#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 5.40 0.03 5.09 0.11 -1.26 -5.09 120.40 124.68 1p1d s VAL 19 Ca 0.00 0.34 -0.27 0.00 -2.93 0.00 0.00 61.98 59.12 1p1d s VAL 19 Cb 0.00 -3.47 0.09 0.00 -1.53 0.00 0.00 36.38 31.46 1p1d s VAL 19 CO 0.00 0.59 0.74 0.54 -3.33 0.00 0.00 175.10 173.64 1p1d s VAL 20 N -0.90 0.00 -0.10 2.04 0.11 -1.26 -5.08 120.40 115.21 1p1d s VAL 20 Ca 0.16 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.20 1p1d s VAL 20 Cb -0.13 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.69 1p1d s VAL 20 CO 0.05 0.00 -0.05 -1.38 -3.33 0.00 0.00 175.10 170.40 1p1d s HIS 21 N -2.61 3.01 1.11 1.54 -3.43 -1.26 -4.97 115.29 108.67 1p1d s HIS 21 Ca -0.01 -0.08 -0.16 0.00 -0.80 0.00 0.00 55.06 54.01 1p1d s HIS 21 Cb -0.01 -1.82 0.15 0.00 -1.43 0.00 0.00 32.58 29.48 1p1d s HIS 21 CO -0.04 0.21 0.39 0.25 -2.00 0.00 0.00 174.74 173.55 1p1d n THR 22 N 2.71 0.00 -3.48 -5.38 -2.24 -1.26 -3.67 114.28 100.96 1p1d n THR 22 Ca -0.18 -0.31 -0.12 0.00 -2.27 0.00 0.00 64.05 61.17 1p1d n THR 22 Cb 0.53 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 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 -3.79 1.03 0.09 -0.78 0.41 0.12 -4.85 118.70 110.93 1p1d s GLU 23 Ca 0.60 -0.19 0.07 0.00 -0.41 0.00 0.00 54.97 55.04 1p1d s GLU 23 Cb -0.17 0.48 -0.04 0.00 -1.78 0.00 0.00 34.13 32.61 1p1d s GLU 23 CO 0.66 -0.41 -0.11 0.95 -0.49 0.00 0.00 175.26 175.86 1p1d s THR 24 N -2.71 3.31 0.15 3.63 -4.23 -1.26 0.02 115.64 114.55 1p1d s THR 24 Ca -0.01 -1.24 -0.05 0.00 -1.18 0.00 0.00 61.69 59.21 1p1d s THR 24 Cb -0.01 -2.52 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 1p1d s THR 24 CO -0.05 0.15 0.18 0.28 -0.54 0.00 0.00 174.62 174.64 1p1d s THR 25 N -1.17 0.08 0.22 3.99 -1.32 0.74 -4.98 115.64 113.20 1p1d s THR 25 Ca 0.20 -1.64 0.05 0.00 -1.21 0.00 0.00 61.69 59.09 1p1d s THR 25 Cb -0.11 -1.97 -0.03 0.00 -1.51 0.00 0.00 72.50 68.88 1p1d s THR 25 CO 0.12 -0.35 0.29 -1.83 -2.21 0.00 0.00 174.62 170.64 1p1d s GLU 26 N -4.01 3.27 0.02 7.08 1.03 -1.26 -0.95 118.70 123.87 1p1d s GLU 26 Ca 0.21 -0.82 -0.06 0.00 0.03 0.00 0.00 54.97 54.34 1p1d s GLU 26 Cb 0.05 -2.80 -0.01 0.00 -0.80 0.00 0.00 34.13 30.58 1p1d s GLU 26 CO 0.02 0.44 0.10 0.54 -1.33 0.00 0.00 175.26 175.02 1p1d s VAL 27 N -1.97 0.11 -0.21 1.83 0.11 0.18 -4.90 120.40 115.54 1p1d s VAL 27 Ca 0.34 -0.87 -0.00 0.00 -2.93 0.00 0.00 61.98 58.51 1p1d s VAL 27 Cb -0.09 -0.57 0.06 0.00 -1.53 0.00 0.00 36.38 34.24 1p1d s VAL 27 CO 0.27 -0.48 -0.03 -0.69 -3.33 0.00 0.00 175.10 170.85 1p1d s VAL 28 N -1.84 1.17 -0.24 2.04 1.01 -1.26 -2.09 120.40 119.19 1p1d s VAL 28 Ca -0.11 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 1p1d s VAL 28 Cb -0.06 -1.50 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 1p1d s VAL 28 CO -0.01 -0.10 0.01 -0.76 0.00 0.00 0.00 175.10 174.25 1p1d s LEU 29 N 1.57 3.25 0.28 3.92 1.02 -0.36 -4.74 118.68 123.62 1p1d s LEU 29 Ca -0.03 -0.43 0.08 0.00 0.02 0.00 0.00 54.13 53.77 1p1d s LEU 29 Cb -0.18 -1.81 -0.04 0.00 0.02 0.00 0.00 46.19 44.18 1p1d s LEU 29 CO -0.07 -0.06 0.13 0.42 0.02 0.00 0.00 176.35 176.79 1p1d s THR 30 N 1.51 3.73 -0.39 5.49 -4.23 -1.26 0.15 115.64 120.64 1p1d s THR 30 Ca 0.05 -1.63 -0.19 0.00 -1.18 0.00 0.00 61.69 58.74 1p1d s THR 30 Cb -0.15 -3.11 0.01 0.00 1.34 0.00 0.00 72.50 70.59 1p1d s THR 30 CO -0.00 -0.31 0.57 0.00 -0.54 0.00 0.00 174.62 174.34 1p1d s ALA 31 N -2.27 3.42 0.34 3.99 0.00 -0.90 -4.38 121.76 121.95 1p1d s ALA 31 Ca 0.34 -1.12 -0.05 0.00 0.00 0.00 0.00 51.96 51.13 1p1d s ALA 31 Cb -0.06 -3.15 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1p1d s ALA 31 CO 0.23 -1.49 0.61 0.16 0.00 0.00 0.00 175.76 175.27 1p1d s ASP 32 N 1.86 6.42 0.00 0.00 -4.77 -0.42 -4.81 116.67 114.95 1p1d s ASP 32 Ca 0.20 0.77 0.06 0.00 -3.30 0.00 0.00 52.55 50.28 1p1d s ASP 32 Cb -0.15 -2.17 0.36 0.00 -1.09 0.00 0.00 42.92 39.87 1p1d s ASP 32 CO 0.16 -0.28 1.04 -0.81 0.70 0.00 0.00 175.17 175.98 1p1d n PRO 33 N -1.26 0.78 -0.09 2.11 -0.04 -1.26 -0.49 135.00 134.77 1p1d n PRO 33 Ca -0.01 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.28 1p1d n PRO 33 Cb 0.54 -1.12 -0.07 0.00 -0.04 0.00 0.00 33.50 32.82 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 -0.62 0.94 -1.32 0.52 0.31 -1.26 -4.89 118.33 112.02 1p1d n VAL 34 Ca 0.05 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 1p1d n VAL 34 Cb 0.02 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.39 1p1d n VAL 34 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1p1d n THR 35 N -3.57 0.00 0.00 2.52 -2.24 -1.23 -5.07 114.28 104.70 1p1d n THR 35 Ca -0.33 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1p1d n THR 35 Cb 0.76 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 1p1d n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p1d n GLY 36 N 0.00 0.99 2.80 3.38 0.00 0.36 -4.41 105.19 108.31 1p1d n GLY 36 Ca 0.00 0.48 -0.27 0.00 0.00 0.00 0.00 46.02 46.24 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 1.22 -1.75 1.61 0.40 -1.26 -1.29 117.98 116.91 1p1d s PHE 37 Ca 0.00 -0.82 0.22 0.00 -0.60 0.00 0.00 56.93 55.73 1p1d s PHE 37 Cb 0.00 -1.09 1.23 0.00 0.51 0.00 0.00 43.02 43.67 1p1d s PHE 37 CO 0.00 -0.56 1.71 0.41 0.70 0.00 0.00 175.22 177.48 1p1d n GLY 38 N 5.00 -0.84 3.79 4.36 0.00 -1.26 -4.77 105.19 111.47 1p1d n GLY 38 Ca -0.10 -0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.25 5.08 -0.21 -0.61 1.01 -1.26 0.37 121.20 123.33 1p1d s ILE 39 Ca 0.28 0.86 -0.03 0.00 0.00 0.00 0.00 60.65 61.76 1p1d s ILE 39 Cb 0.15 -3.74 -0.00 0.00 0.01 0.00 0.00 42.46 38.88 1p1d s ILE 39 CO 0.29 0.49 -0.08 -1.10 0.00 0.00 0.00 174.94 174.54 1p1d s GLN 40 N -0.47 3.29 -0.07 2.79 -0.21 0.47 -4.99 119.66 120.47 1p1d s GLN 40 Ca 0.24 -0.67 -0.13 0.00 0.02 0.00 0.00 55.36 54.81 1p1d s GLN 40 Cb -0.16 -2.89 -0.05 0.00 1.00 0.00 0.00 33.01 30.91 1p1d s GLN 40 CO 0.12 -0.17 0.33 -0.51 -2.12 0.00 0.00 175.29 172.93 1p1d s LEU 41 N 1.37 4.39 0.41 2.90 1.02 -1.26 0.17 118.68 127.66 1p1d s LEU 41 Ca 0.05 0.74 0.07 0.00 0.02 0.00 0.00 54.13 55.01 1p1d s LEU 41 Cb -0.14 -2.43 -0.05 0.00 0.02 0.00 0.00 46.19 43.59 1p1d s LEU 41 CO -0.05 0.27 0.18 -1.58 0.02 0.00 0.00 176.35 175.18 1p1d s GLN 42 N -0.57 2.24 -0.44 1.70 0.74 0.67 -4.83 119.66 119.17 1p1d s GLN 42 Ca 0.20 -1.81 0.07 0.00 0.05 0.00 0.00 55.36 53.87 1p1d s GLN 42 Cb -0.15 -2.00 0.29 0.00 1.10 0.00 0.00 33.01 32.25 1p1d s GLN 42 CO 0.09 -0.09 0.87 0.41 -0.55 0.00 0.00 175.29 176.01 1p1d n GLY 43 N -1.23 1.38 2.73 2.59 0.00 -1.26 -2.31 105.19 107.09 1p1d n GLY 43 Ca -0.01 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.39 1p1d n GLY 43 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p1d n SER 44 N 0.93 -2.39 0.00 1.61 7.64 -1.26 -4.88 113.62 115.27 1p1d n SER 44 Ca 0.13 -3.40 0.00 0.00 1.01 0.00 0.00 58.87 56.61 1p1d n SER 44 Cb 0.64 1.81 0.00 0.00 -1.01 0.00 0.00 64.21 65.65 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1p1d n VAL 45 N 0.77 0.00 -0.33 0.44 0.31 -1.26 -4.33 118.33 113.93 1p1d n VAL 45 Ca 0.06 0.48 0.20 0.00 -0.01 0.00 0.00 64.34 65.07 1p1d n VAL 45 Cb 0.68 -1.45 0.40 0.00 -0.91 0.00 0.00 33.84 32.56 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 0.31 -5.66 3.52 -0.00 -1.96 -3.46 116.94 109.69 1p1d h PHE 46 Ca 0.00 0.06 -0.11 0.00 -0.00 0.00 0.00 57.97 57.91 1p1d h PHE 46 Cb 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 35.95 35.98 1p1d h PHE 46 CO 0.00 -0.42 -0.54 0.00 -0.00 0.00 0.00 178.31 177.35 1p1d n ALA 47 N -2.78 -2.74 0.00 12.09 0.00 -1.26 -4.99 120.51 120.84 1p1d n ALA 47 Ca 0.28 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.30 1p1d n ALA 47 Cb 0.94 -2.61 0.00 0.00 0.00 0.00 0.00 19.45 17.78 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 -0.92 0.00 -0.83 0.00 5.66 -1.26 -5.15 114.28 111.78 1p1d n THR 48 Ca 0.01 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.66 1p1d n THR 48 Cb 0.53 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 69.42 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 -0.76 0.00 1.09 0.28 -1.26 -4.67 120.64 115.32 1p1d n GLU 49 Ca 0.00 -0.21 0.00 0.00 -0.16 0.00 0.00 57.16 56.79 1p1d n GLU 49 Cb 0.00 -1.41 0.00 0.00 1.43 0.00 0.00 31.44 31.46 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 -3.83 0.00 0.00 3.84 5.66 -1.26 -4.96 114.28 113.73 1p1d n THR 50 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1p1d n THR 50 Cb 0.65 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.43 1p1d n THR 50 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1p1d n LEU 51 N 0.00 0.00 -0.66 1.09 4.77 -1.26 -4.98 117.00 115.96 1p1d n LEU 51 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 1p1d n LEU 51 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1p1d n LEU 51 CO 0.00 0.00 -0.07 -0.24 -1.33 0.00 0.00 177.39 175.75 1p1d n SER 52 N -0.42 -4.46 -4.62 -1.43 2.88 -1.26 -4.83 113.62 99.48 1p1d n SER 52 Ca 0.00 0.18 -0.43 0.00 -1.33 0.00 0.00 58.87 57.29 1p1d n SER 52 Cb 0.00 -3.29 -0.02 0.00 -0.75 0.00 0.00 64.21 60.15 1p1d n SER 52 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1p1d s SER 53 N -1.91 6.59 0.55 -3.46 0.15 -1.26 -4.84 113.70 109.52 1p1d s SER 53 Ca 0.00 1.12 -0.18 0.00 0.70 0.00 0.00 55.95 57.59 1p1d s SER 53 Cb 0.00 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.72 1p1d s SER 53 CO 0.00 -1.16 1.09 -2.16 1.20 0.00 0.00 173.24 172.21 1p1d s PRO 54 N 4.35 3.40 -0.38 5.44 0.04 -1.26 -4.52 135.00 142.07 1p1d s PRO 54 Ca 0.57 1.44 -0.38 0.00 0.04 0.00 0.00 61.00 62.68 1p1d s PRO 54 Cb -0.16 -2.03 -0.14 0.00 0.04 0.00 0.00 34.50 32.21 1p1d s PRO 54 CO 0.25 -0.78 2.12 -2.30 0.04 0.00 0.00 177.00 176.34 1p1d n PRO 55 N -1.48 0.81 -4.07 0.56 -0.02 -1.26 -4.74 135.00 124.81 1p1d n PRO 55 Ca 0.10 0.23 -0.32 0.00 -2.02 0.00 0.00 63.50 61.50 1p1d n PRO 55 Cb 0.52 -2.18 -0.15 0.00 -0.02 0.00 0.00 33.50 31.67 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 6.54 3.34 0.05 2.45 2.34 -0.98 -0.16 118.68 132.26 1p1d s LEU 56 Ca 1.11 -1.34 -0.33 0.00 0.06 0.00 0.00 54.13 53.62 1p1d s LEU 56 Cb -1.05 -1.54 -0.12 0.00 -0.56 0.00 0.00 46.19 42.92 1p1d s LEU 56 CO 0.55 -0.18 1.76 -0.38 -1.06 0.00 0.00 176.35 177.04 1p1d n ILE 57 N 4.45 0.32 1.01 1.48 5.41 -1.26 -0.24 119.36 130.54 1p1d n ILE 57 Ca -0.14 -0.06 0.11 0.00 1.00 0.00 0.00 62.75 63.65 1p1d n ILE 57 Cb 0.43 -1.81 -0.02 0.00 -0.71 0.00 0.00 39.64 37.53 1p1d n ILE 57 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1p1d n SER 58 N 5.23 1.24 0.00 4.38 7.64 0.13 -2.00 113.62 130.24 1p1d n SER 58 Ca 0.19 -1.06 0.00 0.00 1.01 0.00 0.00 58.87 59.01 1p1d n SER 58 Cb 0.31 0.73 0.00 0.00 -1.01 0.00 0.00 64.21 64.24 1p1d n SER 58 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p1d n TYR 59 N -1.03 0.00 -4.13 1.43 9.36 -1.23 -4.99 117.16 116.56 1p1d n TYR 59 Ca 0.06 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 61.04 1p1d n TYR 59 Cb 0.37 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.01 1p1d n TYR 59 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1p1d s ILE 60 N -0.86 2.37 0.12 2.97 1.01 -1.26 -0.40 121.20 125.17 1p1d s ILE 60 Ca 0.00 -1.71 0.05 0.00 0.00 0.00 0.00 60.65 58.99 1p1d s ILE 60 Cb 0.00 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 1p1d s ILE 60 CO 0.00 -0.02 0.03 -0.70 0.00 0.00 0.00 174.94 174.25 1p1d s GLU 61 N -3.89 2.60 -0.46 2.79 2.12 0.16 -4.92 118.70 117.10 1p1d s GLU 61 Ca 0.41 -0.90 -0.03 0.00 0.36 0.00 0.00 54.97 54.81 1p1d s GLU 61 Cb 0.03 -2.53 0.15 0.00 0.26 0.00 0.00 34.13 32.04 1p1d s GLU 61 CO 0.22 0.51 2.47 0.00 -0.54 0.00 0.00 175.26 177.93 1p1d n ALA 62 N 0.23 6.09 0.00 6.30 0.00 -1.26 -3.98 120.51 127.89 1p1d n ALA 62 Ca -0.10 -2.77 0.00 0.00 0.00 0.00 0.00 53.44 50.57 1p1d n ALA 62 Cb 0.53 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 18.08 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 0.52 0.00 -3.86 0.00 -0.08 -1.26 -5.16 116.55 106.71 1p1d n ASP 63 Ca 0.45 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.61 1p1d n ASP 63 Cb 0.54 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.88 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 0.00 -0.04 0.20 1.67 0.15 -1.26 -4.74 113.70 109.69 1p1d s SER 64 Ca 0.00 0.06 0.14 0.00 0.70 0.00 0.00 55.95 56.85 1p1d s SER 64 Cb 0.00 0.17 0.76 0.00 -1.71 0.00 0.00 66.02 65.24 1p1d s SER 64 CO 0.00 -0.10 1.44 -0.81 1.20 0.00 0.00 173.24 174.97 1p1d n PRO 65 N 2.70 0.09 0.27 5.44 -0.04 -1.26 -1.52 135.00 140.69 1p1d n PRO 65 Ca -0.15 0.57 -0.15 0.00 -0.04 0.00 0.00 63.50 63.74 1p1d n PRO 65 Cb 0.58 -1.79 -0.08 0.00 -0.04 0.00 0.00 33.50 32.18 1p1d n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p1d h ALA 66 N 2.03 -0.70 0.00 0.55 0.00 -1.85 0.35 119.26 119.63 1p1d h ALA 66 Ca 0.00 -0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 1p1d h ALA 66 Cb 0.03 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1p1d h ALA 66 CO 0.00 -0.78 -0.93 1.49 0.00 0.00 0.00 179.25 179.03 1p1d h GLU 67 N -0.94 0.00 0.00 0.00 4.57 -1.79 -3.17 114.58 113.25 1p1d h GLU 67 Ca -0.07 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1p1d h GLU 67 Cb 0.62 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1p1d h GLU 67 CO 0.12 0.93 -0.01 0.00 -1.18 0.00 0.00 179.01 178.87 1p1d h ARG 68 N 0.00 0.00 -1.18 1.92 -0.00 -1.28 -3.08 114.38 110.76 1p1d h ARG 68 Ca -0.01 0.00 0.34 0.00 -0.50 0.00 0.00 59.98 59.81 1p1d h ARG 68 Cb 1.67 0.00 -0.05 0.00 0.00 0.00 0.00 29.97 31.59 1p1d h ARG 68 CO 0.12 0.01 0.90 0.00 0.00 0.00 0.00 179.97 181.00 1p1d n GLY 70 N -1.76 0.38 2.39 0.00 0.00 -1.16 -4.87 105.19 100.16 1p1d n GLY 70 Ca 0.26 -0.99 -0.02 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.52 0.36 -4.18 1.61 0.31 -1.24 -3.90 118.33 107.78 1p1d n VAL 71 Ca 0.00 -1.41 -0.13 0.00 -0.01 0.00 0.00 64.34 62.79 1p1d n VAL 71 Cb 0.26 1.02 -0.09 0.00 -0.91 0.00 0.00 33.84 34.12 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 -3.12 1.15 -0.10 7.52 1.43 -1.26 -4.77 118.68 119.53 1p1d s LEU 72 Ca 0.15 -1.41 -0.31 0.00 -1.03 0.00 0.00 54.13 51.53 1p1d s LEU 72 Cb 0.34 0.68 0.10 0.00 0.03 0.00 0.00 46.19 47.34 1p1d s LEU 72 CO -0.09 -0.96 0.83 -1.58 0.23 0.00 0.00 176.35 174.78 1p1d s GLN 73 N -3.91 0.84 -0.59 1.70 2.00 -1.26 -5.06 119.66 113.38 1p1d s GLN 73 Ca 0.37 0.20 -0.26 0.00 -2.00 0.00 0.00 55.36 53.66 1p1d s GLN 73 Cb 0.04 0.40 -0.10 0.00 0.80 0.00 0.00 33.01 34.15 1p1d s GLN 73 CO 0.15 -0.26 2.45 -0.89 -0.50 0.00 0.00 175.29 176.24 1p1d n ILE 74 N 0.81 -0.07 -0.54 -2.34 5.41 -1.26 -1.38 119.36 119.99 1p1d n ILE 74 Ca -0.15 -0.68 0.00 0.00 1.00 0.00 0.00 62.75 62.92 1p1d n ILE 74 Cb 0.58 -2.43 0.00 0.00 -0.71 0.00 0.00 39.64 37.08 1p1d n ILE 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1p1d n GLY 75 N 6.15 0.95 0.10 7.39 0.00 -0.84 -4.97 105.19 113.96 1p1d n GLY 75 Ca 0.42 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.42 1p1d n GLY 75 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p1d n ASP 76 N 0.28 0.70 -1.55 1.61 -0.08 -0.48 -4.85 116.55 112.19 1p1d n ASP 76 Ca 0.00 0.58 0.00 0.00 -1.51 0.00 0.00 54.79 53.86 1p1d n ASP 76 Cb 0.11 -0.76 0.00 0.00 2.34 0.00 0.00 41.12 42.81 1p1d n ASP 76 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1p1d n ARG 77 N -2.17 -4.40 -4.27 -0.67 1.74 -1.26 -3.29 116.66 102.35 1p1d n ARG 77 Ca 0.05 3.23 -0.28 0.00 -0.77 0.00 0.00 57.85 60.08 1p1d n ARG 77 Cb 0.38 -3.61 -0.10 0.00 -1.02 0.00 0.00 32.46 28.12 1p1d n ARG 77 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1p1d s VAL 78 N -2.76 3.22 -0.06 1.55 1.01 0.77 -3.90 120.40 120.23 1p1d s VAL 78 Ca 0.00 -1.50 0.03 0.00 0.00 0.00 0.00 61.98 60.51 1p1d s VAL 78 Cb 0.00 -2.55 -0.06 0.00 0.00 0.00 0.00 36.38 33.77 1p1d s VAL 78 CO 0.00 -0.01 -0.02 0.80 0.00 0.00 0.00 175.10 175.87 1p1d n MET 79 N 0.35 1.87 -3.77 2.72 1.56 0.05 -4.09 117.12 115.81 1p1d n MET 79 Ca -0.12 0.02 -0.13 0.00 -0.27 0.00 0.00 57.70 57.19 1p1d n MET 79 Cb 0.54 -1.15 -0.10 0.00 2.15 0.00 0.00 33.22 34.66 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 -2.14 -0.75 -0.21 -5.12 0.00 -1.26 -3.51 121.76 108.76 1p1d s ALA 80 Ca -0.06 0.70 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 1p1d s ALA 80 Cb 0.02 -0.34 0.06 0.00 0.00 0.00 0.00 23.12 22.85 1p1d s ALA 80 CO 0.21 -0.18 -0.03 0.42 0.00 0.00 0.00 175.76 176.18 1p1d s ILE 81 N -0.27 1.21 -1.43 0.00 1.01 0.50 -2.99 121.20 119.24 1p1d s ILE 81 Ca -0.04 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.67 1p1d s ILE 81 Cb -0.03 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.92 1p1d s ILE 81 CO 0.01 -0.08 0.00 0.59 0.00 0.00 0.00 174.94 175.47 1p1d n ASN 82 N 4.80 -4.24 0.00 3.58 3.02 -0.20 0.02 115.26 122.24 1p1d n ASN 82 Ca -0.11 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 1p1d n ASN 82 Cb 0.46 -3.72 0.00 0.00 -0.61 0.00 0.00 39.78 35.90 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 -0.58 3.09 3.71 7.41 0.00 -1.26 -5.05 105.19 112.51 1p1d n GLY 83 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.75 4.21 0.00 -0.61 1.01 0.10 -5.04 121.20 118.12 1p1d s ILE 84 Ca 0.00 1.58 0.00 0.00 0.00 0.00 0.00 60.65 62.23 1p1d s ILE 84 Cb 0.00 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.46 1p1d s ILE 84 CO 0.00 0.09 0.00 -2.65 0.00 0.00 0.00 174.94 172.38 1p1d n PRO 85 N 4.23 1.18 0.00 2.79 -0.02 -1.26 -0.37 135.00 141.55 1p1d n PRO 85 Ca 0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 1p1d n PRO 85 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.95 1p1d n PRO 85 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1p1d n THR 86 N -0.92 0.00 0.98 3.45 -2.24 -1.23 -4.38 114.28 109.93 1p1d n THR 86 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 1p1d n THR 86 Cb 0.00 -0.04 0.54 0.00 -2.10 0.00 0.00 70.33 68.73 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 -2.45 0.21 -2.01 -0.78 2.13 -1.26 -3.30 120.64 113.17 1p1d n GLU 87 Ca 0.00 0.09 -0.30 0.00 0.66 0.00 0.00 57.16 57.60 1p1d n GLU 87 Cb 0.00 -1.50 0.03 0.00 0.27 0.00 0.00 31.44 30.24 1p1d n GLU 87 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1p1d n ASP 88 N -1.36 5.91 -3.78 4.31 8.00 -1.26 -4.85 116.55 123.52 1p1d n ASP 88 Ca 0.09 -3.77 0.03 0.00 0.71 0.00 0.00 54.79 51.86 1p1d n ASP 88 Cb 0.21 -0.64 0.01 0.00 -0.02 0.00 0.00 41.12 40.67 1p1d n ASP 88 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1p1d s SER 89 N -2.74 -0.01 0.23 -2.24 0.15 -1.21 -5.02 113.70 102.86 1p1d s SER 89 Ca 0.53 -0.08 -0.21 0.00 0.70 0.00 0.00 55.95 56.89 1p1d s SER 89 Cb 0.43 0.07 -0.08 0.00 -1.71 0.00 0.00 66.02 64.73 1p1d s SER 89 CO -0.13 -0.13 0.75 -0.89 1.20 0.00 0.00 173.24 174.04 1p1d s THR 90 N -2.08 4.52 0.57 6.45 2.01 -1.26 -4.65 115.64 121.21 1p1d s THR 90 Ca 0.24 1.36 0.29 0.00 0.31 0.00 0.00 61.69 63.89 1p1d s THR 90 Cb 0.03 -3.88 0.42 0.00 0.01 0.00 0.00 72.50 69.07 1p1d s THR 90 CO -0.04 0.21 1.88 2.19 -0.69 0.00 0.00 174.62 178.18 1p1d h PHE 91 N 3.43 0.00 -0.72 4.92 -0.00 -1.89 0.62 116.94 123.31 1p1d h PHE 91 Ca -0.48 0.00 0.11 0.00 -0.00 0.00 0.00 57.97 57.60 1p1d h PHE 91 Cb 1.19 0.00 -0.05 0.00 -0.00 0.00 0.00 35.95 37.10 1p1d h PHE 91 CO 0.63 0.00 0.47 0.93 -0.00 0.00 0.00 178.31 180.35 1p1d h GLU 92 N 0.00 0.53 -0.55 6.09 5.08 -1.94 -0.54 114.58 123.26 1p1d h GLU 92 Ca 0.29 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.56 1p1d h GLU 92 Cb 1.40 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 1p1d h GLU 92 CO -0.00 0.35 0.10 1.05 -1.00 0.00 0.00 179.01 179.51 1p1d h GLU 93 N 0.55 0.86 -0.25 2.33 -0.00 -1.25 0.24 114.58 117.06 1p1d h GLU 93 Ca 0.34 -0.20 -0.13 0.00 -0.00 0.00 0.00 59.36 59.37 1p1d h GLU 93 Cb 0.57 -0.12 -0.01 0.00 -0.00 0.00 0.00 28.75 29.19 1p1d h GLU 93 CO -0.12 0.80 -0.38 0.00 -0.00 0.00 0.00 179.01 179.31 1p1d h ALA 94 N 1.28 0.87 -0.18 1.06 0.00 -1.24 -0.51 119.26 120.54 1p1d h ALA 94 Ca 0.17 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1p1d h ALA 94 Cb 0.35 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1p1d h ALA 94 CO 0.00 0.64 -0.45 -0.91 0.00 0.00 0.00 179.25 178.53 1p1d h ASN 95 N 0.47 0.71 -0.33 0.00 -0.26 -0.85 -1.93 115.58 113.39 1p1d h ASN 95 Ca 0.04 -0.57 -0.11 0.00 -0.56 0.00 0.00 56.30 55.10 1p1d h ASN 95 Cb 0.88 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 37.92 1p1d h ASN 95 CO 0.08 1.16 -0.24 0.06 -1.06 0.00 0.00 177.43 177.42 1p1d h GLN 96 N 0.30 0.74 -0.17 0.81 -0.00 -0.47 -2.57 115.11 113.77 1p1d h GLN 96 Ca -0.00 -0.36 -0.06 0.00 -0.00 0.00 0.00 58.65 58.23 1p1d h GLN 96 Cb 1.06 -0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.53 1p1d h GLN 96 CO 0.10 0.98 -0.15 1.37 -0.00 0.00 0.00 178.83 181.13 1p1d h LEU 97 N 0.51 0.26 0.64 0.06 8.10 -1.14 -2.48 115.31 121.26 1p1d h LEU 97 Ca 0.06 -0.06 -0.03 0.00 0.11 0.00 0.00 57.88 57.96 1p1d h LEU 97 Cb 0.80 -0.07 0.01 0.00 -0.44 0.00 0.00 40.66 40.96 1p1d h LEU 97 CO 0.06 0.43 -0.31 -0.07 -4.11 0.00 0.00 178.44 174.45 1p1d h LEU 98 N 0.26 -0.73 -1.96 0.17 3.38 -1.15 1.52 115.31 116.80 1p1d h LEU 98 Ca 0.05 -0.01 0.22 0.00 0.09 0.00 0.00 57.88 58.23 1p1d h LEU 98 Cb 0.42 0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1p1d h LEU 98 CO 0.03 -0.42 0.56 0.08 0.09 0.00 0.00 178.44 178.77 1p1d h ARG 99 N -1.01 0.03 -0.61 1.13 0.11 -1.35 0.27 114.38 112.95 1p1d h ARG 99 Ca -0.09 -0.00 -0.42 0.00 0.10 0.00 0.00 59.98 59.57 1p1d h ARG 99 Cb 0.70 -0.01 -0.29 0.00 1.11 0.00 0.00 29.97 31.48 1p1d h ARG 99 CO 0.14 0.02 -0.38 -0.25 0.10 0.00 0.00 179.97 179.60 1p1d n ASP 100 N -4.32 4.39 -1.22 0.08 8.00 -0.90 -4.62 116.55 117.97 1p1d n ASP 100 Ca 0.16 -3.79 0.08 0.00 0.71 0.00 0.00 54.79 51.95 1p1d n ASP 100 Cb 0.82 -0.52 0.29 0.00 -0.02 0.00 0.00 41.12 41.70 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 -0.88 4.18 -0.74 -2.24 7.64 0.51 -4.36 113.62 117.72 1p1d n SER 101 Ca 0.41 -2.50 0.08 0.00 1.01 0.00 0.00 58.87 57.88 1p1d n SER 101 Cb 0.90 -0.49 0.23 0.00 -1.01 0.00 0.00 64.21 63.84 1p1d n SER 101 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1p1d n SER 102 N 0.58 3.56 -0.08 6.43 7.64 -1.26 -4.35 113.62 126.13 1p1d n SER 102 Ca 0.22 -2.90 -0.10 0.00 1.01 0.00 0.00 58.87 57.09 1p1d n SER 102 Cb 0.80 -0.49 -0.03 0.00 -1.01 0.00 0.00 64.21 63.48 1p1d n SER 102 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1p1d h ILE 103 N 1.56 1.19 -0.03 0.44 2.04 -1.91 -2.61 117.51 118.20 1p1d h ILE 103 Ca 0.00 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1p1d h ILE 103 Cb 1.30 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 1p1d h ILE 103 CO 0.17 0.20 0.00 0.35 0.00 0.00 0.00 178.15 178.86 1p1d n THR 104 N -4.74 0.01 -2.03 -0.27 -2.24 -1.26 -4.93 114.28 98.82 1p1d n THR 104 Ca -0.03 -0.33 -0.18 0.00 -2.27 0.00 0.00 64.05 61.25 1p1d n THR 104 Cb 0.15 0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 69.13 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 0.52 -5.14 -3.59 3.42 7.64 -0.98 -4.95 113.62 110.54 1p1d n SER 105 Ca 0.18 0.15 -0.12 0.00 1.01 0.00 0.00 58.87 60.09 1p1d n SER 105 Cb 0.43 -4.21 -0.06 0.00 -1.01 0.00 0.00 64.21 59.36 1p1d n SER 105 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1p1d s LYS 106 N -4.36 0.67 -0.22 1.43 2.20 -1.26 -2.12 119.74 116.09 1p1d s LYS 106 Ca 0.00 0.38 -0.03 0.00 -0.36 0.00 0.00 55.97 55.96 1p1d s LYS 106 Cb 0.00 0.32 0.11 0.00 -1.51 0.00 0.00 37.83 36.75 1p1d s LYS 106 CO 0.00 -0.17 0.32 0.08 -0.36 0.00 0.00 175.35 175.23 1p1d s VAL 107 N -0.58 -0.50 -0.08 4.02 1.01 0.40 -4.87 120.40 119.79 1p1d s VAL 107 Ca -0.02 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.75 1p1d s VAL 107 Cb -0.02 -0.74 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 1p1d s VAL 107 CO 0.01 -0.13 0.42 -0.89 0.00 0.00 0.00 175.10 174.51 1p1d s THR 108 N 2.47 5.15 0.14 3.92 2.01 -1.26 -1.22 115.64 126.84 1p1d s THR 108 Ca 0.09 0.84 -0.03 0.00 0.31 0.00 0.00 61.69 62.90 1p1d s THR 108 Cb -0.15 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.58 1p1d s THR 108 CO -0.14 0.43 0.12 -1.48 -0.69 0.00 0.00 174.62 172.86 1p1d s LEU 109 N -0.03 1.54 -0.06 4.42 2.34 -0.89 -1.03 118.68 124.97 1p1d s LEU 109 Ca 0.23 -1.11 0.05 0.00 0.06 0.00 0.00 54.13 53.37 1p1d s LEU 109 Cb -0.15 0.56 -0.02 0.00 -0.56 0.00 0.00 46.19 46.02 1p1d s LEU 109 CO 0.10 -0.78 -0.20 -1.61 -1.06 0.00 0.00 176.35 172.81 1p1d s GLU 110 N -4.02 2.57 0.26 1.48 2.02 -1.16 -0.65 118.70 119.21 1p1d s GLU 110 Ca 0.22 -0.81 0.05 0.00 0.02 0.00 0.00 54.97 54.45 1p1d s GLU 110 Cb 0.06 -2.28 -0.06 0.00 0.10 0.00 0.00 34.13 31.96 1p1d s GLU 110 CO 0.01 0.47 -0.01 0.96 0.02 0.00 0.00 175.26 176.71 1p1d s ILE 111 N -0.36 1.26 0.01 -1.63 -4.36 -0.13 -0.77 121.20 115.23 1p1d s ILE 111 Ca 0.03 -2.06 0.05 0.00 -0.26 0.00 0.00 60.65 58.41 1p1d s ILE 111 Cb -0.12 -2.45 -0.02 0.00 1.25 0.00 0.00 42.46 41.12 1p1d s ILE 111 CO 0.02 -0.26 -0.15 -0.70 0.24 0.00 0.00 174.94 174.08 1p1d s GLU 112 N -3.82 1.14 0.31 0.37 2.12 -1.21 -0.18 118.70 117.43 1p1d s GLU 112 Ca 0.30 -0.67 -0.19 0.00 0.36 0.00 0.00 54.97 54.77 1p1d s GLU 112 Cb 0.06 -1.14 0.04 0.00 0.26 0.00 0.00 34.13 33.35 1p1d s GLU 112 CO 0.11 0.30 0.80 -0.59 -0.54 0.00 0.00 175.26 175.34 1p1d s PHE 113 N -0.59 -0.02 0.28 5.30 -0.12 0.10 -4.75 117.98 118.17 1p1d s PHE 113 Ca 0.05 -0.52 -0.11 0.00 -0.05 0.00 0.00 56.93 56.29 1p1d s PHE 113 Cb -0.07 0.76 -0.08 0.00 -0.63 0.00 0.00 43.02 43.01 1p1d s PHE 113 CO 0.00 -1.33 0.63 -0.51 -0.05 0.00 0.00 175.22 173.96 1p1d s ASP 114 N -3.03 6.67 -0.47 1.98 1.01 -1.26 0.13 116.67 121.71 1p1d s ASP 114 Ca 0.14 1.06 -0.14 0.00 0.71 0.00 0.00 52.55 54.32 1p1d s ASP 114 Cb -0.05 -2.28 0.08 0.00 1.01 0.00 0.00 42.92 41.68 1p1d s ASP 114 CO 0.08 -0.15 0.37 0.68 0.21 0.00 0.00 175.17 176.37 1p1d s VAL 115 N -1.92 5.00 -0.29 -1.27 -7.23 -1.24 -4.92 120.40 108.52 1p1d s VAL 115 Ca 0.50 -1.18 -0.16 0.00 -1.81 0.00 0.00 61.98 59.33 1p1d s VAL 115 Cb -0.11 -4.02 0.14 0.00 0.56 0.00 0.00 36.38 32.95 1p1d s VAL 115 CO 0.21 -0.59 0.94 0.00 -0.31 0.00 0.00 175.10 175.35 1p1d s ALA 116 N 1.59 -2.22 0.00 1.32 0.00 0.48 -4.56 121.76 118.37 1p1d s ALA 116 Ca 0.04 2.22 0.00 0.00 0.00 0.00 0.00 51.96 54.22 1p1d s ALA 116 Cb -0.24 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1p1d s ALA 116 CO 0.05 -0.35 0.57 0.39 0.00 0.00 0.00 175.76 176.43 1p1d n GLU 117 N 3.74 0.80 -1.50 0.00 -0.58 -1.26 -4.73 120.64 117.11 1p1d n GLU 117 Ca -0.19 -0.73 0.00 0.00 -0.42 0.00 0.00 57.16 55.82 1p1d n GLU 117 Cb 0.58 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 30.70 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 -0.16 -2.00 -4.90 1.62 2.88 -1.26 -4.36 113.62 105.44 1p1d n SER 118 Ca 0.00 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.21 1p1d n SER 118 Cb 0.29 -1.00 -0.05 0.00 -0.75 0.00 0.00 64.21 62.70 1p1d n SER 118 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1p1d s VAL 119 N -2.76 5.29 -0.31 2.46 -7.23 -1.26 -2.88 120.40 113.71 1p1d s VAL 119 Ca 0.00 -0.02 0.03 0.00 -1.81 0.00 0.00 61.98 60.18 1p1d s VAL 119 Cb 0.00 -3.60 0.09 0.00 0.56 0.00 0.00 36.38 33.43 1p1d s VAL 119 CO 0.00 0.22 0.03 0.27 -0.31 0.00 0.00 175.10 175.31 1p1d s ILE 120 N -1.45 1.91 0.38 -0.62 -5.25 -0.36 -4.97 121.20 110.84 1p1d s ILE 120 Ca 0.33 -1.96 -0.09 0.00 -0.99 0.00 0.00 60.65 57.94 1p1d s ILE 120 Cb -0.13 -2.35 -0.06 0.00 2.95 0.00 0.00 42.46 42.88 1p1d s ILE 120 CO 0.21 -0.49 0.72 -2.16 -1.79 0.00 0.00 174.94 171.43 1p1d s PRO 121 N 1.12 3.74 0.00 0.37 0.04 -1.26 -2.19 135.00 136.82 1p1d s PRO 121 Ca 0.07 0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.46 1p1d s PRO 121 Cb -0.19 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1p1d s PRO 121 CO -0.11 0.02 0.62 0.43 0.04 0.00 0.00 177.00 178.01 1p1d n SER 122 N -1.22 -0.37 -2.12 6.66 7.64 -1.23 -5.00 113.62 117.98 1p1d n SER 122 Ca 0.01 -1.24 0.00 0.00 1.01 0.00 0.00 58.87 58.66 1p1d n SER 122 Cb 0.54 0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 1p1d n SER 122 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1p1d n SER 123 N 0.00 -8.37 0.00 6.43 7.64 -1.26 -4.47 113.62 113.59 1p1d n SER 123 Ca -0.10 1.47 0.00 0.00 1.01 0.00 0.00 58.87 61.25 1p1d n SER 123 Cb 0.52 -4.86 0.00 0.00 -1.01 0.00 0.00 64.21 58.86 1p1d n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p1d n GLY 124 N 1.93 2.36 2.81 0.23 0.00 0.01 -4.88 105.19 107.65 1p1d n GLY 124 Ca 0.00 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 1p1d n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1d s THR 125 N -0.26 1.15 -0.29 2.61 2.01 -1.26 -2.06 115.64 117.54 1p1d s THR 125 Ca 0.00 -1.44 -0.07 0.00 0.31 0.00 0.00 61.69 60.49 1p1d s THR 125 Cb 0.00 -1.78 -0.00 0.00 0.01 0.00 0.00 72.50 70.73 1p1d s THR 125 CO 0.00 -0.54 0.09 0.12 -0.69 0.00 0.00 174.62 173.61 1p1d s PHE 126 N 1.50 3.14 -0.03 4.92 2.19 -0.15 -3.50 117.98 126.05 1p1d s PHE 126 Ca 0.07 -0.80 -0.04 0.00 0.33 0.00 0.00 56.93 56.49 1p1d s PHE 126 Cb -0.18 -2.27 -0.04 0.00 -1.31 0.00 0.00 43.02 39.22 1p1d s PHE 126 CO -0.18 -0.51 0.19 -1.01 1.83 0.00 0.00 175.22 175.53 1p1d s HIS 127 N 1.54 3.56 -0.41 10.12 3.76 -0.93 -0.82 115.29 132.11 1p1d s HIS 127 Ca 0.04 0.41 0.02 0.00 -0.15 0.00 0.00 55.06 55.38 1p1d s HIS 127 Cb -0.17 -1.87 0.11 0.00 1.11 0.00 0.00 32.58 31.77 1p1d s HIS 127 CO 0.03 0.66 0.15 0.08 -0.85 0.00 0.00 174.74 174.81 1p1d s VAL 128 N -1.27 2.62 -0.75 -0.90 1.01 -0.42 -1.22 120.40 119.46 1p1d s VAL 128 Ca 0.25 -2.55 -0.26 0.00 0.00 0.00 0.00 61.98 59.42 1p1d s VAL 128 Cb -0.13 -2.86 0.04 0.00 0.00 0.00 0.00 36.38 33.43 1p1d s VAL 128 CO 0.16 -0.68 1.25 -0.54 0.00 0.00 0.00 175.10 175.29 1p1d s LYS 129 N 0.62 3.22 -0.29 2.72 1.02 -1.14 -2.14 119.74 123.75 1p1d s LYS 129 Ca 0.12 -0.42 -0.06 0.00 0.02 0.00 0.00 55.97 55.63 1p1d s LYS 129 Cb -0.21 -4.30 0.01 0.00 -0.52 0.00 0.00 37.83 32.81 1p1d s LYS 129 CO -0.05 -2.10 0.05 -0.51 -0.92 0.00 0.00 175.35 171.82 1p1d s LEU 130 N 5.39 3.73 -0.22 3.17 1.02 -0.96 -4.30 118.68 126.51 1p1d s LEU 130 Ca 0.34 -0.76 -0.28 0.00 0.02 0.00 0.00 54.13 53.45 1p1d s LEU 130 Cb -0.09 -1.83 -0.05 0.00 0.02 0.00 0.00 46.19 44.24 1p1d s LEU 130 CO 0.12 -0.18 2.17 -2.84 0.02 0.00 0.00 176.35 175.64 1p1d s PRO 131 N 1.46 3.18 0.41 1.29 0.02 -1.26 -1.92 135.00 138.18 1p1d s PRO 131 Ca 0.02 1.98 -0.04 0.00 0.02 0.00 0.00 61.00 62.98 1p1d s PRO 131 Cb -0.17 -4.35 -0.04 0.00 0.02 0.00 0.00 34.50 29.96 1p1d s PRO 131 CO 0.01 -2.05 0.69 0.15 -0.33 0.00 0.00 177.00 175.47 1p1d s LYS 132 N 6.23 3.57 0.48 5.54 1.02 -0.62 -4.85 119.74 131.11 1p1d s LYS 132 Ca 0.98 0.06 0.02 0.00 0.02 0.00 0.00 55.97 57.05 1p1d s LYS 132 Cb -0.32 -2.49 -0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1p1d s LYS 132 CO 0.35 -0.04 0.04 -1.59 -0.92 0.00 0.00 175.35 173.19 1p1d s LYS 133 N -4.36 2.12 0.00 1.68 0.00 -1.26 -3.57 119.74 114.35 1p1d s LYS 133 Ca 0.45 -2.34 0.00 0.00 0.00 0.00 0.00 55.97 54.09 1p1d s LYS 133 Cb -0.10 -1.27 0.00 0.00 0.00 0.00 0.00 37.83 36.46 1p1d s LYS 133 CO 0.39 -0.39 0.57 1.58 0.00 0.00 0.00 175.35 177.50 1p1d n HIS 134 N -1.16 0.00 -3.55 1.78 -0.00 -1.26 -4.41 115.22 106.62 1p1d n HIS 134 Ca -0.15 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.28 1p1d n HIS 134 Cb 0.66 -0.07 -0.14 0.00 -0.00 0.00 0.00 29.99 30.44 1p1d n HIS 134 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 1p1d s SER 135 N -2.91 3.47 -0.04 0.26 0.01 -1.26 -4.86 113.70 108.37 1p1d s SER 135 Ca 0.00 -1.58 -0.04 0.00 1.31 0.00 0.00 55.95 55.64 1p1d s SER 135 Cb 0.00 -0.45 0.01 0.00 0.21 0.00 0.00 66.02 65.79 1p1d s SER 135 CO 0.00 -0.40 0.11 -0.69 0.41 0.00 0.00 173.24 172.67 1p1d s VAL 136 N 1.75 0.01 0.39 3.43 1.01 -1.26 -5.07 120.40 120.66 1p1d s VAL 136 Ca 0.11 -0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.72 1p1d s VAL 136 Cb -0.18 -0.20 -0.09 0.00 0.00 0.00 0.00 36.38 35.91 1p1d s VAL 136 CO -0.26 -0.06 1.32 -1.83 0.00 0.00 0.00 175.10 174.27 1p1d s GLU 137 N -0.15 4.04 -0.21 2.72 -1.05 -1.26 -4.96 118.70 117.83 1p1d s GLU 137 Ca -0.02 2.20 -0.05 0.00 -0.15 0.00 0.00 54.97 56.95 1p1d s GLU 137 Cb -0.02 -2.83 -0.20 0.00 -0.44 0.00 0.00 34.13 30.65 1p1d s GLU 137 CO 0.00 -0.45 -0.01 -0.11 0.95 0.00 0.00 175.26 175.65 1p1d n LEU 138 N 0.27 2.66 0.00 1.83 7.94 -1.26 -4.54 117.00 123.90 1p1d n LEU 138 Ca 0.03 0.08 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1p1d n LEU 138 Cb 0.43 -0.98 0.00 0.00 0.53 0.00 0.00 43.42 43.40 1p1d n LEU 138 CO 0.57 0.82 0.00 0.61 -1.11 0.00 0.00 177.39 178.28 1p1d n GLY 139 N 1.99 0.84 3.53 -3.96 0.00 -1.26 -3.52 105.19 102.80 1p1d n GLY 139 Ca -0.41 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 1p1d n GLY 139 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 140 N -2.00 3.40 -0.03 -0.61 -4.36 -1.26 -1.05 121.20 115.29 1p1d s ILE 140 Ca 0.00 -0.59 0.03 0.00 -0.26 0.00 0.00 60.65 59.83 1p1d s ILE 140 Cb 0.00 -2.37 -0.03 0.00 1.25 0.00 0.00 42.46 41.31 1p1d s ILE 140 CO 0.00 0.59 -0.09 -0.89 0.24 0.00 0.00 174.94 174.79 1p1d s THR 141 N -0.70 3.48 0.32 8.37 2.01 0.19 -4.96 115.64 124.35 1p1d s THR 141 Ca 0.11 -0.71 0.07 0.00 0.31 0.00 0.00 61.69 61.47 1p1d s THR 141 Cb -0.11 -2.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.93 1p1d s THR 141 CO 0.01 0.49 0.36 -0.63 -0.69 0.00 0.00 174.62 174.16 1p1d s ILE 142 N -0.88 3.96 0.13 1.82 1.01 -1.26 0.29 121.20 126.26 1p1d s ILE 142 Ca 0.14 -1.20 -0.24 0.00 0.00 0.00 0.00 60.65 59.35 1p1d s ILE 142 Cb -0.11 -3.34 0.07 0.00 0.01 0.00 0.00 42.46 39.09 1p1d s ILE 142 CO 0.04 -0.20 0.62 -0.94 0.00 0.00 0.00 174.94 174.46 1p1d s SER 143 N -4.05 -0.58 -0.25 3.58 1.04 0.21 -4.39 113.70 109.26 1p1d s SER 143 Ca 0.41 0.10 -0.00 0.00 0.48 0.00 0.00 55.95 56.94 1p1d s SER 143 Cb -0.08 0.59 0.07 0.00 0.10 0.00 0.00 66.02 66.70 1p1d s SER 143 CO 0.28 -0.91 0.02 -0.94 0.98 0.00 0.00 173.24 172.67 1p1d s SER 144 N -2.53 3.73 0.09 7.02 1.04 -1.26 -1.70 113.70 120.09 1p1d s SER 144 Ca -0.01 -1.29 -0.29 0.00 0.48 0.00 0.00 55.95 54.84 1p1d s SER 144 Cb -0.01 -0.97 -0.12 0.00 0.10 0.00 0.00 66.02 65.02 1p1d s SER 144 CO -0.10 -0.32 1.47 -0.65 0.98 0.00 0.00 173.24 174.63 1p1d h PRO 145 N 8.04 -0.54 0.00 4.02 0.11 -1.95 -3.36 132.00 138.32 1p1d h PRO 145 Ca -0.15 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1p1d h PRO 145 Cb 1.06 0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1p1d h PRO 145 CO 0.42 -0.36 -0.02 0.77 -0.21 0.00 0.00 178.00 178.60 1p1d h SER 146 N -0.56 0.00 -3.42 -2.05 0.02 -1.96 -3.48 113.55 102.10 1p1d h SER 146 Ca 0.01 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.59 1p1d h SER 146 Cb 0.61 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 1p1d h SER 146 CO -0.32 0.06 -0.48 -0.24 -1.14 0.00 0.00 176.83 174.71 1p1d n SER 147 N -2.36 -5.34 -2.53 3.07 2.88 -1.26 -4.87 113.62 103.21 1p1d n SER 147 Ca -0.00 0.01 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 1p1d n SER 147 Cb 0.01 -4.45 0.03 0.00 -0.75 0.00 0.00 64.21 59.04 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 -3.06 2.36 0.00 -1.46 1.74 -1.26 -5.05 116.66 109.93 1p1d n ARG 148 Ca -0.20 -3.80 0.00 0.00 -0.77 0.00 0.00 57.85 53.08 1p1d n ARG 148 Cb 0.66 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1p1d n ARG 148 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1p1d n LYS 149 N -0.46 0.00 -1.51 5.56 -0.00 -1.26 -5.09 118.16 115.40 1p1d n LYS 149 Ca 0.23 0.00 -0.44 0.00 -0.00 0.00 0.00 58.31 58.09 1p1d n LYS 149 Cb 0.82 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 35.79 1p1d n LYS 149 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1p1d n PRO 150 N -0.30 1.10 0.00 -1.58 -0.02 -1.26 -2.09 135.00 130.84 1p1d n PRO 150 Ca 0.00 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1p1d n PRO 150 Cb 0.00 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 30.72 1p1d n PRO 150 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p1d n GLY 151 N 6.26 1.91 3.63 -1.23 0.00 -1.25 -5.00 105.19 109.50 1p1d n GLY 151 Ca 0.41 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.05 1p1d n GLY 151 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1p1d n ASP 152 N 0.00 0.99 -4.51 1.61 5.75 -0.89 -4.90 116.55 114.61 1p1d n ASP 152 Ca 0.00 0.84 -0.29 0.00 -0.01 0.00 0.00 54.79 55.33 1p1d n ASP 152 Cb 0.00 -1.40 0.18 0.00 -1.03 0.00 0.00 41.12 38.86 1p1d n ASP 152 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 1p1d s PRO 153 N -2.70 0.30 0.01 0.11 0.04 -1.26 -4.35 135.00 127.15 1p1d s PRO 153 Ca 0.74 0.25 0.07 0.00 0.04 0.00 0.00 61.00 62.10 1p1d s PRO 153 Cb -0.43 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 1p1d s PRO 153 CO 0.48 -2.76 -0.21 -0.51 0.04 0.00 0.00 177.00 174.04 1p1d s LEU 154 N -6.39 2.09 -0.06 -3.56 2.01 -1.21 -4.56 118.68 107.00 1p1d s LEU 154 Ca 0.67 -0.44 -0.25 0.00 0.01 0.00 0.00 54.13 54.12 1p1d s LEU 154 Cb -0.15 -1.06 0.05 0.00 0.01 0.00 0.00 46.19 45.05 1p1d s LEU 154 CO 0.56 0.23 0.56 0.68 1.01 0.00 0.00 176.35 179.38 1p1d s VAL 155 N -0.61 0.02 0.61 -1.59 -7.23 -0.69 0.63 120.40 111.55 1p1d s VAL 155 Ca 0.08 -0.14 -0.17 0.00 -1.81 0.00 0.00 61.98 59.93 1p1d s VAL 155 Cb -0.08 -0.86 -0.02 0.00 0.56 0.00 0.00 36.38 35.97 1p1d s VAL 155 CO 0.00 -0.08 1.15 -0.63 -0.31 0.00 0.00 175.10 175.23 1p1d s ILE 156 N -1.04 2.98 0.00 -0.62 1.09 -1.26 0.65 121.20 123.01 1p1d s ILE 156 Ca -0.10 0.54 0.00 0.00 -1.10 0.00 0.00 60.65 59.99 1p1d s ILE 156 Cb -0.02 -3.13 0.00 0.00 -1.06 0.00 0.00 42.46 38.25 1p1d s ILE 156 CO 0.07 -0.20 0.07 -0.24 -0.10 0.00 0.00 174.94 174.54 1p1d n SER 157 N -1.90 0.14 0.00 3.58 2.88 0.15 -4.61 113.62 113.84 1p1d n SER 157 Ca 0.12 -0.46 0.00 0.00 -1.33 0.00 0.00 58.87 57.20 1p1d n SER 157 Cb 0.51 0.31 0.00 0.00 -0.75 0.00 0.00 64.21 64.28 1p1d n SER 157 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1p1d n ASP 158 N -0.31 0.00 -4.00 -3.46 8.00 -1.23 -4.91 116.55 110.65 1p1d n ASP 158 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 1p1d n ASP 158 Cb 0.04 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.03 1p1d n ASP 158 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1p1d s ILE 159 N -1.78 0.20 0.01 0.53 1.01 -1.26 0.57 121.20 120.48 1p1d s ILE 159 Ca 0.00 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 59.73 1p1d s ILE 159 Cb 0.00 -0.33 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 1p1d s ILE 159 CO 0.00 -0.46 -0.03 -1.59 0.00 0.00 0.00 174.94 172.86 1p1d s LYS 160 N -1.45 0.24 -1.33 2.79 0.00 -0.22 -5.00 119.74 114.76 1p1d s LYS 160 Ca -0.14 -0.31 -0.16 0.00 0.00 0.00 0.00 55.97 55.35 1p1d s LYS 160 Cb -0.10 -0.08 0.02 0.00 0.00 0.00 0.00 37.83 37.67 1p1d s LYS 160 CO -0.01 0.01 2.08 1.63 0.00 0.00 0.00 175.35 179.06 1p1d n LYS 161 N 2.41 2.72 0.00 1.78 4.76 -1.26 -4.09 118.16 124.48 1p1d n LYS 161 Ca -0.17 -2.66 0.00 0.00 -2.87 0.00 0.00 58.31 52.61 1p1d n LYS 161 Cb 0.57 -3.31 0.00 0.00 -1.84 0.00 0.00 35.03 30.46 1p1d n LYS 161 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1p1d n GLY 162 N 4.50 0.00 3.77 0.72 0.00 -1.26 -4.24 105.19 108.69 1p1d n GLY 162 Ca 0.51 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.23 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 -4.04 4.24 0.65 1.61 0.15 -1.23 -3.60 113.70 111.48 1p1d s SER 163 Ca 0.00 -1.47 0.30 0.00 0.70 0.00 0.00 55.95 55.48 1p1d s SER 163 Cb 0.00 0.29 1.64 0.00 -1.71 0.00 0.00 66.02 66.24 1p1d s SER 163 CO 0.00 -0.83 1.95 -0.37 1.20 0.00 0.00 173.24 175.19 1p1d h VAL 164 N 1.27 0.10 -0.02 4.45 -1.51 -1.88 -3.21 116.25 115.46 1p1d h VAL 164 Ca -0.42 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 1p1d h VAL 164 Cb 1.30 0.68 -0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1p1d h VAL 164 CO 0.71 0.00 -0.02 0.00 -1.23 0.00 0.00 177.57 177.03 1p1d h ALA 165 N 1.42 -0.15 0.00 5.19 0.00 -1.91 -0.46 119.26 123.35 1p1d h ALA 165 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1p1d h ALA 165 Cb 0.72 0.88 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1p1d h ALA 165 CO -0.00 -0.16 -0.29 1.25 0.00 0.00 0.00 179.25 180.05 1p1d h HIS 166 N -0.01 0.00 -0.04 0.00 6.17 -1.75 -2.78 115.15 116.75 1p1d h HIS 166 Ca 0.00 0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.09 1p1d h HIS 166 Cb 0.01 0.00 -0.00 0.00 2.52 0.00 0.00 27.41 29.94 1p1d h HIS 166 CO -0.79 0.29 0.03 -0.09 0.71 0.00 0.00 177.93 178.09 1p1d h ARG 167 N 0.00 0.00 -1.39 5.26 9.65 -1.30 -2.33 114.38 124.27 1p1d h ARG 167 Ca -0.00 0.00 0.40 0.00 -1.10 0.00 0.00 59.98 59.28 1p1d h ARG 167 Cb 0.63 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.15 1p1d h ARG 167 CO 0.04 0.00 1.01 1.79 2.80 0.00 0.00 179.97 185.61 1p1d h THR 168 N 0.00 0.29 -4.62 0.20 1.35 -0.84 0.14 112.91 109.42 1p1d h THR 168 Ca 0.02 0.00 -0.18 0.00 -0.55 0.00 0.00 66.41 65.70 1p1d h THR 168 Cb 0.07 0.29 0.13 0.00 -1.73 0.00 0.00 68.15 66.92 1p1d h THR 168 CO -0.00 0.00 -0.57 0.61 -0.25 0.00 0.00 175.52 175.31 1p1d n GLY 169 N -1.81 -0.43 0.00 5.82 0.00 -0.88 -4.19 105.19 103.70 1p1d n GLY 169 Ca 0.30 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -2.73 0.00 -1.54 2.61 5.66 -1.26 -5.05 114.28 111.98 1p1d n THR 170 Ca -0.07 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.69 1p1d n THR 170 Cb 0.59 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.26 1p1d n THR 170 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1p1d n LEU 171 N -0.41 0.96 -4.83 1.09 4.77 -1.26 -4.90 117.00 112.42 1p1d n LEU 171 Ca 0.00 -0.83 -0.32 0.00 -0.03 0.00 0.00 56.01 54.82 1p1d n LEU 171 Cb 0.00 -1.29 -0.06 0.00 -2.33 0.00 0.00 43.42 39.75 1p1d n LEU 171 CO 0.00 -1.87 -0.21 -1.61 -1.33 0.00 0.00 177.39 172.37 1p1d s GLU 172 N 8.35 3.19 -1.06 3.23 2.02 -1.26 -4.99 118.70 128.18 1p1d s GLU 172 Ca 1.09 -0.46 -0.24 0.00 0.02 0.00 0.00 54.97 55.38 1p1d s GLU 172 Cb -0.46 -2.93 -0.08 0.00 0.10 0.00 0.00 34.13 30.76 1p1d s GLU 172 CO 0.29 0.64 1.96 -0.51 0.02 0.00 0.00 175.26 177.66 1p1d s LEU 173 N -1.99 3.06 0.00 1.80 1.43 -1.26 -3.55 118.68 118.16 1p1d s LEU 173 Ca 0.27 -1.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.16 1p1d s LEU 173 Cb -0.12 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.52 1p1d s LEU 173 CO 0.18 -3.06 0.00 0.61 0.23 0.00 0.00 176.35 174.32 1p1d n GLY 174 N 6.26 0.00 3.36 -3.19 0.00 -1.26 -5.06 105.19 105.30 1p1d n GLY 174 Ca 0.43 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 1p1d n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p1d s ASP 175 N 0.00 3.25 -0.34 1.61 1.11 -1.23 -5.04 116.67 116.03 1p1d s ASP 175 Ca 0.00 -0.59 -0.15 0.00 0.18 0.00 0.00 52.55 51.99 1p1d s ASP 175 Cb 0.00 -0.32 -0.01 0.00 1.07 0.00 0.00 42.92 43.66 1p1d s ASP 175 CO 0.00 0.25 0.36 -0.54 1.18 0.00 0.00 175.17 176.42 1p1d s LYS 176 N -1.34 3.60 0.01 8.23 -0.14 -1.26 -4.02 119.74 124.81 1p1d s LYS 176 Ca 0.12 -0.39 -0.22 0.00 -1.36 0.00 0.00 55.97 54.13 1p1d s LYS 176 Cb -0.10 -3.79 -0.05 0.00 -1.68 0.00 0.00 37.83 32.20 1p1d s LYS 176 CO 0.03 -0.50 0.64 -0.51 -0.76 0.00 0.00 175.35 174.24 1p1d s LEU 177 N 2.01 4.43 -0.02 3.17 1.43 0.21 0.09 118.68 130.00 1p1d s LEU 177 Ca 0.12 1.23 0.02 0.00 -1.03 0.00 0.00 54.13 54.47 1p1d s LEU 177 Cb -0.16 -3.00 -0.03 0.00 0.03 0.00 0.00 46.19 43.03 1p1d s LEU 177 CO 0.12 0.09 0.02 0.00 0.23 0.00 0.00 176.35 176.80 1p1d n LEU 178 N 2.71 0.00 -3.87 1.79 -0.00 0.41 -3.33 117.00 114.71 1p1d n LEU 178 Ca -0.06 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.86 1p1d n LEU 178 Cb 0.51 0.04 -0.07 0.00 -0.00 0.00 0.00 43.42 43.90 1p1d n LEU 178 CO 0.44 0.04 -0.03 0.00 -0.00 0.00 0.00 177.39 177.84 1p1d s ALA 179 N -2.08 -0.23 -0.17 1.47 0.00 -1.23 0.10 121.76 119.62 1p1d s ALA 179 Ca -0.01 -0.66 -0.05 0.00 0.00 0.00 0.00 51.96 51.25 1p1d s ALA 179 Cb 0.01 0.67 0.06 0.00 0.00 0.00 0.00 23.12 23.85 1p1d s ALA 179 CO 0.09 -0.59 0.08 0.42 0.00 0.00 0.00 175.76 175.76 1p1d s ILE 180 N -3.90 -0.03 0.00 0.00 -1.09 0.14 -1.71 121.20 114.61 1p1d s ILE 180 Ca 0.10 -0.19 0.00 0.00 -2.23 0.00 0.00 60.65 58.33 1p1d s ILE 180 Cb 0.04 -0.61 0.00 0.00 -1.58 0.00 0.00 42.46 40.31 1p1d s ILE 180 CO -0.06 -0.26 0.00 -0.67 -1.23 0.00 0.00 174.94 172.71 1p1d n ASP 181 N 5.26 0.00 0.00 3.58 2.03 0.68 -1.43 116.55 126.67 1p1d n ASP 181 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 1p1d n ASP 181 Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 1p1d n ASP 181 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1p1d n ASN 182 N 1.77 2.93 -4.90 1.67 5.03 -1.26 -4.78 115.26 115.72 1p1d n ASN 182 Ca 0.00 0.00 -0.28 0.00 0.87 0.00 0.00 54.58 55.17 1p1d n ASN 182 Cb 0.00 0.51 -0.01 0.00 -1.02 0.00 0.00 39.78 39.26 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1p1d s ILE 183 N -1.28 4.90 -0.08 2.41 -1.09 -0.51 -5.09 121.20 120.46 1p1d s ILE 183 Ca 0.00 0.27 0.03 0.00 -2.23 0.00 0.00 60.65 58.72 1p1d s ILE 183 Cb 0.00 -3.82 0.01 0.00 -1.58 0.00 0.00 42.46 37.07 1p1d s ILE 183 CO 0.00 -0.69 -0.15 -0.13 -1.23 0.00 0.00 174.94 172.74 1p1d s ARG 184 N -4.35 2.07 0.00 2.79 0.52 -1.26 0.25 118.95 118.97 1p1d s ARG 184 Ca 0.48 -0.54 0.18 0.00 -0.52 0.00 0.00 55.73 55.33 1p1d s ARG 184 Cb -0.10 -1.66 0.89 0.00 0.52 0.00 0.00 34.95 34.60 1p1d s ARG 184 CO 0.39 0.06 1.55 1.28 0.02 0.00 0.00 175.30 178.60 1p1d n LEU 185 N 3.76 0.00 -0.32 2.53 7.99 0.29 -3.18 117.00 128.07 1p1d n LEU 185 Ca -0.22 0.32 0.18 0.00 -0.01 0.00 0.00 56.01 56.28 1p1d n LEU 185 Cb 0.52 -0.32 0.38 0.00 -0.11 0.00 0.00 43.42 43.89 1p1d n LEU 185 CO 0.26 -0.13 1.04 -2.24 -1.51 0.00 0.00 177.39 174.81 1p1d h ASP 186 N 0.00 0.28 0.00 -1.43 2.03 -1.90 -2.67 116.42 112.74 1p1d h ASP 186 Ca 0.00 0.19 0.00 0.00 -0.73 0.00 0.00 57.03 56.49 1p1d h ASP 186 Cb 0.19 0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.88 1p1d h ASP 186 CO 0.00 -0.12 -1.16 -1.54 -1.03 0.00 0.00 179.24 175.39 1p1d n SER 187 N -5.12 3.91 -3.22 4.15 3.41 -1.23 -4.89 113.62 110.64 1p1d n SER 187 Ca 0.26 -0.02 -0.17 0.00 -0.26 0.00 0.00 58.87 58.68 1p1d n SER 187 Cb 0.81 1.19 0.12 0.00 -0.26 0.00 0.00 64.21 66.07 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 -3.44 2.70 0.24 0.00 3.41 -1.26 -3.77 113.62 111.50 1p1d n SER 189 Ca 0.10 -2.28 -0.15 0.00 -0.26 0.00 0.00 58.87 56.28 1p1d n SER 189 Cb 0.36 0.17 -0.08 0.00 -0.26 0.00 0.00 64.21 64.40 1p1d n SER 189 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1p1d h MET 190 N 0.00 -0.58 -0.83 4.33 4.05 -1.84 -2.63 114.93 117.42 1p1d h MET 190 Ca -0.24 0.04 0.24 0.00 -0.28 0.00 0.00 59.70 59.46 1p1d h MET 190 Cb 0.75 0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 31.65 1p1d h MET 190 CO 0.40 -0.31 0.61 0.93 0.23 0.00 0.00 176.91 178.76 1p1d h GLU 191 N -0.75 0.00 0.33 0.39 5.08 -1.97 0.01 114.58 117.66 1p1d h GLU 191 Ca -0.06 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1p1d h GLU 191 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1p1d h GLU 191 CO 0.10 0.00 -0.16 -0.44 -1.00 0.00 0.00 179.01 177.51 1p1d h ASP 192 N 0.00 -0.37 -0.85 1.42 3.32 -1.88 -2.06 116.42 116.00 1p1d h ASP 192 Ca 0.40 -0.11 0.22 0.00 0.02 0.00 0.00 57.03 57.55 1p1d h ASP 192 Cb 1.60 0.10 -0.05 0.00 0.22 0.00 0.00 39.33 41.20 1p1d h ASP 192 CO -0.00 -0.09 0.58 0.00 -1.72 0.00 0.00 179.24 178.00 1p1d h ALA 193 N -0.07 2.47 -0.16 3.45 0.00 -0.79 0.30 119.26 124.47 1p1d h ALA 193 Ca -0.04 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1p1d h ALA 193 Cb 0.46 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1p1d h ALA 193 CO 0.07 -0.72 0.03 0.28 0.00 0.00 0.00 179.25 178.91 1p1d h VAL 194 N 0.21 1.21 -0.08 0.00 2.07 -0.89 0.73 116.25 119.50 1p1d h VAL 194 Ca 0.42 -0.66 -0.13 0.00 0.82 0.00 0.00 66.70 67.16 1p1d h VAL 194 Cb 1.33 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1p1d h VAL 194 CO -0.09 0.20 -0.53 -0.61 0.02 0.00 0.00 177.57 176.56 1p1d h GLN 195 N 0.05 0.21 0.00 1.57 -0.00 -0.37 -1.87 115.11 114.71 1p1d h GLN 195 Ca 0.05 -0.13 -0.10 0.00 -0.00 0.00 0.00 58.65 58.47 1p1d h GLN 195 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.75 1p1d h GLN 195 CO 0.00 0.69 -0.49 0.82 0.00 0.00 0.00 178.83 179.85 1p1d h ILE 196 N 0.17 0.97 -0.72 2.39 2.04 -0.90 0.34 117.51 121.81 1p1d h ILE 196 Ca 0.00 -1.98 -0.06 0.00 1.00 0.00 0.00 64.86 63.83 1p1d h ILE 196 Cb 0.99 2.21 -0.03 0.00 -0.74 0.00 0.00 36.82 39.24 1p1d h ILE 196 CO 0.08 0.48 0.23 -0.07 0.00 0.00 0.00 178.15 178.87 1p1d h LEU 197 N 0.00 1.04 0.13 1.44 4.07 0.12 -0.07 115.31 122.04 1p1d h LEU 197 Ca -0.00 -0.20 -0.30 0.00 0.08 0.00 0.00 57.88 57.45 1p1d h LEU 197 Cb 1.17 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 42.63 1p1d h LEU 197 CO 0.06 0.97 -1.56 1.56 -1.08 0.00 0.00 178.44 178.39 1p1d h GLN 198 N 1.06 0.27 0.00 1.13 4.20 -1.25 -3.30 115.11 117.21 1p1d h GLN 198 Ca 0.23 -0.46 0.00 0.00 0.06 0.00 0.00 58.65 58.48 1p1d h GLN 198 Cb 0.29 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1p1d h GLN 198 CO -0.01 1.22 0.00 0.37 -0.67 0.00 0.00 178.83 179.74 1p1d h GLN 199 N -0.19 0.00 -1.76 1.46 -0.00 -0.31 -2.33 115.11 111.98 1p1d h GLN 199 Ca -0.33 0.00 -0.25 0.00 -0.00 0.00 0.00 58.65 58.07 1p1d h GLN 199 Cb 1.85 0.00 -0.10 0.00 0.00 0.00 0.00 27.48 29.23 1p1d h GLN 199 CO 0.08 0.00 0.23 0.00 0.00 0.00 0.00 178.83 179.14 1p1d n GLU 201 N 0.92 2.45 0.00 0.00 0.28 -0.88 -2.47 120.64 120.94 1p1d n GLU 201 Ca 0.26 -1.79 0.00 0.00 -0.16 0.00 0.00 57.16 55.46 1p1d n GLU 201 Cb 0.58 -2.68 0.00 0.00 1.43 0.00 0.00 31.44 30.78 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 4.72 0.00 0.00 -1.84 8.00 -1.23 -4.42 116.55 121.78 1p1d n ASP 202 Ca 0.54 0.00 0.00 0.00 0.71 0.00 0.00 54.79 56.04 1p1d n ASP 202 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 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 -0.43 0.00 -4.56 0.64 0.00 -1.03 -1.59 117.00 110.03 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 -0.21 -0.69 0.00 0.00 0.00 177.39 176.49 1p1d s VAL 204 N 0.00 4.95 -0.43 1.96 1.01 -0.81 -4.81 120.40 122.27 1p1d s VAL 204 Ca 0.00 0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.88 1p1d s VAL 204 Cb 0.00 -3.33 0.05 0.00 0.00 0.00 0.00 36.38 33.10 1p1d s VAL 204 CO 0.00 0.31 0.33 -0.75 0.00 0.00 0.00 175.10 174.99 1p1d s LYS 205 N 1.47 2.94 -0.59 2.72 2.20 -1.26 -2.26 119.74 124.96 1p1d s LYS 205 Ca 0.06 -1.19 -0.24 0.00 -0.36 0.00 0.00 55.97 54.24 1p1d s LYS 205 Cb -0.15 -4.01 0.05 0.00 -1.51 0.00 0.00 37.83 32.21 1p1d s LYS 205 CO 0.07 -0.87 0.99 -0.51 -0.36 0.00 0.00 175.35 174.66 1p1d s LEU 206 N 1.64 4.05 -0.82 5.43 1.02 -0.91 -0.23 118.68 128.86 1p1d s LEU 206 Ca 0.04 -0.45 -0.20 0.00 0.02 0.00 0.00 54.13 53.54 1p1d s LEU 206 Cb -0.21 -2.75 0.11 0.00 0.02 0.00 0.00 46.19 43.36 1p1d s LEU 206 CO 0.08 -1.33 1.04 -0.75 0.02 0.00 0.00 176.35 175.41 1p1d s LYS 207 N 4.16 3.41 0.46 1.70 2.20 -0.70 -1.30 119.74 129.68 1p1d s LYS 207 Ca 0.30 -1.47 0.08 0.00 -0.36 0.00 0.00 55.97 54.53 1p1d s LYS 207 Cb -0.13 -4.65 0.02 0.00 -1.51 0.00 0.00 37.83 31.56 1p1d s LYS 207 CO 0.18 -1.76 0.58 0.96 -0.36 0.00 0.00 175.35 174.94 1p1d s ILE 208 N 3.05 2.68 -0.15 5.43 -0.00 -0.00 -0.44 121.20 131.76 1p1d s ILE 208 Ca 0.27 -1.09 -0.10 0.00 -0.00 0.00 0.00 60.65 59.74 1p1d s ILE 208 Cb -0.10 -2.77 -0.05 0.00 -0.00 0.00 0.00 42.46 39.54 1p1d s ILE 208 CO -0.02 0.00 0.19 -0.60 -0.00 0.00 0.00 174.94 174.51 1p1d s ARG 209 N -4.38 3.98 0.20 0.37 6.06 0.11 -0.97 118.95 124.32 1p1d s ARG 209 Ca 0.54 -0.08 0.08 0.00 -2.50 0.00 0.00 55.73 53.78 1p1d s ARG 209 Cb -0.07 -3.34 -0.05 0.00 0.06 0.00 0.00 34.95 31.55 1p1d s ARG 209 CO 0.33 0.45 -0.16 0.21 -2.50 0.00 0.00 175.30 173.63 1p1d s LYS 210 N -0.10 1.35 -1.38 5.12 2.36 -0.87 -4.40 119.74 121.81 1p1d s LYS 210 Ca 0.13 -1.57 -0.07 0.00 -2.55 0.00 0.00 55.97 51.90 1p1d s LYS 210 Cb -0.12 -1.21 0.03 0.00 -1.05 0.00 0.00 37.83 35.48 1p1d s LYS 210 CO 0.02 0.21 1.00 -3.47 1.55 0.00 0.00 175.35 174.66 1p1d n ASP 211 N -0.28 -4.18 -4.78 1.43 -0.08 -1.26 -0.81 116.55 106.59 1p1d n ASP 211 Ca -0.09 -0.68 -0.35 0.00 -1.51 0.00 0.00 54.79 52.16 1p1d n ASP 211 Cb 0.60 -4.50 -0.01 0.00 2.34 0.00 0.00 41.12 39.55 1p1d n ASP 211 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1p1d s GLU 212 N -6.20 3.60 0.00 -0.67 2.02 -1.26 -4.77 118.70 111.42 1p1d s GLU 212 Ca 0.41 1.57 0.00 0.00 0.02 0.00 0.00 54.97 56.96 1p1d s GLU 212 Cb -0.19 -2.14 0.00 0.00 0.10 0.00 0.00 34.13 31.90 1p1d s GLU 212 CO 0.78 -0.63 0.49 -3.47 0.02 0.00 0.00 175.26 172.44