#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 4.90 -0.02 5.09 -7.23 -1.26 -5.04 120.40 116.84 1p1d s VAL 19 Ca 0.00 0.84 0.01 0.00 -1.81 0.00 0.00 61.98 61.02 1p1d s VAL 19 Cb 0.00 -4.04 0.01 0.00 0.56 0.00 0.00 36.38 32.91 1p1d s VAL 19 CO 0.00 -0.20 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.87 1p1d s VAL 20 N 2.69 0.37 -0.42 1.32 1.01 -1.26 -5.09 120.40 119.02 1p1d s VAL 20 Ca 0.26 -0.09 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 1p1d s VAL 20 Cb -0.15 -0.39 0.07 0.00 0.00 0.00 0.00 36.38 35.91 1p1d s VAL 20 CO 0.13 0.16 0.27 -2.28 0.00 0.00 0.00 175.10 173.38 1p1d s HIS 21 N 0.55 3.31 0.89 5.22 2.46 -1.26 -4.95 115.29 121.51 1p1d s HIS 21 Ca -0.06 -1.34 -0.13 0.00 0.47 0.00 0.00 55.06 54.00 1p1d s HIS 21 Cb -0.10 -2.90 0.05 0.00 -0.13 0.00 0.00 32.58 29.50 1p1d s HIS 21 CO -0.00 -0.81 0.66 0.25 -2.47 0.00 0.00 174.74 172.37 1p1d n THR 22 N 4.98 0.58 -3.83 0.89 -2.24 -1.26 -4.22 114.28 109.17 1p1d n THR 22 Ca -0.11 -0.19 -0.11 0.00 -2.27 0.00 0.00 64.05 61.37 1p1d n THR 22 Cb 0.44 -0.78 -0.09 0.00 -2.10 0.00 0.00 70.33 67.79 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 -3.73 0.66 -0.10 -0.78 2.02 0.81 -4.95 118.70 112.63 1p1d s GLU 23 Ca 0.62 -0.51 -0.01 0.00 0.02 0.00 0.00 54.97 55.09 1p1d s GLU 23 Cb -0.25 0.28 -0.03 0.00 0.10 0.00 0.00 34.13 34.23 1p1d s GLU 23 CO 0.62 -0.19 -0.05 0.95 0.02 0.00 0.00 175.26 176.61 1p1d s THR 24 N -2.16 3.80 0.40 3.63 -4.23 -1.26 -1.29 115.64 114.54 1p1d s THR 24 Ca -0.08 -0.42 0.04 0.00 -1.18 0.00 0.00 61.69 60.04 1p1d s THR 24 Cb -0.03 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 71.17 1p1d s THR 24 CO -0.02 0.56 0.07 0.28 -0.54 0.00 0.00 174.62 174.98 1p1d s THR 25 N -0.39 1.00 0.21 3.99 -1.32 0.76 -4.96 115.64 114.93 1p1d s THR 25 Ca 0.06 -2.00 0.05 0.00 -1.21 0.00 0.00 61.69 58.59 1p1d s THR 25 Cb -0.12 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.33 1p1d s THR 25 CO 0.02 0.00 0.22 -1.83 -2.21 0.00 0.00 174.62 170.82 1p1d s GLU 26 N -3.80 3.09 -0.03 7.08 1.03 -1.26 -1.59 118.70 123.22 1p1d s GLU 26 Ca 0.25 -0.88 -0.11 0.00 0.03 0.00 0.00 54.97 54.26 1p1d s GLU 26 Cb 0.05 -2.71 0.02 0.00 -0.80 0.00 0.00 34.13 30.69 1p1d s GLU 26 CO 0.13 0.45 0.25 0.08 -1.33 0.00 0.00 175.26 174.84 1p1d s VAL 27 N -1.94 0.05 -0.22 1.83 1.01 0.22 -4.87 120.40 116.48 1p1d s VAL 27 Ca 0.33 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 1p1d s VAL 27 Cb -0.09 -0.51 0.06 0.00 0.00 0.00 0.00 36.38 35.84 1p1d s VAL 27 CO 0.26 -0.23 -0.02 -0.69 0.00 0.00 0.00 175.10 174.42 1p1d s VAL 28 N -1.00 1.12 -0.29 2.92 1.01 -1.26 -0.59 120.40 122.32 1p1d s VAL 28 Ca -0.11 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.81 1p1d s VAL 28 Cb -0.05 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1p1d s VAL 28 CO 0.03 -0.15 0.18 -0.76 0.00 0.00 0.00 175.10 174.40 1p1d s LEU 29 N 1.58 4.05 0.29 3.92 1.43 0.14 -4.89 118.68 125.20 1p1d s LEU 29 Ca -0.04 -0.17 0.08 0.00 -1.03 0.00 0.00 54.13 52.97 1p1d s LEU 29 Cb -0.18 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 1p1d s LEU 29 CO -0.07 -0.10 0.16 0.42 0.23 0.00 0.00 176.35 176.99 1p1d s THR 30 N 1.72 3.82 0.58 5.49 -4.23 -1.26 0.13 115.64 121.89 1p1d s THR 30 Ca 0.06 -1.56 0.02 0.00 -1.18 0.00 0.00 61.69 59.04 1p1d s THR 30 Cb -0.16 -3.17 0.06 0.00 1.34 0.00 0.00 72.50 70.57 1p1d s THR 30 CO 0.09 -0.30 0.81 0.00 -0.54 0.00 0.00 174.62 174.69 1p1d s ALA 31 N -2.26 3.96 -0.26 3.99 0.00 -0.95 -3.21 121.76 123.04 1p1d s ALA 31 Ca 0.35 -1.52 -0.25 0.00 0.00 0.00 0.00 51.96 50.54 1p1d s ALA 31 Cb -0.06 -1.98 0.09 0.00 0.00 0.00 0.00 23.12 21.17 1p1d s ALA 31 CO 0.24 -0.90 0.84 0.34 0.00 0.00 0.00 175.76 176.28 1p1d s ASP 32 N -4.52 -0.62 0.00 0.00 2.15 -1.26 -4.75 116.67 107.66 1p1d s ASP 32 Ca 0.60 1.17 0.00 0.00 0.43 0.00 0.00 52.55 54.75 1p1d s ASP 32 Cb -0.09 1.17 0.00 0.00 -0.30 0.00 0.00 42.92 43.71 1p1d s ASP 32 CO 0.39 -0.23 0.35 -0.81 -0.17 0.00 0.00 175.17 174.70 1p1d n PRO 33 N 2.37 0.64 0.01 4.34 -0.04 -1.26 -1.92 135.00 139.14 1p1d n PRO 33 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1p1d n PRO 33 Cb 0.55 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 1p1d n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1p1d n VAL 34 N 0.12 0.06 -2.46 0.52 0.31 -1.26 -4.98 118.33 110.64 1p1d n VAL 34 Ca 0.00 0.02 -0.03 0.00 -0.01 0.00 0.00 64.34 64.32 1p1d n VAL 34 Cb 0.15 -1.01 0.05 0.00 -0.91 0.00 0.00 33.84 32.11 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 -2.83 0.13 -1.61 2.52 -2.24 -1.22 -5.12 114.28 103.91 1p1d n THR 35 Ca 0.00 -0.87 -0.56 0.00 -2.27 0.00 0.00 64.05 60.34 1p1d n THR 35 Cb 0.23 0.87 -0.07 0.00 -2.10 0.00 0.00 70.33 69.26 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 -0.85 0.33 2.75 3.38 0.00 -0.81 -2.80 105.19 107.20 1p1d n GLY 36 Ca -0.17 0.79 -0.01 0.00 0.00 0.00 0.00 46.02 46.63 1p1d n GLY 36 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1p1d n PHE 37 N 2.98 -2.53 0.67 1.61 3.72 -1.20 -4.70 117.46 118.02 1p1d n PHE 37 Ca 0.22 0.98 0.00 0.00 -0.05 0.00 0.00 57.45 58.59 1p1d n PHE 37 Cb 0.13 -3.65 0.06 0.00 -0.94 0.00 0.00 39.48 35.08 1p1d n PHE 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1p1d n GLY 38 N -1.41 1.87 3.47 1.37 0.00 -1.12 -4.81 105.19 104.54 1p1d n GLY 38 Ca 0.02 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 1p1d n GLY 38 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 39 N -1.16 3.45 -0.21 -0.61 -5.25 -1.26 0.27 121.20 116.43 1p1d s ILE 39 Ca 0.09 -0.54 -0.12 0.00 -0.99 0.00 0.00 60.65 59.09 1p1d s ILE 39 Cb 0.07 -2.45 -0.05 0.00 2.95 0.00 0.00 42.46 42.98 1p1d s ILE 39 CO 0.02 0.54 0.24 -1.10 -1.79 0.00 0.00 174.94 172.85 1p1d s GLN 40 N -0.01 4.15 -0.02 0.37 -0.21 -0.91 -5.01 119.66 118.01 1p1d s GLN 40 Ca -0.02 -0.08 -0.10 0.00 0.02 0.00 0.00 55.36 55.18 1p1d s GLN 40 Cb -0.14 -3.50 -0.05 0.00 1.00 0.00 0.00 33.01 30.33 1p1d s GLN 40 CO 0.03 0.11 0.31 -0.51 -2.12 0.00 0.00 175.29 173.11 1p1d s LEU 41 N 0.89 4.42 0.35 2.90 1.02 -1.26 -1.67 118.68 125.32 1p1d s LEU 41 Ca 0.12 0.73 0.08 0.00 0.02 0.00 0.00 54.13 55.09 1p1d s LEU 41 Cb -0.13 -2.51 -0.05 0.00 0.02 0.00 0.00 46.19 43.52 1p1d s LEU 41 CO 0.04 0.32 0.10 -1.58 0.02 0.00 0.00 176.35 175.24 1p1d s GLN 42 N -1.30 2.24 0.00 1.70 0.74 -0.52 -4.90 119.66 117.62 1p1d s GLN 42 Ca 0.23 -1.67 0.00 0.00 0.05 0.00 0.00 55.36 53.98 1p1d s GLN 42 Cb -0.14 -2.05 0.00 0.00 1.10 0.00 0.00 33.01 31.91 1p1d s GLN 42 CO 0.12 0.09 0.00 0.41 -0.55 0.00 0.00 175.29 175.36 1p1d n GLY 43 N -1.08 0.91 3.12 2.59 0.00 -1.26 -2.12 105.19 107.35 1p1d n GLY 43 Ca -0.03 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1p1d n GLY 43 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p1d s SER 44 N -1.21 4.98 0.00 1.61 1.04 -1.25 -4.20 113.70 114.66 1p1d s SER 44 Ca 0.00 -1.75 0.00 0.00 0.48 0.00 0.00 55.95 54.68 1p1d s SER 44 Cb 0.00 -1.73 0.00 0.00 0.10 0.00 0.00 66.02 64.39 1p1d s SER 44 CO 0.00 -0.39 0.56 0.52 0.98 0.00 0.00 173.24 174.91 1p1d n VAL 45 N 4.52 0.00 -0.35 5.02 0.31 -1.26 -2.38 118.33 124.19 1p1d n VAL 45 Ca -0.06 1.06 0.02 0.00 -0.01 0.00 0.00 64.34 65.36 1p1d n VAL 45 Cb 0.42 -1.72 0.09 0.00 -0.91 0.00 0.00 33.84 31.72 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 -0.75 -5.80 3.52 -0.00 -1.97 -3.46 116.94 108.48 1p1d h PHE 46 Ca 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 57.97 58.06 1p1d h PHE 46 Cb 0.00 0.48 0.00 0.00 -0.00 0.00 0.00 35.95 36.43 1p1d h PHE 46 CO -0.07 -0.41 -0.62 0.00 -0.00 0.00 0.00 178.31 177.21 1p1d n ALA 47 N -3.52 -1.62 0.00 12.09 0.00 -1.00 -5.01 120.51 121.45 1p1d n ALA 47 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1p1d n ALA 47 Cb 0.45 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1p1d n ALA 47 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1p1d n THR 48 N 1.59 0.00 -3.57 0.00 5.66 -1.26 -4.95 114.28 111.75 1p1d n THR 48 Ca 0.00 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.74 1p1d n THR 48 Cb 0.31 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.09 1p1d n THR 48 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1p1d n GLU 49 N 0.00 -3.59 0.00 1.09 0.28 -1.26 -4.80 120.64 112.36 1p1d n GLU 49 Ca 0.00 0.47 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 1p1d n GLU 49 Cb 0.00 -5.21 0.00 0.00 1.43 0.00 0.00 31.44 27.66 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 -4.10 0.00 -1.90 3.84 5.66 -1.26 -5.07 114.28 111.45 1p1d n THR 50 Ca 0.01 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 61.00 1p1d n THR 50 Cb 0.53 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.31 1p1d n THR 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1p1d n LEU 51 N 0.00 -0.19 -0.98 1.09 -0.00 -1.26 -4.51 117.00 111.15 1p1d n LEU 51 Ca 0.00 -0.68 0.00 0.00 -0.00 0.00 0.00 56.01 55.33 1p1d n LEU 51 Cb 0.00 0.29 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 1p1d n LEU 51 CO 0.00 0.82 0.08 -1.20 -0.00 0.00 0.00 177.39 177.08 1p1d n SER 52 N -0.09 0.45 -3.07 1.45 7.64 -1.26 -3.75 113.62 114.99 1p1d n SER 52 Ca -0.04 -0.31 -0.18 0.00 1.01 0.00 0.00 58.87 59.35 1p1d n SER 52 Cb 0.40 -0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.49 1p1d n SER 52 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1p1d n SER 53 N 0.90 -1.14 0.15 6.43 2.88 -1.26 -4.93 113.62 116.65 1p1d n SER 53 Ca 0.00 -2.81 -0.14 0.00 -1.33 0.00 0.00 58.87 54.59 1p1d n SER 53 Cb 0.08 0.27 -0.08 0.00 -0.75 0.00 0.00 64.21 63.72 1p1d n SER 53 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1p1d h PRO 54 N 4.43 -0.33 -4.63 -1.46 0.11 -1.74 -3.32 132.00 125.06 1p1d h PRO 54 Ca 0.05 0.02 -0.71 0.00 0.11 0.00 0.00 66.00 65.47 1p1d h PRO 54 Cb 0.95 0.08 -0.20 0.00 0.11 0.00 0.00 31.00 31.93 1p1d h PRO 54 CO 0.36 -0.10 -0.02 -1.25 -0.21 0.00 0.00 178.00 176.78 1p1d s PRO 55 N -5.42 3.05 -0.47 1.05 0.04 -1.26 -4.12 135.00 127.87 1p1d s PRO 55 Ca -0.15 -1.25 0.03 0.00 0.04 0.00 0.00 61.00 59.67 1p1d s PRO 55 Cb 0.04 -4.20 0.15 0.00 0.04 0.00 0.00 34.50 30.53 1p1d s PRO 55 CO 0.61 -1.34 0.31 -0.51 0.04 0.00 0.00 177.00 176.12 1p1d s LEU 56 N 2.36 2.58 0.31 -3.56 1.43 -0.90 -3.09 118.68 117.81 1p1d s LEU 56 Ca 0.10 -2.95 -0.30 0.00 -1.03 0.00 0.00 54.13 49.96 1p1d s LEU 56 Cb -0.24 -0.92 -0.12 0.00 0.03 0.00 0.00 46.19 44.95 1p1d s LEU 56 CO 0.07 -0.21 1.52 -0.38 0.23 0.00 0.00 176.35 177.58 1p1d n ILE 57 N 3.09 1.33 -0.01 -0.59 5.41 -1.26 -1.43 119.36 125.90 1p1d n ILE 57 Ca 0.17 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1p1d n ILE 57 Cb 0.39 -1.86 0.00 0.00 -0.71 0.00 0.00 39.64 37.46 1p1d n ILE 57 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1p1d n SER 58 N 1.64 0.15 -3.88 4.38 3.41 -0.67 0.13 113.62 118.77 1p1d n SER 58 Ca 0.07 -0.56 -0.11 0.00 -0.26 0.00 0.00 58.87 58.01 1p1d n SER 58 Cb 0.36 0.80 -0.10 0.00 -0.26 0.00 0.00 64.21 65.02 1p1d n SER 58 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1p1d s TYR 59 N -0.80 0.07 0.15 7.33 5.04 -1.25 -4.92 117.35 122.96 1p1d s TYR 59 Ca 0.00 -0.19 0.09 0.00 -2.44 0.00 0.00 57.07 54.53 1p1d s TYR 59 Cb 0.00 -0.06 -0.04 0.00 0.35 0.00 0.00 41.96 42.21 1p1d s TYR 59 CO 0.00 -0.29 -0.21 0.42 -1.34 0.00 0.00 175.55 174.12 1p1d s ILE 60 N -1.53 1.95 -0.42 3.14 -1.09 -1.26 -2.15 121.20 119.84 1p1d s ILE 60 Ca -0.14 -1.80 -0.11 0.00 -2.23 0.00 0.00 60.65 56.37 1p1d s ILE 60 Cb -0.07 -1.83 0.06 0.00 -1.58 0.00 0.00 42.46 39.04 1p1d s ILE 60 CO 0.01 -0.14 0.27 -0.70 -1.23 0.00 0.00 174.94 173.15 1p1d s GLU 61 N -2.40 2.75 -0.10 2.79 2.12 0.14 -4.95 118.70 119.06 1p1d s GLU 61 Ca 0.14 -1.32 -0.29 0.00 0.36 0.00 0.00 54.97 53.86 1p1d s GLU 61 Cb -0.08 -3.85 -0.06 0.00 0.26 0.00 0.00 34.13 30.40 1p1d s GLU 61 CO 0.06 -0.89 1.90 0.00 -0.54 0.00 0.00 175.26 175.79 1p1d s ALA 62 N 1.51 3.32 0.00 6.30 0.00 -1.26 -2.85 121.76 128.78 1p1d s ALA 62 Ca 0.03 0.94 0.00 0.00 0.00 0.00 0.00 51.96 52.93 1p1d s ALA 62 Cb -0.22 -3.89 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1p1d s ALA 62 CO 0.05 -1.92 0.00 -3.47 0.00 0.00 0.00 175.76 170.42 1p1d n ASP 63 N 8.66 -0.48 -1.90 0.00 2.03 -1.26 -5.12 116.55 118.48 1p1d n ASP 63 Ca 0.22 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.45 1p1d n ASP 63 Cb 0.43 -0.12 -0.03 0.00 -0.72 0.00 0.00 41.12 40.68 1p1d n ASP 63 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1p1d n SER 64 N 0.02 -0.24 -0.24 1.67 7.64 -1.13 -4.87 113.62 116.47 1p1d n SER 64 Ca 0.00 -1.87 0.12 0.00 1.01 0.00 0.00 58.87 58.13 1p1d n SER 64 Cb 0.12 0.66 0.15 0.00 -1.01 0.00 0.00 64.21 64.12 1p1d n SER 64 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1p1d n PRO 65 N -0.25 0.65 0.08 1.43 -0.04 -1.26 -3.71 135.00 131.89 1p1d n PRO 65 Ca 0.03 -0.47 -0.07 0.00 -0.04 0.00 0.00 63.50 62.94 1p1d n PRO 65 Cb 0.24 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.17 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 3.50 -0.29 0.00 0.55 0.00 -1.86 0.33 119.26 121.49 1p1d h ALA 66 Ca 0.00 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1p1d h ALA 66 Cb 0.58 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1p1d h ALA 66 CO 0.00 -0.30 -0.77 1.49 0.00 0.00 0.00 179.25 179.68 1p1d h GLU 67 N -1.03 0.00 -0.01 0.00 4.57 -1.84 -3.17 114.58 113.11 1p1d h GLU 67 Ca -0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1p1d h GLU 67 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1p1d h GLU 67 CO 0.05 0.77 -0.49 0.54 -1.18 0.00 0.00 179.01 178.70 1p1d n ARG 68 N -3.48 0.50 -0.32 1.92 3.00 -1.24 -4.23 116.66 112.80 1p1d n ARG 68 Ca -0.00 -0.34 0.23 0.00 -0.01 0.00 0.00 57.85 57.72 1p1d n ARG 68 Cb 0.78 -1.49 0.44 0.00 0.00 0.00 0.00 32.46 32.19 1p1d n ARG 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1p1d n GLY 70 N -1.35 0.47 2.73 0.00 0.00 -1.26 -5.06 105.19 100.72 1p1d n GLY 70 Ca 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.30 1p1d n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p1d s VAL 71 N 0.00 -0.35 0.11 1.61 0.11 -1.26 -2.64 120.40 117.98 1p1d s VAL 71 Ca 0.00 -0.26 0.03 0.00 -2.93 0.00 0.00 61.98 58.81 1p1d s VAL 71 Cb 0.00 0.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.81 1p1d s VAL 71 CO 0.00 0.00 -0.08 -0.76 -3.33 0.00 0.00 175.10 170.93 1p1d s LEU 72 N 1.19 2.49 -0.22 2.54 2.01 -1.26 -4.91 118.68 120.53 1p1d s LEU 72 Ca 0.22 -0.97 -0.27 0.00 0.01 0.00 0.00 54.13 53.13 1p1d s LEU 72 Cb 0.08 -0.16 0.10 0.00 0.01 0.00 0.00 46.19 46.22 1p1d s LEU 72 CO -0.11 -0.40 0.86 -1.58 1.01 0.00 0.00 176.35 176.13 1p1d s GLN 73 N -3.60 0.73 0.20 1.70 0.74 -1.26 -4.91 119.66 113.27 1p1d s GLN 73 Ca 0.11 0.63 -0.33 0.00 0.05 0.00 0.00 55.36 55.82 1p1d s GLN 73 Cb 0.03 0.35 -0.14 0.00 1.10 0.00 0.00 33.01 34.36 1p1d s GLN 73 CO -0.03 -0.14 1.50 -0.89 -0.55 0.00 0.00 175.29 175.19 1p1d n ILE 74 N 1.97 0.46 -2.50 -2.34 5.41 -1.26 -2.58 119.36 118.52 1p1d n ILE 74 Ca -0.14 -0.12 -0.03 0.00 1.00 0.00 0.00 62.75 63.47 1p1d n ILE 74 Cb 0.56 -1.52 0.01 0.00 -0.71 0.00 0.00 39.64 37.98 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 2.80 0.61 0.27 7.39 0.00 0.34 -4.94 105.19 111.65 1p1d n GLY 75 Ca 0.14 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1p1d n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1p1d h ASP 76 N -0.34 0.53 -3.52 1.61 3.32 -1.72 -3.46 116.42 112.84 1p1d h ASP 76 Ca -0.08 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1p1d h ASP 76 Cb 1.05 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1p1d h ASP 76 CO 0.07 0.32 -0.03 -1.14 -1.72 0.00 0.00 179.24 176.74 1p1d n ARG 77 N -4.82 -0.36 -2.07 3.56 0.63 -1.22 -4.33 116.66 108.06 1p1d n ARG 77 Ca 0.10 0.76 -0.34 0.00 -0.92 0.00 0.00 57.85 57.46 1p1d n ARG 77 Cb 0.23 -2.44 0.02 0.00 0.45 0.00 0.00 32.46 30.72 1p1d n ARG 77 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1p1d s VAL 78 N -2.55 3.38 0.00 5.15 1.01 -1.18 -3.00 120.40 123.21 1p1d s VAL 78 Ca 0.02 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1p1d s VAL 78 Cb -0.00 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1p1d s VAL 78 CO 0.17 -0.30 0.00 1.15 0.00 0.00 0.00 175.10 176.12 1p1d n MET 79 N -1.80 3.01 -3.68 2.72 0.00 0.30 -4.53 117.12 113.13 1p1d n MET 79 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 57.70 57.69 1p1d n MET 79 Cb 0.52 -0.97 -0.09 0.00 0.00 0.00 0.00 33.22 32.68 1p1d n MET 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1p1d s ALA 80 N -1.93 -1.38 -0.30 3.17 0.00 -1.25 -1.21 121.76 118.87 1p1d s ALA 80 Ca 0.00 1.73 -0.02 0.00 0.00 0.00 0.00 51.96 53.68 1p1d s ALA 80 Cb 0.00 -1.02 0.05 0.00 0.00 0.00 0.00 23.12 22.15 1p1d s ALA 80 CO 0.00 -0.29 0.00 0.42 0.00 0.00 0.00 175.76 175.90 1p1d s ILE 81 N 0.92 2.98 -1.33 0.00 1.09 0.96 -2.81 121.20 123.02 1p1d s ILE 81 Ca -0.05 -1.41 0.00 0.00 -1.10 0.00 0.00 60.65 58.09 1p1d s ILE 81 Cb -0.05 -2.73 0.00 0.00 -1.06 0.00 0.00 42.46 38.62 1p1d s ILE 81 CO -0.08 -0.12 0.00 0.59 -0.10 0.00 0.00 174.94 175.23 1p1d n ASN 82 N 4.62 -3.83 0.00 3.58 3.02 -0.53 -0.67 115.26 121.44 1p1d n ASN 82 Ca -0.13 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1p1d n ASN 82 Cb 0.43 -3.43 0.00 0.00 -0.61 0.00 0.00 39.78 36.18 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 -0.49 2.13 3.65 7.41 0.00 -1.26 -5.07 105.19 111.56 1p1d n GLY 83 Ca -0.15 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.69 3.32 1.13 -0.61 -1.09 0.16 -4.98 121.20 118.43 1p1d s ILE 84 Ca 0.00 0.37 -0.14 0.00 -2.23 0.00 0.00 60.65 58.65 1p1d s ILE 84 Cb 0.00 -3.28 0.26 0.00 -1.58 0.00 0.00 42.46 37.86 1p1d s ILE 84 CO 0.00 -0.08 1.06 -2.16 -1.23 0.00 0.00 174.94 172.53 1p1d s PRO 85 N 4.65 -0.64 0.00 2.79 0.04 -1.26 -0.02 135.00 140.55 1p1d s PRO 85 Ca 0.82 0.49 0.00 0.00 0.04 0.00 0.00 61.00 62.36 1p1d s PRO 85 Cb -0.35 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1p1d s PRO 85 CO 0.35 -3.45 0.00 0.25 0.04 0.00 0.00 177.00 174.19 1p1d n THR 86 N -4.67 0.00 0.26 1.26 -2.24 -0.35 -4.76 114.28 103.78 1p1d n THR 86 Ca 0.06 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.98 1p1d n THR 86 Cb 0.57 -0.22 0.72 0.00 -2.10 0.00 0.00 70.33 69.29 1p1d n THR 86 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1p1d h GLU 87 N 0.00 0.00 -1.51 -0.78 4.81 -1.86 -2.88 114.58 112.37 1p1d h GLU 87 Ca 0.00 0.00 -0.49 0.00 -0.13 0.00 0.00 59.36 58.74 1p1d h GLU 87 Cb 0.00 0.00 -0.41 0.00 0.63 0.00 0.00 28.75 28.97 1p1d h GLU 87 CO 0.00 0.00 -0.95 -0.40 -0.73 0.00 0.00 179.01 176.93 1p1d n ASP 88 N -2.51 2.98 -3.60 1.04 5.75 -1.26 -4.95 116.55 114.00 1p1d n ASP 88 Ca -0.01 -3.26 0.01 0.00 -0.01 0.00 0.00 54.79 51.52 1p1d n ASP 88 Cb 0.10 -0.52 -0.01 0.00 -1.03 0.00 0.00 41.12 39.67 1p1d n ASP 88 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1p1d s SER 89 N -3.23 -0.05 0.38 -1.12 0.15 -1.09 -5.01 113.70 103.73 1p1d s SER 89 Ca 0.40 -0.06 -0.28 0.00 0.70 0.00 0.00 55.95 56.71 1p1d s SER 89 Cb 0.40 0.10 -0.11 0.00 -1.71 0.00 0.00 66.02 64.69 1p1d s SER 89 CO -0.09 -0.17 1.47 0.41 1.20 0.00 0.00 173.24 176.07 1p1d n THR 90 N -0.35 2.01 0.13 6.45 -1.04 -1.26 -4.85 114.28 115.36 1p1d n THR 90 Ca -0.05 -0.50 -0.02 0.00 -2.04 0.00 0.00 64.05 61.44 1p1d n THR 90 Cb 0.61 -1.94 0.13 0.00 -1.82 0.00 0.00 70.33 67.32 1p1d n THR 90 CO 0.00 0.00 0.00 2.19 -0.64 0.00 0.00 175.07 176.62 1p1d h PHE 91 N 2.91 0.00 -0.73 -1.42 -5.15 -1.92 -3.24 116.94 107.39 1p1d h PHE 91 Ca -0.50 0.00 0.10 0.00 -0.20 0.00 0.00 57.97 57.36 1p1d h PHE 91 Cb 1.25 0.00 -0.07 0.00 0.22 0.00 0.00 35.95 37.34 1p1d h PHE 91 CO 0.53 0.66 0.37 0.93 -2.00 0.00 0.00 178.31 178.80 1p1d h GLU 92 N 0.00 0.60 -0.65 6.09 4.39 -1.94 -0.72 114.58 122.35 1p1d h GLU 92 Ca -0.01 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1p1d h GLU 92 Cb 1.19 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.67 1p1d h GLU 92 CO 0.09 0.40 0.36 1.05 -1.16 0.00 0.00 179.01 179.74 1p1d h GLU 93 N 0.62 0.90 -0.30 2.33 4.11 -1.96 -1.41 114.58 118.86 1p1d h GLU 93 Ca 0.36 -0.09 -0.06 0.00 0.07 0.00 0.00 59.36 59.63 1p1d h GLU 93 Cb 0.38 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1p1d h GLU 93 CO -0.27 0.66 -0.08 0.00 0.07 0.00 0.00 179.01 179.38 1p1d h ALA 94 N 1.49 1.30 -0.53 1.06 0.00 -1.28 -2.07 119.26 119.23 1p1d h ALA 94 Ca 0.23 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1p1d h ALA 94 Cb 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1p1d h ALA 94 CO -0.04 0.47 -0.11 -0.91 0.00 0.00 0.00 179.25 178.67 1p1d h ASN 95 N 0.46 1.00 0.48 0.00 -0.26 -0.48 -2.44 115.58 114.35 1p1d h ASN 95 Ca 0.09 -0.33 -0.02 0.00 -0.56 0.00 0.00 56.30 55.48 1p1d h ASN 95 Cb 0.43 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 1p1d h ASN 95 CO 0.02 1.11 -0.23 1.56 -1.06 0.00 0.00 177.43 178.83 1p1d h GLN 96 N 0.89 -0.62 -0.78 0.81 1.08 -0.92 -2.54 115.11 113.03 1p1d h GLN 96 Ca 0.14 0.04 0.14 0.00 -1.45 0.00 0.00 58.65 57.52 1p1d h GLN 96 Cb 0.66 0.14 -0.09 0.00 -0.05 0.00 0.00 27.48 28.14 1p1d h GLN 96 CO 0.05 -0.33 0.36 1.37 -0.95 0.00 0.00 178.83 179.32 1p1d h LEU 97 N -0.86 0.39 0.98 1.46 8.10 -1.41 -1.10 115.31 122.87 1p1d h LEU 97 Ca -0.07 0.10 -0.05 0.00 0.11 0.00 0.00 57.88 57.97 1p1d h LEU 97 Cb 0.58 0.04 0.01 0.00 -0.44 0.00 0.00 40.66 40.85 1p1d h LEU 97 CO 0.11 0.17 -0.49 -0.07 -4.11 0.00 0.00 178.44 174.04 1p1d h LEU 98 N 0.53 -1.18 -1.99 0.17 3.38 -1.40 1.24 115.31 116.06 1p1d h LEU 98 Ca 0.42 0.05 0.28 0.00 0.09 0.00 0.00 57.88 58.72 1p1d h LEU 98 Cb 0.60 0.31 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 1p1d h LEU 98 CO -0.37 -0.82 0.70 0.03 0.09 0.00 0.00 178.44 178.07 1p1d h ARG 99 N -1.34 0.00 -0.51 1.13 3.08 -1.14 0.65 114.38 116.25 1p1d h ARG 99 Ca -0.13 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.59 1p1d h ARG 99 Cb 1.04 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.88 1p1d h ARG 99 CO 0.20 0.00 -0.18 -3.47 -1.07 0.00 0.00 179.97 175.46 1p1d n ASP 100 N -4.21 3.65 -1.51 7.04 2.03 -0.44 -4.60 116.55 118.51 1p1d n ASP 100 Ca 0.20 -3.79 0.05 0.00 0.52 0.00 0.00 54.79 51.77 1p1d n ASP 100 Cb 1.03 -0.60 0.33 0.00 -0.72 0.00 0.00 41.12 41.16 1p1d n ASP 100 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1p1d n SER 101 N -1.00 4.79 -0.89 1.67 2.88 0.42 -4.38 113.62 117.11 1p1d n SER 101 Ca 0.39 -3.05 0.08 0.00 -1.33 0.00 0.00 58.87 54.96 1p1d n SER 101 Cb 0.96 -0.64 0.25 0.00 -0.75 0.00 0.00 64.21 64.02 1p1d n SER 101 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1p1d n SER 102 N -0.00 3.78 -0.04 -3.46 7.64 -1.26 -4.32 113.62 115.96 1p1d n SER 102 Ca 0.28 -2.82 -0.12 0.00 1.01 0.00 0.00 58.87 57.22 1p1d n SER 102 Cb 1.11 -0.49 -0.07 0.00 -1.01 0.00 0.00 64.21 63.75 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 1.96 1.31 -0.24 0.44 5.03 -1.90 -2.91 117.51 121.20 1p1d h ILE 103 Ca 0.00 -1.05 0.00 0.00 -0.12 0.00 0.00 64.86 63.69 1p1d h ILE 103 Cb 1.33 1.78 0.00 0.00 -3.03 0.00 0.00 36.82 36.90 1p1d h ILE 103 CO 0.19 0.30 0.00 0.35 -0.68 0.00 0.00 178.15 178.31 1p1d n THR 104 N -4.72 0.32 -2.07 -0.27 -2.24 -1.26 -4.89 114.28 99.14 1p1d n THR 104 Ca -0.06 -0.39 -0.20 0.00 -2.27 0.00 0.00 64.05 61.13 1p1d n THR 104 Cb 0.27 0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.75 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 0.38 -5.56 -3.60 3.42 7.64 -1.10 -4.91 113.62 109.88 1p1d n SER 105 Ca 0.14 0.20 -0.06 0.00 1.01 0.00 0.00 58.87 60.16 1p1d n SER 105 Cb 0.30 -4.75 -0.04 0.00 -1.01 0.00 0.00 64.21 58.72 1p1d n SER 105 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1p1d s LYS 106 N -4.50 0.36 -0.06 1.43 0.00 -1.26 -2.23 119.74 113.48 1p1d s LYS 106 Ca 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 55.97 55.83 1p1d s LYS 106 Cb 0.00 0.17 0.03 0.00 0.00 0.00 0.00 37.83 38.03 1p1d s LYS 106 CO 0.00 -0.13 0.32 0.08 0.00 0.00 0.00 175.35 175.62 1p1d s VAL 107 N -1.61 0.03 -0.17 1.79 1.01 0.34 -4.84 120.40 116.96 1p1d s VAL 107 Ca 0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 1p1d s VAL 107 Cb -0.01 -0.56 -0.00 0.00 0.00 0.00 0.00 36.38 35.81 1p1d s VAL 107 CO -0.04 -0.16 -0.13 -0.89 0.00 0.00 0.00 175.10 173.89 1p1d s THR 108 N -0.73 2.84 0.11 3.92 2.01 -1.26 0.27 115.64 122.80 1p1d s THR 108 Ca -0.08 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.26 1p1d s THR 108 Cb -0.04 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.21 1p1d s THR 108 CO 0.03 0.50 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.58 1p1d s LEU 109 N 0.92 2.40 -0.17 4.42 1.43 0.25 -1.46 118.68 126.47 1p1d s LEU 109 Ca -0.03 -0.80 -0.00 0.00 -1.03 0.00 0.00 54.13 52.27 1p1d s LEU 109 Cb -0.15 -0.43 0.00 0.00 0.03 0.00 0.00 46.19 45.65 1p1d s LEU 109 CO -0.01 -0.20 -0.15 -1.61 0.23 0.00 0.00 176.35 174.61 1p1d s GLU 110 N -2.69 3.18 0.09 1.70 2.02 -1.12 0.70 118.70 122.58 1p1d s GLU 110 Ca 0.07 -0.75 0.08 0.00 0.02 0.00 0.00 54.97 54.38 1p1d s GLU 110 Cb -0.04 -2.67 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 1p1d s GLU 110 CO 0.02 -0.08 -0.14 0.96 0.02 0.00 0.00 175.26 176.03 1p1d s ILE 111 N 1.05 3.07 0.05 -1.63 -4.36 -0.62 0.11 121.20 118.87 1p1d s ILE 111 Ca -0.01 -1.33 0.08 0.00 -0.26 0.00 0.00 60.65 59.13 1p1d s ILE 111 Cb -0.15 -2.40 -0.03 0.00 1.25 0.00 0.00 42.46 41.13 1p1d s ILE 111 CO -0.04 0.15 -0.23 -0.70 0.24 0.00 0.00 174.94 174.37 1p1d s GLU 112 N -2.02 1.90 0.31 0.37 2.12 -1.16 -0.17 118.70 120.04 1p1d s GLU 112 Ca 0.19 -1.07 -0.19 0.00 0.36 0.00 0.00 54.97 54.26 1p1d s GLU 112 Cb -0.11 -2.07 0.04 0.00 0.26 0.00 0.00 34.13 32.25 1p1d s GLU 112 CO 0.11 0.52 0.79 -0.59 -0.54 0.00 0.00 175.26 175.55 1p1d s PHE 113 N -0.88 -0.04 0.07 5.30 -0.12 -0.41 -4.84 117.98 117.06 1p1d s PHE 113 Ca 0.13 -0.50 -0.06 0.00 -0.05 0.00 0.00 56.93 56.45 1p1d s PHE 113 Cb -0.10 0.76 -0.05 0.00 -0.63 0.00 0.00 43.02 43.00 1p1d s PHE 113 CO 0.04 -1.33 0.32 0.16 -0.05 0.00 0.00 175.22 174.36 1p1d s ASP 114 N -3.02 6.50 -0.45 1.98 -4.77 -1.26 -0.13 116.67 115.52 1p1d s ASP 114 Ca 0.14 0.57 -0.16 0.00 -3.30 0.00 0.00 52.55 49.80 1p1d s ASP 114 Cb -0.05 -2.09 0.05 0.00 -1.09 0.00 0.00 42.92 39.74 1p1d s ASP 114 CO 0.08 0.17 0.37 0.68 0.70 0.00 0.00 175.17 177.17 1p1d s VAL 115 N -1.45 5.22 0.00 2.11 -7.23 -1.26 -4.93 120.40 112.86 1p1d s VAL 115 Ca 0.34 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 1p1d s VAL 115 Cb -0.13 -4.05 0.00 0.00 0.56 0.00 0.00 36.38 32.76 1p1d s VAL 115 CO 0.20 -0.47 0.00 0.00 -0.31 0.00 0.00 175.10 174.52 1p1d n ALA 116 N 5.25 0.00 -0.43 1.32 0.00 0.26 -4.72 120.51 122.19 1p1d n ALA 116 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1p1d n ALA 116 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1p1d n ALA 116 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1p1d n GLU 117 N 0.00 1.84 -1.19 0.00 -0.58 -1.26 -4.67 120.64 114.78 1p1d n GLU 117 Ca 0.00 -1.18 0.00 0.00 -0.42 0.00 0.00 57.16 55.56 1p1d n GLU 117 Cb 0.00 -0.83 0.00 0.00 -0.57 0.00 0.00 31.44 30.04 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 -0.35 -1.58 -4.90 1.62 2.88 -1.25 -4.29 113.62 105.75 1p1d n SER 118 Ca 0.01 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.22 1p1d n SER 118 Cb 0.36 -0.79 -0.05 0.00 -0.75 0.00 0.00 64.21 62.98 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 -1.74 5.29 -0.43 2.46 -7.23 -1.26 -3.34 120.40 114.15 1p1d s VAL 119 Ca 0.00 -0.07 0.02 0.00 -1.81 0.00 0.00 61.98 60.12 1p1d s VAL 119 Cb 0.00 -3.60 0.13 0.00 0.56 0.00 0.00 36.38 33.46 1p1d s VAL 119 CO 0.00 0.19 0.21 0.27 -0.31 0.00 0.00 175.10 175.45 1p1d s ILE 120 N -1.48 1.70 0.00 -0.62 -5.25 -0.25 -4.94 121.20 110.36 1p1d s ILE 120 Ca 0.34 -2.56 0.00 0.00 -0.99 0.00 0.00 60.65 57.44 1p1d s ILE 120 Cb -0.13 -2.20 0.00 0.00 2.95 0.00 0.00 42.46 43.08 1p1d s ILE 120 CO 0.23 -0.81 0.00 -0.81 -1.79 0.00 0.00 174.94 171.75 1p1d n PRO 121 N 3.68 1.55 0.00 0.37 -0.04 -1.26 -2.17 135.00 137.13 1p1d n PRO 121 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1p1d n PRO 121 Cb 0.36 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.82 1p1d n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1p1d n SER 122 N -1.67 0.00 0.00 3.54 2.88 -1.26 -4.90 113.62 112.21 1p1d n SER 122 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1p1d n SER 122 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 0.00 0.00 -3.46 3.41 -1.26 -4.86 113.62 107.45 1p1d n SER 123 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1p1d n SER 123 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1p1d n SER 123 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p1d n GLY 124 N 0.00 2.51 2.84 5.00 0.00 0.45 -4.91 105.19 111.08 1p1d n GLY 124 Ca 0.00 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.67 1.26 -0.33 2.61 2.01 -1.25 -2.14 115.64 117.13 1p1d s THR 125 Ca 0.00 -1.40 -0.12 0.00 0.31 0.00 0.00 61.69 60.48 1p1d s THR 125 Cb 0.00 -1.79 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 1p1d s THR 125 CO 0.00 -0.43 0.23 0.12 -0.69 0.00 0.00 174.62 173.85 1p1d s PHE 126 N 1.46 3.22 -0.06 4.92 2.19 0.50 -3.98 117.98 126.24 1p1d s PHE 126 Ca 0.04 -0.21 -0.17 0.00 0.33 0.00 0.00 56.93 56.92 1p1d s PHE 126 Cb -0.18 -2.46 -0.05 0.00 -1.31 0.00 0.00 43.02 39.02 1p1d s PHE 126 CO -0.14 -0.35 0.48 -1.01 1.83 0.00 0.00 175.22 176.02 1p1d s HIS 127 N 1.72 3.62 -0.72 10.12 3.76 -0.92 0.51 115.29 133.37 1p1d s HIS 127 Ca 0.06 0.98 0.03 0.00 -0.15 0.00 0.00 55.06 55.98 1p1d s HIS 127 Cb -0.17 -2.48 0.17 0.00 1.11 0.00 0.00 32.58 31.22 1p1d s HIS 127 CO 0.10 0.36 0.52 0.08 -0.85 0.00 0.00 174.74 174.96 1p1d s VAL 128 N -0.10 3.23 -0.67 -0.90 1.01 0.13 -1.09 120.40 122.00 1p1d s VAL 128 Ca 0.26 -3.99 -0.27 0.00 0.00 0.00 0.00 61.98 57.98 1p1d s VAL 128 Cb -0.16 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.15 1p1d s VAL 128 CO 0.13 -0.99 1.21 -0.54 0.00 0.00 0.00 175.10 174.91 1p1d s LYS 129 N -1.20 3.30 0.03 2.72 -0.14 -1.21 -2.09 119.74 121.15 1p1d s LYS 129 Ca 0.24 -0.12 0.05 0.00 -1.36 0.00 0.00 55.97 54.78 1p1d s LYS 129 Cb -0.09 -4.12 -0.02 0.00 -1.68 0.00 0.00 37.83 31.92 1p1d s LYS 129 CO -0.13 -1.94 -0.15 -0.48 -0.76 0.00 0.00 175.35 171.89 1p1d s LEU 130 N 5.29 2.15 0.19 3.17 0.05 -0.98 -3.91 118.68 124.64 1p1d s LEU 130 Ca 0.36 -0.44 -0.30 0.00 0.05 0.00 0.00 54.13 53.81 1p1d s LEU 130 Cb -0.09 -0.68 -0.08 0.00 -2.05 0.00 0.00 46.19 43.29 1p1d s LEU 130 CO 0.18 0.07 1.17 -2.16 -0.55 0.00 0.00 176.35 175.06 1p1d s PRO 131 N -1.02 4.53 0.24 1.48 0.04 -1.26 -1.27 135.00 137.74 1p1d s PRO 131 Ca 0.03 1.84 0.07 0.00 0.04 0.00 0.00 61.00 62.98 1p1d s PRO 131 Cb -0.08 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 1p1d s PRO 131 CO 0.01 -0.03 0.13 0.21 0.04 0.00 0.00 177.00 177.37 1p1d s LYS 132 N -0.40 2.74 0.06 4.56 2.20 -0.97 -4.80 119.74 123.14 1p1d s LYS 132 Ca 0.51 -1.13 0.01 0.00 -0.36 0.00 0.00 55.97 55.00 1p1d s LYS 132 Cb -0.32 -2.46 0.01 0.00 -1.51 0.00 0.00 37.83 33.54 1p1d s LYS 132 CO 0.37 0.40 0.06 0.36 -0.36 0.00 0.00 175.35 176.18 1p1d n LYS 133 N -0.98 1.26 0.00 4.03 0.00 -1.26 -3.72 118.16 117.49 1p1d n LYS 133 Ca -0.08 -0.38 0.00 0.00 -0.00 0.00 0.00 58.31 57.85 1p1d n LYS 133 Cb 0.58 0.02 0.00 0.00 -0.00 0.00 0.00 35.03 35.63 1p1d n LYS 133 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 1p1d n HIS 134 N -0.81 0.00 -2.98 5.58 -0.00 -1.26 -4.22 115.22 111.52 1p1d n HIS 134 Ca 0.00 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 58.02 1p1d n HIS 134 Cb 0.07 -0.19 -0.01 0.00 -0.12 0.00 0.00 29.99 29.73 1p1d n HIS 134 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1p1d n SER 135 N -1.08 -1.37 -4.43 0.26 7.64 -1.26 -4.87 113.62 108.51 1p1d n SER 135 Ca 0.00 -2.97 -0.23 0.00 1.01 0.00 0.00 58.87 56.69 1p1d n SER 135 Cb 0.00 0.57 -0.10 0.00 -1.01 0.00 0.00 64.21 63.67 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 -0.21 2.24 -0.58 0.44 1.01 -1.26 -5.05 120.40 116.99 1p1d s VAL 136 Ca 0.33 -2.30 -0.31 0.00 0.00 0.00 0.00 61.98 59.70 1p1d s VAL 136 Cb 0.19 -2.19 -0.13 0.00 0.00 0.00 0.00 36.38 34.24 1p1d s VAL 136 CO -0.17 -0.43 2.41 1.21 0.00 0.00 0.00 175.10 178.12 1p1d n GLU 137 N -0.44 0.75 -0.14 2.72 2.13 -1.08 -4.80 120.64 119.78 1p1d n GLU 137 Ca -0.07 0.11 -0.08 0.00 0.66 0.00 0.00 57.16 57.78 1p1d n GLU 137 Cb 0.60 -2.51 -0.00 0.00 0.27 0.00 0.00 31.44 29.80 1p1d n GLU 137 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1p1d h LEU 138 N 14.62 0.52 0.00 4.31 7.12 -1.97 -3.46 115.31 136.45 1p1d h LEU 138 Ca -0.20 -0.10 0.00 0.00 0.13 0.00 0.00 57.88 57.71 1p1d h LEU 138 Cb 1.30 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.30 1p1d h LEU 138 CO 1.17 0.47 0.00 0.61 -0.13 0.00 0.00 178.44 180.56 1p1d n GLY 139 N -0.96 0.65 3.65 3.75 0.00 -1.26 -3.85 105.19 107.17 1p1d n GLY 139 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.56 4.05 -0.06 -0.61 -4.36 -1.26 -0.23 121.20 116.16 1p1d s ILE 140 Ca 0.00 -0.43 0.03 0.00 -0.26 0.00 0.00 60.65 59.99 1p1d s ILE 140 Cb 0.00 -2.72 0.00 0.00 1.25 0.00 0.00 42.46 41.00 1p1d s ILE 140 CO 0.00 0.54 -0.16 -0.89 0.24 0.00 0.00 174.94 174.66 1p1d s THR 141 N -0.92 1.42 0.34 8.37 2.01 0.25 -4.96 115.64 122.15 1p1d s THR 141 Ca 0.15 -0.67 0.04 0.00 0.31 0.00 0.00 61.69 61.52 1p1d s THR 141 Cb -0.11 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.13 1p1d s THR 141 CO 0.04 0.41 0.49 -0.63 -0.69 0.00 0.00 174.62 174.25 1p1d s ILE 142 N 0.38 4.45 -0.06 1.82 1.01 -1.26 0.38 121.20 127.91 1p1d s ILE 142 Ca -0.12 -0.84 -0.29 0.00 0.00 0.00 0.00 60.65 59.40 1p1d s ILE 142 Cb -0.15 -3.58 0.07 0.00 0.01 0.00 0.00 42.46 38.81 1p1d s ILE 142 CO 0.04 -0.27 0.65 -0.44 0.00 0.00 0.00 174.94 174.91 1p1d s SER 143 N -4.12 -0.62 -0.12 3.58 0.01 0.83 -4.55 113.70 108.71 1p1d s SER 143 Ca 0.42 0.70 -0.00 0.00 1.31 0.00 0.00 55.95 58.38 1p1d s SER 143 Cb -0.09 0.56 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 1p1d s SER 143 CO 0.32 -0.57 -0.10 -0.94 0.41 0.00 0.00 173.24 172.36 1p1d s SER 144 N -1.12 4.28 0.05 2.44 1.04 -1.26 -1.66 113.70 117.46 1p1d s SER 144 Ca -0.11 -0.23 -0.34 0.00 0.48 0.00 0.00 55.95 55.76 1p1d s SER 144 Cb -0.01 -1.50 -0.19 0.00 0.10 0.00 0.00 66.02 64.42 1p1d s SER 144 CO 0.09 0.21 1.45 1.55 0.98 0.00 0.00 173.24 177.52 1p1d h PRO 145 N 6.36 -1.11 0.00 4.02 0.13 -1.95 -3.49 132.00 135.96 1p1d h PRO 145 Ca -0.32 0.08 0.08 0.00 -0.87 0.00 0.00 66.00 64.96 1p1d h PRO 145 Cb 1.20 0.25 -0.01 0.00 0.13 0.00 0.00 31.00 32.57 1p1d h PRO 145 CO 0.56 -0.73 0.36 0.43 -0.23 0.00 0.00 178.00 178.39 1p1d n SER 146 N -5.56 -1.37 -0.79 1.44 7.64 -1.26 -5.05 113.62 108.67 1p1d n SER 146 Ca -0.15 -1.80 0.02 0.00 1.01 0.00 0.00 58.87 57.96 1p1d n SER 146 Cb 0.46 2.25 0.20 0.00 -1.01 0.00 0.00 64.21 66.11 1p1d n SER 146 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1p1d n SER 147 N -1.18 2.01 -2.33 6.43 2.88 -1.26 -4.71 113.62 115.46 1p1d n SER 147 Ca -0.03 -3.84 -0.30 0.00 -1.33 0.00 0.00 58.87 53.38 1p1d n SER 147 Cb 0.42 -0.57 0.03 0.00 -0.75 0.00 0.00 64.21 63.35 1p1d n SER 147 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1p1d n ARG 148 N -1.13 3.23 -3.78 -1.46 5.12 -1.26 -4.99 116.66 112.39 1p1d n ARG 148 Ca 0.24 -3.94 -0.13 0.00 -1.93 0.00 0.00 57.85 52.09 1p1d n ARG 148 Cb 0.81 -2.27 -0.09 0.00 -1.16 0.00 0.00 32.46 29.75 1p1d n ARG 148 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1p1d s LYS 149 N -3.71 0.63 0.59 5.56 3.01 -1.26 -5.03 119.74 119.53 1p1d s LYS 149 Ca 0.54 -0.24 0.29 0.00 -1.01 0.00 0.00 55.97 55.55 1p1d s LYS 149 Cb 0.44 0.27 1.51 0.00 -1.01 0.00 0.00 37.83 39.04 1p1d s LYS 149 CO -0.09 -0.17 1.93 -1.35 0.51 0.00 0.00 175.35 176.18 1p1d h PRO 150 N 3.96 0.00 0.00 -1.68 0.11 -2.00 -3.37 132.00 129.02 1p1d h PRO 150 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1p1d h PRO 150 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1p1d h PRO 150 CO 0.40 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.60 1p1d n GLY 151 N -1.47 -1.04 3.57 -0.55 0.00 -1.26 -5.04 105.19 99.40 1p1d n GLY 151 Ca 0.06 0.43 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 1p1d n GLY 151 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p1d n ASP 152 N 0.00 0.53 -4.24 1.61 9.92 -1.26 -4.61 116.55 118.50 1p1d n ASP 152 Ca 0.00 0.95 -0.29 0.00 -0.53 0.00 0.00 54.79 54.91 1p1d n ASP 152 Cb 0.00 -1.29 0.20 0.00 -0.64 0.00 0.00 41.12 39.38 1p1d n ASP 152 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1p1d s PRO 153 N -2.04 -0.06 0.58 -0.24 0.04 -1.26 -4.92 135.00 127.09 1p1d s PRO 153 Ca 0.66 0.03 -0.00 0.00 0.04 0.00 0.00 61.00 61.73 1p1d s PRO 153 Cb -0.53 -1.72 0.04 0.00 0.04 0.00 0.00 34.50 32.32 1p1d s PRO 153 CO 0.55 -2.96 0.81 -0.51 0.04 0.00 0.00 177.00 174.94 1p1d s LEU 154 N -6.45 3.20 -0.02 -3.56 2.01 -1.17 -4.63 118.68 108.05 1p1d s LEU 154 Ca 0.69 0.06 -0.16 0.00 0.01 0.00 0.00 54.13 54.73 1p1d s LEU 154 Cb -0.11 -2.91 0.03 0.00 0.01 0.00 0.00 46.19 43.21 1p1d s LEU 154 CO 0.55 -1.22 0.35 0.68 1.01 0.00 0.00 176.35 177.72 1p1d s VAL 155 N -2.84 0.05 0.48 -1.59 -7.23 -0.67 0.60 120.40 109.20 1p1d s VAL 155 Ca 0.58 -0.40 -0.22 0.00 -1.81 0.00 0.00 61.98 60.12 1p1d s VAL 155 Cb -0.10 -0.64 -0.07 0.00 0.56 0.00 0.00 36.38 36.13 1p1d s VAL 155 CO 0.39 -0.22 1.21 -0.63 -0.31 0.00 0.00 175.10 175.54 1p1d s ILE 156 N -1.22 2.88 0.00 -0.62 1.01 -1.26 -0.12 121.20 121.87 1p1d s ILE 156 Ca -0.13 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.18 1p1d s ILE 156 Cb -0.05 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 39.10 1p1d s ILE 156 CO 0.05 -0.02 0.03 -0.24 0.00 0.00 0.00 174.94 174.76 1p1d n SER 157 N -0.65 0.06 -3.63 3.58 2.88 0.16 -4.39 113.62 111.63 1p1d n SER 157 Ca 0.08 -0.33 -0.06 0.00 -1.33 0.00 0.00 58.87 57.23 1p1d n SER 157 Cb 0.48 0.37 -0.06 0.00 -0.75 0.00 0.00 64.21 64.24 1p1d n SER 157 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1p1d s ASP 158 N -0.37 -0.24 0.06 -3.46 -1.08 -1.22 -4.93 116.67 105.43 1p1d s ASP 158 Ca 0.00 0.41 0.04 0.00 -0.52 0.00 0.00 52.55 52.48 1p1d s ASP 158 Cb 0.00 0.40 -0.03 0.00 -1.46 0.00 0.00 42.92 41.83 1p1d s ASP 158 CO 0.00 -0.12 -0.12 -0.63 0.52 0.00 0.00 175.17 174.82 1p1d s ILE 159 N -0.24 0.89 0.02 4.11 1.01 -1.25 -0.58 121.20 125.16 1p1d s ILE 159 Ca 0.05 -1.17 0.07 0.00 0.00 0.00 0.00 60.65 59.60 1p1d s ILE 159 Cb -0.04 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 1p1d s ILE 159 CO -0.08 -0.25 -0.21 -0.75 0.00 0.00 0.00 174.94 173.65 1p1d s LYS 160 N -1.58 1.53 0.45 2.79 2.20 0.68 -4.98 119.74 120.83 1p1d s LYS 160 Ca -0.04 -0.86 -0.18 0.00 -0.36 0.00 0.00 55.97 54.52 1p1d s LYS 160 Cb -0.10 -1.57 -0.09 0.00 -1.51 0.00 0.00 37.83 34.56 1p1d s LYS 160 CO 0.01 0.42 0.93 0.21 -0.36 0.00 0.00 175.35 176.56 1p1d s LYS 161 N -0.89 4.08 0.00 4.03 2.47 -1.26 -3.70 119.74 124.47 1p1d s LYS 161 Ca 0.08 0.98 0.00 0.00 -1.56 0.00 0.00 55.97 55.47 1p1d s LYS 161 Cb -0.08 -2.20 0.00 0.00 -1.46 0.00 0.00 37.83 34.09 1p1d s LYS 161 CO 0.01 -0.10 0.00 0.41 0.16 0.00 0.00 175.35 175.82 1p1d n GLY 162 N -1.00 2.75 3.82 5.54 0.00 -1.26 -4.81 105.19 110.22 1p1d n GLY 162 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1p1d n GLY 162 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p1d s SER 163 N -1.83 6.55 0.63 1.61 0.01 -1.24 -4.96 113.70 114.48 1p1d s SER 163 Ca 0.00 0.66 0.23 0.00 1.31 0.00 0.00 55.95 58.15 1p1d s SER 163 Cb 0.00 -2.17 1.15 0.00 0.21 0.00 0.00 66.02 65.21 1p1d s SER 163 CO 0.00 0.29 1.63 -0.37 0.41 0.00 0.00 173.24 175.19 1p1d h VAL 164 N 4.09 0.11 -0.20 3.43 -1.51 -1.90 -0.92 116.25 119.35 1p1d h VAL 164 Ca -0.50 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.02 1p1d h VAL 164 Cb 1.21 0.41 -0.04 0.00 -2.13 0.00 0.00 31.29 30.74 1p1d h VAL 164 CO 0.65 0.00 -0.06 0.00 -1.23 0.00 0.00 177.57 176.93 1p1d h ALA 165 N 0.97 0.12 0.00 5.19 0.00 -1.89 -2.03 119.26 121.63 1p1d h ALA 165 Ca 0.15 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.98 1p1d h ALA 165 Cb 1.46 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 1p1d h ALA 165 CO -0.00 -0.48 -0.97 1.25 0.00 0.00 0.00 179.25 179.04 1p1d h HIS 166 N -0.01 0.00 -0.17 0.00 6.17 -1.37 -3.35 115.15 116.42 1p1d h HIS 166 Ca 0.10 0.00 0.03 0.00 0.71 0.00 0.00 60.37 61.21 1p1d h HIS 166 Cb 0.16 0.00 -0.03 0.00 2.52 0.00 0.00 27.41 30.06 1p1d h HIS 166 CO -0.23 0.66 -0.04 0.00 0.71 0.00 0.00 177.93 179.03 1p1d h ARG 167 N 0.00 -0.00 -0.37 5.26 2.47 -1.10 -0.76 114.38 119.88 1p1d h ARG 167 Ca -0.08 0.00 0.11 0.00 -1.26 0.00 0.00 59.98 58.75 1p1d h ARG 167 Cb 1.57 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.88 1p1d h ARG 167 CO 0.07 -0.00 0.43 0.00 0.56 0.00 0.00 179.97 181.03 1p1d h THR 168 N -0.00 0.35 -0.14 2.04 1.03 -1.51 0.74 112.91 115.42 1p1d h THR 168 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.48 1p1d h THR 168 Cb 0.13 0.65 0.00 0.00 -1.07 0.00 0.00 68.15 67.86 1p1d h THR 168 CO -0.18 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 175.94 1p1d n GLY 169 N -1.47 -1.44 2.76 2.99 0.00 -0.29 -4.08 105.19 103.66 1p1d n GLY 169 Ca 0.06 -1.29 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 1p1d n GLY 169 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1p1d n THR 170 N -0.06 -0.31 -3.71 2.61 5.66 -1.26 -4.88 114.28 112.33 1p1d n THR 170 Ca 0.00 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 1p1d n THR 170 Cb 0.00 -0.81 -0.15 0.00 -1.55 0.00 0.00 70.33 67.82 1p1d n THR 170 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1p1d s LEU 171 N -5.56 2.15 0.03 1.09 1.02 -1.26 -5.01 118.68 111.13 1p1d s LEU 171 Ca 0.12 -1.75 0.01 0.00 0.02 0.00 0.00 54.13 52.53 1p1d s LEU 171 Cb -0.07 -0.84 -0.02 0.00 0.02 0.00 0.00 46.19 45.29 1p1d s LEU 171 CO 0.15 -0.40 -0.05 -1.83 0.02 0.00 0.00 176.35 174.24 1p1d s GLU 172 N 1.48 0.39 0.33 1.70 -1.05 -1.26 -4.99 118.70 115.30 1p1d s GLU 172 Ca 0.11 -0.65 -0.29 0.00 -0.15 0.00 0.00 54.97 53.99 1p1d s GLU 172 Cb -0.18 -0.05 -0.12 0.00 -0.44 0.00 0.00 34.13 33.34 1p1d s GLU 172 CO -0.22 -0.01 1.38 1.28 0.95 0.00 0.00 175.26 178.64 1p1d n LEU 173 N 1.59 3.78 0.00 1.83 4.77 -1.26 -2.79 117.00 124.92 1p1d n LEU 173 Ca -0.23 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.94 1p1d n LEU 173 Cb 0.55 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.13 1p1d n LEU 173 CO 0.20 -0.30 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 1p1d n GLY 174 N 1.09 2.33 3.80 -0.72 0.00 -1.26 -5.05 105.19 105.38 1p1d n GLY 174 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1p1d n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p1d s ASP 175 N -1.59 4.17 -0.17 1.61 1.01 -1.12 -5.02 116.67 115.57 1p1d s ASP 175 Ca 0.00 1.20 0.01 0.00 0.71 0.00 0.00 52.55 54.47 1p1d s ASP 175 Cb 0.00 -1.89 0.01 0.00 1.01 0.00 0.00 42.92 42.05 1p1d s ASP 175 CO 0.00 -2.16 -0.17 -0.54 0.21 0.00 0.00 175.17 172.51 1p1d s LYS 176 N -5.19 3.11 0.16 8.23 -0.14 -1.26 -4.24 119.74 120.42 1p1d s LYS 176 Ca 0.62 -0.79 -0.27 0.00 -1.36 0.00 0.00 55.97 54.17 1p1d s LYS 176 Cb -0.15 -2.61 -0.08 0.00 -1.68 0.00 0.00 37.83 33.32 1p1d s LYS 176 CO 0.54 -0.09 0.84 -0.51 -0.76 0.00 0.00 175.35 175.37 1p1d s LEU 177 N 1.05 4.58 0.02 3.17 1.02 0.20 0.10 118.68 128.82 1p1d s LEU 177 Ca -0.01 1.72 -0.01 0.00 0.02 0.00 0.00 54.13 55.84 1p1d s LEU 177 Cb -0.14 -3.40 -0.00 0.00 0.02 0.00 0.00 46.19 42.66 1p1d s LEU 177 CO -0.05 0.14 -0.02 -0.11 0.02 0.00 0.00 176.35 176.33 1p1d n LEU 178 N 1.85 0.45 -4.47 1.79 0.00 0.32 -3.05 117.00 113.89 1p1d n LEU 178 Ca -0.03 0.06 -0.24 0.00 0.00 0.00 0.00 56.01 55.80 1p1d n LEU 178 Cb 0.48 -0.21 -0.10 0.00 0.00 0.00 0.00 43.42 43.59 1p1d n LEU 178 CO 0.48 -0.56 -0.44 0.00 0.00 0.00 0.00 177.39 176.87 1p1d s ALA 179 N -2.19 2.68 -0.23 1.96 0.00 -1.20 -0.08 121.76 122.70 1p1d s ALA 179 Ca -0.02 -1.91 -0.04 0.00 0.00 0.00 0.00 51.96 49.98 1p1d s ALA 179 Cb 0.00 -0.14 0.08 0.00 0.00 0.00 0.00 23.12 23.06 1p1d s ALA 179 CO 0.03 0.17 0.11 0.42 0.00 0.00 0.00 175.76 176.48 1p1d s ILE 180 N -2.64 -0.05 0.00 0.00 -1.09 0.19 -0.62 121.20 116.98 1p1d s ILE 180 Ca 0.30 -0.47 0.00 0.00 -2.23 0.00 0.00 60.65 58.25 1p1d s ILE 180 Cb -0.02 -0.79 0.00 0.00 -1.58 0.00 0.00 42.46 40.07 1p1d s ILE 180 CO 0.14 -0.49 0.00 -0.67 -1.23 0.00 0.00 174.94 172.69 1p1d n ASP 181 N 5.25 0.00 0.00 3.58 2.03 0.11 -1.45 116.55 126.08 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 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 1p1d n ASP 181 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1p1d n ASN 182 N 0.94 0.35 -4.82 1.67 4.05 -1.26 -4.80 115.26 111.39 1p1d n ASN 182 Ca 0.00 0.00 -0.38 0.00 0.45 0.00 0.00 54.58 54.65 1p1d n ASN 182 Cb 0.00 0.06 -0.06 0.00 1.23 0.00 0.00 39.78 41.01 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1p1d s ILE 183 N -0.46 5.12 -0.27 -1.44 -1.09 -0.53 -5.07 121.20 117.47 1p1d s ILE 183 Ca 0.00 0.75 -0.10 0.00 -2.23 0.00 0.00 60.65 59.07 1p1d s ILE 183 Cb 0.00 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1p1d s ILE 183 CO 0.00 0.55 0.15 -0.13 -1.23 0.00 0.00 174.94 174.28 1p1d s ARG 184 N -0.83 3.85 0.21 2.79 0.52 -1.26 0.53 118.95 124.75 1p1d s ARG 184 Ca 0.22 -0.37 0.23 0.00 -0.52 0.00 0.00 55.73 55.29 1p1d s ARG 184 Cb -0.16 -3.55 0.91 0.00 0.52 0.00 0.00 34.95 32.68 1p1d s ARG 184 CO 0.11 -0.18 1.70 1.28 0.02 0.00 0.00 175.30 178.23 1p1d n LEU 185 N 5.01 0.58 -0.51 2.53 4.77 0.88 -3.17 117.00 127.10 1p1d n LEU 185 Ca -0.15 0.62 0.44 0.00 -0.03 0.00 0.00 56.01 56.90 1p1d n LEU 185 Cb 0.52 -0.52 0.79 0.00 -2.33 0.00 0.00 43.42 41.88 1p1d n LEU 185 CO 0.32 -0.43 1.41 -0.78 -1.33 0.00 0.00 177.39 176.58 1p1d h ASP 186 N 0.00 0.00 0.00 -1.43 3.58 -1.80 0.14 116.42 116.91 1p1d h ASP 186 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1p1d h ASP 186 Cb 0.42 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.47 1p1d h ASP 186 CO 0.00 0.00 0.00 -1.20 -2.88 0.00 0.00 179.24 175.16 1p1d n SER 187 N -4.06 0.35 -4.89 2.28 7.64 -1.20 -4.73 113.62 109.02 1p1d n SER 187 Ca 0.35 -0.70 -0.32 0.00 1.01 0.00 0.00 58.87 59.21 1p1d n SER 187 Cb 1.63 0.27 -0.05 0.00 -1.01 0.00 0.00 64.21 65.06 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p1d n SER 189 N 0.28 -1.70 0.21 0.00 7.64 -1.26 -4.75 113.62 114.05 1p1d n SER 189 Ca -0.04 -0.95 -0.12 0.00 1.01 0.00 0.00 58.87 58.77 1p1d n SER 189 Cb 0.52 -0.67 -0.07 0.00 -1.01 0.00 0.00 64.21 62.98 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 -0.55 -0.58 1.43 4.05 -1.95 -2.68 114.93 114.65 1p1d h MET 190 Ca -0.27 0.04 0.13 0.00 -0.28 0.00 0.00 59.70 59.31 1p1d h MET 190 Cb 0.83 0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 31.73 1p1d h MET 190 CO 0.18 -0.25 0.40 0.93 0.23 0.00 0.00 176.91 178.39 1p1d h GLU 191 N -1.00 0.21 -0.14 0.39 5.08 -1.99 -0.60 114.58 116.53 1p1d h GLU 191 Ca -0.06 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1p1d h GLU 191 Cb 0.56 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1p1d h GLU 191 CO 0.10 0.14 0.07 -0.44 -1.00 0.00 0.00 179.01 177.88 1p1d h ASP 192 N 0.21 0.17 -0.91 1.42 3.32 -1.90 -1.24 116.42 117.49 1p1d h ASP 192 Ca 0.28 -0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.30 1p1d h ASP 192 Cb 0.80 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 40.24 1p1d h ASP 192 CO -0.05 0.21 0.58 0.00 -1.72 0.00 0.00 179.24 178.25 1p1d h ALA 193 N 0.97 1.25 -0.18 3.45 0.00 -0.77 0.67 119.26 124.66 1p1d h ALA 193 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1p1d h ALA 193 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1p1d h ALA 193 CO -0.01 0.35 -0.03 0.28 0.00 0.00 0.00 179.25 179.84 1p1d h VAL 194 N 1.05 1.13 -0.30 0.00 2.07 -1.00 0.45 116.25 119.66 1p1d h VAL 194 Ca 0.39 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 1p1d h VAL 194 Cb 0.16 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1p1d h VAL 194 CO -0.17 0.18 0.09 1.56 0.02 0.00 0.00 177.57 179.24 1p1d h GLN 195 N 0.25 0.48 0.00 1.57 4.20 0.31 -1.69 115.11 120.23 1p1d h GLN 195 Ca 0.06 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1p1d h GLN 195 Cb 0.23 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1p1d h GLN 195 CO 0.01 0.54 -0.22 0.82 -0.67 0.00 0.00 178.83 179.31 1p1d h ILE 196 N 0.33 0.59 -0.28 2.54 1.08 -0.75 -0.93 117.51 120.09 1p1d h ILE 196 Ca 0.10 -1.03 -0.12 0.00 -0.39 0.00 0.00 64.86 63.42 1p1d h ILE 196 Cb 0.27 1.68 -0.01 0.00 -3.07 0.00 0.00 36.82 35.69 1p1d h ILE 196 CO -0.00 0.21 -0.32 -0.07 -0.69 0.00 0.00 178.15 177.29 1p1d h LEU 197 N 0.00 0.60 0.00 1.44 4.07 -0.14 -2.59 115.31 118.70 1p1d h LEU 197 Ca -0.00 -0.24 -0.22 0.00 0.08 0.00 0.00 57.88 57.50 1p1d h LEU 197 Cb 0.67 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.21 1p1d h LEU 197 CO 0.03 0.88 -1.22 1.56 -1.08 0.00 0.00 178.44 178.61 1p1d h GLN 198 N 0.50 0.01 0.00 1.13 4.20 -1.06 -3.35 115.11 116.53 1p1d h GLN 198 Ca 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1p1d h GLN 198 Cb 0.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 1p1d h GLN 198 CO 0.06 1.00 0.07 -0.56 -0.67 0.00 0.00 178.83 178.74 1p1d h GLN 199 N -0.98 0.00 -1.13 1.46 -0.00 -1.29 -1.25 115.11 111.92 1p1d h GLN 199 Ca -0.34 0.00 -0.26 0.00 -0.00 0.00 0.00 58.65 58.05 1p1d h GLN 199 Cb 1.31 0.00 -0.14 0.00 -0.00 0.00 0.00 27.48 28.64 1p1d h GLN 199 CO -0.20 0.00 0.34 0.00 -0.00 0.00 0.00 178.83 178.97 1p1d n GLU 201 N -0.12 1.00 0.00 0.00 0.28 -0.48 -1.89 120.64 119.44 1p1d n GLU 201 Ca 0.29 -1.30 0.00 0.00 -0.16 0.00 0.00 57.16 55.99 1p1d n GLU 201 Cb 0.93 -2.53 0.00 0.00 1.43 0.00 0.00 31.44 31.27 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 6.58 0.00 0.00 -1.84 8.00 -1.24 -4.63 116.55 123.42 1p1d n ASP 202 Ca 0.38 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.88 1p1d n ASP 202 Cb 0.27 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 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 -0.19 0.00 -4.49 0.64 0.00 -0.79 -2.29 117.00 109.88 1p1d n LEU 203 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 56.01 55.67 1p1d n LEU 203 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 43.42 43.30 1p1d n LEU 203 CO 0.00 0.00 -0.34 -0.69 0.00 0.00 0.00 177.39 176.36 1p1d s VAL 204 N 0.00 3.94 -0.38 1.96 1.01 -0.39 -4.84 120.40 121.70 1p1d s VAL 204 Ca 0.00 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.57 1p1d s VAL 204 Cb 0.00 -2.74 0.05 0.00 0.00 0.00 0.00 36.38 33.69 1p1d s VAL 204 CO 0.00 0.48 0.18 -0.75 0.00 0.00 0.00 175.10 175.01 1p1d s LYS 205 N 0.50 2.62 -0.26 2.72 2.20 -1.25 -2.32 119.74 123.94 1p1d s LYS 205 Ca -0.03 -1.29 -0.20 0.00 -0.36 0.00 0.00 55.97 54.09 1p1d s LYS 205 Cb -0.14 -3.63 -0.02 0.00 -1.51 0.00 0.00 37.83 32.53 1p1d s LYS 205 CO 0.03 -0.79 0.60 -0.51 -0.36 0.00 0.00 175.35 174.31 1p1d s LEU 206 N 1.42 4.07 -0.74 5.43 1.02 -0.89 0.09 118.68 129.09 1p1d s LEU 206 Ca 0.01 0.62 -0.16 0.00 0.02 0.00 0.00 54.13 54.62 1p1d s LEU 206 Cb -0.21 -2.79 0.17 0.00 0.02 0.00 0.00 46.19 43.38 1p1d s LEU 206 CO 0.03 -0.36 0.74 -0.54 0.02 0.00 0.00 176.35 176.24 1p1d s LYS 207 N 2.46 3.38 0.65 1.70 1.02 0.21 0.18 119.74 129.33 1p1d s LYS 207 Ca 0.25 -2.04 -0.09 0.00 0.02 0.00 0.00 55.97 54.10 1p1d s LYS 207 Cb -0.15 -4.43 0.00 0.00 -0.52 0.00 0.00 37.83 32.73 1p1d s LYS 207 CO 0.09 -1.39 1.01 0.42 -0.92 0.00 0.00 175.35 174.56 1p1d s ILE 208 N 1.16 3.77 -0.27 2.17 -1.09 0.18 0.12 121.20 127.25 1p1d s ILE 208 Ca 0.15 0.37 -0.08 0.00 -2.23 0.00 0.00 60.65 58.87 1p1d s ILE 208 Cb -0.16 -3.54 -0.02 0.00 -1.58 0.00 0.00 42.46 37.16 1p1d s ILE 208 CO -0.04 -0.66 0.08 -0.60 -1.23 0.00 0.00 174.94 172.50 1p1d s ARG 209 N -5.19 3.46 -0.17 2.79 3.52 0.29 -0.37 118.95 123.28 1p1d s ARG 209 Ca 0.56 -0.61 -0.01 0.00 -0.13 0.00 0.00 55.73 55.54 1p1d s ARG 209 Cb -0.11 -3.37 0.04 0.00 -1.56 0.00 0.00 34.95 29.95 1p1d s ARG 209 CO 0.50 -0.29 -0.04 0.15 -0.81 0.00 0.00 175.30 174.81 1p1d s LYS 210 N 1.59 1.34 -0.27 5.12 1.02 -0.91 -4.22 119.74 123.40 1p1d s LYS 210 Ca 0.05 -0.52 -0.02 0.00 0.02 0.00 0.00 55.97 55.50 1p1d s LYS 210 Cb -0.16 -2.02 0.09 0.00 -0.52 0.00 0.00 37.83 35.23 1p1d s LYS 210 CO 0.04 -0.46 2.38 -0.25 -0.92 0.00 0.00 175.35 176.14 1p1d n ASP 211 N 4.89 6.19 -4.34 2.83 8.00 -1.26 0.17 116.55 133.03 1p1d n ASP 211 Ca -0.11 -2.95 -0.21 0.00 0.71 0.00 0.00 54.79 52.23 1p1d n ASP 211 Cb 0.47 -1.15 -0.11 0.00 -0.02 0.00 0.00 41.12 40.32 1p1d n ASP 211 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1p1d s GLU 212 N -1.24 1.29 0.00 -1.24 2.02 -1.26 -5.00 118.70 113.27 1p1d s GLU 212 Ca 0.38 -1.47 0.00 0.00 0.02 0.00 0.00 54.97 53.90 1p1d s GLU 212 Cb 0.25 -1.25 0.00 0.00 0.10 0.00 0.00 34.13 33.23 1p1d s GLU 212 CO -0.06 0.24 0.00 -3.47 0.02 0.00 0.00 175.26 171.99