -1.63 -0.09 0.00 -2.10 0.00 0.00 70.33 66.98 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 4.81 2.11 -0.05 -0.78 0.41 -0.73 -4.96 118.70 119.51 1p1d s GLU 23 Ca 1.01 -1.89 0.04 0.00 -0.41 0.00 0.00 54.97 53.73 1p1d s GLU 23 Cb -0.85 -1.88 -0.00 0.00 -1.78 0.00 0.00 34.13 29.62 1p1d s GLU 23 CO 0.54 -0.03 -0.18 0.95 -0.49 0.00 0.00 175.26 176.06 1p1d s THR 24 N -2.61 1.49 0.48 3.63 -4.23 -1.26 -1.52 115.64 111.62 1p1d s THR 24 Ca 0.38 -0.74 0.02 0.00 -1.18 0.00 0.00 61.69 60.17 1p1d s THR 24 Cb 0.04 -1.28 -0.02 0.00 1.34 0.00 0.00 72.50 72.58 1p1d s THR 24 CO 0.20 0.43 0.02 0.28 -0.54 0.00 0.00 174.62 175.01 1p1d s THR 25 N 0.07 1.18 0.30 3.99 -1.32 0.36 -4.98 115.64 115.24 1p1d s THR 25 Ca -0.05 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.52 1p1d s THR 25 Cb -0.12 -2.29 -0.04 0.00 -1.51 0.00 0.00 72.50 68.53 1p1d s THR 25 CO 0.03 0.00 0.03 -1.83 -2.21 0.00 0.00 174.62 170.64 1p1d s GLU 26 N -3.83 2.26 0.04 7.08 1.03 -1.26 -1.77 118.70 122.25 1p1d s GLU 26 Ca 0.12 -1.51 0.03 0.00 0.03 0.00 0.00 54.97 53.64 1p1d s GLU 26 Cb 0.03 -2.12 -0.02 0.00 -0.80 0.00 0.00 34.13 31.22 1p1d s GLU 26 CO 0.07 0.26 -0.10 0.08 -1.33 0.00 0.00 175.26 174.24 1p1d s VAL 27 N -2.39 0.72 -0.22 1.83 1.01 0.47 -4.78 120.40 117.03 1p1d s VAL 27 Ca 0.33 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 1p1d s VAL 27 Cb -0.04 -0.73 0.06 0.00 0.00 0.00 0.00 36.38 35.67 1p1d s VAL 27 CO 0.20 -0.27 -0.02 -0.69 0.00 0.00 0.00 175.10 174.33 1p1d s VAL 28 N -1.20 1.16 -0.26 2.92 1.01 -1.26 -1.98 120.40 120.79 1p1d s VAL 28 Ca -0.06 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 1p1d s VAL 28 Cb -0.09 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1p1d s VAL 28 CO 0.01 -0.17 0.06 -0.76 0.00 0.00 0.00 175.10 174.24 1p1d s LEU 29 N 1.56 3.50 0.29 3.92 2.01 0.72 -4.91 118.68 125.77 1p1d s LEU 29 Ca -0.03 -0.39 0.08 0.00 0.01 0.00 0.00 54.13 53.80 1p1d s LEU 29 Cb -0.18 -1.89 -0.04 0.00 0.01 0.00 0.00 46.19 44.10 1p1d s LEU 29 CO -0.07 -0.08 0.17 0.42 1.01 0.00 0.00 176.35 177.79 1p1d s THR 30 N 1.56 3.73 -0.30 5.49 -4.23 -1.26 0.13 115.64 120.77 1p1d s THR 30 Ca 0.05 -1.55 -0.10 0.00 -1.18 0.00 0.00 61.69 58.91 1p1d s THR 30 Cb -0.16 -3.15 -0.02 0.00 1.34 0.00 0.00 72.50 70.51 1p1d s THR 30 CO 0.02 -0.28 0.16 0.00 -0.54 0.00 0.00 174.62 173.99 1p1d s ALA 31 N -2.27 3.34 0.40 3.99 0.00 -0.81 -4.40 121.76 122.01 1p1d s ALA 31 Ca 0.36 -1.31 -0.13 0.00 0.00 0.00 0.00 51.96 50.87 1p1d s ALA 31 Cb -0.06 -2.41 -0.08 0.00 0.00 0.00 0.00 23.12 20.57 1p1d s ALA 31 CO 0.24 -0.81 0.81 0.34 0.00 0.00 0.00 175.76 176.33 1p1d s ASP 32 N 1.66 6.63 0.00 0.00 2.15 0.12 -4.80 116.67 122.43 1p1d s ASP 32 Ca 0.05 1.27 0.18 0.00 0.43 0.00 0.00 52.55 54.49 1p1d s ASP 32 Cb -0.17 -2.38 1.06 0.00 -0.30 0.00 0.00 42.92 41.14 1p1d s ASP 32 CO 0.07 -0.38 1.56 -0.81 -0.17 0.00 0.00 175.17 175.45 1p1d n PRO 33 N -1.06 0.82 -0.08 4.34 -0.04 -1.26 -0.58 135.00 137.13 1p1d n PRO 33 Ca 0.04 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.33 1p1d n PRO 33 Cb 0.54 -1.34 -0.06 0.00 -0.04 0.00 0.00 33.50 32.60 1p1d n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1p1d n VAL 34 N -0.84 1.06 -0.36 0.52 0.31 -1.26 -4.87 118.33 112.88 1p1d n VAL 34 Ca 0.13 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1p1d n VAL 34 Cb 0.06 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.19 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 -3.86 0.00 0.00 2.52 5.66 -1.24 -5.09 114.28 112.27 1p1d n THR 35 Ca -0.31 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.51 1p1d n THR 35 Cb 0.68 1.36 0.00 0.00 -1.55 0.00 0.00 70.33 70.82 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 0.16 1.62 3.12 1.09 0.00 0.25 -4.55 105.19 106.87 1p1d n GLY 36 Ca 0.00 0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1p1d n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p1d s PHE 37 N 0.00 3.01 -1.88 1.61 0.40 -1.26 -0.70 117.98 119.16 1p1d s PHE 37 Ca 0.00 -1.86 0.03 0.00 -0.60 0.00 0.00 56.93 54.50 1p1d s PHE 37 Cb 0.00 -1.95 0.11 0.00 0.51 0.00 0.00 43.02 41.68 1p1d s PHE 37 CO 0.00 -0.82 1.04 0.41 0.70 0.00 0.00 175.22 176.56 1p1d n GLY 38 N 4.56 -0.22 3.87 4.36 0.00 -1.26 -4.87 105.19 111.63 1p1d n GLY 38 Ca -0.18 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 1p1d n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 39 N -1.78 5.02 -0.29 -0.61 1.01 -1.26 0.14 121.20 123.43 1p1d s ILE 39 Ca 0.08 0.50 -0.04 0.00 0.00 0.00 0.00 60.65 61.19 1p1d s ILE 39 Cb 0.04 -3.66 0.10 0.00 0.01 0.00 0.00 42.46 38.95 1p1d s ILE 39 CO 0.05 0.19 0.13 -1.10 0.00 0.00 0.00 174.94 174.21 1p1d s GLN 40 N -2.15 0.23 0.14 2.79 -0.21 0.15 -4.95 119.66 115.66 1p1d s GLN 40 Ca 0.37 -0.57 0.06 0.00 0.02 0.00 0.00 55.36 55.24 1p1d s GLN 40 Cb -0.14 -1.22 -0.04 0.00 1.00 0.00 0.00 33.01 32.61 1p1d s GLN 40 CO 0.20 -1.02 0.03 -0.48 -2.12 0.00 0.00 175.29 171.90 1p1d s LEU 41 N 2.06 3.48 0.43 2.90 0.05 -1.26 0.24 118.68 126.58 1p1d s LEU 41 Ca 0.09 -0.25 0.08 0.00 0.05 0.00 0.00 54.13 54.09 1p1d s LEU 41 Cb -0.16 -2.15 0.01 0.00 -2.05 0.00 0.00 46.19 41.84 1p1d s LEU 41 CO -0.36 0.12 0.59 -1.10 -0.55 0.00 0.00 176.35 175.05 1p1d s GLN 42 N -2.73 2.80 -0.11 1.48 -0.21 0.11 -4.78 119.66 116.22 1p1d s GLN 42 Ca 0.28 -1.21 0.20 0.00 0.02 0.00 0.00 55.36 54.64 1p1d s GLN 42 Cb -0.10 -2.74 0.44 0.00 1.00 0.00 0.00 33.01 31.61 1p1d s GLN 42 CO 0.20 -0.31 1.18 0.41 -2.12 0.00 0.00 175.29 174.64 1p1d n GLY 43 N -1.89 2.59 2.74 3.09 0.00 -1.26 -1.86 105.19 108.60 1p1d n GLY 43 Ca 0.08 -1.12 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 1p1d n GLY 43 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p1d n SER 44 N -0.16 -2.62 0.00 1.61 7.64 -1.26 -4.62 113.62 114.20 1p1d n SER 44 Ca 0.12 -3.17 0.00 0.00 1.01 0.00 0.00 58.87 56.84 1p1d n SER 44 Cb 0.97 1.71 0.00 0.00 -1.01 0.00 0.00 64.21 65.88 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1p1d n VAL 45 N 1.43 0.00 -0.09 0.44 0.31 -1.26 -3.85 118.33 115.32 1p1d n VAL 45 Ca 0.07 1.23 -0.12 0.00 -0.01 0.00 0.00 64.34 65.51 1p1d n VAL 45 Cb 0.65 -2.16 -0.05 0.00 -0.91 0.00 0.00 33.84 31.37 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 0.62 -5.65 3.52 -0.00 -1.98 -3.49 116.94 109.96 1p1d h PHE 46 Ca 0.00 -0.16 -0.05 0.00 -0.00 0.00 0.00 57.97 57.76 1p1d h PHE 46 Cb 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 35.95 35.81 1p1d h PHE 46 CO 0.03 0.80 -0.92 0.00 -0.00 0.00 0.00 178.31 178.22 1p1d n ALA 47 N -2.43 -2.87 -2.84 12.09 0.00 -1.25 -5.03 120.51 118.19 1p1d n ALA 47 Ca -0.04 0.50 -0.04 0.00 0.00 0.00 0.00 53.44 53.86 1p1d n ALA 47 Cb 0.36 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 18.19 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 -1.66 -0.95 -1.18 0.00 -4.23 -1.26 -4.98 115.64 101.39 1p1d s THR 48 Ca 0.10 -0.95 -0.29 0.00 -1.18 0.00 0.00 61.69 59.37 1p1d s THR 48 Cb -0.02 -0.05 0.02 0.00 1.34 0.00 0.00 72.50 73.79 1p1d s THR 48 CO 0.60 -0.05 0.73 -1.84 -0.54 0.00 0.00 174.62 173.52 1p1d n GLU 49 N 3.11 -0.63 0.00 3.99 0.28 -1.26 -4.55 120.64 121.57 1p1d n GLU 49 Ca 0.18 0.24 0.00 0.00 -0.16 0.00 0.00 57.16 57.41 1p1d n GLU 49 Cb 0.56 -3.14 0.00 0.00 1.43 0.00 0.00 31.44 30.28 1p1d n GLU 49 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1p1d n THR 50 N -4.68 0.00 -1.09 3.84 -2.24 -1.26 -5.01 114.28 103.84 1p1d n THR 50 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1p1d n THR 50 Cb 0.57 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 1p1d n THR 50 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p1d n LEU 51 N 0.00 0.00 -0.52 3.22 -0.00 -1.26 -4.68 117.00 113.76 1p1d n LEU 51 Ca 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 56.01 56.10 1p1d n LEU 51 Cb 0.00 -0.49 0.00 0.00 -0.00 0.00 0.00 43.42 42.93 1p1d n LEU 51 CO 0.00 0.00 0.14 -1.20 -0.00 0.00 0.00 177.39 176.33 1p1d n SER 52 N 0.37 0.58 -4.66 1.45 7.64 -1.26 -4.51 113.62 113.23 1p1d n SER 52 Ca 0.00 -1.08 -0.43 0.00 1.01 0.00 0.00 58.87 58.37 1p1d n SER 52 Cb 0.09 -0.27 -0.02 0.00 -1.01 0.00 0.00 64.21 63.00 1p1d n SER 52 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1p1d s SER 53 N -0.41 7.09 1.12 6.43 0.01 -1.26 -4.87 113.70 121.81 1p1d s SER 53 Ca 0.00 1.42 -0.15 0.00 1.31 0.00 0.00 55.95 58.53 1p1d s SER 53 Cb 0.00 -2.54 0.18 0.00 0.21 0.00 0.00 66.02 63.87 1p1d s SER 53 CO 0.00 -0.67 0.52 -2.65 0.41 0.00 0.00 173.24 170.85 1p1d n PRO 54 N 6.30 -1.81 -1.59 12.44 -0.02 -1.26 -4.50 135.00 144.57 1p1d n PRO 54 Ca 0.12 -0.50 -0.43 0.00 -2.02 0.00 0.00 63.50 60.68 1p1d n PRO 54 Cb 0.46 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1p1d n PRO 54 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1p1d n PRO 55 N -3.37 1.32 -3.49 0.52 -0.02 -1.26 -4.79 135.00 123.91 1p1d n PRO 55 Ca 0.03 0.47 -0.19 0.00 -2.02 0.00 0.00 63.50 61.79 1p1d n PRO 55 Cb 0.57 -1.94 -0.13 0.00 -0.02 0.00 0.00 33.50 31.99 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 -0.02 -0.08 -0.07 2.45 2.34 -0.78 -3.71 118.68 118.81 1p1d s LEU 56 Ca 0.61 -0.35 -0.29 0.00 0.06 0.00 0.00 54.13 54.16 1p1d s LEU 56 Cb -0.61 0.34 -0.07 0.00 -0.56 0.00 0.00 46.19 45.30 1p1d s LEU 56 CO 0.58 -0.34 1.91 -0.63 -1.06 0.00 0.00 176.35 176.81 1p1d s ILE 57 N 2.31 3.22 -0.10 1.48 1.01 -1.26 0.07 121.20 127.93 1p1d s ILE 57 Ca 0.07 0.26 0.21 0.00 0.00 0.00 0.00 60.65 61.19 1p1d s ILE 57 Cb -0.16 -3.20 -0.26 0.00 0.01 0.00 0.00 42.46 38.86 1p1d s ILE 57 CO -0.16 -0.06 0.50 -0.24 0.00 0.00 0.00 174.94 174.98 1p1d n SER 58 N 8.44 0.20 -3.63 3.58 2.88 0.14 0.52 113.62 125.75 1p1d n SER 58 Ca 0.21 0.08 -0.05 0.00 -1.33 0.00 0.00 58.87 57.79 1p1d n SER 58 Cb 0.43 1.39 -0.06 0.00 -0.75 0.00 0.00 64.21 65.21 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 -3.21 -1.02 0.24 0.66 5.04 -0.91 -4.89 117.35 113.26 1p1d s TYR 59 Ca -0.07 1.96 0.03 0.00 -2.44 0.00 0.00 57.07 56.56 1p1d s TYR 59 Cb 0.11 0.61 0.04 0.00 0.35 0.00 0.00 41.96 43.07 1p1d s TYR 59 CO 0.87 -0.51 0.33 -0.89 -1.34 0.00 0.00 175.55 174.01 1p1d n ILE 60 N 4.48 0.00 -4.74 3.14 5.41 -1.25 -0.68 119.36 125.72 1p1d n ILE 60 Ca -0.18 -0.77 -0.31 0.00 1.00 0.00 0.00 62.75 62.50 1p1d n ILE 60 Cb 0.56 -0.85 -0.13 0.00 -0.71 0.00 0.00 39.64 38.52 1p1d n ILE 60 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1p1d s GLU 61 N -3.11 2.14 -0.63 0.38 2.12 0.38 -4.87 118.70 115.11 1p1d s GLU 61 Ca 0.25 -0.93 -0.27 0.00 0.36 0.00 0.00 54.97 54.38 1p1d s GLU 61 Cb -0.02 -2.21 -0.01 0.00 0.26 0.00 0.00 34.13 32.15 1p1d s GLU 61 CO 0.16 0.55 1.74 0.00 -0.54 0.00 0.00 175.26 177.17 1p1d s ALA 62 N -0.88 2.31 0.00 6.30 0.00 -1.26 -3.13 121.76 125.11 1p1d s ALA 62 Ca 0.14 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1p1d s ALA 62 Cb -0.10 -4.29 0.00 0.00 0.00 0.00 0.00 23.12 18.73 1p1d s ALA 62 CO 0.04 -3.74 0.00 -3.47 0.00 0.00 0.00 175.76 168.59 1p1d n ASP 63 N 12.00 -0.07 -4.16 0.00 -0.08 -1.26 -5.13 116.55 117.86 1p1d n ASP 63 Ca 0.17 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.21 1p1d n ASP 63 Cb 0.51 -0.02 -0.15 0.00 2.34 0.00 0.00 41.12 43.81 1p1d n ASP 63 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1p1d s SER 64 N -1.15 1.99 0.58 1.67 0.15 -1.18 -4.99 113.70 110.77 1p1d s SER 64 Ca 0.00 -0.32 0.33 0.00 0.70 0.00 0.00 55.95 56.65 1p1d s SER 64 Cb 0.00 -0.21 1.77 0.00 -1.71 0.00 0.00 66.02 65.87 1p1d s SER 64 CO 0.00 0.20 1.99 1.55 1.20 0.00 0.00 173.24 178.17 1p1d h PRO 65 N 5.64 0.00 0.40 5.44 0.13 -1.88 0.14 132.00 141.86 1p1d h PRO 65 Ca -0.37 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.74 1p1d h PRO 65 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1p1d h PRO 65 CO 0.48 0.00 -0.19 0.00 -0.23 0.00 0.00 178.00 178.06 1p1d h ALA 66 N 1.67 -0.54 0.00 -0.56 0.00 -1.86 0.95 119.26 118.92 1p1d h ALA 66 Ca 0.00 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1p1d h ALA 66 Cb 0.31 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1p1d h ALA 66 CO 0.00 -0.62 -0.74 1.49 0.00 0.00 0.00 179.25 179.39 1p1d h GLU 67 N -0.92 0.00 -0.01 0.00 4.57 -1.71 -3.10 114.58 113.41 1p1d h GLU 67 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1p1d h GLU 67 Cb 0.55 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1p1d h GLU 67 CO 0.09 0.74 -0.09 0.54 -1.18 0.00 0.00 179.01 179.11 1p1d n ARG 68 N -3.42 1.35 -0.09 1.92 5.12 0.43 -4.30 116.66 117.66 1p1d n ARG 68 Ca 0.00 -0.77 -0.08 0.00 -1.93 0.00 0.00 57.85 55.07 1p1d n ARG 68 Cb 0.78 -1.48 -0.02 0.00 -1.16 0.00 0.00 32.46 30.58 1p1d n ARG 68 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1p1d n GLY 70 N -1.41 1.11 2.21 0.00 0.00 -1.26 -4.82 105.19 101.01 1p1d n GLY 70 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1p1d n GLY 70 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p1d n VAL 71 N 0.00 -0.15 -3.80 1.61 0.31 -1.26 -4.63 118.33 110.42 1p1d n VAL 71 Ca 0.00 -4.53 -0.13 0.00 -0.01 0.00 0.00 64.34 59.68 1p1d n VAL 71 Cb 0.00 -0.57 -0.10 0.00 -0.91 0.00 0.00 33.84 32.26 1p1d n VAL 71 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1p1d s LEU 72 N -2.26 1.07 0.25 7.52 1.43 -1.26 -4.90 118.68 120.53 1p1d s LEU 72 Ca 0.39 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1p1d s LEU 72 Cb 0.32 0.97 -0.03 0.00 0.03 0.00 0.00 46.19 47.47 1p1d s LEU 72 CO -0.09 -0.27 0.22 -1.10 0.23 0.00 0.00 176.35 175.35 1p1d s GLN 73 N -0.66 1.42 -0.69 1.70 1.11 -1.26 -4.94 119.66 116.34 1p1d s GLN 73 Ca -0.08 -1.71 -0.24 0.00 0.01 0.00 0.00 55.36 53.35 1p1d s GLN 73 Cb -0.04 0.31 -0.19 0.00 -1.01 0.00 0.00 33.01 32.08 1p1d s GLN 73 CO 0.02 -0.50 1.87 -0.89 0.01 0.00 0.00 175.29 175.79 1p1d n ILE 74 N -0.39 1.46 0.00 1.08 2.08 -1.26 -4.02 119.36 118.31 1p1d n ILE 74 Ca 0.03 -1.31 0.00 0.00 0.56 0.00 0.00 62.75 62.03 1p1d n ILE 74 Cb 0.64 -2.24 0.00 0.00 -0.75 0.00 0.00 39.64 37.30 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 4.82 1.53 2.90 7.39 0.00 0.19 -4.77 105.19 117.24 1p1d n GLY 75 Ca 0.48 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1p1d n GLY 75 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p1d s ASP 76 N 0.00 4.35 0.37 1.61 1.11 -1.26 -4.80 116.67 118.05 1p1d s ASP 76 Ca 0.00 -1.81 -0.28 0.00 0.18 0.00 0.00 52.55 50.64 1p1d s ASP 76 Cb 0.00 -1.27 -0.11 0.00 1.07 0.00 0.00 42.92 42.61 1p1d s ASP 76 CO 0.00 -0.37 1.51 0.54 1.18 0.00 0.00 175.17 178.03 1p1d n ARG 77 N 4.54 2.69 -4.43 8.23 5.12 -1.26 -4.55 116.66 127.01 1p1d n ARG 77 Ca -0.01 0.95 -0.27 0.00 -1.93 0.00 0.00 57.85 56.59 1p1d n ARG 77 Cb 0.42 -2.69 -0.13 0.00 -1.16 0.00 0.00 32.46 28.91 1p1d n ARG 77 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1p1d s VAL 78 N -0.95 1.98 -0.13 1.55 -7.23 -1.24 -4.52 120.40 109.86 1p1d s VAL 78 Ca 0.55 -1.59 0.11 0.00 -1.81 0.00 0.00 61.98 59.25 1p1d s VAL 78 Cb -0.48 -1.76 -0.16 0.00 0.56 0.00 0.00 36.38 34.54 1p1d s VAL 78 CO 0.62 0.07 0.04 0.80 -0.31 0.00 0.00 175.10 176.32 1p1d n MET 79 N 1.16 1.82 -3.77 4.82 1.56 -0.53 -4.51 117.12 117.66 1p1d n MET 79 Ca -0.18 -0.00 -0.13 0.00 -0.27 0.00 0.00 57.70 57.12 1p1d n MET 79 Cb 0.53 -1.34 -0.12 0.00 2.15 0.00 0.00 33.22 34.45 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 -2.32 -0.66 -0.26 -5.12 0.00 -1.26 -2.87 121.76 109.28 1p1d s ALA 80 Ca -0.07 0.83 0.03 0.00 0.00 0.00 0.00 51.96 52.75 1p1d s ALA 80 Cb 0.04 -0.49 0.06 0.00 0.00 0.00 0.00 23.12 22.73 1p1d s ALA 80 CO 0.54 -0.14 -0.10 0.42 0.00 0.00 0.00 175.76 176.47 1p1d s ILE 81 N 0.38 2.07 -1.89 0.00 1.01 0.11 -2.39 121.20 120.50 1p1d s ILE 81 Ca -0.02 -1.59 0.00 0.00 0.00 0.00 0.00 60.65 59.04 1p1d s ILE 81 Cb -0.04 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.22 1p1d s ILE 81 CO -0.02 -0.05 0.00 0.59 0.00 0.00 0.00 174.94 175.46 1p1d n ASN 82 N 4.46 -5.14 0.00 3.58 4.13 0.25 -0.89 115.26 121.66 1p1d n ASN 82 Ca -0.13 0.33 0.00 0.00 1.68 0.00 0.00 54.58 56.46 1p1d n ASN 82 Cb 0.42 -4.49 0.00 0.00 -1.54 0.00 0.00 39.78 34.18 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 -0.55 2.12 3.75 7.41 0.00 -1.26 -5.04 105.19 111.62 1p1d n GLY 83 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.25 3.15 0.00 -0.61 1.01 -0.07 -5.00 121.20 117.43 1p1d s ILE 84 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 60.65 61.69 1p1d s ILE 84 Cb 0.00 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1p1d s ILE 84 CO 0.00 0.20 0.00 -0.81 0.00 0.00 0.00 174.94 174.33 1p1d n PRO 85 N 1.79 -1.02 0.10 2.79 -0.04 -1.26 0.04 135.00 137.40 1p1d n PRO 85 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1p1d n PRO 85 Cb 0.43 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.89 1p1d n PRO 85 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1p1d n THR 86 N -2.42 0.00 0.38 0.52 -2.24 -1.14 -4.48 114.28 104.90 1p1d n THR 86 Ca 0.00 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.88 1p1d n THR 86 Cb 0.00 -0.21 0.43 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.99 0.13 -1.90 -0.78 1.02 -1.26 -2.78 120.64 112.09 1p1d n GLU 87 Ca 0.00 0.41 -0.33 0.00 -0.02 0.00 0.00 57.16 57.21 1p1d n GLU 87 Cb 0.00 -1.77 0.04 0.00 -0.02 0.00 0.00 31.44 29.69 1p1d n GLU 87 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1p1d n ASP 88 N -2.02 6.57 -2.69 1.62 -0.08 -1.26 -4.98 116.55 113.70 1p1d n ASP 88 Ca 0.02 -3.79 0.02 0.00 -1.51 0.00 0.00 54.79 49.53 1p1d n ASP 88 Cb 0.18 -0.80 0.01 0.00 2.34 0.00 0.00 41.12 42.85 1p1d n ASP 88 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1p1d n SER 89 N -0.66 -0.69 -4.91 1.67 7.64 -1.12 -5.01 113.62 110.54 1p1d n SER 89 Ca 0.52 -1.13 -0.28 0.00 1.01 0.00 0.00 58.87 58.99 1p1d n SER 89 Cb 0.56 1.07 0.04 0.00 -1.01 0.00 0.00 64.21 64.87 1p1d n SER 89 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1p1d s THR 90 N -2.06 3.40 0.07 0.44 2.01 -1.26 -4.92 115.64 113.31 1p1d s THR 90 Ca 0.18 0.14 -0.15 0.00 0.31 0.00 0.00 61.69 62.17 1p1d s THR 90 Cb -0.00 -3.40 -0.18 0.00 0.01 0.00 0.00 72.50 68.93 1p1d s THR 90 CO -0.01 -0.46 1.25 2.19 -0.69 0.00 0.00 174.62 176.91 1p1d h PHE 91 N -0.42 0.92 -0.65 4.92 -5.15 -1.82 -3.18 116.94 111.55 1p1d h PHE 91 Ca -0.45 -0.42 0.15 0.00 -0.20 0.00 0.00 57.97 57.04 1p1d h PHE 91 Cb 1.26 -0.13 -0.04 0.00 0.22 0.00 0.00 35.95 37.26 1p1d h PHE 91 CO 0.46 1.24 0.45 1.49 -2.00 0.00 0.00 178.31 179.95 1p1d h GLU 92 N 0.34 0.24 -0.06 6.09 4.81 -1.95 -0.84 114.58 123.21 1p1d h GLU 92 Ca -0.06 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1p1d h GLU 92 Cb 1.35 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 1p1d h GLU 92 CO 0.14 0.16 0.03 0.93 -0.73 0.00 0.00 179.01 179.55 1p1d h GLU 93 N 0.25 0.08 -0.83 1.92 4.39 -1.96 -1.37 114.58 117.07 1p1d h GLU 93 Ca 0.32 -0.01 0.11 0.00 0.34 0.00 0.00 59.36 60.12 1p1d h GLU 93 Cb 0.89 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.44 1p1d h GLU 93 CO -0.07 0.12 0.46 0.00 -1.16 0.00 0.00 179.01 178.36 1p1d h ALA 94 N 0.95 1.19 -0.68 3.43 0.00 -1.26 0.22 119.26 123.12 1p1d h ALA 94 Ca 0.02 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1p1d h ALA 94 Cb 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1p1d h ALA 94 CO -0.00 0.04 0.45 -0.97 0.00 0.00 0.00 179.25 178.77 1p1d h ASN 95 N 0.74 0.72 -0.64 0.00 -0.00 -0.95 -1.24 115.58 114.20 1p1d h ASN 95 Ca 0.41 -0.01 -0.02 0.00 -0.00 0.00 0.00 56.30 56.68 1p1d h ASN 95 Cb 0.44 -0.17 -0.03 0.00 -0.00 0.00 0.00 38.32 38.56 1p1d h ASN 95 CO -0.28 0.50 0.33 1.56 -0.00 0.00 0.00 177.43 179.55 1p1d h GLN 96 N 0.84 0.91 -0.68 6.67 1.08 0.53 0.22 115.11 124.68 1p1d h GLN 96 Ca 0.27 -0.12 0.08 0.00 -1.45 0.00 0.00 58.65 57.43 1p1d h GLN 96 Cb 0.03 -0.17 -0.06 0.00 -0.05 0.00 0.00 27.48 27.22 1p1d h GLN 96 CO -0.07 0.70 0.34 -0.07 -0.95 0.00 0.00 178.83 178.79 1p1d h LEU 97 N 0.88 0.47 -0.13 1.46 3.38 -0.53 -0.26 115.31 120.58 1p1d h LEU 97 Ca 0.22 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.21 1p1d h LEU 97 Cb 0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1p1d h LEU 97 CO -0.03 0.28 -0.04 -0.07 0.09 0.00 0.00 178.44 178.67 1p1d h LEU 98 N 0.61 0.27 -1.69 1.67 4.07 -0.98 0.35 115.31 119.60 1p1d h LEU 98 Ca 0.32 -0.39 0.26 0.00 0.08 0.00 0.00 57.88 58.15 1p1d h LEU 98 Cb 0.30 -0.07 -0.06 0.00 1.08 0.00 0.00 40.66 41.90 1p1d h LEU 98 CO -0.24 0.59 0.66 0.03 -1.08 0.00 0.00 178.44 178.41 1p1d h ARG 99 N -0.06 0.22 -0.60 1.13 3.08 0.17 0.24 114.38 118.56 1p1d h ARG 99 Ca 0.03 -0.01 -0.44 0.00 0.07 0.00 0.00 59.98 59.63 1p1d h ARG 99 Cb 0.48 -0.05 -0.35 0.00 0.08 0.00 0.00 29.97 30.14 1p1d h ARG 99 CO 0.02 0.14 -0.76 -0.25 -1.07 0.00 0.00 179.97 178.05 1p1d n ASP 100 N -4.42 4.28 -1.63 7.04 8.00 -0.18 -4.73 116.55 124.92 1p1d n ASP 100 Ca 0.21 -3.76 0.02 0.00 0.71 0.00 0.00 54.79 51.97 1p1d n ASP 100 Cb 0.90 -0.38 0.28 0.00 -0.02 0.00 0.00 41.12 41.90 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1p1d n SER 101 N -0.78 4.47 -0.12 -2.24 7.64 0.12 -4.00 113.62 118.70 1p1d n SER 101 Ca 0.39 -2.79 0.05 0.00 1.01 0.00 0.00 58.87 57.52 1p1d n SER 101 Cb 0.92 -0.66 0.07 0.00 -1.01 0.00 0.00 64.21 63.52 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 0.29 1.62 0.01 6.43 3.41 -1.26 -4.04 113.62 120.08 1p1d n SER 102 Ca 0.25 -2.43 -0.12 0.00 -0.26 0.00 0.00 58.87 56.31 1p1d n SER 102 Cb 1.04 -0.24 -0.07 0.00 -0.26 0.00 0.00 64.21 64.68 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 1.55 1.12 -0.51 -1.33 2.04 -1.88 -3.01 117.51 115.48 1p1d h ILE 103 Ca 0.00 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.51 1p1d h ILE 103 Cb 0.95 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1p1d h ILE 103 CO 0.00 0.09 0.00 1.07 0.00 0.00 0.00 178.15 179.31 1p1d n THR 104 N -5.00 0.88 -2.10 -0.27 5.66 -1.26 -4.94 114.28 107.25 1p1d n THR 104 Ca -0.07 -0.94 -0.18 0.00 -3.05 0.00 0.00 64.05 59.81 1p1d n THR 104 Cb 0.10 0.61 -0.03 0.00 -1.55 0.00 0.00 70.33 69.45 1p1d n THR 104 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1p1d n SER 105 N 1.16 -5.28 -3.60 1.09 7.64 -1.14 -4.96 113.62 108.53 1p1d n SER 105 Ca 0.18 0.13 -0.12 0.00 1.01 0.00 0.00 58.87 60.07 1p1d n SER 105 Cb 0.53 -4.36 -0.05 0.00 -1.01 0.00 0.00 64.21 59.33 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 -4.49 1.06 -0.26 1.43 1.02 -1.25 -1.92 119.74 115.34 1p1d s LYS 106 Ca 0.00 -0.52 -0.05 0.00 0.02 0.00 0.00 55.97 55.43 1p1d s LYS 106 Cb 0.00 0.47 0.14 0.00 -0.52 0.00 0.00 37.83 37.92 1p1d s LYS 106 CO 0.00 -0.41 0.50 0.08 -0.92 0.00 0.00 175.35 174.60 1p1d s VAL 107 N -3.27 -0.79 -0.02 3.17 1.01 0.36 -4.69 120.40 116.16 1p1d s VAL 107 Ca -0.01 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.88 1p1d s VAL 107 Cb 0.00 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 1p1d s VAL 107 CO -0.08 -0.02 0.33 0.42 0.00 0.00 0.00 175.10 175.75 1p1d s THR 108 N 2.71 5.18 0.06 3.92 -4.23 -1.26 -0.20 115.64 121.83 1p1d s THR 108 Ca 0.08 0.56 0.01 0.00 -1.18 0.00 0.00 61.69 61.16 1p1d s THR 108 Cb -0.14 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.06 1p1d s THR 108 CO -0.17 0.52 -0.06 -0.76 -0.54 0.00 0.00 174.62 173.61 1p1d s LEU 109 N -1.26 2.40 -0.24 4.79 1.43 -0.84 -0.58 118.68 124.38 1p1d s LEU 109 Ca 0.23 -0.81 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 1p1d s LEU 109 Cb -0.15 -0.03 0.06 0.00 0.03 0.00 0.00 46.19 46.09 1p1d s LEU 109 CO 0.12 -0.39 -0.11 -1.61 0.23 0.00 0.00 176.35 174.59 1p1d s GLU 110 N -2.91 2.19 0.31 1.70 0.41 -1.00 -0.40 118.70 119.00 1p1d s GLU 110 Ca 0.01 -1.21 0.09 0.00 -0.41 0.00 0.00 54.97 53.46 1p1d s GLU 110 Cb -0.01 -2.78 -0.05 0.00 -1.78 0.00 0.00 34.13 29.52 1p1d s GLU 110 CO -0.04 -0.53 0.01 0.96 -0.49 0.00 0.00 175.26 175.17 1p1d s ILE 111 N 1.19 2.92 0.01 -1.63 -4.36 -0.73 -1.45 121.20 117.15 1p1d s ILE 111 Ca -0.07 -1.94 0.04 0.00 -0.26 0.00 0.00 60.65 58.42 1p1d s ILE 111 Cb -0.19 -2.80 -0.01 0.00 1.25 0.00 0.00 42.46 40.71 1p1d s ILE 111 CO -0.06 -0.26 -0.12 -0.70 0.24 0.00 0.00 174.94 174.04 1p1d s GLU 112 N -3.71 0.88 0.31 0.37 2.12 -1.26 -0.49 118.70 116.92 1p1d s GLU 112 Ca 0.34 -0.56 -0.19 0.00 0.36 0.00 0.00 54.97 54.92 1p1d s GLU 112 Cb -0.03 -0.85 0.04 0.00 0.26 0.00 0.00 34.13 33.55 1p1d s GLU 112 CO 0.20 0.22 0.79 -0.59 -0.54 0.00 0.00 175.26 175.34 1p1d s PHE 113 N -0.56 -0.02 0.43 5.30 -0.12 -0.58 -5.00 117.98 117.43 1p1d s PHE 113 Ca 0.02 -0.52 -0.11 0.00 -0.05 0.00 0.00 56.93 56.27 1p1d s PHE 113 Cb -0.06 0.77 -0.06 0.00 -0.63 0.00 0.00 43.02 43.03 1p1d s PHE 113 CO 0.00 -1.34 0.80 -0.51 -0.05 0.00 0.00 175.22 174.13 1p1d s ASP 114 N -3.03 6.51 -0.42 1.98 1.11 -1.26 -1.78 116.67 119.79 1p1d s ASP 114 Ca 0.14 1.18 -0.09 0.00 0.18 0.00 0.00 52.55 53.96 1p1d s ASP 114 Cb -0.05 -2.35 0.08 0.00 1.07 0.00 0.00 42.92 41.67 1p1d s ASP 114 CO 0.09 -0.44 0.26 0.68 1.18 0.00 0.00 175.17 176.93 1p1d s VAL 115 N -2.44 4.22 0.00 -1.27 -7.23 -1.26 -4.93 120.40 107.50 1p1d s VAL 115 Ca 0.52 -1.40 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1p1d s VAL 115 Cb -0.10 -3.58 0.00 0.00 0.56 0.00 0.00 36.38 33.26 1p1d s VAL 115 CO 0.32 -0.50 0.00 0.00 -0.31 0.00 0.00 175.10 174.61 1p1d n ALA 116 N 4.91 0.00 -2.12 1.32 0.00 0.18 -4.35 120.51 120.45 1p1d n ALA 116 Ca -0.10 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.38 1p1d n ALA 116 Cb 0.43 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.98 1p1d n ALA 116 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1p1d n GLU 117 N 0.00 0.90 -0.79 0.00 4.07 -1.26 -4.89 120.64 118.67 1p1d n GLU 117 Ca 0.00 -2.71 0.00 0.00 -0.06 0.00 0.00 57.16 54.39 1p1d n GLU 117 Cb 0.00 -0.85 0.00 0.00 -0.06 0.00 0.00 31.44 30.53 1p1d n GLU 117 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1p1d n SER 118 N -0.28 -1.05 -3.79 4.31 2.88 -1.25 -4.29 113.62 110.15 1p1d n SER 118 Ca 0.13 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.52 1p1d n SER 118 Cb 0.93 -0.53 -0.16 0.00 -0.75 0.00 0.00 64.21 63.71 1p1d n SER 118 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1p1d s VAL 119 N 0.00 -0.04 -0.44 2.46 0.11 -1.26 0.08 120.40 121.31 1p1d s VAL 119 Ca 0.00 0.18 -0.08 0.00 -2.93 0.00 0.00 61.98 59.15 1p1d s VAL 119 Cb 0.00 -0.08 0.10 0.00 -1.53 0.00 0.00 36.38 34.88 1p1d s VAL 119 CO 0.00 0.08 0.29 0.27 -3.33 0.00 0.00 175.10 172.40 1p1d s ILE 120 N 0.89 4.02 0.72 7.04 -5.25 0.72 -4.95 121.20 124.38 1p1d s ILE 120 Ca -0.07 -1.71 -0.13 0.00 -0.99 0.00 0.00 60.65 57.74 1p1d s ILE 120 Cb -0.11 -3.60 0.03 0.00 2.95 0.00 0.00 42.46 41.73 1p1d s ILE 120 CO -0.02 -0.67 1.11 -2.84 -1.79 0.00 0.00 174.94 170.73 1p1d s PRO 121 N 1.34 2.47 0.00 0.37 0.02 -1.26 -2.36 135.00 135.58 1p1d s PRO 121 Ca 0.05 1.36 0.00 0.00 0.02 0.00 0.00 61.00 62.43 1p1d s PRO 121 Cb -0.25 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.36 1p1d s PRO 121 CO -0.01 -1.50 0.00 0.45 -0.33 0.00 0.00 177.00 175.61 1p1d n SER 122 N -2.90 0.00 -4.52 2.53 2.88 -1.18 -4.93 113.62 105.50 1p1d n SER 122 Ca 0.10 0.00 -0.63 0.00 -1.33 0.00 0.00 58.87 57.01 1p1d n SER 122 Cb 0.52 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.88 1p1d n SER 122 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1p1d n SER 123 N 0.00 1.13 0.00 -3.46 3.41 -1.26 0.68 113.62 114.12 1p1d n SER 123 Ca 0.00 0.93 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 1p1d n SER 123 Cb 0.00 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 63.03 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 5.63 3.01 3.00 5.00 0.00 0.42 -4.94 105.19 117.31 1p1d n GLY 124 Ca 0.41 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 45.31 1p1d n GLY 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p1d s THR 125 N -0.23 1.95 -0.21 2.61 -4.23 0.21 -2.14 115.64 113.60 1p1d s THR 125 Ca 0.00 -1.68 -0.03 0.00 -1.18 0.00 0.00 61.69 58.80 1p1d s THR 125 Cb 0.00 -2.21 -0.00 0.00 1.34 0.00 0.00 72.50 71.63 1p1d s THR 125 CO 0.00 -0.22 -0.06 0.12 -0.54 0.00 0.00 174.62 173.92 1p1d s PHE 126 N 1.16 2.93 -0.20 3.99 5.36 -0.94 -3.11 117.98 127.18 1p1d s PHE 126 Ca -0.02 -1.02 -0.03 0.00 -0.96 0.00 0.00 56.93 54.89 1p1d s PHE 126 Cb -0.19 -2.08 -0.01 0.00 -0.34 0.00 0.00 43.02 40.40 1p1d s PHE 126 CO -0.07 -0.58 -0.07 -1.01 -1.46 0.00 0.00 175.22 172.03 1p1d s HIS 127 N 1.44 2.92 -0.50 10.12 3.76 -0.99 -1.24 115.29 130.80 1p1d s HIS 127 Ca 0.06 -0.98 -0.11 0.00 -0.15 0.00 0.00 55.06 53.87 1p1d s HIS 127 Cb -0.14 -2.04 0.12 0.00 1.11 0.00 0.00 32.58 31.63 1p1d s HIS 127 CO -0.04 -0.53 0.40 0.08 -0.85 0.00 0.00 174.74 173.79 1p1d s VAL 128 N 1.29 4.55 -0.49 -0.90 1.01 -0.10 -0.20 120.40 125.56 1p1d s VAL 128 Ca 0.03 -1.70 -0.27 0.00 0.00 0.00 0.00 61.98 60.04 1p1d s VAL 128 Cb -0.14 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.30 1p1d s VAL 128 CO -0.03 -0.81 1.05 -0.54 0.00 0.00 0.00 175.10 174.77 1p1d s LYS 129 N 1.43 3.61 -0.20 2.72 1.02 0.11 -2.28 119.74 126.16 1p1d s LYS 129 Ca 0.05 0.34 0.01 0.00 0.02 0.00 0.00 55.97 56.39 1p1d s LYS 129 Cb -0.27 -3.93 0.04 0.00 -0.52 0.00 0.00 37.83 33.14 1p1d s LYS 129 CO 0.00 -1.36 -0.15 -0.51 -0.92 0.00 0.00 175.35 172.42 1p1d s LEU 130 N 4.22 2.40 -0.14 3.17 1.43 -0.89 -3.85 118.68 125.03 1p1d s LEU 130 Ca 0.42 -0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 52.38 1p1d s LEU 130 Cb -0.08 -1.39 -0.05 0.00 0.03 0.00 0.00 46.19 44.69 1p1d s LEU 130 CO 0.29 -0.09 1.94 -2.84 0.23 0.00 0.00 176.35 175.88 1p1d s PRO 131 N 1.30 3.67 0.45 1.29 0.02 -1.26 -1.34 135.00 139.13 1p1d s PRO 131 Ca 0.00 2.09 -0.06 0.00 0.02 0.00 0.00 61.00 63.05 1p1d s PRO 131 Cb -0.15 -4.20 -0.04 0.00 0.02 0.00 0.00 34.50 30.13 1p1d s PRO 131 CO -0.10 -1.48 0.76 0.15 -0.33 0.00 0.00 177.00 176.00 1p1d s LYS 132 N 5.21 3.58 0.00 5.54 -0.14 -0.58 -4.82 119.74 128.52 1p1d s LYS 132 Ca 0.87 0.20 0.00 0.00 -1.36 0.00 0.00 55.97 55.68 1p1d s LYS 132 Cb -0.33 -2.41 0.00 0.00 -1.68 0.00 0.00 37.83 33.41 1p1d s LYS 132 CO 0.35 -0.14 0.00 1.63 -0.76 0.00 0.00 175.35 176.43 1p1d n LYS 133 N -2.03 2.16 0.05 1.68 4.01 -1.26 -3.77 118.16 119.00 1p1d n LYS 133 Ca 0.00 0.00 -0.14 0.00 -0.51 0.00 0.00 58.31 57.67 1p1d n LYS 133 Cb 0.55 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 35.03 1p1d n LYS 133 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1p1d h HIS 134 N 0.04 0.70 -0.00 2.13 3.86 -2.00 -3.31 115.15 116.57 1p1d h HIS 134 Ca 0.00 -0.35 -0.06 0.00 -1.16 0.00 0.00 60.37 58.80 1p1d h HIS 134 Cb 0.00 -0.09 -0.13 0.00 1.06 0.00 0.00 27.41 28.25 1p1d h HIS 134 CO 0.00 1.16 -0.03 0.43 0.86 0.00 0.00 177.93 180.35 1p1d n SER 135 N -3.81 -1.24 -4.50 2.45 7.64 -1.26 -4.92 113.62 107.98 1p1d n SER 135 Ca -0.07 -1.72 -0.24 0.00 1.01 0.00 0.00 58.87 57.86 1p1d n SER 135 Cb 0.79 0.67 -0.10 0.00 -1.01 0.00 0.00 64.21 64.57 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 0.10 2.67 0.22 0.44 1.01 -1.26 -5.08 120.40 118.49 1p1d s VAL 136 Ca 0.26 -2.26 -0.30 0.00 0.00 0.00 0.00 61.98 59.68 1p1d s VAL 136 Cb 0.20 -2.39 -0.10 0.00 0.00 0.00 0.00 36.38 34.09 1p1d s VAL 136 CO -0.08 -0.36 1.45 -1.83 0.00 0.00 0.00 175.10 174.28 1p1d s GLU 137 N -3.44 4.28 -0.22 2.72 -1.05 -1.26 -4.94 118.70 114.78 1p1d s GLU 137 Ca 0.29 2.27 -0.19 0.00 -0.15 0.00 0.00 54.97 57.19 1p1d s GLU 137 Cb -0.06 -3.14 -0.18 0.00 -0.44 0.00 0.00 34.13 30.32 1p1d s GLU 137 CO 0.15 -0.44 0.08 1.28 0.95 0.00 0.00 175.26 177.28 1p1d n LEU 138 N 2.82 1.93 0.00 1.83 4.77 -1.26 -4.82 117.00 122.28 1p1d n LEU 138 Ca 0.08 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1p1d n LEU 138 Cb 0.40 -0.94 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 1p1d n LEU 138 CO 0.60 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1p1d n GLY 139 N 1.43 0.89 3.70 -0.72 0.00 -1.26 -4.16 105.19 105.06 1p1d n GLY 139 Ca -0.38 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 1p1d n GLY 139 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 140 N -2.00 4.40 -0.21 -0.61 -0.00 -1.26 -0.31 121.20 121.21 1p1d s ILE 140 Ca 0.00 -0.29 0.01 0.00 -0.00 0.00 0.00 60.65 60.38 1p1d s ILE 140 Cb 0.00 -2.89 0.04 0.00 -0.00 0.00 0.00 42.46 39.62 1p1d s ILE 140 CO 0.00 0.55 -0.12 -0.89 -0.00 0.00 0.00 174.94 174.48 1p1d s THR 141 N -0.95 1.87 0.54 8.37 2.01 0.68 -4.96 115.64 123.20 1p1d s THR 141 Ca 0.15 -1.18 -0.07 0.00 0.31 0.00 0.00 61.69 60.90 1p1d s THR 141 Cb -0.11 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 1p1d s THR 141 CO 0.05 0.17 0.88 -0.63 -0.69 0.00 0.00 174.62 174.40 1p1d s ILE 142 N 1.29 4.64 0.06 1.82 1.01 -1.26 0.38 121.20 129.14 1p1d s ILE 142 Ca -0.02 0.36 -0.13 0.00 0.00 0.00 0.00 60.65 60.85 1p1d s ILE 142 Cb -0.17 -3.80 0.02 0.00 0.01 0.00 0.00 42.46 38.52 1p1d s ILE 142 CO -0.08 -0.87 0.30 -0.44 0.00 0.00 0.00 174.94 173.85 1p1d s SER 143 N -4.16 -0.11 -0.65 3.58 0.01 0.50 -4.73 113.70 108.14 1p1d s SER 143 Ca 0.51 -0.26 -0.05 0.00 1.31 0.00 0.00 55.95 57.45 1p1d s SER 143 Cb -0.11 0.37 0.17 0.00 0.21 0.00 0.00 66.02 66.66 1p1d s SER 143 CO 0.48 -0.66 0.49 -0.55 0.41 0.00 0.00 173.24 173.41 1p1d s SER 144 N -2.25 5.52 1.02 2.44 0.15 -1.26 -1.19 113.70 118.12 1p1d s SER 144 Ca -0.03 -2.78 -0.21 0.00 0.70 0.00 0.00 55.95 53.63 1p1d s SER 144 Cb 0.00 -1.92 -0.08 0.00 -1.71 0.00 0.00 66.02 62.31 1p1d s SER 144 CO -0.05 -0.42 -0.71 -2.65 1.20 0.00 0.00 173.24 170.60 1p1d n PRO 145 N 3.63 -0.39 0.00 5.44 -0.02 -1.26 -4.67 135.00 137.73 1p1d n PRO 145 Ca 0.08 -0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 1p1d n PRO 145 Cb 0.40 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 1p1d n PRO 145 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1p1d n SER 146 N 1.65 -1.93 -3.98 2.55 7.64 -1.26 -4.66 113.62 113.63 1p1d n SER 146 Ca -0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1p1d n SER 146 Cb 0.64 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.79 1p1d n SER 146 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1p1d s SER 147 N -4.00 -0.11 -0.07 6.43 0.01 -1.26 -4.94 113.70 109.76 1p1d s SER 147 Ca 0.00 -0.90 0.00 0.00 1.31 0.00 0.00 55.95 56.36 1p1d s SER 147 Cb 0.00 0.60 0.00 0.00 0.21 0.00 0.00 66.02 66.83 1p1d s SER 147 CO 0.00 -1.16 0.00 0.54 0.41 0.00 0.00 173.24 173.03 1p1d n ARG 148 N -0.39 -0.06 -3.76 12.44 1.74 -1.26 -5.05 116.66 120.31 1p1d n ARG 148 Ca -0.02 0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 57.02 1p1d n ARG 148 Cb 0.62 -3.63 -0.13 0.00 -1.02 0.00 0.00 32.46 28.30 1p1d n ARG 148 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1p1d s LYS 149 N -3.85 0.20 0.63 5.56 3.01 -1.26 -5.02 119.74 119.01 1p1d s LYS 149 Ca 0.00 0.40 0.28 0.00 -1.01 0.00 0.00 55.97 55.64 1p1d s LYS 149 Cb 0.00 -0.04 1.44 0.00 -1.01 0.00 0.00 37.83 38.22 1p1d s LYS 149 CO 0.00 -0.11 1.84 -1.35 0.51 0.00 0.00 175.35 176.24 1p1d h PRO 150 N 6.68 0.00 0.00 -1.68 0.11 -1.96 -3.38 132.00 131.76 1p1d h PRO 150 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1p1d h PRO 150 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1p1d h PRO 150 CO 0.39 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.59 1p1d n GLY 151 N -1.40 0.00 0.37 -0.55 0.00 -1.26 -4.12 105.19 98.23 1p1d n GLY 151 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 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 0.00 -1.03 -3.30 1.61 1.82 -1.76 -2.93 116.42 110.83 1p1d h ASP 152 Ca 0.00 0.12 -0.49 0.00 -0.39 0.00 0.00 57.03 56.26 1p1d h ASP 152 Cb 0.00 0.39 0.01 0.00 0.68 0.00 0.00 39.33 40.41 1p1d h ASP 152 CO 0.00 -0.44 -0.03 -2.16 -1.61 0.00 0.00 179.24 175.00 1p1d s PRO 153 N -5.98 3.58 -0.04 0.28 0.04 -1.26 -4.62 135.00 127.01 1p1d s PRO 153 Ca -0.16 0.05 0.03 0.00 0.04 0.00 0.00 61.00 60.96 1p1d s PRO 153 Cb 0.08 -2.52 0.01 0.00 0.04 0.00 0.00 34.50 32.10 1p1d s PRO 153 CO 0.64 0.01 -0.11 -0.51 0.04 0.00 0.00 177.00 177.07 1p1d s LEU 154 N -4.21 1.75 0.12 -3.56 2.01 -1.20 -4.26 118.68 109.33 1p1d s LEU 154 Ca 0.45 -0.25 -0.20 0.00 0.01 0.00 0.00 54.13 54.15 1p1d s LEU 154 Cb -0.10 -0.71 0.05 0.00 0.01 0.00 0.00 46.19 45.44 1p1d s LEU 154 CO 0.37 0.07 0.49 -0.69 1.01 0.00 0.00 176.35 177.60 1p1d s VAL 155 N 0.31 0.04 -0.10 -1.59 1.01 -0.34 0.64 120.40 120.38 1p1d s VAL 155 Ca -0.06 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1p1d s VAL 155 Cb -0.11 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1p1d s VAL 155 CO 0.02 -0.17 0.04 -0.63 0.00 0.00 0.00 175.10 174.35 1p1d s ILE 156 N -3.55 4.60 0.00 2.22 1.01 -0.88 0.19 121.20 124.79 1p1d s ILE 156 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.52 1p1d s ILE 156 Cb 0.00 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.52 1p1d s ILE 156 CO -0.11 0.60 0.00 -1.20 0.00 0.00 0.00 174.94 174.24 1p1d n SER 157 N 2.17 0.68 -3.70 3.58 7.64 0.16 -4.64 113.62 119.51 1p1d n SER 157 Ca -0.19 -0.25 -0.14 0.00 1.01 0.00 0.00 58.87 59.30 1p1d n SER 157 Cb 0.54 0.63 -0.14 0.00 -1.01 0.00 0.00 64.21 64.23 1p1d n SER 157 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1p1d s ASP 158 N -0.77 0.23 0.07 6.43 -1.08 -1.22 -4.97 116.67 115.37 1p1d s ASP 158 Ca 0.00 0.41 0.09 0.00 -0.52 0.00 0.00 52.55 52.53 1p1d s ASP 158 Cb 0.00 0.36 -0.03 0.00 -1.46 0.00 0.00 42.92 41.78 1p1d s ASP 158 CO 0.00 -0.20 -0.22 -0.63 0.52 0.00 0.00 175.17 174.64 1p1d s ILE 159 N 1.80 2.52 0.03 4.11 1.01 -1.24 -0.23 121.20 129.19 1p1d s ILE 159 Ca -0.03 -1.40 0.08 0.00 0.00 0.00 0.00 60.65 59.29 1p1d s ILE 159 Cb -0.12 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 1p1d s ILE 159 CO -0.07 0.26 -0.21 -0.75 0.00 0.00 0.00 174.94 174.17 1p1d s LYS 160 N -1.62 2.02 0.83 2.79 2.36 0.57 -4.98 119.74 121.72 1p1d s LYS 160 Ca 0.14 -1.00 -0.12 0.00 -2.55 0.00 0.00 55.97 52.45 1p1d s LYS 160 Cb -0.10 -2.12 0.09 0.00 -1.05 0.00 0.00 37.83 34.65 1p1d s LYS 160 CO 0.05 0.54 1.14 0.15 1.55 0.00 0.00 175.35 178.78 1p1d s LYS 161 N -1.22 1.83 0.00 4.03 1.02 -1.26 -3.84 119.74 120.30 1p1d s LYS 161 Ca 0.13 0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.43 1p1d s LYS 161 Cb -0.10 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1p1d s LYS 161 CO 0.03 -1.73 0.00 0.41 -0.92 0.00 0.00 175.35 173.14 1p1d n GLY 162 N -2.70 1.64 3.71 -3.33 0.00 -1.26 -4.95 105.19 98.29 1p1d n GLY 162 Ca 0.07 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1p1d n GLY 162 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p1d s SER 163 N 0.00 2.01 0.45 1.61 0.15 -1.26 -4.86 113.70 111.81 1p1d s SER 163 Ca 0.00 0.68 0.25 0.00 0.70 0.00 0.00 55.95 57.59 1p1d s SER 163 Cb 0.00 -1.00 0.84 0.00 -1.71 0.00 0.00 66.02 64.15 1p1d s SER 163 CO 0.00 -3.45 1.79 0.58 1.20 0.00 0.00 173.24 173.35 1p1d h VAL 164 N -2.12 0.35 0.00 4.45 2.07 -1.88 -3.10 116.25 116.02 1p1d h VAL 164 Ca -0.47 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 65.98 1p1d h VAL 164 Cb 1.29 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 1p1d h VAL 164 CO 0.43 0.16 0.00 0.00 0.02 0.00 0.00 177.57 178.17 1p1d n ALA 165 N -2.17 -0.29 0.25 1.67 0.00 -1.26 -1.83 120.51 116.89 1p1d n ALA 165 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.56 1p1d n ALA 165 Cb 0.45 0.15 0.63 0.00 0.00 0.00 0.00 19.45 20.67 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 -0.61 0.00 6.17 -1.71 -2.53 115.15 116.46 1p1d h HIS 166 Ca 0.00 0.00 0.08 0.00 0.71 0.00 0.00 60.37 61.16 1p1d h HIS 166 Cb 0.00 0.00 -0.04 0.00 2.52 0.00 0.00 27.41 29.89 1p1d h HIS 166 CO -0.12 0.17 0.41 -0.09 0.71 0.00 0.00 177.93 179.01 1p1d h ARG 167 N 0.00 0.51 -0.96 5.26 9.65 -1.42 -2.87 114.38 124.55 1p1d h ARG 167 Ca -0.00 -0.03 0.11 0.00 -1.10 0.00 0.00 59.98 58.95 1p1d h ARG 167 Cb 0.48 -0.12 -0.13 0.00 -1.39 0.00 0.00 29.97 28.82 1p1d h ARG 167 CO 0.02 0.34 -0.50 0.25 2.80 0.00 0.00 179.97 182.88 1p1d n THR 168 N -4.48 -0.60 0.00 0.20 -2.24 -0.76 0.47 114.28 106.87 1p1d n THR 168 Ca 0.09 2.30 0.00 0.00 -2.27 0.00 0.00 64.05 64.17 1p1d n THR 168 Cb 0.29 -2.90 0.00 0.00 -2.10 0.00 0.00 70.33 65.62 1p1d n THR 168 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p1d n GLY 169 N -1.31 3.16 1.73 3.38 0.00 -1.09 -2.77 105.19 108.29 1p1d n GLY 169 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.23 1.78 -3.42 2.61 5.66 -1.26 -4.94 114.28 113.47 1p1d n THR 170 Ca 0.00 -3.17 -0.41 0.00 -3.05 0.00 0.00 64.05 57.42 1p1d n THR 170 Cb 0.00 -0.04 -0.02 0.00 -1.55 0.00 0.00 70.33 68.72 1p1d n THR 170 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1p1d n LEU 171 N -0.61 5.09 -4.44 1.09 7.94 -1.26 -4.97 117.00 119.85 1p1d n LEU 171 Ca 0.23 -5.10 -0.37 0.00 -1.11 0.00 0.00 56.01 49.67 1p1d n LEU 171 Cb 0.89 -1.30 -0.03 0.00 0.53 0.00 0.00 43.42 43.50 1p1d n LEU 171 CO 0.14 1.48 1.84 1.21 -1.11 0.00 0.00 177.39 180.95 1p1d n GLU 172 N 2.37 2.35 -2.33 1.96 2.13 -1.26 -4.32 120.64 121.54 1p1d n GLU 172 Ca 0.24 -2.77 0.00 0.00 0.66 0.00 0.00 57.16 55.29 1p1d n GLU 172 Cb 0.38 -3.53 0.00 0.00 0.27 0.00 0.00 31.44 28.55 1p1d n GLU 172 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1p1d n LEU 173 N 10.70 0.00 0.00 4.31 4.77 -1.26 -1.97 117.00 133.55 1p1d n LEU 173 Ca 0.48 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.90 1p1d n LEU 173 Cb 0.45 -0.94 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 1p1d n LEU 173 CO 0.76 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 1p1d n GLY 174 N -0.44 0.62 5.64 -0.72 0.00 -1.26 -2.07 105.19 106.96 1p1d n GLY 174 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 1.02 0.00 -3.67 1.61 8.00 -0.83 -4.39 116.55 118.28 1p1d n ASP 175 Ca 0.00 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.22 1p1d n ASP 175 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 40.94 1p1d n ASP 175 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1p1d s LYS 176 N 0.00 0.46 -0.09 -1.24 -0.14 -1.26 -4.76 119.74 112.71 1p1d s LYS 176 Ca 0.00 -0.50 -0.17 0.00 -1.36 0.00 0.00 55.97 53.94 1p1d s LYS 176 Cb 0.00 -1.86 -0.05 0.00 -1.68 0.00 0.00 37.83 34.25 1p1d s LYS 176 CO 0.00 -0.78 0.44 -0.51 -0.76 0.00 0.00 175.35 173.74 1p1d s LEU 177 N 1.91 4.32 0.00 3.17 1.43 0.21 0.12 118.68 129.84 1p1d s LEU 177 Ca 0.03 0.82 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 1p1d s LEU 177 Cb -0.17 -2.64 0.00 0.00 0.03 0.00 0.00 46.19 43.41 1p1d s LEU 177 CO -0.17 0.09 0.00 0.00 0.23 0.00 0.00 176.35 176.50 1p1d n LEU 178 N 3.22 0.00 -3.75 1.79 -0.00 -0.84 -3.27 117.00 114.16 1p1d n LEU 178 Ca -0.09 -0.05 -0.13 0.00 -0.00 0.00 0.00 56.01 55.75 1p1d n LEU 178 Cb 0.52 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.81 1p1d n LEU 178 CO 0.41 0.00 -0.15 0.00 -0.00 0.00 0.00 177.39 177.65 1p1d s ALA 179 N -0.43 -0.47 -0.09 1.47 0.00 -0.99 -2.35 121.76 118.89 1p1d s ALA 179 Ca 0.00 0.81 -0.02 0.00 0.00 0.00 0.00 51.96 52.75 1p1d s ALA 179 Cb 0.00 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.64 1p1d s ALA 179 CO 0.00 -0.16 0.01 0.42 0.00 0.00 0.00 175.76 176.03 1p1d s ILE 180 N 0.93 0.37 -1.35 0.00 1.01 0.26 0.85 121.20 123.26 1p1d s ILE 180 Ca -0.07 0.04 -0.07 0.00 0.00 0.00 0.00 60.65 60.55 1p1d s ILE 180 Cb -0.08 -0.59 0.02 0.00 0.01 0.00 0.00 42.46 41.82 1p1d s ILE 180 CO -0.06 0.18 1.04 0.47 0.00 0.00 0.00 174.94 176.58 1p1d n ASP 181 N 5.14 -4.42 0.00 3.58 8.00 0.91 -1.53 116.55 128.24 1p1d n ASP 181 Ca -0.07 -0.64 0.00 0.00 0.71 0.00 0.00 54.79 54.78 1p1d n ASP 181 Cb 0.50 -4.69 0.00 0.00 -0.02 0.00 0.00 41.12 36.90 1p1d n ASP 181 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1p1d n ASN 182 N -3.01 0.00 -4.87 -2.24 2.85 -1.26 -4.97 115.26 101.76 1p1d n ASN 182 Ca -0.09 0.00 -0.31 0.00 -0.11 0.00 0.00 54.58 54.07 1p1d n ASN 182 Cb 0.59 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.61 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 -0.93 4.69 -0.08 -1.44 -1.09 -0.58 -5.06 121.20 116.71 1p1d s ILE 183 Ca 0.00 0.88 0.01 0.00 -2.23 0.00 0.00 60.65 59.31 1p1d s ILE 183 Cb 0.00 -3.81 0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1p1d s ILE 183 CO 0.00 -0.93 -0.10 -0.13 -1.23 0.00 0.00 174.94 172.55 1p1d s ARG 184 N -4.70 1.55 0.00 2.79 0.52 -1.26 0.89 118.95 118.74 1p1d s ARG 184 Ca 0.55 -0.33 0.31 0.00 -0.52 0.00 0.00 55.73 55.74 1p1d s ARG 184 Cb -0.11 -1.41 1.62 0.00 0.52 0.00 0.00 34.95 35.57 1p1d s ARG 184 CO 0.45 -0.09 2.09 1.28 0.02 0.00 0.00 175.30 179.05 1p1d n LEU 185 N 4.23 0.00 -0.56 2.53 7.99 -0.99 -3.95 117.00 126.25 1p1d n LEU 185 Ca -0.19 0.21 0.45 0.00 -0.01 0.00 0.00 56.01 56.47 1p1d n LEU 185 Cb 0.51 -0.21 0.75 0.00 -0.11 0.00 0.00 43.42 44.36 1p1d n LEU 185 CO 0.22 -0.00 1.37 -0.78 -1.51 0.00 0.00 177.39 176.69 1p1d h ASP 186 N 0.00 0.09 0.00 -1.43 1.82 -1.82 0.23 116.42 115.31 1p1d h ASP 186 Ca 0.00 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.70 1p1d h ASP 186 Cb 0.21 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.27 1p1d h ASP 186 CO 0.00 -0.08 -0.93 -0.24 -1.61 0.00 0.00 179.24 176.39 1p1d n SER 187 N -4.27 2.81 -1.99 2.28 2.88 -1.25 -5.02 113.62 109.06 1p1d n SER 187 Ca 0.40 -0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 1p1d n SER 187 Cb 1.71 1.16 0.00 0.00 -0.75 0.00 0.00 64.21 66.32 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p1d n SER 189 N -2.93 0.91 0.02 0.00 7.64 -1.26 -4.35 113.62 113.65 1p1d n SER 189 Ca 0.00 -0.75 -0.11 0.00 1.01 0.00 0.00 58.87 59.02 1p1d n SER 189 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.12 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 0.00 -0.13 -0.65 1.43 4.05 -1.67 -3.21 114.93 114.75 1p1d h MET 190 Ca 0.00 0.01 0.19 0.00 -0.28 0.00 0.00 59.70 59.62 1p1d h MET 190 Cb 0.00 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.80 1p1d h MET 190 CO 0.00 0.38 0.47 0.93 0.23 0.00 0.00 176.91 178.93 1p1d h GLU 191 N -0.85 0.00 0.23 0.39 4.39 -1.92 -0.60 114.58 116.22 1p1d h GLU 191 Ca -0.01 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1p1d h GLU 191 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1p1d h GLU 191 CO 0.02 0.00 -0.11 0.22 -1.16 0.00 0.00 179.01 177.98 1p1d h ASP 192 N 0.00 -0.27 -0.73 1.42 1.82 -1.96 0.40 116.42 117.10 1p1d h ASP 192 Ca 0.31 0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.99 1p1d h ASP 192 Cb 1.25 0.07 -0.05 0.00 0.68 0.00 0.00 39.33 41.28 1p1d h ASP 192 CO -0.00 -0.19 0.45 0.00 -1.61 0.00 0.00 179.24 177.89 1p1d h ALA 193 N 0.46 0.97 -0.14 -0.78 0.00 -1.15 0.37 119.26 118.99 1p1d h ALA 193 Ca -0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1p1d h ALA 193 Cb 0.24 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1p1d h ALA 193 CO 0.05 0.22 -0.12 0.28 0.00 0.00 0.00 179.25 179.67 1p1d h VAL 194 N 0.87 1.17 -0.14 0.00 2.07 -1.06 0.35 116.25 119.51 1p1d h VAL 194 Ca 0.30 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1p1d h VAL 194 Cb 0.05 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1p1d h VAL 194 CO -0.13 0.23 0.04 1.56 0.02 0.00 0.00 177.57 179.30 1p1d h GLN 195 N 0.20 0.21 0.00 1.57 7.50 0.18 -1.92 115.11 122.86 1p1d h GLN 195 Ca 0.04 -0.04 -0.06 0.00 0.50 0.00 0.00 58.65 59.08 1p1d h GLN 195 Cb 0.35 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 27.84 1p1d h GLN 195 CO 0.02 0.34 -0.31 0.82 -1.50 0.00 0.00 178.83 178.20 1p1d h ILE 196 N 0.04 0.69 -0.57 2.54 5.03 -0.76 -2.36 117.51 122.12 1p1d h ILE 196 Ca 0.04 -1.40 -0.06 0.00 -0.12 0.00 0.00 64.86 63.33 1p1d h ILE 196 Cb 0.21 1.92 -0.03 0.00 -3.03 0.00 0.00 36.82 35.89 1p1d h ILE 196 CO -0.00 0.30 0.13 0.25 -0.68 0.00 0.00 178.15 178.15 1p1d h LEU 197 N 0.00 0.84 0.00 1.44 5.85 0.20 -1.86 115.31 121.78 1p1d h LEU 197 Ca -0.00 -0.16 -0.11 0.00 0.84 0.00 0.00 57.88 58.45 1p1d h LEU 197 Cb 0.89 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 1p1d h LEU 197 CO 0.04 0.82 -0.68 1.56 -0.34 0.00 0.00 178.44 179.85 1p1d h GLN 198 N 0.86 0.00 0.00 1.25 4.20 -1.26 -3.34 115.11 116.81 1p1d h GLN 198 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1p1d h GLN 198 Cb 0.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1p1d h GLN 198 CO 0.00 0.71 0.14 -0.56 -0.67 0.00 0.00 178.83 178.45 1p1d h GLN 199 N -1.00 0.00 -1.67 1.46 -0.00 -1.51 -1.61 115.11 110.79 1p1d h GLN 199 Ca -0.16 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 58.17 1p1d h GLN 199 Cb 0.94 0.00 -0.13 0.00 -0.00 0.00 0.00 27.48 28.29 1p1d h GLN 199 CO -0.10 0.00 0.34 0.00 -0.00 0.00 0.00 178.83 179.07 1p1d n GLU 201 N 0.64 2.18 0.00 0.00 0.28 -0.61 -2.48 120.64 120.65 1p1d n GLU 201 Ca 0.31 -1.67 0.00 0.00 -0.16 0.00 0.00 57.16 55.64 1p1d n GLU 201 Cb 0.58 -2.63 0.00 0.00 1.43 0.00 0.00 31.44 30.83 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 4.90 0.00 0.00 -1.84 8.00 -1.25 -4.34 116.55 122.02 1p1d n ASP 202 Ca 0.49 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.99 1p1d n ASP 202 Cb 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 1p1d n ASP 202 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1p1d n LEU 203 N -0.60 0.00 -4.60 0.64 0.00 -1.04 -1.52 117.00 109.89 1p1d n LEU 203 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.64 1p1d n LEU 203 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.31 1p1d n LEU 203 CO 0.00 0.00 -0.18 0.68 0.00 0.00 0.00 177.39 177.89 1p1d s VAL 204 N 0.00 5.23 -0.39 1.96 -7.23 -0.45 -4.85 120.40 114.67 1p1d s VAL 204 Ca 0.00 0.14 -0.11 0.00 -1.81 0.00 0.00 61.98 60.20 1p1d s VAL 204 Cb 0.00 -3.48 0.04 0.00 0.56 0.00 0.00 36.38 33.50 1p1d s VAL 204 CO 0.00 0.28 0.23 -0.75 -0.31 0.00 0.00 175.10 174.55 1p1d s LYS 205 N 1.56 2.78 -0.31 4.82 2.20 -1.26 -2.09 119.74 127.45 1p1d s LYS 205 Ca 0.07 -1.18 -0.19 0.00 -0.36 0.00 0.00 55.97 54.31 1p1d s LYS 205 Cb -0.15 -3.77 -0.01 0.00 -1.51 0.00 0.00 37.83 32.39 1p1d s LYS 205 CO 0.09 -0.78 0.56 -0.51 -0.36 0.00 0.00 175.35 174.36 1p1d s LEU 206 N 1.53 4.17 -0.37 5.43 1.02 -0.97 -0.06 118.68 129.43 1p1d s LEU 206 Ca 0.02 0.33 -0.09 0.00 0.02 0.00 0.00 54.13 54.41 1p1d s LEU 206 Cb -0.20 -2.71 0.05 0.00 0.02 0.00 0.00 46.19 43.35 1p1d s LEU 206 CO 0.06 -0.43 0.18 -0.75 0.02 0.00 0.00 176.35 175.43 1p1d s LYS 207 N 2.47 2.67 0.49 1.70 2.20 0.25 -0.92 119.74 128.60 1p1d s LYS 207 Ca 0.22 -1.22 0.06 0.00 -0.36 0.00 0.00 55.97 54.67 1p1d s LYS 207 Cb -0.15 -3.63 0.00 0.00 -1.51 0.00 0.00 37.83 32.54 1p1d s LYS 207 CO 0.12 -0.75 0.30 0.96 -0.36 0.00 0.00 175.35 175.61 1p1d s ILE 208 N 1.45 1.90 -0.21 5.43 -0.00 -0.37 -1.98 121.20 127.43 1p1d s ILE 208 Ca 0.01 -1.58 -0.02 0.00 -0.00 0.00 0.00 60.65 59.05 1p1d s ILE 208 Cb -0.20 -2.48 -0.00 0.00 -0.00 0.00 0.00 42.46 39.78 1p1d s ILE 208 CO 0.04 0.00 -0.09 -0.60 -0.00 0.00 0.00 174.94 174.29 1p1d s ARG 209 N -4.12 3.26 -0.24 0.37 6.06 0.33 -2.21 118.95 122.40 1p1d s ARG 209 Ca 0.35 -0.68 0.01 0.00 -2.50 0.00 0.00 55.73 52.90 1p1d s ARG 209 Cb -0.00 -2.88 0.06 0.00 0.06 0.00 0.00 34.95 32.19 1p1d s ARG 209 CO 0.20 -0.20 -0.04 0.21 -2.50 0.00 0.00 175.30 172.98 1p1d s LYS 210 N 1.42 1.54 -0.12 5.12 2.36 -0.91 -4.01 119.74 125.15 1p1d s LYS 210 Ca 0.05 -1.04 0.01 0.00 -2.55 0.00 0.00 55.97 52.45 1p1d s LYS 210 Cb -0.14 -2.58 0.02 0.00 -1.05 0.00 0.00 37.83 34.08 1p1d s LYS 210 CO -0.06 -0.64 0.72 -0.25 1.55 0.00 0.00 175.35 176.67 1p1d n ASP 211 N 4.66 -0.42 -1.95 1.43 8.00 -1.26 0.16 116.55 127.17 1p1d n ASP 211 Ca -0.10 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.16 1p1d n ASP 211 Cb 0.44 0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.92 1p1d n ASP 211 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1p1d n GLU 212 N -0.23 0.64 0.00 -1.24 0.28 -1.26 -5.05 120.64 113.78 1p1d n GLU 212 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.88 1p1d n GLU 212 Cb 0.56 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.43 1p1d n GLU 212 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50