#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p0b s PRO 12 N 0.00 2.54 0.23 5.56 0.04 -1.26 -4.64 135.00 137.47 1p0b s PRO 12 Ca 0.00 0.37 -0.08 0.00 0.04 0.00 0.00 61.00 61.33 1p0b s PRO 12 Cb 0.00 -1.99 0.22 0.00 0.04 0.00 0.00 34.50 32.77 1p0b s PRO 12 CO 0.00 -1.25 1.90 -0.09 0.04 0.00 0.00 177.00 177.60 1p0b h ARG 13 N -0.81 1.12 -1.65 4.56 2.43 -1.85 -2.76 114.38 115.42 1p0b h ARG 13 Ca -0.45 -0.07 0.09 0.00 -0.81 0.00 0.00 59.98 58.74 1p0b h ARG 13 Cb 1.28 -0.25 -0.24 0.00 -0.42 0.00 0.00 29.97 30.34 1p0b h ARG 13 CO 0.64 0.74 0.17 0.12 -1.51 0.00 0.00 179.97 180.13 1p0b s PHE 14 N -6.12 -0.86 -0.22 2.20 5.36 -1.24 -4.09 117.98 113.02 1p0b s PHE 14 Ca -0.13 1.62 -0.04 0.00 -0.96 0.00 0.00 56.93 57.42 1p0b s PHE 14 Cb 0.17 0.51 0.11 0.00 -0.34 0.00 0.00 43.02 43.47 1p0b s PHE 14 CO 0.80 -0.42 0.35 0.45 -1.46 0.00 0.00 175.22 174.93 1p0b s SER 15 N 1.86 0.35 -0.23 6.13 0.15 -0.40 -4.96 113.70 116.61 1p0b s SER 15 Ca -0.08 0.33 -0.09 0.00 0.70 0.00 0.00 55.95 56.82 1p0b s SER 15 Cb -0.06 0.99 -0.04 0.00 -1.71 0.00 0.00 66.02 65.20 1p0b s SER 15 CO -0.17 -0.28 0.11 0.12 1.20 0.00 0.00 173.24 174.21 1p0b s PHE 16 N 2.51 3.22 -0.06 3.44 5.36 -1.26 -0.49 117.98 130.69 1p0b s PHE 16 Ca 0.08 -0.01 0.03 0.00 -0.96 0.00 0.00 56.93 56.07 1p0b s PHE 16 Cb -0.14 -2.22 0.00 0.00 -0.34 0.00 0.00 43.02 40.32 1p0b s PHE 16 CO -0.14 -0.06 -0.16 -1.54 -1.46 0.00 0.00 175.22 171.86 1p0b s SER 17 N 1.12 2.18 -0.27 6.13 1.04 -0.12 -4.99 113.70 118.79 1p0b s SER 17 Ca 0.06 -0.37 -0.12 0.00 0.48 0.00 0.00 55.95 56.00 1p0b s SER 17 Cb -0.14 -0.83 -0.05 0.00 0.10 0.00 0.00 66.02 65.10 1p0b s SER 17 CO 0.04 0.11 0.24 -0.63 0.98 0.00 0.00 173.24 173.98 1p0b s ILE 18 N 0.33 5.28 -0.09 -1.02 1.01 -1.26 -1.37 121.20 124.07 1p0b s ILE 18 Ca -0.11 0.29 0.07 0.00 0.00 0.00 0.00 60.65 60.91 1p0b s ILE 18 Cb -0.14 -3.58 -0.24 0.00 0.01 0.00 0.00 42.46 38.51 1p0b s ILE 18 CO 0.04 0.23 0.47 0.00 0.00 0.00 0.00 174.94 175.68 1p0b n ALA 19 N 5.05 1.33 -3.12 9.38 0.00 -0.04 -4.97 120.51 128.14 1p0b n ALA 19 Ca -0.12 -0.80 -0.12 0.00 0.00 0.00 0.00 53.44 52.39 1p0b n ALA 19 Cb 0.52 -0.69 -0.07 0.00 0.00 0.00 0.00 19.45 19.21 1p0b n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p0b s ALA 20 N -2.57 -0.92 0.05 0.00 0.00 -1.00 -5.02 121.76 112.30 1p0b s ALA 20 Ca -0.12 0.23 -0.01 0.00 0.00 0.00 0.00 51.96 52.06 1p0b s ALA 20 Cb 0.07 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 1p0b s ALA 20 CO 0.80 -0.44 -0.03 1.03 0.00 0.00 0.00 175.76 177.11 1p0b s ARG 21 N -2.49 0.55 -0.28 0.00 0.52 -1.26 -1.15 118.95 114.84 1p0b s ARG 21 Ca -0.05 -1.08 -0.02 0.00 -0.52 0.00 0.00 55.73 54.06 1p0b s ARG 21 Cb -0.01 0.15 0.17 0.00 0.52 0.00 0.00 34.95 35.78 1p0b s ARG 21 CO -0.03 -0.09 0.51 -2.00 0.02 0.00 0.00 175.30 173.72 1p0b s GLU 22 N -3.30 0.48 7.61 3.54 2.12 -0.86 -4.89 118.70 123.40 1p0b s GLU 22 Ca 0.02 0.84 0.00 0.00 0.36 0.00 0.00 54.97 56.19 1p0b s GLU 22 Cb 0.03 0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.59 1p0b s GLU 22 CO -0.07 -0.61 0.00 0.41 -0.54 0.00 0.00 175.26 174.44 1p0b n GLY 23 N 5.40 3.18 0.01 -1.50 0.00 -1.26 -1.28 105.19 109.75 1p0b n GLY 23 Ca -0.02 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 45.93 1p0b n GLY 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p0b n LYS 24 N 13.76 0.03 -2.49 1.61 5.02 -1.26 -4.91 118.16 129.92 1p0b n LYS 24 Ca 0.00 0.01 -0.36 0.00 -2.02 0.00 0.00 58.31 55.94 1p0b n LYS 24 Cb 0.00 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.46 1p0b n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p0b s ALA 25 N -3.02 2.98 0.02 7.82 0.00 -0.40 -3.37 121.76 125.79 1p0b s ALA 25 Ca 0.11 0.71 -0.01 0.00 0.00 0.00 0.00 51.96 52.78 1p0b s ALA 25 Cb 0.17 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 1p0b s ALA 25 CO 0.65 -0.34 -0.01 1.03 0.00 0.00 0.00 175.76 177.09 1p0b s ARG 26 N -2.80 0.31 -0.01 0.00 3.00 -1.26 -2.03 118.95 116.17 1p0b s ARG 26 Ca 0.62 -0.57 0.02 0.00 0.00 0.00 0.00 55.73 55.81 1p0b s ARG 26 Cb -0.21 0.11 -0.00 0.00 0.00 0.00 0.00 34.95 34.85 1p0b s ARG 26 CO 0.26 -0.05 -0.06 -0.08 0.00 0.00 0.00 175.30 175.36 1p0b s THR 27 N -1.39 0.50 0.00 0.02 -1.32 -0.30 -4.03 115.64 109.12 1p0b s THR 27 Ca -0.15 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.06 1p0b s THR 27 Cb -0.09 -0.42 0.00 0.00 -1.51 0.00 0.00 72.50 70.47 1p0b s THR 27 CO -0.01 0.14 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 1p0b n GLY 28 N 2.95 1.66 3.12 6.08 0.00 -0.47 -0.86 105.19 117.67 1p0b n GLY 28 Ca -0.13 -0.25 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 1p0b n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p0b s THR 29 N -0.71 0.09 -0.22 2.61 -4.23 -0.47 -1.07 115.64 111.63 1p0b s THR 29 Ca 0.00 -0.73 -0.00 0.00 -1.18 0.00 0.00 61.69 59.78 1p0b s THR 29 Cb 0.00 -0.51 0.03 0.00 1.34 0.00 0.00 72.50 73.36 1p0b s THR 29 CO 0.00 -0.40 -0.12 -0.63 -0.54 0.00 0.00 174.62 172.93 1p0b s ILE 30 N -1.56 2.49 -0.17 2.99 1.01 0.27 -0.94 121.20 125.29 1p0b s ILE 30 Ca -0.13 -1.06 -0.13 0.00 0.00 0.00 0.00 60.65 59.33 1p0b s ILE 30 Cb -0.07 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 40.15 1p0b s ILE 30 CO 0.01 0.30 0.27 -1.61 0.00 0.00 0.00 174.94 173.91 1p0b s GLU 31 N 1.28 4.24 0.22 2.79 2.02 0.36 -0.64 118.70 128.97 1p0b s GLU 31 Ca 0.01 0.05 0.01 0.00 0.02 0.00 0.00 54.97 55.06 1p0b s GLU 31 Cb -0.16 -3.44 -0.05 0.00 0.10 0.00 0.00 34.13 30.59 1p0b s GLU 31 CO -0.08 0.22 0.06 -1.64 0.02 0.00 0.00 175.26 173.84 1p0b s MET 32 N 0.54 1.27 0.24 1.61 -1.94 -0.55 -1.27 119.30 119.19 1p0b s MET 32 Ca 0.15 -1.66 -0.05 0.00 -1.71 0.00 0.00 55.69 52.42 1p0b s MET 32 Cb -0.13 -0.24 0.36 0.00 2.01 0.00 0.00 34.83 36.83 1p0b s MET 32 CO 0.03 -0.23 1.82 0.87 -0.01 0.00 0.00 175.02 177.50 1p0b h LYS 33 N 2.53 0.78 -0.04 2.03 1.57 -1.64 -1.94 116.57 119.86 1p0b h LYS 33 Ca -0.37 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1p0b h LYS 33 Cb 1.23 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1p0b h LYS 33 CO 0.61 0.52 0.00 0.54 -0.57 0.00 0.00 179.45 180.55 1p0b n ARG 34 N -4.73 1.34 0.00 3.15 1.74 -1.26 -4.69 116.66 112.21 1p0b n ARG 34 Ca 0.12 -0.51 0.00 0.00 -0.77 0.00 0.00 57.85 56.70 1p0b n ARG 34 Cb 0.24 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1p0b n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p0b n GLY 35 N 1.02 1.05 3.84 -0.13 0.00 -0.73 -4.16 105.19 106.09 1p0b n GLY 35 Ca 0.18 -1.62 -0.37 0.00 0.00 0.00 0.00 46.02 44.21 1p0b n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p0b s VAL 36 N -1.60 5.35 -0.21 1.61 1.01 -1.26 -1.49 120.40 123.81 1p0b s VAL 36 Ca 0.00 0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.11 1p0b s VAL 36 Cb 0.00 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 33.05 1p0b s VAL 36 CO 0.00 0.60 -0.10 -0.63 0.00 0.00 0.00 175.10 174.97 1p0b s ILE 37 N -0.89 2.86 0.04 2.22 1.01 0.18 -4.88 121.20 121.75 1p0b s ILE 37 Ca 0.14 -0.71 -0.24 0.00 0.00 0.00 0.00 60.65 59.84 1p0b s ILE 37 Cb -0.12 -2.29 -0.06 0.00 0.01 0.00 0.00 42.46 40.00 1p0b s ILE 37 CO 0.03 0.44 0.74 -0.13 0.00 0.00 0.00 174.94 176.01 1p0b s ARG 38 N 1.40 4.47 0.09 2.79 0.52 -1.26 -0.56 118.95 126.38 1p0b s ARG 38 Ca 0.05 1.01 0.09 0.00 -0.52 0.00 0.00 55.73 56.35 1p0b s ARG 38 Cb -0.14 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 31.94 1p0b s ARG 38 CO -0.07 0.31 -0.22 0.95 0.02 0.00 0.00 175.30 176.29 1p0b s THR 39 N -0.13 1.83 0.42 0.02 -4.23 -0.23 -3.53 115.64 109.79 1p0b s THR 39 Ca 0.37 -1.49 -0.26 0.00 -1.18 0.00 0.00 61.69 59.13 1p0b s THR 39 Cb -0.20 -1.63 -0.10 0.00 1.34 0.00 0.00 72.50 71.91 1p0b s THR 39 CO 0.22 0.06 1.31 -2.65 -0.54 0.00 0.00 174.62 173.03 1p0b n PRO 40 N 1.28 2.05 -4.82 3.99 -0.02 -1.26 -1.36 135.00 134.86 1p0b n PRO 40 Ca -0.18 0.73 -0.28 0.00 -2.02 0.00 0.00 63.50 61.74 1p0b n PRO 40 Cb 0.53 -2.44 -0.15 0.00 -0.02 0.00 0.00 33.50 31.42 1p0b n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p0b s ALA 41 N -1.19 1.96 -0.14 3.55 0.00 0.32 -4.86 121.76 121.40 1p0b s ALA 41 Ca 0.60 -1.12 -0.00 0.00 0.00 0.00 0.00 51.96 51.44 1p0b s ALA 41 Cb -0.50 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 1p0b s ALA 41 CO 0.59 0.46 -0.13 0.12 0.00 0.00 0.00 175.76 176.79 1p0b s PHE 42 N -0.76 2.81 -0.32 0.00 5.36 -1.26 -0.72 117.98 123.09 1p0b s PHE 42 Ca 0.09 -0.72 -0.09 0.00 -0.96 0.00 0.00 56.93 55.25 1p0b s PHE 42 Cb -0.09 -1.86 0.01 0.00 -0.34 0.00 0.00 43.02 40.73 1p0b s PHE 42 CO 0.01 -0.27 0.13 -1.64 -1.46 0.00 0.00 175.22 172.00 1p0b s MET 43 N 0.48 3.10 0.40 10.12 -1.94 0.90 -4.74 119.30 127.63 1p0b s MET 43 Ca -0.09 -0.87 -0.26 0.00 -1.71 0.00 0.00 55.69 52.75 1p0b s MET 43 Cb -0.16 -3.52 -0.09 0.00 2.01 0.00 0.00 34.83 33.07 1p0b s MET 43 CO 0.04 -0.50 1.36 -2.14 -0.01 0.00 0.00 175.02 173.77 1p0b s PRO 44 N 1.55 3.96 -0.07 2.03 0.02 -1.25 -4.12 135.00 137.12 1p0b s PRO 44 Ca 0.03 2.28 -0.10 0.00 0.02 0.00 0.00 61.00 63.22 1p0b s PRO 44 Cb -0.18 -2.80 -0.05 0.00 0.02 0.00 0.00 34.50 31.50 1p0b s PRO 44 CO 0.05 -0.54 0.25 0.08 -0.33 0.00 0.00 177.00 176.51 1p0b s VAL 45 N -1.22 5.31 0.00 3.83 1.01 -1.26 -1.07 120.40 127.00 1p0b s VAL 45 Ca 0.56 0.47 0.00 0.00 0.00 0.00 0.00 61.98 63.02 1p0b s VAL 45 Cb -0.41 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1p0b s VAL 45 CO 0.53 0.60 0.00 0.61 0.00 0.00 0.00 175.10 176.84 1p0b n GLY 46 N 1.93 1.68 1.68 4.51 0.00 -0.93 -4.50 105.19 109.56 1p0b n GLY 46 Ca -0.17 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1p0b n GLY 46 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1p0b n THR 47 N 0.00 -5.35 0.00 2.61 -1.04 -1.24 -4.74 114.28 104.52 1p0b n THR 47 Ca 0.00 2.42 0.00 0.00 -2.04 0.00 0.00 64.05 64.43 1p0b n THR 47 Cb 0.00 -3.26 0.00 0.00 -1.82 0.00 0.00 70.33 65.25 1p0b n THR 47 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1p0b n ALA 48 N 0.17 0.00 -3.21 2.41 0.00 -1.26 -4.32 120.51 114.29 1p0b n ALA 48 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1p0b n ALA 48 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 1p0b n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p0b n ALA 49 N -1.03 -0.96 -3.63 0.00 0.00 -1.26 -4.99 120.51 108.64 1p0b n ALA 49 Ca 0.00 0.30 -0.11 0.00 0.00 0.00 0.00 53.44 53.63 1p0b n ALA 49 Cb 0.00 -4.10 -0.07 0.00 0.00 0.00 0.00 19.45 15.28 1p0b n ALA 49 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1p0b s THR 50 N -3.19 0.00 -0.44 0.00 -1.32 -1.26 -4.72 115.64 104.71 1p0b s THR 50 Ca 0.40 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.61 1p0b s THR 50 Cb -0.17 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.84 1p0b s THR 50 CO 0.49 0.00 1.01 -0.69 -2.21 0.00 0.00 174.62 173.22 1p0b s VAL 51 N 0.66 4.40 -0.26 5.08 1.01 -1.26 -3.70 120.40 126.32 1p0b s VAL 51 Ca -0.02 1.07 -0.43 0.00 0.00 0.00 0.00 61.98 62.60 1p0b s VAL 51 Cb -0.05 -4.48 -0.20 0.00 0.00 0.00 0.00 36.38 31.66 1p0b s VAL 51 CO -0.06 -0.82 1.38 0.29 0.00 0.00 0.00 175.10 175.90 1p0b n LYS 52 N 7.31 0.10 -1.16 2.72 5.02 -1.26 -1.72 118.16 129.16 1p0b n LYS 52 Ca 0.09 0.04 -0.06 0.00 -2.02 0.00 0.00 58.31 56.36 1p0b n LYS 52 Cb 0.48 -1.55 -0.02 0.00 -0.02 0.00 0.00 35.03 33.92 1p0b n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1p0b n ALA 53 N 2.99 -0.09 -3.05 7.82 0.00 -1.26 -4.97 120.51 121.95 1p0b n ALA 53 Ca 0.26 0.09 -0.19 0.00 0.00 0.00 0.00 53.44 53.60 1p0b n ALA 53 Cb 0.02 -1.10 -0.15 0.00 0.00 0.00 0.00 19.45 18.22 1p0b n ALA 53 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1p0b s LEU 54 N -1.28 1.77 0.55 0.00 1.43 -0.70 -4.53 118.68 115.91 1p0b s LEU 54 Ca 0.00 -0.14 -0.18 0.00 -1.03 0.00 0.00 54.13 52.78 1p0b s LEU 54 Cb 0.00 -0.43 -0.06 0.00 0.03 0.00 0.00 46.19 45.74 1p0b s LEU 54 CO 0.00 0.04 1.06 -0.54 0.23 0.00 0.00 176.35 177.14 1p0b s LYS 55 N 0.22 3.49 0.41 1.70 1.02 -1.26 -4.48 119.74 120.84 1p0b s LYS 55 Ca -0.03 1.30 0.11 0.00 0.02 0.00 0.00 55.97 57.37 1p0b s LYS 55 Cb -0.07 -2.05 0.93 0.00 -0.52 0.00 0.00 37.83 36.11 1p0b s LYS 55 CO 0.00 -0.68 1.97 -1.35 -0.92 0.00 0.00 175.35 174.37 1p0b h PRO 56 N 0.91 0.51 0.00 -1.68 0.11 -1.85 -0.40 132.00 129.60 1p0b h PRO 56 Ca -0.48 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.53 1p0b h PRO 56 Cb 1.22 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1p0b h PRO 56 CO 0.58 0.34 -0.35 1.05 -0.21 0.00 0.00 178.00 179.41 1p0b h GLU 57 N 0.53 0.00 -0.09 1.05 4.11 -1.91 -0.28 114.58 117.98 1p0b h GLU 57 Ca 0.29 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.51 1p0b h GLU 57 Cb 0.43 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1p0b h GLU 57 CO -0.09 0.35 -0.74 1.15 0.07 0.00 0.00 179.01 179.75 1p0b h THR 58 N 0.00 1.32 -0.55 -1.06 2.02 -1.47 0.21 112.91 113.39 1p0b h THR 58 Ca -0.00 -1.99 0.02 0.00 0.77 0.00 0.00 66.41 65.21 1p0b h THR 58 Cb 0.62 2.18 -0.04 0.00 -1.74 0.00 0.00 68.15 69.18 1p0b h THR 58 CO 0.05 0.62 0.33 0.58 0.37 0.00 0.00 175.52 177.46 1p0b h VAL 59 N 0.33 1.06 -0.59 3.16 2.07 -0.88 -1.84 116.25 119.56 1p0b h VAL 59 Ca -0.07 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 1p0b h VAL 59 Cb 1.38 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1p0b h VAL 59 CO 0.15 0.12 0.09 -0.09 0.02 0.00 0.00 177.57 177.86 1p0b h ARG 60 N 0.66 0.96 -0.06 1.57 9.65 -0.97 -2.75 114.38 123.43 1p0b h ARG 60 Ca 0.22 -0.24 -0.02 0.00 -1.10 0.00 0.00 59.98 58.84 1p0b h ARG 60 Cb 0.02 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.47 1p0b h ARG 60 CO -0.10 0.89 -0.06 0.00 2.80 0.00 0.00 179.97 183.51 1p0b h ALA 61 N 1.19 1.79 0.00 2.80 0.00 -0.16 -0.75 119.26 124.12 1p0b h ALA 61 Ca 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1p0b h ALA 61 Cb 0.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1p0b h ALA 61 CO 0.01 0.16 0.00 0.25 0.00 0.00 0.00 179.25 179.67 1p0b n THR 62 N -4.41 0.80 0.00 0.00 -2.24 -0.80 -4.87 114.28 102.76 1p0b n THR 62 Ca -0.02 0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1p0b n THR 62 Cb 0.17 -1.06 0.00 0.00 -2.10 0.00 0.00 70.33 67.34 1p0b n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p0b n GLY 63 N 0.19 0.80 3.74 3.38 0.00 -0.29 -4.69 105.19 108.33 1p0b n GLY 63 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1p0b n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p0b s ALA 64 N -2.00 3.63 -0.05 4.61 0.00 -1.19 -4.91 121.76 121.85 1p0b s ALA 64 Ca 0.00 1.33 0.22 0.00 0.00 0.00 0.00 51.96 53.50 1p0b s ALA 64 Cb 0.00 -3.56 -0.33 0.00 0.00 0.00 0.00 23.12 19.23 1p0b s ALA 64 CO 0.00 -0.74 0.46 -0.25 0.00 0.00 0.00 175.76 175.22 1p0b n ASP 65 N 2.42 0.02 -3.64 0.00 8.00 -1.26 -4.61 116.55 117.48 1p0b n ASP 65 Ca 0.07 0.01 -0.15 0.00 0.71 0.00 0.00 54.79 55.43 1p0b n ASP 65 Cb 0.40 1.88 -0.07 0.00 -0.02 0.00 0.00 41.12 43.31 1p0b n ASP 65 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1p0b s ILE 66 N -3.43 0.04 0.23 0.53 2.07 -1.26 -4.11 121.20 115.27 1p0b s ILE 66 Ca -0.08 -0.29 0.06 0.00 -1.41 0.00 0.00 60.65 58.93 1p0b s ILE 66 Cb 0.13 -0.84 -0.05 0.00 0.13 0.00 0.00 42.46 41.83 1p0b s ILE 66 CO 0.90 -0.16 -0.08 0.27 -1.91 0.00 0.00 174.94 173.96 1p0b s ILE 67 N -1.61 1.51 -0.10 2.00 -4.36 -1.16 -3.90 121.20 113.58 1p0b s ILE 67 Ca -0.10 -2.13 -0.03 0.00 -0.26 0.00 0.00 60.65 58.13 1p0b s ILE 67 Cb -0.02 -2.24 -0.03 0.00 1.25 0.00 0.00 42.46 41.41 1p0b s ILE 67 CO 0.04 -0.44 0.03 -0.22 0.24 0.00 0.00 174.94 174.59 1p0b s LEU 68 N -3.35 3.76 0.35 0.37 0.20 -0.24 -1.07 118.68 118.70 1p0b s LEU 68 Ca 0.26 0.20 0.09 0.00 0.69 0.00 0.00 54.13 55.37 1p0b s LEU 68 Cb 0.03 -1.88 -0.06 0.00 -0.43 0.00 0.00 46.19 43.84 1p0b s LEU 68 CO 0.08 0.37 -0.06 -0.83 -0.29 0.00 0.00 176.35 175.62 1p0b s GLY 69 N -0.81 2.17 -0.09 7.98 0.00 0.13 -2.20 107.32 114.50 1p0b s GLY 69 Ca 0.13 -2.07 0.01 0.00 0.00 0.00 0.00 44.72 42.79 1p0b s GLY 69 CO 0.03 -2.00 -0.11 -1.31 0.00 0.00 0.00 173.10 169.70 1p0b s ASN 70 N -3.64 2.10 0.18 1.64 0.02 -1.26 -0.89 114.94 113.08 1p0b s ASN 70 Ca 0.33 -0.34 -0.13 0.00 -1.02 0.00 0.00 52.86 51.71 1p0b s ASN 70 Cb 0.02 -0.91 0.14 0.00 0.02 0.00 0.00 41.25 40.53 1p0b s ASN 70 CO 0.17 -0.02 1.78 0.74 0.02 0.00 0.00 177.10 179.79 1p0b h THR 71 N 6.04 0.93 0.48 1.60 2.02 -1.71 -2.82 112.91 119.45 1p0b h THR 71 Ca -0.31 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 1p0b h THR 71 Cb 1.16 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 1p0b h THR 71 CO 0.46 0.09 -0.39 0.22 0.37 0.00 0.00 175.52 176.26 1p0b h TYR 72 N 0.47 -1.06 -0.65 3.16 3.20 -1.84 -1.50 116.97 118.76 1p0b h TYR 72 Ca 0.23 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.03 1p0b h TYR 72 Cb 0.16 0.40 -0.03 0.00 1.54 0.00 0.00 36.73 38.80 1p0b h TYR 72 CO -0.11 -0.56 0.14 0.45 -1.64 0.00 0.00 178.16 176.43 1p0b h HIS 73 N -0.86 1.12 0.00 -3.82 3.86 -1.92 -3.09 115.15 110.43 1p0b h HIS 73 Ca -0.05 -0.14 -0.11 0.00 -1.16 0.00 0.00 60.37 58.91 1p0b h HIS 73 Cb 0.74 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.89 1p0b h HIS 73 CO -0.18 0.93 -0.52 -0.07 0.86 0.00 0.00 177.93 178.95 1p0b h LEU 74 N 0.98 0.00 -1.15 2.43 3.38 -1.49 -0.38 115.31 119.07 1p0b h LEU 74 Ca 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 1p0b h LEU 74 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1p0b h LEU 74 CO 0.01 0.52 -0.20 0.00 0.09 0.00 0.00 178.44 178.86 1p0b h MET 75 N 0.00 0.00 0.05 1.13 -0.00 -1.19 0.13 114.93 115.05 1p0b h MET 75 Ca -0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.48 1p0b h MET 75 Cb 1.01 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.59 1p0b h MET 75 CO 0.07 0.20 -1.16 -0.07 -0.00 0.00 0.00 176.91 175.94 1p0b h LEU 76 N 0.00 0.15 -7.24 -0.10 3.38 -1.44 -3.37 115.31 106.70 1p0b h LEU 76 Ca -0.00 -0.73 -0.19 0.00 0.09 0.00 0.00 57.88 57.05 1p0b h LEU 76 Cb 0.72 -0.05 -0.31 0.00 0.09 0.00 0.00 40.66 41.11 1p0b h LEU 76 CO 0.03 1.48 -0.48 -0.60 0.09 0.00 0.00 178.44 178.96 1p0b s ARG 77 N -2.39 0.20 0.00 1.13 3.52 -0.18 -4.22 118.95 117.00 1p0b s ARG 77 Ca -0.24 0.71 0.30 0.00 -0.13 0.00 0.00 55.73 56.37 1p0b s ARG 77 Cb 0.04 -0.03 1.40 0.00 -1.56 0.00 0.00 34.95 34.80 1p0b s ARG 77 CO 0.68 -0.23 1.94 -0.35 -0.81 0.00 0.00 175.30 176.53 1p0b n PRO 78 N 4.90 1.31 0.00 5.12 -0.04 -1.23 -3.90 135.00 141.17 1p0b n PRO 78 Ca -0.14 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 62.80 1p0b n PRO 78 Cb 0.51 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 1p0b n PRO 78 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p0b n GLY 79 N 1.12 2.96 0.09 0.55 0.00 0.46 -4.71 105.19 105.65 1p0b n GLY 79 Ca 0.21 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 1p0b n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p0b h ALA 80 N 0.00 0.10 -0.71 4.61 0.00 -1.73 -1.81 119.26 119.72 1p0b h ALA 80 Ca 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1p0b h ALA 80 Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1p0b h ALA 80 CO 0.00 -0.15 0.41 0.93 0.00 0.00 0.00 179.25 180.45 1p0b h GLU 81 N -0.24 0.97 -0.29 0.00 3.07 -1.93 -0.97 114.58 115.20 1p0b h GLU 81 Ca 0.01 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 58.75 1p0b h GLU 81 Cb 0.49 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1p0b h GLU 81 CO 0.01 0.69 0.04 -0.09 -1.40 0.00 0.00 179.01 178.26 1p0b h ARG 82 N 0.98 0.48 -0.68 2.33 2.43 -1.82 -0.79 114.38 117.31 1p0b h ARG 82 Ca 0.25 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1p0b h ARG 82 Cb -0.02 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1p0b h ARG 82 CO -0.05 0.60 0.35 0.82 -1.51 0.00 0.00 179.97 180.18 1p0b h ILE 83 N 0.29 1.21 -0.33 1.20 2.04 -0.86 -1.18 117.51 119.88 1p0b h ILE 83 Ca 0.09 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 1p0b h ILE 83 Cb 0.35 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1p0b h ILE 83 CO 0.01 0.24 0.14 0.00 0.00 0.00 0.00 178.15 178.54 1p0b h ALA 84 N 1.45 0.42 -0.37 1.87 0.00 -0.84 0.57 119.26 122.36 1p0b h ALA 84 Ca 0.24 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1p0b h ALA 84 Cb 0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1p0b h ALA 84 CO -0.04 0.00 0.24 0.87 0.00 0.00 0.00 179.25 180.33 1p0b h LYS 85 N 0.38 0.46 -0.00 0.00 1.57 -0.53 -1.25 116.57 117.21 1p0b h LYS 85 Ca 0.11 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1p0b h LYS 85 Cb 0.15 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1p0b h LYS 85 CO -0.01 0.30 -0.02 1.28 -0.57 0.00 0.00 179.45 180.43 1p0b n LEU 86 N -4.48 0.47 0.00 2.94 4.77 -0.50 -4.90 117.00 115.29 1p0b n LEU 86 Ca 0.03 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1p0b n LEU 86 Cb 0.08 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1p0b n LEU 86 CO 0.35 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1p0b n GLY 87 N 1.11 0.87 0.00 -0.72 0.00 -0.47 -4.74 105.19 101.24 1p0b n GLY 87 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1p0b n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p0b n GLY 88 N -0.65 2.41 0.36 -0.02 0.00 0.15 -4.53 105.19 102.92 1p0b n GLY 88 Ca 0.00 -1.91 -0.04 0.00 0.00 0.00 0.00 46.02 44.07 1p0b n GLY 88 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p0b h LEU 89 N 0.00 1.13 0.04 0.99 5.85 -1.29 -1.23 115.31 120.81 1p0b h LEU 89 Ca 0.00 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.64 1p0b h LEU 89 Cb 0.00 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1p0b h LEU 89 CO 0.00 0.91 -0.19 0.45 -0.34 0.00 0.00 178.44 179.27 1p0b h HIS 90 N 1.27 -0.49 -0.55 1.25 3.86 -1.77 -0.08 115.15 118.63 1p0b h HIS 90 Ca 0.32 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.49 1p0b h HIS 90 Cb 0.02 0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1p0b h HIS 90 CO 0.01 -0.27 0.15 1.03 0.86 0.00 0.00 177.93 179.71 1p0b h SER 91 N -0.33 0.82 0.07 2.45 0.87 -1.77 0.19 113.55 115.85 1p0b h SER 91 Ca 0.04 -0.22 0.02 0.00 -1.23 0.00 0.00 61.79 60.40 1p0b h SER 91 Cb 0.38 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.09 1p0b h SER 91 CO -0.15 0.82 -0.25 0.15 -0.53 0.00 0.00 176.83 176.88 1p0b h PHE 92 N 0.77 -0.66 -0.01 2.24 3.57 -0.73 -3.07 116.94 119.06 1p0b h PHE 92 Ca 0.17 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1p0b h PHE 92 Cb 0.31 0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1p0b h PHE 92 CO 0.02 -0.34 -0.50 0.00 -2.23 0.00 0.00 178.31 175.26 1p0b n MET 93 N -5.37 0.51 -2.20 1.11 0.00 -0.09 -4.98 117.12 106.11 1p0b n MET 93 Ca -0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 57.70 57.28 1p0b n MET 93 Cb 0.28 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 32.01 1p0b n MET 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1p0b n GLY 94 N 1.43 0.51 3.11 3.17 0.00 0.60 -4.76 105.19 109.26 1p0b n GLY 94 Ca 0.08 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 1p0b n GLY 94 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1p0b s TRP 95 N -2.37 2.99 -2.16 1.61 -0.11 -0.71 -4.75 118.94 113.44 1p0b s TRP 95 Ca 0.01 -1.88 0.23 0.00 1.22 0.00 0.00 56.10 55.68 1p0b s TRP 95 Cb -0.00 -1.94 0.58 0.00 -1.50 0.00 0.00 33.47 30.61 1p0b s TRP 95 CO 0.01 -0.82 1.50 -0.40 -4.62 0.00 0.00 176.95 172.62 1p0b n ASP 96 N 4.56 3.80 -4.50 5.86 5.68 -1.26 -4.38 116.55 126.31 1p0b n ASP 96 Ca -0.18 -2.00 -0.18 0.00 -0.50 0.00 0.00 54.79 51.94 1p0b n ASP 96 Cb 0.47 -0.42 0.07 0.00 -1.14 0.00 0.00 41.12 40.10 1p0b n ASP 96 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1p0b n ARG 97 N 1.61 0.51 -1.75 0.11 1.74 -1.26 -4.88 116.66 112.75 1p0b n ARG 97 Ca 0.23 -2.66 -0.39 0.00 -0.77 0.00 0.00 57.85 54.26 1p0b n ARG 97 Cb 0.62 -0.29 0.04 0.00 -1.02 0.00 0.00 32.46 31.81 1p0b n ARG 97 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1p0b n PRO 98 N -2.22 1.71 -4.27 5.56 -0.02 -1.26 -4.95 135.00 129.55 1p0b n PRO 98 Ca 0.14 0.63 -0.20 0.00 -2.02 0.00 0.00 63.50 62.05 1p0b n PRO 98 Cb 0.52 -2.59 -0.16 0.00 -0.02 0.00 0.00 33.50 31.26 1p0b n PRO 98 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1p0b s ILE 99 N -1.28 0.66 -0.16 4.25 1.01 -1.26 -2.96 121.20 121.45 1p0b s ILE 99 Ca 0.72 -0.23 -0.06 0.00 0.00 0.00 0.00 60.65 61.08 1p0b s ILE 99 Cb -0.42 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.38 1p0b s ILE 99 CO 0.49 0.24 0.04 -0.22 0.00 0.00 0.00 174.94 175.49 1p0b s LEU 100 N 0.64 3.71 -0.15 2.97 0.20 -0.23 -1.45 118.68 124.36 1p0b s LEU 100 Ca -0.09 0.07 -0.03 0.00 0.69 0.00 0.00 54.13 54.77 1p0b s LEU 100 Cb -0.13 -1.92 -0.02 0.00 -0.43 0.00 0.00 46.19 43.69 1p0b s LEU 100 CO 0.01 0.21 -0.06 0.42 -0.29 0.00 0.00 176.35 176.64 1p0b s THR 101 N 0.13 3.71 0.64 3.68 -4.23 -0.53 0.19 115.64 119.24 1p0b s THR 101 Ca 0.03 -0.42 -0.13 0.00 -1.18 0.00 0.00 61.69 59.99 1p0b s THR 101 Cb -0.13 -2.61 -0.01 0.00 1.34 0.00 0.00 72.50 71.09 1p0b s THR 101 CO 0.01 0.50 1.06 -0.62 -0.54 0.00 0.00 174.62 175.03 1p0b s ASP 102 N 0.35 5.58 0.19 3.99 -1.08 -0.07 -3.07 116.67 122.56 1p0b s ASP 102 Ca -0.06 1.73 0.26 0.00 -0.52 0.00 0.00 52.55 53.97 1p0b s ASP 102 Cb -0.15 -2.52 0.85 0.00 -1.46 0.00 0.00 42.92 39.64 1p0b s ASP 102 CO 0.04 -1.31 1.79 -1.54 0.52 0.00 0.00 175.17 174.67 1p0b n SER 103 N -2.54 0.75 0.00 -0.34 3.41 -1.26 -2.03 113.62 111.61 1p0b n SER 103 Ca 0.08 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 1p0b n SER 103 Cb 0.53 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1p0b n SER 103 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p0b n GLY 104 N 1.30 1.12 0.41 5.00 0.00 -1.26 -4.70 105.19 107.07 1p0b n GLY 104 Ca 0.06 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.28 1p0b n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1p0b h GLY 105 N 0.00 0.82 0.00 -0.02 0.00 -1.90 -1.56 103.07 100.41 1p0b h GLY 105 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 47.33 47.07 1p0b h GLY 105 CO 0.00 -0.02 -0.77 -1.82 0.00 0.00 0.00 176.54 173.93 1p0b h TYR 106 N 0.36 0.00 -0.90 5.60 3.20 -1.92 -3.38 116.97 119.94 1p0b h TYR 106 Ca 0.48 0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.48 1p0b h TYR 106 Cb 1.28 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 39.48 1p0b h TYR 106 CO -0.00 0.59 0.58 1.96 -1.64 0.00 0.00 178.16 179.64 1p0b h GLN 107 N -1.00 0.75 -0.05 1.82 1.08 -1.95 -2.32 115.11 113.44 1p0b h GLN 107 Ca -0.13 -0.04 0.01 0.00 -1.45 0.00 0.00 58.65 57.04 1p0b h GLN 107 Cb 0.80 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 28.06 1p0b h GLN 107 CO -0.08 0.49 0.04 0.28 -0.95 0.00 0.00 178.83 178.61 1p0b h VAL 108 N 0.77 0.83 0.00 -0.54 2.07 -1.51 -0.48 116.25 117.39 1p0b h VAL 108 Ca 0.44 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.96 1p0b h VAL 108 Cb 0.62 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1p0b h VAL 108 CO -0.21 0.00 -0.92 0.23 0.02 0.00 0.00 177.57 176.69 1p0b n MET 109 N -4.31 0.10 -0.07 1.57 2.81 -0.90 -3.50 117.12 112.83 1p0b n MET 109 Ca -0.02 -0.01 -0.14 0.00 -1.81 0.00 0.00 57.70 55.72 1p0b n MET 109 Cb 0.14 -1.52 -0.14 0.00 -0.71 0.00 0.00 33.22 30.98 1p0b n MET 109 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1p0b n SER 110 N -1.65 1.09 -0.00 7.83 7.64 -0.53 -4.69 113.62 123.31 1p0b n SER 110 Ca 0.04 0.11 0.04 0.00 1.01 0.00 0.00 58.87 60.06 1p0b n SER 110 Cb 0.37 0.05 -0.06 0.00 -1.01 0.00 0.00 64.21 63.55 1p0b n SER 110 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1p0b n LEU 111 N -3.08 0.01 -4.76 -3.43 4.77 -0.30 -5.04 117.00 105.16 1p0b n LEU 111 Ca -0.32 -0.01 -0.38 0.00 -0.03 0.00 0.00 56.01 55.27 1p0b n LEU 111 Cb 1.07 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.17 1p0b n LEU 111 CO 0.39 0.00 0.91 -0.55 -1.33 0.00 0.00 177.39 176.82 1p0b s SER 112 N -2.91 5.91 0.00 -1.43 0.15 -1.23 -4.88 113.70 109.30 1p0b s SER 112 Ca -0.03 2.54 -0.02 0.00 0.70 0.00 0.00 55.95 59.14 1p0b s SER 112 Cb 0.05 -2.62 -0.01 0.00 -1.71 0.00 0.00 66.02 61.73 1p0b s SER 112 CO 0.34 -1.12 0.78 0.28 1.20 0.00 0.00 173.24 174.72 1p0b h SER 113 N 2.01 -0.07 -4.40 5.45 0.02 -1.48 -3.45 113.55 111.62 1p0b h SER 113 Ca -0.50 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 59.77 1p0b h SER 113 Cb 1.26 0.02 -0.28 0.00 0.14 0.00 0.00 62.40 63.55 1p0b h SER 113 CO 0.60 -0.04 -0.88 -0.76 -1.14 0.00 0.00 176.83 174.61 1p0b s LEU 114 N -4.47 2.13 0.08 5.07 2.01 -1.25 -5.00 118.68 117.25 1p0b s LEU 114 Ca -0.01 -0.54 0.03 0.00 0.01 0.00 0.00 54.13 53.62 1p0b s LEU 114 Cb 0.00 -1.27 -0.03 0.00 0.01 0.00 0.00 46.19 44.90 1p0b s LEU 114 CO 0.04 0.27 -0.09 0.42 1.01 0.00 0.00 176.35 177.99 1p0b s THR 115 N -0.73 0.83 -0.20 5.49 -4.23 -1.26 -2.44 115.64 113.10 1p0b s THR 115 Ca 0.11 -1.56 -0.03 0.00 -1.18 0.00 0.00 61.69 59.03 1p0b s THR 115 Cb -0.10 -1.24 0.06 0.00 1.34 0.00 0.00 72.50 72.56 1p0b s THR 115 CO 0.01 -0.55 0.04 -0.75 -0.54 0.00 0.00 174.62 172.83 1p0b s LYS 116 N -2.65 0.64 -0.03 3.99 2.20 -0.35 -4.99 119.74 118.54 1p0b s LYS 116 Ca 0.03 -0.46 -0.12 0.00 -0.36 0.00 0.00 55.97 55.06 1p0b s LYS 116 Cb -0.03 -2.08 -0.05 0.00 -1.51 0.00 0.00 37.83 34.15 1p0b s LYS 116 CO -0.01 -0.67 0.32 -0.65 -0.36 0.00 0.00 175.35 173.99 1p0b s GLN 117 N 1.85 3.75 0.29 4.03 -0.21 -1.26 -1.55 119.66 126.56 1p0b s GLN 117 Ca -0.00 0.22 -0.14 0.00 0.02 0.00 0.00 55.36 55.46 1p0b s GLN 117 Cb -0.17 -3.19 0.01 0.00 1.00 0.00 0.00 33.01 30.66 1p0b s GLN 117 CO -0.10 0.71 0.59 -1.54 -2.12 0.00 0.00 175.29 172.83 1p0b s SER 118 N -1.13 -0.01 0.51 5.90 1.04 -0.39 -5.02 113.70 114.61 1p0b s SER 118 Ca 0.22 -0.94 0.15 0.00 0.48 0.00 0.00 55.95 55.86 1p0b s SER 118 Cb -0.15 0.67 1.21 0.00 0.10 0.00 0.00 66.02 67.86 1p0b s SER 118 CO 0.11 -1.29 2.13 -0.08 0.98 0.00 0.00 173.24 175.09 1p0b h GLU 119 N 2.13 0.05 -0.05 4.02 4.57 -2.02 -2.17 114.58 121.11 1p0b h GLU 119 Ca -0.25 -0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.79 1p0b h GLU 119 Cb 1.25 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.81 1p0b h GLU 119 CO 0.33 0.04 -0.60 1.49 -1.18 0.00 0.00 179.01 179.10 1p0b h GLU 120 N 0.05 0.16 0.00 1.92 4.57 -1.98 -3.50 114.58 115.80 1p0b h GLU 120 Ca 0.01 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1p0b h GLU 120 Cb 0.01 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1p0b h GLU 120 CO -0.00 0.70 0.00 0.41 -1.18 0.00 0.00 179.01 178.94 1p0b n GLY 121 N 0.22 -0.24 2.97 1.92 0.00 -0.82 -4.41 105.19 104.83 1p0b n GLY 121 Ca -0.02 -0.96 -0.23 0.00 0.00 0.00 0.00 46.02 44.81 1p0b n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p0b s VAL 122 N -3.96 0.93 0.05 1.61 0.11 0.12 -1.26 120.40 118.01 1p0b s VAL 122 Ca 0.00 -0.35 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 1p0b s VAL 122 Cb 0.00 -0.89 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1p0b s VAL 122 CO 0.00 0.31 0.13 0.42 -3.33 0.00 0.00 175.10 172.64 1p0b s THR 123 N 0.83 4.94 0.24 5.04 -4.23 -0.60 0.09 115.64 121.96 1p0b s THR 123 Ca -0.12 -0.53 -0.22 0.00 -1.18 0.00 0.00 61.69 59.64 1p0b s THR 123 Cb -0.15 -3.37 0.03 0.00 1.34 0.00 0.00 72.50 70.35 1p0b s THR 123 CO 0.02 0.18 0.77 0.72 -0.54 0.00 0.00 174.62 175.77 1p0b s PHE 124 N -1.40 -0.20 -0.01 3.99 -0.71 0.37 -1.22 117.98 118.81 1p0b s PHE 124 Ca 0.30 -0.21 0.07 0.00 -1.04 0.00 0.00 56.93 56.05 1p0b s PHE 124 Cb -0.12 0.68 -0.02 0.00 -1.21 0.00 0.00 43.02 42.35 1p0b s PHE 124 CO 0.23 -1.12 -0.21 0.15 -1.34 0.00 0.00 175.22 172.93 1p0b s LYS 125 N -3.75 1.65 0.00 1.99 1.02 -1.02 0.19 119.74 119.81 1p0b s LYS 125 Ca 0.11 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.32 1p0b s LYS 125 Cb -0.05 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.65 1p0b s LYS 125 CO 0.05 0.44 0.00 0.45 -0.92 0.00 0.00 175.35 175.37 1p0b n SER 126 N 2.46 0.59 0.00 2.83 2.88 -1.26 -1.33 113.62 119.79 1p0b n SER 126 Ca -0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.39 1p0b n SER 126 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1p0b n SER 126 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1p0b n HIS 127 N 0.00 0.00 -4.40 0.66 -0.00 -1.26 -4.70 115.22 105.52 1p0b n HIS 127 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.38 1p0b n HIS 127 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 29.88 1p0b n HIS 127 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 1p0b s ARG 132 N 0.00 3.45 0.09 -0.41 3.52 -1.26 -4.91 118.95 119.43 1p0b s ARG 132 Ca 0.00 -0.49 0.05 0.00 -0.13 0.00 0.00 55.73 55.16 1p0b s ARG 132 Cb 0.00 -2.87 -0.03 0.00 -1.56 0.00 0.00 34.95 30.49 1p0b s ARG 132 CO 0.00 0.38 -0.13 -1.01 -0.81 0.00 0.00 175.30 173.73 1p0b s HIS 133 N -0.02 1.21 0.02 5.12 3.76 0.51 -4.93 115.29 120.95 1p0b s HIS 133 Ca 0.02 -0.53 0.07 0.00 -0.15 0.00 0.00 55.06 54.47 1p0b s HIS 133 Cb -0.13 -0.66 -0.03 0.00 1.11 0.00 0.00 32.58 32.87 1p0b s HIS 133 CO 0.02 0.06 -0.21 1.41 -0.85 0.00 0.00 174.74 175.18 1p0b s MET 134 N -2.24 2.08 -0.05 1.40 1.75 -1.26 0.14 119.30 121.12 1p0b s MET 134 Ca 0.02 -0.96 -0.02 0.00 -1.25 0.00 0.00 55.69 53.49 1p0b s MET 134 Cb -0.07 -2.13 0.03 0.00 2.84 0.00 0.00 34.83 35.50 1p0b s MET 134 CO 0.02 0.55 0.05 -1.17 -0.65 0.00 0.00 175.02 173.82 1p0b s LEU 135 N -1.12 0.25 0.36 4.11 2.96 0.11 -4.97 118.68 120.39 1p0b s LEU 135 Ca 0.12 0.05 0.03 0.00 -0.22 0.00 0.00 54.13 54.12 1p0b s LEU 135 Cb -0.10 -0.20 -0.04 0.00 0.50 0.00 0.00 46.19 46.35 1p0b s LEU 135 CO 0.02 -0.24 0.09 -0.94 -1.32 0.00 0.00 176.35 173.97 1p0b s SER 136 N 2.10 2.52 0.19 3.68 1.04 -1.26 0.14 113.70 122.10 1p0b s SER 136 Ca 0.05 -1.52 -0.12 0.00 0.48 0.00 0.00 55.95 54.84 1p0b s SER 136 Cb -0.12 0.23 0.19 0.00 0.10 0.00 0.00 66.02 66.41 1p0b s SER 136 CO -0.03 -0.77 1.78 -0.65 0.98 0.00 0.00 173.24 174.54 1p0b h PRO 137 N 1.96 0.48 -0.26 4.02 0.11 -1.90 0.83 132.00 137.24 1p0b h PRO 137 Ca -0.38 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 1p0b h PRO 137 Cb 1.26 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1p0b h PRO 137 CO 0.63 0.32 0.16 0.93 -0.21 0.00 0.00 178.00 179.83 1p0b h GLU 138 N 0.50 0.36 -0.29 1.05 3.07 -1.92 -1.38 114.58 115.97 1p0b h GLU 138 Ca 0.25 -0.03 -0.12 0.00 -0.50 0.00 0.00 59.36 58.96 1p0b h GLU 138 Cb 0.21 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1p0b h GLU 138 CO -0.20 0.28 -0.33 -0.09 -1.40 0.00 0.00 179.01 177.26 1p0b h ARG 139 N 0.34 0.63 -0.07 2.33 9.65 -1.87 -1.49 114.38 123.89 1p0b h ARG 139 Ca 0.10 -0.29 -0.00 0.00 -1.10 0.00 0.00 59.98 58.68 1p0b h ARG 139 Cb 0.01 -0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 28.57 1p0b h ARG 139 CO -0.02 0.88 0.03 1.03 2.80 0.00 0.00 179.97 184.69 1p0b h SER 140 N 0.53 0.10 -0.68 -3.80 0.87 -0.68 0.81 113.55 110.70 1p0b h SER 140 Ca 0.06 -0.17 0.01 0.00 -1.23 0.00 0.00 61.79 60.46 1p0b h SER 140 Cb 0.83 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.73 1p0b h SER 140 CO 0.07 0.25 0.45 0.40 -0.53 0.00 0.00 176.83 177.47 1p0b h ILE 141 N -0.04 1.17 -0.75 2.23 1.08 -1.19 -1.16 117.51 118.85 1p0b h ILE 141 Ca 0.02 -0.31 -0.05 0.00 -0.39 0.00 0.00 64.86 64.13 1p0b h ILE 141 Cb 0.18 0.17 -0.03 0.00 -3.07 0.00 0.00 36.82 34.07 1p0b h ILE 141 CO -0.00 0.17 0.25 -0.08 -0.69 0.00 0.00 178.15 177.80 1p0b h GLU 142 N 0.92 1.14 -0.52 2.37 4.81 -1.01 -0.76 114.58 121.53 1p0b h GLU 142 Ca 0.25 -0.23 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1p0b h GLU 142 Cb -0.10 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.08 1p0b h GLU 142 CO -0.06 0.96 0.19 0.82 -0.73 0.00 0.00 179.01 180.20 1p0b h ILE 143 N 1.10 1.22 -0.12 2.32 2.04 -0.42 0.27 117.51 123.92 1p0b h ILE 143 Ca 0.24 -0.70 -0.05 0.00 1.00 0.00 0.00 64.86 65.36 1p0b h ILE 143 Cb 0.28 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1p0b h ILE 143 CO -0.01 0.26 -0.15 1.56 0.00 0.00 0.00 178.15 179.81 1p0b h GLN 144 N 0.70 0.20 -0.17 2.37 4.20 -0.86 -0.15 115.11 121.40 1p0b h GLN 144 Ca 0.17 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 1p0b h GLN 144 Cb 0.22 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 1p0b h GLN 144 CO -0.01 0.35 -0.06 1.25 -0.67 0.00 0.00 178.83 179.70 1p0b h HIS 145 N 0.19 0.38 -0.48 2.96 2.76 -0.50 -1.42 115.15 119.04 1p0b h HIS 145 Ca 0.04 -0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.12 1p0b h HIS 145 Cb 0.38 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.23 1p0b h HIS 145 CO 0.00 0.62 0.29 -0.07 -1.30 0.00 0.00 177.93 177.48 1p0b h LEU 146 N 0.03 0.56 -0.85 0.26 3.38 -0.40 0.18 115.31 118.48 1p0b h LEU 146 Ca 0.04 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1p0b h LEU 146 Cb 0.51 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1p0b h LEU 146 CO 0.02 0.43 -0.13 -0.07 0.09 0.00 0.00 178.44 178.78 1p0b h LEU 147 N 0.66 0.00 -0.30 1.67 3.38 -0.91 -3.32 115.31 116.49 1p0b h LEU 147 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1p0b h LEU 147 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1p0b h LEU 147 CO -0.03 0.13 0.00 0.61 0.09 0.00 0.00 178.44 179.24 1p0b n GLY 148 N 0.45 0.68 3.76 0.83 0.00 0.05 -0.95 105.19 110.01 1p0b n GLY 148 Ca 0.01 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 44.91 1p0b n GLY 148 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p0b s SER 149 N -2.90 5.61 -0.13 1.61 0.15 -0.60 -4.88 113.70 112.56 1p0b s SER 149 Ca 0.00 2.89 -0.12 0.00 0.70 0.00 0.00 55.95 59.43 1p0b s SER 149 Cb 0.00 -2.65 -0.25 0.00 -1.71 0.00 0.00 66.02 61.41 1p0b s SER 149 CO 0.00 -1.35 0.39 0.44 1.20 0.00 0.00 173.24 173.92 1p0b h ASP 150 N 1.99 0.34 -3.75 5.45 5.19 -1.60 -3.44 116.42 120.60 1p0b h ASP 150 Ca -0.51 -0.84 -0.68 0.00 -0.62 0.00 0.00 57.03 54.38 1p0b h ASP 150 Cb 1.28 -0.11 -0.34 0.00 0.18 0.00 0.00 39.33 40.34 1p0b h ASP 150 CO 0.60 1.74 -0.75 -0.63 -3.12 0.00 0.00 179.24 177.08 1p0b s ILE 151 N -2.51 2.63 -0.09 0.35 1.01 -0.90 -0.50 121.20 121.20 1p0b s ILE 151 Ca -0.23 -1.42 -0.17 0.00 0.00 0.00 0.00 60.65 58.84 1p0b s ILE 151 Cb 0.06 -2.49 -0.05 0.00 0.01 0.00 0.00 42.46 39.99 1p0b s ILE 151 CO 0.74 -0.01 0.44 -0.69 0.00 0.00 0.00 174.94 175.42 1p0b s VAL 152 N 1.21 5.15 -0.10 2.92 1.01 0.33 -1.46 120.40 129.46 1p0b s VAL 152 Ca -0.06 0.89 -0.09 0.00 0.00 0.00 0.00 61.98 62.73 1p0b s VAL 152 Cb -0.19 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1p0b s VAL 152 CO -0.03 0.40 0.20 -0.04 0.00 0.00 0.00 175.10 175.62 1p0b s MET 153 N 0.14 3.56 0.68 2.72 -1.94 -1.17 -0.79 119.30 122.49 1p0b s MET 153 Ca 0.24 -0.02 -0.16 0.00 -1.71 0.00 0.00 55.69 54.05 1p0b s MET 153 Cb -0.15 -3.20 0.01 0.00 2.01 0.00 0.00 34.83 33.50 1p0b s MET 153 CO 0.11 0.75 1.18 0.00 -0.01 0.00 0.00 175.02 177.05 1p0b s ALA 154 N -1.01 2.30 -0.28 3.03 0.00 -0.56 -4.38 121.76 120.87 1p0b s ALA 154 Ca 0.17 0.83 -0.25 0.00 0.00 0.00 0.00 51.96 52.70 1p0b s ALA 154 Cb -0.13 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1p0b s ALA 154 CO 0.06 -1.56 0.88 0.12 0.00 0.00 0.00 175.76 175.26 1p0b s PHE 155 N -1.98 3.25 0.18 0.00 2.19 -1.26 -4.57 117.98 115.79 1p0b s PHE 155 Ca 0.73 1.07 0.01 0.00 0.33 0.00 0.00 56.93 59.07 1p0b s PHE 155 Cb -0.27 -3.24 -0.00 0.00 -1.31 0.00 0.00 43.02 38.20 1p0b s PHE 155 CO 0.41 -0.53 0.04 -0.40 1.83 0.00 0.00 175.22 176.57 1p0b n ASP 156 N 6.25 1.65 -3.97 6.13 5.75 -1.26 -4.35 116.55 126.75 1p0b n ASP 156 Ca 0.07 -1.90 -0.29 0.00 -0.01 0.00 0.00 54.79 52.66 1p0b n ASP 156 Cb 0.47 0.32 -0.17 0.00 -1.03 0.00 0.00 41.12 40.71 1p0b n ASP 156 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1p0b s GLU 157 N -2.68 1.98 -0.56 0.11 2.12 -1.26 -4.32 118.70 114.08 1p0b s GLU 157 Ca 0.05 -0.43 -0.23 0.00 0.36 0.00 0.00 54.97 54.72 1p0b s GLU 157 Cb 0.00 -1.89 0.05 0.00 0.26 0.00 0.00 34.13 32.55 1p0b s GLU 157 CO 0.04 -0.25 0.87 0.00 -0.54 0.00 0.00 175.26 175.39 1p0b s THR 159 N 3.67 2.38 0.78 0.00 2.01 -1.26 -4.97 115.64 118.25 1p0b s THR 159 Ca 0.25 0.22 -0.14 0.00 0.31 0.00 0.00 61.69 62.33 1p0b s THR 159 Cb -0.15 -3.14 0.07 0.00 0.01 0.00 0.00 72.50 69.29 1p0b s THR 159 CO 0.16 0.01 1.22 -2.84 -0.69 0.00 0.00 174.62 172.48 1p0b s PRO 160 N 1.46 1.80 -0.07 4.92 0.02 -1.26 -4.92 135.00 136.95 1p0b s PRO 160 Ca 0.74 1.79 0.04 0.00 0.02 0.00 0.00 61.00 63.58 1p0b s PRO 160 Cb -0.46 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.27 1p0b s PRO 160 CO 0.32 -2.10 -0.20 -0.47 -0.33 0.00 0.00 177.00 174.23 1p0b s TYR 161 N -2.05 2.11 0.81 6.54 5.04 -1.26 -3.76 117.35 124.78 1p0b s TYR 161 Ca 0.74 -0.77 -0.12 0.00 -2.44 0.00 0.00 57.07 54.49 1p0b s TYR 161 Cb -0.30 -1.43 0.08 0.00 0.35 0.00 0.00 41.96 40.66 1p0b s TYR 161 CO 0.49 -0.30 1.16 -1.25 -1.34 0.00 0.00 175.55 174.31 1p0b s PRO 162 N 0.28 2.00 -0.03 4.97 0.04 -1.26 -4.86 135.00 136.14 1p0b s PRO 162 Ca -0.13 0.19 -0.04 0.00 0.04 0.00 0.00 61.00 61.06 1p0b s PRO 162 Cb -0.16 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1p0b s PRO 162 CO 0.06 -1.59 0.11 0.00 0.04 0.00 0.00 177.00 175.62 1p0b s ALA 163 N -3.51 -0.27 0.65 8.56 0.00 -1.25 -5.12 121.76 120.83 1p0b s ALA 163 Ca 0.62 0.21 -0.15 0.00 0.00 0.00 0.00 51.96 52.64 1p0b s ALA 163 Cb -0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 22.87 1p0b s ALA 163 CO 0.50 -0.08 1.11 0.95 0.00 0.00 0.00 175.76 178.24 1p0b s THR 164 N -0.22 3.27 0.33 0.00 -4.23 -1.26 -4.77 115.64 108.75 1p0b s THR 164 Ca -0.03 0.60 0.06 0.00 -1.18 0.00 0.00 61.69 61.13 1p0b s THR 164 Cb -0.02 -3.12 0.30 0.00 1.34 0.00 0.00 72.50 71.00 1p0b s THR 164 CO 0.00 -0.36 1.87 -0.65 -0.54 0.00 0.00 174.62 174.95 1p0b h PRO 165 N 0.09 0.80 -0.16 3.99 0.11 -2.00 0.58 132.00 135.40 1p0b h PRO 165 Ca -0.47 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1p0b h PRO 165 Cb 1.25 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1p0b h PRO 165 CO 0.54 0.53 0.03 1.03 -0.21 0.00 0.00 178.00 179.93 1p0b h SER 166 N 0.82 0.25 -0.55 -2.05 0.87 -1.99 -0.23 113.55 110.68 1p0b h SER 166 Ca 0.44 -0.24 -0.11 0.00 -1.23 0.00 0.00 61.79 60.65 1p0b h SER 166 Cb 0.56 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 1p0b h SER 166 CO -0.21 0.43 -0.10 0.03 -0.53 0.00 0.00 176.83 176.44 1p0b h ARG 167 N 0.06 1.04 -0.75 2.24 2.47 -1.79 -1.60 114.38 116.06 1p0b h ARG 167 Ca 0.05 -0.38 -0.06 0.00 -1.26 0.00 0.00 59.98 58.33 1p0b h ARG 167 Cb 0.28 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.50 1p0b h ARG 167 CO 0.00 1.08 0.24 0.00 0.56 0.00 0.00 179.97 181.84 1p0b h ALA 168 N 0.93 0.98 -0.01 0.04 0.00 -0.84 -1.23 119.26 119.13 1p0b h ALA 168 Ca 0.14 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1p0b h ALA 168 Cb 0.68 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1p0b h ALA 168 CO 0.05 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.96 1p0b h ALA 169 N 1.12 0.02 -0.73 0.00 0.00 -0.82 -0.65 119.26 118.20 1p0b h ALA 169 Ca 0.24 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.09 1p0b h ALA 169 Cb 0.30 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 1p0b h ALA 169 CO -0.01 -0.37 0.44 0.77 0.00 0.00 0.00 179.25 180.08 1p0b h SER 170 N -0.19 0.70 -0.04 0.00 0.02 -1.20 0.59 113.55 113.43 1p0b h SER 170 Ca 0.00 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1p0b h SER 170 Cb 0.22 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 1p0b h SER 170 CO -0.00 0.47 0.01 -1.28 -1.14 0.00 0.00 176.83 174.89 1p0b h SER 171 N 0.84 0.07 -0.55 3.07 0.87 -1.11 -1.84 113.55 114.90 1p0b h SER 171 Ca 0.31 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1p0b h SER 171 Cb 0.10 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 1p0b h SER 171 CO -0.15 0.28 0.36 -0.03 -0.53 0.00 0.00 176.83 176.76 1p0b h MET 172 N -0.14 0.73 -0.77 2.24 -1.53 -0.85 -0.72 114.93 113.88 1p0b h MET 172 Ca 0.01 -0.05 0.03 0.00 -3.44 0.00 0.00 59.70 56.25 1p0b h MET 172 Cb 0.24 -0.16 -0.04 0.00 -0.55 0.00 0.00 31.60 31.08 1p0b h MET 172 CO 0.00 0.49 0.50 0.93 0.14 0.00 0.00 176.91 178.97 1p0b h GLU 173 N 0.75 0.95 -0.37 0.39 5.08 -0.78 0.37 114.58 120.98 1p0b h GLU 173 Ca 0.20 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1p0b h GLU 173 Cb -0.08 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 28.94 1p0b h GLU 173 CO -0.04 0.63 0.15 -0.09 -1.00 0.00 0.00 179.01 178.66 1p0b h ARG 174 N 0.98 0.55 -0.90 2.33 2.43 -0.91 -1.99 114.38 116.87 1p0b h ARG 174 Ca 0.30 -0.10 0.08 0.00 -0.81 0.00 0.00 59.98 59.45 1p0b h ARG 174 Cb -0.02 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 29.37 1p0b h ARG 174 CO -0.10 0.52 0.55 0.77 -1.51 0.00 0.00 179.97 180.21 1p0b h SER 175 N 0.45 0.85 -0.27 -3.80 0.02 -0.17 0.78 113.55 111.41 1p0b h SER 175 Ca 0.12 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 61.00 1p0b h SER 175 Cb 0.18 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1p0b h SER 175 CO -0.01 0.52 -0.16 0.24 -1.14 0.00 0.00 176.83 176.28 1p0b h MET 176 N 0.97 0.71 -0.64 3.45 2.86 -0.58 0.41 114.93 122.12 1p0b h MET 176 Ca 0.41 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.71 1p0b h MET 176 Cb 0.25 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1p0b h MET 176 CO -0.20 0.84 0.06 0.00 1.06 0.00 0.00 176.91 178.67 1p0b h ARG 177 N 0.64 1.07 -0.02 1.72 3.08 -0.58 -2.13 114.38 118.16 1p0b h ARG 177 Ca 0.10 -0.30 -0.08 0.00 0.07 0.00 0.00 59.98 59.77 1p0b h ARG 177 Cb 0.64 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1p0b h ARG 177 CO 0.04 1.00 -0.38 -1.49 -1.07 0.00 0.00 179.97 178.08 1p0b h TRP 178 N 0.99 0.04 -0.65 3.04 6.55 -0.16 -2.12 115.95 123.65 1p0b h TRP 178 Ca 0.19 -0.01 -0.08 0.00 0.95 0.00 0.00 58.89 59.94 1p0b h TRP 178 Cb 0.48 -0.01 -0.03 0.00 -0.86 0.00 0.00 29.16 28.74 1p0b h TRP 178 CO 0.03 0.42 0.09 0.00 -1.05 0.00 0.00 178.44 177.94 1p0b h ALA 179 N 1.58 0.87 -0.47 1.49 0.00 0.37 0.22 119.26 123.32 1p0b h ALA 179 Ca 0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1p0b h ALA 179 Cb 0.69 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1p0b h ALA 179 CO 0.05 0.64 -0.02 -0.22 0.00 0.00 0.00 179.25 179.71 1p0b h LYS 180 N 1.00 0.83 -0.35 0.00 1.63 -1.13 -1.01 116.57 117.55 1p0b h LYS 180 Ca 0.20 -0.27 -0.07 0.00 -0.85 0.00 0.00 60.65 59.65 1p0b h LYS 180 Cb 0.45 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.00 1p0b h LYS 180 CO 0.01 0.89 -0.07 0.00 -3.45 0.00 0.00 179.45 176.84 1p0b h ARG 181 N 0.68 0.58 -0.33 1.90 3.08 -1.03 -1.93 114.38 117.33 1p0b h ARG 181 Ca 0.13 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1p0b h ARG 181 Cb 0.53 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1p0b h ARG 181 CO 0.03 0.65 0.00 0.77 -1.07 0.00 0.00 179.97 180.35 1p0b h SER 182 N 0.54 0.57 -0.19 7.04 0.02 -0.25 -1.51 113.55 119.77 1p0b h SER 182 Ca 0.10 -0.31 0.02 0.00 -0.84 0.00 0.00 61.79 60.77 1p0b h SER 182 Cb 0.45 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1p0b h SER 182 CO 0.02 0.74 0.06 -0.09 -1.14 0.00 0.00 176.83 176.42 1p0b h ARG 183 N 0.39 0.14 -0.69 3.45 9.65 -0.91 -1.14 114.38 125.26 1p0b h ARG 183 Ca 0.09 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.92 1p0b h ARG 183 Cb 0.44 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.96 1p0b h ARG 183 CO 0.02 0.09 0.24 -0.44 2.80 0.00 0.00 179.97 182.68 1p0b h ASP 184 N 0.14 0.99 -0.60 -3.80 3.32 -1.27 -0.36 116.42 114.84 1p0b h ASP 184 Ca 0.08 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1p0b h ASP 184 Cb 0.06 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1p0b h ASP 184 CO -0.09 0.92 0.27 0.00 -1.72 0.00 0.00 179.24 178.62 1p0b h ALA 185 N 1.11 0.78 -0.14 3.45 0.00 -1.08 -0.76 119.26 122.63 1p0b h ALA 185 Ca 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1p0b h ALA 185 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1p0b h ALA 185 CO -0.01 0.37 0.06 0.35 0.00 0.00 0.00 179.25 180.02 1p0b h PHE 186 N 0.83 0.21 0.00 0.00 3.04 -0.92 -2.90 116.94 117.21 1p0b h PHE 186 Ca 0.21 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.11 1p0b h PHE 186 Cb 0.15 -0.06 -0.00 0.00 2.56 0.00 0.00 35.95 38.59 1p0b h PHE 186 CO 0.00 0.27 -0.15 -0.44 -2.02 0.00 0.00 178.31 175.98 1p0b h ASP 187 N 0.09 0.00 1.25 0.41 3.32 -0.86 -2.72 116.42 117.90 1p0b h ASP 187 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1p0b h ASP 187 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1p0b h ASP 187 CO -0.00 0.15 0.00 0.28 -1.72 0.00 0.00 179.24 177.94 1p0b h SER 188 N 0.00 0.00 -3.44 6.45 0.02 -0.92 -3.39 113.55 112.27 1p0b h SER 188 Ca -0.00 0.00 -0.75 0.00 -0.84 0.00 0.00 61.79 60.20 1p0b h SER 188 Cb 0.42 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 62.69 1p0b h SER 188 CO 0.02 0.00 -0.23 -0.60 -1.14 0.00 0.00 176.83 174.88 1p0b s ARG 189 N -3.40 2.88 0.18 3.45 3.52 -1.02 -4.98 118.95 119.57 1p0b s ARG 189 Ca 0.05 -1.98 -0.26 0.00 -0.13 0.00 0.00 55.73 53.40 1p0b s ARG 189 Cb 0.09 -4.12 0.03 0.00 -1.56 0.00 0.00 34.95 29.39 1p0b s ARG 189 CO 0.55 -1.25 1.55 0.87 -0.81 0.00 0.00 175.30 176.20 1p0b h LYS 190 N 8.28 -0.09 -0.83 5.12 1.57 -1.83 0.06 116.57 128.85 1p0b h LYS 190 Ca -0.15 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.75 1p0b h LYS 190 Cb 1.06 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 33.31 1p0b h LYS 190 CO 0.87 -0.06 0.46 1.49 -0.57 0.00 0.00 179.45 181.64 1p0b h GLU 191 N -0.09 0.71 -0.11 3.15 4.81 -1.94 -0.62 114.58 120.49 1p0b h GLU 191 Ca 0.21 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1p0b h GLU 191 Cb 0.51 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 1p0b h GLU 191 CO -0.86 0.47 -0.11 0.37 -0.73 0.00 0.00 179.01 178.14 1p0b h GLN 192 N 0.73 0.26 -0.13 1.92 4.15 -1.52 -2.41 115.11 118.12 1p0b h GLN 192 Ca 0.42 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.69 1p0b h GLN 192 Cb 0.46 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.15 1p0b h GLN 192 CO -0.29 0.68 0.05 0.00 -1.93 0.00 0.00 178.83 177.34 1p0b h ALA 193 N 0.58 1.85 0.00 3.38 0.00 -0.63 0.26 119.26 124.70 1p0b h ALA 193 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1p0b h ALA 193 Cb 0.63 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1p0b h ALA 193 CO 0.03 0.13 -0.72 0.93 0.00 0.00 0.00 179.25 179.61 1p0b h GLU 194 N 0.17 0.00 0.00 0.00 5.08 -1.06 -3.40 114.58 115.37 1p0b h GLU 194 Ca 0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1p0b h GLU 194 Cb 0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1p0b h GLU 194 CO -0.00 0.00 -1.22 0.09 -1.00 0.00 0.00 179.01 176.88 1p0b n ASN 195 N -2.65 4.01 -4.81 1.42 3.02 -0.91 -4.76 115.26 110.58 1p0b n ASN 195 Ca 0.01 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.29 1p0b n ASN 195 Cb 0.52 1.03 -0.05 0.00 -0.61 0.00 0.00 39.78 40.68 1p0b n ASN 195 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p0b s ALA 196 N -2.24 4.05 0.27 5.41 0.00 0.06 -4.77 121.76 124.53 1p0b s ALA 196 Ca -0.02 -1.37 0.12 0.00 0.00 0.00 0.00 51.96 50.69 1p0b s ALA 196 Cb 0.02 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.66 1p0b s ALA 196 CO 0.18 -0.24 -0.20 0.00 0.00 0.00 0.00 175.76 175.49 1p0b s ALA 197 N -2.73 2.70 -0.10 0.00 0.00 0.35 -4.75 121.76 117.23 1p0b s ALA 197 Ca 0.30 -1.86 0.02 0.00 0.00 0.00 0.00 51.96 50.42 1p0b s ALA 197 Cb 0.01 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.89 1p0b s ALA 197 CO 0.18 0.28 -0.14 -1.17 0.00 0.00 0.00 175.76 174.90 1p0b s LEU 198 N -3.46 1.67 -0.10 0.00 0.20 -1.26 -0.51 118.68 115.23 1p0b s LEU 198 Ca 0.29 -0.39 -0.01 0.00 0.69 0.00 0.00 54.13 54.70 1p0b s LEU 198 Cb -0.05 -1.02 -0.03 0.00 -0.43 0.00 0.00 46.19 44.66 1p0b s LEU 198 CO 0.14 0.01 -0.03 -0.36 -0.29 0.00 0.00 176.35 175.83 1p0b s PHE 199 N 0.98 3.07 0.37 5.38 0.40 0.03 -0.97 117.98 127.23 1p0b s PHE 199 Ca -0.07 0.04 -0.01 0.00 -0.60 0.00 0.00 56.93 56.29 1p0b s PHE 199 Cb -0.15 -1.80 -0.04 0.00 0.51 0.00 0.00 43.02 41.54 1p0b s PHE 199 CO -0.01 0.32 0.60 0.20 0.70 0.00 0.00 175.22 177.03 1p0b s GLY 200 N -0.59 1.42 -0.17 4.36 0.00 -0.67 -1.50 107.32 110.17 1p0b s GLY 200 Ca 0.09 -0.80 0.01 0.00 0.00 0.00 0.00 44.72 44.03 1p0b s GLY 200 CO 0.02 -0.71 -0.17 -0.42 0.00 0.00 0.00 173.10 171.83 1p0b s ILE 201 N -2.38 1.84 0.14 0.90 1.01 -1.26 -0.31 121.20 121.13 1p0b s ILE 201 Ca 0.42 -0.86 -0.30 0.00 0.00 0.00 0.00 60.65 59.91 1p0b s ILE 201 Cb -0.10 -1.72 -0.07 0.00 0.01 0.00 0.00 42.46 40.59 1p0b s ILE 201 CO 0.37 0.45 1.06 -1.58 0.00 0.00 0.00 174.94 175.24 1p0b s GLN 202 N 1.37 4.61 0.00 2.79 0.74 0.58 -4.85 119.66 124.90 1p0b s GLN 202 Ca 0.04 1.62 0.00 0.00 0.05 0.00 0.00 55.36 57.07 1p0b s GLN 202 Cb -0.13 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.65 1p0b s GLN 202 CO -0.11 0.09 0.00 1.04 -0.55 0.00 0.00 175.29 175.75 1p0b n GLN 203 N 2.73 2.23 0.00 1.67 1.13 -1.26 -0.59 117.38 123.30 1p0b n GLN 203 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 1p0b n GLN 203 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.82 1p0b n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p0b n GLY 204 N 3.35 1.55 7.00 1.08 0.00 -1.26 -4.20 105.19 112.71 1p0b n GLY 204 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1p0b n GLY 204 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p0b n SER 205 N 0.00 0.00 -1.15 1.61 2.88 -1.26 -2.31 113.62 113.38 1p0b n SER 205 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 1p0b n SER 205 Cb 0.00 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 63.74 1p0b n SER 205 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1p0b n VAL 206 N 0.00 1.80 -3.38 2.46 0.24 -1.26 -4.94 118.33 113.25 1p0b n VAL 206 Ca 0.00 -1.36 -0.39 0.00 -2.04 0.00 0.00 64.34 60.55 1p0b n VAL 206 Cb 0.00 0.09 -0.09 0.00 -1.47 0.00 0.00 33.84 32.37 1p0b n VAL 206 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1p0b s PHE 207 N -1.96 3.26 0.17 6.34 0.08 -0.98 -4.92 117.98 119.97 1p0b s PHE 207 Ca 0.42 0.45 -0.15 0.00 0.12 0.00 0.00 56.93 57.77 1p0b s PHE 207 Cb 0.28 -2.58 0.12 0.00 -0.57 0.00 0.00 43.02 40.28 1p0b s PHE 207 CO 0.17 -0.20 1.72 1.49 -0.10 0.00 0.00 175.22 178.30 1p0b h GLU 208 N 8.05 0.21 -0.66 0.44 4.81 -1.93 -0.59 114.58 124.91 1p0b h GLU 208 Ca -0.32 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.87 1p0b h GLU 208 Cb 1.16 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.46 1p0b h GLU 208 CO 0.66 0.14 0.31 -2.95 -0.73 0.00 0.00 179.01 176.44 1p0b h ASN 209 N 0.22 0.85 -0.36 1.04 -1.07 -1.95 0.24 115.58 114.55 1p0b h ASN 209 Ca 0.20 -0.09 -0.15 0.00 0.07 0.00 0.00 56.30 56.34 1p0b h ASN 209 Cb 0.25 -0.22 -0.01 0.00 -2.07 0.00 0.00 38.32 36.28 1p0b h ASN 209 CO -0.27 0.72 -0.35 -0.07 0.07 0.00 0.00 177.43 177.54 1p0b h LEU 210 N 0.94 0.94 -0.81 6.14 4.07 -1.76 -1.29 115.31 123.54 1p0b h LEU 210 Ca 0.23 -0.46 -0.01 0.00 0.08 0.00 0.00 57.88 57.71 1p0b h LEU 210 Cb 0.10 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.54 1p0b h LEU 210 CO -0.03 1.21 0.46 0.03 -1.08 0.00 0.00 178.44 179.03 1p0b h ARG 211 N 0.68 1.11 -0.16 1.13 2.47 -0.55 -0.77 114.38 118.29 1p0b h ARG 211 Ca 0.06 -0.12 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 1p0b h ARG 211 Cb 0.94 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 29.03 1p0b h ARG 211 CO 0.09 0.81 0.07 0.37 0.56 0.00 0.00 179.97 181.87 1p0b h GLN 212 N 1.11 0.23 -0.88 0.04 5.75 -0.78 0.99 115.11 121.59 1p0b h GLN 212 Ca 0.29 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.75 1p0b h GLN 212 Cb 0.01 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.47 1p0b h GLN 212 CO -0.05 0.28 0.57 1.96 -2.65 0.00 0.00 178.83 178.94 1p0b h GLN 213 N 0.12 1.16 -0.09 1.69 4.20 -0.98 -0.14 115.11 121.08 1p0b h GLN 213 Ca 0.05 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1p0b h GLN 213 Cb 0.13 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.65 1p0b h GLN 213 CO -0.01 0.78 -0.04 1.03 -0.67 0.00 0.00 178.83 179.93 1p0b h SER 214 N 1.19 0.19 -0.46 1.46 0.87 -0.86 -0.79 113.55 115.14 1p0b h SER 214 Ca 0.32 -0.40 0.05 0.00 -1.23 0.00 0.00 61.79 60.53 1p0b h SER 214 Cb -0.12 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 61.75 1p0b h SER 214 CO -0.07 0.54 0.21 0.00 -0.53 0.00 0.00 176.83 176.99 1p0b h ALA 215 N 0.65 0.58 -0.54 6.23 0.00 -0.48 -0.85 119.26 124.84 1p0b h ALA 215 Ca 0.02 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1p0b h ALA 215 Cb 0.47 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1p0b h ALA 215 CO 0.01 -0.15 0.25 -0.44 0.00 0.00 0.00 179.25 178.92 1p0b h ASP 216 N 0.43 0.71 -0.59 0.00 3.32 -0.96 -0.47 116.42 118.85 1p0b h ASP 216 Ca 0.21 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1p0b h ASP 216 Cb 0.14 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1p0b h ASP 216 CO -0.16 0.65 0.33 0.00 -1.72 0.00 0.00 179.24 178.34 1p0b h ALA 217 N 1.09 0.76 -0.41 3.45 0.00 -0.64 -0.16 119.26 123.36 1p0b h ALA 217 Ca 0.19 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1p0b h ALA 217 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1p0b h ALA 217 CO -0.02 0.27 0.10 -0.07 0.00 0.00 0.00 179.25 179.53 1p0b h LEU 218 N 0.80 0.62 -0.96 0.00 4.07 -0.97 -2.03 115.31 116.84 1p0b h LEU 218 Ca 0.21 -0.23 -0.09 0.00 0.08 0.00 0.00 57.88 57.85 1p0b h LEU 218 Cb 0.03 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 1p0b h LEU 218 CO -0.03 0.69 -0.23 0.00 -1.08 0.00 0.00 178.44 177.78 1p0b h ALA 219 N 0.96 1.12 -0.71 1.53 0.00 -0.86 0.12 119.26 121.42 1p0b h ALA 219 Ca 0.13 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1p0b h ALA 219 Cb 0.31 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1p0b h ALA 219 CO 0.00 0.55 0.30 1.49 0.00 0.00 0.00 179.25 181.59 1p0b h GLU 220 N 0.43 1.06 -0.15 0.00 4.57 -0.77 -2.88 114.58 116.83 1p0b h GLU 220 Ca 0.07 -0.19 -0.08 0.00 -1.18 0.00 0.00 59.36 57.98 1p0b h GLU 220 Cb 0.64 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.05 1p0b h GLU 220 CO 0.05 0.87 -0.23 0.82 -1.18 0.00 0.00 179.01 179.33 1p0b h ILE 221 N 1.02 1.35 -0.43 2.32 2.04 -1.00 -3.50 117.51 119.32 1p0b h ILE 221 Ca 0.24 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1p0b h ILE 221 Cb 0.19 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1p0b h ILE 221 CO -0.02 0.43 0.00 0.61 0.00 0.00 0.00 178.15 179.17 1p0b n GLY 222 N 0.33 -0.81 3.20 5.37 0.00 0.39 -5.11 105.19 108.55 1p0b n GLY 222 Ca -0.06 -1.02 -0.12 0.00 0.00 0.00 0.00 46.02 44.82 1p0b n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p0b s PHE 223 N -0.00 1.03 -0.17 1.61 0.08 -1.26 -5.01 117.98 114.25 1p0b s PHE 223 Ca 0.00 -1.10 0.22 0.00 0.12 0.00 0.00 56.93 56.17 1p0b s PHE 223 Cb 0.00 -0.59 0.50 0.00 -0.57 0.00 0.00 43.02 42.36 1p0b s PHE 223 CO 0.00 -0.33 1.65 -0.44 -0.10 0.00 0.00 175.22 176.00 1p0b h ASP 224 N 2.79 0.00 -5.05 1.36 3.32 -1.45 -3.47 116.42 113.93 1p0b h ASP 224 Ca -0.36 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.67 1p0b h ASP 224 Cb 1.20 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.63 1p0b h ASP 224 CO 0.62 0.20 0.08 -0.83 -1.72 0.00 0.00 179.24 177.58 1p0b s GLY 225 N -4.30 -0.34 -0.12 2.75 0.00 -1.23 -4.29 107.32 99.79 1p0b s GLY 225 Ca 0.04 0.09 0.00 0.00 0.00 0.00 0.00 44.72 44.86 1p0b s GLY 225 CO 0.67 -0.11 -0.11 -0.19 0.00 0.00 0.00 173.10 173.36 1p0b s TYR 226 N -3.81 1.77 0.09 1.90 1.51 -0.19 -1.66 117.35 116.95 1p0b s TYR 226 Ca 0.04 -0.90 -0.06 0.00 -1.01 0.00 0.00 57.07 55.14 1p0b s TYR 226 Cb -0.00 -1.36 -0.05 0.00 -0.11 0.00 0.00 41.96 40.43 1p0b s TYR 226 CO -0.09 -0.54 0.34 0.00 -1.11 0.00 0.00 175.55 174.16 1p0b s ALA 227 N 1.44 3.80 -0.42 3.71 0.00 0.58 -1.00 121.76 129.88 1p0b s ALA 227 Ca 0.02 -0.54 -0.12 0.00 0.00 0.00 0.00 51.96 51.31 1p0b s ALA 227 Cb -0.13 -2.13 0.05 0.00 0.00 0.00 0.00 23.12 20.91 1p0b s ALA 227 CO -0.07 0.65 0.28 0.08 0.00 0.00 0.00 175.76 176.70 1p0b s VAL 228 N -1.49 4.73 0.52 0.00 1.01 0.22 -0.31 120.40 125.08 1p0b s VAL 228 Ca 0.35 -1.04 0.05 0.00 0.00 0.00 0.00 61.98 61.34 1p0b s VAL 228 Cb -0.13 -3.76 0.04 0.00 0.00 0.00 0.00 36.38 32.53 1p0b s VAL 228 CO 0.21 -0.41 0.71 -0.83 0.00 0.00 0.00 175.10 174.78 1p0b s GLY 229 N 2.00 1.86 0.00 4.51 0.00 0.25 -2.64 107.32 113.30 1p0b s GLY 229 Ca 0.03 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.15 1p0b s GLY 229 CO 0.06 -1.32 0.00 0.61 0.00 0.00 0.00 173.10 172.45 1p0b n GLY 230 N -2.18 0.38 1.22 0.20 0.00 -1.26 -4.66 105.19 98.89 1p0b n GLY 230 Ca 0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.21 1p0b n GLY 230 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p0b n LEU 231 N 0.00 3.87 -1.91 0.99 4.77 -1.26 -4.35 117.00 119.11 1p0b n LEU 231 Ca 0.00 -2.11 -0.18 0.00 -0.03 0.00 0.00 56.01 53.69 1p0b n LEU 231 Cb 0.14 -0.45 0.05 0.00 -2.33 0.00 0.00 43.42 40.82 1p0b n LEU 231 CO 0.00 0.89 0.18 0.00 -1.33 0.00 0.00 177.39 177.13 1p0b n ALA 232 N 1.23 4.59 -2.40 -1.18 0.00 -1.26 -4.64 120.51 116.85 1p0b n ALA 232 Ca 0.22 -3.61 -0.15 0.00 0.00 0.00 0.00 53.44 49.89 1p0b n ALA 232 Cb 0.63 -0.38 0.03 0.00 0.00 0.00 0.00 19.45 19.73 1p0b n ALA 232 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1p0b n VAL 233 N -0.73 1.95 0.00 0.00 0.24 -1.26 -4.93 118.33 113.60 1p0b n VAL 233 Ca 0.37 -3.75 0.00 0.00 -2.04 0.00 0.00 64.34 58.92 1p0b n VAL 233 Cb 0.92 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.13 1p0b n VAL 233 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1p0b n GLY 234 N -0.60 1.82 3.77 7.63 0.00 -1.26 -4.22 105.19 112.33 1p0b n GLY 234 Ca 0.28 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.90 1p0b n GLY 234 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1p0b s GLU 235 N 0.00 4.21 0.79 1.61 1.03 -1.26 -5.01 118.70 120.07 1p0b s GLU 235 Ca 0.00 2.03 -0.12 0.00 0.03 0.00 0.00 54.97 56.92 1p0b s GLU 235 Cb 0.00 -2.89 0.07 0.00 -0.80 0.00 0.00 34.13 30.50 1p0b s GLU 235 CO 0.00 -0.25 1.11 0.20 -1.33 0.00 0.00 175.26 174.99 1p0b s GLY 236 N -0.80 1.62 0.22 -3.83 0.00 -1.26 -4.81 107.32 98.46 1p0b s GLY 236 Ca 0.53 -0.32 -0.09 0.00 0.00 0.00 0.00 44.72 44.84 1p0b s GLY 236 CO 0.46 0.12 1.85 -1.61 0.00 0.00 0.00 173.10 173.91 1p0b h GLN 237 N -1.04 0.85 -0.43 2.90 4.15 -1.99 -1.43 115.11 118.13 1p0b h GLN 237 Ca -0.47 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 58.96 1p0b h GLN 237 Cb 1.28 -0.19 -0.05 0.00 0.21 0.00 0.00 27.48 28.73 1p0b h GLN 237 CO 0.61 0.56 0.14 -0.44 -1.93 0.00 0.00 178.83 177.77 1p0b h ASP 238 N 0.87 0.12 -0.48 -0.69 5.19 -1.99 0.15 116.42 119.60 1p0b h ASP 238 Ca 0.31 0.06 -0.07 0.00 -0.62 0.00 0.00 57.03 56.70 1p0b h ASP 238 Cb 0.07 0.05 -0.02 0.00 0.18 0.00 0.00 39.33 39.62 1p0b h ASP 238 CO -0.13 0.10 0.02 -0.08 -3.12 0.00 0.00 179.24 176.03 1p0b h GLU 239 N 0.29 0.83 -0.24 3.56 4.57 -1.85 -1.18 114.58 120.58 1p0b h GLU 239 Ca 0.20 -0.26 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1p0b h GLU 239 Cb 0.21 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1p0b h GLU 239 CO -0.22 0.87 0.12 1.98 -1.18 0.00 0.00 179.01 180.58 1p0b h MET 240 N 0.69 0.33 -0.77 1.92 4.05 -0.77 -0.71 114.93 119.68 1p0b h MET 240 Ca 0.14 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.50 1p0b h MET 240 Cb 0.48 -0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.18 1p0b h MET 240 CO 0.02 0.32 0.42 0.74 0.23 0.00 0.00 176.91 178.65 1p0b h PHE 241 N 0.26 1.06 -0.64 1.39 0.04 -0.63 -0.16 116.94 118.27 1p0b h PHE 241 Ca 0.08 -0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.85 1p0b h PHE 241 Cb 0.09 -0.34 -0.04 0.00 2.20 0.00 0.00 35.95 37.87 1p0b h PHE 241 CO -0.03 0.74 0.40 -0.09 -0.60 0.00 0.00 178.31 178.73 1p0b h ARG 242 N 1.07 0.77 -0.43 1.51 2.43 -0.86 0.36 114.38 119.23 1p0b h ARG 242 Ca 0.27 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.27 1p0b h ARG 242 Cb 0.03 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1p0b h ARG 242 CO -0.04 0.51 -0.24 0.28 -1.51 0.00 0.00 179.97 178.97 1p0b h VAL 243 N 0.79 1.27 -0.50 0.20 2.07 -0.64 -2.82 116.25 116.63 1p0b h VAL 243 Ca 0.25 -1.38 -0.05 0.00 0.82 0.00 0.00 66.70 66.34 1p0b h VAL 243 Cb -0.00 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1p0b h VAL 243 CO -0.09 0.47 0.11 -0.07 0.02 0.00 0.00 177.57 178.01 1p0b h LEU 244 N 0.77 0.70 -0.71 2.57 3.38 -0.48 -0.48 115.31 121.06 1p0b h LEU 244 Ca 0.10 -0.12 0.16 0.00 0.09 0.00 0.00 57.88 58.10 1p0b h LEU 244 Cb 0.79 -0.18 -0.12 0.00 0.09 0.00 0.00 40.66 41.23 1p0b h LEU 244 CO 0.07 0.70 0.04 0.44 0.09 0.00 0.00 178.44 179.78 1p0b h ASP 245 N 0.73 -0.25 0.16 -0.43 3.32 -0.67 -2.06 116.42 117.22 1p0b h ASP 245 Ca 0.16 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.39 1p0b h ASP 245 Cb 0.28 0.29 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1p0b h ASP 245 CO -0.00 -0.13 -1.46 2.22 -1.72 0.00 0.00 179.24 178.15 1p0b n PHE 246 N -5.29 0.12 -0.01 4.55 1.16 -1.14 -4.57 117.46 112.28 1p0b n PHE 246 Ca 0.12 0.03 -0.17 0.00 -1.87 0.00 0.00 57.45 55.57 1p0b n PHE 246 Cb 0.44 -0.38 -0.14 0.00 -1.61 0.00 0.00 39.48 37.79 1p0b n PHE 246 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1p0b h SER 247 N 0.00 0.23 -0.90 5.98 0.02 -0.48 -3.36 113.55 115.05 1p0b h SER 247 Ca 0.00 -0.97 -0.02 0.00 -0.84 0.00 0.00 61.79 59.96 1p0b h SER 247 Cb 0.81 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.23 1p0b h SER 247 CO 0.00 1.21 0.50 0.58 -1.14 0.00 0.00 176.83 177.98 1p0b h VAL 248 N -0.68 1.26 0.00 2.27 2.07 -1.63 -2.06 116.25 117.47 1p0b h VAL 248 Ca -0.08 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1p0b h VAL 248 Cb 1.33 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1p0b h VAL 248 CO 0.07 0.29 0.00 -0.65 0.02 0.00 0.00 177.57 177.30 1p0b h PRO 249 N 1.26 0.00 0.00 1.57 0.11 -1.79 -1.18 132.00 131.97 1p0b h PRO 249 Ca 0.32 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.43 1p0b h PRO 249 Cb 0.01 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.12 1p0b h PRO 249 CO -0.05 0.00 -0.01 0.52 -0.21 0.00 0.00 178.00 178.25 1p0b h MET 250 N 0.00 0.00 -6.91 1.05 2.86 -1.51 -3.45 114.93 106.97 1p0b h MET 250 Ca 0.00 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.16 1p0b h MET 250 Cb 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1p0b h MET 250 CO 0.00 0.01 0.19 -0.51 1.06 0.00 0.00 176.91 177.66 1p0b s LEU 251 N -6.21 3.87 0.17 1.22 1.43 -0.45 -4.77 118.68 113.95 1p0b s LEU 251 Ca 0.04 1.34 -0.34 0.00 -1.03 0.00 0.00 54.13 54.15 1p0b s LEU 251 Cb 0.07 -4.21 -0.14 0.00 0.03 0.00 0.00 46.19 41.94 1p0b s LEU 251 CO 0.61 -0.37 1.50 -2.65 0.23 0.00 0.00 176.35 175.66 1p0b n PRO 252 N -0.99 1.97 -0.03 1.29 -0.02 -1.26 -4.88 135.00 131.08 1p0b n PRO 252 Ca 0.04 0.71 -0.06 0.00 -2.02 0.00 0.00 63.50 62.17 1p0b n PRO 252 Cb 0.54 -2.43 0.14 0.00 -0.02 0.00 0.00 33.50 31.73 1p0b n PRO 252 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1p0b h ASP 253 N 5.27 0.62 -0.10 2.55 1.82 -1.93 -3.18 116.42 121.48 1p0b h ASP 253 Ca -0.45 -0.23 0.00 0.00 -0.39 0.00 0.00 57.03 55.96 1p0b h ASP 253 Cb 1.27 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.11 1p0b h ASP 253 CO 0.84 0.88 0.00 -0.90 -1.61 0.00 0.00 179.24 178.44 1p0b n ASP 254 N -4.09 0.56 -4.38 2.28 3.85 -1.26 -4.83 116.55 108.68 1p0b n ASP 254 Ca -0.01 -2.00 -0.24 0.00 -0.71 0.00 0.00 54.79 51.83 1p0b n ASP 254 Cb 0.44 -0.08 -0.11 0.00 -1.35 0.00 0.00 41.12 40.02 1p0b n ASP 254 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1p0b s LYS 255 N -1.85 1.39 0.54 0.11 -0.14 -1.20 -4.87 119.74 113.72 1p0b s LYS 255 Ca 0.06 -1.47 -0.22 0.00 -1.36 0.00 0.00 55.97 52.98 1p0b s LYS 255 Cb 0.03 -1.56 -0.05 0.00 -1.68 0.00 0.00 37.83 34.57 1p0b s LYS 255 CO 0.04 0.33 1.36 -2.14 -0.76 0.00 0.00 175.35 174.18 1p0b s PRO 256 N -2.78 3.16 -0.22 -1.68 0.02 -1.26 -4.81 135.00 127.43 1p0b s PRO 256 Ca 0.18 2.24 -0.01 0.00 0.02 0.00 0.00 61.00 63.43 1p0b s PRO 256 Cb -0.07 -2.27 0.02 0.00 0.02 0.00 0.00 34.50 32.20 1p0b s PRO 256 CO 0.08 -1.18 -0.10 -1.01 -0.33 0.00 0.00 177.00 174.47 1p0b s HIS 257 N -1.30 2.97 -0.27 6.54 3.76 -1.26 -1.03 115.29 124.71 1p0b s HIS 257 Ca 0.71 -1.44 -0.02 0.00 -0.15 0.00 0.00 55.06 54.16 1p0b s HIS 257 Cb -0.41 -2.03 0.03 0.00 1.11 0.00 0.00 32.58 31.29 1p0b s HIS 257 CO 0.48 -0.71 -0.03 -0.47 -0.85 0.00 0.00 174.74 173.16 1p0b s TYR 258 N 1.35 3.13 -0.53 1.40 5.04 -0.17 0.32 117.35 127.89 1p0b s TYR 258 Ca 0.03 -1.60 -0.22 0.00 -2.44 0.00 0.00 57.07 52.84 1p0b s TYR 258 Cb -0.15 -2.09 0.05 0.00 0.35 0.00 0.00 41.96 40.12 1p0b s TYR 258 CO -0.06 -0.74 0.78 -1.17 -1.34 0.00 0.00 175.55 173.02 1p0b s LEU 259 N 1.32 4.53 0.13 6.97 2.96 -0.44 0.71 118.68 134.86 1p0b s LEU 259 Ca -0.01 -0.62 -0.31 0.00 -0.22 0.00 0.00 54.13 52.98 1p0b s LEU 259 Cb -0.18 -2.64 -0.07 0.00 0.50 0.00 0.00 46.19 43.80 1p0b s LEU 259 CO -0.03 -1.05 1.27 -0.04 -1.32 0.00 0.00 176.35 175.18 1p0b s MET 260 N 3.28 4.41 0.00 1.98 -1.94 -1.08 -3.60 119.30 122.34 1p0b s MET 260 Ca 0.23 1.93 0.00 0.00 -1.71 0.00 0.00 55.69 56.14 1p0b s MET 260 Cb -0.16 -3.27 0.00 0.00 2.01 0.00 0.00 34.83 33.42 1p0b s MET 260 CO 0.16 -0.27 0.00 0.41 -0.01 0.00 0.00 175.02 175.31 1p0b n GLY 261 N 2.89 0.29 3.59 -0.03 0.00 -1.08 -4.45 105.19 106.40 1p0b n GLY 261 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1p0b n GLY 261 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p0b s VAL 262 N -1.66 5.15 0.00 1.61 1.01 -0.76 -4.71 120.40 121.05 1p0b s VAL 262 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1p0b s VAL 262 Cb 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1p0b s VAL 262 CO 0.00 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1p0b n GLY 263 N 4.71 5.54 0.57 4.51 0.00 -1.26 -3.84 105.19 115.42 1p0b n GLY 263 Ca -0.08 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1p0b n GLY 263 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1p0b n LYS 264 N 0.00 0.00 -0.27 1.61 4.81 -1.26 -4.48 118.16 118.57 1p0b n LYS 264 Ca 0.00 0.40 -0.02 0.00 -0.87 0.00 0.00 58.31 57.82 1p0b n LYS 264 Cb 0.00 -0.18 0.04 0.00 0.02 0.00 0.00 35.03 34.92 1p0b n LYS 264 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1p0b h PRO 265 N 0.00 -0.07 0.00 1.64 0.11 -2.00 -0.76 132.00 130.92 1p0b h PRO 265 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.05 1p0b h PRO 265 Cb 0.00 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1p0b h PRO 265 CO 0.00 -0.05 -0.32 0.38 -0.21 0.00 0.00 178.00 177.81 1p0b h ASP 266 N -0.07 0.00 -0.35 -2.05 2.03 -2.00 -1.97 116.42 112.00 1p0b h ASP 266 Ca 0.31 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.57 1p0b h ASP 266 Cb 0.57 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.06 1p0b h ASP 266 CO -0.80 0.32 0.05 0.44 -1.03 0.00 0.00 179.24 178.22 1p0b h ASP 267 N 0.00 0.57 0.03 4.15 3.45 -1.39 -2.19 116.42 121.05 1p0b h ASP 267 Ca -0.00 -0.26 -0.00 0.00 0.43 0.00 0.00 57.03 57.19 1p0b h ASP 267 Cb 0.65 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.27 1p0b h ASP 267 CO 0.04 0.69 -0.01 0.40 -1.57 0.00 0.00 179.24 178.79 1p0b h ILE 268 N 0.43 1.02 -0.39 0.35 2.04 -0.95 0.17 117.51 120.18 1p0b h ILE 268 Ca 0.11 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.85 1p0b h ILE 268 Cb 0.37 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 1p0b h ILE 268 CO 0.01 0.04 0.14 0.58 0.00 0.00 0.00 178.15 178.92 1p0b h VAL 269 N -0.11 0.89 -0.23 1.67 2.07 -1.35 -0.21 116.25 118.98 1p0b h VAL 269 Ca -0.00 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 1p0b h VAL 269 Cb 0.10 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1p0b h VAL 269 CO 0.01 0.06 -0.08 1.23 0.02 0.00 0.00 177.57 178.80 1p0b h GLY 270 N 0.31 0.38 1.59 2.17 0.00 -1.16 -1.90 103.07 104.46 1p0b h GLY 270 Ca 0.18 -0.23 -0.19 0.00 0.00 0.00 0.00 47.33 47.09 1p0b h GLY 270 CO -0.18 0.22 -0.77 0.00 0.00 0.00 0.00 176.54 175.80 1p0b h ALA 271 N 1.58 0.55 -0.55 3.60 0.00 -0.30 -2.89 119.26 121.24 1p0b h ALA 271 Ca 0.07 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.26 1p0b h ALA 271 Cb 0.37 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1p0b h ALA 271 CO 0.02 0.78 -0.02 0.28 0.00 0.00 0.00 179.25 180.31 1p0b h VAL 272 N 0.26 1.26 0.00 0.00 2.07 -0.77 -0.79 116.25 118.28 1p0b h VAL 272 Ca -0.04 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.35 1p0b h VAL 272 Cb 1.36 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1p0b h VAL 272 CO 0.13 0.41 0.00 -0.33 0.02 0.00 0.00 177.57 177.80 1p0b h GLU 273 N 0.89 0.00 -0.51 1.57 5.08 -1.23 -1.41 114.58 118.97 1p0b h GLU 273 Ca 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1p0b h GLU 273 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1p0b h GLU 273 CO 0.03 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.58 1p0b n ARG 274 N -3.03 3.17 -0.15 2.33 1.74 -0.41 -4.20 116.66 116.11 1p0b n ARG 274 Ca -0.03 -2.57 0.00 0.00 -0.77 0.00 0.00 57.85 54.48 1p0b n ARG 274 Cb 0.09 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 1p0b n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p0b n GLY 275 N 0.78 0.92 3.80 -0.13 0.00 -0.53 -4.75 105.19 105.27 1p0b n GLY 275 Ca 0.20 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1p0b n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p0b s ILE 276 N -2.00 4.49 -0.09 -0.61 -1.09 -0.59 -4.67 121.20 116.63 1p0b s ILE 276 Ca 0.00 1.47 0.07 0.00 -2.23 0.00 0.00 60.65 59.96 1p0b s ILE 276 Cb 0.00 -3.98 -0.10 0.00 -1.58 0.00 0.00 42.46 36.80 1p0b s ILE 276 CO 0.00 0.35 0.19 0.47 -1.23 0.00 0.00 174.94 174.73 1p0b n ASP 277 N 1.13 2.62 -3.90 3.58 8.00 0.15 -4.41 116.55 123.71 1p0b n ASP 277 Ca -0.04 -0.16 -0.11 0.00 0.71 0.00 0.00 54.79 55.19 1p0b n ASP 277 Cb 0.50 1.25 -0.12 0.00 -0.02 0.00 0.00 41.12 42.73 1p0b n ASP 277 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1p0b s MET 278 N -2.30 0.22 0.03 -1.24 -1.94 -0.74 -0.52 119.30 112.82 1p0b s MET 278 Ca -0.01 -0.27 -0.02 0.00 -1.71 0.00 0.00 55.69 53.68 1p0b s MET 278 Cb 0.05 0.09 -0.02 0.00 2.01 0.00 0.00 34.83 36.95 1p0b s MET 278 CO 0.30 -0.04 0.02 -0.06 -0.01 0.00 0.00 175.02 175.22 1p0b s PHE 279 N -0.77 0.30 0.02 -0.03 0.40 0.10 -1.33 117.98 116.66 1p0b s PHE 279 Ca -0.08 -0.64 -0.16 0.00 -0.60 0.00 0.00 56.93 55.44 1p0b s PHE 279 Cb -0.05 -0.22 0.03 0.00 0.51 0.00 0.00 43.02 43.28 1p0b s PHE 279 CO -0.00 -0.30 0.35 0.16 0.70 0.00 0.00 175.22 176.13 1p0b s ASP 280 N -2.05 -0.21 0.00 1.36 -4.77 -1.25 -0.07 116.67 109.69 1p0b s ASP 280 Ca -0.06 -0.00 0.00 0.00 -3.30 0.00 0.00 52.55 49.18 1p0b s ASP 280 Cb -0.02 0.36 0.00 0.00 -1.09 0.00 0.00 42.92 42.17 1p0b s ASP 280 CO -0.04 -0.56 0.00 0.00 0.70 0.00 0.00 175.17 175.26 1p0b n VAL 282 N -0.17 0.00 -0.12 0.00 0.24 -1.26 -4.36 118.33 112.67 1p0b n VAL 282 Ca 0.00 -0.11 -0.10 0.00 -2.04 0.00 0.00 64.34 62.08 1p0b n VAL 282 Cb 0.00 0.15 -0.05 0.00 -1.47 0.00 0.00 33.84 32.47 1p0b n VAL 282 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1p0b h LEU 283 N 1.07 -1.44 -0.52 1.34 6.46 -1.96 0.24 115.31 120.49 1p0b h LEU 283 Ca 0.00 0.22 0.10 0.00 -0.12 0.00 0.00 57.88 58.08 1p0b h LEU 283 Cb 0.41 0.63 -0.10 0.00 -0.73 0.00 0.00 40.66 40.87 1p0b h LEU 283 CO 0.00 -0.38 -0.13 -0.65 -0.62 0.00 0.00 178.44 176.67 1p0b h PRO 284 N -0.34 0.00 0.23 5.25 0.11 -1.93 0.25 132.00 135.56 1p0b h PRO 284 Ca 0.13 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1p0b h PRO 284 Cb 0.59 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1p0b h PRO 284 CO -0.56 0.00 -0.11 1.79 -0.21 0.00 0.00 178.00 178.91 1p0b h THR 285 N 0.00 0.40 -0.36 -1.15 1.35 -1.77 -2.41 112.91 108.98 1p0b h THR 285 Ca 0.25 -0.94 0.03 0.00 -0.55 0.00 0.00 66.41 65.19 1p0b h THR 285 Cb 0.38 0.68 -0.03 0.00 -1.73 0.00 0.00 68.15 67.45 1p0b h THR 285 CO -0.53 0.11 0.17 -0.09 -0.25 0.00 0.00 175.52 174.93 1p0b h ARG 286 N -1.01 0.34 -0.31 4.72 2.43 -0.49 -1.75 114.38 118.32 1p0b h ARG 286 Ca -0.03 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.04 1p0b h ARG 286 Cb 0.41 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1p0b h ARG 286 CO 0.05 0.22 -0.14 0.77 -1.51 0.00 0.00 179.97 179.36 1p0b h SER 287 N 0.35 0.52 -0.50 -3.80 0.02 -0.66 -2.49 113.55 106.98 1p0b h SER 287 Ca 0.15 -0.14 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1p0b h SER 287 Cb 0.08 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 1p0b h SER 287 CO -0.12 0.69 0.32 1.23 -1.14 0.00 0.00 176.83 177.82 1p0b h GLY 288 N 0.95 0.71 2.00 -3.77 0.00 -0.85 -0.27 103.07 101.84 1p0b h GLY 288 Ca 0.09 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 1p0b h GLY 288 CO 0.03 0.24 -0.14 3.21 0.00 0.00 0.00 176.54 179.88 1p0b h ARG 289 N 0.66 0.00 -0.01 4.80 3.08 -1.07 -2.38 114.38 119.47 1p0b h ARG 289 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1p0b h ARG 289 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1p0b h ARG 289 CO -0.05 0.14 -0.14 -1.71 -1.07 0.00 0.00 179.97 177.14 1p0b n ASN 290 N -3.38 0.87 0.00 7.04 5.15 -0.55 -4.90 115.26 119.48 1p0b n ASN 290 Ca -0.00 -0.91 0.00 0.00 -0.60 0.00 0.00 54.58 53.06 1p0b n ASN 290 Cb 0.33 0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.61 1p0b n ASN 290 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1p0b n GLY 291 N 1.27 0.69 3.67 8.20 0.00 -0.77 -4.93 105.19 113.31 1p0b n GLY 291 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1p0b n GLY 291 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1p0b s GLN 292 N -0.73 4.19 -0.08 1.61 0.74 -0.22 0.08 119.66 125.25 1p0b s GLN 292 Ca 0.00 0.32 0.04 0.00 0.05 0.00 0.00 55.36 55.76 1p0b s GLN 292 Cb 0.00 -3.54 -0.01 0.00 1.10 0.00 0.00 33.01 30.55 1p0b s GLN 292 CO 0.00 -0.08 -0.19 0.00 -0.55 0.00 0.00 175.29 174.47 1p0b s ALA 293 N 1.42 2.40 0.18 1.58 0.00 -0.05 -3.65 121.76 123.63 1p0b s ALA 293 Ca 0.22 -0.98 -0.23 0.00 0.00 0.00 0.00 51.96 50.96 1p0b s ALA 293 Cb -0.15 -0.90 -0.08 0.00 0.00 0.00 0.00 23.12 21.99 1p0b s ALA 293 CO 0.09 0.39 0.75 -0.06 0.00 0.00 0.00 175.76 176.93 1p0b s PHE 294 N -0.10 3.83 0.09 0.00 0.08 -1.26 -0.88 117.98 119.74 1p0b s PHE 294 Ca -0.04 1.55 -0.03 0.00 0.12 0.00 0.00 56.93 58.53 1p0b s PHE 294 Cb -0.14 -2.71 -0.03 0.00 -0.57 0.00 0.00 43.02 39.57 1p0b s PHE 294 CO 0.04 0.47 0.08 0.95 -0.10 0.00 0.00 175.22 176.66 1p0b s THR 295 N -1.25 0.15 -0.44 0.64 -4.23 -1.09 -4.78 115.64 104.65 1p0b s THR 295 Ca 0.37 -1.66 0.21 0.00 -1.18 0.00 0.00 61.69 59.43 1p0b s THR 295 Cb -0.21 -1.67 0.22 0.00 1.34 0.00 0.00 72.50 72.18 1p0b s THR 295 CO 0.24 -0.70 1.64 0.79 -0.54 0.00 0.00 174.62 176.06 1p0b n TRP 296 N -0.02 0.70 -0.72 3.99 7.02 -1.26 -1.09 117.44 126.06 1p0b n TRP 296 Ca -0.11 0.31 0.09 0.00 -1.02 0.00 0.00 57.50 56.76 1p0b n TRP 296 Cb 0.62 -0.99 0.38 0.00 -2.42 0.00 0.00 31.31 28.90 1p0b n TRP 296 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1p0b n ASP 297 N -2.17 5.12 0.00 -0.99 8.00 -1.26 -3.03 116.55 122.22 1p0b n ASP 297 Ca 0.01 -2.61 0.00 0.00 0.71 0.00 0.00 54.79 52.90 1p0b n ASP 297 Cb 0.15 -0.62 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 1p0b n ASP 297 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1p0b n GLY 298 N 0.97 1.62 3.82 0.44 0.00 -0.25 -4.78 105.19 107.00 1p0b n GLY 298 Ca 0.27 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 1p0b n GLY 298 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1p0b s PRO 299 N -2.10 3.66 0.09 1.61 0.04 -1.26 -2.68 135.00 134.36 1p0b s PRO 299 Ca 0.00 1.12 0.06 0.00 0.04 0.00 0.00 61.00 62.22 1p0b s PRO 299 Cb 0.00 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1p0b s PRO 299 CO 0.00 -0.52 -0.15 0.96 0.04 0.00 0.00 177.00 177.32 1p0b s ILE 300 N -2.46 1.26 -0.41 0.56 -4.36 -0.06 -4.95 121.20 110.78 1p0b s ILE 300 Ca 0.62 -1.45 -0.12 0.00 -0.26 0.00 0.00 60.65 59.44 1p0b s ILE 300 Cb -0.13 -1.26 0.04 0.00 1.25 0.00 0.00 42.46 42.36 1p0b s ILE 300 CO 0.32 -0.25 0.27 0.21 0.24 0.00 0.00 174.94 175.73 1p0b s ASN 301 N -1.95 5.87 0.60 4.36 3.84 -1.26 -0.87 114.94 125.54 1p0b s ASN 301 Ca 0.02 -1.13 0.35 0.00 0.21 0.00 0.00 52.86 52.31 1p0b s ASN 301 Cb -0.09 -2.08 1.92 0.00 -0.55 0.00 0.00 41.25 40.45 1p0b s ASN 301 CO 0.03 -0.48 2.07 -0.29 -2.79 0.00 0.00 177.10 175.64 1p0b h ILE 302 N 5.84 0.00 0.00 -5.21 6.09 -0.74 -1.55 117.51 121.94 1p0b h ILE 302 Ca -0.26 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1p0b h ILE 302 Cb 1.10 0.78 0.00 0.00 0.47 0.00 0.00 36.82 39.18 1p0b h ILE 302 CO 0.74 0.00 0.00 0.03 -3.07 0.00 0.00 178.15 175.85 1p0b h ARG 303 N 0.00 0.00 -6.81 2.19 3.08 -1.89 -3.41 114.38 107.54 1p0b h ARG 303 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 1p0b h ARG 303 Cb 0.25 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.38 1p0b h ARG 303 CO 0.00 0.00 0.89 1.21 -1.07 0.00 0.00 179.97 181.00 1p0b s ASN 304 N -4.78 6.36 0.58 7.04 3.84 -0.59 -4.86 114.94 122.53 1p0b s ASN 304 Ca 0.05 2.97 0.29 0.00 0.21 0.00 0.00 52.86 56.38 1p0b s ASN 304 Cb 0.09 -2.64 1.48 0.00 -0.55 0.00 0.00 41.25 39.64 1p0b s ASN 304 CO 0.49 -0.92 1.92 0.00 -2.79 0.00 0.00 177.10 175.79 1p0b h ALA 305 N 4.73 2.28 0.00 1.71 0.00 -1.90 -1.33 119.26 124.74 1p0b h ALA 305 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1p0b h ALA 305 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1p0b h ALA 305 CO 0.78 -0.74 0.00 2.89 0.00 0.00 0.00 179.25 182.18 1p0b n ARG 306 N -3.86 0.12 -0.03 0.00 1.85 -1.26 -1.90 116.66 111.56 1p0b n ARG 306 Ca 0.10 0.21 0.07 0.00 -1.00 0.00 0.00 57.85 57.23 1p0b n ARG 306 Cb 0.69 -1.50 0.08 0.00 -1.05 0.00 0.00 32.46 30.68 1p0b n ARG 306 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1p0b n PHE 307 N -1.30 0.09 0.07 2.89 3.72 -0.50 -4.59 117.46 117.83 1p0b n PHE 307 Ca 0.04 -0.07 0.14 0.00 -0.05 0.00 0.00 57.45 57.51 1p0b n PHE 307 Cb 0.07 -0.00 0.62 0.00 -0.94 0.00 0.00 39.48 39.23 1p0b n PHE 307 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1p0b h SER 308 N 2.89 0.10 0.00 4.37 4.64 -1.55 -2.69 113.55 121.31 1p0b h SER 308 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1p0b h SER 308 Cb 0.65 -0.02 -0.10 0.00 -0.31 0.00 0.00 62.40 62.62 1p0b h SER 308 CO 0.00 0.06 -0.52 -0.62 -0.87 0.00 0.00 176.83 174.88 1p0b n GLU 309 N -4.45 0.86 -2.94 4.77 1.02 -1.26 -4.69 120.64 113.95 1p0b n GLU 309 Ca 0.05 -2.43 -0.42 0.00 -0.02 0.00 0.00 57.16 54.34 1p0b n GLU 309 Cb 0.37 -1.00 -0.05 0.00 -0.02 0.00 0.00 31.44 30.73 1p0b n GLU 309 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1p0b s ASP 310 N -2.48 6.54 0.00 1.62 -1.08 -1.02 -4.92 116.67 115.33 1p0b s ASP 310 Ca 0.29 0.28 0.28 0.00 -0.52 0.00 0.00 52.55 52.89 1p0b s ASP 310 Cb 0.29 -2.40 1.11 0.00 -1.46 0.00 0.00 42.92 40.46 1p0b s ASP 310 CO -0.06 -0.79 1.81 0.18 0.52 0.00 0.00 175.17 176.82 1p0b n LEU 311 N 6.55 0.31 -4.78 -1.34 4.77 -1.26 -0.46 117.00 120.79 1p0b n LEU 311 Ca 0.03 0.16 -0.32 0.00 -0.03 0.00 0.00 56.01 55.86 1p0b n LEU 311 Cb 0.48 -0.29 0.06 0.00 -2.33 0.00 0.00 43.42 41.34 1p0b n LEU 311 CO 0.56 0.06 0.72 -0.54 -1.33 0.00 0.00 177.39 176.86 1p0b s LYS 312 N -2.73 2.68 0.92 3.23 1.02 -1.26 -4.54 119.74 119.06 1p0b s LYS 312 Ca 0.21 1.24 -0.12 0.00 0.02 0.00 0.00 55.97 57.33 1p0b s LYS 312 Cb 0.19 -1.94 0.14 0.00 -0.52 0.00 0.00 37.83 35.70 1p0b s LYS 312 CO 0.53 -1.33 1.13 -1.25 -0.92 0.00 0.00 175.35 173.52 1p0b s PRO 313 N -4.48 1.10 0.23 -1.68 0.04 -1.26 -0.99 135.00 127.95 1p0b s PRO 313 Ca 0.64 0.30 -0.09 0.00 0.04 0.00 0.00 61.00 61.89 1p0b s PRO 313 Cb -0.18 -1.83 0.36 0.00 0.04 0.00 0.00 34.50 32.88 1p0b s PRO 313 CO 0.48 -2.23 1.66 -0.07 0.04 0.00 0.00 177.00 176.88 1p0b h LEU 314 N -1.52 -0.22 -7.94 -3.56 4.07 -1.89 -3.40 115.31 100.85 1p0b h LEU 314 Ca -0.51 0.16 -0.42 0.00 0.08 0.00 0.00 57.88 57.19 1p0b h LEU 314 Cb 1.33 0.27 -0.31 0.00 1.08 0.00 0.00 40.66 43.03 1p0b h LEU 314 CO 0.62 -0.11 -0.78 -0.62 -1.08 0.00 0.00 178.44 176.47 1p0b s ASP 315 N -5.23 1.14 0.60 -0.43 -1.08 -1.26 -4.89 116.67 105.52 1p0b s ASP 315 Ca -0.13 -0.17 0.36 0.00 -0.52 0.00 0.00 52.55 52.08 1p0b s ASP 315 Cb 0.20 -0.34 1.95 0.00 -1.46 0.00 0.00 42.92 43.27 1p0b s ASP 315 CO 0.74 0.05 2.24 0.77 0.52 0.00 0.00 175.17 179.49 1p0b h SER 316 N 6.49 0.00 0.00 -0.34 4.64 -1.99 -3.17 113.55 119.18 1p0b h SER 316 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1p0b h SER 316 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1p0b h SER 316 CO 0.49 0.03 -1.26 -0.62 -0.87 0.00 0.00 176.83 174.60 1p0b n GLU 317 N -3.39 0.76 -1.63 4.77 1.02 -1.26 -5.04 120.64 115.88 1p0b n GLU 317 Ca -0.02 -0.07 -0.49 0.00 -0.02 0.00 0.00 57.16 56.56 1p0b n GLU 317 Cb 0.14 -1.16 -0.05 0.00 -0.02 0.00 0.00 31.44 30.35 1p0b n GLU 317 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1p0b n HIS 319 N 2.70 0.52 -1.40 0.00 8.25 -1.26 -4.74 115.22 119.30 1p0b n HIS 319 Ca 0.17 -0.26 -0.31 0.00 -0.26 0.00 0.00 57.72 57.05 1p0b n HIS 319 Cb 0.24 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.43 1p0b n HIS 319 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1p0b h ALA 321 N -0.85 1.78 -0.44 0.00 0.00 -1.95 -2.22 119.26 115.57 1p0b h ALA 321 Ca -0.44 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1p0b h ALA 321 Cb 1.23 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1p0b h ALA 321 CO 0.53 0.17 0.11 0.28 0.00 0.00 0.00 179.25 180.34 1p0b h VAL 322 N 0.55 1.23 0.00 0.00 2.07 -1.91 -2.47 116.25 115.71 1p0b h VAL 322 Ca 0.20 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.92 1p0b h VAL 322 Cb 0.11 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1p0b h VAL 322 CO -0.05 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.82 1p0b h GLN 324 N 0.00 0.00 0.00 0.00 4.15 -1.10 -3.43 115.11 114.74 1p0b h GLN 324 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.34 1p0b h GLN 324 Cb 0.55 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 1p0b h GLN 324 CO 0.00 0.53 -1.30 1.63 -1.93 0.00 0.00 178.83 177.76 1p0b n LYS 325 N -3.13 1.26 -4.28 1.69 5.02 -0.96 -5.08 118.16 112.68 1p0b n LYS 325 Ca -0.03 0.02 -0.29 0.00 -2.02 0.00 0.00 58.31 55.98 1p0b n LYS 325 Cb 0.83 -1.11 -0.11 0.00 -0.02 0.00 0.00 35.03 34.62 1p0b n LYS 325 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1p0b s TRP 326 N -2.10 2.59 0.47 2.13 0.51 -0.41 -5.11 118.94 117.01 1p0b s TRP 326 Ca -0.05 -0.23 -0.04 0.00 -2.12 0.00 0.00 56.10 53.66 1p0b s TRP 326 Cb 0.02 -1.37 -0.03 0.00 -0.81 0.00 0.00 33.47 31.28 1p0b s TRP 326 CO 0.14 0.40 0.74 -1.54 -0.51 0.00 0.00 176.95 176.18 1p0b s SER 327 N -2.18 6.12 0.31 2.95 1.04 -1.26 -4.55 113.70 116.13 1p0b s SER 327 Ca 0.19 0.73 -0.01 0.00 0.48 0.00 0.00 55.95 57.34 1p0b s SER 327 Cb -0.11 -2.04 0.50 0.00 0.10 0.00 0.00 66.02 64.48 1p0b s SER 327 CO 0.11 -0.61 1.98 0.03 0.98 0.00 0.00 173.24 175.73 1p0b h ARG 328 N 0.28 0.99 -0.68 4.02 3.08 -0.97 -2.25 114.38 118.85 1p0b h ARG 328 Ca -0.47 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 59.54 1p0b h ARG 328 Cb 1.22 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 31.01 1p0b h ARG 328 CO 0.61 0.67 0.42 0.00 -1.07 0.00 0.00 179.97 180.60 1p0b h ALA 329 N 1.52 0.89 -0.14 0.04 0.00 -0.74 0.28 119.26 121.10 1p0b h ALA 329 Ca 0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1p0b h ALA 329 Cb -0.10 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1p0b h ALA 329 CO -0.06 0.18 -0.01 -0.92 0.00 0.00 0.00 179.25 178.44 1p0b h TYR 330 N 0.82 0.29 -0.56 0.00 3.20 -1.70 -2.08 116.97 116.94 1p0b h TYR 330 Ca 0.28 -0.05 -0.05 0.00 3.14 0.00 0.00 58.73 62.04 1p0b h TYR 330 Cb 0.03 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1p0b h TYR 330 CO -0.05 0.50 0.13 0.82 -1.64 0.00 0.00 178.16 177.92 1p0b h ILE 331 N -0.02 1.23 -0.13 1.81 2.04 -1.16 0.14 117.51 121.43 1p0b h ILE 331 Ca 0.04 -0.85 0.03 0.00 1.00 0.00 0.00 64.86 65.08 1p0b h ILE 331 Cb 0.40 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1p0b h ILE 331 CO 0.01 0.32 -0.08 -0.74 0.00 0.00 0.00 178.15 177.66 1p0b h HIS 332 N 0.83 -0.19 -0.44 1.37 2.76 -0.34 0.21 115.15 119.35 1p0b h HIS 332 Ca 0.18 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.40 1p0b h HIS 332 Cb 0.32 0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.35 1p0b h HIS 332 CO 0.02 -0.12 0.24 1.25 -1.30 0.00 0.00 177.93 178.01 1p0b h HIS 333 N -0.08 0.44 -0.03 5.26 -0.00 -0.70 -0.46 115.15 119.58 1p0b h HIS 333 Ca 0.08 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.47 1p0b h HIS 333 Cb 0.19 -0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 27.46 1p0b h HIS 333 CO -0.21 0.23 -0.02 -0.07 -0.00 0.00 0.00 177.93 177.87 1p0b h LEU 334 N 0.47 -0.06 -0.44 0.26 4.07 -0.42 -0.92 115.31 118.27 1p0b h LEU 334 Ca 0.19 0.02 -0.06 0.00 0.08 0.00 0.00 57.88 58.10 1p0b h LEU 334 Cb 0.07 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.83 1p0b h LEU 334 CO -0.12 -0.03 0.02 0.40 -1.08 0.00 0.00 178.44 177.64 1p0b h ILE 335 N -0.02 1.26 0.00 1.22 1.08 -0.84 -0.83 117.51 119.38 1p0b h ILE 335 Ca 0.02 -0.99 -0.02 0.00 -0.39 0.00 0.00 64.86 63.48 1p0b h ILE 335 Cb 0.05 1.04 -0.00 0.00 -3.07 0.00 0.00 36.82 34.84 1p0b h ILE 335 CO -0.05 0.34 -0.10 0.03 -0.69 0.00 0.00 178.15 177.69 1p0b h ARG 336 N 0.60 0.00 -0.02 2.37 3.08 -0.96 -1.50 114.38 117.96 1p0b h ARG 336 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1p0b h ARG 336 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1p0b h ARG 336 CO 0.02 0.10 -0.02 0.00 -1.07 0.00 0.00 179.97 179.00 1p0b n ALA 337 N -2.20 2.60 -1.56 0.04 0.00 -0.36 -4.93 120.51 114.10 1p0b n ALA 337 Ca -0.01 -0.46 -0.12 0.00 0.00 0.00 0.00 53.44 52.86 1p0b n ALA 337 Cb 0.27 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.54 1p0b n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p0b n GLY 338 N 1.20 0.93 3.74 0.00 0.00 -0.56 -4.98 105.19 105.50 1p0b n GLY 338 Ca 0.18 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 1p0b n GLY 338 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p0b s GLU 339 N -3.38 4.60 0.30 1.61 0.41 -0.37 -4.96 118.70 116.91 1p0b s GLU 339 Ca 0.00 1.69 0.02 0.00 -0.41 0.00 0.00 54.97 56.27 1p0b s GLU 339 Cb 0.00 -3.29 0.57 0.00 -1.78 0.00 0.00 34.13 29.63 1p0b s GLU 339 CO 0.00 0.08 1.86 0.82 -0.49 0.00 0.00 175.26 177.53 1p0b h ILE 340 N 3.78 0.96 -0.05 -1.63 2.04 -1.94 -0.22 117.51 120.45 1p0b h ILE 340 Ca -0.44 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.10 1p0b h ILE 340 Cb 1.21 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1p0b h ILE 340 CO 0.73 0.18 0.04 0.25 0.00 0.00 0.00 178.15 179.35 1p0b h LEU 341 N 0.98 0.00 -0.25 1.44 5.85 -1.93 -1.07 115.31 120.32 1p0b h LEU 341 Ca 0.46 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.17 1p0b h LEU 341 Cb 0.42 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1p0b h LEU 341 CO -0.22 0.00 0.11 1.23 -0.34 0.00 0.00 178.44 179.23 1p0b h GLY 342 N 0.00 0.40 0.98 3.75 0.00 -1.30 -0.51 103.07 106.39 1p0b h GLY 342 Ca 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 1p0b h GLY 342 CO -0.00 0.19 0.26 0.00 0.00 0.00 0.00 176.54 177.00 1p0b h ALA 343 N 0.97 0.64 -0.29 3.60 0.00 -1.23 -0.92 119.26 122.03 1p0b h ALA 343 Ca 0.09 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1p0b h ALA 343 Cb 0.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1p0b h ALA 343 CO -0.01 0.17 0.12 0.52 0.00 0.00 0.00 179.25 180.05 1p0b h MET 344 N 0.66 0.25 -0.26 0.00 2.07 -1.02 -0.70 114.93 115.93 1p0b h MET 344 Ca 0.17 -0.02 -0.08 0.00 -2.07 0.00 0.00 59.70 57.71 1p0b h MET 344 Cb 0.07 -0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 29.74 1p0b h MET 344 CO -0.03 0.17 -0.14 -0.07 1.07 0.00 0.00 176.91 177.91 1p0b h LEU 345 N 0.26 0.57 -0.72 1.22 4.07 -0.94 -1.68 115.31 118.09 1p0b h LEU 345 Ca 0.12 -0.42 -0.03 0.00 0.08 0.00 0.00 57.88 57.63 1p0b h LEU 345 Cb 0.07 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 1p0b h LEU 345 CO -0.11 0.87 0.32 0.24 -1.08 0.00 0.00 178.44 178.67 1p0b h MET 346 N 0.28 1.05 -0.35 1.13 2.86 -1.08 -2.11 114.93 116.71 1p0b h MET 346 Ca 0.06 -0.17 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 1p0b h MET 346 Cb 0.66 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1p0b h MET 346 CO 0.04 0.85 -0.13 1.15 1.06 0.00 0.00 176.91 179.88 1p0b h THR 347 N 1.01 1.28 -0.38 2.22 2.02 -1.09 -1.33 112.91 116.65 1p0b h THR 347 Ca 0.24 -1.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.18 1p0b h THR 347 Cb 0.17 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1p0b h THR 347 CO -0.03 0.40 0.17 -0.08 0.37 0.00 0.00 175.52 176.36 1p0b h GLU 348 N 0.48 0.55 -0.24 6.66 4.81 -1.22 -1.20 114.58 124.43 1p0b h GLU 348 Ca 0.08 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1p0b h GLU 348 Cb 0.65 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1p0b h GLU 348 CO 0.04 0.50 0.14 1.25 -0.73 0.00 0.00 179.01 180.22 1p0b h HIS 349 N 0.47 0.32 -0.47 0.92 2.76 -1.31 -0.35 115.15 117.49 1p0b h HIS 349 Ca 0.13 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.30 1p0b h HIS 349 Cb 0.14 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 28.97 1p0b h HIS 349 CO -0.01 0.25 0.29 -0.91 -1.30 0.00 0.00 177.93 176.24 1p0b h ASN 350 N 0.30 0.56 -0.61 3.26 2.35 -1.06 0.31 115.58 120.68 1p0b h ASN 350 Ca 0.09 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.70 1p0b h ASN 350 Cb 0.02 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1p0b h ASN 350 CO -0.02 0.44 0.07 0.40 -1.65 0.00 0.00 177.43 176.68 1p0b h ILE 351 N 0.62 1.26 -0.67 2.81 1.08 -1.10 -1.20 117.51 120.31 1p0b h ILE 351 Ca 0.17 -1.06 -0.06 0.00 -0.39 0.00 0.00 64.86 63.53 1p0b h ILE 351 Cb -0.02 0.70 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 1p0b h ILE 351 CO -0.03 0.39 0.19 0.00 -0.69 0.00 0.00 178.15 178.01 1p0b h ALA 352 N 1.09 1.08 -0.42 1.87 0.00 -0.60 -0.93 119.26 121.36 1p0b h ALA 352 Ca 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1p0b h ALA 352 Cb 0.47 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1p0b h ALA 352 CO 0.02 0.62 0.17 0.35 0.00 0.00 0.00 179.25 180.41 1p0b h PHE 353 N 0.99 0.63 -0.63 0.00 3.57 0.04 -0.07 116.94 121.46 1p0b h PHE 353 Ca 0.22 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1p0b h PHE 353 Cb 0.30 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 1p0b h PHE 353 CO 0.02 0.55 0.36 1.88 -2.23 0.00 0.00 178.31 178.90 1p0b h TYR 354 N 0.53 0.85 -0.26 0.41 -1.99 -0.83 -0.29 116.97 115.40 1p0b h TYR 354 Ca 0.14 -0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.77 1p0b h TYR 354 Cb 0.18 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 1p0b h TYR 354 CO -0.00 0.60 -0.23 1.96 -0.00 0.00 0.00 178.16 180.49 1p0b h GLN 355 N 0.86 0.48 -0.32 4.88 1.08 -0.93 -1.33 115.11 119.84 1p0b h GLN 355 Ca 0.23 -0.17 -0.09 0.00 -1.45 0.00 0.00 58.65 57.16 1p0b h GLN 355 Cb 0.01 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 1p0b h GLN 355 CO -0.04 0.68 -0.19 1.96 -0.95 0.00 0.00 178.83 180.29 1p0b h GLN 356 N 0.43 0.58 -0.41 1.46 4.20 -0.54 -0.79 115.11 120.04 1p0b h GLN 356 Ca 0.07 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 1p0b h GLN 356 Cb 0.64 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 1p0b h GLN 356 CO 0.05 0.75 0.10 1.25 -0.67 0.00 0.00 178.83 180.31 1p0b h LEU 357 N 0.52 0.62 -0.98 1.46 5.85 -0.44 -1.10 115.31 121.25 1p0b h LEU 357 Ca 0.08 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.51 1p0b h LEU 357 Cb 0.63 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1p0b h LEU 357 CO 0.04 0.69 0.08 0.24 -0.34 0.00 0.00 178.44 179.16 1p0b h MET 358 N 0.53 0.82 -0.50 1.25 2.86 -0.87 -1.35 114.93 117.67 1p0b h MET 358 Ca 0.13 -0.19 -0.07 0.00 -2.06 0.00 0.00 59.70 57.51 1p0b h MET 358 Cb 0.31 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1p0b h MET 358 CO 0.00 0.77 0.05 0.37 1.06 0.00 0.00 176.91 179.16 1p0b h GLN 359 N 0.79 0.85 -0.53 1.72 5.75 -0.86 0.67 115.11 123.49 1p0b h GLN 359 Ca 0.17 -0.25 -0.05 0.00 -0.15 0.00 0.00 58.65 58.37 1p0b h GLN 359 Cb 0.35 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.79 1p0b h GLN 359 CO 0.01 0.86 0.14 0.87 -2.65 0.00 0.00 178.83 178.06 1p0b h LYS 360 N 0.72 0.80 0.10 1.69 1.57 -0.83 0.37 116.57 120.99 1p0b h LYS 360 Ca 0.15 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1p0b h LYS 360 Cb 0.45 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1p0b h LYS 360 CO 0.02 0.71 -0.05 0.82 -0.57 0.00 0.00 179.45 180.38 1p0b h ILE 361 N 0.78 1.07 -0.18 1.86 2.04 -0.93 -0.99 117.51 121.16 1p0b h ILE 361 Ca 0.17 -0.66 0.03 0.00 1.00 0.00 0.00 64.86 65.40 1p0b h ILE 361 Cb 0.26 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 1p0b h ILE 361 CO -0.00 0.16 -0.00 0.03 0.00 0.00 0.00 178.15 178.33 1p0b h ARG 362 N -0.44 0.05 -0.44 2.37 3.08 -0.57 -1.41 114.38 117.02 1p0b h ARG 362 Ca -0.01 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1p0b h ARG 362 Cb 0.37 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1p0b h ARG 362 CO 0.02 0.04 0.25 -0.44 -1.07 0.00 0.00 179.97 178.77 1p0b h ASP 363 N 0.06 0.54 -0.58 7.04 3.32 -0.94 -1.12 116.42 124.74 1p0b h ASP 363 Ca 0.09 -0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.00 1p0b h ASP 363 Cb 0.11 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 1p0b h ASP 363 CO -0.15 0.46 0.16 0.77 -1.72 0.00 0.00 179.24 178.77 1p0b h SER 364 N 0.57 0.90 -0.31 6.45 4.64 -0.94 -0.88 113.55 123.98 1p0b h SER 364 Ca 0.15 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1p0b h SER 364 Cb 0.04 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 1p0b h SER 364 CO -0.03 0.86 0.06 0.40 -0.87 0.00 0.00 176.83 177.25 1p0b h ILE 365 N 0.92 1.23 -0.09 0.95 2.04 -1.03 0.75 117.51 122.28 1p0b h ILE 365 Ca 0.20 -0.79 0.02 0.00 1.00 0.00 0.00 64.86 65.30 1p0b h ILE 365 Cb 0.31 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1p0b h ILE 365 CO -0.00 0.26 0.07 0.28 0.00 0.00 0.00 178.15 178.75 1p0b h SER 366 N 0.33 0.00 -0.50 1.72 0.02 -0.82 -1.59 113.55 112.70 1p0b h SER 366 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1p0b h SER 366 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1p0b h SER 366 CO 0.00 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.07 1p0b n GLU 367 N -4.38 2.58 -2.41 3.45 1.02 -0.37 -4.97 120.64 115.57 1p0b n GLU 367 Ca -0.01 -2.42 -0.17 0.00 -0.02 0.00 0.00 57.16 54.54 1p0b n GLU 367 Cb 0.18 -1.54 -0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1p0b n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1p0b n GLY 368 N 1.57 -0.33 1.06 0.62 0.00 -0.44 -4.89 105.19 102.78 1p0b n GLY 368 Ca 0.21 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 46.13 1p0b n GLY 368 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1p0b n ARG 369 N -2.77 0.59 -0.17 1.61 1.85 0.13 -4.85 116.66 113.05 1p0b n ARG 369 Ca -0.19 -2.39 -0.11 0.00 -1.00 0.00 0.00 57.85 54.16 1p0b n ARG 369 Cb 0.65 -0.65 0.01 0.00 -1.05 0.00 0.00 32.46 31.41 1p0b n ARG 369 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 177.63 177.97 1p0b h PHE 370 N 0.88 1.16 -0.98 2.89 3.57 -1.83 -1.50 116.94 121.14 1p0b h PHE 370 Ca -0.13 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.11 1p0b h PHE 370 Cb 1.52 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 39.94 1p0b h PHE 370 CO 0.36 1.10 0.62 1.03 -2.23 0.00 0.00 178.31 179.19 1p0b h SER 371 N 0.90 1.15 -0.39 0.41 0.87 -1.91 0.31 113.55 114.88 1p0b h SER 371 Ca 0.13 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.57 1p0b h SER 371 Cb 0.75 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1p0b h SER 371 CO 0.06 0.85 -0.04 -0.61 -0.53 0.00 0.00 176.83 176.57 1p0b h GLN 372 N 1.33 0.72 -0.46 2.24 5.75 -1.90 -1.91 115.11 120.87 1p0b h GLN 372 Ca 0.35 -0.25 0.03 0.00 -0.15 0.00 0.00 58.65 58.63 1p0b h GLN 372 Cb -0.11 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.35 1p0b h GLN 372 CO -0.07 0.83 0.26 0.35 -2.65 0.00 0.00 178.83 177.55 1p0b h PHE 373 N 0.53 0.49 -0.44 3.99 3.57 -0.18 -0.08 116.94 124.83 1p0b h PHE 373 Ca 0.11 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.67 1p0b h PHE 373 Cb 0.53 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.07 1p0b h PHE 373 CO 0.04 0.27 0.17 0.00 -2.23 0.00 0.00 178.31 176.56 1p0b h ALA 374 N 1.22 0.53 -0.36 2.41 0.00 -0.21 0.15 119.26 122.99 1p0b h ALA 374 Ca 0.19 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1p0b h ALA 374 Cb 0.04 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1p0b h ALA 374 CO -0.10 -0.22 0.09 0.37 0.00 0.00 0.00 179.25 179.39 1p0b h GLN 375 N 0.35 0.58 -0.62 0.00 4.15 -0.93 -2.04 115.11 116.59 1p0b h GLN 375 Ca 0.20 -0.14 -0.09 0.00 0.77 0.00 0.00 58.65 59.39 1p0b h GLN 375 Cb 0.18 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 1p0b h GLN 375 CO -0.19 0.62 0.03 -0.44 -1.93 0.00 0.00 178.83 176.92 1p0b h ASP 376 N 0.43 1.05 0.15 -0.69 3.32 -0.72 -2.17 116.42 117.78 1p0b h ASP 376 Ca 0.11 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1p0b h ASP 376 Cb 0.31 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1p0b h ASP 376 CO 0.00 1.08 -0.12 0.15 -1.72 0.00 0.00 179.24 178.63 1p0b h PHE 377 N 0.98 -0.32 -0.41 4.55 3.57 -0.59 -2.50 116.94 122.22 1p0b h PHE 377 Ca 0.18 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1p0b h PHE 377 Cb 0.52 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 1p0b h PHE 377 CO 0.04 -0.19 0.26 0.00 -2.23 0.00 0.00 178.31 176.18 1p0b h ARG 378 N -0.29 0.51 -0.45 1.11 3.08 -1.31 0.16 114.38 117.19 1p0b h ARG 378 Ca -0.00 -0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.11 1p0b h ARG 378 Cb 0.26 -0.11 -0.08 0.00 0.08 0.00 0.00 29.97 30.12 1p0b h ARG 378 CO -0.02 0.33 -0.06 0.00 -1.07 0.00 0.00 179.97 179.15 1p0b h ALA 379 N 1.17 0.36 0.13 0.04 0.00 -1.28 0.11 119.26 119.78 1p0b h ALA 379 Ca 0.16 0.16 -0.30 0.00 0.00 0.00 0.00 54.91 54.93 1p0b h ALA 379 Cb -0.03 0.29 0.03 0.00 0.00 0.00 0.00 17.79 18.08 1p0b h ALA 379 CO -0.06 -0.42 -1.26 -0.09 0.00 0.00 0.00 179.25 177.42 1p0b h ARG 380 N 0.05 0.56 -0.66 0.00 2.43 -1.22 -2.79 114.38 112.75 1p0b h ARG 380 Ca 0.22 -0.78 -0.08 0.00 -0.81 0.00 0.00 59.98 58.54 1p0b h ARG 380 Cb 0.34 0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1p0b h ARG 380 CO -0.42 1.35 0.10 -0.92 -1.51 0.00 0.00 179.97 178.56 1p0b h TYR 381 N 0.23 1.15 -0.00 2.20 3.20 -0.42 -2.97 116.97 120.37 1p0b h TYR 381 Ca -0.18 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.53 1p0b h TYR 381 Cb 1.94 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.89 1p0b h TYR 381 CO 0.11 0.97 -0.35 1.19 -1.64 0.00 0.00 178.16 178.43 1p0b n PHE 382 N -4.21 0.00 1.78 -3.82 3.72 0.35 -3.65 117.46 111.63 1p0b n PHE 382 Ca 0.04 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.58 1p0b n PHE 382 Cb 0.29 -0.29 0.85 0.00 -0.94 0.00 0.00 39.48 39.39 1p0b n PHE 382 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71