#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a1d s VAL 17 N 0.00 4.90 -1.63 1.39 1.01 0.45 -3.58 120.40 122.93 2a1d s VAL 17 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.02 2a1d s VAL 17 Cb 0.00 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.57 2a1d s VAL 17 CO 0.00 0.55 0.00 -0.62 0.00 0.00 0.00 175.10 175.03 2a1d n GLU 18 N 1.89 -1.35 0.00 2.72 -0.58 -1.26 -2.55 120.64 119.51 2a1d n GLU 18 Ca -0.12 0.94 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 2a1d n GLU 18 Cb 0.51 -5.35 0.00 0.00 -0.57 0.00 0.00 31.44 26.04 2a1d n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2a1d n GLY 19 N -0.95 -2.36 3.65 0.62 0.00 -1.24 -4.88 105.19 100.04 2a1d n GLY 19 Ca -0.20 -1.32 -0.03 0.00 0.00 0.00 0.00 46.02 44.47 2a1d n GLY 19 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a1d s GLN 20 N 0.00 0.18 -0.11 1.61 0.74 -1.20 -4.89 119.66 115.99 2a1d s GLN 20 Ca 0.00 0.23 -0.36 0.00 0.05 0.00 0.00 55.36 55.28 2a1d s GLN 20 Cb 0.00 0.07 -0.13 0.00 1.10 0.00 0.00 33.01 34.05 2a1d s GLN 20 CO 0.00 -0.02 1.78 -0.25 -0.55 0.00 0.00 175.29 176.24 2a1d n ASP 21 N 2.13 2.99 -4.52 6.67 9.92 -1.26 -1.42 116.55 131.06 2a1d n ASP 21 Ca -0.13 1.02 -0.29 0.00 -0.53 0.00 0.00 54.79 54.87 2a1d n ASP 21 Cb 0.57 -1.30 0.21 0.00 -0.64 0.00 0.00 41.12 39.96 2a1d n ASP 21 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2a1d s ALA 22 N 3.39 0.38 -0.57 2.24 0.00 0.13 -4.85 121.76 122.47 2a1d s ALA 22 Ca 0.93 -0.39 -0.11 0.00 0.00 0.00 0.00 51.96 52.39 2a1d s ALA 22 Cb -0.82 -3.12 0.15 0.00 0.00 0.00 0.00 23.12 19.32 2a1d s ALA 22 CO 0.54 -3.30 0.47 -1.21 0.00 0.00 0.00 175.76 172.26 2a1d s GLU 23 N -4.86 2.80 0.00 0.00 2.02 -1.26 -4.93 118.70 112.47 2a1d s GLU 23 Ca 0.67 -1.98 0.00 0.00 0.02 0.00 0.00 54.97 53.68 2a1d s GLU 23 Cb -0.20 -4.07 0.00 0.00 0.10 0.00 0.00 34.13 29.97 2a1d s GLU 23 CO 0.60 -1.24 0.00 1.55 0.02 0.00 0.00 175.26 176.19 2a1d n VAL 24 N 4.62 0.00 -0.38 2.63 3.14 -1.26 -1.37 118.33 125.71 2a1d n VAL 24 Ca -0.03 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.35 2a1d n VAL 24 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.19 2a1d n VAL 24 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2a1d n GLY 25 N 0.00 0.93 0.08 7.55 0.00 -1.26 -4.99 105.19 107.51 2a1d n GLY 25 Ca 0.00 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 2a1d n GLY 25 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2a1d n LEU 26 N 0.00 0.84 -3.19 0.99 7.94 -0.47 -4.62 117.00 118.49 2a1d n LEU 26 Ca 0.00 0.40 -0.21 0.00 -1.11 0.00 0.00 56.01 55.09 2a1d n LEU 26 Cb 0.03 0.18 -0.05 0.00 0.53 0.00 0.00 43.42 44.11 2a1d n LEU 26 CO 0.00 0.39 -0.25 -1.20 -1.11 0.00 0.00 177.39 175.22 2a1d n SER 27 N -3.03 0.61 -0.28 1.96 7.64 -1.26 -4.99 113.62 114.27 2a1d n SER 27 Ca -0.18 -2.88 0.08 0.00 1.01 0.00 0.00 58.87 56.91 2a1d n SER 27 Cb 1.06 -0.63 0.20 0.00 -1.01 0.00 0.00 64.21 63.83 2a1d n SER 27 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2a1d h PRO 28 N 3.47 0.09 0.00 1.43 0.13 -1.79 0.47 132.00 135.81 2a1d h PRO 28 Ca 0.09 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2a1d h PRO 28 Cb 0.92 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2a1d h PRO 28 CO 0.49 0.06 0.00 -2.67 -0.23 0.00 0.00 178.00 175.65 2a1d n TRP 29 N -5.37 0.00 -2.27 1.56 2.14 0.59 -4.12 117.44 109.97 2a1d n TRP 29 Ca 0.16 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.30 2a1d n TRP 29 Cb 0.55 -0.24 -0.02 0.00 -0.81 0.00 0.00 31.31 30.79 2a1d n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2a1d s GLN 30 N -2.48 3.64 0.40 -2.67 2.00 0.17 0.12 119.66 120.83 2a1d s GLN 30 Ca 0.07 1.18 0.08 0.00 -2.00 0.00 0.00 55.36 54.69 2a1d s GLN 30 Cb 0.05 -4.03 -0.00 0.00 0.80 0.00 0.00 33.01 29.83 2a1d s GLN 30 CO 0.10 -1.48 0.50 0.08 -0.50 0.00 0.00 175.29 173.99 2a1d s VAL 31 N 5.42 3.22 -0.27 1.34 1.01 -1.18 -3.99 120.40 125.94 2a1d s VAL 31 Ca 0.65 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 61.53 2a1d s VAL 31 Cb -0.17 -3.10 0.09 0.00 0.00 0.00 0.00 36.38 33.19 2a1d s VAL 31 CO 0.30 -0.05 0.09 -0.32 0.00 0.00 0.00 175.10 175.13 2a1d s MET 32 N -4.25 0.50 -0.42 2.72 1.75 -1.14 -1.87 119.30 116.59 2a1d s MET 32 Ca 0.51 -0.70 -0.28 0.00 -1.25 0.00 0.00 55.69 53.96 2a1d s MET 32 Cb -0.09 -1.75 -0.00 0.00 2.84 0.00 0.00 34.83 35.83 2a1d s MET 32 CO 0.31 -0.90 1.59 -0.51 -0.65 0.00 0.00 175.02 174.87 2a1d s LEU 33 N 1.85 3.50 0.02 4.11 1.43 0.17 -2.18 118.68 127.58 2a1d s LEU 33 Ca 0.07 0.88 0.04 0.00 -1.03 0.00 0.00 54.13 54.08 2a1d s LEU 33 Cb -0.17 -3.38 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 2a1d s LEU 33 CO -0.24 -1.66 -0.06 0.12 0.23 0.00 0.00 176.35 174.74 2a1d s PHE 34 N 6.37 2.88 -0.02 0.29 5.36 -1.07 -1.14 117.98 130.66 2a1d s PHE 34 Ca 0.67 -0.05 -0.12 0.00 -0.96 0.00 0.00 56.93 56.48 2a1d s PHE 34 Cb -0.16 -1.59 -0.05 0.00 -0.34 0.00 0.00 43.02 40.87 2a1d s PHE 34 CO 0.31 0.38 0.35 0.50 -1.46 0.00 0.00 175.22 175.30 2a1d s ARG 35 N -1.53 3.79 0.01 10.12 3.52 0.98 -1.41 118.95 134.43 2a1d s ARG 35 Ca 0.18 0.25 -0.10 0.00 -0.13 0.00 0.00 55.73 55.93 2a1d s ARG 35 Cb -0.11 -3.18 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 2a1d s ARG 35 CO 0.09 0.70 0.93 0.87 -0.81 0.00 0.00 175.30 177.08 2a1d h LYS 36 N 4.63 -0.34 -3.35 5.12 1.57 -1.64 -3.01 116.57 119.54 2a1d h LYS 36 Ca -0.52 0.02 -0.25 0.00 -1.87 0.00 0.00 60.65 58.04 2a1d h LYS 36 Cb 1.22 0.08 -0.31 0.00 0.08 0.00 0.00 32.23 33.29 2a1d h LYS 36 CO 0.61 -0.23 -0.62 0.45 -0.57 0.00 0.00 179.45 179.09 2a1d s SER 36 N -2.91 -0.07 0.18 0.86 0.15 -1.26 -2.13 113.70 108.51 2a1d s SER 36 Ca -0.05 0.23 -0.30 0.00 0.70 0.00 0.00 55.95 56.53 2a1d s SER 36 Cb 0.01 0.14 -0.08 0.00 -1.71 0.00 0.00 66.02 64.37 2a1d s SER 36 CO 0.16 -0.12 1.25 -2.16 1.20 0.00 0.00 173.24 173.57 2a1d s PRO 37 N 0.93 4.44 -0.46 5.44 0.04 -1.26 -5.01 135.00 139.12 2a1d s PRO 37 Ca -0.07 1.95 -0.44 0.00 0.04 0.00 0.00 61.00 62.48 2a1d s PRO 37 Cb -0.10 -3.23 -0.18 0.00 0.04 0.00 0.00 34.50 31.04 2a1d s PRO 37 CO -0.04 -0.18 1.92 1.04 0.04 0.00 0.00 177.00 179.78 2a1d n GLN 38 N 2.69 0.27 -3.67 4.56 6.02 -0.91 -4.85 117.38 121.49 2a1d n GLN 38 Ca 0.06 0.09 -0.12 0.00 -0.01 0.00 0.00 57.00 57.01 2a1d n GLN 38 Cb 0.44 -1.68 -0.08 0.00 1.02 0.00 0.00 30.24 29.93 2a1d n GLN 38 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2a1d s GLU 39 N 4.75 0.68 -0.07 -1.09 2.12 -1.14 -5.01 118.70 118.95 2a1d s GLU 39 Ca 1.11 0.91 -0.30 0.00 0.36 0.00 0.00 54.97 57.06 2a1d s GLU 39 Cb -1.37 0.27 -0.03 0.00 0.26 0.00 0.00 34.13 33.25 2a1d s GLU 39 CO 0.69 -0.10 1.20 -1.17 -0.54 0.00 0.00 175.26 175.34 2a1d s LEU 40 N 0.68 4.27 -0.19 2.70 2.96 -1.26 -0.02 118.68 127.83 2a1d s LEU 40 Ca -0.03 1.80 -0.16 0.00 -0.22 0.00 0.00 54.13 55.52 2a1d s LEU 40 Cb -0.05 -3.56 -0.07 0.00 0.50 0.00 0.00 46.19 43.02 2a1d s LEU 40 CO -0.05 -0.60 -0.30 0.18 -1.32 0.00 0.00 176.35 174.27 2a1d n LEU 41 N 5.34 1.92 -3.83 -0.68 4.77 -0.29 -4.91 117.00 119.31 2a1d n LEU 41 Ca 0.11 0.39 -0.09 0.00 -0.03 0.00 0.00 56.01 56.40 2a1d n LEU 41 Cb 0.46 -0.79 0.01 0.00 -2.33 0.00 0.00 43.42 40.78 2a1d n LEU 41 CO 0.55 -0.16 0.50 0.00 -1.33 0.00 0.00 177.39 176.95 2a1d n GLY 43 N -0.52 0.27 0.00 0.00 0.00 -1.24 0.46 105.19 104.17 2a1d n GLY 43 Ca -0.07 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.01 2a1d n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a1d n ALA 44 N -3.06 0.00 -3.71 4.61 0.00 -0.78 -3.09 120.51 114.47 2a1d n ALA 44 Ca -0.10 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.22 2a1d n ALA 44 Cb 0.34 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.67 2a1d n ALA 44 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2a1d s SER 45 N -0.62 -0.22 -0.18 0.00 0.15 0.71 -3.12 113.70 110.42 2a1d s SER 45 Ca 0.00 0.60 -0.20 0.00 0.70 0.00 0.00 55.95 57.05 2a1d s SER 45 Cb 0.00 0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 64.79 2a1d s SER 45 CO 0.00 -0.18 0.57 -0.22 1.20 0.00 0.00 173.24 174.61 2a1d s LEU 46 N 1.45 4.17 0.00 3.45 2.96 0.32 0.23 118.68 131.27 2a1d s LEU 46 Ca -0.08 0.78 0.07 0.00 -0.22 0.00 0.00 54.13 54.69 2a1d s LEU 46 Cb -0.10 -2.80 0.04 0.00 0.50 0.00 0.00 46.19 43.83 2a1d s LEU 46 CO -0.09 -0.19 0.68 2.30 -1.32 0.00 0.00 176.35 177.72 2a1d n ILE 47 N 4.46 0.00 0.00 6.68 -5.35 -0.04 -1.46 119.36 123.65 2a1d n ILE 47 Ca -0.03 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 2a1d n ILE 47 Cb 0.50 1.14 0.00 0.00 -1.74 0.00 0.00 39.64 39.54 2a1d n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2a1d n SER 48 N 0.23 3.59 -0.15 7.28 3.41 -1.19 -4.61 113.62 122.18 2a1d n SER 48 Ca 0.04 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.67 2a1d n SER 48 Cb 0.17 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 2a1d n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2a1d n ASP 49 N 0.00 2.26 0.00 4.04 5.75 -1.26 -4.54 116.55 122.80 2a1d n ASP 49 Ca 0.00 -2.13 0.00 0.00 -0.01 0.00 0.00 54.79 52.65 2a1d n ASP 49 Cb 0.00 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 2a1d n ASP 49 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2a1d n ARG 50 N -0.40 0.00 -5.07 0.11 1.85 -1.26 -1.76 116.66 110.12 2a1d n ARG 50 Ca 0.04 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.57 2a1d n ARG 50 Cb 0.34 -0.06 -0.16 0.00 -1.05 0.00 0.00 32.46 31.53 2a1d n ARG 50 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 2a1d s TRP 51 N 0.00 2.62 -0.02 2.89 0.52 -1.26 -1.04 118.94 122.65 2a1d s TRP 51 Ca 0.00 -0.81 0.03 0.00 0.02 0.00 0.00 56.10 55.34 2a1d s TRP 51 Cb 0.00 -1.73 -0.00 0.00 -1.15 0.00 0.00 33.47 30.59 2a1d s TRP 51 CO 0.00 -0.28 -0.12 0.54 0.02 0.00 0.00 176.95 177.11 2a1d s VAL 52 N 0.19 1.00 -0.15 4.03 0.11 -0.37 -0.86 120.40 124.34 2a1d s VAL 52 Ca -0.12 -0.50 -0.04 0.00 -2.93 0.00 0.00 61.98 58.39 2a1d s VAL 52 Cb -0.16 -0.86 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 2a1d s VAL 52 CO 0.07 0.29 -0.02 -0.22 -3.33 0.00 0.00 175.10 171.89 2a1d s LEU 53 N -0.03 3.34 0.22 2.54 2.96 0.64 -0.25 118.68 128.10 2a1d s LEU 53 Ca -0.00 -0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.76 2a1d s LEU 53 Cb -0.08 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 2a1d s LEU 53 CO 0.00 0.18 0.27 0.28 -1.32 0.00 0.00 176.35 175.77 2a1d s THR 54 N 0.29 0.00 -0.27 3.68 -1.32 0.65 -0.20 115.64 118.47 2a1d s THR 54 Ca -0.02 -1.76 -0.29 0.00 -1.21 0.00 0.00 61.69 58.41 2a1d s THR 54 Cb -0.14 -2.38 -0.03 0.00 -1.51 0.00 0.00 72.50 68.45 2a1d s THR 54 CO 0.03 0.00 1.77 0.00 -2.21 0.00 0.00 174.62 174.21 2a1d s ALA 55 N -4.10 3.03 0.29 11.08 0.00 -1.25 0.20 121.76 131.01 2a1d s ALA 55 Ca 0.32 0.42 0.17 0.00 0.00 0.00 0.00 51.96 52.87 2a1d s ALA 55 Cb 0.04 -3.95 1.06 0.00 0.00 0.00 0.00 23.12 20.27 2a1d s ALA 55 CO 0.11 -2.35 1.24 0.00 0.00 0.00 0.00 175.76 174.75 2a1d n ALA 56 N 9.61 0.81 1.07 0.00 0.00 -1.23 0.23 120.51 131.02 2a1d n ALA 56 Ca 0.22 0.80 0.13 0.00 0.00 0.00 0.00 53.44 54.58 2a1d n ALA 56 Cb 0.46 -0.80 0.61 0.00 0.00 0.00 0.00 19.45 19.71 2a1d n ALA 56 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2a1d n HIS 57 N -4.76 0.00 0.21 0.00 1.44 -1.26 -3.07 115.22 107.79 2a1d n HIS 57 Ca 0.30 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 56.07 2a1d n HIS 57 Cb 1.02 -0.38 0.47 0.00 0.12 0.00 0.00 29.99 31.21 2a1d n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2a1d n LEU 59 N -3.88 1.86 -4.36 0.00 4.77 -1.17 -4.89 117.00 109.33 2a1d n LEU 59 Ca -0.02 0.49 -0.32 0.00 -0.03 0.00 0.00 56.01 56.13 2a1d n LEU 59 Cb 0.36 -0.89 -0.15 0.00 -2.33 0.00 0.00 43.42 40.42 2a1d n LEU 59 CO 0.36 -0.04 -0.49 -0.22 -1.33 0.00 0.00 177.39 175.66 2a1d s LEU 60 N -7.97 2.48 -0.04 2.23 0.20 -1.19 -1.17 118.68 113.23 2a1d s LEU 60 Ca -0.25 -0.36 -0.31 0.00 0.69 0.00 0.00 54.13 53.91 2a1d s LEU 60 Cb 0.05 -1.51 0.11 0.00 -0.43 0.00 0.00 46.19 44.42 2a1d s LEU 60 CO 0.42 0.25 1.10 -0.47 -0.29 0.00 0.00 176.35 177.36 2a1d s TYR 60 N -0.16 -0.16 0.00 5.38 5.04 0.66 -4.11 117.35 124.00 2a1d s TYR 60 Ca -0.02 0.03 0.00 0.00 -2.44 0.00 0.00 57.07 54.64 2a1d s TYR 60 Cb -0.14 0.55 0.00 0.00 0.35 0.00 0.00 41.96 42.72 2a1d s TYR 60 CO 0.04 -0.42 0.00 -2.30 -1.34 0.00 0.00 175.55 171.53 2a1d n PRO 60 N -0.30 0.00 -1.01 4.97 -0.02 -1.26 -2.74 135.00 134.64 2a1d n PRO 60 Ca -0.05 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.32 2a1d n PRO 60 Cb 0.61 0.00 0.25 0.00 -0.02 0.00 0.00 33.50 34.33 2a1d n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2a1d n TRP 60 N 0.00 2.48 -2.33 6.00 8.01 -1.26 -4.89 117.44 125.44 2a1d n TRP 60 Ca 0.00 -1.32 -0.13 0.00 -1.31 0.00 0.00 57.50 54.74 2a1d n TRP 60 Cb 0.00 -0.73 -0.01 0.00 -2.01 0.00 0.00 31.31 28.56 2a1d n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 2a1d n ASP 60 N -0.39 -3.92 -4.73 -0.99 8.00 -1.23 -4.91 116.55 108.38 2a1d n ASP 60 Ca 0.44 0.20 -0.38 0.00 0.71 0.00 0.00 54.79 55.76 2a1d n ASP 60 Cb 1.41 -3.36 -0.06 0.00 -0.02 0.00 0.00 41.12 39.09 2a1d n ASP 60 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2a1d s LYS 60 N -4.83 4.31 -0.35 -1.24 1.02 -1.11 -4.98 119.74 112.56 2a1d s LYS 60 Ca 0.00 0.46 -0.06 0.00 0.02 0.00 0.00 55.97 56.39 2a1d s LYS 60 Cb 0.00 -3.42 0.20 0.00 -0.52 0.00 0.00 37.83 34.10 2a1d s LYS 60 CO 0.00 0.21 1.04 1.21 -0.92 0.00 0.00 175.35 176.89 2a1d s ASN 60 N 0.46 -0.42 0.60 2.83 2.47 -1.09 -0.25 114.94 119.55 2a1d s ASN 60 Ca 0.26 -0.41 -0.03 0.00 0.42 0.00 0.00 52.86 53.09 2a1d s ASN 60 Cb -0.15 0.55 0.03 0.00 -1.45 0.00 0.00 41.25 40.22 2a1d s ASN 60 CO 0.11 -0.02 0.87 -0.36 -3.72 0.00 0.00 177.10 173.98 2a1d s PHE 60 N 1.26 3.04 0.20 0.43 0.08 -0.31 -4.98 117.98 117.70 2a1d s PHE 60 Ca 0.21 0.35 -0.02 0.00 0.12 0.00 0.00 56.93 57.59 2a1d s PHE 60 Cb 0.09 -2.83 -0.04 0.00 -0.57 0.00 0.00 43.02 39.67 2a1d s PHE 60 CO -0.11 -0.96 0.17 0.95 -0.10 0.00 0.00 175.22 175.17 2a1d s THR 60 N -2.95 0.00 0.32 0.64 -4.23 -1.26 -4.82 115.64 103.34 2a1d s THR 60 Ca 0.56 -1.92 0.04 0.00 -1.18 0.00 0.00 61.69 59.18 2a1d s THR 60 Cb -0.10 -2.45 0.41 0.00 1.34 0.00 0.00 72.50 71.70 2a1d s THR 60 CO 0.42 -0.02 1.57 -0.37 -0.54 0.00 0.00 174.62 175.69 2a1d h VAL 61 N 2.58 0.00 -0.12 2.29 -1.51 -1.90 -0.21 116.25 117.38 2a1d h VAL 61 Ca -0.35 -0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.11 2a1d h VAL 61 Cb 1.25 0.00 -0.00 0.00 -2.13 0.00 0.00 31.29 30.40 2a1d h VAL 61 CO 0.51 0.00 0.02 0.44 -1.23 0.00 0.00 177.57 177.31 2a1d h ASP 62 N 0.00 0.19 -0.49 4.19 3.32 -1.96 -3.21 116.42 118.46 2a1d h ASP 62 Ca 0.63 -0.25 0.14 0.00 0.02 0.00 0.00 57.03 57.57 2a1d h ASP 62 Cb 1.34 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.82 2a1d h ASP 62 CO -0.92 0.39 0.54 0.44 -1.72 0.00 0.00 179.24 177.97 2a1d h ASP 63 N -0.02 0.00 -4.08 6.45 3.45 -1.42 -3.45 116.42 117.34 2a1d h ASP 63 Ca 0.04 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 57.16 2a1d h ASP 63 Cb 0.28 0.00 -0.09 0.00 -0.56 0.00 0.00 39.33 38.96 2a1d h ASP 63 CO 0.00 0.00 -0.29 0.00 -1.57 0.00 0.00 179.24 177.38 2a1d n LEU 64 N -3.65 0.00 -3.64 1.55 -0.00 -1.19 -1.75 117.00 108.32 2a1d n LEU 64 Ca 0.09 -2.54 -0.09 0.00 -0.00 0.00 0.00 56.01 53.48 2a1d n LEU 64 Cb 0.73 1.67 -0.07 0.00 -0.00 0.00 0.00 43.42 45.75 2a1d n LEU 64 CO 0.27 -0.48 0.49 -1.48 -0.00 0.00 0.00 177.39 176.19 2a1d s LEU 65 N 0.00 -0.73 0.66 1.47 0.05 -0.50 -4.53 118.68 115.10 2a1d s LEU 65 Ca 0.30 1.27 -0.08 0.00 0.05 0.00 0.00 54.13 55.67 2a1d s LEU 65 Cb 0.01 2.22 0.02 0.00 -2.05 0.00 0.00 46.19 46.39 2a1d s LEU 65 CO 0.21 -0.21 1.00 0.68 -0.55 0.00 0.00 176.35 177.49 2a1d s VAL 66 N 0.98 3.28 -0.23 1.48 -7.23 -1.00 -2.61 120.40 115.07 2a1d s VAL 66 Ca -0.05 0.12 -0.03 0.00 -1.81 0.00 0.00 61.98 60.21 2a1d s VAL 66 Cb -0.05 -3.36 0.10 0.00 0.56 0.00 0.00 36.38 33.63 2a1d s VAL 66 CO -0.11 -0.42 0.20 -0.13 -0.31 0.00 0.00 175.10 174.33 2a1d s ARG 67 N -5.19 0.19 0.26 4.82 1.81 -0.93 -2.32 118.95 117.59 2a1d s ARG 67 Ca 0.57 -0.03 0.03 0.00 -1.72 0.00 0.00 55.73 54.58 2a1d s ARG 67 Cb -0.11 -1.21 -0.03 0.00 -0.45 0.00 0.00 34.95 33.15 2a1d s ARG 67 CO 0.48 -0.79 0.41 0.42 -0.68 0.00 0.00 175.30 175.14 2a1d s ILE 68 N 2.26 5.22 -0.39 1.52 1.09 -0.90 -2.87 121.20 127.14 2a1d s ILE 68 Ca 0.07 -0.80 -0.11 0.00 -1.10 0.00 0.00 60.65 58.71 2a1d s ILE 68 Cb -0.15 -3.85 0.01 0.00 -1.06 0.00 0.00 42.46 37.41 2a1d s ILE 68 CO -0.19 -0.37 0.51 0.61 -0.10 0.00 0.00 174.94 175.39 2a1d n GLY 69 N -1.41 -1.19 0.00 6.18 0.00 -1.25 -2.50 105.19 105.02 2a1d n GLY 69 Ca -0.08 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.87 2a1d n GLY 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2a1d n LYS 70 N -0.53 0.47 0.01 1.61 5.02 -1.26 -3.32 118.16 120.15 2a1d n LYS 70 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2a1d n LYS 70 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.41 2a1d n LYS 70 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2a1d n HIS 71 N 0.00 -1.19 -3.22 2.13 -0.00 -1.26 -4.75 115.22 106.93 2a1d n HIS 71 Ca 0.00 0.04 -0.39 0.00 -0.00 0.00 0.00 57.72 57.37 2a1d n HIS 71 Cb 0.00 0.32 -0.06 0.00 -0.00 0.00 0.00 29.99 30.25 2a1d n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2a1d s SER 72 N -2.00 6.61 0.36 0.26 0.15 -1.26 0.03 113.70 117.85 2a1d s SER 72 Ca 0.00 0.73 0.19 0.00 0.70 0.00 0.00 55.95 57.58 2a1d s SER 72 Cb 0.00 -2.31 0.42 0.00 -1.71 0.00 0.00 66.02 62.42 2a1d s SER 72 CO 0.00 -0.18 1.61 0.08 1.20 0.00 0.00 173.24 175.95 2a1d h ARG 73 N 7.37 0.00 0.00 5.44 0.11 -1.05 -3.41 114.38 122.84 2a1d h ARG 73 Ca -0.34 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.74 2a1d h ARG 73 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 2a1d h ARG 73 CO 0.75 0.33 0.00 2.41 0.10 0.00 0.00 179.97 183.55 2a1d n THR 74 N -3.27 0.00 -1.34 0.08 -1.04 -1.26 -4.95 114.28 102.51 2a1d n THR 74 Ca 0.02 0.03 -0.33 0.00 -2.04 0.00 0.00 64.05 61.72 2a1d n THR 74 Cb 0.59 -0.60 0.10 0.00 -1.82 0.00 0.00 70.33 68.60 2a1d n THR 74 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2a1d s ARG 75 N 0.00 2.04 0.24 -2.82 1.81 -1.26 -5.00 118.95 113.95 2a1d s ARG 75 Ca 0.00 1.65 -0.30 0.00 -1.72 0.00 0.00 55.73 55.37 2a1d s ARG 75 Cb 0.00 -1.83 -0.09 0.00 -0.45 0.00 0.00 34.95 32.58 2a1d s ARG 75 CO 0.00 -1.89 1.07 -0.47 -0.68 0.00 0.00 175.30 173.33 2a1d s TYR 76 N -2.18 3.67 -0.78 -0.53 5.04 -1.26 -4.86 117.35 116.45 2a1d s TYR 76 Ca 0.72 1.72 0.03 0.00 -2.44 0.00 0.00 57.07 57.09 2a1d s TYR 76 Cb -0.27 -3.22 0.24 0.00 0.35 0.00 0.00 41.96 39.07 2a1d s TYR 76 CO 0.47 -0.35 0.85 0.39 -1.34 0.00 0.00 175.55 175.58 2a1d n GLU 77 N 1.61 2.81 -0.33 4.97 1.02 -1.26 -4.93 120.64 124.54 2a1d n GLU 77 Ca -0.00 -4.60 0.21 0.00 -0.02 0.00 0.00 57.16 52.75 2a1d n GLU 77 Cb 0.46 -2.34 0.43 0.00 -0.02 0.00 0.00 31.44 29.97 2a1d n GLU 77 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 2a1d h ARG 77 N 4.91 0.30 -0.73 3.49 0.11 -1.94 0.93 114.38 121.45 2a1d h ARG 77 Ca 0.19 -0.02 0.08 0.00 0.10 0.00 0.00 59.98 60.33 2a1d h ARG 77 Cb 0.69 -0.07 -0.07 0.00 1.11 0.00 0.00 29.97 31.64 2a1d h ARG 77 CO 0.92 0.20 0.40 0.87 0.10 0.00 0.00 179.97 182.45 2a1d h LYS 78 N 0.31 0.67 0.00 0.08 1.57 -2.01 -3.37 116.57 113.83 2a1d h LYS 78 Ca 0.69 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.42 2a1d h LYS 78 Cb 1.52 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.68 2a1d h LYS 78 CO -0.61 0.44 -1.02 1.33 -0.57 0.00 0.00 179.45 179.02 2a1d n VAL 79 N -4.80 0.02 -1.99 0.50 0.24 -0.46 -5.05 118.33 106.79 2a1d n VAL 79 Ca 0.11 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.34 61.98 2a1d n VAL 79 Cb 0.24 -0.97 -0.03 0.00 -1.47 0.00 0.00 33.84 31.61 2a1d n VAL 79 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2a1d s GLU 80 N -2.01 4.22 -0.12 7.34 2.12 0.31 -4.75 118.70 125.80 2a1d s GLU 80 Ca -0.00 2.26 0.02 0.00 0.36 0.00 0.00 54.97 57.61 2a1d s GLU 80 Cb 0.00 -3.54 -0.00 0.00 0.26 0.00 0.00 34.13 30.85 2a1d s GLU 80 CO 0.01 -0.68 -0.20 0.15 -0.54 0.00 0.00 175.26 173.99 2a1d s LYS 81 N 2.40 3.13 -0.19 4.30 -0.14 -1.04 -4.69 119.74 123.51 2a1d s LYS 81 Ca 0.71 -0.82 -0.07 0.00 -1.36 0.00 0.00 55.97 54.44 2a1d s LYS 81 Cb -0.39 -2.45 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 2a1d s LYS 81 CO 0.31 0.11 0.04 0.42 -0.76 0.00 0.00 175.35 175.47 2a1d s ILE 82 N 0.54 4.49 0.01 2.17 1.09 -1.26 -2.11 121.20 126.15 2a1d s ILE 82 Ca -0.12 -0.13 0.02 0.00 -1.10 0.00 0.00 60.65 59.32 2a1d s ILE 82 Cb -0.17 -3.03 -0.01 0.00 -1.06 0.00 0.00 42.46 38.19 2a1d s ILE 82 CO 0.04 0.44 -0.08 -0.55 -0.10 0.00 0.00 174.94 174.70 2a1d s SER 83 N 0.62 0.89 0.16 3.58 0.15 -0.98 -5.04 113.70 113.07 2a1d s SER 83 Ca 0.02 -0.29 -0.14 0.00 0.70 0.00 0.00 55.95 56.24 2a1d s SER 83 Cb -0.13 -0.05 -0.07 0.00 -1.71 0.00 0.00 66.02 64.06 2a1d s SER 83 CO 0.02 -0.01 0.55 -0.04 1.20 0.00 0.00 173.24 174.96 2a1d s MET 84 N -0.70 3.96 -0.02 5.44 -1.94 -1.26 -2.39 119.30 122.39 2a1d s MET 84 Ca -0.01 0.46 -0.27 0.00 -1.71 0.00 0.00 55.69 54.16 2a1d s MET 84 Cb -0.05 -2.89 -0.03 0.00 2.01 0.00 0.00 34.83 33.86 2a1d s MET 84 CO 0.00 0.45 0.86 -0.51 -0.01 0.00 0.00 175.02 175.82 2a1d s LEU 85 N -2.08 4.36 -0.01 -0.03 1.43 -1.26 0.88 118.68 121.97 2a1d s LEU 85 Ca 0.39 1.47 -0.00 0.00 -1.03 0.00 0.00 54.13 54.96 2a1d s LEU 85 Cb -0.14 -3.36 -0.00 0.00 0.03 0.00 0.00 46.19 42.71 2a1d s LEU 85 CO 0.19 -0.18 -0.00 -0.78 0.23 0.00 0.00 176.35 175.81 2a1d h ASP 86 N 6.68 0.00 -3.68 2.29 3.58 -0.31 -3.43 116.42 121.55 2a1d h ASP 86 Ca -0.41 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.50 2a1d h ASP 86 Cb 1.21 0.00 -0.19 0.00 1.72 0.00 0.00 39.33 42.07 2a1d h ASP 86 CO 0.75 0.03 -0.79 -0.75 -2.88 0.00 0.00 179.24 175.60 2a1d s LYS 87 N -1.04 1.25 -0.05 0.28 2.20 -1.20 -4.90 119.74 116.28 2a1d s LYS 87 Ca -0.00 -1.36 0.05 0.00 -0.36 0.00 0.00 55.97 54.30 2a1d s LYS 87 Cb 0.00 -1.37 -0.02 0.00 -1.51 0.00 0.00 37.83 34.93 2a1d s LYS 87 CO 0.00 0.29 -0.18 -1.50 -0.36 0.00 0.00 175.35 173.60 2a1d s ILE 88 N -1.83 2.72 -0.31 5.43 2.07 -1.26 -2.32 121.20 125.70 2a1d s ILE 88 Ca 0.14 -0.85 0.02 0.00 -1.41 0.00 0.00 60.65 58.55 2a1d s ILE 88 Cb -0.07 -2.04 0.09 0.00 0.13 0.00 0.00 42.46 40.58 2a1d s ILE 88 CO 0.06 0.58 0.03 -0.31 -1.91 0.00 0.00 174.94 173.40 2a1d s TYR 89 N -0.60 3.09 0.18 3.50 4.12 0.18 -4.99 117.35 122.84 2a1d s TYR 89 Ca 0.09 -2.51 0.03 0.00 0.02 0.00 0.00 57.07 54.70 2a1d s TYR 89 Cb -0.11 -2.40 -0.03 0.00 -1.52 0.00 0.00 41.96 37.89 2a1d s TYR 89 CO 0.01 -0.91 0.31 0.42 0.02 0.00 0.00 175.55 175.40 2a1d s ILE 90 N 1.14 5.30 0.16 2.71 1.09 -1.26 0.39 121.20 130.73 2a1d s ILE 90 Ca 0.07 -0.80 -0.30 0.00 -1.10 0.00 0.00 60.65 58.52 2a1d s ILE 90 Cb -0.19 -3.79 -0.07 0.00 -1.06 0.00 0.00 42.46 37.36 2a1d s ILE 90 CO -0.11 -0.18 1.05 -2.28 -0.10 0.00 0.00 174.94 173.31 2a1d s HIS 91 N -1.83 3.69 0.00 3.97 2.46 -1.20 -4.96 115.29 117.41 2a1d s HIS 91 Ca 0.34 1.68 0.00 0.00 0.47 0.00 0.00 55.06 57.55 2a1d s HIS 91 Cb -0.10 -3.19 0.00 0.00 -0.13 0.00 0.00 32.58 29.16 2a1d s HIS 91 CO 0.29 -0.29 0.89 -2.30 -2.47 0.00 0.00 174.74 170.86 2a1d n PRO 92 N 2.50 0.00 -0.01 2.88 -0.02 -1.26 -2.38 135.00 136.71 2a1d n PRO 92 Ca 0.02 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2a1d n PRO 92 Cb 0.47 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 2a1d n PRO 92 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2a1d n ARG 93 N -1.85 0.16 -2.68 -0.52 1.74 -1.26 -4.75 116.66 107.48 2a1d n ARG 93 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 2a1d n ARG 93 Cb 0.00 -1.42 -0.02 0.00 -1.02 0.00 0.00 32.46 30.00 2a1d n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2a1d s TYR 94 N 0.93 3.34 -0.40 -1.55 5.04 -1.00 -4.48 117.35 119.23 2a1d s TYR 94 Ca 0.00 1.43 -0.07 0.00 -2.44 0.00 0.00 57.07 55.99 2a1d s TYR 94 Cb 0.00 -3.25 0.08 0.00 0.35 0.00 0.00 41.96 39.14 2a1d s TYR 94 CO 0.00 -0.47 0.21 1.21 -1.34 0.00 0.00 175.55 175.16 2a1d s ASN 95 N 1.22 5.46 -0.20 4.32 2.47 -0.32 -4.90 114.94 122.99 2a1d s ASN 95 Ca 0.43 -1.58 0.09 0.00 0.42 0.00 0.00 52.86 52.22 2a1d s ASN 95 Cb -0.15 -1.92 -0.18 0.00 -1.45 0.00 0.00 41.25 37.55 2a1d s ASN 95 CO 0.06 -0.50 -0.06 -2.67 -3.72 0.00 0.00 177.10 170.21 2a1d n TRP 96 N 4.81 0.00 -0.42 0.43 4.27 -1.26 0.20 117.44 125.48 2a1d n TRP 96 Ca -0.09 0.00 0.34 0.00 -3.89 0.00 0.00 57.50 53.86 2a1d n TRP 96 Cb 0.43 -0.86 0.63 0.00 -1.36 0.00 0.00 31.31 30.14 2a1d n TRP 96 CO 0.00 0.00 0.00 0.87 -2.29 0.00 0.00 177.69 176.27 2a1d h LYS 97 N 0.00 0.15 0.00 -2.67 1.57 -2.01 -3.33 116.57 110.28 2a1d h LYS 97 Ca -0.49 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.26 2a1d h LYS 97 Cb 1.94 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 34.21 2a1d h LYS 97 CO -0.02 0.10 -0.53 -1.91 -0.57 0.00 0.00 179.45 176.52 2a1d n GLU 97 N -4.59 0.08 -0.49 3.15 2.13 -1.26 -5.03 120.64 114.63 2a1d n GLU 97 Ca 0.33 0.03 0.00 0.00 0.66 0.00 0.00 57.16 58.19 2a1d n GLU 97 Cb 1.30 -0.64 0.00 0.00 0.27 0.00 0.00 31.44 32.37 2a1d n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2a1d n ASN 98 N -3.48 0.00 -3.28 4.31 6.94 -1.22 -4.96 115.26 113.57 2a1d n ASN 98 Ca -0.04 -1.69 -0.16 0.00 -0.02 0.00 0.00 54.58 52.67 2a1d n ASN 98 Cb 0.25 -0.14 0.07 0.00 -2.36 0.00 0.00 39.78 37.60 2a1d n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2a1d n LEU 99 N 0.00 -5.47 -4.87 -4.53 4.77 0.53 -4.98 117.00 102.46 2a1d n LEU 99 Ca 0.00 -0.72 -0.34 0.00 -0.03 0.00 0.00 56.01 54.92 2a1d n LEU 99 Cb 0.64 -3.17 -0.05 0.00 -2.33 0.00 0.00 43.42 38.50 2a1d n LEU 99 CO 0.00 0.13 0.06 -0.62 -1.33 0.00 0.00 177.39 175.62 2a1d s ASP 100 N -3.42 6.60 -1.48 -1.43 2.15 -0.50 -4.03 116.67 114.57 2a1d s ASP 100 Ca 0.45 0.74 -0.12 0.00 0.43 0.00 0.00 52.55 54.05 2a1d s ASP 100 Cb -0.06 -2.16 0.06 0.00 -0.30 0.00 0.00 42.92 40.46 2a1d s ASP 100 CO 0.75 0.16 0.95 0.54 -0.17 0.00 0.00 175.17 177.39 2a1d n ARG 101 N 0.80 -5.82 -2.08 4.34 5.12 -1.26 -1.17 116.66 116.58 2a1d n ARG 101 Ca -0.07 0.67 -0.39 0.00 -1.93 0.00 0.00 57.85 56.13 2a1d n ARG 101 Cb 0.52 -5.58 -0.03 0.00 -1.16 0.00 0.00 32.46 26.22 2a1d n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2a1d n ASP 102 N -2.79 3.89 -3.76 0.55 2.03 -1.26 -4.57 116.55 110.64 2a1d n ASP 102 Ca 0.02 -2.81 -0.13 0.00 0.52 0.00 0.00 54.79 52.38 2a1d n ASP 102 Cb 0.54 -1.64 -0.09 0.00 -0.72 0.00 0.00 41.12 39.21 2a1d n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2a1d s ILE 103 N 6.05 0.05 -0.06 5.18 2.07 -1.26 -3.47 121.20 129.75 2a1d s ILE 103 Ca 0.57 -0.39 -0.11 0.00 -1.41 0.00 0.00 60.65 59.31 2a1d s ILE 103 Cb 0.06 -0.58 0.02 0.00 0.13 0.00 0.00 42.46 42.09 2a1d s ILE 103 CO 0.07 -0.21 0.27 0.00 -1.91 0.00 0.00 174.94 173.16 2a1d s ALA 104 N -1.04 -0.67 -0.12 1.50 0.00 0.53 -3.25 121.76 118.71 2a1d s ALA 104 Ca -0.11 0.51 -0.03 0.00 0.00 0.00 0.00 51.96 52.33 2a1d s ALA 104 Cb -0.05 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.84 2a1d s ALA 104 CO 0.03 -0.19 -0.02 -0.51 0.00 0.00 0.00 175.76 175.08 2a1d s LEU 105 N -0.56 3.40 -0.12 0.00 1.02 0.16 -0.26 118.68 122.33 2a1d s LEU 105 Ca -0.07 0.01 0.03 0.00 0.02 0.00 0.00 54.13 54.12 2a1d s LEU 105 Cb -0.04 -1.79 0.01 0.00 0.02 0.00 0.00 46.19 44.39 2a1d s LEU 105 CO 0.02 0.28 -0.20 -0.76 0.02 0.00 0.00 176.35 175.70 2a1d s LEU 106 N -0.29 1.99 -0.44 1.79 1.43 0.66 0.48 118.68 124.31 2a1d s LEU 106 Ca 0.05 -0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 52.51 2a1d s LEU 106 Cb -0.12 -1.32 0.08 0.00 0.03 0.00 0.00 46.19 44.85 2a1d s LEU 106 CO 0.02 0.08 0.30 -0.75 0.23 0.00 0.00 176.35 176.23 2a1d s LYS 107 N 0.73 2.68 0.15 1.70 2.36 -0.98 -1.24 119.74 125.14 2a1d s LYS 107 Ca -0.10 -1.47 -0.34 0.00 -2.55 0.00 0.00 55.97 51.50 2a1d s LYS 107 Cb -0.16 -3.88 -0.15 0.00 -1.05 0.00 0.00 37.83 32.60 2a1d s LYS 107 CO 0.01 -1.00 1.50 1.28 1.55 0.00 0.00 175.35 178.69 2a1d n LEU 108 N 4.98 2.71 -0.22 5.43 4.32 -0.21 0.39 117.00 134.40 2a1d n LEU 108 Ca -0.10 1.10 0.26 0.00 -0.02 0.00 0.00 56.01 57.24 2a1d n LEU 108 Cb 0.43 -1.36 0.65 0.00 -1.62 0.00 0.00 43.42 41.51 2a1d n LEU 108 CO 0.41 -0.51 1.25 0.50 -1.22 0.00 0.00 177.39 177.83 2a1d h LYS 109 N 5.43 0.14 -3.33 3.23 1.63 0.22 -3.40 116.57 120.50 2a1d h LYS 109 Ca -0.46 -0.01 -0.23 0.00 -0.85 0.00 0.00 60.65 59.10 2a1d h LYS 109 Cb 1.28 -0.03 -0.30 0.00 -0.60 0.00 0.00 32.23 32.57 2a1d h LYS 109 CO 0.85 0.10 -0.60 -0.98 -3.45 0.00 0.00 179.45 175.37 2a1d s ARG 110 N -5.15 0.10 0.23 1.90 1.70 -1.26 -4.93 118.95 111.55 2a1d s ARG 110 Ca -0.06 0.30 -0.31 0.00 -0.47 0.00 0.00 55.73 55.18 2a1d s ARG 110 Cb 0.22 -0.10 -0.11 0.00 -0.57 0.00 0.00 34.95 34.39 2a1d s ARG 110 CO 0.78 -0.12 1.61 -1.25 -1.08 0.00 0.00 175.30 175.24 2a1d s PRO 111 N 0.81 4.16 0.34 3.89 0.04 -1.26 -4.93 135.00 138.05 2a1d s PRO 111 Ca -0.06 2.50 -0.05 0.00 0.04 0.00 0.00 61.00 63.43 2a1d s PRO 111 Cb -0.08 -3.08 -0.05 0.00 0.04 0.00 0.00 34.50 31.33 2a1d s PRO 111 CO -0.04 -0.64 0.61 0.96 0.04 0.00 0.00 177.00 177.94 2a1d s ILE 112 N 0.62 4.99 -0.24 0.56 -4.36 -0.72 -5.03 121.20 117.01 2a1d s ILE 112 Ca 0.68 0.08 -0.20 0.00 -0.26 0.00 0.00 60.65 60.94 2a1d s ILE 112 Cb -0.47 -3.77 -0.02 0.00 1.25 0.00 0.00 42.46 39.46 2a1d s ILE 112 CO 0.39 -0.45 0.63 -1.83 0.24 0.00 0.00 174.94 173.91 2a1d s GLU 113 N -3.84 4.13 0.04 0.37 -1.05 -1.26 -4.89 118.70 112.20 2a1d s GLU 113 Ca 0.45 0.56 -0.30 0.00 -0.15 0.00 0.00 54.97 55.52 2a1d s GLU 113 Cb -0.10 -3.63 -0.06 0.00 -0.44 0.00 0.00 34.13 29.90 2a1d s GLU 113 CO 0.33 -0.37 1.24 -0.51 0.95 0.00 0.00 175.26 176.89 2a1d s LEU 114 N 2.38 4.35 0.00 1.83 1.43 -1.26 -4.91 118.68 122.49 2a1d s LEU 114 Ca 0.26 2.03 0.01 0.00 -1.03 0.00 0.00 54.13 55.41 2a1d s LEU 114 Cb -0.16 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.50 2a1d s LEU 114 CO 0.09 -0.53 0.09 -1.54 0.23 0.00 0.00 176.35 174.69 2a1d n SER 115 N 4.28 2.17 0.00 2.29 3.41 -1.26 -4.93 113.62 119.59 2a1d n SER 115 Ca 0.10 -1.90 0.02 0.00 -0.26 0.00 0.00 58.87 56.84 2a1d n SER 115 Cb 0.46 0.07 0.14 0.00 -0.26 0.00 0.00 64.21 64.61 2a1d n SER 115 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2a1d n ASP 116 N -1.55 0.00 0.00 4.04 8.00 -1.26 -2.25 116.55 123.53 2a1d n ASP 116 Ca -0.05 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 54.82 2a1d n ASP 116 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2a1d n ASP 116 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2a1d n TYR 117 N -0.69 0.00 -3.19 1.24 4.01 -1.26 -4.86 117.16 112.42 2a1d n TYR 117 Ca 0.03 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.52 2a1d n TYR 117 Cb 0.02 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 38.99 2a1d n TYR 117 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2a1d n ILE 118 N -0.41 1.80 -4.18 -0.72 -0.00 -0.95 -3.90 119.36 111.00 2a1d n ILE 118 Ca 0.00 -5.08 -0.33 0.00 -0.00 0.00 0.00 62.75 57.34 2a1d n ILE 118 Cb 0.03 -1.57 -0.08 0.00 -0.00 0.00 0.00 39.64 38.02 2a1d n ILE 118 CO 0.00 0.00 0.00 -2.28 -0.00 0.00 0.00 176.55 174.27 2a1d s HIS 119 N -2.63 3.19 0.73 1.39 2.46 -1.26 -3.99 115.29 115.18 2a1d s HIS 119 Ca 0.42 0.15 -0.12 0.00 0.47 0.00 0.00 55.06 55.98 2a1d s HIS 119 Cb 0.23 -1.70 0.03 0.00 -0.13 0.00 0.00 32.58 31.00 2a1d s HIS 119 CO -0.08 0.51 1.11 -1.25 -2.47 0.00 0.00 174.74 172.56 2a1d s PRO 120 N -1.68 2.68 0.36 2.88 0.04 -1.26 -0.30 135.00 137.72 2a1d s PRO 120 Ca 0.22 0.39 0.08 0.00 0.04 0.00 0.00 61.00 61.73 2a1d s PRO 120 Cb -0.12 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2a1d s PRO 120 CO 0.12 -1.15 0.26 0.54 0.04 0.00 0.00 177.00 176.81 2a1d s VAL 121 N -3.40 3.11 0.17 -0.36 0.11 -0.53 -4.78 120.40 114.72 2a1d s VAL 121 Ca 0.59 -1.48 0.02 0.00 -2.93 0.00 0.00 61.98 58.18 2a1d s VAL 121 Cb -0.11 -3.07 -0.04 0.00 -1.53 0.00 0.00 36.38 31.63 2a1d s VAL 121 CO 0.51 -0.13 0.31 0.00 -3.33 0.00 0.00 175.10 172.47 2a1d s LEU 123 N -3.38 4.36 0.47 0.00 1.43 -1.26 -0.36 118.68 119.94 2a1d s LEU 123 Ca 0.35 0.60 -0.17 0.00 -1.03 0.00 0.00 54.13 53.88 2a1d s LEU 123 Cb -0.11 -2.30 -0.14 0.00 0.03 0.00 0.00 46.19 43.68 2a1d s LEU 123 CO 0.29 0.29 -0.13 -0.81 0.23 0.00 0.00 176.35 176.22 2a1d n PRO 124 N 2.48 0.00 -4.19 1.29 -0.04 -1.26 -4.87 135.00 128.41 2a1d n PRO 124 Ca -0.16 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.98 2a1d n PRO 124 Cb 0.53 -0.92 -0.08 0.00 -0.04 0.00 0.00 33.50 32.99 2a1d n PRO 124 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2a1d s ASP 125 N -0.92 5.31 0.58 3.54 2.15 -1.26 -4.94 116.67 121.13 2a1d s ASP 125 Ca 0.52 0.01 0.31 0.00 0.43 0.00 0.00 52.55 53.83 2a1d s ASP 125 Cb -0.45 -1.42 1.40 0.00 -0.30 0.00 0.00 42.92 42.14 2a1d s ASP 125 CO 0.61 0.25 1.75 0.07 -0.17 0.00 0.00 175.17 177.68 2a1d h LYS 126 N 4.04 0.00 0.00 4.34 5.09 -1.99 -1.52 116.57 126.53 2a1d h LYS 126 Ca -0.49 0.00 -0.27 0.00 0.09 0.00 0.00 60.65 59.98 2a1d h LYS 126 Cb 1.17 0.00 -0.05 0.00 0.10 0.00 0.00 32.23 33.46 2a1d h LYS 126 CO 0.60 0.00 -2.04 0.94 -2.09 0.00 0.00 179.45 176.86 2a1d n GLN 127 N -3.76 0.47 -0.19 0.07 -0.06 -1.26 -4.32 117.38 108.32 2a1d n GLN 127 Ca 0.17 0.10 0.00 0.00 -2.00 0.00 0.00 57.00 55.28 2a1d n GLN 127 Cb 1.04 -1.37 0.00 0.00 -4.06 0.00 0.00 30.24 25.85 2a1d n GLN 127 CO 0.00 0.00 0.00 2.41 -0.20 0.00 0.00 177.06 179.27 2a1d n THR 128 N -3.03 0.78 0.00 1.69 -1.04 -0.57 -0.92 114.28 111.19 2a1d n THR 128 Ca -0.32 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.50 2a1d n THR 128 Cb 0.85 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 2a1d n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2a1d n ALA 129 N 1.77 0.00 -0.42 2.41 0.00 -1.26 -1.76 120.51 121.26 2a1d n ALA 129 Ca 0.00 0.00 0.34 0.00 0.00 0.00 0.00 53.44 53.78 2a1d n ALA 129 Cb 0.20 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.27 2a1d n ALA 129 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2a1d h LYS 129 N 0.00 0.11 0.00 0.00 1.79 -1.39 -3.16 116.57 113.92 2a1d h LYS 129 Ca 0.00 -0.01 -0.31 0.00 -2.18 0.00 0.00 60.65 58.16 2a1d h LYS 129 Cb 0.00 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.57 2a1d h LYS 129 CO 0.00 0.07 -2.16 1.28 -1.08 0.00 0.00 179.45 177.56 2a1d n LEU 129 N -4.79 2.95 -4.04 2.94 4.77 -0.72 -4.80 117.00 113.31 2a1d n LEU 129 Ca 0.36 -0.11 -0.39 0.00 -0.03 0.00 0.00 56.01 55.84 2a1d n LEU 129 Cb 1.35 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 41.70 2a1d n LEU 129 CO 0.18 0.84 2.03 0.18 -1.33 0.00 0.00 177.39 179.28 2a1d n LEU 130 N -3.09 4.40 -4.03 2.23 4.77 -1.19 -4.83 117.00 115.26 2a1d n LEU 130 Ca -0.36 -3.33 -0.24 0.00 -0.03 0.00 0.00 56.01 52.05 2a1d n LEU 130 Cb 0.89 -1.47 -0.16 0.00 -2.33 0.00 0.00 43.42 40.35 2a1d n LEU 130 CO 0.21 -0.44 -0.46 -1.00 -1.33 0.00 0.00 177.39 174.36 2a1d s HIS 131 N 6.25 1.34 -0.03 -1.77 3.76 -1.26 -4.89 115.29 118.69 2a1d s HIS 131 Ca 0.58 -0.43 -0.38 0.00 -0.15 0.00 0.00 55.06 54.68 2a1d s HIS 131 Cb 0.09 -0.97 -0.17 0.00 1.11 0.00 0.00 32.58 32.64 2a1d s HIS 131 CO 0.08 -0.21 1.43 0.00 -0.85 0.00 0.00 174.74 175.20 2a1d n ALA 132 N 3.58 -1.00 0.00 -1.40 0.00 -1.26 -1.60 120.51 118.83 2a1d n ALA 132 Ca -0.21 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2a1d n ALA 132 Cb 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.89 2a1d n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a1d n GLY 133 N 2.92 3.16 3.77 0.00 0.00 -0.57 -4.96 105.19 109.51 2a1d n GLY 133 Ca 0.21 -1.12 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 2a1d n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a1d s PHE 134 N 0.00 2.91 -0.13 1.61 0.08 -0.63 -4.54 117.98 117.29 2a1d s PHE 134 Ca 0.00 1.49 -0.09 0.00 0.12 0.00 0.00 56.93 58.44 2a1d s PHE 134 Cb 0.00 -3.53 -0.04 0.00 -0.57 0.00 0.00 43.02 38.88 2a1d s PHE 134 CO 0.00 -1.73 0.18 0.15 -0.10 0.00 0.00 175.22 173.72 2a1d s LYS 135 N -2.33 3.74 0.13 0.44 1.02 -1.26 -0.31 119.74 121.16 2a1d s LYS 135 Ca 0.58 -0.08 0.01 0.00 0.02 0.00 0.00 55.97 56.50 2a1d s LYS 135 Cb -0.34 -3.27 0.01 0.00 -0.52 0.00 0.00 37.83 33.71 2a1d s LYS 135 CO 0.43 0.61 0.08 0.41 -0.92 0.00 0.00 175.35 175.95 2a1d n GLY 136 N 2.46 3.19 3.00 -3.33 0.00 -0.35 -4.89 105.19 105.27 2a1d n GLY 136 Ca -0.18 -2.21 -0.24 0.00 0.00 0.00 0.00 46.02 43.39 2a1d n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2a1d s ARG 137 N -2.50 1.57 -0.07 1.61 3.52 0.49 -2.18 118.95 121.39 2a1d s ARG 137 Ca 0.06 -0.37 0.04 0.00 -0.13 0.00 0.00 55.73 55.33 2a1d s ARG 137 Cb -0.00 -1.33 -0.01 0.00 -1.56 0.00 0.00 34.95 32.04 2a1d s ARG 137 CO 0.04 0.00 -0.20 0.08 -0.81 0.00 0.00 175.30 174.41 2a1d s VAL 138 N 0.73 2.46 0.02 7.11 1.01 0.88 -0.46 120.40 132.15 2a1d s VAL 138 Ca -0.14 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 60.94 2a1d s VAL 138 Cb -0.16 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2a1d s VAL 138 CO 0.03 0.56 -0.05 0.42 0.00 0.00 0.00 175.10 176.06 2a1d s THR 139 N -0.15 0.34 0.00 3.92 -4.23 -1.23 -0.61 115.64 113.68 2a1d s THR 139 Ca -0.03 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.72 2a1d s THR 139 Cb -0.14 -0.40 0.00 0.00 1.34 0.00 0.00 72.50 73.30 2a1d s THR 139 CO 0.04 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 2a1d n GLY 140 N 1.95 -0.41 1.81 3.99 0.00 -0.95 -4.39 105.19 107.18 2a1d n GLY 140 Ca -0.20 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.57 2a1d n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2a1d n TRP 141 N -0.34 2.30 -1.81 1.61 8.01 -1.26 -2.11 117.44 123.85 2a1d n TRP 141 Ca 0.00 -2.21 -0.30 0.00 -1.31 0.00 0.00 57.50 53.68 2a1d n TRP 141 Cb 0.00 -0.67 0.21 0.00 -2.01 0.00 0.00 31.31 28.84 2a1d n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2a1d s GLY 142 N -2.80 1.78 -0.08 6.99 0.00 -1.13 -4.57 107.32 107.52 2a1d s GLY 142 Ca 0.52 -1.27 -0.38 0.00 0.00 0.00 0.00 44.72 43.59 2a1d s GLY 142 CO 0.01 -0.43 1.51 0.70 0.00 0.00 0.00 173.10 174.89 2a1d n ASN 143 N -4.00 1.93 0.32 1.64 5.03 -0.52 -2.76 115.26 116.90 2a1d n ASN 143 Ca 0.16 1.10 0.20 0.00 0.87 0.00 0.00 54.58 56.92 2a1d n ASN 143 Cb 0.59 -1.16 1.12 0.00 -1.02 0.00 0.00 39.78 39.31 2a1d n ASN 143 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 2a1d h ARG 144 N 5.68 0.00 -2.12 3.52 3.08 0.09 -3.12 114.38 121.51 2a1d h ARG 144 Ca -0.47 0.00 0.26 0.00 0.07 0.00 0.00 59.98 59.84 2a1d h ARG 144 Cb 1.33 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.31 2a1d h ARG 144 CO 0.86 0.00 0.74 0.50 -1.07 0.00 0.00 179.97 180.99 2a1d s ARG 145 N -4.30 0.77 0.08 0.04 3.52 -1.26 -4.17 118.95 113.63 2a1d s ARG 145 Ca -0.05 -0.48 -0.22 0.00 -0.13 0.00 0.00 55.73 54.85 2a1d s ARG 145 Cb 0.14 0.23 -0.07 0.00 -1.56 0.00 0.00 34.95 33.69 2a1d s ARG 145 CO 0.45 -0.36 0.67 -2.00 -0.81 0.00 0.00 175.30 173.25 2a1d s GLU 146 N -2.30 4.38 -0.05 5.12 2.12 -1.26 -5.01 118.70 121.69 2a1d s GLU 146 Ca 0.21 0.91 0.03 0.00 0.36 0.00 0.00 54.97 56.49 2a1d s GLU 146 Cb 0.00 -3.28 0.01 0.00 0.26 0.00 0.00 34.13 31.11 2a1d s GLU 146 CO 0.01 0.52 -0.13 0.95 -0.54 0.00 0.00 175.26 176.06 2a1d s THR 147 N -0.79 1.17 -0.86 -1.70 -4.23 -1.26 -5.13 115.64 102.84 2a1d s THR 147 Ca 0.33 -0.54 -0.24 0.00 -1.18 0.00 0.00 61.69 60.06 2a1d s THR 147 Cb -0.20 -1.04 -0.17 0.00 1.34 0.00 0.00 72.50 72.42 2a1d s THR 147 CO 0.21 0.35 1.90 -2.67 -0.54 0.00 0.00 174.62 173.88 2a1d n TRP 148 N 3.48 1.83 -1.61 3.99 4.27 -1.26 -4.98 117.44 123.17 2a1d n TRP 148 Ca -0.20 -1.32 0.00 0.00 -3.89 0.00 0.00 57.50 52.09 2a1d n TRP 148 Cb 0.53 -2.02 0.00 0.00 -1.36 0.00 0.00 31.31 28.45 2a1d n TRP 148 CO 0.00 0.00 0.00 -2.37 -2.29 0.00 0.00 177.69 173.03 2a1d n THR 149 N 7.17 0.00 -2.17 -1.67 5.66 -1.26 -5.07 114.28 116.94 2a1d n THR 149 Ca 0.47 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 61.27 2a1d n THR 149 Cb 0.44 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.19 2a1d n THR 149 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2a1d n SER 149 N 2.08 -5.46 -3.67 1.09 7.64 -1.26 -4.94 113.62 109.10 2a1d n SER 149 Ca 0.00 0.15 -0.11 0.00 1.01 0.00 0.00 58.87 59.92 2a1d n SER 149 Cb 0.00 -4.64 -0.08 0.00 -1.01 0.00 0.00 64.21 58.48 2a1d n SER 149 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2a1d s VAL 149 N -2.88 -0.01 -0.00 0.44 1.01 -1.26 -5.11 120.40 112.59 2a1d s VAL 149 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.00 2a1d s VAL 149 Cb 0.00 -0.83 -0.00 0.00 0.00 0.00 0.00 36.38 35.55 2a1d s VAL 149 CO 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 175.10 175.10 2a1d n ALA 149 N 3.54 0.91 -0.60 5.51 0.00 -1.26 -4.91 120.51 123.70 2a1d n ALA 149 Ca -0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.07 2a1d n ALA 149 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 2a1d n ALA 149 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2a1d n GLU 149 N -2.52 0.00 -1.67 0.00 0.00 -1.26 -4.47 120.64 110.72 2a1d n GLU 149 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 57.16 57.18 2a1d n GLU 149 Cb 0.00 -0.55 0.02 0.00 0.00 0.00 0.00 31.44 30.91 2a1d n GLU 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2a1d n VAL 150 N 2.57 0.19 -3.34 3.84 0.31 -1.26 -5.11 118.33 115.54 2a1d n VAL 150 Ca 0.06 -1.16 -0.21 0.00 -0.01 0.00 0.00 64.34 63.02 2a1d n VAL 150 Cb 0.25 0.98 -0.00 0.00 -0.91 0.00 0.00 33.84 34.16 2a1d n VAL 150 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2a1d s GLN 151 N -0.57 3.14 0.80 5.55 1.11 -1.26 0.74 119.66 129.16 2a1d s GLN 151 Ca 0.28 -0.77 -0.13 0.00 0.01 0.00 0.00 55.36 54.74 2a1d s GLN 151 Cb 0.33 -2.73 0.19 0.00 -1.01 0.00 0.00 33.01 29.80 2a1d s GLN 151 CO -0.13 -0.02 0.80 -0.35 0.01 0.00 0.00 175.29 175.60 2a1d n PRO 152 N -1.78 -2.05 -0.12 2.91 -0.04 -1.26 -4.84 135.00 127.82 2a1d n PRO 152 Ca -0.01 -1.26 -0.16 0.00 -0.04 0.00 0.00 63.50 62.04 2a1d n PRO 152 Cb 0.58 -1.07 -0.13 0.00 -0.04 0.00 0.00 33.50 32.84 2a1d n PRO 152 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2a1d n SER 153 N -4.10 1.59 -4.87 3.54 2.88 -1.26 -4.87 113.62 106.52 2a1d n SER 153 Ca 0.11 -0.10 -0.21 0.00 -1.33 0.00 0.00 58.87 57.34 2a1d n SER 153 Cb 0.40 -0.06 -0.03 0.00 -0.75 0.00 0.00 64.21 63.77 2a1d n SER 153 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2a1d s VAL 154 N -2.50 2.73 0.35 2.46 -7.23 -1.25 -0.38 120.40 114.57 2a1d s VAL 154 Ca -0.28 -1.35 -0.28 0.00 -1.81 0.00 0.00 61.98 58.26 2a1d s VAL 154 Cb 0.08 -3.01 -0.10 0.00 0.56 0.00 0.00 36.38 33.91 2a1d s VAL 154 CO 0.63 -0.01 1.28 -0.22 -0.31 0.00 0.00 175.10 176.47 2a1d s LEU 155 N -4.12 4.37 0.12 1.32 2.96 0.10 -4.86 118.68 118.58 2a1d s LEU 155 Ca 0.48 2.63 0.04 0.00 -0.22 0.00 0.00 54.13 57.06 2a1d s LEU 155 Cb -0.03 -3.73 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2a1d s LEU 155 CO 0.28 -0.58 0.10 -1.10 -1.32 0.00 0.00 176.35 173.72 2a1d s GLN 156 N -1.90 2.88 -0.04 1.98 -1.52 -0.89 0.18 119.66 120.34 2a1d s GLN 156 Ca 0.51 -0.77 -0.02 0.00 -1.95 0.00 0.00 55.36 53.13 2a1d s GLN 156 Cb -0.38 -2.69 0.03 0.00 -0.22 0.00 0.00 33.01 29.75 2a1d s GLN 156 CO 0.50 0.53 0.10 0.54 -0.25 0.00 0.00 175.29 176.71 2a1d s VAL 157 N -1.54 -0.04 -0.03 1.09 0.11 -0.51 -2.25 120.40 117.22 2a1d s VAL 157 Ca 0.30 0.16 -0.02 0.00 -2.93 0.00 0.00 61.98 59.49 2a1d s VAL 157 Cb -0.11 -0.17 0.02 0.00 -1.53 0.00 0.00 36.38 34.59 2a1d s VAL 157 CO 0.22 0.06 0.07 0.54 -3.33 0.00 0.00 175.10 172.67 2a1d s VAL 158 N 0.93 -0.03 -0.37 2.04 0.11 0.21 -3.21 120.40 120.09 2a1d s VAL 158 Ca -0.07 0.10 -0.12 0.00 -2.93 0.00 0.00 61.98 58.96 2a1d s VAL 158 Cb -0.10 -0.13 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 2a1d s VAL 158 CO -0.04 0.04 0.22 0.20 -3.33 0.00 0.00 175.10 172.19 2a1d s ASN 159 N 0.60 5.81 -0.13 3.54 0.01 -1.26 -0.08 114.94 123.42 2a1d s ASN 159 Ca -0.05 -0.83 -0.01 0.00 -0.71 0.00 0.00 52.86 51.26 2a1d s ASN 159 Cb -0.07 -2.06 -0.02 0.00 0.41 0.00 0.00 41.25 39.51 2a1d s ASN 159 CO -0.02 -0.35 -0.09 -0.76 -1.51 0.00 0.00 177.10 174.37 2a1d s LEU 160 N 1.61 2.95 0.49 0.60 1.43 -0.93 -4.83 118.68 119.99 2a1d s LEU 160 Ca 0.03 -0.23 -0.20 0.00 -1.03 0.00 0.00 54.13 52.70 2a1d s LEU 160 Cb -0.19 -1.68 -0.08 0.00 0.03 0.00 0.00 46.19 44.27 2a1d s LEU 160 CO 0.08 0.18 1.05 -2.16 0.23 0.00 0.00 176.35 175.73 2a1d s PRO 161 N 0.26 3.78 0.25 1.29 0.04 -1.26 -1.21 135.00 138.14 2a1d s PRO 161 Ca -0.07 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.07 2a1d s PRO 161 Cb -0.15 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 2a1d s PRO 161 CO 0.04 -0.45 0.99 -0.51 0.04 0.00 0.00 177.00 177.11 2a1d s LEU 162 N -3.47 4.62 0.06 -3.56 1.43 0.57 0.36 118.68 118.69 2a1d s LEU 162 Ca 0.67 2.04 0.02 0.00 -1.03 0.00 0.00 54.13 55.83 2a1d s LEU 162 Cb -0.17 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 2a1d s LEU 162 CO 0.21 0.07 0.10 -0.69 0.23 0.00 0.00 176.35 176.27 2a1d s VAL 163 N -1.17 4.71 0.12 -1.59 1.01 -0.67 -1.51 120.40 121.29 2a1d s VAL 163 Ca 0.42 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 2a1d s VAL 163 Cb -0.28 -3.24 -0.06 0.00 0.00 0.00 0.00 36.38 32.80 2a1d s VAL 163 CO 0.35 0.18 0.92 -1.83 0.00 0.00 0.00 175.10 174.72 2a1d s GLU 164 N -2.25 4.68 0.07 2.72 1.03 -1.26 -4.64 118.70 119.05 2a1d s GLU 164 Ca 0.29 1.39 -0.06 0.00 0.03 0.00 0.00 54.97 56.61 2a1d s GLU 164 Cb -0.12 -3.36 0.06 0.00 -0.80 0.00 0.00 34.13 29.90 2a1d s GLU 164 CO 0.21 0.27 0.47 -2.13 -1.33 0.00 0.00 175.26 172.75 2a1d n ARG 165 N 2.60 -0.08 -0.05 -4.83 3.00 -1.26 -1.46 116.66 114.58 2a1d n ARG 165 Ca 0.01 0.46 -0.08 0.00 -0.00 0.00 0.00 57.85 58.25 2a1d n ARG 165 Cb 0.49 -0.69 -0.05 0.00 0.00 0.00 0.00 32.46 32.21 2a1d n ARG 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 2a1d h PRO 166 N 0.00 -0.24 -0.15 -0.14 0.11 -2.00 -1.87 132.00 127.71 2a1d h PRO 166 Ca 0.10 0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.25 2a1d h PRO 166 Cb 0.17 0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.28 2a1d h PRO 166 CO -0.30 -0.16 -0.48 0.28 -0.21 0.00 0.00 178.00 177.14 2a1d h VAL 167 N -0.25 0.00 -0.87 3.15 2.07 -1.65 0.11 116.25 118.82 2a1d h VAL 167 Ca 0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 2a1d h VAL 167 Cb 0.33 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.00 2a1d h VAL 167 CO -0.28 0.00 -0.51 0.00 0.02 0.00 0.00 177.57 176.80 2a1d h LYS 169 N 0.00 0.58 -0.06 0.00 3.64 -0.84 -3.06 116.57 116.83 2a1d h LYS 169 Ca 0.14 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2a1d h LYS 169 Cb 0.36 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2a1d h LYS 169 CO -0.82 0.38 -0.11 0.00 -2.27 0.00 0.00 179.45 176.64 2a1d h ALA 170 N 1.28 -0.07 0.00 5.00 0.00 0.21 -2.78 119.26 122.90 2a1d h ALA 170 Ca 0.24 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2a1d h ALA 170 Cb 0.10 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2a1d h ALA 170 CO -0.14 -0.58 0.00 -1.13 0.00 0.00 0.00 179.25 177.40 2a1d n SER 171 N -5.24 0.19 -3.63 0.00 3.41 0.71 -4.73 113.62 104.32 2a1d n SER 171 Ca -0.04 -0.49 -0.11 0.00 -0.26 0.00 0.00 58.87 57.97 2a1d n SER 171 Cb 0.16 -0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 63.97 2a1d n SER 171 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2a1d s THR 172 N -1.21 0.07 -1.22 6.66 2.01 -1.05 -4.70 115.64 116.21 2a1d s THR 172 Ca 0.00 -0.56 0.13 0.00 0.31 0.00 0.00 61.69 61.57 2a1d s THR 172 Cb 0.00 -1.14 0.30 0.00 0.01 0.00 0.00 72.50 71.67 2a1d s THR 172 CO 0.00 -0.31 1.22 0.54 -0.69 0.00 0.00 174.62 175.38 2a1d n ARG 173 N -0.15 2.40 -3.85 4.92 5.12 -1.26 -4.92 116.66 118.92 2a1d n ARG 173 Ca -0.16 -1.96 -0.35 0.00 -1.93 0.00 0.00 57.85 53.45 2a1d n ARG 173 Cb 0.63 -1.30 -0.08 0.00 -1.16 0.00 0.00 32.46 30.55 2a1d n ARG 173 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2a1d s ILE 174 N -1.02 5.24 0.12 0.55 1.01 -1.26 -5.05 121.20 120.79 2a1d s ILE 174 Ca 0.25 0.12 -0.31 0.00 0.00 0.00 0.00 60.65 60.71 2a1d s ILE 174 Cb 0.14 -3.36 -0.09 0.00 0.01 0.00 0.00 42.46 39.16 2a1d s ILE 174 CO 0.18 0.49 1.58 -0.60 0.00 0.00 0.00 174.94 176.59 2a1d s ARG 175 N 0.03 4.22 0.42 2.79 3.52 -1.26 -4.99 118.95 123.68 2a1d s ARG 175 Ca 0.08 2.31 0.00 0.00 -0.13 0.00 0.00 55.73 58.00 2a1d s ARG 175 Cb -0.12 -3.34 -0.01 0.00 -1.56 0.00 0.00 34.95 29.92 2a1d s ARG 175 CO -0.00 -0.64 0.64 0.42 -0.81 0.00 0.00 175.30 174.91 2a1d s ILE 176 N 1.72 4.36 0.00 4.11 -1.09 -1.26 -4.92 121.20 124.13 2a1d s ILE 176 Ca 0.71 -0.46 -0.08 0.00 -2.23 0.00 0.00 60.65 58.59 2a1d s ILE 176 Cb -0.41 -3.61 0.00 0.00 -1.58 0.00 0.00 42.46 36.86 2a1d s ILE 176 CO 0.31 -0.42 0.16 0.42 -1.23 0.00 0.00 174.94 174.18 2a1d s THR 177 N -2.49 0.08 -0.91 2.92 -4.23 -1.26 -5.00 115.64 104.75 2a1d s THR 177 Ca 0.46 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 2a1d s THR 177 Cb -0.10 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.27 2a1d s THR 177 CO 0.38 -0.37 0.88 0.47 -0.54 0.00 0.00 174.62 175.44 2a1d n ASP 178 N 1.39 0.00 -2.00 3.99 9.92 -1.26 -1.57 116.55 127.02 2a1d n ASP 178 Ca -0.23 0.39 -0.21 0.00 -0.53 0.00 0.00 54.79 54.22 2a1d n ASP 178 Cb 0.56 -0.39 0.13 0.00 -0.64 0.00 0.00 41.12 40.77 2a1d n ASP 178 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2a1d n ASN 179 N -1.38 4.29 -3.61 -2.24 4.13 -1.26 -4.86 115.26 110.33 2a1d n ASN 179 Ca 0.00 -3.31 -0.07 0.00 1.68 0.00 0.00 54.58 52.87 2a1d n ASN 179 Cb 0.07 -0.81 -0.05 0.00 -1.54 0.00 0.00 39.78 37.45 2a1d n ASN 179 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2a1d s MET 180 N -2.68 0.39 0.17 3.52 0.23 -0.61 -3.40 119.30 116.92 2a1d s MET 180 Ca 0.46 0.15 0.04 0.00 -1.03 0.00 0.00 55.69 55.31 2a1d s MET 180 Cb 0.38 0.18 -0.05 0.00 -1.53 0.00 0.00 34.83 33.82 2a1d s MET 180 CO 0.07 -0.11 -0.05 -0.59 -2.03 0.00 0.00 175.02 172.30 2a1d s PHE 181 N -0.84 1.31 -0.03 3.16 -0.12 -0.61 -4.69 117.98 116.17 2a1d s PHE 181 Ca 0.03 -0.86 0.07 0.00 -0.05 0.00 0.00 56.93 56.12 2a1d s PHE 181 Cb -0.01 -0.71 -0.02 0.00 -0.63 0.00 0.00 43.02 41.64 2a1d s PHE 181 CO -0.03 -0.02 -0.25 0.00 -0.05 0.00 0.00 175.22 174.87 2a1d s ALA 183 N -0.51 1.40 0.00 0.00 0.00 -0.31 -1.67 121.76 120.67 2a1d s ALA 183 Ca 0.07 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 50.71 2a1d s ALA 183 Cb -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.99 2a1d s ALA 183 CO -0.00 0.02 0.00 0.41 0.00 0.00 0.00 175.76 176.19 2a1d n GLY 184 N 0.35 -0.07 3.63 0.00 0.00 0.16 -2.37 105.19 106.89 2a1d n GLY 184 Ca -0.14 -1.57 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 2a1d n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2a1d s TYR 184 N -2.57 3.09 0.27 1.61 2.02 -1.26 -4.11 117.35 116.41 2a1d s TYR 184 Ca 0.00 0.06 -0.29 0.00 -0.37 0.00 0.00 57.07 56.47 2a1d s TYR 184 Cb 0.00 -1.82 -0.09 0.00 -0.40 0.00 0.00 41.96 39.65 2a1d s TYR 184 CO 0.00 0.33 0.99 0.15 -1.57 0.00 0.00 175.55 175.46 2a1d s LYS 185 N -0.58 4.74 0.21 -0.62 1.02 -1.26 -4.90 119.74 118.35 2a1d s LYS 185 Ca 0.09 1.57 -0.18 0.00 0.02 0.00 0.00 55.97 57.47 2a1d s LYS 185 Cb -0.12 -3.18 0.20 0.00 -0.52 0.00 0.00 37.83 34.22 2a1d s LYS 185 CO 0.02 0.38 1.58 -1.00 -0.92 0.00 0.00 175.35 175.41 2a1d h PRO 186 N 3.89 -0.08 0.00 -1.68 0.13 -1.95 0.75 132.00 133.06 2a1d h PRO 186 Ca -0.46 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2a1d h PRO 186 Cb 1.20 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2a1d h PRO 186 CO 0.67 -0.05 0.30 0.78 -0.23 0.00 0.00 178.00 179.47 2a1d h GLY 186 N -0.08 0.00 -0.85 1.56 0.00 -1.99 -3.42 103.07 98.28 2a1d h GLY 186 Ca 0.30 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 47.17 2a1d h GLY 186 CO -0.80 0.00 0.35 -0.54 0.00 0.00 0.00 176.54 175.56 2a1d s GLU 186 N -3.54 1.59 -0.06 4.80 2.02 0.26 -5.07 118.70 118.70 2a1d s GLU 186 Ca -0.02 -0.22 -0.04 0.00 0.02 0.00 0.00 54.97 54.72 2a1d s GLU 186 Cb 0.05 -1.99 -0.01 0.00 0.10 0.00 0.00 34.13 32.27 2a1d s GLU 186 CO 0.16 -1.76 -0.07 0.41 0.02 0.00 0.00 175.26 174.02 2a1d n GLY 186 N -3.33 -0.70 2.48 -1.39 0.00 -1.26 -4.95 105.19 96.03 2a1d n GLY 186 Ca 0.11 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2a1d n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2a1d n LYS 186 N -3.22 -4.16 -3.48 1.61 5.02 -1.26 -5.06 118.16 107.60 2a1d n LYS 186 Ca -0.03 -1.15 -0.02 0.00 -2.02 0.00 0.00 58.31 55.09 2a1d n LYS 186 Cb 0.11 -1.46 0.02 0.00 -0.02 0.00 0.00 35.03 33.68 2a1d n LYS 186 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2a1d n ARG 187 N -4.92 0.50 0.00 1.97 1.85 -1.26 -4.90 116.66 109.90 2a1d n ARG 187 Ca 0.11 -1.17 0.00 0.00 -1.00 0.00 0.00 57.85 55.79 2a1d n ARG 187 Cb 0.47 1.61 0.00 0.00 -1.05 0.00 0.00 32.46 33.48 2a1d n ARG 187 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2a1d n GLY 188 N -0.62 1.01 0.00 2.89 0.00 -1.26 -4.90 105.19 102.30 2a1d n GLY 188 Ca -0.01 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2a1d n GLY 188 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2a1d n ASP 189 N 0.00 0.00 -4.95 1.61 2.03 -1.06 -4.67 116.55 109.51 2a1d n ASP 189 Ca 0.00 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.08 2a1d n ASP 189 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 2a1d n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a1d s ALA 190 N -2.00 3.76 0.00 -1.67 0.00 -1.26 -0.41 121.76 120.18 2a1d s ALA 190 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2a1d s ALA 190 Cb 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.99 2a1d s ALA 190 CO 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 175.76 175.39 2a1d s GLU 192 N 1.64 2.83 -1.55 0.00 8.01 -1.26 -3.21 118.70 125.15 2a1d s GLU 192 Ca 0.00 1.20 -0.05 0.00 0.01 0.00 0.00 54.97 56.13 2a1d s GLU 192 Cb 0.00 -1.97 0.01 0.00 -4.31 0.00 0.00 34.13 27.86 2a1d s GLU 192 CO 0.00 -1.20 0.59 0.41 0.01 0.00 0.00 175.26 175.07 2a1d n GLY 193 N -1.10 -0.52 0.00 -1.39 0.00 -1.26 -1.43 105.19 99.48 2a1d n GLY 193 Ca 0.09 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2a1d n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2a1d n ASP 194 N -2.50 3.30 0.00 1.61 8.00 -1.20 -2.83 116.55 122.93 2a1d n ASP 194 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 2a1d n ASP 194 Cb 0.62 0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.95 2a1d n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2a1d n SER 195 N -1.78 0.00 0.00 -2.24 7.64 -1.26 -1.98 113.62 114.00 2a1d n SER 195 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2a1d n SER 195 Cb 0.35 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2a1d n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a1d n GLY 196 N 0.00 0.00 3.37 0.23 0.00 -1.23 -2.81 105.19 104.75 2a1d n GLY 196 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2a1d n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a1d n GLY 197 N -0.87 -2.31 3.90 -0.02 0.00 -0.84 -3.63 105.19 101.42 2a1d n GLY 197 Ca 0.00 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 2a1d n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2a1d s PRO 198 N -3.28 3.65 -0.44 1.61 0.04 -1.26 -1.55 135.00 133.78 2a1d s PRO 198 Ca 0.56 0.22 0.03 0.00 0.04 0.00 0.00 61.00 61.85 2a1d s PRO 198 Cb -0.23 -2.47 0.12 0.00 0.04 0.00 0.00 34.50 31.97 2a1d s PRO 198 CO 0.68 -0.02 0.18 0.12 0.04 0.00 0.00 177.00 178.01 2a1d s PHE 199 N -2.41 3.02 0.40 0.56 2.19 0.23 -3.52 117.98 118.45 2a1d s PHE 199 Ca 0.48 -2.89 0.07 0.00 0.33 0.00 0.00 56.93 54.91 2a1d s PHE 199 Cb -0.10 -2.60 0.00 0.00 -1.31 0.00 0.00 43.02 39.01 2a1d s PHE 199 CO 0.35 -0.82 0.55 0.14 1.83 0.00 0.00 175.22 177.28 2a1d s VAL 200 N 0.30 3.39 0.01 3.12 -7.23 0.39 -0.43 120.40 119.96 2a1d s VAL 200 Ca 0.15 -0.96 -0.08 0.00 -1.81 0.00 0.00 61.98 59.28 2a1d s VAL 200 Cb -0.23 -3.16 0.00 0.00 0.56 0.00 0.00 36.38 33.55 2a1d s VAL 200 CO -0.04 -0.07 0.16 -0.04 -0.31 0.00 0.00 175.10 174.81 2a1d s MET 201 N -4.32 0.56 -0.31 4.82 -1.94 -0.33 0.18 119.30 117.96 2a1d s MET 201 Ca 0.51 -0.47 -0.05 0.00 -1.71 0.00 0.00 55.69 53.97 2a1d s MET 201 Cb -0.10 0.23 0.03 0.00 2.01 0.00 0.00 34.83 37.01 2a1d s MET 201 CO 0.33 -0.15 0.06 0.21 -0.01 0.00 0.00 175.02 175.46 2a1d s LYS 202 N -1.79 2.68 -0.07 2.03 2.20 -1.26 -0.28 119.74 123.26 2a1d s LYS 202 Ca -0.11 -1.12 -0.29 0.00 -0.36 0.00 0.00 55.97 54.08 2a1d s LYS 202 Cb -0.05 -3.33 -0.06 0.00 -1.51 0.00 0.00 37.83 32.88 2a1d s LYS 202 CO -0.00 -0.59 1.85 0.45 -0.36 0.00 0.00 175.35 176.70 2a1d s SER 203 N 1.38 6.36 0.25 1.43 0.15 0.20 -4.85 113.70 118.63 2a1d s SER 203 Ca -0.02 2.26 0.22 0.00 0.70 0.00 0.00 55.95 59.12 2a1d s SER 203 Cb -0.19 -2.53 0.98 0.00 -1.71 0.00 0.00 66.02 62.58 2a1d s SER 203 CO 0.01 -1.18 1.68 -2.65 1.20 0.00 0.00 173.24 172.30 2a1d n PRO 204 N 7.61 0.17 -0.20 5.44 -0.02 -1.26 -0.49 135.00 146.25 2a1d n PRO 204 Ca 0.20 0.46 0.07 0.00 -2.02 0.00 0.00 63.50 62.21 2a1d n PRO 204 Cb 0.43 -1.86 0.19 0.00 -0.02 0.00 0.00 33.50 32.24 2a1d n PRO 204 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2a1d n TYR 204 N -2.19 0.52 0.00 6.00 4.01 -1.26 -4.43 117.16 119.81 2a1d n TYR 204 Ca 0.01 -0.26 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 2a1d n TYR 204 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 2a1d n TYR 204 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2a1d n ASN 204 N 0.67 0.00 -3.12 7.72 6.94 -0.91 -5.03 115.26 121.53 2a1d n ASN 204 Ca 0.14 0.00 -0.07 0.00 -0.02 0.00 0.00 54.58 54.63 2a1d n ASN 204 Cb 0.34 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.75 2a1d n ASN 204 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2a1d n ASN 205 N 0.00 -0.09 -4.29 0.53 4.13 0.36 -4.90 115.26 111.00 2a1d n ASN 205 Ca 0.00 -0.25 -0.23 0.00 1.68 0.00 0.00 54.58 55.79 2a1d n ASN 205 Cb 0.00 -0.30 -0.12 0.00 -1.54 0.00 0.00 39.78 37.82 2a1d n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2a1d s ARG 206 N -4.30 1.14 -0.20 3.52 0.52 -1.23 -4.93 118.95 113.47 2a1d s ARG 206 Ca 0.03 -1.22 -0.11 0.00 -0.52 0.00 0.00 55.73 53.90 2a1d s ARG 206 Cb -0.02 -1.31 -0.05 0.00 0.52 0.00 0.00 34.95 34.09 2a1d s ARG 206 CO 0.19 0.29 0.19 -1.58 0.02 0.00 0.00 175.30 174.41 2a1d s TRP 207 N -1.47 3.39 -0.08 -0.53 0.52 -1.26 -0.62 118.94 118.88 2a1d s TRP 207 Ca 0.09 0.37 0.03 0.00 0.02 0.00 0.00 56.10 56.61 2a1d s TRP 207 Cb -0.09 -2.25 -0.01 0.00 -1.15 0.00 0.00 33.47 29.97 2a1d s TRP 207 CO 0.05 0.20 -0.18 0.71 0.02 0.00 0.00 176.95 177.75 2a1d s TYR 208 N 0.62 2.65 -0.78 -1.98 1.51 0.62 -1.58 117.35 118.41 2a1d s TYR 208 Ca 0.10 -0.59 -0.23 0.00 -1.01 0.00 0.00 57.07 55.34 2a1d s TYR 208 Cb -0.12 -1.70 0.06 0.00 -0.11 0.00 0.00 41.96 40.09 2a1d s TYR 208 CO 0.01 -0.13 1.15 -1.14 -1.11 0.00 0.00 175.55 174.33 2a1d s GLN 209 N -0.08 3.27 0.12 -0.62 0.74 0.51 -1.19 119.66 122.42 2a1d s GLN 209 Ca -0.04 -0.84 -0.14 0.00 0.05 0.00 0.00 55.36 54.39 2a1d s GLN 209 Cb -0.14 -4.48 -0.04 0.00 1.10 0.00 0.00 33.01 29.44 2a1d s GLN 209 CO 0.04 -1.97 1.49 0.52 -0.55 0.00 0.00 175.29 174.83 2a1d h MET 210 N 9.63 0.78 -4.57 1.67 2.86 -1.07 -3.37 114.93 120.86 2a1d h MET 210 Ca -0.15 -0.34 -0.29 0.00 -2.06 0.00 0.00 59.70 56.86 2a1d h MET 210 Cb 1.05 -0.02 -0.14 0.00 0.06 0.00 0.00 31.60 32.55 2a1d h MET 210 CO 1.24 0.96 -0.52 0.20 1.06 0.00 0.00 176.91 179.85 2a1d s GLY 211 N -3.59 1.60 -0.06 8.32 0.00 -0.59 -0.56 107.32 112.44 2a1d s GLY 211 Ca -0.12 -1.72 0.05 0.00 0.00 0.00 0.00 44.72 42.93 2a1d s GLY 211 CO 0.83 -1.33 -0.22 -0.42 0.00 0.00 0.00 173.10 171.96 2a1d s ILE 212 N -3.90 2.37 0.01 0.90 1.01 -1.09 0.74 121.20 121.23 2a1d s ILE 212 Ca 0.38 -0.96 -0.30 0.00 0.00 0.00 0.00 60.65 59.77 2a1d s ILE 212 Cb 0.05 -1.89 -0.07 0.00 0.01 0.00 0.00 42.46 40.56 2a1d s ILE 212 CO 0.16 0.57 1.60 -0.69 0.00 0.00 0.00 174.94 176.58 2a1d s VAL 213 N -0.26 3.40 0.01 2.92 1.01 -0.59 -0.09 120.40 126.79 2a1d s VAL 213 Ca -0.00 0.70 -0.02 0.00 0.00 0.00 0.00 61.98 62.66 2a1d s VAL 213 Cb -0.13 -3.45 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 2a1d s VAL 213 CO 0.03 -0.03 -0.05 -0.24 0.00 0.00 0.00 175.10 174.81 2a1d n SER 214 N 6.16 0.69 -1.40 3.32 2.88 -0.70 -3.53 113.62 121.03 2a1d n SER 214 Ca 0.16 0.10 -0.03 0.00 -1.33 0.00 0.00 58.87 57.77 2a1d n SER 214 Cb 0.42 -0.29 -0.01 0.00 -0.75 0.00 0.00 64.21 63.58 2a1d n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2a1d n TRP 215 N -3.14 -0.54 0.00 0.66 4.27 -0.25 -4.87 117.44 113.57 2a1d n TRP 215 Ca -0.02 -0.47 0.00 0.00 -3.89 0.00 0.00 57.50 53.12 2a1d n TRP 215 Cb 0.07 0.10 0.00 0.00 -1.36 0.00 0.00 31.31 30.12 2a1d n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2a1d n GLY 216 N -0.11 2.29 3.32 -1.67 0.00 -1.26 -0.97 105.19 106.79 2a1d n GLY 216 Ca 0.00 -0.73 -0.46 0.00 0.00 0.00 0.00 46.02 44.83 2a1d n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a1d s GLU 217 N -2.00 3.16 2.07 1.61 2.02 -1.26 -4.91 118.70 119.39 2a1d s GLU 217 Ca 0.00 -1.88 0.00 0.00 0.02 0.00 0.00 54.97 53.11 2a1d s GLU 217 Cb 0.00 -4.34 0.00 0.00 0.10 0.00 0.00 34.13 29.89 2a1d s GLU 217 CO 0.00 -1.34 0.00 0.41 0.02 0.00 0.00 175.26 174.35 2a1d n GLY 219 N 4.93 0.75 3.50 -1.39 0.00 -1.26 -4.77 105.19 106.95 2a1d n GLY 219 Ca -0.06 -1.22 -0.00 0.00 0.00 0.00 0.00 46.02 44.74 2a1d n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a1d n ASP 221 N 4.74 -3.53 -3.15 0.00 2.03 -1.26 -4.70 116.55 110.68 2a1d n ASP 221 Ca -0.12 0.24 -0.19 0.00 0.52 0.00 0.00 54.79 55.24 2a1d n ASP 221 Cb 0.53 -3.13 0.17 0.00 -0.72 0.00 0.00 41.12 37.98 2a1d n ASP 221 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2a1d n ARG 221 N -2.39 -3.15 -3.83 -0.67 1.74 -1.26 -4.93 116.66 102.16 2a1d n ARG 221 Ca -0.13 -1.01 -0.36 0.00 -0.77 0.00 0.00 57.85 55.58 2a1d n ARG 221 Cb 0.52 -1.12 -0.13 0.00 -1.02 0.00 0.00 32.46 30.71 2a1d n ARG 221 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2a1d s ASP 222 N -3.01 5.11 0.00 0.55 -0.00 -1.26 -4.53 116.67 113.53 2a1d s ASP 222 Ca 0.43 -1.71 0.00 0.00 -0.00 0.00 0.00 52.55 51.27 2a1d s ASP 222 Cb -0.06 -1.78 0.00 0.00 -0.00 0.00 0.00 42.92 41.08 2a1d s ASP 222 CO 0.35 -0.42 0.00 0.61 -0.00 0.00 0.00 175.17 175.71 2a1d n GLY 223 N 4.60 1.92 3.94 0.21 0.00 -1.26 -5.03 105.19 109.56 2a1d n GLY 223 Ca -0.06 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 2a1d n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a1d s LYS 224 N 0.00 3.32 0.28 1.61 1.02 -1.26 -4.78 119.74 119.93 2a1d s LYS 224 Ca 0.00 -0.83 0.07 0.00 0.02 0.00 0.00 55.97 55.23 2a1d s LYS 224 Cb 0.00 -2.81 -0.06 0.00 -0.52 0.00 0.00 37.83 34.44 2a1d s LYS 224 CO 0.00 0.42 -0.07 0.71 -0.92 0.00 0.00 175.35 175.50 2a1d s TYR 225 N -2.01 1.99 0.09 3.18 2.02 -1.26 -4.68 117.35 116.68 2a1d s TYR 225 Ca 0.34 -0.67 -0.25 0.00 -0.37 0.00 0.00 57.07 56.11 2a1d s TYR 225 Cb -0.09 -1.13 -0.06 0.00 -0.40 0.00 0.00 41.96 40.28 2a1d s TYR 225 CO 0.28 0.32 0.78 0.20 -1.57 0.00 0.00 175.55 175.56 2a1d s GLY 226 N -3.46 2.84 -0.17 0.71 0.00 -1.00 -4.59 107.32 101.66 2a1d s GLY 226 Ca 0.30 0.32 -0.05 0.00 0.00 0.00 0.00 44.72 45.28 2a1d s GLY 226 CO 0.12 1.04 0.01 -1.36 0.00 0.00 0.00 173.10 172.92 2a1d s PHE 227 N -0.39 3.13 0.34 1.90 0.40 -0.14 -1.17 117.98 122.05 2a1d s PHE 227 Ca 0.38 -0.14 0.09 0.00 -0.60 0.00 0.00 56.93 56.66 2a1d s PHE 227 Cb -0.21 -2.02 -0.05 0.00 0.51 0.00 0.00 43.02 41.24 2a1d s PHE 227 CO 0.24 0.04 0.02 0.71 0.70 0.00 0.00 175.22 176.93 2a1d s TYR 228 N 0.41 2.55 0.13 0.36 1.51 -0.02 -1.09 117.35 121.19 2a1d s TYR 228 Ca -0.01 -0.44 -0.27 0.00 -1.01 0.00 0.00 57.07 55.35 2a1d s TYR 228 Cb -0.13 -1.50 -0.07 0.00 -0.11 0.00 0.00 41.96 40.15 2a1d s TYR 228 CO 0.02 0.47 0.83 0.99 -1.11 0.00 0.00 175.55 176.75 2a1d s THR 229 N -2.52 4.47 -0.96 -0.71 2.01 0.87 -1.57 115.64 117.23 2a1d s THR 229 Ca 0.35 1.80 -0.24 0.00 0.31 0.00 0.00 61.69 63.91 2a1d s THR 229 Cb 0.00 -4.19 0.04 0.00 0.01 0.00 0.00 72.50 68.36 2a1d s THR 229 CO 0.19 0.43 1.45 -2.28 -0.69 0.00 0.00 174.62 173.73 2a1d s HIS 230 N -0.60 2.44 0.16 4.92 2.46 -1.22 -2.68 115.29 120.77 2a1d s HIS 230 Ca 0.39 -0.62 -0.15 0.00 0.47 0.00 0.00 55.06 55.16 2a1d s HIS 230 Cb -0.23 -4.65 0.07 0.00 -0.13 0.00 0.00 32.58 27.64 2a1d s HIS 230 CO 0.27 -1.96 1.79 0.28 -2.47 0.00 0.00 174.74 172.65 2a1d h VAL 231 N 6.69 1.02 -0.14 0.89 2.07 -1.13 -3.07 116.25 122.59 2a1d h VAL 231 Ca 0.11 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.51 2a1d h VAL 231 Cb 1.02 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 2a1d h VAL 231 CO 1.39 0.09 -0.15 0.15 0.02 0.00 0.00 177.57 179.06 2a1d h PHE 232 N 0.48 -0.39 -0.13 1.57 3.57 -1.84 -0.49 116.94 119.71 2a1d h PHE 232 Ca 0.18 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.74 2a1d h PHE 232 Cb 0.04 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2a1d h PHE 232 CO -0.08 -0.22 0.30 -0.09 -2.23 0.00 0.00 178.31 175.98 2a1d h ARG 233 N -0.19 0.00 0.00 1.11 2.43 -1.90 0.33 114.38 116.16 2a1d h ARG 233 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2a1d h ARG 233 Cb 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2a1d h ARG 233 CO -0.25 0.00 -0.98 1.28 -1.51 0.00 0.00 179.97 178.51 2a1d n LEU 234 N -3.27 0.75 0.32 3.80 7.99 -0.31 -4.30 117.00 121.97 2a1d n LEU 234 Ca 0.01 -0.27 0.13 0.00 -0.01 0.00 0.00 56.01 55.87 2a1d n LEU 234 Cb 0.39 -0.07 0.68 0.00 -0.11 0.00 0.00 43.42 44.31 2a1d n LEU 234 CO 0.20 0.17 1.09 0.50 -1.51 0.00 0.00 177.39 177.83 2a1d h LYS 235 N 0.00 0.00 -0.23 3.23 3.64 0.89 0.83 116.57 124.94 2a1d h LYS 235 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2a1d h LYS 235 Cb 0.58 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2a1d h LYS 235 CO 0.00 0.00 -0.19 0.87 -2.27 0.00 0.00 179.45 177.86 2a1d h LYS 236 N 0.00 0.53 0.34 1.90 1.79 -1.75 -2.60 116.57 116.78 2a1d h LYS 236 Ca 0.00 -0.27 -0.02 0.00 -2.18 0.00 0.00 60.65 58.19 2a1d h LYS 236 Cb 0.84 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 2a1d h LYS 236 CO 0.00 0.84 -0.17 2.35 -1.08 0.00 0.00 179.45 181.40 2a1d h TRP 237 N 0.22 -0.43 -0.70 -1.35 7.01 0.36 -2.26 115.95 118.81 2a1d h TRP 237 Ca 0.04 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.09 2a1d h TRP 237 Cb 0.73 0.14 -0.08 0.00 -2.10 0.00 0.00 29.16 27.85 2a1d h TRP 237 CO 0.07 -0.12 -0.41 -0.89 -2.79 0.00 0.00 178.44 174.30 2a1d n ILE 238 N -5.18 -0.48 -0.01 2.65 5.41 -0.85 -0.88 119.36 120.01 2a1d n ILE 238 Ca -0.10 2.15 -0.14 0.00 1.00 0.00 0.00 62.75 65.66 2a1d n ILE 238 Cb 0.26 -2.69 -0.09 0.00 -0.71 0.00 0.00 39.64 36.41 2a1d n ILE 238 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2a1d h GLN 239 N 0.00 -0.50 -1.91 0.38 4.15 -1.50 0.12 115.11 115.84 2a1d h GLN 239 Ca 0.11 0.03 0.56 0.00 0.77 0.00 0.00 58.65 60.12 2a1d h GLN 239 Cb 0.29 0.11 -0.08 0.00 0.21 0.00 0.00 27.48 28.01 2a1d h GLN 239 CO -0.66 -0.34 1.37 1.17 -1.93 0.00 0.00 178.83 178.44 2a1d n LYS 240 N -5.16 -0.00 -0.05 1.69 4.81 -0.06 -1.39 118.16 118.00 2a1d n LYS 240 Ca -0.05 1.07 0.02 0.00 -0.87 0.00 0.00 58.31 58.47 2a1d n LYS 240 Cb 0.34 -2.44 -0.15 0.00 0.02 0.00 0.00 35.03 32.80 2a1d n LYS 240 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 2a1d n VAL 241 N -3.92 0.56 -0.06 3.15 0.24 0.30 -4.35 118.33 114.25 2a1d n VAL 241 Ca 0.43 -0.60 -0.08 0.00 -2.04 0.00 0.00 64.34 62.05 2a1d n VAL 241 Cb 1.95 -0.20 -0.07 0.00 -1.47 0.00 0.00 33.84 34.05 2a1d n VAL 241 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2a1d h ILE 242 N 0.00 0.98 0.00 1.34 2.04 -0.05 -3.29 117.51 118.53 2a1d h ILE 242 Ca -0.22 -1.75 0.00 0.00 1.00 0.00 0.00 64.86 63.89 2a1d h ILE 242 Cb 1.46 1.87 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 2a1d h ILE 242 CO 0.01 0.33 0.00 0.47 0.00 0.00 0.00 178.15 178.97 2a1d n ASP 243 N -4.68 4.23 0.10 1.72 9.92 -1.01 -4.44 116.55 122.39 2a1d n ASP 243 Ca -0.06 -2.11 -0.04 0.00 -0.53 0.00 0.00 54.79 52.04 2a1d n ASP 243 Cb 0.28 -0.89 -0.02 0.00 -0.64 0.00 0.00 41.12 39.85 2a1d n ASP 243 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 2a1d h ARG 244 N 1.57 -0.27 -5.84 -1.24 9.65 -1.76 -3.43 114.38 113.06 2a1d h ARG 244 Ca 0.00 0.02 -0.58 0.00 -1.10 0.00 0.00 59.98 58.31 2a1d h ARG 244 Cb 0.80 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.43 2a1d h ARG 244 CO 0.00 -0.18 1.52 1.28 2.80 0.00 0.00 179.97 185.39 2a1d n LEU 245 N -3.16 2.47 0.00 3.80 4.77 -1.26 -2.60 117.00 121.01 2a1d n LEU 245 Ca -0.04 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2a1d n LEU 245 Cb 0.11 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 39.78 2a1d n LEU 245 CO 0.09 -0.91 0.00 0.61 -1.33 0.00 0.00 177.39 175.85 2a1d n GLY 246 N 6.15 1.30 0.00 -0.72 0.00 -1.26 -5.19 105.19 105.47 2a1d n GLY 246 Ca 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2a1d n GLY 246 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76