#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n8q s HIS 10 N 0.00 -0.49 -0.26 1.61 5.65 0.10 -4.85 115.29 117.05 1n8q s HIS 10 Ca 0.00 0.27 -0.10 0.00 0.25 0.00 0.00 55.06 55.47 1n8q s HIS 10 Cb 0.00 0.51 -0.05 0.00 -1.18 0.00 0.00 32.58 31.87 1n8q s HIS 10 CO 0.00 -0.83 0.17 0.15 -0.65 0.00 0.00 174.74 173.58 1n8q s LYS 11 N -3.74 3.97 -0.08 2.88 1.02 -1.26 -1.51 119.74 121.01 1n8q s LYS 11 Ca 0.01 -0.31 -0.20 0.00 0.02 0.00 0.00 55.97 55.49 1n8q s LYS 11 Cb -0.01 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 1n8q s LYS 11 CO -0.13 -0.08 0.57 0.42 -0.92 0.00 0.00 175.35 175.21 1n8q s ILE 12 N 1.46 5.10 -0.25 2.17 1.01 0.83 -4.87 121.20 126.64 1n8q s ILE 12 Ca 0.07 1.17 -0.16 0.00 0.00 0.00 0.00 60.65 61.73 1n8q s ILE 12 Cb -0.15 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 1n8q s ILE 12 CO 0.08 0.31 0.41 -0.54 0.00 0.00 0.00 174.94 175.20 1n8q s LYS 13 N 0.57 4.06 -0.06 2.79 3.01 -0.46 -0.78 119.74 128.88 1n8q s LYS 13 Ca 0.31 0.13 -0.00 0.00 -1.01 0.00 0.00 55.97 55.40 1n8q s LYS 13 Cb -0.16 -3.63 -0.03 0.00 -1.01 0.00 0.00 37.83 32.99 1n8q s LYS 13 CO 0.14 -0.25 -0.02 0.20 0.51 0.00 0.00 175.35 175.94 1n8q s GLY 14 N 1.50 1.82 -0.14 -3.33 0.00 0.44 -0.39 107.32 107.21 1n8q s GLY 14 Ca 0.17 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 44.04 1n8q s GLY 14 CO 0.09 -0.66 -0.17 -1.59 0.00 0.00 0.00 173.10 170.77 1n8q s THR 15 N -0.92 1.76 -0.18 0.90 2.01 0.04 -1.90 115.64 117.36 1n8q s THR 15 Ca 0.15 -0.78 -0.04 0.00 0.31 0.00 0.00 61.69 61.33 1n8q s THR 15 Cb -0.11 -1.61 -0.02 0.00 0.01 0.00 0.00 72.50 70.77 1n8q s THR 15 CO 0.04 0.49 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.74 1n8q s VAL 16 N 1.17 3.80 -0.13 3.82 1.01 -0.58 -0.88 120.40 128.62 1n8q s VAL 16 Ca -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 1n8q s VAL 16 Cb -0.14 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 1n8q s VAL 16 CO -0.07 0.46 -0.09 -0.69 0.00 0.00 0.00 175.10 174.71 1n8q s VAL 17 N 0.75 3.48 0.21 2.92 1.01 -0.21 -1.28 120.40 127.29 1n8q s VAL 17 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1n8q s VAL 17 Cb -0.14 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 1n8q s VAL 17 CO 0.02 0.52 0.10 -1.48 0.00 0.00 0.00 175.10 174.26 1n8q s LEU 18 N 0.15 1.51 -0.03 3.92 0.05 0.01 -0.97 118.68 123.32 1n8q s LEU 18 Ca -0.04 -1.34 0.06 0.00 0.05 0.00 0.00 54.13 52.86 1n8q s LEU 18 Cb -0.14 0.19 -0.01 0.00 -2.05 0.00 0.00 46.19 44.17 1n8q s LEU 18 CO 0.04 -0.76 -0.21 -0.04 -0.55 0.00 0.00 176.35 174.83 1n8q s MET 19 N -4.07 1.85 0.59 1.48 -1.94 0.21 -0.55 119.30 116.87 1n8q s MET 19 Ca 0.35 -0.77 -0.17 0.00 -1.71 0.00 0.00 55.69 53.40 1n8q s MET 19 Cb 0.07 -1.73 -0.03 0.00 2.01 0.00 0.00 34.83 35.15 1n8q s MET 19 CO 0.11 0.42 1.09 1.03 -0.01 0.00 0.00 175.02 177.66 1n8q s ARG 20 N -0.39 3.19 0.29 2.03 0.52 -1.26 -0.74 118.95 122.58 1n8q s ARG 20 Ca 0.05 1.39 0.02 0.00 -0.52 0.00 0.00 55.73 56.67 1n8q s ARG 20 Cb -0.09 -2.00 0.44 0.00 0.52 0.00 0.00 34.95 33.81 1n8q s ARG 20 CO 0.00 -0.94 1.77 -0.22 0.02 0.00 0.00 175.30 175.93 1n8q h LYS 21 N 0.59 0.58 0.00 3.54 1.63 -1.95 -2.71 116.57 118.24 1n8q h LYS 21 Ca -0.48 -0.17 0.00 0.00 -0.85 0.00 0.00 60.65 59.15 1n8q h LYS 21 Cb 1.24 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 1n8q h LYS 21 CO 0.56 0.69 0.00 -0.91 -3.45 0.00 0.00 179.45 176.34 1n8q h ASN 22 N 0.53 0.00 0.67 4.20 2.35 -1.92 -0.78 115.58 120.63 1n8q h ASN 22 Ca 0.10 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1n8q h ASN 22 Cb 0.52 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.89 1n8q h ASN 22 CO 0.03 0.00 -1.33 0.52 -1.65 0.00 0.00 177.43 175.00 1n8q n VAL 23 N -2.63 0.43 0.18 2.81 0.31 -1.02 -4.22 118.33 114.19 1n8q n VAL 23 Ca -0.01 -0.54 0.02 0.00 -0.01 0.00 0.00 64.34 63.81 1n8q n VAL 23 Cb 0.14 -0.24 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 1n8q n VAL 23 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1n8q n LEU 24 N -2.55 0.36 -4.79 7.52 4.77 -0.77 -4.39 117.00 117.15 1n8q n LEU 24 Ca -0.01 -0.57 -0.38 0.00 -0.03 0.00 0.00 56.01 55.01 1n8q n LEU 24 Cb 0.56 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.59 1n8q n LEU 24 CO 0.42 0.08 0.12 -0.62 -1.33 0.00 0.00 177.39 176.06 1n8q s ASP 25 N -1.21 6.74 0.26 -1.43 2.15 -0.37 -3.23 116.67 119.58 1n8q s ASP 25 Ca 0.02 0.88 -0.02 0.00 0.43 0.00 0.00 52.55 53.85 1n8q s ASP 25 Cb 0.03 -2.26 0.46 0.00 -0.30 0.00 0.00 42.92 40.85 1n8q s ASP 25 CO 0.14 0.20 1.81 1.62 -0.17 0.00 0.00 175.17 178.77 1n8q h VAL 26 N 4.12 0.88 -0.69 1.11 3.04 -1.91 0.13 116.25 122.93 1n8q h VAL 26 Ca -0.47 -0.28 -0.08 0.00 -1.01 0.00 0.00 66.70 64.86 1n8q h VAL 26 Cb 1.20 0.00 -0.03 0.00 -2.01 0.00 0.00 31.29 30.45 1n8q h VAL 26 CO 0.67 0.15 0.13 0.78 -1.01 0.00 0.00 177.57 178.29 1n8q h ASN 27 N 0.81 1.08 0.36 3.17 2.35 -1.97 -2.35 115.58 119.02 1n8q h ASN 27 Ca 0.43 -0.25 -0.30 0.00 -0.55 0.00 0.00 56.30 55.63 1n8q h ASN 27 Cb 0.44 -0.29 0.02 0.00 0.05 0.00 0.00 38.32 38.55 1n8q h ASN 27 CO -0.27 1.05 -1.31 0.28 -1.65 0.00 0.00 177.43 175.53 1n8q h SER 28 N 1.06 0.70 0.25 5.81 0.02 -1.76 -3.35 113.55 116.29 1n8q h SER 28 Ca 0.21 -0.71 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1n8q h SER 28 Cb 0.42 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1n8q h SER 28 CO 0.01 1.54 -0.06 0.52 -1.14 0.00 0.00 176.83 177.70 1n8q n VAL 29 N -3.68 0.00 -0.11 2.27 0.31 0.42 -3.73 118.33 113.81 1n8q n VAL 29 Ca -0.13 -0.06 0.22 0.00 -0.01 0.00 0.00 64.34 64.36 1n8q n VAL 29 Cb 1.03 -0.17 0.65 0.00 -0.91 0.00 0.00 33.84 34.45 1n8q n VAL 29 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1n8q h THR 30 N 0.59 0.68 -0.10 2.52 1.35 -1.58 0.55 112.91 116.92 1n8q h THR 30 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 1n8q h THR 30 Cb 0.28 0.56 0.00 0.00 -1.73 0.00 0.00 68.15 67.26 1n8q h THR 30 CO 0.00 0.02 0.00 -1.54 -0.25 0.00 0.00 175.52 173.75 1n8q n SER 31 N -4.37 0.83 -3.62 5.36 3.41 -1.24 -4.63 113.62 109.35 1n8q n SER 31 Ca 0.14 -2.03 -0.29 0.00 -0.26 0.00 0.00 58.87 56.43 1n8q n SER 31 Cb 0.72 -0.18 -0.15 0.00 -0.26 0.00 0.00 64.21 64.34 1n8q n SER 31 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1n8q s VAL 32 N -1.71 0.28 0.00 -3.33 1.01 0.19 -5.02 120.40 111.82 1n8q s VAL 32 Ca 0.07 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.13 1n8q s VAL 32 Cb 0.04 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.23 1n8q s VAL 32 CO 0.04 -0.65 0.00 0.61 0.00 0.00 0.00 175.10 175.10 1n8q n GLY 33 N 5.11 0.98 3.00 4.51 0.00 -1.26 -1.37 105.19 116.15 1n8q n GLY 33 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 1n8q n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n8q s GLY 34 N 0.00 1.01 -0.07 -0.02 0.00 -1.26 -4.63 107.32 102.34 1n8q s GLY 34 Ca 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 44.72 43.98 1n8q s GLY 34 CO 0.00 0.49 0.00 1.39 0.00 0.00 0.00 173.10 174.98 1n8q n ILE 35 N 4.60 -4.28 -0.27 0.90 2.08 -1.26 -5.06 119.36 116.06 1n8q n ILE 35 Ca -0.17 0.81 0.00 0.00 0.56 0.00 0.00 62.75 63.95 1n8q n ILE 35 Cb 0.50 -3.89 0.00 0.00 -0.75 0.00 0.00 39.64 35.51 1n8q n ILE 35 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 1n8q n ILE 36 N 1.17 0.00 -2.32 1.39 2.08 -1.26 -4.51 119.36 115.91 1n8q n ILE 36 Ca -0.00 0.00 -0.04 0.00 0.56 0.00 0.00 62.75 63.27 1n8q n ILE 36 Cb 0.39 0.00 -0.00 0.00 -0.75 0.00 0.00 39.64 39.27 1n8q n ILE 36 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1n8q n GLY 37 N 5.00 -0.40 2.43 7.39 0.00 -1.26 -4.88 105.19 113.47 1n8q n GLY 37 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1n8q n GLY 37 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1n8q n GLN 38 N -2.44 0.67 0.00 1.61 -0.06 -1.26 -4.59 117.38 111.31 1n8q n GLN 38 Ca -0.05 -1.59 0.00 0.00 -2.00 0.00 0.00 57.00 53.36 1n8q n GLN 38 Cb 0.49 1.83 0.00 0.00 -4.06 0.00 0.00 30.24 28.50 1n8q n GLN 38 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1n8q n GLY 39 N -0.36 0.70 3.95 1.69 0.00 -1.26 -4.50 105.19 105.41 1n8q n GLY 39 Ca -0.04 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 1n8q n GLY 39 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n8q n LEU 40 N 0.00 -2.43 0.00 0.99 4.77 -1.26 -4.37 117.00 114.71 1n8q n LEU 40 Ca 0.00 -0.85 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 1n8q n LEU 40 Cb 0.00 -2.44 0.00 0.00 -2.33 0.00 0.00 43.42 38.65 1n8q n LEU 40 CO 0.00 0.42 0.00 -0.90 -1.33 0.00 0.00 177.39 175.58 1n8q n ASP 41 N -2.85 0.00 -4.51 -1.43 3.85 -1.26 -4.30 116.55 106.06 1n8q n ASP 41 Ca -0.03 0.00 -0.36 0.00 -0.71 0.00 0.00 54.79 53.69 1n8q n ASP 41 Cb 0.56 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 40.19 1n8q n ASP 41 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1n8q n LEU 42 N 0.00 0.39 0.19 -2.12 7.99 -1.26 -4.74 117.00 117.44 1n8q n LEU 42 Ca 0.00 -0.12 0.11 0.00 -0.01 0.00 0.00 56.01 56.00 1n8q n LEU 42 Cb 0.00 -0.99 0.12 0.00 -0.11 0.00 0.00 43.42 42.44 1n8q n LEU 42 CO 0.00 -1.05 0.60 -0.37 -1.51 0.00 0.00 177.39 175.06 1n8q h VAL 43 N 7.78 0.03 -0.43 4.08 -1.51 -1.75 -3.16 116.25 121.30 1n8q h VAL 43 Ca -0.06 -1.05 0.00 0.00 -1.23 0.00 0.00 66.70 64.35 1n8q h VAL 43 Cb 1.26 1.90 0.00 0.00 -2.13 0.00 0.00 31.29 32.32 1n8q h VAL 43 CO 1.38 0.02 0.00 0.61 -1.23 0.00 0.00 177.57 178.35 1n8q n GLY 44 N 1.13 0.52 3.08 5.19 0.00 -1.26 -4.52 105.19 109.32 1n8q n GLY 44 Ca 0.03 -0.14 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1n8q n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n8q s SER 45 N -1.47 -0.94 0.00 1.61 1.04 -1.26 -4.88 113.70 107.80 1n8q s SER 45 Ca 0.00 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.32 1n8q s SER 45 Cb 0.00 1.43 0.00 0.00 0.10 0.00 0.00 66.02 67.55 1n8q s SER 45 CO 0.00 -0.15 0.00 1.07 0.98 0.00 0.00 173.24 175.14 1n8q n THR 46 N 4.77 0.00 0.00 2.02 5.66 -1.26 -4.85 114.28 120.62 1n8q n THR 46 Ca 0.08 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.91 1n8q n THR 46 Cb 0.58 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.24 1n8q n THR 46 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1n8q h LEU 47 N 0.00 0.40 -3.21 1.09 3.38 -2.05 -3.49 115.31 111.42 1n8q h LEU 47 Ca 0.00 -0.82 -0.00 0.00 0.09 0.00 0.00 57.88 57.15 1n8q h LEU 47 Cb 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1n8q h LEU 47 CO 0.00 1.18 -1.00 -0.67 0.09 0.00 0.00 178.44 178.04 1n8q n ASP 48 N -4.30 -6.75 -1.21 -0.43 2.03 -1.26 -4.94 116.55 99.69 1n8q n ASP 48 Ca -0.11 0.53 -0.02 0.00 0.52 0.00 0.00 54.79 55.71 1n8q n ASP 48 Cb 0.65 -2.05 0.22 0.00 -0.72 0.00 0.00 41.12 39.22 1n8q n ASP 48 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1n8q n THR 49 N 1.21 2.55 0.13 5.18 -2.24 -1.26 -4.74 114.28 115.10 1n8q n THR 49 Ca -0.00 -2.35 0.03 0.00 -2.27 0.00 0.00 64.05 59.46 1n8q n THR 49 Cb 0.44 -0.32 0.01 0.00 -2.10 0.00 0.00 70.33 68.37 1n8q n THR 49 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1n8q h LEU 50 N 1.32 0.00 -1.68 3.22 3.38 -1.92 -2.79 115.31 116.85 1n8q h LEU 50 Ca 0.19 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.21 1n8q h LEU 50 Cb 1.73 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.46 1n8q h LEU 50 CO 0.42 0.49 0.30 0.74 0.09 0.00 0.00 178.44 180.48 1n8q h THR 51 N 0.00 0.99 0.00 0.22 2.02 -1.96 -2.88 112.91 111.29 1n8q h THR 51 Ca -0.02 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1n8q h THR 51 Cb 1.39 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1n8q h THR 51 CO 0.06 0.07 -0.01 0.00 0.37 0.00 0.00 175.52 176.01 1n8q h ALA 52 N 1.75 1.41 -0.00 6.16 0.00 -1.88 -1.94 119.26 124.76 1n8q h ALA 52 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1n8q h ALA 52 Cb 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1n8q h ALA 52 CO -0.05 0.01 -0.10 1.19 0.00 0.00 0.00 179.25 180.31 1n8q n PHE 53 N -3.69 0.00 -0.02 0.00 3.01 -1.09 -4.51 117.46 111.16 1n8q n PHE 53 Ca -0.03 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.24 1n8q n PHE 53 Cb 0.09 -0.20 -0.14 0.00 -0.01 0.00 0.00 39.48 39.23 1n8q n PHE 53 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1n8q n LEU 54 N -1.01 2.40 0.00 4.37 4.32 -0.73 -4.35 117.00 122.00 1n8q n LEU 54 Ca 0.14 0.17 0.00 0.00 -0.02 0.00 0.00 56.01 56.31 1n8q n LEU 54 Cb 0.27 -0.89 0.00 0.00 -1.62 0.00 0.00 43.42 41.19 1n8q n LEU 54 CO 0.24 0.80 0.00 0.61 -1.22 0.00 0.00 177.39 177.82 1n8q n GLY 55 N 1.98 1.31 2.48 -0.72 0.00 -1.26 -4.47 105.19 104.50 1n8q n GLY 55 Ca -0.32 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.44 1n8q n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n8q n ARG 56 N 0.00 3.33 -0.09 1.61 5.12 -1.26 -4.66 116.66 120.71 1n8q n ARG 56 Ca 0.00 -4.44 -0.15 0.00 -1.93 0.00 0.00 57.85 51.33 1n8q n ARG 56 Cb 0.00 -2.20 -0.07 0.00 -1.16 0.00 0.00 32.46 29.03 1n8q n ARG 56 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1n8q n SER 57 N -0.47 2.06 -3.79 0.55 7.64 -1.26 -4.84 113.62 113.51 1n8q n SER 57 Ca 0.38 0.05 -0.22 0.00 1.01 0.00 0.00 58.87 60.09 1n8q n SER 57 Cb 0.68 -0.38 -0.17 0.00 -1.01 0.00 0.00 64.21 63.33 1n8q n SER 57 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1n8q s VAL 58 N -2.33 0.36 -0.03 0.44 1.01 -1.26 0.53 120.40 119.12 1n8q s VAL 58 Ca -0.24 0.09 0.05 0.00 0.00 0.00 0.00 61.98 61.89 1n8q s VAL 58 Cb 0.07 -0.49 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 1n8q s VAL 58 CO 0.35 0.24 -0.18 -0.94 0.00 0.00 0.00 175.10 174.57 1n8q s SER 59 N 1.71 3.75 0.03 3.32 1.04 -0.28 -2.88 113.70 120.39 1n8q s SER 59 Ca 0.01 -0.29 0.07 0.00 0.48 0.00 0.00 55.95 56.22 1n8q s SER 59 Cb -0.13 -0.69 -0.02 0.00 0.10 0.00 0.00 66.02 65.28 1n8q s SER 59 CO -0.04 0.33 -0.22 -0.76 0.98 0.00 0.00 173.24 173.53 1n8q s LEU 60 N -0.76 2.13 -0.14 2.42 1.02 0.67 -0.77 118.68 123.24 1n8q s LEU 60 Ca 0.11 -0.49 -0.04 0.00 0.02 0.00 0.00 54.13 53.73 1n8q s LEU 60 Cb -0.10 -1.06 0.06 0.00 0.02 0.00 0.00 46.19 45.10 1n8q s LEU 60 CO 0.01 0.21 0.10 -1.58 0.02 0.00 0.00 176.35 175.10 1n8q s GLN 61 N -0.98 0.04 0.47 1.70 0.74 -0.07 -1.49 119.66 120.07 1n8q s GLN 61 Ca 0.08 0.06 -0.22 0.00 0.05 0.00 0.00 55.36 55.33 1n8q s GLN 61 Cb -0.09 -1.46 -0.07 0.00 1.10 0.00 0.00 33.01 32.49 1n8q s GLN 61 CO 0.01 -0.59 1.12 -0.51 -0.55 0.00 0.00 175.29 174.77 1n8q s LEU 62 N 2.17 3.95 -0.11 3.68 1.02 -1.26 -0.45 118.68 127.67 1n8q s LEU 62 Ca 0.03 2.18 0.01 0.00 0.02 0.00 0.00 54.13 56.37 1n8q s LEU 62 Cb -0.15 -4.36 0.02 0.00 0.02 0.00 0.00 46.19 41.72 1n8q s LEU 62 CO -0.08 -0.90 -0.13 -0.63 0.02 0.00 0.00 176.35 174.63 1n8q s ILE 63 N -1.68 1.36 0.26 -0.59 1.01 0.37 -1.39 121.20 120.55 1n8q s ILE 63 Ca 0.65 -0.54 -0.30 0.00 0.00 0.00 0.00 60.65 60.47 1n8q s ILE 63 Cb -0.25 -1.28 -0.10 0.00 0.01 0.00 0.00 42.46 40.85 1n8q s ILE 63 CO 0.30 0.42 1.31 -0.55 0.00 0.00 0.00 174.94 176.42 1n8q s SER 64 N 1.23 6.84 0.26 3.58 0.15 -0.48 -1.30 113.70 123.98 1n8q s SER 64 Ca -0.02 2.53 0.20 0.00 0.70 0.00 0.00 55.95 59.36 1n8q s SER 64 Cb -0.14 -2.63 0.08 0.00 -1.71 0.00 0.00 66.02 61.62 1n8q s SER 64 CO -0.05 -0.53 1.23 0.00 1.20 0.00 0.00 173.24 175.09 1n8q h ALA 65 N 4.53 0.70 0.00 5.45 0.00 0.04 -3.39 119.26 126.59 1n8q h ALA 65 Ca -0.46 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1n8q h ALA 65 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1n8q h ALA 65 CO 0.73 0.27 -0.42 0.25 0.00 0.00 0.00 179.25 180.07 1n8q n THR 66 N -2.93 0.00 -4.30 0.00 -2.24 -1.24 -4.29 114.28 99.28 1n8q n THR 66 Ca -0.00 -0.33 -0.31 0.00 -2.27 0.00 0.00 64.05 61.14 1n8q n THR 66 Cb 0.63 0.84 -0.16 0.00 -2.10 0.00 0.00 70.33 69.53 1n8q n THR 66 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1n8q s LYS 67 N -1.54 2.58 0.36 -0.78 3.01 -1.26 -4.93 119.74 117.18 1n8q s LYS 67 Ca 0.00 -0.68 0.07 0.00 -1.01 0.00 0.00 55.97 54.36 1n8q s LYS 67 Cb 0.02 -2.22 -0.01 0.00 -1.01 0.00 0.00 37.83 34.61 1n8q s LYS 67 CO 0.12 -0.14 0.42 0.00 0.51 0.00 0.00 175.35 176.27 1n8q s ALA 68 N 1.17 4.15 0.23 5.17 0.00 -1.26 -1.50 121.76 129.71 1n8q s ALA 68 Ca -0.01 -1.60 0.00 0.00 0.00 0.00 0.00 51.96 50.35 1n8q s ALA 68 Cb -0.14 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1n8q s ALA 68 CO -0.07 -0.09 0.00 -0.40 0.00 0.00 0.00 175.76 175.21 1n8q n ASP 69 N -1.59 0.00 -0.11 0.00 5.68 0.79 -4.68 116.55 116.64 1n8q n ASP 69 Ca 0.01 -0.52 -0.05 0.00 -0.50 0.00 0.00 54.79 53.73 1n8q n ASP 69 Cb 0.59 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.58 1n8q n ASP 69 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1n8q h ALA 70 N -0.62 0.22 -1.18 2.12 0.00 -2.01 -3.14 119.26 114.66 1n8q h ALA 70 Ca 0.00 0.14 -0.73 0.00 0.00 0.00 0.00 54.91 54.33 1n8q h ALA 70 Cb 0.00 0.31 -0.31 0.00 0.00 0.00 0.00 17.79 17.79 1n8q h ALA 70 CO 0.00 -0.47 0.59 -1.71 0.00 0.00 0.00 179.25 177.66 1n8q n ASN 71 N -5.31 6.77 0.00 0.00 2.85 -1.26 -4.91 115.26 113.40 1n8q n ASN 71 Ca 0.02 -3.79 0.00 0.00 -0.11 0.00 0.00 54.58 50.69 1n8q n ASN 71 Cb 0.22 -0.92 0.00 0.00 1.24 0.00 0.00 39.78 40.32 1n8q n ASN 71 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1n8q n GLY 72 N -0.48 2.74 3.78 8.20 0.00 -1.19 -5.01 105.19 113.23 1n8q n GLY 72 Ca 0.49 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.13 1n8q n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n8q s LYS 73 N -0.02 4.59 0.00 1.61 1.02 -1.26 -4.04 119.74 121.65 1n8q s LYS 73 Ca 0.00 1.23 -0.38 0.00 0.02 0.00 0.00 55.97 56.84 1n8q s LYS 73 Cb 0.00 -3.10 -0.17 0.00 -0.52 0.00 0.00 37.83 34.04 1n8q s LYS 73 CO 0.00 0.46 1.36 0.41 -0.92 0.00 0.00 175.35 176.66 1n8q n GLY 74 N 1.19 0.38 3.67 -3.33 0.00 0.19 -0.15 105.19 107.14 1n8q n GLY 74 Ca -0.03 0.75 -0.46 0.00 0.00 0.00 0.00 46.02 46.29 1n8q n GLY 74 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1n8q n LYS 75 N 2.77 2.19 -3.04 1.61 4.81 -0.56 -4.64 118.16 121.30 1n8q n LYS 75 Ca 0.20 0.79 -0.40 0.00 -0.87 0.00 0.00 58.31 58.04 1n8q n LYS 75 Cb 0.16 -2.58 -0.05 0.00 0.02 0.00 0.00 35.03 32.57 1n8q n LYS 75 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1n8q s LEU 76 N 1.44 4.43 0.00 3.14 1.02 -1.26 -1.38 118.68 126.07 1n8q s LEU 76 Ca 0.81 1.36 0.00 0.00 0.02 0.00 0.00 54.13 56.32 1n8q s LEU 76 Cb -0.67 -3.14 0.00 0.00 0.02 0.00 0.00 46.19 42.40 1n8q s LEU 76 CO 0.40 0.03 0.00 0.61 0.02 0.00 0.00 176.35 177.41 1n8q n GLY 77 N 2.45 -0.44 3.78 -3.19 0.00 -0.48 -5.03 105.19 102.28 1n8q n GLY 77 Ca -0.03 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 43.93 1n8q n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n8q s LYS 78 N 0.26 4.10 0.06 1.61 1.02 -1.26 -4.84 119.74 120.69 1n8q s LYS 78 Ca 0.00 0.38 -0.30 0.00 0.02 0.00 0.00 55.97 56.07 1n8q s LYS 78 Cb 0.00 -3.32 -0.09 0.00 -0.52 0.00 0.00 37.83 33.90 1n8q s LYS 78 CO 0.00 0.46 1.81 0.00 -0.92 0.00 0.00 175.35 176.70 1n8q s ALA 79 N -0.32 3.67 0.03 5.17 0.00 -1.26 -4.66 121.76 124.38 1n8q s ALA 79 Ca 0.23 1.29 0.07 0.00 0.00 0.00 0.00 51.96 53.56 1n8q s ALA 79 Cb -0.16 -3.77 -0.02 0.00 0.00 0.00 0.00 23.12 19.17 1n8q s ALA 79 CO 0.11 -1.33 -0.22 0.99 0.00 0.00 0.00 175.76 175.31 1n8q s THR 80 N 3.44 1.73 0.18 0.00 2.01 -0.56 -4.91 115.64 117.53 1n8q s THR 80 Ca 0.81 -1.13 0.05 0.00 0.31 0.00 0.00 61.69 61.73 1n8q s THR 80 Cb -0.42 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 1n8q s THR 80 CO 0.36 0.31 0.15 -0.36 -0.69 0.00 0.00 174.62 174.39 1n8q s PHE 81 N -0.71 3.16 0.12 4.92 0.40 -1.26 -0.23 117.98 124.37 1n8q s PHE 81 Ca 0.08 -0.03 -0.31 0.00 -0.60 0.00 0.00 56.93 56.08 1n8q s PHE 81 Cb -0.09 -1.50 -0.10 0.00 0.51 0.00 0.00 43.02 41.84 1n8q s PHE 81 CO 0.01 0.52 1.74 -0.51 0.70 0.00 0.00 175.22 177.68 1n8q s LEU 82 N -3.21 4.38 -0.01 -0.37 1.02 -1.14 -4.78 118.68 114.58 1n8q s LEU 82 Ca 0.31 2.67 0.19 0.00 0.02 0.00 0.00 54.13 57.32 1n8q s LEU 82 Cb -0.10 -3.57 -0.23 0.00 0.02 0.00 0.00 46.19 42.31 1n8q s LEU 82 CO 0.24 -0.95 0.68 -1.84 0.02 0.00 0.00 176.35 174.50 1n8q n GLU 83 N 5.34 0.77 -3.56 1.70 0.28 -0.71 -4.60 120.64 119.86 1n8q n GLU 83 Ca 0.17 -0.05 -0.06 0.00 -0.16 0.00 0.00 57.16 57.05 1n8q n GLU 83 Cb 0.39 -1.40 -0.02 0.00 1.43 0.00 0.00 31.44 31.84 1n8q n GLU 83 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1n8q s GLY 84 N -3.18 -0.40 -0.10 -1.84 0.00 -0.99 -4.98 107.32 95.84 1n8q s GLY 84 Ca 0.03 1.05 -0.18 0.00 0.00 0.00 0.00 44.72 45.62 1n8q s GLY 84 CO 0.77 0.34 0.48 -0.42 0.00 0.00 0.00 173.10 174.27 1n8q s ILE 85 N -2.94 5.15 -0.31 0.90 1.01 -1.26 -0.34 121.20 123.40 1n8q s ILE 85 Ca 0.07 0.96 -0.13 0.00 0.00 0.00 0.00 60.65 61.54 1n8q s ILE 85 Cb -0.01 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 1n8q s ILE 85 CO -0.07 0.36 0.29 -0.63 0.00 0.00 0.00 174.94 174.89 1n8q s ILE 86 N 0.36 5.24 -0.07 2.92 1.01 -0.73 -4.82 121.20 125.10 1n8q s ILE 86 Ca 0.26 0.14 0.25 0.00 0.00 0.00 0.00 60.65 61.30 1n8q s ILE 86 Cb -0.15 -3.69 0.28 0.00 0.01 0.00 0.00 42.46 38.91 1n8q s ILE 86 CO 0.11 0.08 1.76 0.71 0.00 0.00 0.00 174.94 177.60 1n8q h THR 87 N 5.45 0.29 -1.93 2.92 1.35 -1.87 -3.37 112.91 115.75 1n8q h THR 87 Ca -0.32 -1.07 -0.03 0.00 -0.55 0.00 0.00 66.41 64.44 1n8q h THR 87 Cb 1.16 1.85 -0.21 0.00 -1.73 0.00 0.00 68.15 69.23 1n8q h THR 87 CO 0.63 0.14 0.21 -0.55 -0.25 0.00 0.00 175.52 175.70 1n8q s SER 88 N -6.09 -0.66 -0.03 5.36 0.15 -1.26 -4.75 113.70 106.40 1n8q s SER 88 Ca 0.03 1.06 -0.11 0.00 0.70 0.00 0.00 55.95 57.63 1n8q s SER 88 Cb 0.08 1.00 0.02 0.00 -1.71 0.00 0.00 66.02 65.40 1n8q s SER 88 CO 0.63 -0.38 0.24 -0.76 1.20 0.00 0.00 173.24 174.17 1n8q s LEU 89 N -0.30 1.14 0.24 3.45 1.02 -1.26 -5.04 118.68 117.92 1n8q s LEU 89 Ca -0.04 0.11 0.20 0.00 0.02 0.00 0.00 54.13 54.43 1n8q s LEU 89 Cb -0.03 0.95 0.95 0.00 0.02 0.00 0.00 46.19 48.09 1n8q s LEU 89 CO 0.04 -0.32 1.62 -2.65 0.02 0.00 0.00 176.35 175.06 1n8q n PRO 90 N 1.82 0.15 -0.08 1.29 -0.02 -1.26 -2.15 135.00 134.75 1n8q n PRO 90 Ca -0.19 0.49 0.03 0.00 -2.02 0.00 0.00 63.50 61.81 1n8q n PRO 90 Cb 0.56 -1.85 0.08 0.00 -0.02 0.00 0.00 33.50 32.27 1n8q n PRO 90 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1n8q n THR 91 N -2.14 0.76 0.00 3.45 5.66 -1.26 -4.89 114.28 115.86 1n8q n THR 91 Ca 0.01 -0.88 0.00 0.00 -3.05 0.00 0.00 64.05 60.13 1n8q n THR 91 Cb 0.14 0.65 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 1n8q n THR 91 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1n8q n LEU 92 N 0.17 0.00 0.00 1.09 0.00 -0.91 -5.01 117.00 112.33 1n8q n LEU 92 Ca 0.06 0.83 0.00 0.00 0.00 0.00 0.00 56.01 56.90 1n8q n LEU 92 Cb 0.31 -0.33 0.00 0.00 0.00 0.00 0.00 43.42 43.40 1n8q n LEU 92 CO 0.05 -0.33 0.00 0.61 0.00 0.00 0.00 177.39 177.72 1n8q n GLY 93 N -0.89 -1.20 3.72 -3.96 0.00 -1.26 -4.76 105.19 96.83 1n8q n GLY 93 Ca 0.00 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 1n8q n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n8q s ALA 94 N -3.19 3.44 0.00 4.61 0.00 -1.26 -2.83 121.76 122.52 1n8q s ALA 94 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1n8q s ALA 94 Cb 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1n8q s ALA 94 CO 0.00 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.75 1n8q n GLY 95 N 2.78 0.89 3.94 0.00 0.00 -1.24 -4.85 105.19 106.71 1n8q n GLY 95 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1n8q n GLY 95 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n8q s GLN 96 N -0.22 3.50 0.01 1.61 -0.21 -1.13 -4.36 119.66 118.86 1n8q s GLN 96 Ca 0.00 -0.42 0.02 0.00 0.02 0.00 0.00 55.36 54.97 1n8q s GLN 96 Cb 0.00 -2.84 -0.01 0.00 1.00 0.00 0.00 33.01 31.16 1n8q s GLN 96 CO 0.00 0.39 -0.06 -1.12 -2.12 0.00 0.00 175.29 172.38 1n8q s SER 97 N -3.37 0.64 0.10 5.90 0.01 0.29 -4.24 113.70 113.02 1n8q s SER 97 Ca 0.38 -0.27 0.09 0.00 1.31 0.00 0.00 55.95 57.45 1n8q s SER 97 Cb -0.11 -0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.07 1n8q s SER 97 CO 0.30 -0.05 -0.23 0.00 0.41 0.00 0.00 173.24 173.67 1n8q s ALA 98 N -0.63 1.96 -0.00 1.44 0.00 -1.26 -0.81 121.76 122.46 1n8q s ALA 98 Ca -0.03 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.64 1n8q s ALA 98 Cb -0.05 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.78 1n8q s ALA 98 CO -0.00 0.41 0.00 -0.06 0.00 0.00 0.00 175.76 176.11 1n8q s PHE 99 N -1.10 0.02 -0.06 0.00 0.08 -0.40 -1.78 117.98 114.75 1n8q s PHE 99 Ca 0.09 0.01 -0.11 0.00 0.12 0.00 0.00 56.93 57.03 1n8q s PHE 99 Cb -0.10 -0.03 -0.05 0.00 -0.57 0.00 0.00 43.02 42.27 1n8q s PHE 99 CO 0.04 -0.01 0.28 -1.59 -0.10 0.00 0.00 175.22 173.85 1n8q s LYS 100 N 0.08 3.69 -0.02 0.44 -2.85 0.53 -1.53 119.74 120.08 1n8q s LYS 100 Ca -0.01 0.16 -0.01 0.00 -1.00 0.00 0.00 55.97 55.11 1n8q s LYS 100 Cb -0.01 -3.21 0.02 0.00 -2.06 0.00 0.00 37.83 32.57 1n8q s LYS 100 CO -0.00 0.73 0.05 -1.50 0.10 0.00 0.00 175.35 174.73 1n8q s ILE 101 N -1.05 -0.02 -0.09 3.79 2.07 -0.80 -1.74 121.20 123.36 1n8q s ILE 101 Ca 0.20 0.08 0.03 0.00 -1.41 0.00 0.00 60.65 59.55 1n8q s ILE 101 Cb -0.14 -0.09 -0.01 0.00 0.13 0.00 0.00 42.46 42.34 1n8q s ILE 101 CO 0.09 0.03 -0.19 0.20 -1.91 0.00 0.00 174.94 173.16 1n8q s ASN 102 N 0.46 3.56 -0.14 4.50 0.02 -1.26 -0.42 114.94 121.66 1n8q s ASN 102 Ca -0.04 -0.40 -0.02 0.00 -1.02 0.00 0.00 52.86 51.38 1n8q s ASN 102 Cb -0.05 -1.20 -0.02 0.00 0.02 0.00 0.00 41.25 39.99 1n8q s ASN 102 CO -0.02 0.22 -0.06 -0.36 0.02 0.00 0.00 177.10 176.90 1n8q s PHE 103 N -0.01 2.97 -0.08 2.20 0.08 0.04 -4.90 117.98 118.29 1n8q s PHE 103 Ca -0.06 -0.33 -0.30 0.00 0.12 0.00 0.00 56.93 56.37 1n8q s PHE 103 Cb -0.15 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.37 1n8q s PHE 103 CO 0.05 -0.02 1.32 -1.21 -0.10 0.00 0.00 175.22 175.26 1n8q s GLU 104 N 0.19 4.28 -0.08 0.44 2.02 -1.26 -0.12 118.70 124.16 1n8q s GLU 104 Ca -0.03 1.80 -0.20 0.00 0.02 0.00 0.00 54.97 56.55 1n8q s GLU 104 Cb -0.14 -3.67 0.04 0.00 0.10 0.00 0.00 34.13 30.46 1n8q s GLU 104 CO 0.03 -0.61 0.47 -0.46 0.02 0.00 0.00 175.26 174.71 1n8q s TRP 105 N 2.88 -0.42 0.35 1.61 -0.11 -0.57 -4.70 118.94 117.98 1n8q s TRP 105 Ca 0.59 0.83 0.04 0.00 1.22 0.00 0.00 56.10 58.79 1n8q s TRP 105 Cb -0.26 0.21 -0.06 0.00 -1.50 0.00 0.00 33.47 31.85 1n8q s TRP 105 CO 0.21 -0.40 0.05 0.16 -4.62 0.00 0.00 176.95 172.35 1n8q s ASP 106 N -0.77 2.81 0.07 5.86 1.47 -1.26 0.01 116.67 124.86 1n8q s ASP 106 Ca -0.08 -1.40 -0.31 0.00 1.18 0.00 0.00 52.55 51.94 1n8q s ASP 106 Cb -0.03 -0.12 -0.07 0.00 -0.34 0.00 0.00 42.92 42.36 1n8q s ASP 106 CO 0.05 -0.59 1.46 -1.81 0.68 0.00 0.00 175.17 174.96 1n8q s ASP 107 N -3.56 6.77 0.00 2.11 1.11 -1.26 -2.08 116.67 119.75 1n8q s ASP 107 Ca 0.35 2.32 0.00 0.00 0.18 0.00 0.00 52.55 55.39 1n8q s ASP 107 Cb 0.09 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.50 1n8q s ASP 107 CO 0.16 -0.74 0.00 0.61 1.18 0.00 0.00 175.17 176.38 1n8q n GLY 108 N 3.67 1.46 0.01 0.21 0.00 -1.26 -4.83 105.19 104.45 1n8q n GLY 108 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 1n8q n GLY 108 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n8q n SER 109 N 0.00 0.53 0.00 1.61 7.64 -0.89 -4.95 113.62 117.56 1n8q n SER 109 Ca 0.00 -0.30 0.00 0.00 1.01 0.00 0.00 58.87 59.58 1n8q n SER 109 Cb 0.00 1.64 0.00 0.00 -1.01 0.00 0.00 64.21 64.84 1n8q n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n8q n GLY 110 N 1.38 0.33 3.33 0.23 0.00 -1.22 -4.24 105.19 105.00 1n8q n GLY 110 Ca -0.01 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.77 1n8q n GLY 110 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n8q s ILE 111 N 0.00 3.07 0.48 -0.61 1.01 -1.26 -4.87 121.20 119.02 1n8q s ILE 111 Ca 0.00 -0.63 -0.23 0.00 0.00 0.00 0.00 60.65 59.79 1n8q s ILE 111 Cb 0.00 -2.33 -0.07 0.00 0.01 0.00 0.00 42.46 40.08 1n8q s ILE 111 CO 0.00 0.49 1.29 -2.84 0.00 0.00 0.00 174.94 173.88 1n8q s PRO 112 N 0.80 3.58 0.00 2.79 0.02 -1.26 0.71 135.00 141.64 1n8q s PRO 112 Ca -0.04 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1n8q s PRO 112 Cb -0.15 -2.45 0.00 0.00 0.02 0.00 0.00 34.50 31.92 1n8q s PRO 112 CO 0.01 -0.79 0.06 0.41 -0.33 0.00 0.00 177.00 176.37 1n8q n GLY 113 N 0.61 0.68 3.77 0.52 0.00 -0.42 -4.57 105.19 105.78 1n8q n GLY 113 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 1n8q n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n8q s ALA 114 N -0.06 -1.44 -0.03 4.61 0.00 -1.08 -1.77 121.76 121.99 1n8q s ALA 114 Ca 0.00 -0.03 -0.20 0.00 0.00 0.00 0.00 51.96 51.73 1n8q s ALA 114 Cb 0.00 0.75 0.04 0.00 0.00 0.00 0.00 23.12 23.91 1n8q s ALA 114 CO 0.00 -1.01 0.43 -0.59 0.00 0.00 0.00 175.76 174.59 1n8q s PHE 115 N -3.63 -0.34 0.12 0.00 -0.12 -0.48 -0.48 117.98 113.05 1n8q s PHE 115 Ca 0.11 0.56 -0.05 0.00 -0.05 0.00 0.00 56.93 57.49 1n8q s PHE 115 Cb -0.04 0.19 -0.05 0.00 -0.63 0.00 0.00 43.02 42.49 1n8q s PHE 115 CO 0.03 -0.45 0.35 0.71 -0.05 0.00 0.00 175.22 175.81 1n8q s TYR 116 N -1.23 3.50 -0.02 3.49 2.02 0.41 -1.56 117.35 123.96 1n8q s TYR 116 Ca -0.12 0.55 0.03 0.00 -0.37 0.00 0.00 57.07 57.16 1n8q s TYR 116 Cb -0.04 -2.00 -0.00 0.00 -0.40 0.00 0.00 41.96 39.52 1n8q s TYR 116 CO 0.06 0.47 -0.11 -1.50 -1.57 0.00 0.00 175.55 172.90 1n8q s ILE 117 N -1.59 0.92 -0.11 2.71 2.07 -0.53 -0.90 121.20 123.78 1n8q s ILE 117 Ca 0.39 -0.47 0.03 0.00 -1.41 0.00 0.00 60.65 59.19 1n8q s ILE 117 Cb -0.12 -0.79 0.01 0.00 0.13 0.00 0.00 42.46 41.69 1n8q s ILE 117 CO 0.24 0.27 -0.20 -0.54 -1.91 0.00 0.00 174.94 172.80 1n8q s LYS 118 N -0.07 2.63 -0.36 3.50 1.02 0.05 -3.89 119.74 122.62 1n8q s LYS 118 Ca 0.01 -0.72 -0.16 0.00 0.02 0.00 0.00 55.97 55.11 1n8q s LYS 118 Cb -0.07 -2.09 -0.00 0.00 -0.52 0.00 0.00 37.83 35.15 1n8q s LYS 118 CO 0.00 0.05 0.42 1.21 -0.92 0.00 0.00 175.35 176.11 1n8q s ASN 119 N 0.65 6.22 0.00 2.83 2.47 -1.26 -1.13 114.94 124.73 1n8q s ASN 119 Ca -0.13 -0.24 0.23 0.00 0.42 0.00 0.00 52.86 53.14 1n8q s ASN 119 Cb -0.16 -2.22 0.48 0.00 -1.45 0.00 0.00 41.25 37.90 1n8q s ASN 119 CO 0.03 -0.42 1.43 0.49 -3.72 0.00 0.00 177.10 174.91 1n8q n PHE 120 N 5.52 0.51 0.80 0.43 3.72 0.19 -0.34 117.46 128.29 1n8q n PHE 120 Ca -0.08 -0.25 0.06 0.00 -0.05 0.00 0.00 57.45 57.13 1n8q n PHE 120 Cb 0.49 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.19 1n8q n PHE 120 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1n8q n MET 121 N 1.36 1.90 0.00 -1.08 2.81 -1.24 -4.96 117.12 115.91 1n8q n MET 121 Ca 0.19 -1.32 0.00 0.00 -1.81 0.00 0.00 57.70 54.76 1n8q n MET 121 Cb 0.57 -1.32 0.00 0.00 -0.71 0.00 0.00 33.22 31.77 1n8q n MET 121 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 1n8q n GLN 122 N 0.55 0.00 -3.25 0.03 7.27 -1.26 -4.84 117.38 115.88 1n8q n GLN 122 Ca 0.12 0.00 -0.38 0.00 0.07 0.00 0.00 57.00 56.81 1n8q n GLN 122 Cb 0.33 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 32.92 1n8q n GLN 122 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1n8q s THR 123 N 0.00 5.15 0.64 1.69 2.01 -1.26 -4.72 115.64 119.15 1n8q s THR 123 Ca 0.00 1.07 -0.17 0.00 0.31 0.00 0.00 61.69 62.90 1n8q s THR 123 Cb 0.00 -3.87 -0.01 0.00 0.01 0.00 0.00 72.50 68.63 1n8q s THR 123 CO 0.00 0.32 1.19 -1.83 -0.69 0.00 0.00 174.62 173.60 1n8q s GLU 124 N 0.62 2.70 0.20 4.92 1.03 -1.26 -4.87 118.70 122.03 1n8q s GLU 124 Ca 0.29 1.72 0.03 0.00 0.03 0.00 0.00 54.97 57.04 1n8q s GLU 124 Cb -0.16 -1.91 -0.05 0.00 -0.80 0.00 0.00 34.13 31.22 1n8q s GLU 124 CO 0.12 -1.39 -0.03 -0.59 -1.33 0.00 0.00 175.26 172.04 1n8q s PHE 125 N -1.85 1.42 -0.31 4.83 -0.12 -1.10 -4.13 117.98 116.71 1n8q s PHE 125 Ca 0.74 -0.90 -0.10 0.00 -0.05 0.00 0.00 56.93 56.62 1n8q s PHE 125 Cb -0.28 -0.80 -0.01 0.00 -0.63 0.00 0.00 43.02 41.30 1n8q s PHE 125 CO 0.38 -0.05 0.18 0.12 -0.05 0.00 0.00 175.22 175.80 1n8q s PHE 126 N -3.45 3.19 -0.09 3.49 5.36 0.08 -0.35 117.98 126.22 1n8q s PHE 126 Ca 0.25 -0.40 -0.21 0.00 -0.96 0.00 0.00 56.93 55.60 1n8q s PHE 126 Cb 0.05 -2.38 -0.04 0.00 -0.34 0.00 0.00 43.02 40.31 1n8q s PHE 126 CO 0.06 -0.40 0.61 -1.17 -1.46 0.00 0.00 175.22 172.86 1n8q s LEU 127 N 1.66 4.30 -0.24 6.12 2.96 0.11 0.67 118.68 134.26 1n8q s LEU 127 Ca 0.05 1.04 -0.15 0.00 -0.22 0.00 0.00 54.13 54.84 1n8q s LEU 127 Cb -0.17 -2.92 -0.10 0.00 0.50 0.00 0.00 46.19 43.50 1n8q s LEU 127 CO 0.08 -0.06 -0.35 0.52 -1.32 0.00 0.00 176.35 175.21 1n8q n VAL 128 N 3.70 1.51 -3.68 1.68 0.31 -0.14 -1.40 118.33 120.30 1n8q n VAL 128 Ca -0.04 -0.18 -0.08 0.00 -0.01 0.00 0.00 64.34 64.03 1n8q n VAL 128 Cb 0.51 -2.06 -0.02 0.00 -0.91 0.00 0.00 33.84 31.36 1n8q n VAL 128 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1n8q s SER 129 N -6.88 -0.35 -0.03 4.52 1.04 -0.99 -0.15 113.70 110.87 1n8q s SER 129 Ca -0.35 -0.35 0.04 0.00 0.48 0.00 0.00 55.95 55.77 1n8q s SER 129 Cb 0.11 0.63 -0.00 0.00 0.10 0.00 0.00 66.02 66.85 1n8q s SER 129 CO 0.46 -1.12 -0.13 -0.22 0.98 0.00 0.00 173.24 173.22 1n8q s LEU 130 N -2.84 1.90 -0.12 2.42 2.96 -0.84 -1.04 118.68 121.13 1n8q s LEU 130 Ca 0.08 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 1n8q s LEU 130 Cb -0.03 -0.73 0.01 0.00 0.50 0.00 0.00 46.19 45.93 1n8q s LEU 130 CO -0.01 0.13 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.06 1n8q s THR 131 N -0.03 1.83 -0.14 3.68 2.01 -0.05 -0.09 115.64 122.85 1n8q s THR 131 Ca -0.00 -0.85 -0.03 0.00 0.31 0.00 0.00 61.69 61.11 1n8q s THR 131 Cb -0.08 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 1n8q s THR 131 CO 0.01 0.51 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.66 1n8q s LEU 132 N 0.74 3.36 0.38 4.42 1.43 0.50 -0.78 118.68 128.73 1n8q s LEU 132 Ca -0.10 -0.05 0.06 0.00 -1.03 0.00 0.00 54.13 53.00 1n8q s LEU 132 Cb -0.16 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1n8q s LEU 132 CO 0.01 0.22 0.21 -1.83 0.23 0.00 0.00 176.35 175.18 1n8q s GLU 133 N 0.08 1.87 -1.10 1.70 -1.05 0.48 -1.61 118.70 119.07 1n8q s GLU 133 Ca 0.00 -2.12 -0.01 0.00 -0.15 0.00 0.00 54.97 52.69 1n8q s GLU 133 Cb -0.13 -0.15 -0.02 0.00 -0.44 0.00 0.00 34.13 33.39 1n8q s GLU 133 CO 0.02 -0.58 0.93 -3.47 0.95 0.00 0.00 175.26 173.11 1n8q n ASP 134 N -1.47 -3.12 -4.35 0.83 4.64 -1.26 -1.35 116.55 110.46 1n8q n ASP 134 Ca 0.00 -0.61 -0.38 0.00 -1.38 0.00 0.00 54.79 52.43 1n8q n ASP 134 Cb 0.64 -4.91 -0.12 0.00 -1.04 0.00 0.00 41.12 35.68 1n8q n ASP 134 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1n8q s ILE 135 N -3.35 4.05 -0.02 5.18 1.01 -1.26 -4.62 121.20 122.19 1n8q s ILE 135 Ca 0.11 -0.69 -0.35 0.00 0.00 0.00 0.00 60.65 59.72 1n8q s ILE 135 Cb -0.01 -3.10 -0.13 0.00 0.01 0.00 0.00 42.46 39.22 1n8q s ILE 135 CO 0.69 0.06 1.72 -2.65 0.00 0.00 0.00 174.94 174.76 1n8q n PRO 136 N 4.88 1.92 -1.63 2.79 -0.02 -1.26 -2.00 135.00 139.69 1n8q n PRO 136 Ca -0.14 0.70 -0.18 0.00 -2.02 0.00 0.00 63.50 61.86 1n8q n PRO 136 Cb 0.48 -2.48 -0.07 0.00 -0.02 0.00 0.00 33.50 31.41 1n8q n PRO 136 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1n8q n ASN 137 N 5.07 -4.85 -4.24 2.55 5.15 -1.26 -4.99 115.26 112.69 1n8q n ASN 137 Ca 0.21 0.41 -0.22 0.00 -0.60 0.00 0.00 54.58 54.37 1n8q n ASN 137 Cb 0.26 -4.31 -0.13 0.00 -0.53 0.00 0.00 39.78 35.07 1n8q n ASN 137 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 1n8q s HIS 138 N -2.58 1.58 1.17 1.20 2.46 -0.85 -5.15 115.29 113.12 1n8q s HIS 138 Ca 0.00 -0.42 -0.19 0.00 0.47 0.00 0.00 55.06 54.92 1n8q s HIS 138 Cb 0.00 -0.89 0.28 0.00 -0.13 0.00 0.00 32.58 31.84 1n8q s HIS 138 CO 0.00 0.14 1.15 0.20 -2.47 0.00 0.00 174.74 173.75 1n8q s GLY 139 N -1.72 1.62 0.47 1.59 0.00 -1.26 -4.54 107.32 103.47 1n8q s GLY 139 Ca 0.04 -1.01 -0.24 0.00 0.00 0.00 0.00 44.72 43.51 1n8q s GLY 139 CO 0.03 -0.13 1.32 -0.56 0.00 0.00 0.00 173.10 173.76 1n8q s SER 140 N -4.07 5.89 -0.15 1.64 0.01 -1.26 -4.79 113.70 110.96 1n8q s SER 140 Ca 0.72 2.68 -0.03 0.00 1.31 0.00 0.00 55.95 60.62 1n8q s SER 140 Cb -0.08 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.49 1n8q s SER 140 CO 0.55 -1.14 -0.05 -0.63 0.41 0.00 0.00 173.24 172.38 1n8q s ILE 141 N -1.31 3.77 -0.05 1.44 1.01 -0.63 -4.98 121.20 120.45 1n8q s ILE 141 Ca 0.63 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.91 1n8q s ILE 141 Cb -0.38 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 1n8q s ILE 141 CO 0.48 0.49 -0.10 -1.00 0.00 0.00 0.00 174.94 174.81 1n8q s HIS 142 N 0.40 2.82 -0.12 3.97 3.76 -1.26 -0.37 115.29 124.48 1n8q s HIS 142 Ca -0.05 -0.07 0.01 0.00 -0.15 0.00 0.00 55.06 54.81 1n8q s HIS 142 Cb -0.14 -1.66 0.02 0.00 1.11 0.00 0.00 32.58 31.90 1n8q s HIS 142 CO 0.03 0.27 -0.16 -0.06 -0.85 0.00 0.00 174.74 173.97 1n8q s PHE 143 N -0.79 2.12 -0.24 1.40 0.40 0.87 -0.56 117.98 121.19 1n8q s PHE 143 Ca 0.12 -1.07 -0.09 0.00 -0.60 0.00 0.00 56.93 55.29 1n8q s PHE 143 Cb -0.11 -1.53 -0.04 0.00 0.51 0.00 0.00 43.02 41.85 1n8q s PHE 143 CO 0.01 -0.55 0.12 0.08 0.70 0.00 0.00 175.22 175.58 1n8q s VAL 144 N 1.12 4.96 -0.03 -0.44 1.01 -1.26 -1.98 120.40 123.78 1n8q s VAL 144 Ca -0.03 0.04 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 1n8q s VAL 144 Cb -0.14 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1n8q s VAL 144 CO -0.04 0.34 -0.15 0.00 0.00 0.00 0.00 175.10 175.25 1n8q n ASN 146 N -3.86 -3.09 -3.89 0.00 3.02 -0.50 -4.98 115.26 101.97 1n8q n ASN 146 Ca -0.08 -1.08 -0.11 0.00 -0.03 0.00 0.00 54.58 53.28 1n8q n ASN 146 Cb 0.27 -2.85 -0.12 0.00 -0.61 0.00 0.00 39.78 36.47 1n8q n ASN 146 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1n8q s SER 147 N -3.83 0.04 0.02 6.41 0.15 -0.82 -4.96 113.70 110.71 1n8q s SER 147 Ca 0.30 -0.14 -0.30 0.00 0.70 0.00 0.00 55.95 56.51 1n8q s SER 147 Cb -0.12 0.16 -0.04 0.00 -1.71 0.00 0.00 66.02 64.30 1n8q s SER 147 CO 0.90 -0.20 1.02 0.26 1.20 0.00 0.00 173.24 176.42 1n8q s TRP 148 N -0.80 3.63 -0.35 3.44 0.52 -1.26 0.06 118.94 124.18 1n8q s TRP 148 Ca -0.09 1.63 -0.05 0.00 0.02 0.00 0.00 56.10 57.61 1n8q s TRP 148 Cb -0.05 -3.17 0.06 0.00 -1.15 0.00 0.00 33.47 29.15 1n8q s TRP 148 CO 0.00 -0.24 0.12 0.42 0.02 0.00 0.00 176.95 177.27 1n8q s ILE 149 N 0.91 3.60 0.71 2.03 -1.09 0.53 -4.94 121.20 122.96 1n8q s ILE 149 Ca 0.53 -1.36 -0.07 0.00 -2.23 0.00 0.00 60.65 57.52 1n8q s ILE 149 Cb -0.23 -3.13 0.07 0.00 -1.58 0.00 0.00 42.46 37.58 1n8q s ILE 149 CO 0.29 -0.28 1.02 -0.31 -1.23 0.00 0.00 174.94 174.42 1n8q s TYR 150 N 1.34 2.86 0.17 3.97 1.51 -1.26 -2.72 117.35 123.21 1n8q s TYR 150 Ca -0.00 0.42 -0.33 0.00 -1.01 0.00 0.00 57.07 56.15 1n8q s TYR 150 Cb -0.21 -3.21 -0.15 0.00 -0.11 0.00 0.00 41.96 38.28 1n8q s TYR 150 CO 0.01 -1.44 1.27 -1.71 -1.11 0.00 0.00 175.55 172.56 1n8q n ASN 151 N -2.94 1.79 0.14 2.29 2.85 -1.26 -4.37 115.26 113.75 1n8q n ASN 151 Ca 0.08 1.13 0.14 0.00 -0.11 0.00 0.00 54.58 55.83 1n8q n ASN 151 Cb 0.60 -1.27 0.68 0.00 1.24 0.00 0.00 39.78 41.03 1n8q n ASN 151 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1n8q h ALA 152 N 3.90 2.22 -0.75 5.20 0.00 -1.05 -2.38 119.26 126.41 1n8q h ALA 152 Ca -0.44 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.46 1n8q h ALA 152 Cb 1.32 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 1n8q h ALA 152 CO 0.74 -0.32 0.50 0.87 0.00 0.00 0.00 179.25 181.03 1n8q h LYS 153 N 0.00 0.99 0.00 0.00 1.57 -1.90 -2.94 116.57 114.29 1n8q h LYS 153 Ca 0.12 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1n8q h LYS 153 Cb 0.50 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1n8q h LYS 153 CO -0.00 0.65 0.00 1.28 -0.57 0.00 0.00 179.45 180.81 1n8q n LEU 154 N -4.42 0.00 -0.10 2.94 4.77 -0.89 -4.43 117.00 114.87 1n8q n LEU 154 Ca 0.08 0.25 -0.19 0.00 -0.03 0.00 0.00 56.01 56.12 1n8q n LEU 154 Cb 0.03 -0.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.81 1n8q n LEU 154 CO 0.36 -0.19 -1.05 0.49 -1.33 0.00 0.00 177.39 175.67 1n8q n PHE 155 N -1.25 0.00 -2.66 -1.77 3.01 -1.11 -5.09 117.46 108.59 1n8q n PHE 155 Ca 0.04 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.44 1n8q n PHE 155 Cb 0.05 -0.69 -0.04 0.00 -0.01 0.00 0.00 39.48 38.79 1n8q n PHE 155 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1n8q n LYS 156 N -4.12 -4.25 -0.20 -1.08 2.85 -1.26 -4.99 118.16 105.12 1n8q n LYS 156 Ca -0.34 3.23 0.00 0.00 -1.05 0.00 0.00 58.31 60.15 1n8q n LYS 156 Cb 0.69 -4.64 0.00 0.00 -0.65 0.00 0.00 35.03 30.43 1n8q n LYS 156 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1n8q n SER 157 N 1.78 -2.14 -4.81 -5.58 3.41 -1.26 -5.05 113.62 99.96 1n8q n SER 157 Ca -0.37 0.03 -0.33 0.00 -0.26 0.00 0.00 58.87 57.94 1n8q n SER 157 Cb 0.58 0.22 -0.01 0.00 -0.26 0.00 0.00 64.21 64.74 1n8q n SER 157 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1n8q s ASP 158 N -0.68 6.08 0.20 4.04 1.01 -1.26 -4.98 116.67 121.07 1n8q s ASP 158 Ca 0.00 1.76 -0.32 0.00 0.71 0.00 0.00 52.55 54.70 1n8q s ASP 158 Cb 0.00 -2.53 -0.12 0.00 1.01 0.00 0.00 42.92 41.28 1n8q s ASP 158 CO 0.00 -0.96 1.72 0.54 0.21 0.00 0.00 175.17 176.67 1n8q n ARG 159 N -1.78 2.70 -4.75 8.23 5.12 -1.25 -4.90 116.66 120.04 1n8q n ARG 159 Ca 0.08 0.98 -0.26 0.00 -1.93 0.00 0.00 57.85 56.72 1n8q n ARG 159 Cb 0.53 -2.82 -0.15 0.00 -1.16 0.00 0.00 32.46 28.87 1n8q n ARG 159 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1n8q s ILE 160 N 1.25 1.59 -0.00 0.55 2.07 -1.26 -1.45 121.20 123.95 1n8q s ILE 160 Ca 0.76 -1.05 0.02 0.00 -1.41 0.00 0.00 60.65 58.97 1n8q s ILE 160 Cb -0.53 -1.36 -0.01 0.00 0.13 0.00 0.00 42.46 40.69 1n8q s ILE 160 CO 0.33 0.29 -0.07 -0.36 -1.91 0.00 0.00 174.94 173.22 1n8q s PHE 161 N -0.67 0.60 0.18 3.50 0.08 -0.60 -4.99 117.98 116.09 1n8q s PHE 161 Ca 0.07 -0.15 0.07 0.00 0.12 0.00 0.00 56.93 57.04 1n8q s PHE 161 Cb -0.08 -0.39 -0.04 0.00 -0.57 0.00 0.00 43.02 41.94 1n8q s PHE 161 CO 0.01 -0.01 0.05 -0.06 -0.10 0.00 0.00 175.22 175.11 1n8q s PHE 162 N -0.27 2.95 0.89 0.36 0.08 -1.26 -1.38 117.98 119.35 1n8q s PHE 162 Ca 0.01 -0.10 -0.11 0.00 0.12 0.00 0.00 56.93 56.86 1n8q s PHE 162 Cb -0.03 -1.42 0.12 0.00 -0.57 0.00 0.00 43.02 41.12 1n8q s PHE 162 CO -0.00 0.52 1.10 0.00 -0.10 0.00 0.00 175.22 176.74 1n8q s ALA 163 N -1.77 1.57 0.29 5.36 0.00 -0.73 -4.41 121.76 122.06 1n8q s ALA 163 Ca 0.29 0.17 0.26 0.00 0.00 0.00 0.00 51.96 52.68 1n8q s ALA 163 Cb -0.09 -3.28 0.91 0.00 0.00 0.00 0.00 23.12 20.66 1n8q s ALA 163 CO 0.20 -2.39 0.82 0.09 0.00 0.00 0.00 175.76 174.48 1n8q n ASN 164 N -3.94 0.01 -4.70 0.00 4.13 0.28 -4.80 115.26 106.23 1n8q n ASN 164 Ca 0.08 0.53 -0.42 0.00 1.68 0.00 0.00 54.58 56.45 1n8q n ASN 164 Cb 0.54 -0.27 -0.03 0.00 -1.54 0.00 0.00 39.78 38.48 1n8q n ASN 164 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1n8q s GLN 165 N -3.99 4.38 -0.01 3.52 1.11 -1.26 -2.58 119.66 120.82 1n8q s GLN 165 Ca -0.03 1.76 -0.23 0.00 0.01 0.00 0.00 55.36 56.88 1n8q s GLN 165 Cb 0.14 -3.45 -0.05 0.00 -1.01 0.00 0.00 33.01 28.65 1n8q s GLN 165 CO 0.47 -0.36 0.68 0.95 0.01 0.00 0.00 175.29 177.03 1n8q s THR 166 N 1.63 4.90 -0.05 -0.19 -4.23 -1.26 -4.87 115.64 111.58 1n8q s THR 166 Ca 0.58 1.43 0.00 0.00 -1.18 0.00 0.00 61.69 62.52 1n8q s THR 166 Cb -0.28 -4.02 0.02 0.00 1.34 0.00 0.00 72.50 69.56 1n8q s THR 166 CO 0.26 0.34 -0.02 -0.31 -0.54 0.00 0.00 174.62 174.36 1n8q s TYR 167 N 0.20 0.62 0.73 3.99 2.02 -0.88 -4.94 117.35 119.08 1n8q s TYR 167 Ca 0.35 -0.14 -0.16 0.00 -0.37 0.00 0.00 57.07 56.75 1n8q s TYR 167 Cb -0.19 -0.64 0.03 0.00 -0.40 0.00 0.00 41.96 40.76 1n8q s TYR 167 CO 0.19 -0.22 1.19 1.28 -1.57 0.00 0.00 175.55 176.43 1n8q n LEU 168 N 4.39 4.90 -1.78 -1.29 4.77 -1.26 -4.06 117.00 122.68 1n8q n LEU 168 Ca -0.20 0.70 -0.06 0.00 -0.03 0.00 0.00 56.01 56.42 1n8q n LEU 168 Cb 0.50 -1.51 -0.08 0.00 -2.33 0.00 0.00 43.42 40.00 1n8q n LEU 168 CO 0.19 -1.48 1.27 -2.65 -1.33 0.00 0.00 177.39 173.39 1n8q n PRO 169 N -2.43 1.44 0.00 3.23 -0.02 -1.26 -1.85 135.00 134.11 1n8q n PRO 169 Ca 0.14 -0.49 0.13 0.00 -2.02 0.00 0.00 63.50 61.27 1n8q n PRO 169 Cb 0.49 -1.51 0.68 0.00 -0.02 0.00 0.00 33.50 33.14 1n8q n PRO 169 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1n8q n SER 170 N 2.03 0.00 0.00 2.55 3.41 -1.26 -4.67 113.62 115.68 1n8q n SER 170 Ca 0.21 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1n8q n SER 170 Cb 0.68 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1n8q n SER 170 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n8q n GLU 171 N -1.25 0.00 0.00 4.33 1.02 -0.77 -4.89 120.64 119.08 1n8q n GLU 171 Ca 0.13 0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1n8q n GLU 171 Cb 0.19 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 28.92 1n8q n GLU 171 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1n8q n THR 172 N -2.69 0.00 -1.69 2.62 -1.04 -1.19 -4.22 114.28 106.07 1n8q n THR 172 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1n8q n THR 172 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 1n8q n THR 172 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1n8q s PRO 173 N 0.00 4.14 0.27 -2.82 0.02 -1.26 -4.74 135.00 130.61 1n8q s PRO 173 Ca 0.00 2.59 -0.02 0.00 0.02 0.00 0.00 61.00 63.59 1n8q s PRO 173 Cb 0.00 -4.15 0.58 0.00 0.02 0.00 0.00 34.50 30.96 1n8q s PRO 173 CO 0.00 -0.95 1.64 0.00 -0.33 0.00 0.00 177.00 177.36 1n8q h ALA 174 N 10.52 1.06 0.00 -1.55 0.00 -1.86 0.20 119.26 127.62 1n8q h ALA 174 Ca -0.49 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1n8q h ALA 174 Cb 1.23 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1n8q h ALA 174 CO 0.94 -0.44 0.00 -2.30 0.00 0.00 0.00 179.25 177.45 1n8q n PRO 175 N -5.27 0.10 -0.00 0.00 -0.02 -1.26 -2.73 135.00 125.81 1n8q n PRO 175 Ca 0.18 0.60 0.08 0.00 -2.02 0.00 0.00 63.50 62.34 1n8q n PRO 175 Cb 0.58 -1.83 -0.12 0.00 -0.02 0.00 0.00 33.50 32.11 1n8q n PRO 175 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1n8q n LEU 176 N -2.05 0.33 -0.24 2.45 4.32 0.65 0.53 117.00 122.99 1n8q n LEU 176 Ca -0.01 -0.20 0.03 0.00 -0.02 0.00 0.00 56.01 55.81 1n8q n LEU 176 Cb 0.02 0.00 0.13 0.00 -1.62 0.00 0.00 43.42 41.95 1n8q n LEU 176 CO 0.07 0.08 0.82 0.58 -1.22 0.00 0.00 177.39 177.72 1n8q h VAL 177 N 0.00 0.40 -0.09 4.08 2.07 -1.26 -1.51 116.25 119.93 1n8q h VAL 177 Ca 0.00 -0.04 -0.13 0.00 0.82 0.00 0.00 66.70 67.35 1n8q h VAL 177 Cb 0.64 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1n8q h VAL 177 CO 0.00 0.02 -0.54 0.11 0.02 0.00 0.00 177.57 177.18 1n8q h LYS 178 N 0.10 0.27 -0.48 1.57 1.57 -1.82 -2.63 116.57 115.15 1n8q h LYS 178 Ca 0.37 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.90 1n8q h LYS 178 Cb 0.63 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1n8q h LYS 178 CO -0.62 0.74 -0.06 1.88 -0.57 0.00 0.00 179.45 180.82 1n8q h TYR 179 N 0.21 0.91 -0.19 -1.35 0.05 -1.59 -1.31 116.97 113.70 1n8q h TYR 179 Ca 0.00 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.61 1n8q h TYR 179 Cb 1.01 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.51 1n8q h TYR 179 CO 0.02 0.86 0.05 -0.09 -1.05 0.00 0.00 178.16 177.96 1n8q h ARG 180 N 0.77 0.30 -0.56 4.88 2.43 -1.20 -2.72 114.38 118.29 1n8q h ARG 180 Ca 0.14 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 1n8q h ARG 180 Cb 0.55 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 1n8q h ARG 180 CO 0.03 0.42 0.04 0.93 -1.51 0.00 0.00 179.97 179.87 1n8q h GLU 181 N 0.13 0.97 -0.21 0.20 5.08 -1.39 -2.93 114.58 116.43 1n8q h GLU 181 Ca 0.06 -0.29 -0.14 0.00 -1.00 0.00 0.00 59.36 58.00 1n8q h GLU 181 Cb 0.24 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1n8q h GLU 181 CO -0.00 0.95 -0.45 1.49 -1.00 0.00 0.00 179.01 180.01 1n8q h GLU 182 N 0.85 0.52 -0.05 2.33 4.81 -1.28 -1.50 114.58 120.26 1n8q h GLU 182 Ca 0.16 -0.28 -0.15 0.00 -0.13 0.00 0.00 59.36 58.96 1n8q h GLU 182 Cb 0.49 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1n8q h GLU 182 CO 0.02 0.86 -0.65 1.49 -0.73 0.00 0.00 179.01 180.00 1n8q h GLU 183 N 0.42 0.20 -0.55 1.92 4.81 -1.48 -0.76 114.58 119.14 1n8q h GLU 183 Ca 0.03 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.07 1n8q h GLU 183 Cb 0.95 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.33 1n8q h GLU 183 CO 0.08 0.78 0.17 -0.07 -0.73 0.00 0.00 179.01 179.25 1n8q h LEU 184 N 0.14 0.76 -0.49 1.64 4.07 -1.31 -1.25 115.31 118.87 1n8q h LEU 184 Ca -0.01 -0.12 -0.13 0.00 0.08 0.00 0.00 57.88 57.70 1n8q h LEU 184 Cb 1.17 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.70 1n8q h LEU 184 CO 0.10 0.72 -0.19 -0.74 -1.08 0.00 0.00 178.44 177.25 1n8q h HIS 185 N 0.80 1.13 -0.21 1.13 2.76 -1.07 -2.79 115.15 116.91 1n8q h HIS 185 Ca 0.18 -0.27 -0.09 0.00 -2.20 0.00 0.00 60.37 58.00 1n8q h HIS 185 Cb 0.23 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 1n8q h HIS 185 CO 0.01 1.09 -0.24 -0.91 -1.30 0.00 0.00 177.93 176.58 1n8q h ASN 186 N 0.85 0.38 0.66 3.26 2.35 -0.54 -2.83 115.58 119.70 1n8q h ASN 186 Ca 0.11 -0.12 -0.09 0.00 -0.55 0.00 0.00 56.30 55.66 1n8q h ASN 186 Cb 0.77 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 1n8q h ASN 186 CO 0.06 0.63 -0.41 -0.07 -1.65 0.00 0.00 177.43 176.00 1n8q h LEU 187 N 0.35 0.00 -0.07 1.61 4.07 -1.11 -3.25 115.31 116.91 1n8q h LEU 187 Ca 0.05 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.81 1n8q h LEU 187 Cb 0.62 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.37 1n8q h LEU 187 CO 0.04 0.41 -0.77 0.03 -1.08 0.00 0.00 178.44 177.07 1n8q h ARG 188 N 0.00 0.64 0.00 1.13 3.08 -1.25 0.87 114.38 118.85 1n8q h ARG 188 Ca -0.00 -0.60 0.00 0.00 0.07 0.00 0.00 59.98 59.45 1n8q h ARG 188 Cb 0.85 0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1n8q h ARG 188 CO 0.05 1.21 0.00 0.41 -1.07 0.00 0.00 179.97 180.57 1n8q n GLY 189 N 0.89 1.60 0.57 0.04 0.00 -1.17 -4.41 105.19 102.71 1n8q n GLY 189 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1n8q n GLY 189 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n8q n ASP 190 N 0.00 0.00 0.00 1.61 2.03 -1.26 -4.56 116.55 114.36 1n8q n ASP 190 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1n8q n ASP 190 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1n8q n ASP 190 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1n8q n GLY 191 N 0.00 0.64 3.39 0.27 0.00 -1.26 -5.08 105.19 103.15 1n8q n GLY 191 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1n8q n GLY 191 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n8q s THR 192 N -2.00 1.69 0.00 2.61 -4.23 -1.26 -5.12 115.64 107.33 1n8q s THR 192 Ca 0.00 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.34 1n8q s THR 192 Cb 0.00 -2.26 0.00 0.00 1.34 0.00 0.00 72.50 71.58 1n8q s THR 192 CO 0.00 -0.44 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 1n8q n GLY 193 N -0.49 2.45 3.68 3.99 0.00 -1.26 -4.94 105.19 108.63 1n8q n GLY 193 Ca -0.07 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 1n8q n GLY 193 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n8q s GLU 194 N -4.40 4.37 0.31 1.61 2.12 -1.24 -4.17 118.70 117.29 1n8q s GLU 194 Ca 0.00 1.47 -0.29 0.00 0.36 0.00 0.00 54.97 56.51 1n8q s GLU 194 Cb 0.00 -3.57 -0.10 0.00 0.26 0.00 0.00 34.13 30.72 1n8q s GLU 194 CO 0.00 -0.42 1.27 1.03 -0.54 0.00 0.00 175.26 176.60 1n8q s ARG 195 N 2.32 4.42 0.22 4.30 1.81 -1.26 -4.92 118.95 125.83 1n8q s ARG 195 Ca 0.50 2.12 0.10 0.00 -1.72 0.00 0.00 55.73 56.73 1n8q s ARG 195 Cb -0.20 -3.11 -0.04 0.00 -0.45 0.00 0.00 34.95 31.15 1n8q s ARG 195 CO 0.17 -0.11 -0.14 0.15 -0.68 0.00 0.00 175.30 174.68 1n8q s LYS 196 N -1.53 1.86 0.35 3.54 -0.14 -1.26 -4.88 119.74 117.67 1n8q s LYS 196 Ca 0.49 -1.48 0.15 0.00 -1.36 0.00 0.00 55.97 53.76 1n8q s LYS 196 Cb -0.38 -1.98 1.08 0.00 -1.68 0.00 0.00 37.83 34.87 1n8q s LYS 196 CO 0.49 0.39 1.68 1.49 -0.76 0.00 0.00 175.35 178.64 1n8q h GLU 197 N 2.66 0.35 -0.14 1.68 4.81 -1.97 -1.63 114.58 120.34 1n8q h GLU 197 Ca -0.45 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1n8q h GLU 197 Cb 1.23 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1n8q h GLU 197 CO 0.55 0.23 0.00 -2.67 -0.73 0.00 0.00 179.01 176.39 1n8q n TRP 198 N -4.97 0.18 -3.21 0.92 4.27 -1.26 -4.37 117.44 109.00 1n8q n TRP 198 Ca 0.31 -0.09 -0.27 0.00 -3.89 0.00 0.00 57.50 53.56 1n8q n TRP 198 Cb 0.96 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.89 1n8q n TRP 198 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 1n8q s GLU 199 N -1.82 3.58 -0.42 -2.67 2.02 -0.62 -4.85 118.70 113.92 1n8q s GLU 199 Ca 0.33 -0.04 0.10 0.00 0.02 0.00 0.00 54.97 55.39 1n8q s GLU 199 Cb 0.18 -2.59 0.40 0.00 0.10 0.00 0.00 34.13 32.22 1n8q s GLU 199 CO 0.28 0.11 0.94 0.54 0.02 0.00 0.00 175.26 177.15 1n8q n ARG 200 N -1.42 2.17 -4.34 1.61 1.74 -1.26 -1.49 116.66 113.66 1n8q n ARG 200 Ca -0.02 -3.97 -0.34 0.00 -0.77 0.00 0.00 57.85 52.75 1n8q n ARG 200 Cb 0.55 -1.84 -0.14 0.00 -1.02 0.00 0.00 32.46 30.00 1n8q n ARG 200 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1n8q s ILE 201 N -3.89 3.04 -0.21 0.55 1.01 -1.26 -4.49 121.20 115.95 1n8q s ILE 201 Ca 0.41 -0.63 -0.05 0.00 0.00 0.00 0.00 60.65 60.37 1n8q s ILE 201 Cb 0.38 -2.32 -0.02 0.00 0.01 0.00 0.00 42.46 40.50 1n8q s ILE 201 CO -0.09 0.49 0.00 -0.31 0.00 0.00 0.00 174.94 175.03 1n8q s TYR 202 N 0.93 3.03 0.37 3.97 1.51 0.30 -4.59 117.35 122.86 1n8q s TYR 202 Ca -0.02 -0.53 -0.11 0.00 -1.01 0.00 0.00 57.07 55.40 1n8q s TYR 202 Cb -0.15 -2.10 0.04 0.00 -0.11 0.00 0.00 41.96 39.63 1n8q s TYR 202 CO -0.00 -0.31 0.67 0.34 -1.11 0.00 0.00 175.55 175.14 1n8q s ASP 203 N 1.15 0.34 0.12 2.29 -1.08 -1.26 -4.50 116.67 113.73 1n8q s ASP 203 Ca 0.03 -1.26 0.09 0.00 -0.52 0.00 0.00 52.55 50.89 1n8q s ASP 203 Cb -0.14 0.78 -0.04 0.00 -1.46 0.00 0.00 42.92 42.06 1n8q s ASP 203 CO 0.01 -1.54 -0.17 -0.31 0.52 0.00 0.00 175.17 173.68 1n8q s TYR 204 N -2.62 2.54 0.18 -5.34 1.51 -1.26 -0.15 117.35 112.22 1n8q s TYR 204 Ca 0.21 -0.26 -0.15 0.00 -1.01 0.00 0.00 57.07 55.86 1n8q s TYR 204 Cb -0.03 -1.34 0.02 0.00 -0.11 0.00 0.00 41.96 40.50 1n8q s TYR 204 CO 0.15 0.40 0.45 0.34 -1.11 0.00 0.00 175.55 175.78 1n8q s ASP 205 N -2.21 -0.17 0.79 2.29 -1.08 0.44 -4.46 116.67 112.27 1n8q s ASP 205 Ca 0.19 -0.58 -0.08 0.00 -0.52 0.00 0.00 52.55 51.55 1n8q s ASP 205 Cb -0.10 0.54 0.12 0.00 -1.46 0.00 0.00 42.92 42.01 1n8q s ASP 205 CO 0.11 -1.00 1.11 0.68 0.52 0.00 0.00 175.17 176.58 1n8q s VAL 206 N -3.90 2.15 -1.02 1.11 -7.23 -1.26 -0.72 120.40 109.54 1n8q s VAL 206 Ca 0.11 -0.24 -0.16 0.00 -1.81 0.00 0.00 61.98 59.88 1n8q s VAL 206 Cb 0.00 -2.91 0.16 0.00 0.56 0.00 0.00 36.38 34.20 1n8q s VAL 206 CO -0.02 0.00 1.18 -0.31 -0.31 0.00 0.00 175.10 175.64 1n8q s TYR 207 N -3.43 3.39 -0.03 2.82 1.51 -0.83 -4.60 117.35 116.17 1n8q s TYR 207 Ca 0.66 -1.78 0.05 0.00 -1.01 0.00 0.00 57.07 54.98 1n8q s TYR 207 Cb -0.08 -4.21 0.07 0.00 -0.11 0.00 0.00 41.96 37.64 1n8q s TYR 207 CO 0.47 -1.37 1.02 0.27 -1.11 0.00 0.00 175.55 174.84 1n8q n ASN 208 N 5.71 2.02 -0.14 2.29 2.04 -1.26 -1.16 115.26 124.75 1n8q n ASN 208 Ca 0.27 -2.24 0.05 0.00 -0.44 0.00 0.00 54.58 52.22 1n8q n ASN 208 Cb 0.46 -0.11 0.09 0.00 -2.53 0.00 0.00 39.78 37.69 1n8q n ASN 208 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1n8q n ASP 209 N -0.71 2.35 0.02 0.53 3.85 -1.26 -1.11 116.55 120.22 1n8q n ASP 209 Ca 0.04 -2.51 0.01 0.00 -0.71 0.00 0.00 54.79 51.61 1n8q n ASP 209 Cb 0.36 -0.23 -0.10 0.00 -1.35 0.00 0.00 41.12 39.80 1n8q n ASP 209 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1n8q n LEU 210 N -0.80 0.67 -5.03 -2.12 4.32 -1.26 -4.90 117.00 107.87 1n8q n LEU 210 Ca 0.09 0.29 -0.19 0.00 -0.02 0.00 0.00 56.01 56.18 1n8q n LEU 210 Cb 0.47 0.11 0.05 0.00 -1.62 0.00 0.00 43.42 42.43 1n8q n LEU 210 CO 0.02 0.15 0.32 -0.83 -1.22 0.00 0.00 177.39 175.83 1n8q s GLY 211 N -4.82 1.76 -0.40 -0.72 0.00 -1.26 -0.51 107.32 101.36 1n8q s GLY 211 Ca -0.04 -2.07 0.07 0.00 0.00 0.00 0.00 44.72 42.68 1n8q s GLY 211 CO 0.82 -1.65 0.49 1.34 0.00 0.00 0.00 173.10 174.09 1n8q n ASP 212 N -2.19 0.11 0.18 1.64 2.03 0.10 -4.84 116.55 113.58 1n8q n ASP 212 Ca 0.15 -2.64 0.14 0.00 0.52 0.00 0.00 54.79 52.96 1n8q n ASP 212 Cb 0.61 -0.62 0.56 0.00 -0.72 0.00 0.00 41.12 40.95 1n8q n ASP 212 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1n8q h PRO 213 N 4.36 0.00 0.00 -0.67 0.14 -1.75 -1.48 132.00 132.61 1n8q h PRO 213 Ca 0.12 0.00 -0.07 0.00 0.14 0.00 0.00 66.00 66.18 1n8q h PRO 213 Cb 0.88 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.01 1n8q h PRO 213 CO 0.45 0.00 -0.36 -0.44 0.14 0.00 0.00 178.00 177.79 1n8q h ASP 214 N 0.00 0.00 1.44 1.44 3.32 -1.94 -2.63 116.42 118.05 1n8q h ASP 214 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1n8q h ASP 214 Cb 0.43 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 1n8q h ASP 214 CO 0.00 0.36 -0.04 0.50 -1.72 0.00 0.00 179.24 178.33 1n8q h LYS 215 N 0.00 0.00 0.00 3.56 3.64 -1.67 -3.49 116.57 118.61 1n8q h LYS 215 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1n8q h LYS 215 Cb 0.72 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1n8q h LYS 215 CO 0.05 0.04 0.00 0.41 -2.27 0.00 0.00 179.45 177.68 1n8q n GLY 216 N 0.54 -0.42 0.10 5.01 0.00 -0.99 -4.93 105.19 104.49 1n8q n GLY 216 Ca 0.02 -1.55 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 1n8q n GLY 216 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1n8q n GLU 217 N -0.23 0.67 0.00 1.61 0.00 -1.26 -3.62 120.64 117.80 1n8q n GLU 217 Ca 0.00 0.28 0.11 0.00 0.00 0.00 0.00 57.16 57.54 1n8q n GLU 217 Cb 0.00 -1.76 0.51 0.00 0.00 0.00 0.00 31.44 30.19 1n8q n GLU 217 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 1n8q n ASN 218 N -3.16 0.00 -0.56 -1.84 6.94 -1.26 -2.11 115.26 113.28 1n8q n ASN 218 Ca -0.22 0.29 0.11 0.00 -0.02 0.00 0.00 54.58 54.75 1n8q n ASN 218 Cb 1.05 -0.42 0.03 0.00 -2.36 0.00 0.00 39.78 38.09 1n8q n ASN 218 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1n8q n HIS 219 N -1.42 0.00 -2.58 -2.53 8.25 -1.24 -4.96 115.22 110.75 1n8q n HIS 219 Ca 0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.17 1n8q n HIS 219 Cb 0.23 -0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.29 1n8q n HIS 219 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n8q s ALA 220 N -2.40 3.08 0.03 -1.41 0.00 -0.90 0.00 121.76 120.16 1n8q s ALA 220 Ca 0.20 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.85 1n8q s ALA 220 Cb 0.18 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.03 1n8q s ALA 220 CO 0.53 -0.17 -0.07 1.03 0.00 0.00 0.00 175.76 177.07 1n8q s ARG 221 N -2.56 0.50 0.50 0.00 1.81 -1.26 -4.88 118.95 113.05 1n8q s ARG 221 Ca 0.58 -0.56 -0.22 0.00 -1.72 0.00 0.00 55.73 53.82 1n8q s ARG 221 Cb -0.21 -0.35 -0.07 0.00 -0.45 0.00 0.00 34.95 33.88 1n8q s ARG 221 CO 0.26 0.08 1.18 -1.25 -0.68 0.00 0.00 175.30 174.89 1n8q s PRO 222 N -1.06 3.55 0.17 3.54 0.04 -1.26 -4.75 135.00 135.23 1n8q s PRO 222 Ca -0.05 1.80 -0.31 0.00 0.04 0.00 0.00 61.00 62.47 1n8q s PRO 222 Cb -0.07 -2.28 -0.10 0.00 0.04 0.00 0.00 34.50 32.09 1n8q s PRO 222 CO 0.00 -0.73 1.55 0.08 0.04 0.00 0.00 177.00 177.94 1n8q s VAL 223 N -1.56 2.67 -0.20 -0.36 1.01 -1.26 -4.88 120.40 115.82 1n8q s VAL 223 Ca 0.67 0.48 -0.04 0.00 0.00 0.00 0.00 61.98 63.10 1n8q s VAL 223 Cb -0.29 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 1n8q s VAL 223 CO 0.35 0.04 -0.05 -0.76 0.00 0.00 0.00 175.10 174.68 1n8q s LEU 224 N 1.06 2.97 0.00 3.92 1.02 -0.31 -4.82 118.68 122.52 1n8q s LEU 224 Ca 0.69 -0.32 0.00 0.00 0.02 0.00 0.00 54.13 54.52 1n8q s LEU 224 Cb -0.43 -1.74 0.00 0.00 0.02 0.00 0.00 46.19 44.04 1n8q s LEU 224 CO 0.32 0.04 0.00 0.61 0.02 0.00 0.00 176.35 177.34 1n8q n GLY 225 N 4.39 2.36 2.32 -3.19 0.00 0.26 -1.97 105.19 109.35 1n8q n GLY 225 Ca -0.18 -1.79 -0.00 0.00 0.00 0.00 0.00 46.02 44.05 1n8q n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8q n GLY 226 N 1.61 0.37 3.32 -0.02 0.00 -1.26 -4.86 105.19 104.34 1n8q n GLY 226 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 1n8q n GLY 226 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n8q s ASN 227 N -2.06 0.08 -0.02 1.61 2.20 -1.26 -5.08 114.94 110.41 1n8q s ASN 227 Ca 0.00 -1.21 -0.01 0.00 -0.94 0.00 0.00 52.86 50.70 1n8q s ASN 227 Cb 0.00 0.44 -0.26 0.00 -2.00 0.00 0.00 41.25 39.42 1n8q s ASN 227 CO 0.00 -0.92 0.76 0.44 -2.94 0.00 0.00 177.10 174.44 1n8q h ASP 228 N 2.53 0.31 -0.01 3.54 5.19 -1.98 -3.21 116.42 122.79 1n8q h ASP 228 Ca -0.33 -0.50 -0.00 0.00 -0.62 0.00 0.00 57.03 55.59 1n8q h ASP 228 Cb 1.25 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.65 1n8q h ASP 228 CO 0.48 1.42 0.01 0.74 -3.12 0.00 0.00 179.24 178.77 1n8q h THR 229 N 0.05 1.09 -2.32 0.35 2.02 -2.00 -3.36 112.91 108.76 1n8q h THR 229 Ca -0.27 -0.27 -0.60 0.00 0.77 0.00 0.00 66.41 66.04 1n8q h THR 229 Cb 2.01 1.25 -0.42 0.00 -1.74 0.00 0.00 68.15 69.26 1n8q h THR 229 CO 0.14 0.07 -0.62 0.49 0.37 0.00 0.00 175.52 175.97 1n8q n PHE 230 N -5.02 3.33 -1.83 3.16 3.72 -1.26 -4.65 117.46 114.91 1n8q n PHE 230 Ca -0.07 -4.14 -0.34 0.00 -0.05 0.00 0.00 57.45 52.85 1n8q n PHE 230 Cb 0.08 -0.55 0.05 0.00 -0.94 0.00 0.00 39.48 38.12 1n8q n PHE 230 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1n8q s PRO 231 N -2.24 2.81 -0.00 -1.08 0.04 -1.21 0.91 135.00 134.22 1n8q s PRO 231 Ca 0.37 1.57 -0.27 0.00 0.04 0.00 0.00 61.00 62.72 1n8q s PRO 231 Cb 0.12 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.79 1n8q s PRO 231 CO -0.04 -1.28 0.61 -0.47 0.04 0.00 0.00 177.00 175.86 1n8q s TYR 232 N -2.05 -0.56 0.81 0.56 5.04 -1.26 -4.50 117.35 115.39 1n8q s TYR 232 Ca 0.71 0.83 -0.13 0.00 -2.44 0.00 0.00 57.07 56.04 1n8q s TYR 232 Cb -0.24 0.39 0.08 0.00 0.35 0.00 0.00 41.96 42.54 1n8q s TYR 232 CO 0.38 -0.63 1.19 -0.35 -1.34 0.00 0.00 175.55 174.80 1n8q n PRO 233 N 0.69 0.17 -2.12 4.97 -0.04 -1.26 -4.66 135.00 132.75 1n8q n PRO 233 Ca -0.19 0.14 -0.28 0.00 -0.04 0.00 0.00 63.50 63.12 1n8q n PRO 233 Cb 0.58 -2.42 0.04 0.00 -0.04 0.00 0.00 33.50 31.66 1n8q n PRO 233 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1n8q s ARG 234 N -4.09 2.82 0.36 0.54 1.81 -0.15 -4.77 118.95 115.47 1n8q s ARG 234 Ca 0.73 0.22 0.04 0.00 -1.72 0.00 0.00 55.73 55.00 1n8q s ARG 234 Cb -0.29 -2.13 -0.06 0.00 -0.45 0.00 0.00 34.95 32.02 1n8q s ARG 234 CO 0.51 -0.92 0.05 -0.98 -0.68 0.00 0.00 175.30 173.28 1n8q s ARG 235 N -5.21 1.78 -0.04 3.54 1.04 0.11 -4.14 118.95 116.03 1n8q s ARG 235 Ca 0.57 -2.02 -0.33 0.00 -1.04 0.00 0.00 55.73 52.91 1n8q s ARG 235 Cb -0.11 -1.04 -0.11 0.00 -2.04 0.00 0.00 34.95 31.65 1n8q s ARG 235 CO 0.48 -0.20 1.91 0.41 -0.04 0.00 0.00 175.30 177.87 1n8q n GLY 236 N -0.81 1.61 3.69 3.88 0.00 -1.26 -0.42 105.19 111.88 1n8q n GLY 236 Ca -0.04 0.84 -0.43 0.00 0.00 0.00 0.00 46.02 46.39 1n8q n GLY 236 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1n8q n ARG 237 N 6.92 2.73 -4.66 1.61 0.63 0.78 -4.69 116.66 119.98 1n8q n ARG 237 Ca 0.22 0.99 -0.25 0.00 -0.92 0.00 0.00 57.85 57.89 1n8q n ARG 237 Cb 0.34 -2.88 -0.16 0.00 0.45 0.00 0.00 32.46 30.20 1n8q n ARG 237 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 1n8q s THR 238 N 2.76 1.24 -0.63 5.15 -1.32 -1.26 -4.76 115.64 116.82 1n8q s THR 238 Ca 0.83 -0.55 0.03 0.00 -1.21 0.00 0.00 61.69 60.79 1n8q s THR 238 Cb -0.50 -1.11 0.37 0.00 -1.51 0.00 0.00 72.50 69.75 1n8q s THR 238 CO 0.38 0.38 1.29 0.61 -2.21 0.00 0.00 174.62 175.07 1n8q n GLY 239 N 3.69 5.82 3.71 6.08 0.00 -1.26 -4.96 105.19 118.27 1n8q n GLY 239 Ca -0.22 -2.71 -0.30 0.00 0.00 0.00 0.00 46.02 42.80 1n8q n GLY 239 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n8q s ARG 240 N -3.71 1.21 0.49 1.61 0.52 -1.26 -3.68 118.95 114.14 1n8q s ARG 240 Ca 0.48 0.86 -0.22 0.00 -0.52 0.00 0.00 55.73 56.33 1n8q s ARG 240 Cb 0.34 -1.80 -0.06 0.00 0.52 0.00 0.00 34.95 33.94 1n8q s ARG 240 CO -0.20 -2.28 1.22 -1.59 0.02 0.00 0.00 175.30 172.47 1n8q s LYS 241 N -4.91 3.52 0.81 3.54 -2.85 -1.26 -4.73 119.74 113.86 1n8q s LYS 241 Ca 0.64 1.91 -0.11 0.00 -1.00 0.00 0.00 55.97 57.40 1n8q s LYS 241 Cb -0.18 -2.32 0.08 0.00 -2.06 0.00 0.00 37.83 33.34 1n8q s LYS 241 CO 0.57 -0.79 1.09 -1.25 0.10 0.00 0.00 175.35 175.07 1n8q s PRO 242 N -2.81 1.97 0.78 1.78 0.04 -1.26 -1.74 135.00 133.75 1n8q s PRO 242 Ca 0.67 0.87 -0.12 0.00 0.04 0.00 0.00 61.00 62.45 1n8q s PRO 242 Cb -0.32 -1.89 0.06 0.00 0.04 0.00 0.00 34.50 32.40 1n8q s PRO 242 CO 0.38 -1.76 1.14 -0.08 0.04 0.00 0.00 177.00 176.72 1n8q s THR 243 N -3.01 2.74 0.08 1.26 -1.32 -0.56 -4.53 115.64 110.31 1n8q s THR 243 Ca 0.61 0.29 -0.17 0.00 -1.21 0.00 0.00 61.69 61.22 1n8q s THR 243 Cb -0.16 -2.68 -0.10 0.00 -1.51 0.00 0.00 72.50 68.05 1n8q s THR 243 CO 0.56 -0.27 1.41 0.03 -2.21 0.00 0.00 174.62 174.14 1n8q h ARG 244 N -0.89 0.59 0.00 7.08 2.47 -1.96 -3.33 114.38 118.35 1n8q h ARG 244 Ca -0.45 -0.30 0.00 0.00 -1.26 0.00 0.00 59.98 57.97 1n8q h ARG 244 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 1n8q h ARG 244 CO 0.49 0.89 -0.12 0.87 0.56 0.00 0.00 179.97 182.66 1n8q h LYS 245 N 0.31 0.00 -2.09 0.04 1.57 -1.93 -3.42 116.57 111.04 1n8q h LYS 245 Ca 0.04 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.61 1n8q h LYS 245 Cb 0.77 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.76 1n8q h LYS 245 CO 0.06 0.00 -0.54 0.34 -0.57 0.00 0.00 179.45 178.74 1n8q s ASP 246 N -5.31 0.72 0.61 0.86 3.68 -1.25 -5.02 116.67 110.95 1n8q s ASP 246 Ca 0.08 -0.03 0.29 0.00 2.13 0.00 0.00 52.55 55.02 1n8q s ASP 246 Cb 0.09 0.84 1.60 0.00 -1.45 0.00 0.00 42.92 44.00 1n8q s ASP 246 CO 0.65 -0.32 1.98 -0.65 0.13 0.00 0.00 175.17 176.97 1n8q h PRO 247 N 8.23 0.00 -0.01 4.34 0.11 -1.83 -2.42 132.00 140.41 1n8q h PRO 247 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1n8q h PRO 247 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1n8q h PRO 247 CO 0.28 0.00 -0.26 0.09 -0.21 0.00 0.00 178.00 177.90 1n8q n ASN 248 N -3.54 1.16 -4.68 -2.05 4.13 -1.26 -4.83 115.26 104.19 1n8q n ASN 248 Ca 0.04 -1.00 -0.34 0.00 1.68 0.00 0.00 54.58 54.96 1n8q n ASN 248 Cb 0.47 0.16 -0.09 0.00 -1.54 0.00 0.00 39.78 38.78 1n8q n ASN 248 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1n8q s SER 249 N -2.46 5.15 -0.01 6.41 0.01 -0.91 -4.87 113.70 117.02 1n8q s SER 249 Ca 0.25 0.07 -0.19 0.00 1.31 0.00 0.00 55.95 57.39 1n8q s SER 249 Cb 0.19 -1.40 -0.05 0.00 0.21 0.00 0.00 66.02 64.97 1n8q s SER 249 CO 0.51 0.33 0.54 -0.70 0.41 0.00 0.00 173.24 174.33 1n8q s GLU 250 N -1.18 4.24 0.61 12.44 2.12 -0.27 -1.49 118.70 135.17 1n8q s GLU 250 Ca 0.16 0.63 -0.18 0.00 0.36 0.00 0.00 54.97 55.94 1n8q s GLU 250 Cb -0.11 -3.32 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 1n8q s GLU 250 CO 0.06 0.42 1.19 -1.54 -0.54 0.00 0.00 175.26 174.85 1n8q s SER 251 N -0.33 5.15 0.47 -1.70 1.04 -0.71 -4.61 113.70 113.01 1n8q s SER 251 Ca 0.29 2.32 -0.19 0.00 0.48 0.00 0.00 55.95 58.85 1n8q s SER 251 Cb -0.18 -2.59 -0.09 0.00 0.10 0.00 0.00 66.02 63.26 1n8q s SER 251 CO 0.16 -1.62 0.98 -0.13 0.98 0.00 0.00 173.24 173.61 1n8q s ARG 252 N -3.45 4.05 -0.03 4.02 0.52 -1.26 -4.90 118.95 117.90 1n8q s ARG 252 Ca 0.76 1.09 -0.13 0.00 -0.52 0.00 0.00 55.73 56.93 1n8q s ARG 252 Cb -0.29 -2.15 0.02 0.00 0.52 0.00 0.00 34.95 33.06 1n8q s ARG 252 CO 0.34 -0.19 0.29 0.45 0.02 0.00 0.00 175.30 176.21 1n8q s SER 253 N -2.49 -0.19 0.31 0.23 0.15 -1.26 -5.04 113.70 105.42 1n8q s SER 253 Ca 0.62 0.15 0.26 0.00 0.70 0.00 0.00 55.95 57.67 1n8q s SER 253 Cb -0.10 0.36 1.05 0.00 -1.71 0.00 0.00 66.02 65.61 1n8q s SER 253 CO 0.21 -0.37 1.77 0.78 1.20 0.00 0.00 173.24 176.83 1n8q h ASN 254 N 4.28 0.00 -3.20 5.45 2.35 -2.01 -3.41 115.58 119.05 1n8q h ASN 254 Ca -0.29 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 54.81 1n8q h ASN 254 Cb 1.18 0.00 -0.36 0.00 0.05 0.00 0.00 38.32 39.20 1n8q h ASN 254 CO 0.38 0.00 -0.84 -1.81 -1.65 0.00 0.00 177.43 173.51 1n8q s ASP 255 N -4.55 3.20 -0.17 5.81 1.01 -1.26 -5.11 116.67 115.60 1n8q s ASP 255 Ca 0.04 -0.72 -0.06 0.00 0.71 0.00 0.00 52.55 52.52 1n8q s ASP 255 Cb 0.09 -1.39 -0.04 0.00 1.01 0.00 0.00 42.92 42.59 1n8q s ASP 255 CO 0.43 -0.05 0.02 0.54 0.21 0.00 0.00 175.17 176.33 1n8q s VAL 256 N 1.33 4.45 0.36 -1.27 0.11 -1.26 -5.07 120.40 119.05 1n8q s VAL 256 Ca 0.03 -0.16 -0.28 0.00 -2.93 0.00 0.00 61.98 58.64 1n8q s VAL 256 Cb -0.14 -2.98 -0.10 0.00 -1.53 0.00 0.00 36.38 31.63 1n8q s VAL 256 CO -0.11 0.48 1.32 -0.47 -3.33 0.00 0.00 175.10 172.99 1n8q s TYR 257 N 0.29 2.93 0.03 1.54 6.14 -1.26 -5.02 117.35 122.00 1n8q s TYR 257 Ca 0.01 1.40 -0.00 0.00 0.64 0.00 0.00 57.07 59.11 1n8q s TYR 257 Cb -0.13 -3.70 -0.03 0.00 0.42 0.00 0.00 41.96 38.53 1n8q s TYR 257 CO 0.01 -2.01 -0.03 -0.48 0.64 0.00 0.00 175.55 173.68 1n8q s LEU 258 N -2.05 2.35 0.18 6.97 2.34 -1.26 -4.84 118.68 122.38 1n8q s LEU 258 Ca 0.52 -0.73 -0.33 0.00 0.06 0.00 0.00 54.13 53.66 1n8q s LEU 258 Cb -0.39 0.14 -0.13 0.00 -0.56 0.00 0.00 46.19 45.25 1n8q s LEU 258 CO 0.52 -0.43 1.69 -2.65 -1.06 0.00 0.00 176.35 174.42 1n8q n PRO 259 N 0.92 2.58 -2.19 1.48 -0.02 -1.26 -4.88 135.00 131.63 1n8q n PRO 259 Ca -0.19 0.93 -0.41 0.00 -2.02 0.00 0.00 63.50 61.81 1n8q n PRO 259 Cb 0.58 -2.76 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 1n8q n PRO 259 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1n8q s ARG 260 N 1.23 4.40 0.00 -0.52 6.06 -0.56 -0.83 118.95 128.74 1n8q s ARG 260 Ca 0.77 2.11 0.00 0.00 -2.50 0.00 0.00 55.73 56.11 1n8q s ARG 260 Cb -0.56 -3.13 0.00 0.00 0.06 0.00 0.00 34.95 31.32 1n8q s ARG 260 CO 0.34 -0.16 0.00 -0.25 -2.50 0.00 0.00 175.30 172.73 1n8q n ASP 261 N 1.52 0.00 0.18 -2.12 10.43 -1.26 -4.77 116.55 120.53 1n8q n ASP 261 Ca 0.02 0.00 0.12 0.00 2.57 0.00 0.00 54.79 57.50 1n8q n ASP 261 Cb 0.42 0.00 0.21 0.00 1.84 0.00 0.00 41.12 43.60 1n8q n ASP 261 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 1n8q h GLU 262 N 2.29 0.00 -4.99 -1.24 4.39 -1.33 -3.43 114.58 110.27 1n8q h GLU 262 Ca 0.00 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.03 1n8q h GLU 262 Cb 0.00 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 28.48 1n8q h GLU 262 CO 0.00 0.00 -0.21 0.00 -1.16 0.00 0.00 179.01 177.64 1n8q s ALA 263 N -3.19 3.47 -0.03 3.43 0.00 -1.26 -4.16 121.76 120.03 1n8q s ALA 263 Ca 0.07 -1.24 -0.17 0.00 0.00 0.00 0.00 51.96 50.62 1n8q s ALA 263 Cb 0.07 -2.93 -0.05 0.00 0.00 0.00 0.00 23.12 20.21 1n8q s ALA 263 CO 0.66 -1.24 0.46 -0.06 0.00 0.00 0.00 175.76 175.58 1n8q s PHE 264 N 2.14 3.67 0.75 0.00 0.40 -1.26 -5.06 117.98 118.62 1n8q s PHE 264 Ca 0.13 1.01 -0.04 0.00 -0.60 0.00 0.00 56.93 57.43 1n8q s PHE 264 Cb -0.16 -2.42 0.13 0.00 0.51 0.00 0.00 43.02 41.08 1n8q s PHE 264 CO 0.13 0.47 1.04 0.20 0.70 0.00 0.00 175.22 177.76 1n8q s GLY 265 N -0.51 1.76 0.03 4.36 0.00 -1.26 -5.10 107.32 106.59 1n8q s GLY 265 Ca 0.25 -1.51 -0.06 0.00 0.00 0.00 0.00 44.72 43.41 1n8q s GLY 265 CO 0.13 -0.94 0.10 0.30 0.00 0.00 0.00 173.10 172.69 1n8q s HIS 266 N -3.27 0.16 -0.05 1.90 0.09 -1.20 -5.04 115.29 107.88 1n8q s HIS 266 Ca 0.66 -0.40 0.13 0.00 -0.00 0.00 0.00 55.06 55.45 1n8q s HIS 266 Cb -0.06 -0.12 -0.11 0.00 -0.00 0.00 0.00 32.58 32.29 1n8q s HIS 266 CO 0.46 -0.33 1.13 -0.07 -0.00 0.00 0.00 174.74 175.93 1n8q h LEU 267 N 3.91 0.00 -8.79 0.89 -0.00 -1.88 -3.39 115.31 106.04 1n8q h LEU 267 Ca -0.32 0.00 -0.64 0.00 -0.00 0.00 0.00 57.88 56.92 1n8q h LEU 267 Cb 1.19 0.00 -0.21 0.00 -0.00 0.00 0.00 40.66 41.64 1n8q h LEU 267 CO 0.47 0.74 -0.62 -0.75 -0.00 0.00 0.00 178.44 178.27 1n8q s LYS 268 N -2.83 3.73 0.25 1.13 2.20 -1.26 -4.75 119.74 118.22 1n8q s LYS 268 Ca 0.00 -0.46 -0.30 0.00 -0.36 0.00 0.00 55.97 54.86 1n8q s LYS 268 Cb 0.09 -3.21 -0.09 0.00 -1.51 0.00 0.00 37.83 33.11 1n8q s LYS 268 CO 0.79 0.01 1.12 -1.54 -0.36 0.00 0.00 175.35 175.38 1n8q s SER 269 N 1.05 7.22 0.00 1.43 1.04 -0.47 -1.77 113.70 122.20 1n8q s SER 269 Ca 0.03 2.26 0.00 0.00 0.48 0.00 0.00 55.95 58.72 1n8q s SER 269 Cb -0.14 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.36 1n8q s SER 269 CO 0.03 -0.20 0.00 -1.54 0.98 0.00 0.00 173.24 172.50 1n8q n SER 270 N 1.53 0.00 -0.25 7.02 3.41 -1.26 -4.54 113.62 119.52 1n8q n SER 270 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.72 1n8q n SER 270 Cb 0.45 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1n8q n SER 270 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1n8q n ASP 271 N 0.00 1.42 -3.95 4.04 10.43 -0.73 -4.66 116.55 123.11 1n8q n ASP 271 Ca 0.00 -1.15 -0.42 0.00 2.57 0.00 0.00 54.79 55.78 1n8q n ASP 271 Cb 0.00 0.59 0.00 0.00 1.84 0.00 0.00 41.12 43.55 1n8q n ASP 271 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1n8q n PHE 272 N -0.73 3.63 -0.00 1.24 3.72 -1.25 -4.79 117.46 119.28 1n8q n PHE 272 Ca 0.08 -2.93 -0.16 0.00 -0.05 0.00 0.00 57.45 54.38 1n8q n PHE 272 Cb 0.40 -2.35 -0.05 0.00 -0.94 0.00 0.00 39.48 36.53 1n8q n PHE 272 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1n8q h LEU 273 N 9.68 0.85 -1.36 4.37 3.38 -1.96 -2.43 115.31 127.84 1n8q h LEU 273 Ca 0.48 -0.57 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1n8q h LEU 273 Cb 0.69 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1n8q h LEU 273 CO 1.70 1.36 0.01 0.71 0.09 0.00 0.00 178.44 182.31 1n8q h THR 274 N 0.48 1.17 -0.52 0.22 1.35 -1.93 0.48 112.91 114.16 1n8q h THR 274 Ca -0.05 -0.66 -0.06 0.00 -0.55 0.00 0.00 66.41 65.09 1n8q h THR 274 Cb 1.40 0.94 -0.02 0.00 -1.73 0.00 0.00 68.15 68.74 1n8q h THR 274 CO 0.16 0.22 0.08 0.22 -0.25 0.00 0.00 175.52 175.95 1n8q h TYR 275 N 0.43 0.85 -0.47 4.73 3.20 -1.93 -0.62 116.97 123.15 1n8q h TYR 275 Ca 0.10 -0.09 -0.10 0.00 3.14 0.00 0.00 58.73 61.77 1n8q h TYR 275 Cb 0.26 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1n8q h TYR 275 CO 0.01 0.74 -0.11 0.78 -1.64 0.00 0.00 178.16 177.94 1n8q h GLY 276 N 0.97 0.95 0.90 1.82 0.00 -0.47 -2.17 103.07 105.07 1n8q h GLY 276 Ca 0.16 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 1n8q h GLY 276 CO 0.01 0.68 0.09 1.41 0.00 0.00 0.00 176.54 178.72 1n8q h LEU 277 N 0.78 0.29 -1.08 3.11 3.38 -0.87 -1.90 115.31 119.03 1n8q h LEU 277 Ca 0.13 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.02 1n8q h LEU 277 Cb 0.63 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.24 1n8q h LEU 277 CO 0.04 0.36 0.62 0.50 0.09 0.00 0.00 178.44 180.05 1n8q h LYS 278 N 0.20 1.05 -0.48 1.13 3.64 -1.12 -1.54 116.57 119.46 1n8q h LYS 278 Ca 0.07 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 1n8q h LYS 278 Cb 0.16 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1n8q h LYS 278 CO -0.01 0.69 -0.15 0.77 -2.27 0.00 0.00 179.45 178.49 1n8q h SER 279 N 1.08 0.92 -0.75 4.20 0.02 -1.25 -1.29 113.55 116.48 1n8q h SER 279 Ca 0.42 -0.31 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1n8q h SER 279 Cb 0.22 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 1n8q h SER 279 CO -0.17 1.06 0.24 0.58 -1.14 0.00 0.00 176.83 177.40 1n8q h VAL 280 N 0.81 1.26 -0.05 2.27 2.07 -0.47 0.23 116.25 122.37 1n8q h VAL 280 Ca 0.12 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1n8q h VAL 280 Cb 0.69 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1n8q h VAL 280 CO 0.05 0.36 -0.03 -1.28 0.02 0.00 0.00 177.57 176.69 1n8q h SER 281 N 1.11 0.11 0.12 0.57 0.87 -1.27 0.47 113.55 115.54 1n8q h SER 281 Ca 0.24 -0.43 -0.25 0.00 -1.23 0.00 0.00 61.79 60.12 1n8q h SER 281 Cb 0.30 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 1n8q h SER 281 CO -0.01 0.52 -1.22 1.56 -0.53 0.00 0.00 176.83 177.15 1n8q h GLN 282 N -0.29 0.25 0.01 2.24 4.20 -1.17 -3.38 115.11 116.97 1n8q h GLN 282 Ca 0.01 -0.42 -0.40 0.00 0.06 0.00 0.00 58.65 57.89 1n8q h GLN 282 Cb 0.48 0.16 -0.06 0.00 0.30 0.00 0.00 27.48 28.35 1n8q h GLN 282 CO 0.01 1.20 -2.43 0.09 -0.67 0.00 0.00 178.83 177.03 1n8q n ASN 283 N -4.01 1.98 0.01 1.46 3.02 0.73 -4.51 115.26 113.94 1n8q n ASN 283 Ca -0.22 0.03 -0.19 0.00 -0.03 0.00 0.00 54.58 54.17 1n8q n ASN 283 Cb 0.87 -0.57 -0.14 0.00 -0.61 0.00 0.00 39.78 39.33 1n8q n ASN 283 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1n8q h VAL 284 N -0.28 1.42 0.49 2.41 2.07 -1.28 -3.21 116.25 117.87 1n8q h VAL 284 Ca -0.59 -2.45 -0.01 0.00 0.82 0.00 0.00 66.70 64.46 1n8q h VAL 284 Cb 1.82 3.07 -0.01 0.00 -1.52 0.00 0.00 31.29 34.65 1n8q h VAL 284 CO -0.17 0.67 -0.35 0.25 0.02 0.00 0.00 177.57 177.99 1n8q h LEU 285 N -0.52 -0.92 -1.63 2.57 5.85 -1.07 -0.08 115.31 119.51 1n8q h LEU 285 Ca -0.16 0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.69 1n8q h LEU 285 Cb 1.53 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 42.81 1n8q h LEU 285 CO 0.08 -0.53 0.35 -0.65 -0.34 0.00 0.00 178.44 177.35 1n8q h PRO 286 N -0.82 0.44 -0.30 5.25 0.11 -1.78 0.43 132.00 135.33 1n8q h PRO 286 Ca -0.05 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 1n8q h PRO 286 Cb 0.69 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 1n8q h PRO 286 CO 0.02 0.29 0.01 1.25 -0.21 0.00 0.00 178.00 179.36 1n8q h LEU 287 N 0.45 0.51 -0.33 2.35 5.85 -1.52 -1.73 115.31 120.90 1n8q h LEU 287 Ca 0.23 -0.30 -0.20 0.00 0.84 0.00 0.00 57.88 58.45 1n8q h LEU 287 Cb 0.33 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1n8q h LEU 287 CO -0.06 0.68 -0.72 0.25 -0.34 0.00 0.00 178.44 178.25 1n8q h LEU 288 N 0.32 0.68 -1.63 2.25 5.85 -0.02 -2.65 115.31 120.11 1n8q h LEU 288 Ca 0.09 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 1n8q h LEU 288 Cb 0.42 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1n8q h LEU 288 CO 0.01 1.19 0.21 -0.61 -0.34 0.00 0.00 178.44 178.90 1n8q h GLN 289 N 0.40 0.46 -0.45 1.25 4.15 -1.02 -1.27 115.11 118.62 1n8q h GLN 289 Ca -0.03 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.32 1n8q h GLN 289 Cb 1.31 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.88 1n8q h GLN 289 CO 0.14 0.32 0.13 0.77 -1.93 0.00 0.00 178.83 178.26 1n8q h SER 290 N 0.47 0.61 1.02 -0.69 0.02 -0.95 -0.54 113.55 113.50 1n8q h SER 290 Ca 0.12 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 1n8q h SER 290 Cb -0.02 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1n8q h SER 290 CO -0.02 0.60 -0.18 0.00 -1.14 0.00 0.00 176.83 176.09 1n8q h ALA 291 N 1.49 1.00 0.07 3.77 0.00 -1.08 -0.77 119.26 123.75 1n8q h ALA 291 Ca 0.15 -0.16 -0.33 0.00 0.00 0.00 0.00 54.91 54.57 1n8q h ALA 291 Cb 0.21 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1n8q h ALA 291 CO -0.01 0.22 -1.88 1.19 0.00 0.00 0.00 179.25 178.77 1n8q n PHE 292 N -3.31 1.12 0.78 0.00 3.01 -1.02 -1.59 117.46 116.45 1n8q n PHE 292 Ca 0.00 0.30 0.08 0.00 1.01 0.00 0.00 57.45 58.85 1n8q n PHE 292 Cb 0.42 -1.17 0.42 0.00 -0.01 0.00 0.00 39.48 39.14 1n8q n PHE 292 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1n8q n ASP 293 N -3.28 0.00 0.00 4.37 10.43 -0.24 -4.11 116.55 123.73 1n8q n ASP 293 Ca -0.25 0.11 0.00 0.00 2.57 0.00 0.00 54.79 57.21 1n8q n ASP 293 Cb 1.05 -0.32 0.00 0.00 1.84 0.00 0.00 41.12 43.69 1n8q n ASP 293 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1n8q n LEU 294 N -1.32 0.00 0.00 0.64 0.00 -0.30 -5.04 117.00 110.98 1n8q n LEU 294 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.09 1n8q n LEU 294 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.57 1n8q n LEU 294 CO 0.14 0.00 0.00 -3.20 0.00 0.00 0.00 177.39 174.33 1n8q n ASN 295 N 0.00 0.00 0.06 1.96 5.15 -0.62 -5.05 115.26 116.76 1n8q n ASN 295 Ca 0.00 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.05 1n8q n ASN 295 Cb 0.00 0.00 0.32 0.00 -0.53 0.00 0.00 39.78 39.57 1n8q n ASN 295 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1n8q n PHE 296 N -0.56 0.30 -4.36 1.20 3.72 -1.24 -4.28 117.46 112.23 1n8q n PHE 296 Ca 0.00 0.13 -0.22 0.00 -0.05 0.00 0.00 57.45 57.32 1n8q n PHE 296 Cb 0.00 -0.71 -0.13 0.00 -0.94 0.00 0.00 39.48 37.70 1n8q n PHE 296 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1n8q s THR 297 N -3.16 1.36 0.51 4.37 -4.23 -1.26 -4.85 115.64 108.38 1n8q s THR 297 Ca 0.03 -1.23 -0.22 0.00 -1.18 0.00 0.00 61.69 59.09 1n8q s THR 297 Cb 0.07 -1.24 -0.06 0.00 1.34 0.00 0.00 72.50 72.61 1n8q s THR 297 CO 0.22 -0.02 1.29 -2.84 -0.54 0.00 0.00 174.62 172.74 1n8q s PRO 298 N -1.44 3.42 0.03 3.99 0.02 -1.26 -4.90 135.00 134.85 1n8q s PRO 298 Ca 0.03 2.07 0.29 0.00 0.02 0.00 0.00 61.00 63.41 1n8q s PRO 298 Cb -0.09 -2.35 1.17 0.00 0.02 0.00 0.00 34.50 33.26 1n8q s PRO 298 CO 0.02 -0.92 1.91 0.54 -0.33 0.00 0.00 177.00 178.22 1n8q n ARG 299 N -0.75 0.04 -4.13 5.54 1.74 -1.26 -4.81 116.66 113.03 1n8q n ARG 299 Ca 0.09 0.03 -0.15 0.00 -0.77 0.00 0.00 57.85 57.05 1n8q n ARG 299 Cb 0.46 -1.55 -0.13 0.00 -1.02 0.00 0.00 32.46 30.22 1n8q n ARG 299 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1n8q s GLU 300 N -3.02 0.53 0.36 5.56 0.41 -1.26 -3.69 118.70 117.59 1n8q s GLU 300 Ca 0.13 -0.54 -0.26 0.00 -0.41 0.00 0.00 54.97 53.89 1n8q s GLU 300 Cb 0.18 -0.40 -0.09 0.00 -1.78 0.00 0.00 34.13 32.04 1n8q s GLU 300 CO 0.54 0.09 1.15 -0.06 -0.49 0.00 0.00 175.26 176.50 1n8q s PHE 301 N -0.85 3.21 -0.03 1.61 0.08 -1.26 -4.97 117.98 115.77 1n8q s PHE 301 Ca -0.04 1.58 0.09 0.00 0.12 0.00 0.00 56.93 58.68 1n8q s PHE 301 Cb -0.07 -3.37 -0.14 0.00 -0.57 0.00 0.00 43.02 38.88 1n8q s PHE 301 CO 0.00 -1.11 0.17 -0.25 -0.10 0.00 0.00 175.22 173.93 1n8q n ASP 302 N 0.41 2.83 -4.10 1.36 8.00 -1.26 -4.88 116.55 118.91 1n8q n ASP 302 Ca 0.03 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.40 1n8q n ASP 302 Cb 0.46 1.27 -0.09 0.00 -0.02 0.00 0.00 41.12 42.74 1n8q n ASP 302 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1n8q s SER 303 N -3.32 0.26 0.23 -2.24 1.04 -1.26 -4.29 113.70 104.11 1n8q s SER 303 Ca -0.04 -1.37 0.01 0.00 0.48 0.00 0.00 55.95 55.04 1n8q s SER 303 Cb 0.05 0.42 0.23 0.00 0.10 0.00 0.00 66.02 66.82 1n8q s SER 303 CO 0.39 -0.90 1.57 -0.26 0.98 0.00 0.00 173.24 175.02 1n8q h PHE 304 N 2.54 0.48 -1.00 5.02 -1.00 -1.97 -3.05 116.94 117.95 1n8q h PHE 304 Ca -0.34 -0.16 0.07 0.00 2.81 0.00 0.00 57.97 60.34 1n8q h PHE 304 Cb 1.25 -0.09 -0.07 0.00 3.61 0.00 0.00 35.95 40.65 1n8q h PHE 304 CO 0.48 0.84 0.64 -0.44 -1.61 0.00 0.00 178.31 178.22 1n8q h ASP 305 N 0.30 1.02 -0.20 2.17 5.19 -1.99 -1.19 116.42 121.72 1n8q h ASP 305 Ca 0.01 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.42 1n8q h ASP 305 Cb 1.04 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 40.33 1n8q h ASP 305 CO 0.09 0.65 0.11 -0.08 -3.12 0.00 0.00 179.24 176.89 1n8q h GLU 306 N 1.16 0.31 -0.19 3.56 4.81 -1.94 -1.15 114.58 121.14 1n8q h GLU 306 Ca 0.43 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.45 1n8q h GLU 306 Cb 0.19 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1n8q h GLU 306 CO -0.18 0.25 -0.64 0.28 -0.73 0.00 0.00 179.01 177.99 1n8q h VAL 307 N 0.32 1.31 0.00 0.32 2.07 -1.26 -3.25 116.25 115.76 1n8q h VAL 307 Ca 0.08 -1.89 -0.10 0.00 0.82 0.00 0.00 66.70 65.62 1n8q h VAL 307 Cb 0.04 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1n8q h VAL 307 CO -0.01 0.59 -0.45 0.45 0.02 0.00 0.00 177.57 178.17 1n8q h HIS 308 N 0.50 0.00 0.00 1.57 3.86 -0.67 -2.87 115.15 117.54 1n8q h HIS 308 Ca -0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1n8q h HIS 308 Cb 1.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.70 1n8q h HIS 308 CO 0.06 0.45 0.00 0.78 0.86 0.00 0.00 177.93 180.09 1n8q h GLY 309 N 1.43 0.00 1.05 2.45 0.00 -1.26 -1.90 103.07 104.83 1n8q h GLY 309 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.46 1n8q h GLY 309 CO 0.06 0.00 0.35 1.41 0.00 0.00 0.00 176.54 178.36 1n8q h LEU 310 N 0.00 0.03 -1.95 3.11 4.07 -1.63 0.29 115.31 119.23 1n8q h LEU 310 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1n8q h LEU 310 Cb 0.10 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.83 1n8q h LEU 310 CO 0.00 0.01 0.00 -1.22 -1.08 0.00 0.00 178.44 176.15 1n8q n TYR 311 N -4.40 0.18 0.00 1.13 4.02 -0.71 -1.37 117.16 116.00 1n8q n TYR 311 Ca 0.09 -0.16 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 1n8q n TYR 311 Cb 0.54 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 1n8q n TYR 311 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1n8q n SER 312 N 0.71 0.00 0.10 7.72 7.64 -1.09 -4.72 113.62 123.98 1n8q n SER 312 Ca 0.09 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.11 1n8q n SER 312 Cb 0.37 0.00 0.42 0.00 -1.01 0.00 0.00 64.21 63.98 1n8q n SER 312 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n8q n GLY 313 N 3.89 -1.69 6.27 0.23 0.00 -1.18 -4.98 105.19 107.73 1n8q n GLY 313 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1n8q n GLY 313 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8q n GLY 314 N 1.32 -2.06 3.60 -0.02 0.00 0.10 -4.79 105.19 103.34 1n8q n GLY 314 Ca 0.06 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 1n8q n GLY 314 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1n8q s ILE 315 N -0.11 4.29 -0.10 -0.61 2.07 0.03 -4.60 121.20 122.16 1n8q s ILE 315 Ca 0.00 -0.23 -0.30 0.00 -1.41 0.00 0.00 60.65 58.71 1n8q s ILE 315 Cb 0.00 -2.87 -0.02 0.00 0.13 0.00 0.00 42.46 39.71 1n8q s ILE 315 CO 0.00 0.52 1.08 -0.54 -1.91 0.00 0.00 174.94 174.09 1n8q s LYS 316 N -0.06 4.38 0.34 3.50 3.01 -1.26 -1.67 119.74 127.99 1n8q s LYS 316 Ca 0.04 1.48 0.09 0.00 -1.01 0.00 0.00 55.97 56.57 1n8q s LYS 316 Cb -0.13 -3.56 -0.06 0.00 -1.01 0.00 0.00 37.83 33.07 1n8q s LYS 316 CO 0.02 -0.39 -0.04 -0.51 0.51 0.00 0.00 175.35 174.94 1n8q s LEU 317 N 2.22 2.87 0.81 3.17 1.43 0.15 -4.64 118.68 124.70 1n8q s LEU 317 Ca 0.50 -1.07 -0.12 0.00 -1.03 0.00 0.00 54.13 52.41 1n8q s LEU 317 Cb -0.20 -1.21 0.08 0.00 0.03 0.00 0.00 46.19 44.89 1n8q s LEU 317 CO 0.18 -0.22 1.16 -2.16 0.23 0.00 0.00 176.35 175.55 1n8q s PRO 318 N -3.67 1.95 0.10 1.29 0.04 -1.26 -4.60 135.00 128.85 1n8q s PRO 318 Ca 0.34 0.20 -0.23 0.00 0.04 0.00 0.00 61.00 61.35 1n8q s PRO 318 Cb 0.01 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.48 1n8q s PRO 318 CO 0.18 -1.62 1.73 1.15 0.04 0.00 0.00 177.00 178.48 1n8q h THR 319 N -1.08 0.93 0.00 1.26 2.02 -1.95 -2.39 112.91 111.70 1n8q h THR 319 Ca -0.47 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1n8q h THR 319 Cb 1.32 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 1n8q h THR 319 CO 0.65 0.00 0.00 -2.24 0.37 0.00 0.00 175.52 174.30 1n8q h ASP 320 N -0.03 0.00 0.04 4.18 2.03 -1.94 0.75 116.42 121.45 1n8q h ASP 320 Ca 0.02 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.22 1n8q h ASP 320 Cb 0.06 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.57 1n8q h ASP 320 CO -0.04 0.00 -0.43 0.40 -1.03 0.00 0.00 179.24 178.14 1n8q h ILE 321 N 0.00 1.57 0.00 4.15 2.04 -1.94 -3.21 117.51 120.11 1n8q h ILE 321 Ca 0.00 -2.23 0.00 0.00 1.00 0.00 0.00 64.86 63.63 1n8q h ILE 321 Cb 0.59 3.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.67 1n8q h ILE 321 CO 0.00 0.62 0.00 -0.29 0.00 0.00 0.00 178.15 178.48 1n8q h ILE 322 N -0.50 0.00 0.00 -0.67 2.10 -0.99 -2.67 117.51 114.78 1n8q h ILE 322 Ca -0.07 -0.52 0.00 0.00 1.08 0.00 0.00 64.86 65.36 1n8q h ILE 322 Cb 1.25 1.44 0.00 0.00 -1.09 0.00 0.00 36.82 38.42 1n8q h ILE 322 CO 0.08 0.00 -0.25 -1.20 -1.08 0.00 0.00 178.15 175.70 1n8q n SER 323 N -2.58 0.32 -0.53 2.19 7.64 0.26 -1.64 113.62 119.28 1n8q n SER 323 Ca 0.03 0.18 0.12 0.00 1.01 0.00 0.00 58.87 60.21 1n8q n SER 323 Cb 0.37 -0.17 0.11 0.00 -1.01 0.00 0.00 64.21 63.51 1n8q n SER 323 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1n8q n LYS 324 N -1.62 1.36 -0.01 1.43 5.02 -1.01 -4.26 118.16 119.07 1n8q n LYS 324 Ca 0.06 -1.07 0.02 0.00 -2.02 0.00 0.00 58.31 55.30 1n8q n LYS 324 Cb 0.35 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.84 1n8q n LYS 324 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1n8q n ILE 325 N 0.11 0.07 -0.05 -0.18 -5.35 -1.20 -4.69 119.36 108.07 1n8q n ILE 325 Ca 0.11 -0.16 0.02 0.00 -0.27 0.00 0.00 62.75 62.45 1n8q n ILE 325 Cb 0.46 0.15 0.34 0.00 -1.74 0.00 0.00 39.64 38.85 1n8q n ILE 325 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1n8q h SER 326 N 0.00 0.57 -0.42 7.28 0.02 -1.49 -3.27 113.55 116.23 1n8q h SER 326 Ca -0.03 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1n8q h SER 326 Cb 0.47 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1n8q h SER 326 CO 0.00 0.48 0.00 -0.81 -1.14 0.00 0.00 176.83 175.36 1n8q n PRO 327 N -4.40 3.83 -2.79 3.45 -0.04 -1.26 -4.64 135.00 129.15 1n8q n PRO 327 Ca 0.04 -2.96 -0.41 0.00 -0.04 0.00 0.00 63.50 60.12 1n8q n PRO 327 Cb 0.11 -2.01 -0.04 0.00 -0.04 0.00 0.00 33.50 31.51 1n8q n PRO 327 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1n8q s LEU 328 N -2.68 4.48 0.20 1.53 0.05 -1.24 -4.98 118.68 116.04 1n8q s LEU 328 Ca 0.48 1.70 -0.31 0.00 0.05 0.00 0.00 54.13 56.05 1n8q s LEU 328 Cb 0.37 -3.50 -0.16 0.00 -2.05 0.00 0.00 46.19 40.85 1n8q s LEU 328 CO 0.13 -0.05 0.98 -2.65 -0.55 0.00 0.00 176.35 174.21 1n8q n PRO 329 N 2.84 0.89 0.00 1.48 -0.02 -1.26 -2.53 135.00 136.40 1n8q n PRO 329 Ca 0.01 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1n8q n PRO 329 Cb 0.49 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 1n8q n PRO 329 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1n8q n VAL 330 N 0.82 0.00 0.26 -1.45 0.31 -1.26 -4.63 118.33 112.39 1n8q n VAL 330 Ca 0.14 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.61 1n8q n VAL 330 Cb 0.26 0.00 0.71 0.00 -0.91 0.00 0.00 33.84 33.89 1n8q n VAL 330 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1n8q h LEU 331 N 0.00 0.00 -0.12 7.52 4.07 -1.90 -0.86 115.31 124.02 1n8q h LEU 331 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1n8q h LEU 331 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1n8q h LEU 331 CO 0.00 0.11 0.00 2.29 -1.08 0.00 0.00 178.44 179.76 1n8q n LYS 332 N -3.42 0.06 0.01 1.13 -0.00 -1.05 0.12 118.16 115.01 1n8q n LYS 332 Ca -0.01 0.21 0.02 0.00 -0.00 0.00 0.00 58.31 58.53 1n8q n LYS 332 Cb 0.28 -1.59 -0.10 0.00 -0.00 0.00 0.00 35.03 33.62 1n8q n LYS 332 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1n8q n GLU 333 N -1.69 0.64 0.00 -1.58 -0.58 -0.34 -4.43 120.64 112.65 1n8q n GLU 333 Ca 0.04 0.10 0.07 0.00 -0.42 0.00 0.00 57.16 56.95 1n8q n GLU 333 Cb 0.25 -1.71 -0.06 0.00 -0.57 0.00 0.00 31.44 29.34 1n8q n GLU 333 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 1n8q n ILE 334 N -2.73 0.00 -3.92 -3.67 0.13 -0.98 -4.92 119.36 103.27 1n8q n ILE 334 Ca -0.11 -0.21 -0.33 0.00 -1.10 0.00 0.00 62.75 60.99 1n8q n ILE 334 Cb 0.81 1.04 -0.05 0.00 -0.84 0.00 0.00 39.64 40.60 1n8q n ILE 334 CO 0.00 0.00 0.00 -0.36 2.80 0.00 0.00 176.55 178.99 1n8q s PHE 335 N -2.20 3.53 0.55 9.51 0.08 0.12 -5.00 117.98 124.57 1n8q s PHE 335 Ca 0.07 0.35 0.03 0.00 0.12 0.00 0.00 56.93 57.50 1n8q s PHE 335 Cb 0.11 -1.83 0.05 0.00 -0.57 0.00 0.00 43.02 40.78 1n8q s PHE 335 CO 0.53 0.64 0.76 1.03 -0.10 0.00 0.00 175.22 178.08 1n8q s ARG 336 N -1.89 2.47 -0.26 0.44 0.52 -1.25 -4.79 118.95 114.17 1n8q s ARG 336 Ca 0.27 -1.02 -0.21 0.00 -0.52 0.00 0.00 55.73 54.25 1n8q s ARG 336 Cb -0.13 -2.55 0.07 0.00 0.52 0.00 0.00 34.95 32.87 1n8q s ARG 336 CO 0.18 -0.73 0.68 0.99 0.02 0.00 0.00 175.30 176.45 1n8q s THR 337 N -2.71 -0.00 -0.60 0.02 2.01 -1.26 -3.76 115.64 109.34 1n8q s THR 337 Ca 0.58 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 62.52 1n8q s THR 337 Cb -0.09 -0.97 0.16 0.00 0.01 0.00 0.00 72.50 71.61 1n8q s THR 337 CO 0.38 0.00 0.45 -0.62 -0.69 0.00 0.00 174.62 174.14 1n8q s ASP 338 N 0.82 5.64 1.29 3.53 2.15 -1.22 -4.98 116.67 123.90 1n8q s ASP 338 Ca -0.04 -2.50 0.00 0.00 0.43 0.00 0.00 52.55 50.44 1n8q s ASP 338 Cb -0.05 -1.96 0.00 0.00 -0.30 0.00 0.00 42.92 40.61 1n8q s ASP 338 CO -0.06 -0.51 0.00 0.61 -0.17 0.00 0.00 175.17 175.04 1n8q n GLY 339 N 4.05 1.51 2.72 2.66 0.00 -1.26 -3.85 105.19 111.02 1n8q n GLY 339 Ca 0.04 0.03 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 1n8q n GLY 339 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1n8q n GLU 340 N 0.00 1.35 0.00 1.61 0.28 -1.26 -4.88 120.64 117.74 1n8q n GLU 340 Ca 0.00 -2.64 0.00 0.00 -0.16 0.00 0.00 57.16 54.36 1n8q n GLU 340 Cb 0.00 -0.78 0.00 0.00 1.43 0.00 0.00 31.44 32.09 1n8q n GLU 340 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1n8q n GLN 341 N -0.59 0.00 -3.74 3.44 10.64 -1.25 -4.16 117.38 121.71 1n8q n GLN 341 Ca 0.01 0.00 -0.37 0.00 -1.83 0.00 0.00 57.00 54.81 1n8q n GLN 341 Cb 0.83 -0.01 -0.12 0.00 -0.86 0.00 0.00 30.24 30.08 1n8q n GLN 341 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1n8q s ALA 342 N 0.00 3.12 -0.21 2.61 0.00 -1.26 0.32 121.76 126.34 1n8q s ALA 342 Ca 0.00 -1.35 -0.20 0.00 0.00 0.00 0.00 51.96 50.41 1n8q s ALA 342 Cb 0.00 -2.16 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 1n8q s ALA 342 CO 0.00 -0.79 0.61 -1.17 0.00 0.00 0.00 175.76 174.41 1n8q s LEU 343 N 1.55 4.12 0.23 0.00 2.96 -0.67 -3.45 118.68 123.43 1n8q s LEU 343 Ca 0.04 0.77 0.11 0.00 -0.22 0.00 0.00 54.13 54.83 1n8q s LEU 343 Cb -0.16 -2.84 -0.05 0.00 0.50 0.00 0.00 46.19 43.63 1n8q s LEU 343 CO 0.03 -0.28 -0.22 -0.75 -1.32 0.00 0.00 176.35 173.81 1n8q s LYS 344 N 2.03 1.57 -0.00 1.98 2.20 -1.25 -0.79 119.74 125.49 1n8q s LYS 344 Ca 0.27 -1.63 0.06 0.00 -0.36 0.00 0.00 55.97 54.31 1n8q s LYS 344 Cb -0.16 -1.77 -0.02 0.00 -1.51 0.00 0.00 37.83 34.38 1n8q s LYS 344 CO 0.10 0.36 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.20 1n8q s PHE 345 N -2.09 1.63 0.39 4.03 0.08 -0.47 -3.93 117.98 117.62 1n8q s PHE 345 Ca 0.25 -0.32 -0.27 0.00 0.12 0.00 0.00 56.93 56.71 1n8q s PHE 345 Cb -0.06 -1.03 -0.09 0.00 -0.57 0.00 0.00 43.02 41.26 1n8q s PHE 345 CO 0.12 -0.01 1.33 -1.25 -0.10 0.00 0.00 175.22 175.31 1n8q s PRO 346 N -0.56 4.02 0.06 0.24 0.04 -1.26 -4.12 135.00 133.42 1n8q s PRO 346 Ca 0.07 2.23 -0.31 0.00 0.04 0.00 0.00 61.00 63.03 1n8q s PRO 346 Cb -0.07 -2.82 -0.07 0.00 0.04 0.00 0.00 34.50 31.57 1n8q s PRO 346 CO -0.00 -0.47 1.52 -2.14 0.04 0.00 0.00 177.00 175.95 1n8q s PRO 347 N -2.17 4.24 0.40 0.56 0.02 -1.26 -4.94 135.00 131.85 1n8q s PRO 347 Ca 0.55 2.17 -0.26 0.00 0.02 0.00 0.00 61.00 63.49 1n8q s PRO 347 Cb -0.40 -3.51 -0.09 0.00 0.02 0.00 0.00 34.50 30.52 1n8q s PRO 347 CO 0.52 -0.63 1.24 -1.25 -0.33 0.00 0.00 177.00 176.55 1n8q s PRO 348 N 2.26 4.02 0.46 5.54 0.04 -1.26 -4.93 135.00 141.13 1n8q s PRO 348 Ca 0.69 2.02 0.18 0.00 0.04 0.00 0.00 61.00 63.93 1n8q s PRO 348 Cb -0.37 -2.74 1.15 0.00 0.04 0.00 0.00 34.50 32.58 1n8q s PRO 348 CO 0.30 -0.40 1.96 -0.22 0.04 0.00 0.00 177.00 178.67 1n8q h LYS 349 N 2.70 0.28 -0.59 4.56 3.64 -1.82 -2.02 116.57 123.33 1n8q h LYS 349 Ca -0.49 -0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.04 1n8q h LYS 349 Cb 1.24 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1n8q h LYS 349 CO 0.63 0.19 0.55 -0.24 -2.27 0.00 0.00 179.45 178.30 1n8q h VAL 350 N 0.29 0.41 -0.24 2.00 3.04 -1.61 -1.94 116.25 118.20 1n8q h VAL 350 Ca 0.31 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.00 1n8q h VAL 350 Cb 0.81 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1n8q h VAL 350 CO -0.07 0.00 0.00 2.30 -1.01 0.00 0.00 177.57 178.79 1n8q n ILE 351 N -3.86 1.42 0.17 3.17 -6.64 -0.76 -4.61 119.36 108.26 1n8q n ILE 351 Ca 0.12 -1.34 0.04 0.00 -1.77 0.00 0.00 62.75 59.79 1n8q n ILE 351 Cb 0.77 0.23 0.29 0.00 -1.44 0.00 0.00 39.64 39.49 1n8q n ILE 351 CO 0.00 0.00 0.00 1.56 -1.77 0.00 0.00 176.55 176.34 1n8q h GLN 352 N 1.47 0.00 0.00 6.28 4.20 -1.41 -3.30 115.11 122.36 1n8q h GLN 352 Ca 0.00 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 58.32 1n8q h GLN 352 Cb 0.91 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.63 1n8q h GLN 352 CO 0.06 0.43 -2.38 0.28 -0.67 0.00 0.00 178.83 176.56 1n8q n VAL 353 N -3.57 1.37 -4.19 -0.54 0.31 -1.26 -4.98 118.33 105.46 1n8q n VAL 353 Ca -0.00 -0.43 -0.23 0.00 -0.01 0.00 0.00 64.34 63.66 1n8q n VAL 353 Cb 0.54 -1.60 -0.17 0.00 -0.91 0.00 0.00 33.84 31.70 1n8q n VAL 353 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1n8q s SER 354 N -6.81 1.59 0.38 4.52 0.15 -1.24 -5.02 113.70 107.28 1n8q s SER 354 Ca -0.34 -0.22 0.15 0.00 0.70 0.00 0.00 55.95 56.24 1n8q s SER 354 Cb 0.11 -0.67 0.75 0.00 -1.71 0.00 0.00 66.02 64.50 1n8q s SER 354 CO 0.49 -0.06 1.81 0.11 1.20 0.00 0.00 173.24 176.79 1n8q h LYS 355 N 7.49 0.00 -0.00 5.44 1.57 -1.89 -3.35 116.57 125.83 1n8q h LYS 355 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1n8q h LYS 355 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1n8q h LYS 355 CO 0.43 0.37 -0.14 -1.13 -0.57 0.00 0.00 179.45 178.42 1n8q n SER 356 N -3.92 0.98 0.24 0.86 3.41 -1.26 -4.65 113.62 109.28 1n8q n SER 356 Ca -0.02 -0.99 0.16 0.00 -0.26 0.00 0.00 58.87 57.77 1n8q n SER 356 Cb 0.43 0.47 0.74 0.00 -0.26 0.00 0.00 64.21 65.60 1n8q n SER 356 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n8q h ALA 357 N 1.16 1.00 0.00 7.33 0.00 -1.90 -2.57 119.26 124.28 1n8q h ALA 357 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1n8q h ALA 357 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1n8q h ALA 357 CO 0.00 0.00 -0.20 0.11 0.00 0.00 0.00 179.25 179.16 1n8q h TRP 358 N 0.00 0.00 0.00 0.00 5.08 -1.85 -2.94 115.95 116.24 1n8q h TRP 358 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1n8q h TRP 358 Cb 0.30 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.46 1n8q h TRP 358 CO 0.00 0.20 0.00 -1.33 -1.28 0.00 0.00 178.44 176.03 1n8q n MET 359 N -4.06 0.03 -2.77 0.12 2.81 -0.97 -4.47 117.12 107.81 1n8q n MET 359 Ca -0.02 0.23 -0.37 0.00 -1.81 0.00 0.00 57.70 55.73 1n8q n MET 359 Cb 0.27 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.22 1n8q n MET 359 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1n8q s THR 360 N -2.95 4.18 0.31 2.03 -1.32 -1.11 -4.94 115.64 111.83 1n8q s THR 360 Ca 0.08 1.84 0.00 0.00 -1.21 0.00 0.00 61.69 62.40 1n8q s THR 360 Cb 0.10 -4.03 0.21 0.00 -1.51 0.00 0.00 72.50 67.26 1n8q s THR 360 CO 0.27 0.18 1.91 0.44 -2.21 0.00 0.00 174.62 175.21 1n8q h ASP 361 N 3.26 0.77 -0.28 8.08 3.32 -1.90 -2.10 116.42 127.56 1n8q h ASP 361 Ca -0.47 -0.08 0.04 0.00 0.02 0.00 0.00 57.03 56.54 1n8q h ASP 361 Cb 1.19 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 1n8q h ASP 361 CO 0.65 0.66 0.07 -0.33 -1.72 0.00 0.00 179.24 178.57 1n8q h GLU 362 N 0.85 0.17 -0.49 3.56 3.07 -1.92 -1.05 114.58 118.78 1n8q h GLU 362 Ca 0.21 -0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 58.94 1n8q h GLU 362 Cb 0.10 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1n8q h GLU 362 CO -0.03 0.11 -0.16 1.49 -1.40 0.00 0.00 179.01 179.03 1n8q h GLU 363 N 0.18 0.97 -0.38 2.33 4.57 -1.80 0.57 114.58 121.02 1n8q h GLU 363 Ca 0.13 -0.39 0.07 0.00 -1.18 0.00 0.00 59.36 57.99 1n8q h GLU 363 Cb 0.12 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 28.61 1n8q h GLU 363 CO -0.16 1.06 0.01 0.35 -1.18 0.00 0.00 179.01 179.09 1n8q h PHE 364 N 0.82 -0.00 -0.22 0.92 3.57 -1.12 -1.78 116.94 119.13 1n8q h PHE 364 Ca 0.12 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.49 1n8q h PHE 364 Cb 0.73 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1n8q h PHE 364 CO 0.05 -0.06 -0.50 0.00 -2.23 0.00 0.00 178.31 175.57 1n8q h ALA 365 N 1.33 0.73 -0.12 2.41 0.00 -1.07 -3.25 119.26 119.29 1n8q h ALA 365 Ca 0.19 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 1n8q h ALA 365 Cb 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1n8q h ALA 365 CO -0.30 0.67 -0.16 -0.09 0.00 0.00 0.00 179.25 179.37 1n8q h ARG 366 N 0.47 0.19 0.00 0.00 2.43 -0.40 -2.13 114.38 114.93 1n8q h ARG 366 Ca 0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1n8q h ARG 366 Cb 1.03 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 1n8q h ARG 366 CO 0.10 0.35 0.00 0.39 -1.51 0.00 0.00 179.97 179.30 1n8q n GLU 367 N -4.26 0.09 0.14 0.20 1.02 -0.71 -0.92 120.64 116.19 1n8q n GLU 367 Ca -0.01 0.33 0.13 0.00 -0.02 0.00 0.00 57.16 57.59 1n8q n GLU 367 Cb 0.28 -1.67 0.31 0.00 -0.02 0.00 0.00 31.44 30.34 1n8q n GLU 367 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1n8q h MET 368 N 0.00 0.00 0.00 3.49 2.86 -1.50 -1.68 114.93 118.10 1n8q h MET 368 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1n8q h MET 368 Cb 0.30 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 1n8q h MET 368 CO 0.00 0.00 -1.64 1.28 1.06 0.00 0.00 176.91 177.61 1n8q n LEU 369 N -2.56 0.00 -0.05 1.22 4.77 -0.10 -4.37 117.00 115.91 1n8q n LEU 369 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1n8q n LEU 369 Cb 0.47 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1n8q n LEU 369 CO 0.32 0.01 0.19 0.00 -1.33 0.00 0.00 177.39 176.58 1n8q n ALA 370 N -1.99 1.10 -1.83 -1.18 0.00 -0.14 -2.88 120.51 113.58 1n8q n ALA 370 Ca -0.03 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1n8q n ALA 370 Cb 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1n8q n ALA 370 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n8q n GLY 371 N 0.00 1.64 0.19 0.00 0.00 -0.63 -4.89 105.19 101.50 1n8q n GLY 371 Ca 0.00 -1.88 0.07 0.00 0.00 0.00 0.00 46.02 44.21 1n8q n GLY 371 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1n8q h VAL 372 N 0.00 0.70 -2.21 1.61 3.04 -1.86 -3.36 116.25 114.16 1n8q h VAL 372 Ca 0.00 -1.55 -0.58 0.00 -1.01 0.00 0.00 66.70 63.56 1n8q h VAL 372 Cb 0.00 2.02 -0.40 0.00 -2.01 0.00 0.00 31.29 30.90 1n8q h VAL 372 CO 0.00 0.33 -0.93 -3.20 -1.01 0.00 0.00 177.57 172.76 1n8q n ASN 373 N -3.36 0.98 -1.67 3.17 5.15 -1.26 -4.43 115.26 113.84 1n8q n ASN 373 Ca 0.01 -2.81 0.08 0.00 -0.60 0.00 0.00 54.58 51.25 1n8q n ASN 373 Cb 0.55 -0.64 0.36 0.00 -0.53 0.00 0.00 39.78 39.52 1n8q n ASN 373 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1n8q n PRO 374 N 1.66 4.14 0.00 1.20 -0.04 -1.26 -4.28 135.00 136.41 1n8q n PRO 374 Ca 0.25 -2.84 0.06 0.00 -0.04 0.00 0.00 63.50 60.93 1n8q n PRO 374 Cb 0.48 -2.05 -0.06 0.00 -0.04 0.00 0.00 33.50 31.83 1n8q n PRO 374 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1n8q n ASN 375 N 0.83 0.64 -0.11 3.54 4.05 -1.26 -4.63 115.26 118.31 1n8q n ASN 375 Ca 0.25 -0.82 -0.15 0.00 0.45 0.00 0.00 54.58 54.32 1n8q n ASN 375 Cb 1.00 0.94 -0.12 0.00 1.23 0.00 0.00 39.78 42.82 1n8q n ASN 375 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1n8q n LEU 376 N -1.16 2.09 -4.50 1.20 7.94 -1.26 -4.99 117.00 116.31 1n8q n LEU 376 Ca 0.03 -0.09 -0.48 0.00 -1.11 0.00 0.00 56.01 54.35 1n8q n LEU 376 Cb 0.19 -0.46 -0.03 0.00 0.53 0.00 0.00 43.42 43.65 1n8q n LEU 376 CO 0.23 0.78 0.38 0.00 -1.11 0.00 0.00 177.39 177.66 1n8q n ILE 377 N -3.06 1.54 -4.20 1.96 3.06 -1.26 -4.83 119.36 112.56 1n8q n ILE 377 Ca -0.40 -0.38 -0.13 0.00 -2.50 0.00 0.00 62.75 59.34 1n8q n ILE 377 Cb 1.01 -0.47 -0.10 0.00 0.54 0.00 0.00 39.64 40.62 1n8q n ILE 377 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1n8q s ARG 378 N -0.91 0.91 0.02 9.51 1.70 -0.38 -4.91 118.95 124.89 1n8q s ARG 378 Ca 0.67 -1.34 -0.26 0.00 -0.47 0.00 0.00 55.73 54.34 1n8q s ARG 378 Cb -0.88 -0.41 -0.05 0.00 -0.57 0.00 0.00 34.95 33.04 1n8q s ARG 378 CO 0.56 0.03 0.82 0.00 -1.08 0.00 0.00 175.30 175.63 1n8q s LEU 380 N 0.33 4.02 -0.19 0.00 2.96 -0.38 -4.81 118.68 120.60 1n8q s LEU 380 Ca 0.42 1.39 -0.10 0.00 -0.22 0.00 0.00 54.13 55.62 1n8q s LEU 380 Cb -0.20 -3.54 -0.21 0.00 0.50 0.00 0.00 46.19 42.74 1n8q s LEU 380 CO 0.24 -0.91 0.11 0.29 -1.32 0.00 0.00 176.35 174.76 1n8q n LYS 381 N 6.94 0.67 -4.29 1.98 4.76 -1.26 -4.83 118.16 122.12 1n8q n LYS 381 Ca 0.14 0.32 -0.16 0.00 -2.87 0.00 0.00 58.31 55.74 1n8q n LYS 381 Cb 0.46 -1.65 -0.10 0.00 -1.84 0.00 0.00 35.03 31.90 1n8q n LYS 381 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 1n8q s ASP 382 N -6.96 1.02 -0.03 4.39 1.47 -1.26 -4.99 116.67 110.31 1n8q s ASP 382 Ca -0.29 -1.44 -0.01 0.00 1.18 0.00 0.00 52.55 51.99 1n8q s ASP 382 Cb 0.08 0.29 0.02 0.00 -0.34 0.00 0.00 42.92 42.97 1n8q s ASP 382 CO 0.66 -0.81 0.06 0.12 0.68 0.00 0.00 175.17 175.87 1n8q s PHE 383 N -3.81 -0.05 0.00 2.11 2.19 -1.26 -4.43 117.98 112.73 1n8q s PHE 383 Ca 0.38 0.20 0.00 0.00 0.33 0.00 0.00 56.93 57.84 1n8q s PHE 383 Cb 0.07 -0.09 0.00 0.00 -1.31 0.00 0.00 43.02 41.69 1n8q s PHE 383 CO 0.15 -0.08 0.00 -0.35 1.83 0.00 0.00 175.22 176.77 1n8q n PRO 384 N 3.68 -0.84 -2.64 10.12 -0.04 -1.26 -5.09 135.00 138.92 1n8q n PRO 384 Ca -0.20 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.04 1n8q n PRO 384 Cb 0.55 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.07 1n8q n PRO 384 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1n8q s PRO 385 N -2.77 2.27 0.27 0.54 0.05 -1.26 -4.91 135.00 129.19 1n8q s PRO 385 Ca 0.00 -0.92 0.07 0.00 0.05 0.00 0.00 61.00 60.20 1n8q s PRO 385 Cb 0.00 -2.45 -0.06 0.00 0.05 0.00 0.00 34.50 32.05 1n8q s PRO 385 CO 0.00 -0.94 -0.07 -0.98 0.05 0.00 0.00 177.00 175.06 1n8q s ARG 386 N -4.87 1.53 0.18 4.56 1.04 -1.26 -1.41 118.95 118.71 1n8q s ARG 386 Ca 0.60 -1.76 0.06 0.00 -1.04 0.00 0.00 55.73 53.59 1n8q s ARG 386 Cb -0.09 -1.18 -0.04 0.00 -2.04 0.00 0.00 34.95 31.61 1n8q s ARG 386 CO 0.40 0.07 0.12 0.45 -0.04 0.00 0.00 175.30 176.30 1n8q s SER 387 N -3.43 5.39 0.00 -2.89 0.15 -1.26 -4.95 113.70 106.71 1n8q s SER 387 Ca 0.29 -0.20 0.22 0.00 0.70 0.00 0.00 55.95 56.96 1n8q s SER 387 Cb 0.03 -1.36 0.51 0.00 -1.71 0.00 0.00 66.02 63.49 1n8q s SER 387 CO 0.11 0.06 1.45 0.29 1.20 0.00 0.00 173.24 176.35 1n8q n LYS 388 N -0.43 2.48 -2.53 5.44 4.76 -1.26 -4.78 118.16 121.84 1n8q n LYS 388 Ca -0.08 -2.26 -0.34 0.00 -2.87 0.00 0.00 58.31 52.76 1n8q n LYS 388 Cb 0.55 -1.51 -0.03 0.00 -1.84 0.00 0.00 35.03 32.20 1n8q n LYS 388 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n8q s LEU 389 N -1.34 3.84 0.00 -0.35 1.02 -1.26 -5.00 118.68 115.60 1n8q s LEU 389 Ca 0.41 1.94 0.00 0.00 0.02 0.00 0.00 54.13 56.50 1n8q s LEU 389 Cb 0.23 -4.56 0.00 0.00 0.02 0.00 0.00 46.19 41.88 1n8q s LEU 389 CO 0.31 -0.80 0.68 -0.67 0.02 0.00 0.00 176.35 175.89 1n8q n ASP 390 N -0.98 0.00 -2.60 2.29 -0.08 -1.26 -4.52 116.55 109.40 1n8q n ASP 390 Ca 0.09 0.68 -0.00 0.00 -1.51 0.00 0.00 54.79 54.06 1n8q n ASP 390 Cb 0.52 -0.18 0.06 0.00 2.34 0.00 0.00 41.12 43.86 1n8q n ASP 390 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1n8q n SER 391 N -1.16 0.92 -4.80 1.67 3.41 -1.26 -4.69 113.62 107.71 1n8q n SER 391 Ca 0.00 -2.05 -0.29 0.00 -0.26 0.00 0.00 58.87 56.27 1n8q n SER 391 Cb 0.00 -0.24 -0.06 0.00 -0.26 0.00 0.00 64.21 63.65 1n8q n SER 391 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1n8q s GLN 392 N -2.59 2.94 -0.39 4.33 1.11 -1.26 -4.81 119.66 118.98 1n8q s GLN 392 Ca 0.24 -0.75 -0.02 0.00 0.01 0.00 0.00 55.36 54.84 1n8q s GLN 392 Cb 0.34 -2.72 0.20 0.00 -1.01 0.00 0.00 33.01 29.83 1n8q s GLN 392 CO -0.07 0.53 2.20 1.33 0.01 0.00 0.00 175.29 179.30 1n8q n VAL 393 N 0.08 3.01 0.31 1.09 0.24 -1.26 -1.08 118.33 120.71 1n8q n VAL 393 Ca -0.08 -2.14 0.06 0.00 -2.04 0.00 0.00 64.34 60.14 1n8q n VAL 393 Cb 0.53 -1.38 -0.08 0.00 -1.47 0.00 0.00 33.84 31.44 1n8q n VAL 393 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1n8q n TYR 394 N 0.33 0.00 -0.10 6.34 4.11 -1.26 -3.36 117.16 123.22 1n8q n TYR 394 Ca 0.38 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 58.08 1n8q n TYR 394 Cb 0.58 -0.12 -0.07 0.00 -0.00 0.00 0.00 39.34 39.72 1n8q n TYR 394 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1n8q n GLY 395 N 1.51 -0.38 0.28 -7.48 0.00 -0.26 -0.26 105.19 98.61 1n8q n GLY 395 Ca 0.00 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.02 1n8q n GLY 395 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1n8q h ASP 396 N -0.80 0.00 -0.41 1.61 3.45 -1.34 -3.34 116.42 115.60 1n8q h ASP 396 Ca -0.44 0.00 -0.26 0.00 0.43 0.00 0.00 57.03 56.76 1n8q h ASP 396 Cb 1.33 0.00 -0.40 0.00 -0.56 0.00 0.00 39.33 39.71 1n8q h ASP 396 CO -0.26 0.06 -1.07 1.41 -1.57 0.00 0.00 179.24 177.80 1n8q n HIS 397 N -3.71 1.24 -1.04 4.55 8.25 -1.22 -4.95 115.22 118.35 1n8q n HIS 397 Ca -0.02 -1.95 0.13 0.00 -0.26 0.00 0.00 57.72 55.62 1n8q n HIS 397 Cb 0.16 -0.23 -0.04 0.00 1.12 0.00 0.00 29.99 31.00 1n8q n HIS 397 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1n8q n THR 398 N -0.49 0.00 -1.39 1.59 -2.24 0.64 -4.61 114.28 107.79 1n8q n THR 398 Ca 0.11 0.13 -0.34 0.00 -2.27 0.00 0.00 64.05 61.67 1n8q n THR 398 Cb 0.86 -0.46 0.10 0.00 -2.10 0.00 0.00 70.33 68.73 1n8q n THR 398 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1n8q s SER 399 N -5.42 4.11 -0.10 3.42 0.15 -0.50 -4.61 113.70 110.76 1n8q s SER 399 Ca 0.00 2.36 0.17 0.00 0.70 0.00 0.00 55.95 59.17 1n8q s SER 399 Cb 0.00 -2.59 0.59 0.00 -1.71 0.00 0.00 66.02 62.31 1n8q s SER 399 CO 0.00 -2.32 1.51 0.00 1.20 0.00 0.00 173.24 173.63 1n8q n GLN 400 N -2.80 3.37 -2.11 5.44 6.02 -1.26 -4.73 117.38 121.31 1n8q n GLN 400 Ca 0.13 -2.69 -0.42 0.00 -0.01 0.00 0.00 57.00 54.01 1n8q n GLN 400 Cb 0.50 -1.74 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 1n8q n GLN 400 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1n8q s ILE 401 N -1.81 3.62 0.46 5.09 -1.09 -1.26 -4.97 121.20 121.23 1n8q s ILE 401 Ca 0.43 0.89 0.08 0.00 -2.23 0.00 0.00 60.65 59.83 1n8q s ILE 401 Cb 0.28 -3.58 0.02 0.00 -1.58 0.00 0.00 42.46 37.61 1n8q s ILE 401 CO 0.20 -0.04 0.57 0.42 -1.23 0.00 0.00 174.94 174.86 1n8q s THR 402 N 3.21 2.69 0.06 2.92 -4.23 -1.26 -4.72 115.64 114.30 1n8q s THR 402 Ca 0.68 -1.10 0.24 0.00 -1.18 0.00 0.00 61.69 60.34 1n8q s THR 402 Cb -0.32 -2.78 0.24 0.00 1.34 0.00 0.00 72.50 70.98 1n8q s THR 402 CO 0.27 0.00 1.79 0.07 -0.54 0.00 0.00 174.62 176.21 1n8q h LYS 403 N 0.63 0.00 -0.00 3.99 5.09 -1.98 -2.90 116.57 121.40 1n8q h LYS 403 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.36 1n8q h LYS 403 Cb 1.28 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.61 1n8q h LYS 403 CO 0.47 0.21 -0.33 -0.85 -2.09 0.00 0.00 179.45 176.86 1n8q n GLU 404 N -3.31 0.18 0.22 0.07 0.28 -1.26 -3.08 120.64 113.74 1n8q n GLU 404 Ca 0.01 -0.09 0.07 0.00 -0.16 0.00 0.00 57.16 56.99 1n8q n GLU 404 Cb 0.45 -1.50 0.52 0.00 1.43 0.00 0.00 31.44 32.34 1n8q n GLU 404 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1n8q h HIS 405 N 0.22 0.00 -2.07 -1.84 3.86 -1.92 -3.37 115.15 110.03 1n8q h HIS 405 Ca 0.00 0.00 -0.71 0.00 -1.16 0.00 0.00 60.37 58.50 1n8q h HIS 405 Cb 0.49 0.00 -0.33 0.00 1.06 0.00 0.00 27.41 28.63 1n8q h HIS 405 CO 0.00 0.24 0.38 1.28 0.86 0.00 0.00 177.93 180.69 1n8q n LEU 406 N -3.93 6.34 -3.65 2.43 4.77 -1.18 -4.86 117.00 116.92 1n8q n LEU 406 Ca -0.02 -5.28 -0.28 0.00 -0.03 0.00 0.00 56.01 50.40 1n8q n LEU 406 Cb 0.32 -0.89 -0.12 0.00 -2.33 0.00 0.00 43.42 40.40 1n8q n LEU 406 CO 0.35 2.07 -0.22 -1.83 -1.33 0.00 0.00 177.39 176.43 1n8q s GLU 407 N -3.95 1.41 0.00 3.23 -1.05 -1.26 -4.90 118.70 112.18 1n8q s GLU 407 Ca 0.46 -2.30 0.00 0.00 -0.15 0.00 0.00 54.97 52.98 1n8q s GLU 407 Cb 0.31 -2.28 0.00 0.00 -0.44 0.00 0.00 34.13 31.72 1n8q s GLU 407 CO -0.22 -1.25 0.00 -0.35 0.95 0.00 0.00 175.26 174.39 1n8q n PRO 408 N 3.02 0.00 0.00 -4.83 -0.05 -1.26 -5.01 135.00 126.87 1n8q n PRO 408 Ca 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.62 1n8q n PRO 408 Cb 0.38 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.83 1n8q n PRO 408 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 175.50 175.72 1n8q n ASN 409 N 0.00 1.32 0.00 3.54 6.94 -1.26 -5.01 115.26 120.79 1n8q n ASN 409 Ca 0.00 -0.06 0.00 0.00 -0.02 0.00 0.00 54.58 54.50 1n8q n ASN 409 Cb 0.00 0.38 0.00 0.00 -2.36 0.00 0.00 39.78 37.80 1n8q n ASN 409 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1n8q n LEU 410 N -0.51 0.32 -0.09 -4.53 -0.00 -1.26 -4.78 117.00 106.15 1n8q n LEU 410 Ca 0.00 0.55 -0.09 0.00 -0.00 0.00 0.00 56.01 56.48 1n8q n LEU 410 Cb 0.00 -0.12 -0.03 0.00 -0.00 0.00 0.00 43.42 43.27 1n8q n LEU 410 CO 0.00 -0.12 -0.65 1.21 -0.00 0.00 0.00 177.39 177.83 1n8q n GLU 411 N -0.87 0.52 -1.07 1.96 0.00 -1.26 -5.02 120.64 114.90 1n8q n GLU 411 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 57.16 57.38 1n8q n GLU 411 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 31.44 30.01 1n8q n GLU 411 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1n8q n GLY 412 N 1.47 0.89 3.78 8.31 0.00 -1.26 -5.08 105.19 113.29 1n8q n GLY 412 Ca -0.13 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 1n8q n GLY 412 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n8q s LEU 413 N 0.00 2.90 0.78 0.99 1.43 -1.26 -5.06 118.68 118.45 1n8q s LEU 413 Ca 0.00 1.67 -0.12 0.00 -1.03 0.00 0.00 54.13 54.66 1n8q s LEU 413 Cb 0.00 -4.37 0.06 0.00 0.03 0.00 0.00 46.19 41.91 1n8q s LEU 413 CO 0.00 -1.98 1.13 0.42 0.23 0.00 0.00 176.35 176.15 1n8q s THR 414 N -2.97 2.73 0.20 5.49 -4.23 -1.26 -4.93 115.64 110.67 1n8q s THR 414 Ca 0.61 0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 61.24 1n8q s THR 414 Cb -0.16 -3.17 0.12 0.00 1.34 0.00 0.00 72.50 70.63 1n8q s THR 414 CO 0.56 -0.31 1.86 0.58 -0.54 0.00 0.00 174.62 176.77 1n8q h VAL 415 N -0.96 1.15 -0.69 2.29 2.07 -1.90 -2.35 116.25 115.86 1n8q h VAL 415 Ca -0.46 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1n8q h VAL 415 Cb 1.29 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1n8q h VAL 415 CO 0.64 0.16 0.44 -0.78 0.02 0.00 0.00 177.57 178.05 1n8q h ASP 416 N 0.88 0.80 0.60 0.57 3.58 -1.99 -1.39 116.42 119.47 1n8q h ASP 416 Ca 0.25 -0.03 -0.17 0.00 0.42 0.00 0.00 57.03 57.51 1n8q h ASP 416 Cb -0.07 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 40.76 1n8q h ASP 416 CO -0.07 0.60 -0.75 -0.33 -2.88 0.00 0.00 179.24 175.81 1n8q h GLU 417 N 0.94 0.11 -0.17 0.28 5.08 -1.85 -1.84 114.58 117.14 1n8q h GLU 417 Ca 0.25 -0.10 -0.16 0.00 -1.00 0.00 0.00 59.36 58.35 1n8q h GLU 417 Cb -0.08 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1n8q h GLU 417 CO -0.05 0.81 -0.55 0.00 -1.00 0.00 0.00 179.01 178.21 1n8q h ALA 418 N 1.16 0.72 -0.21 3.43 0.00 -0.87 -1.47 119.26 122.02 1n8q h ALA 418 Ca -0.02 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 1n8q h ALA 418 Cb 1.31 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1n8q h ALA 418 CO 0.11 0.69 -0.11 0.82 0.00 0.00 0.00 179.25 180.75 1n8q h ILE 419 N 0.39 1.31 -0.56 0.00 2.04 -1.26 0.64 117.51 120.07 1n8q h ILE 419 Ca 0.01 -1.19 0.11 0.00 1.00 0.00 0.00 64.86 64.79 1n8q h ILE 419 Cb 1.09 1.63 -0.09 0.00 -0.74 0.00 0.00 36.82 38.71 1n8q h ILE 419 CO 0.10 0.36 0.01 1.56 0.00 0.00 0.00 178.15 180.18 1n8q h GLN 420 N 0.16 0.12 -0.78 2.37 4.20 -1.27 -2.20 115.11 117.71 1n8q h GLN 420 Ca 0.05 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1n8q h GLN 420 Cb 0.61 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1n8q h GLN 420 CO 0.03 0.08 0.03 0.09 -0.67 0.00 0.00 178.83 178.39 1n8q n ASN 421 N -5.25 3.63 -3.95 1.46 3.02 -0.56 -4.93 115.26 108.68 1n8q n ASN 421 Ca 0.07 -2.55 -0.26 0.00 -0.03 0.00 0.00 54.58 51.82 1n8q n ASN 421 Cb 0.31 -0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 38.85 1n8q n ASN 421 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1n8q n LYS 422 N 0.30 -3.50 0.00 3.52 4.76 -0.83 -4.91 118.16 117.50 1n8q n LYS 422 Ca 0.17 0.43 0.05 0.00 -2.87 0.00 0.00 58.31 56.09 1n8q n LYS 422 Cb 0.81 -4.66 -0.05 0.00 -1.84 0.00 0.00 35.03 29.28 1n8q n LYS 422 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1n8q n ARG 423 N -4.40 3.04 -4.03 1.97 1.74 0.22 -4.86 116.66 110.35 1n8q n ARG 423 Ca -0.27 -0.15 -0.35 0.00 -0.77 0.00 0.00 57.85 56.31 1n8q n ARG 423 Cb 0.66 -1.05 -0.09 0.00 -1.02 0.00 0.00 32.46 30.97 1n8q n ARG 423 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1n8q s LEU 424 N -2.33 3.95 0.13 0.55 1.43 -1.24 -1.40 118.68 119.76 1n8q s LEU 424 Ca 0.05 0.21 0.06 0.00 -1.03 0.00 0.00 54.13 53.42 1n8q s LEU 424 Cb 0.09 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1n8q s LEU 424 CO 0.41 0.28 -0.14 -0.36 0.23 0.00 0.00 176.35 176.78 1n8q s PHE 425 N -0.25 1.40 -0.03 0.29 0.40 -0.26 -1.25 117.98 118.27 1n8q s PHE 425 Ca 0.09 -0.57 0.03 0.00 -0.60 0.00 0.00 56.93 55.88 1n8q s PHE 425 Cb -0.12 -0.73 -0.00 0.00 0.51 0.00 0.00 43.02 42.68 1n8q s PHE 425 CO 0.01 0.15 -0.13 -1.17 0.70 0.00 0.00 175.22 174.78 1n8q s LEU 426 N -2.56 1.86 -0.39 -0.37 2.96 0.72 -0.55 118.68 120.35 1n8q s LEU 426 Ca 0.10 -0.26 -0.05 0.00 -0.22 0.00 0.00 54.13 53.70 1n8q s LEU 426 Cb -0.04 -0.74 0.08 0.00 0.50 0.00 0.00 46.19 46.00 1n8q s LEU 426 CO 0.03 0.11 0.18 -0.22 -1.32 0.00 0.00 176.35 175.13 1n8q s LEU 427 N 0.07 4.93 -0.33 -0.68 0.20 0.29 -1.25 118.68 121.90 1n8q s LEU 427 Ca -0.02 -1.67 -0.09 0.00 0.69 0.00 0.00 54.13 53.04 1n8q s LEU 427 Cb -0.09 -1.86 0.01 0.00 -0.43 0.00 0.00 46.19 43.82 1n8q s LEU 427 CO 0.01 -0.48 0.15 -0.62 -0.29 0.00 0.00 176.35 175.12 1n8q s ASP 428 N 1.82 5.52 -0.22 3.68 -1.08 -1.26 -1.10 116.67 124.02 1n8q s ASP 428 Ca 0.03 -0.80 0.10 0.00 -0.52 0.00 0.00 52.55 51.37 1n8q s ASP 428 Cb -0.22 -1.97 0.43 0.00 -1.46 0.00 0.00 42.92 39.69 1n8q s ASP 428 CO -0.01 -0.28 1.21 1.41 0.52 0.00 0.00 175.17 178.02 1n8q n HIS 429 N 4.95 0.52 -0.07 -5.34 8.25 -0.58 -4.82 115.22 118.13 1n8q n HIS 429 Ca -0.13 -1.63 -0.09 0.00 -0.26 0.00 0.00 57.72 55.61 1n8q n HIS 429 Cb 0.47 -0.27 -0.06 0.00 1.12 0.00 0.00 29.99 31.25 1n8q n HIS 429 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1n8q h HIS 430 N 1.23 0.00 -0.28 4.41 6.17 -1.87 -3.20 115.15 121.61 1n8q h HIS 430 Ca 0.07 0.00 -0.05 0.00 0.71 0.00 0.00 60.37 61.10 1n8q h HIS 430 Cb 1.11 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 31.03 1n8q h HIS 430 CO 0.77 0.56 -0.02 -0.44 0.71 0.00 0.00 177.93 179.52 1n8q h ASP 431 N -1.00 0.51 -0.71 3.26 3.45 -1.91 -3.07 116.42 116.95 1n8q h ASP 431 Ca -0.07 -0.32 -0.01 0.00 0.43 0.00 0.00 57.03 57.06 1n8q h ASP 431 Cb 0.63 -0.14 -0.04 0.00 -0.56 0.00 0.00 39.33 39.23 1n8q h ASP 431 CO -0.04 0.71 0.41 -0.65 -1.57 0.00 0.00 179.24 178.10 1n8q h PRO 432 N 0.29 0.99 0.00 3.56 0.11 -1.95 -3.21 132.00 131.80 1n8q h PRO 432 Ca 0.08 -0.10 -0.17 0.00 0.11 0.00 0.00 66.00 65.91 1n8q h PRO 432 Cb 0.46 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.34 1n8q h PRO 432 CO 0.02 0.72 -1.20 0.97 -0.21 0.00 0.00 178.00 178.29 1n8q h ILE 433 N 1.00 0.74 -0.59 4.15 2.10 -1.82 -3.39 117.51 119.71 1n8q h ILE 433 Ca 0.26 -2.27 0.12 0.00 1.08 0.00 0.00 64.86 64.04 1n8q h ILE 433 Cb 0.00 2.25 -0.11 0.00 -1.09 0.00 0.00 36.82 37.87 1n8q h ILE 433 CO -0.04 0.42 -0.18 -0.03 -1.08 0.00 0.00 178.15 177.24 1n8q h MET 434 N 0.00 -0.03 0.00 2.19 4.05 -1.53 0.29 114.93 119.90 1n8q h MET 434 Ca -0.13 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.29 1n8q h MET 434 Cb 1.61 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 32.42 1n8q h MET 434 CO 0.06 -0.02 0.00 -2.30 0.23 0.00 0.00 176.91 174.88 1n8q n PRO 435 N -5.42 0.07 0.00 0.39 -0.02 -1.26 -2.73 135.00 126.03 1n8q n PRO 435 Ca 0.06 0.32 0.06 0.00 -2.02 0.00 0.00 63.50 61.92 1n8q n PRO 435 Cb 0.32 -1.63 -0.04 0.00 -0.02 0.00 0.00 33.50 32.13 1n8q n PRO 435 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1n8q n TYR 436 N -1.76 0.00 -0.37 6.00 4.02 -0.05 -4.72 117.16 120.28 1n8q n TYR 436 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.94 1n8q n TYR 436 Cb 0.19 0.00 0.17 0.00 -0.02 0.00 0.00 39.34 39.68 1n8q n TYR 436 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1n8q h LEU 437 N 0.58 1.05 -0.68 7.72 5.85 -0.97 -0.99 115.31 127.87 1n8q h LEU 437 Ca 0.00 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1n8q h LEU 437 Cb 0.34 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1n8q h LEU 437 CO 0.00 0.67 0.30 -0.09 -0.34 0.00 0.00 178.44 178.99 1n8q h ARG 438 N 1.19 0.99 -0.27 1.25 2.43 -1.84 0.19 114.38 118.32 1n8q h ARG 438 Ca 0.43 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.39 1n8q h ARG 438 Cb 0.15 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1n8q h ARG 438 CO -0.17 0.81 -0.00 0.00 -1.51 0.00 0.00 179.97 179.10 1n8q h ARG 439 N 0.95 0.47 -0.76 0.20 3.08 -1.79 -2.52 114.38 114.01 1n8q h ARG 439 Ca 0.23 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 60.15 1n8q h ARG 439 Cb 0.16 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 1n8q h ARG 439 CO -0.02 0.64 0.49 0.82 -1.07 0.00 0.00 179.97 180.82 1n8q h ILE 440 N 0.25 1.13 -0.00 2.04 2.04 -0.85 -2.72 117.51 119.41 1n8q h ILE 440 Ca 0.07 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1n8q h ILE 440 Cb 0.43 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1n8q h ILE 440 CO 0.01 0.18 -0.05 0.59 0.00 0.00 0.00 178.15 178.88 1n8q n ASN 441 N -4.61 0.20 -0.09 1.72 3.02 0.63 -2.27 115.26 113.86 1n8q n ASN 441 Ca 0.08 -0.38 0.13 0.00 -0.03 0.00 0.00 54.58 54.38 1n8q n ASN 441 Cb 0.07 -0.17 0.45 0.00 -0.61 0.00 0.00 39.78 39.51 1n8q n ASN 441 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n8q n ALA 442 N -1.13 3.01 -2.80 5.41 0.00 -0.96 -4.86 120.51 119.19 1n8q n ALA 442 Ca 0.15 -0.30 -0.14 0.00 0.00 0.00 0.00 53.44 53.15 1n8q n ALA 442 Cb 0.25 -1.24 0.05 0.00 0.00 0.00 0.00 19.45 18.51 1n8q n ALA 442 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1n8q n THR 443 N -1.13 0.00 0.28 0.00 -1.04 -0.96 -5.00 114.28 106.43 1n8q n THR 443 Ca 0.10 -1.09 0.17 0.00 -2.04 0.00 0.00 64.05 61.19 1n8q n THR 443 Cb 0.32 -0.86 0.81 0.00 -1.82 0.00 0.00 70.33 68.78 1n8q n THR 443 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1n8q h SER 444 N -0.11 0.00 -3.76 8.00 4.64 -1.89 -3.43 113.55 116.99 1n8q h SER 444 Ca -0.18 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.65 1n8q h SER 444 Cb 0.76 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 1n8q h SER 444 CO 0.23 0.00 0.24 -0.89 -0.87 0.00 0.00 176.83 175.53 1n8q s THR 445 N -4.22 4.39 -0.11 2.95 2.01 -1.26 -4.68 115.64 114.72 1n8q s THR 445 Ca -0.04 1.54 -0.00 0.00 0.31 0.00 0.00 61.69 63.50 1n8q s THR 445 Cb 0.10 -3.90 0.02 0.00 0.01 0.00 0.00 72.50 68.74 1n8q s THR 445 CO 0.34 0.12 -0.08 -0.54 -0.69 0.00 0.00 174.62 173.77 1n8q s LYS 446 N -2.14 1.58 0.10 4.92 -0.14 -0.09 -4.19 119.74 119.79 1n8q s LYS 446 Ca 0.48 -0.28 0.00 0.00 -1.36 0.00 0.00 55.97 54.81 1n8q s LYS 446 Cb -0.17 -1.61 -0.04 0.00 -1.68 0.00 0.00 37.83 34.34 1n8q s LYS 446 CO 0.22 -0.24 -0.02 0.00 -0.76 0.00 0.00 175.35 174.54 1n8q s ALA 447 N 1.62 0.89 0.18 5.17 0.00 -1.26 -3.81 121.76 124.55 1n8q s ALA 447 Ca 0.04 -1.38 0.10 0.00 0.00 0.00 0.00 51.96 50.72 1n8q s ALA 447 Cb -0.13 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 1n8q s ALA 447 CO -0.08 -0.34 -0.22 0.71 0.00 0.00 0.00 175.76 175.84 1n8q s TYR 448 N -3.80 2.11 -0.10 0.00 2.02 -1.26 -4.96 117.35 111.37 1n8q s TYR 448 Ca 0.15 -0.40 -0.21 0.00 -0.37 0.00 0.00 57.07 56.24 1n8q s TYR 448 Cb 0.07 -1.05 -0.04 0.00 -0.40 0.00 0.00 41.96 40.54 1n8q s TYR 448 CO -0.03 0.44 0.60 0.00 -1.57 0.00 0.00 175.55 174.98 1n8q s ALA 449 N -1.82 3.41 0.21 3.71 0.00 0.01 -4.89 121.76 122.38 1n8q s ALA 449 Ca 0.19 -0.04 0.11 0.00 0.00 0.00 0.00 51.96 52.23 1n8q s ALA 449 Cb -0.07 -2.82 -0.05 0.00 0.00 0.00 0.00 23.12 20.18 1n8q s ALA 449 CO 0.09 -0.09 -0.23 0.95 0.00 0.00 0.00 175.76 176.48 1n8q s THR 450 N 0.80 2.34 -0.01 0.00 -4.23 -1.21 -0.24 115.64 113.09 1n8q s THR 450 Ca 0.32 -2.09 0.02 0.00 -1.18 0.00 0.00 61.69 58.76 1n8q s THR 450 Cb -0.16 -2.14 -0.00 0.00 1.34 0.00 0.00 72.50 71.53 1n8q s THR 450 CO 0.14 -0.18 -0.07 -0.13 -0.54 0.00 0.00 174.62 173.84 1n8q s ARG 451 N -2.82 0.67 0.04 3.99 0.52 -0.72 -1.53 118.95 119.10 1n8q s ARG 451 Ca 0.22 -0.26 0.06 0.00 -0.52 0.00 0.00 55.73 55.23 1n8q s ARG 451 Cb -0.07 -0.65 -0.02 0.00 0.52 0.00 0.00 34.95 34.72 1n8q s ARG 451 CO 0.10 0.14 -0.17 -0.08 0.02 0.00 0.00 175.30 175.31 1n8q s THR 452 N -0.03 1.34 -0.10 0.02 -1.32 -0.26 -0.71 115.64 114.58 1n8q s THR 452 Ca 0.01 -1.09 0.00 0.00 -1.21 0.00 0.00 61.69 59.40 1n8q s THR 452 Cb -0.05 -1.19 -0.02 0.00 -1.51 0.00 0.00 72.50 69.73 1n8q s THR 452 CO -0.00 0.08 -0.09 -0.63 -2.21 0.00 0.00 174.62 171.77 1n8q s ILE 453 N -0.83 3.45 0.09 5.08 1.09 -0.70 -0.55 121.20 128.83 1n8q s ILE 453 Ca 0.04 -0.55 0.07 0.00 -1.10 0.00 0.00 60.65 59.11 1n8q s ILE 453 Cb -0.08 -2.43 -0.03 0.00 -1.06 0.00 0.00 42.46 38.85 1n8q s ILE 453 CO 0.01 0.55 -0.18 -0.76 -0.10 0.00 0.00 174.94 174.47 1n8q s LEU 454 N -0.22 2.29 -0.05 2.97 1.02 0.29 -0.69 118.68 124.28 1n8q s LEU 454 Ca 0.02 -0.65 0.04 0.00 0.02 0.00 0.00 54.13 53.57 1n8q s LEU 454 Cb -0.13 -0.71 -0.00 0.00 0.02 0.00 0.00 46.19 45.37 1n8q s LEU 454 CO 0.03 -0.00 -0.18 0.12 0.02 0.00 0.00 176.35 176.33 1n8q s PHE 455 N -1.21 1.83 -0.36 0.29 2.19 0.05 -1.10 117.98 119.68 1n8q s PHE 455 Ca 0.02 -0.58 -0.27 0.00 0.33 0.00 0.00 56.93 56.43 1n8q s PHE 455 Cb -0.10 -1.24 0.02 0.00 -1.31 0.00 0.00 43.02 40.38 1n8q s PHE 455 CO 0.03 -0.22 1.00 -1.17 1.83 0.00 0.00 175.22 176.69 1n8q s LEU 456 N 0.16 3.94 0.91 6.12 2.96 -0.49 -1.26 118.68 131.02 1n8q s LEU 456 Ca -0.07 0.74 -0.12 0.00 -0.22 0.00 0.00 54.13 54.46 1n8q s LEU 456 Cb -0.13 -3.39 0.14 0.00 0.50 0.00 0.00 46.19 43.31 1n8q s LEU 456 CO 0.03 -0.90 1.11 -0.54 -1.32 0.00 0.00 176.35 174.74 1n8q s LYS 457 N 3.63 1.12 0.47 1.98 1.02 0.64 -4.96 119.74 123.63 1n8q s LYS 457 Ca 0.42 0.45 0.26 0.00 0.02 0.00 0.00 55.97 57.12 1n8q s LYS 457 Cb -0.12 -1.82 1.06 0.00 -0.52 0.00 0.00 37.83 36.43 1n8q s LYS 457 CO 0.19 -2.25 1.88 -0.91 -0.92 0.00 0.00 175.35 173.34 1n8q h ASN 458 N -1.54 0.00 -0.01 2.83 4.21 -1.96 -2.08 115.58 117.03 1n8q h ASN 458 Ca -0.51 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.00 1n8q h ASN 458 Cb 1.32 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.52 1n8q h ASN 458 CO 0.60 0.18 0.00 -0.90 -1.29 0.00 0.00 177.43 176.02 1n8q n ASP 459 N -3.38 0.18 0.00 5.81 3.85 -1.26 -4.90 116.55 116.85 1n8q n ASP 459 Ca -0.00 -1.18 0.00 0.00 -0.71 0.00 0.00 54.79 52.90 1n8q n ASP 459 Cb 0.39 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.15 1n8q n ASP 459 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1n8q n GLY 460 N 0.96 0.76 3.97 6.12 0.00 -0.78 -4.94 105.19 111.28 1n8q n GLY 460 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1n8q n GLY 460 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n8q s THR 461 N -2.78 4.95 -0.07 2.61 -4.23 -1.26 -4.84 115.64 110.01 1n8q s THR 461 Ca 0.00 -0.89 -0.04 0.00 -1.18 0.00 0.00 61.69 59.58 1n8q s THR 461 Cb 0.00 -3.75 -0.04 0.00 1.34 0.00 0.00 72.50 70.05 1n8q s THR 461 CO 0.00 -0.33 0.11 -0.22 -0.54 0.00 0.00 174.62 173.63 1n8q s LEU 462 N -4.10 4.11 -0.00 4.79 2.96 -1.26 -0.26 118.68 124.92 1n8q s LEU 462 Ca 0.38 0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.61 1n8q s LEU 462 Cb -0.09 -2.14 -0.00 0.00 0.50 0.00 0.00 46.19 44.45 1n8q s LEU 462 CO 0.31 0.35 -0.04 0.00 -1.32 0.00 0.00 176.35 175.65 1n8q s ARG 463 N -1.29 0.31 0.29 1.98 1.04 -0.39 -4.67 118.95 116.22 1n8q s ARG 463 Ca 0.18 -0.16 -0.29 0.00 -1.04 0.00 0.00 55.73 54.42 1n8q s ARG 463 Cb -0.12 -0.29 -0.10 0.00 -2.04 0.00 0.00 34.95 32.41 1n8q s ARG 463 CO 0.08 0.08 1.11 -1.25 -0.04 0.00 0.00 175.30 175.27 1n8q s PRO 464 N -0.16 4.59 -0.06 3.89 0.04 -1.26 -0.77 135.00 141.27 1n8q s PRO 464 Ca 0.01 1.81 0.05 0.00 0.04 0.00 0.00 61.00 62.91 1n8q s PRO 464 Cb -0.02 -3.14 -0.07 0.00 0.04 0.00 0.00 34.50 31.31 1n8q s PRO 464 CO -0.00 0.17 0.02 1.28 0.04 0.00 0.00 177.00 178.51 1n8q n LEU 465 N 1.09 0.00 -3.64 -3.56 4.32 0.14 -4.79 117.00 110.56 1n8q n LEU 465 Ca -0.01 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.85 1n8q n LEU 465 Cb 0.45 0.14 -0.07 0.00 -1.62 0.00 0.00 43.42 42.32 1n8q n LEU 465 CO 0.54 0.14 0.40 0.00 -1.22 0.00 0.00 177.39 177.25 1n8q s ALA 466 N -2.15 -1.75 -0.12 -1.18 0.00 -1.22 -4.39 121.76 110.95 1n8q s ALA 466 Ca -0.03 2.00 0.02 0.00 0.00 0.00 0.00 51.96 53.95 1n8q s ALA 466 Cb 0.02 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.99 1n8q s ALA 466 CO 0.24 -0.33 -0.18 0.42 0.00 0.00 0.00 175.76 175.91 1n8q s ILE 467 N 0.41 1.72 -0.30 0.00 1.01 -0.54 -1.72 121.20 121.78 1n8q s ILE 467 Ca -0.00 -0.77 -0.13 0.00 0.00 0.00 0.00 60.65 59.75 1n8q s ILE 467 Cb -0.05 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 1n8q s ILE 467 CO 0.00 0.48 0.27 -0.70 0.00 0.00 0.00 174.94 175.00 1n8q s GLU 468 N 0.96 3.83 -0.34 2.79 2.12 0.11 -0.36 118.70 127.82 1n8q s GLU 468 Ca -0.06 -0.30 -0.12 0.00 0.36 0.00 0.00 54.97 54.85 1n8q s GLU 468 Cb -0.15 -3.71 -0.01 0.00 0.26 0.00 0.00 34.13 30.52 1n8q s GLU 468 CO -0.02 -0.30 0.22 -0.51 -0.54 0.00 0.00 175.26 174.10 1n8q s LEU 469 N 1.87 4.45 0.05 2.70 1.43 0.46 -1.75 118.68 127.89 1n8q s LEU 469 Ca 0.10 -0.48 0.06 0.00 -1.03 0.00 0.00 54.13 52.78 1n8q s LEU 469 Cb -0.16 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.92 1n8q s LEU 469 CO 0.11 -0.24 -0.13 -0.44 0.23 0.00 0.00 176.35 175.88 1n8q s SER 470 N 1.69 4.15 0.19 2.29 0.01 0.66 -0.88 113.70 121.81 1n8q s SER 470 Ca 0.06 -0.35 0.08 0.00 1.31 0.00 0.00 55.95 57.04 1n8q s SER 470 Cb -0.17 -0.78 -0.04 0.00 0.21 0.00 0.00 66.02 65.23 1n8q s SER 470 CO 0.09 0.24 -0.15 -0.76 0.41 0.00 0.00 173.24 173.07 1n8q s LEU 471 N -1.64 2.51 -0.36 2.44 1.43 0.17 -0.81 118.68 122.42 1n8q s LEU 471 Ca 0.17 -0.96 -0.16 0.00 -1.03 0.00 0.00 54.13 52.15 1n8q s LEU 471 Cb -0.11 -0.71 -0.01 0.00 0.03 0.00 0.00 46.19 45.40 1n8q s LEU 471 CO 0.08 -0.13 0.40 -2.16 0.23 0.00 0.00 176.35 174.77 1n8q s PRO 472 N -3.34 3.50 -0.19 1.29 0.04 -1.26 -1.95 135.00 133.10 1n8q s PRO 472 Ca 0.20 -0.42 -0.03 0.00 0.04 0.00 0.00 61.00 60.79 1n8q s PRO 472 Cb -0.02 -3.83 0.01 0.00 0.04 0.00 0.00 34.50 30.70 1n8q s PRO 472 CO 0.07 -0.60 0.05 -2.39 0.04 0.00 0.00 177.00 174.17 1n8q n HIS 473 N 5.48 -2.86 -0.14 0.56 1.44 -1.23 -4.89 115.22 113.57 1n8q n HIS 473 Ca -0.08 1.40 -0.06 0.00 -2.01 0.00 0.00 57.72 56.97 1n8q n HIS 473 Cb 0.49 -3.06 0.03 0.00 0.12 0.00 0.00 29.99 27.57 1n8q n HIS 473 CO 0.00 0.00 0.00 -1.35 -2.81 0.00 0.00 176.34 172.18 1n8q h PRO 474 N 3.60 0.48 -6.62 -1.40 0.11 -1.91 -3.39 132.00 122.88 1n8q h PRO 474 Ca -0.12 -0.03 -0.69 0.00 0.11 0.00 0.00 66.00 65.27 1n8q h PRO 474 Cb 0.50 -0.11 -0.26 0.00 0.11 0.00 0.00 31.00 31.24 1n8q h PRO 474 CO 0.05 0.32 -0.85 1.14 -0.21 0.00 0.00 178.00 178.44 1n8q s GLN 475 N -6.15 2.03 0.00 1.05 1.03 -1.26 -5.09 119.66 111.28 1n8q s GLN 475 Ca -0.13 -0.98 0.00 0.00 0.04 0.00 0.00 55.36 54.29 1n8q s GLN 475 Cb 0.12 -2.09 0.00 0.00 0.03 0.00 0.00 33.01 31.07 1n8q s GLN 475 CO 0.73 0.55 0.00 0.41 -2.54 0.00 0.00 175.29 174.43 1n8q n GLY 476 N 1.98 0.27 0.00 2.60 0.00 -1.26 -4.90 105.19 103.87 1n8q n GLY 476 Ca -0.16 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1n8q n GLY 476 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n8q n ASP 477 N 0.00 0.00 -4.81 1.61 2.03 -1.26 -4.94 116.55 109.19 1n8q n ASP 477 Ca 0.00 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.00 1n8q n ASP 477 Cb 0.00 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.46 1n8q n ASP 477 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1n8q s GLN 478 N 0.00 2.72 0.00 -0.67 -0.21 -1.26 -3.89 119.66 116.36 1n8q s GLN 478 Ca 0.00 1.00 0.00 0.00 0.02 0.00 0.00 55.36 56.38 1n8q s GLN 478 Cb 0.00 -1.96 0.00 0.00 1.00 0.00 0.00 33.01 32.05 1n8q s GLN 478 CO 0.00 -1.26 0.00 0.43 -2.12 0.00 0.00 175.29 172.34 1n8q n SER 479 N -3.25 -0.22 0.00 5.90 7.64 -1.26 -4.95 113.62 117.48 1n8q n SER 479 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1n8q n SER 479 Cb 0.53 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1n8q n SER 479 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n8q n GLY 480 N -2.07 -0.12 3.69 0.23 0.00 -1.25 -4.36 105.19 101.30 1n8q n GLY 480 Ca 0.00 -1.16 -0.38 0.00 0.00 0.00 0.00 46.02 44.48 1n8q n GLY 480 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n8q s ALA 481 N -1.40 3.56 -0.50 4.61 0.00 -1.26 -3.50 121.76 123.27 1n8q s ALA 481 Ca 0.00 -0.49 -0.25 0.00 0.00 0.00 0.00 51.96 51.21 1n8q s ALA 481 Cb 0.00 -2.56 0.03 0.00 0.00 0.00 0.00 23.12 20.59 1n8q s ALA 481 CO 0.00 -0.17 0.95 0.12 0.00 0.00 0.00 175.76 176.66 1n8q s PHE 482 N 1.02 2.86 0.08 0.00 2.19 -0.82 -4.94 117.98 118.37 1n8q s PHE 482 Ca 0.18 0.26 0.08 0.00 0.33 0.00 0.00 56.93 57.79 1n8q s PHE 482 Cb -0.14 -4.05 -0.03 0.00 -1.31 0.00 0.00 43.02 37.49 1n8q s PHE 482 CO 0.07 -1.22 -0.22 -1.12 1.83 0.00 0.00 175.22 174.56 1n8q s SER 483 N 2.50 2.69 0.06 6.13 0.01 -1.26 0.43 113.70 124.25 1n8q s SER 483 Ca 0.36 -0.62 0.09 0.00 1.31 0.00 0.00 55.95 57.08 1n8q s SER 483 Cb -0.11 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.90 1n8q s SER 483 CO 0.24 0.14 -0.25 -1.10 0.41 0.00 0.00 173.24 172.68 1n8q s GLN 484 N -1.58 1.61 0.03 12.44 -0.21 -0.06 -5.00 119.66 126.89 1n8q s GLN 484 Ca 0.08 -1.10 0.08 0.00 0.02 0.00 0.00 55.36 54.45 1n8q s GLN 484 Cb -0.10 -1.81 -0.03 0.00 1.00 0.00 0.00 33.01 32.07 1n8q s GLN 484 CO 0.03 0.46 -0.24 0.14 -2.12 0.00 0.00 175.29 173.56 1n8q s VAL 485 N -0.85 2.29 0.11 1.09 -7.23 -1.26 -0.41 120.40 114.14 1n8q s VAL 485 Ca 0.11 -1.28 0.07 0.00 -1.81 0.00 0.00 61.98 59.07 1n8q s VAL 485 Cb -0.10 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 1n8q s VAL 485 CO 0.03 0.41 -0.16 -0.36 -0.31 0.00 0.00 175.10 174.70 1n8q s PHE 486 N -0.79 1.50 0.06 2.82 0.40 0.51 -4.98 117.98 117.50 1n8q s PHE 486 Ca 0.12 -0.48 0.05 0.00 -0.60 0.00 0.00 56.93 56.02 1n8q s PHE 486 Cb -0.10 -0.81 -0.03 0.00 0.51 0.00 0.00 43.02 42.60 1n8q s PHE 486 CO 0.02 0.16 -0.15 -0.51 0.70 0.00 0.00 175.22 175.44 1n8q s LEU 487 N -2.13 2.22 0.43 -0.37 1.02 -1.26 -1.47 118.68 117.12 1n8q s LEU 487 Ca 0.06 -0.54 -0.25 0.00 0.02 0.00 0.00 54.13 53.42 1n8q s LEU 487 Cb -0.08 -0.60 -0.09 0.00 0.02 0.00 0.00 46.19 45.44 1n8q s LEU 487 CO 0.04 -0.00 1.36 -2.65 0.02 0.00 0.00 176.35 175.11 1n8q n PRO 488 N 1.60 2.11 -3.82 1.29 -0.02 -1.26 -4.80 135.00 130.10 1n8q n PRO 488 Ca -0.19 0.75 -0.12 0.00 -2.02 0.00 0.00 63.50 61.91 1n8q n PRO 488 Cb 0.54 -2.51 -0.12 0.00 -0.02 0.00 0.00 33.50 31.39 1n8q n PRO 488 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n8q s ALA 489 N -1.19 -0.43 -0.02 3.55 0.00 -1.26 -5.05 121.76 117.35 1n8q s ALA 489 Ca 0.61 0.43 0.12 0.00 0.00 0.00 0.00 51.96 53.12 1n8q s ALA 489 Cb -0.48 -0.25 -0.19 0.00 0.00 0.00 0.00 23.12 22.20 1n8q s ALA 489 CO 0.58 -0.10 0.88 -0.44 0.00 0.00 0.00 175.76 176.68 1n8q h ASP 490 N 5.67 0.00 -5.30 0.00 3.32 -1.95 -3.39 116.42 114.77 1n8q h ASP 490 Ca -0.26 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.69 1n8q h ASP 490 Cb 1.20 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.66 1n8q h ASP 490 CO 0.40 0.91 -0.15 -1.83 -1.72 0.00 0.00 179.24 176.85 1n8q s GLU 491 N -2.69 1.60 1.74 3.56 -1.05 -1.26 -4.88 118.70 115.71 1n8q s GLU 491 Ca -0.02 -1.36 0.00 0.00 -0.15 0.00 0.00 54.97 53.44 1n8q s GLU 491 Cb 0.09 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 1n8q s GLU 491 CO 0.82 -0.66 0.00 0.41 0.95 0.00 0.00 175.26 176.77 1n8q n GLY 492 N -0.41 -1.56 0.15 -3.83 0.00 -1.26 -3.58 105.19 94.70 1n8q n GLY 492 Ca -0.01 -1.32 0.02 0.00 0.00 0.00 0.00 46.02 44.71 1n8q n GLY 492 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1n8q h VAL 493 N 0.00 1.12 -0.68 1.61 3.04 -1.96 -2.96 116.25 116.42 1n8q h VAL 493 Ca 0.00 -2.01 0.09 0.00 -1.01 0.00 0.00 66.70 63.77 1n8q h VAL 493 Cb 0.00 2.17 -0.04 0.00 -2.01 0.00 0.00 31.29 31.41 1n8q h VAL 493 CO 0.00 0.52 0.45 -0.33 -1.01 0.00 0.00 177.57 177.20 1n8q h GLU 494 N 0.00 0.54 -0.15 4.17 3.07 -1.97 0.94 114.58 121.18 1n8q h GLU 494 Ca -0.01 -0.03 -0.17 0.00 -0.50 0.00 0.00 59.36 58.65 1n8q h GLU 494 Cb 1.13 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.91 1n8q h GLU 494 CO 0.07 0.36 -0.62 0.66 -1.40 0.00 0.00 179.01 178.08 1n8q h SER 495 N 0.56 0.58 -0.44 1.42 4.64 -1.57 -0.79 113.55 117.94 1n8q h SER 495 Ca 0.31 -0.34 -0.13 0.00 -0.47 0.00 0.00 61.79 61.16 1n8q h SER 495 Cb 0.47 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1n8q h SER 495 CO -0.10 1.06 -0.22 0.28 -0.87 0.00 0.00 176.83 176.98 1n8q h SER 496 N 0.38 0.98 -0.44 4.97 0.02 -1.31 0.28 113.55 118.43 1n8q h SER 496 Ca -0.01 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1n8q h SER 496 Cb 1.17 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 1n8q h SER 496 CO 0.11 1.15 0.29 0.40 -1.14 0.00 0.00 176.83 177.64 1n8q h ILE 497 N 0.83 1.12 -0.24 3.27 1.08 -0.84 -1.98 117.51 120.75 1n8q h ILE 497 Ca 0.11 -0.23 -0.05 0.00 -0.39 0.00 0.00 64.86 64.29 1n8q h ILE 497 Cb 0.78 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 35.01 1n8q h ILE 497 CO 0.07 0.12 -0.09 -0.25 -0.69 0.00 0.00 178.15 177.31 1n8q h TRP 498 N 0.59 0.40 -0.11 1.37 2.91 -0.71 0.21 115.95 120.62 1n8q h TRP 498 Ca 0.16 -0.05 -0.20 0.00 1.13 0.00 0.00 58.89 59.93 1n8q h TRP 498 Cb -0.05 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 28.49 1n8q h TRP 498 CO -0.04 0.47 -0.76 1.25 -1.03 0.00 0.00 178.44 178.33 1n8q h LEU 499 N 0.36 0.70 -0.59 0.65 5.85 -0.71 -2.30 115.31 119.27 1n8q h LEU 499 Ca 0.07 -0.46 -0.09 0.00 0.84 0.00 0.00 57.88 58.24 1n8q h LEU 499 Cb 0.38 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1n8q h LEU 499 CO 0.02 1.23 0.02 -0.07 -0.34 0.00 0.00 178.44 179.30 1n8q h LEU 500 N 0.40 1.01 -1.06 2.25 4.07 -1.04 -1.66 115.31 119.28 1n8q h LEU 500 Ca -0.04 -0.30 0.09 0.00 0.08 0.00 0.00 57.88 57.70 1n8q h LEU 500 Cb 1.36 -0.27 -0.07 0.00 1.08 0.00 0.00 40.66 42.76 1n8q h LEU 500 CO 0.14 1.06 0.62 0.00 -1.08 0.00 0.00 178.44 179.19 1n8q h ALA 501 N 0.99 1.49 -0.40 1.53 0.00 -0.75 -1.43 119.26 120.68 1n8q h ALA 501 Ca 0.17 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 1n8q h ALA 501 Cb 0.53 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1n8q h ALA 501 CO 0.03 0.33 -0.34 0.87 0.00 0.00 0.00 179.25 180.14 1n8q h LYS 502 N 1.06 0.93 -0.96 0.00 1.57 -1.26 -2.76 116.57 115.15 1n8q h LYS 502 Ca 0.44 -0.46 0.06 0.00 -1.87 0.00 0.00 60.65 58.83 1n8q h LYS 502 Cb 0.30 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.55 1n8q h LYS 502 CO -0.19 1.11 0.61 0.00 -0.57 0.00 0.00 179.45 180.41 1n8q h ALA 503 N 0.84 1.32 -0.20 3.86 0.00 -0.35 -1.02 119.26 123.72 1n8q h ALA 503 Ca 0.07 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1n8q h ALA 503 Cb 0.92 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1n8q h ALA 503 CO 0.09 0.39 -0.21 1.88 0.00 0.00 0.00 179.25 181.40 1n8q h TYR 504 N 1.11 0.39 -0.18 0.00 0.05 -1.10 -1.06 116.97 116.18 1n8q h TYR 504 Ca 0.41 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 59.10 1n8q h TYR 504 Cb 0.16 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 1n8q h TYR 504 CO -0.01 0.55 -0.00 0.28 -1.05 0.00 0.00 178.16 177.92 1n8q h VAL 505 N 0.32 1.26 -0.23 -2.88 2.07 -1.14 -2.88 116.25 112.76 1n8q h VAL 505 Ca 0.06 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.57 1n8q h VAL 505 Cb 0.55 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1n8q h VAL 505 CO 0.04 0.26 -0.40 0.58 0.02 0.00 0.00 177.57 178.07 1n8q h VAL 506 N 0.07 1.30 -0.54 2.57 2.07 -0.75 0.19 116.25 121.15 1n8q h VAL 506 Ca 0.05 -1.56 0.05 0.00 0.82 0.00 0.00 66.70 66.06 1n8q h VAL 506 Cb 0.39 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 1n8q h VAL 506 CO 0.01 0.49 0.28 0.58 0.02 0.00 0.00 177.57 178.95 1n8q h VAL 507 N 0.45 0.95 -0.30 2.57 2.07 -1.29 0.73 116.25 121.44 1n8q h VAL 507 Ca 0.04 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1n8q h VAL 507 Cb 0.89 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1n8q h VAL 507 CO 0.08 0.10 0.19 0.78 0.02 0.00 0.00 177.57 178.74 1n8q h ASN 508 N 0.53 0.34 -0.54 0.57 -0.26 -1.08 -2.95 115.58 112.19 1n8q h ASN 508 Ca 0.24 -0.02 -0.05 0.00 -0.56 0.00 0.00 56.30 55.91 1n8q h ASN 508 Cb 0.16 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 37.31 1n8q h ASN 508 CO -0.17 0.26 0.12 -0.78 -1.06 0.00 0.00 177.43 175.80 1n8q h ASP 509 N 0.40 0.82 -0.99 5.81 3.58 -0.38 -1.91 116.42 123.75 1n8q h ASP 509 Ca 0.11 -0.24 0.04 0.00 0.42 0.00 0.00 57.03 57.36 1n8q h ASP 509 Cb -0.04 -0.22 -0.06 0.00 1.72 0.00 0.00 39.33 40.74 1n8q h ASP 509 CO -0.02 0.85 0.64 0.28 -2.88 0.00 0.00 179.24 178.11 1n8q h SER 510 N 0.76 1.07 -0.01 2.28 0.02 0.48 0.60 113.55 118.74 1n8q h SER 510 Ca 0.17 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 1n8q h SER 510 Cb 0.35 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 62.66 1n8q h SER 510 CO 0.00 0.72 -0.36 0.00 -1.14 0.00 0.00 176.83 176.06 1n8q h TYR 512 N -0.34 0.25 -0.79 0.00 5.03 -1.29 -1.12 116.97 118.70 1n8q h TYR 512 Ca -0.04 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.32 1n8q h TYR 512 Cb 1.08 -0.03 -0.04 0.00 1.55 0.00 0.00 36.73 39.29 1n8q h TYR 512 CO 0.16 0.04 0.52 1.25 -1.32 0.00 0.00 178.16 178.81 1n8q h HIS 513 N 0.30 0.97 -0.02 -3.82 2.76 -0.85 0.17 115.15 114.66 1n8q h HIS 513 Ca 0.27 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.45 1n8q h HIS 513 Cb 0.34 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 28.97 1n8q h HIS 513 CO -0.20 0.59 -0.02 0.37 -1.30 0.00 0.00 177.93 177.37 1n8q h GLN 514 N 1.03 0.05 0.05 5.26 5.75 -0.60 -0.04 115.11 126.61 1n8q h GLN 514 Ca 0.30 -0.02 -0.26 0.00 -0.15 0.00 0.00 58.65 58.52 1n8q h GLN 514 Cb -0.06 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 1n8q h GLN 514 CO -0.09 0.49 -1.28 -0.07 -2.65 0.00 0.00 178.83 175.24 1n8q h LEU 515 N -0.38 0.15 0.00 -2.39 -0.00 -1.21 -1.53 115.31 109.95 1n8q h LEU 515 Ca 0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 1n8q h LEU 515 Cb 0.48 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 1n8q h LEU 515 CO 0.00 1.16 -0.50 0.52 -0.00 0.00 0.00 178.44 179.62 1n8q n VAL 516 N -3.35 1.35 -0.19 1.22 0.31 0.01 -1.20 118.33 116.49 1n8q n VAL 516 Ca -0.08 0.27 -0.03 0.00 -0.01 0.00 0.00 64.34 64.50 1n8q n VAL 516 Cb 1.00 -1.96 0.18 0.00 -0.91 0.00 0.00 33.84 32.14 1n8q n VAL 516 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1n8q h SER 517 N -0.50 0.87 0.00 4.52 0.02 -1.10 0.13 113.55 117.49 1n8q h SER 517 Ca 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1n8q h SER 517 Cb 0.50 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1n8q h SER 517 CO 0.00 0.77 0.00 1.57 -1.14 0.00 0.00 176.83 178.03 1n8q n HIS 518 N -4.31 0.00 0.29 3.45 -0.00 -0.06 -4.31 115.22 110.27 1n8q n HIS 518 Ca 0.06 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.65 1n8q n HIS 518 Cb 0.17 -0.08 -0.06 0.00 -0.00 0.00 0.00 29.99 30.01 1n8q n HIS 518 CO 0.00 0.00 0.00 2.35 -0.00 0.00 0.00 176.34 178.69 1n8q h TRP 519 N 0.00 -0.86 0.71 1.57 2.91 -1.41 -2.62 115.95 116.24 1n8q h TRP 519 Ca 0.00 -0.01 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 1n8q h TRP 519 Cb 0.00 0.31 0.00 0.00 -0.51 0.00 0.00 29.16 28.96 1n8q h TRP 519 CO 0.00 -0.48 -0.39 1.25 -1.03 0.00 0.00 178.44 177.79 1n8q h LEU 520 N -0.80 -0.95 -0.20 0.65 5.85 -1.06 -0.53 115.31 118.27 1n8q h LEU 520 Ca -0.07 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1n8q h LEU 520 Cb 0.64 0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1n8q h LEU 520 CO 0.07 -0.63 0.00 0.59 -0.34 0.00 0.00 178.44 178.13 1n8q n ASN 521 N -5.54 0.51 0.00 1.25 5.03 0.43 -2.12 115.26 114.82 1n8q n ASN 521 Ca -0.14 0.58 0.00 0.00 0.87 0.00 0.00 54.58 55.89 1n8q n ASN 521 Cb 0.42 -0.70 0.00 0.00 -1.02 0.00 0.00 39.78 38.48 1n8q n ASN 521 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1n8q n THR 522 N -2.01 0.00 -0.28 3.41 -2.24 -0.99 -4.77 114.28 107.39 1n8q n THR 522 Ca 0.05 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 1n8q n THR 522 Cb 0.32 -0.63 -0.10 0.00 -2.10 0.00 0.00 70.33 67.83 1n8q n THR 522 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1n8q h HIS 523 N 0.00 -1.77 -0.13 4.78 3.86 -1.55 -1.74 115.15 118.60 1n8q h HIS 523 Ca 0.00 0.11 -0.11 0.00 -1.16 0.00 0.00 60.37 59.21 1n8q h HIS 523 Cb 0.00 0.86 0.00 0.00 1.06 0.00 0.00 27.41 29.34 1n8q h HIS 523 CO 0.00 -0.42 -0.34 0.00 0.86 0.00 0.00 177.93 178.04 1n8q h ALA 524 N 0.21 0.22 -0.02 2.45 0.00 -1.08 -3.04 119.26 117.99 1n8q h ALA 524 Ca 0.12 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.47 1n8q h ALA 524 Cb 0.48 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1n8q h ALA 524 CO -0.76 0.27 -0.59 0.28 0.00 0.00 0.00 179.25 178.45 1n8q h VAL 525 N 0.06 1.42 -0.15 0.00 2.07 -1.45 -3.20 116.25 115.00 1n8q h VAL 525 Ca -0.00 -2.02 -0.20 0.00 0.82 0.00 0.00 66.70 65.30 1n8q h VAL 525 Cb 0.95 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1n8q h VAL 525 CO 0.07 0.58 -0.72 0.58 0.02 0.00 0.00 177.57 178.11 1n8q h VAL 526 N 0.05 1.31 -0.78 2.57 2.07 -1.33 -3.37 116.25 116.76 1n8q h VAL 526 Ca -0.01 -1.98 0.19 0.00 0.82 0.00 0.00 66.70 65.72 1n8q h VAL 526 Cb 1.06 1.97 -0.13 0.00 -1.52 0.00 0.00 31.29 32.67 1n8q h VAL 526 CO 0.08 0.62 0.11 -0.08 0.02 0.00 0.00 177.57 178.32 1n8q h GLU 527 N 0.46 0.17 0.00 1.57 4.81 -1.53 -1.28 114.58 118.78 1n8q h GLU 527 Ca -0.03 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1n8q h GLU 527 Cb 1.32 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.66 1n8q h GLU 527 CO 0.14 0.11 -0.05 -1.35 -0.73 0.00 0.00 179.01 177.13 1n8q h PRO 528 N 0.17 0.00 -0.15 0.92 0.11 -1.73 -1.37 132.00 129.96 1n8q h PRO 528 Ca 0.45 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.46 1n8q h PRO 528 Cb 0.83 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.92 1n8q h PRO 528 CO -0.63 0.05 -0.37 0.74 -0.21 0.00 0.00 178.00 177.59 1n8q h PHE 529 N 0.00 0.36 -0.38 0.65 0.04 -1.46 -0.02 116.94 116.14 1n8q h PHE 529 Ca -0.00 -0.09 -0.15 0.00 2.80 0.00 0.00 57.97 60.52 1n8q h PHE 529 Cb 0.12 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 1n8q h PHE 529 CO 0.00 0.64 -0.36 0.82 -0.60 0.00 0.00 178.31 178.81 1n8q h ILE 530 N 0.27 1.27 -0.00 -0.55 2.04 -1.14 -1.38 117.51 118.02 1n8q h ILE 530 Ca 0.03 -1.53 -0.00 0.00 1.00 0.00 0.00 64.86 64.35 1n8q h ILE 530 Cb 0.77 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1n8q h ILE 530 CO 0.06 0.51 -0.00 0.40 0.00 0.00 0.00 178.15 179.12 1n8q h ILE 531 N 0.73 1.37 -0.47 -0.67 2.04 -1.33 -2.47 117.51 116.72 1n8q h ILE 531 Ca 0.06 -1.10 0.05 0.00 1.00 0.00 0.00 64.86 64.87 1n8q h ILE 531 Cb 0.95 2.12 -0.05 0.00 -0.74 0.00 0.00 36.82 39.11 1n8q h ILE 531 CO 0.09 0.29 0.21 0.00 0.00 0.00 0.00 178.15 178.74 1n8q h ALA 532 N 0.53 0.59 -0.17 1.87 0.00 -1.01 -1.83 119.26 119.24 1n8q h ALA 532 Ca 0.00 0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1n8q h ALA 532 Cb 0.47 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1n8q h ALA 532 CO 0.00 -0.15 -0.11 1.15 0.00 0.00 0.00 179.25 180.13 1n8q h THR 533 N 0.42 0.66 -0.16 0.00 2.02 -1.24 -2.04 112.91 112.57 1n8q h THR 533 Ca 0.21 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.26 1n8q h THR 533 Cb 0.16 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1n8q h THR 533 CO -0.17 0.00 -0.46 0.78 0.37 0.00 0.00 175.52 176.04 1n8q h ASN 534 N -0.11 0.43 0.81 4.18 4.21 -1.35 0.18 115.58 123.92 1n8q h ASN 534 Ca 0.10 -0.20 -0.07 0.00 1.21 0.00 0.00 56.30 57.34 1n8q h ASN 534 Cb 0.26 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 1n8q h ASN 534 CO -0.24 0.83 -0.35 0.03 -1.29 0.00 0.00 177.43 176.41 1n8q h ARG 535 N 0.32 0.00 0.00 0.81 3.08 -1.19 -3.40 114.38 114.00 1n8q h ARG 535 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1n8q h ARG 535 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1n8q h ARG 535 CO 0.08 0.35 -0.41 0.72 -1.07 0.00 0.00 179.97 179.64 1n8q n HIS 536 N -3.55 0.00 -4.14 3.04 8.25 -0.78 -4.77 115.22 113.27 1n8q n HIS 536 Ca -0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.11 1n8q n HIS 536 Cb 0.48 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.46 1n8q n HIS 536 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1n8q s LEU 537 N -1.85 2.97 0.56 2.41 1.02 0.04 -4.62 118.68 119.22 1n8q s LEU 537 Ca 0.00 -0.32 -0.20 0.00 0.02 0.00 0.00 54.13 53.63 1n8q s LEU 537 Cb 0.00 -1.74 -0.04 0.00 0.02 0.00 0.00 46.19 44.43 1n8q s LEU 537 CO 0.00 0.05 1.25 -0.55 0.02 0.00 0.00 176.35 177.12 1n8q s SER 538 N 1.07 5.30 0.60 2.29 0.15 -1.26 -4.62 113.70 117.23 1n8q s SER 538 Ca 0.01 2.51 0.29 0.00 0.70 0.00 0.00 55.95 59.46 1n8q s SER 538 Cb -0.15 -2.61 1.40 0.00 -1.71 0.00 0.00 66.02 62.95 1n8q s SER 538 CO -0.00 -1.53 1.81 -0.37 1.20 0.00 0.00 173.24 174.35 1n8q h VAL 539 N 1.16 0.29 0.00 4.45 -1.51 -1.94 0.79 116.25 119.49 1n8q h VAL 539 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 1n8q h VAL 539 Cb 1.30 0.52 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1n8q h VAL 539 CO 0.56 0.00 -0.15 0.58 -1.23 0.00 0.00 177.57 177.33 1n8q h VAL 540 N 0.00 0.00 -3.71 7.19 2.07 -1.89 -3.41 116.25 116.50 1n8q h VAL 540 Ca 0.25 -0.98 -0.53 0.00 0.82 0.00 0.00 66.70 66.26 1n8q h VAL 540 Cb 1.43 1.90 0.07 0.00 -1.52 0.00 0.00 31.29 33.17 1n8q h VAL 540 CO -0.00 0.00 0.72 -2.28 0.02 0.00 0.00 177.57 176.03 1n8q s HIS 541 N -3.23 2.92 0.29 1.57 5.04 0.27 -2.07 115.29 120.08 1n8q s HIS 541 Ca 0.06 1.20 0.02 0.00 -1.54 0.00 0.00 55.06 54.81 1n8q s HIS 541 Cb 0.06 -3.82 0.59 0.00 0.04 0.00 0.00 32.58 29.45 1n8q s HIS 541 CO 0.68 -2.45 1.83 -1.35 -2.34 0.00 0.00 174.74 171.11 1n8q h PRO 542 N 3.90 0.93 -0.05 2.88 0.10 -1.88 -2.50 132.00 135.38 1n8q h PRO 542 Ca -0.48 -0.06 -0.18 0.00 0.10 0.00 0.00 66.00 65.38 1n8q h PRO 542 Cb 1.23 -0.21 -0.01 0.00 0.10 0.00 0.00 31.00 32.11 1n8q h PRO 542 CO 0.70 0.61 -0.77 0.82 0.10 0.00 0.00 178.00 179.47 1n8q h ILE 543 N 0.95 1.41 -0.31 4.15 1.08 -1.93 -1.71 117.51 121.15 1n8q h ILE 543 Ca 0.50 -2.26 0.06 0.00 -0.39 0.00 0.00 64.86 62.76 1n8q h ILE 543 Cb 0.54 2.21 -0.05 0.00 -3.07 0.00 0.00 36.82 36.45 1n8q h ILE 543 CO -0.27 0.67 -0.03 0.22 -0.69 0.00 0.00 178.15 178.06 1n8q h TYR 544 N 0.21 -0.06 -0.24 1.37 5.03 -1.72 -1.75 116.97 119.80 1n8q h TYR 544 Ca -0.03 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.22 1n8q h TYR 544 Cb 1.35 0.08 -0.01 0.00 1.55 0.00 0.00 36.73 39.69 1n8q h TYR 544 CO 0.04 -0.08 -0.20 0.87 -1.32 0.00 0.00 178.16 177.47 1n8q h LYS 545 N 0.06 0.42 -0.58 1.82 1.57 -1.26 0.11 116.57 118.72 1n8q h LYS 545 Ca 0.15 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1n8q h LYS 545 Cb 0.21 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1n8q h LYS 545 CO -0.27 0.61 0.26 1.25 -0.57 0.00 0.00 179.45 180.73 1n8q h LEU 546 N 0.38 0.77 0.04 2.94 5.85 -1.02 -3.34 115.31 120.92 1n8q h LEU 546 Ca 0.06 -0.14 -0.30 0.00 0.84 0.00 0.00 57.88 58.34 1n8q h LEU 546 Cb 0.57 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1n8q h LEU 546 CO 0.04 0.69 -1.66 -0.07 -0.34 0.00 0.00 178.44 177.10 1n8q h LEU 547 N 0.79 0.13 -0.70 2.25 4.07 -0.97 -3.41 115.31 117.48 1n8q h LEU 547 Ca 0.20 -0.25 0.15 0.00 0.08 0.00 0.00 57.88 58.06 1n8q h LEU 547 Cb 0.14 -0.04 -0.12 0.00 1.08 0.00 0.00 40.66 41.72 1n8q h LEU 547 CO -0.02 1.22 -0.02 -0.74 -1.08 0.00 0.00 178.44 177.79 1n8q h HIS 548 N 0.02 -0.09 0.00 1.13 2.76 -0.91 -1.52 115.15 116.54 1n8q h HIS 548 Ca -0.27 0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 57.93 1n8q h HIS 548 Cb 1.99 0.15 -0.00 0.00 1.55 0.00 0.00 27.41 31.10 1n8q h HIS 548 CO 0.02 -0.22 -0.07 -1.35 -1.30 0.00 0.00 177.93 175.01 1n8q h PRO 549 N 0.09 0.00 0.00 5.26 0.11 -1.80 -2.16 132.00 133.50 1n8q h PRO 549 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 1n8q h PRO 549 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 1n8q h PRO 549 CO -0.62 0.07 0.00 0.72 -0.21 0.00 0.00 178.00 177.96 1n8q n HIS 550 N -3.50 0.00 0.56 0.65 8.25 -0.57 -3.14 115.22 117.47 1n8q n HIS 550 Ca -0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.51 1n8q n HIS 550 Cb 0.20 -0.01 0.04 0.00 1.12 0.00 0.00 29.99 31.34 1n8q n HIS 550 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1n8q n TYR 551 N -1.01 0.00 -1.63 4.41 4.01 -0.81 -4.24 117.16 117.88 1n8q n TYR 551 Ca 0.20 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.50 1n8q n TYR 551 Cb 0.10 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.09 1n8q n TYR 551 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1n8q n ARG 552 N 0.57 2.30 -0.96 -0.72 0.63 -1.19 -2.36 116.66 114.93 1n8q n ARG 552 Ca 0.07 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 57.79 1n8q n ARG 552 Cb 0.32 -2.95 0.00 0.00 0.45 0.00 0.00 32.46 30.28 1n8q n ARG 552 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1n8q n ASP 553 N 8.74 -1.30 -0.15 6.15 2.03 -1.26 -4.23 116.55 126.53 1n8q n ASP 553 Ca 0.25 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.46 1n8q n ASP 553 Cb 0.38 -0.53 -0.01 0.00 -0.72 0.00 0.00 41.12 40.24 1n8q n ASP 553 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1n8q h THR 554 N 0.00 1.27 -0.09 5.18 2.02 -1.39 -1.56 112.91 118.34 1n8q h THR 554 Ca 0.00 -1.11 -0.06 0.00 0.77 0.00 0.00 66.41 66.01 1n8q h THR 554 Cb 0.05 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1n8q h THR 554 CO 0.00 0.38 -0.23 0.24 0.37 0.00 0.00 175.52 176.27 1n8q h MET 555 N 0.61 0.15 0.73 6.66 2.86 -1.85 -0.84 114.93 123.25 1n8q h MET 555 Ca 0.11 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1n8q h MET 555 Cb 0.55 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.20 1n8q h MET 555 CO 0.03 0.38 -0.35 -0.97 1.06 0.00 0.00 176.91 177.07 1n8q h ASN 556 N 0.14 -0.83 0.02 1.22 -0.00 -1.69 -0.34 115.58 114.10 1n8q h ASN 556 Ca 0.02 0.02 -0.09 0.00 -0.00 0.00 0.00 56.30 56.25 1n8q h ASN 556 Cb 0.50 0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 39.02 1n8q h ASN 556 CO 0.03 -0.56 -0.27 -0.29 -0.00 0.00 0.00 177.43 176.34 1n8q h ILE 557 N -1.03 1.27 -0.42 2.57 6.09 -1.19 -2.16 117.51 122.64 1n8q h ILE 557 Ca -0.10 -1.27 -0.07 0.00 -1.37 0.00 0.00 64.86 62.05 1n8q h ILE 557 Cb 0.76 1.41 -0.02 0.00 0.47 0.00 0.00 36.82 39.44 1n8q h ILE 557 CO 0.16 0.40 -0.05 0.78 -3.07 0.00 0.00 178.15 176.37 1n8q h ASN 558 N 0.36 0.67 0.05 2.19 4.21 -1.16 0.10 115.58 122.00 1n8q h ASN 558 Ca 0.05 -0.17 -0.15 0.00 1.21 0.00 0.00 56.30 57.24 1n8q h ASN 558 Cb 0.67 -0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 1n8q h ASN 558 CO 0.05 0.77 -0.51 1.23 -1.29 0.00 0.00 177.43 177.68 1n8q h GLY 559 N 0.95 0.56 1.16 2.83 0.00 -0.68 -1.52 103.07 106.38 1n8q h GLY 559 Ca 0.12 -0.62 -0.10 0.00 0.00 0.00 0.00 47.33 46.73 1n8q h GLY 559 CO 0.02 0.56 -0.04 -2.00 0.00 0.00 0.00 176.54 175.09 1n8q h LEU 560 N 0.40 0.99 -0.62 3.11 5.85 -1.10 -2.45 115.31 121.49 1n8q h LEU 560 Ca 0.02 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.49 1n8q h LEU 560 Cb 1.03 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 1n8q h LEU 560 CO 0.09 1.06 0.35 0.00 -0.34 0.00 0.00 178.44 179.61 1n8q h ALA 561 N 1.03 0.81 -0.49 1.25 0.00 -0.20 0.43 119.26 122.10 1n8q h ALA 561 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1n8q h ALA 561 Cb 0.58 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1n8q h ALA 561 CO 0.03 0.05 0.27 0.00 0.00 0.00 0.00 179.25 179.60 1n8q h ARG 562 N 0.67 0.67 0.16 0.00 3.08 -1.22 0.28 114.38 118.01 1n8q h ARG 562 Ca 0.26 -0.06 -0.31 0.00 0.07 0.00 0.00 59.98 59.94 1n8q h ARG 562 Cb 0.11 -0.14 0.03 0.00 0.08 0.00 0.00 29.97 30.05 1n8q h ARG 562 CO -0.15 0.49 -1.31 1.25 -1.07 0.00 0.00 179.97 179.19 1n8q h LEU 563 N 0.68 0.82 0.00 3.04 5.85 -0.78 -3.37 115.31 121.55 1n8q h LEU 563 Ca 0.17 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 58.10 1n8q h LEU 563 Cb 0.02 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.79 1n8q h LEU 563 CO -0.03 1.61 -0.39 -1.20 -0.34 0.00 0.00 178.44 178.09 1n8q n SER 564 N -3.74 1.93 -0.10 1.25 7.64 0.14 -4.79 113.62 115.96 1n8q n SER 564 Ca -0.14 -0.07 -0.18 0.00 1.01 0.00 0.00 58.87 59.49 1n8q n SER 564 Cb 1.02 0.53 -0.08 0.00 -1.01 0.00 0.00 64.21 64.67 1n8q n SER 564 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1n8q n LEU 565 N -0.73 2.20 -0.07 -3.43 4.32 0.79 -3.07 117.00 117.00 1n8q n LEU 565 Ca 0.00 0.08 0.01 0.00 -0.02 0.00 0.00 56.01 56.07 1n8q n LEU 565 Cb 0.00 -0.63 0.02 0.00 -1.62 0.00 0.00 43.42 41.18 1n8q n LEU 565 CO 0.00 0.62 0.48 0.55 -1.22 0.00 0.00 177.39 177.82 1n8q n VAL 566 N -3.49 0.87 -2.13 4.08 3.14 -0.13 -1.80 118.33 118.87 1n8q n VAL 566 Ca -0.37 -0.94 -0.27 0.00 -2.96 0.00 0.00 64.34 59.81 1n8q n VAL 566 Cb 0.82 0.57 0.08 0.00 -1.06 0.00 0.00 33.84 34.25 1n8q n VAL 566 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1n8q s ASN 567 N -0.89 4.60 0.25 6.55 4.22 -1.26 -4.89 114.94 123.52 1n8q s ASN 567 Ca 0.03 0.48 -0.04 0.00 -2.14 0.00 0.00 52.86 51.19 1n8q s ASN 567 Cb 0.01 -1.04 0.50 0.00 1.28 0.00 0.00 41.25 42.00 1n8q s ASN 567 CO 0.02 -1.76 1.70 -0.78 -2.04 0.00 0.00 177.10 174.23 1n8q h ASP 568 N -0.78 0.11 -0.64 3.54 3.58 -1.14 -0.66 116.42 120.43 1n8q h ASP 568 Ca -0.44 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.15 1n8q h ASP 568 Cb 1.31 0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.53 1n8q h ASP 568 CO 0.59 -0.00 0.00 0.61 -2.88 0.00 0.00 179.24 177.56 1n8q n GLY 569 N -1.35 2.65 0.99 -0.78 0.00 -1.26 -4.96 105.19 100.48 1n8q n GLY 569 Ca 0.15 -0.75 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 1n8q n GLY 569 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8q n GLY 570 N 1.29 -1.37 0.14 -0.02 0.00 -0.26 -4.71 105.19 100.28 1n8q n GLY 570 Ca 0.23 -1.66 -0.07 0.00 0.00 0.00 0.00 46.02 44.52 1n8q n GLY 570 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1n8q h VAL 571 N -1.27 0.91 -0.51 1.61 2.07 -1.52 -2.53 116.25 115.01 1n8q h VAL 571 Ca -0.11 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.21 1n8q h VAL 571 Cb 0.31 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1n8q h VAL 571 CO 0.08 0.04 -0.15 0.40 0.02 0.00 0.00 177.57 177.96 1n8q h ILE 572 N 0.25 1.27 -0.40 4.57 1.08 -1.66 -1.68 117.51 120.94 1n8q h ILE 572 Ca 0.14 -1.31 -0.05 0.00 -0.39 0.00 0.00 64.86 63.26 1n8q h ILE 572 Cb 0.12 1.04 -0.02 0.00 -3.07 0.00 0.00 36.82 34.89 1n8q h ILE 572 CO -0.15 0.46 0.04 -0.33 -0.69 0.00 0.00 178.15 177.47 1n8q h GLU 573 N 0.87 0.63 0.00 2.37 5.08 -1.74 -0.56 114.58 121.23 1n8q h GLU 573 Ca 0.13 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1n8q h GLU 573 Cb 0.72 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1n8q h GLU 573 CO 0.06 0.62 -0.34 1.96 -1.00 0.00 0.00 179.01 180.31 1n8q h GLN 574 N 0.60 0.00 0.00 2.33 4.20 -1.12 -3.39 115.11 117.73 1n8q h GLN 574 Ca 0.13 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.64 1n8q h GLN 574 Cb 0.33 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 1n8q h GLN 574 CO 0.01 0.00 -1.75 2.41 -0.67 0.00 0.00 178.83 178.83 1n8q n THR 575 N -2.48 0.75 -4.14 -0.54 -1.04 -0.66 -4.97 114.28 101.20 1n8q n THR 575 Ca 0.04 -0.44 -0.23 0.00 -2.04 0.00 0.00 64.05 61.38 1n8q n THR 575 Cb 0.47 -0.74 -0.06 0.00 -1.82 0.00 0.00 70.33 68.18 1n8q n THR 575 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1n8q s PHE 576 N -2.26 2.74 0.22 -1.42 0.08 -0.26 -4.29 117.98 112.79 1n8q s PHE 576 Ca -0.07 -0.32 -0.08 0.00 0.12 0.00 0.00 56.93 56.58 1n8q s PHE 576 Cb 0.03 -1.52 0.27 0.00 -0.57 0.00 0.00 43.02 41.23 1n8q s PHE 576 CO 0.43 0.41 1.82 1.25 -0.10 0.00 0.00 175.22 179.03 1n8q h LEU 577 N 1.61 0.64 -0.45 -0.37 5.85 -1.56 -2.19 115.31 118.84 1n8q h LEU 577 Ca -0.44 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.31 1n8q h LEU 577 Cb 1.25 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.18 1n8q h LEU 577 CO 0.62 0.41 0.00 0.79 -0.34 0.00 0.00 178.44 179.92 1n8q n TRP 578 N -4.74 0.87 0.00 1.25 8.01 -1.26 -4.92 117.44 116.65 1n8q n TRP 578 Ca 0.10 0.31 0.00 0.00 -1.31 0.00 0.00 57.50 56.59 1n8q n TRP 578 Cb 0.18 -0.99 0.00 0.00 -2.01 0.00 0.00 31.31 28.48 1n8q n TRP 578 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1n8q n GLY 579 N 0.48 2.34 0.00 6.99 0.00 -0.83 -1.35 105.19 112.83 1n8q n GLY 579 Ca 0.03 -0.33 0.10 0.00 0.00 0.00 0.00 46.02 45.83 1n8q n GLY 579 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1n8q n ARG 580 N 13.20 0.07 -0.06 1.61 1.85 -1.26 -2.20 116.66 129.87 1n8q n ARG 580 Ca 0.00 0.13 0.12 0.00 -1.00 0.00 0.00 57.85 57.10 1n8q n ARG 580 Cb 0.00 -1.50 0.17 0.00 -1.05 0.00 0.00 32.46 30.08 1n8q n ARG 580 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1n8q n TYR 581 N -1.45 0.16 -0.01 2.89 4.01 -0.46 -4.70 117.16 117.60 1n8q n TYR 581 Ca 0.06 -0.08 -0.10 0.00 -0.16 0.00 0.00 57.90 57.62 1n8q n TYR 581 Cb 0.23 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.23 1n8q n TYR 581 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1n8q h SER 582 N 4.43 -0.88 -0.08 7.72 0.02 -1.41 -1.55 113.55 121.80 1n8q h SER 582 Ca 0.00 0.14 -0.17 0.00 -0.84 0.00 0.00 61.79 60.92 1n8q h SER 582 Cb 0.95 0.39 0.01 0.00 0.14 0.00 0.00 62.40 63.89 1n8q h SER 582 CO 0.00 -0.32 -0.61 0.58 -1.14 0.00 0.00 176.83 175.34 1n8q h VAL 583 N -0.34 1.36 -0.15 2.27 2.07 -1.85 -2.79 116.25 116.82 1n8q h VAL 583 Ca 0.11 -1.93 -0.03 0.00 0.82 0.00 0.00 66.70 65.67 1n8q h VAL 583 Cb 0.50 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 1n8q h VAL 583 CO -0.35 0.58 -0.05 1.05 0.02 0.00 0.00 177.57 178.82 1n8q h GLU 584 N 0.17 0.22 -0.13 1.57 4.11 -1.87 -0.92 114.58 117.72 1n8q h GLU 584 Ca -0.05 -0.04 -0.10 0.00 0.07 0.00 0.00 59.36 59.24 1n8q h GLU 584 Cb 1.26 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1n8q h GLU 584 CO 0.12 0.29 -0.36 0.52 0.07 0.00 0.00 179.01 179.65 1n8q h MET 585 N 0.21 0.28 0.00 1.06 2.86 -1.23 -1.17 114.93 116.94 1n8q h MET 585 Ca 0.05 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 1n8q h MET 585 Cb 0.24 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1n8q h MET 585 CO 0.01 0.61 -0.37 0.66 1.06 0.00 0.00 176.91 178.87 1n8q h SER 586 N 0.24 0.00 -0.23 1.22 4.64 -0.91 -2.18 113.55 116.32 1n8q h SER 586 Ca 0.03 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.24 1n8q h SER 586 Cb 0.75 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.83 1n8q h SER 586 CO 0.06 0.37 -0.22 0.00 -0.87 0.00 0.00 176.83 176.17 1n8q h ALA 587 N 1.63 0.95 -0.91 5.18 0.00 -0.51 -1.28 119.26 124.31 1n8q h ALA 587 Ca -0.00 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.57 1n8q h ALA 587 Cb 0.99 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1n8q h ALA 587 CO 0.05 0.61 0.59 0.28 0.00 0.00 0.00 179.25 180.78 1n8q h VAL 588 N 0.61 1.18 -0.14 0.00 2.07 -0.84 -2.83 116.25 116.30 1n8q h VAL 588 Ca 0.09 -0.40 -0.15 0.00 0.82 0.00 0.00 66.70 67.06 1n8q h VAL 588 Cb 0.70 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1n8q h VAL 588 CO 0.05 0.21 -0.55 0.58 0.02 0.00 0.00 177.57 177.88 1n8q h VAL 589 N 1.17 1.34 -0.47 2.57 2.07 -1.27 -2.29 116.25 119.38 1n8q h VAL 589 Ca 0.35 -1.83 0.14 0.00 0.82 0.00 0.00 66.70 66.18 1n8q h VAL 589 Cb -0.04 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1n8q h VAL 589 CO -0.11 0.56 0.36 0.22 0.02 0.00 0.00 177.57 178.62 1n8q h TYR 590 N 0.32 0.00 -1.08 1.57 3.20 -1.00 0.23 116.97 120.21 1n8q h TYR 590 Ca 0.00 0.00 0.29 0.00 3.14 0.00 0.00 58.73 62.17 1n8q h TYR 590 Cb 1.07 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 39.26 1n8q h TYR 590 CO 0.03 0.00 0.73 0.87 -1.64 0.00 0.00 178.16 178.15 1n8q h LYS 591 N 0.00 0.24 -0.09 1.82 1.57 -1.22 -1.12 116.57 117.77 1n8q h LYS 591 Ca 0.23 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1n8q h LYS 591 Cb 0.95 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1n8q h LYS 591 CO -0.00 0.16 0.00 -0.25 -0.57 0.00 0.00 179.45 178.78 1n8q n ASP 592 N -4.47 2.77 -4.69 0.86 8.00 0.07 -4.94 116.55 114.14 1n8q n ASP 592 Ca 0.25 -1.90 -0.42 0.00 0.71 0.00 0.00 54.79 53.43 1n8q n ASP 592 Cb 1.00 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 42.03 1n8q n ASP 592 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1n8q s TRP 593 N -1.91 2.75 -0.09 1.24 -0.00 -0.42 -5.02 118.94 115.48 1n8q s TRP 593 Ca 0.32 0.67 0.02 0.00 -0.00 0.00 0.00 56.10 57.10 1n8q s TRP 593 Cb 0.21 -3.77 0.01 0.00 -0.00 0.00 0.00 33.47 29.92 1n8q s TRP 593 CO 0.31 -2.91 -0.15 0.14 -0.00 0.00 0.00 176.95 174.34 1n8q s VAL 594 N 2.35 1.39 0.18 5.86 -7.23 -1.26 -5.06 120.40 116.63 1n8q s VAL 594 Ca 0.67 -0.60 -0.17 0.00 -1.81 0.00 0.00 61.98 60.07 1n8q s VAL 594 Cb -0.35 -1.26 0.14 0.00 0.56 0.00 0.00 36.38 35.46 1n8q s VAL 594 CO 0.29 0.42 1.64 0.15 -0.31 0.00 0.00 175.10 177.28 1n8q h PHE 595 N 7.21 -0.43 0.00 2.82 3.57 -1.95 -1.95 116.94 126.22 1n8q h PHE 595 Ca -0.30 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.25 1n8q h PHE 595 Cb 1.18 0.26 0.00 0.00 2.79 0.00 0.00 35.95 40.18 1n8q h PHE 595 CO 0.48 -0.26 0.00 1.79 -2.23 0.00 0.00 178.31 178.09 1n8q h THR 596 N -0.07 0.00 0.00 4.41 1.35 -1.97 -2.28 112.91 114.35 1n8q h THR 596 Ca 0.23 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1n8q h THR 596 Cb 0.42 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 1n8q h THR 596 CO -0.52 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.22 1n8q n ASP 597 N -2.78 0.00 0.15 5.36 8.00 -0.73 -3.23 116.55 123.32 1n8q n ASP 597 Ca 0.02 -0.05 0.12 0.00 0.71 0.00 0.00 54.79 55.59 1n8q n ASP 597 Cb 0.33 -0.30 0.21 0.00 -0.02 0.00 0.00 41.12 41.34 1n8q n ASP 597 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1n8q h GLN 598 N 0.00 0.00 -6.53 -1.24 1.08 -1.41 -3.08 115.11 103.93 1n8q h GLN 598 Ca 0.00 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.63 1n8q h GLN 598 Cb 0.26 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 27.75 1n8q h GLN 598 CO 0.00 0.00 0.89 0.00 -0.95 0.00 0.00 178.83 178.77 1n8q n ALA 599 N -1.99 1.74 -0.18 3.87 0.00 -1.20 -4.84 120.51 117.91 1n8q n ALA 599 Ca 0.04 0.42 -0.01 0.00 0.00 0.00 0.00 53.44 53.89 1n8q n ALA 599 Cb 0.49 -2.42 0.08 0.00 0.00 0.00 0.00 19.45 17.60 1n8q n ALA 599 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1n8q h LEU 600 N 6.50 -0.25 -0.96 0.00 5.85 -1.92 -1.45 115.31 123.09 1n8q h LEU 600 Ca -0.45 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 1n8q h LEU 600 Cb 1.24 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.47 1n8q h LEU 600 CO 0.91 -0.09 0.40 -0.65 -0.34 0.00 0.00 178.44 178.67 1n8q h PRO 601 N 0.11 1.14 -0.58 5.25 0.11 -1.94 -1.78 132.00 134.31 1n8q h PRO 601 Ca 0.28 -0.15 -0.04 0.00 0.11 0.00 0.00 66.00 66.20 1n8q h PRO 601 Cb 0.44 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 1n8q h PRO 601 CO -0.47 0.86 0.20 0.00 -0.21 0.00 0.00 178.00 178.39 1n8q h ALA 602 N 1.30 0.75 -0.17 -0.75 0.00 -1.74 -2.07 119.26 116.58 1n8q h ALA 602 Ca 0.28 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1n8q h ALA 602 Cb 0.09 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1n8q h ALA 602 CO -0.04 0.39 0.05 0.22 0.00 0.00 0.00 179.25 179.88 1n8q h ASP 603 N 0.80 0.06 -0.73 0.00 3.58 -0.95 -0.65 116.42 118.54 1n8q h ASP 603 Ca 0.19 0.02 0.04 0.00 0.42 0.00 0.00 57.03 57.70 1n8q h ASP 603 Cb 0.25 0.01 -0.05 0.00 1.72 0.00 0.00 39.33 41.26 1n8q h ASP 603 CO -0.01 0.06 0.45 -0.07 -2.88 0.00 0.00 179.24 176.79 1n8q h LEU 604 N 0.14 0.72 -0.16 2.28 4.07 -1.15 -2.04 115.31 119.17 1n8q h LEU 604 Ca 0.07 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 58.01 1n8q h LEU 604 Cb 0.05 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.64 1n8q h LEU 604 CO -0.08 0.49 -0.03 0.40 -1.08 0.00 0.00 178.44 178.14 1n8q h ILE 605 N 0.86 1.28 -0.79 1.22 2.04 -1.24 0.22 117.51 121.11 1n8q h ILE 605 Ca 0.30 -0.97 0.10 0.00 1.00 0.00 0.00 64.86 65.29 1n8q h ILE 605 Cb 0.07 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.70 1n8q h ILE 605 CO -0.13 0.29 0.51 0.50 0.00 0.00 0.00 178.15 179.32 1n8q h LYS 606 N 0.01 0.69 -0.23 2.37 3.64 -0.89 0.11 116.57 122.27 1n8q h LYS 606 Ca 0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1n8q h LYS 606 Cb 0.46 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1n8q h LYS 606 CO 0.01 0.46 0.00 0.54 -2.27 0.00 0.00 179.45 178.19 1n8q n ARG 607 N -4.50 1.87 -1.18 1.90 1.74 -0.79 -4.90 116.66 110.80 1n8q n ARG 607 Ca 0.13 -1.32 -0.06 0.00 -0.77 0.00 0.00 57.85 55.83 1n8q n ARG 607 Cb 0.33 -1.40 -0.03 0.00 -1.02 0.00 0.00 32.46 30.34 1n8q n ARG 607 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n8q n GLY 608 N 1.19 0.82 0.15 -0.13 0.00 0.38 -0.76 105.19 106.84 1n8q n GLY 608 Ca 0.16 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.89 1n8q n GLY 608 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n8q n MET 609 N -2.24 0.47 -3.92 1.61 2.00 0.73 -4.46 117.12 111.30 1n8q n MET 609 Ca -0.06 -0.30 -0.08 0.00 0.00 0.00 0.00 57.70 57.26 1n8q n MET 609 Cb 0.28 -1.49 -0.08 0.00 0.00 0.00 0.00 33.22 31.92 1n8q n MET 609 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1n8q s ALA 610 N -2.74 -0.03 0.18 3.04 0.00 -0.91 -2.31 121.76 119.00 1n8q s ALA 610 Ca 0.17 -0.78 0.07 0.00 0.00 0.00 0.00 51.96 51.43 1n8q s ALA 610 Cb 0.18 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.70 1n8q s ALA 610 CO 0.62 -0.47 -0.15 0.96 0.00 0.00 0.00 175.76 176.72 1n8q s ILE 611 N -3.88 1.64 0.23 0.00 -4.36 0.30 -4.35 121.20 110.79 1n8q s ILE 611 Ca 0.06 -2.04 -0.30 0.00 -0.26 0.00 0.00 60.65 58.10 1n8q s ILE 611 Cb 0.06 -1.89 -0.09 0.00 1.25 0.00 0.00 42.46 41.78 1n8q s ILE 611 CO -0.11 -0.51 1.37 -1.61 0.24 0.00 0.00 174.94 174.33 1n8q s GLU 612 N -3.28 4.33 -0.30 0.37 0.41 -1.26 -0.21 118.70 118.76 1n8q s GLU 612 Ca 0.18 2.18 -0.06 0.00 -0.41 0.00 0.00 54.97 56.87 1n8q s GLU 612 Cb -0.02 -3.15 0.19 0.00 -1.78 0.00 0.00 34.13 29.37 1n8q s GLU 612 CO 0.06 -0.33 0.83 0.34 -0.49 0.00 0.00 175.26 175.67 1n8q s ASP 613 N 0.29 -0.94 0.53 -0.19 3.68 -1.00 -4.76 116.67 114.28 1n8q s ASP 613 Ca 0.57 0.38 0.28 0.00 2.13 0.00 0.00 52.55 55.92 1n8q s ASP 613 Cb -0.39 1.71 1.46 0.00 -1.45 0.00 0.00 42.92 44.24 1n8q s ASP 613 CO 0.41 -0.17 2.07 1.55 0.13 0.00 0.00 175.17 179.16 1n8q h PRO 614 N 7.85 0.00 0.00 4.34 0.13 -1.95 -2.95 132.00 139.42 1n8q h PRO 614 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 1n8q h PRO 614 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1n8q h PRO 614 CO 0.05 0.11 -0.03 -1.13 -0.23 0.00 0.00 178.00 176.77 1n8q n SER 615 N -3.57 0.07 -4.82 1.44 3.41 -1.26 -4.73 113.62 104.16 1n8q n SER 615 Ca -0.02 0.46 -0.35 0.00 -0.26 0.00 0.00 58.87 58.70 1n8q n SER 615 Cb 0.24 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.66 1n8q n SER 615 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n8q n PRO 617 N 0.49 -0.07 -0.68 0.00 -0.02 -1.26 -1.24 135.00 132.21 1n8q n PRO 617 Ca -0.01 1.29 -0.00 0.00 -2.02 0.00 0.00 63.50 62.76 1n8q n PRO 617 Cb 0.52 -1.94 0.22 0.00 -0.02 0.00 0.00 33.50 32.28 1n8q n PRO 617 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1n8q n HIS 618 N -5.33 1.16 -0.97 6.00 8.25 -1.26 -4.93 115.22 118.14 1n8q n HIS 618 Ca 0.14 -1.31 0.00 0.00 -0.26 0.00 0.00 57.72 56.29 1n8q n HIS 618 Cb 0.44 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.10 1n8q n HIS 618 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n8q n GLY 619 N -0.87 0.85 3.22 -1.41 0.00 -0.37 -5.00 105.19 101.62 1n8q n GLY 619 Ca 0.30 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.15 1n8q n GLY 619 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1n8q s ILE 620 N -3.50 1.19 -0.10 -0.61 -4.36 -1.23 -2.37 121.20 110.23 1n8q s ILE 620 Ca 0.00 -1.70 0.00 0.00 -0.26 0.00 0.00 60.65 58.69 1n8q s ILE 620 Cb 0.00 -1.48 -0.02 0.00 1.25 0.00 0.00 42.46 42.21 1n8q s ILE 620 CO 0.00 -0.47 -0.09 -0.60 0.24 0.00 0.00 174.94 174.01 1n8q s ARG 621 N -2.74 3.07 -0.34 0.37 3.52 0.70 -4.71 118.95 118.83 1n8q s ARG 621 Ca 0.08 -0.61 -0.18 0.00 -0.13 0.00 0.00 55.73 54.90 1n8q s ARG 621 Cb -0.04 -2.63 -0.01 0.00 -1.56 0.00 0.00 34.95 30.71 1n8q s ARG 621 CO 0.02 0.44 0.49 -0.51 -0.81 0.00 0.00 175.30 174.93 1n8q s LEU 622 N -0.23 4.32 -0.00 -0.88 1.43 -1.26 -0.54 118.68 121.53 1n8q s LEU 622 Ca 0.02 0.00 -0.30 0.00 -1.03 0.00 0.00 54.13 52.82 1n8q s LEU 622 Cb -0.13 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.49 1n8q s LEU 622 CO 0.03 -0.43 1.27 -0.69 0.23 0.00 0.00 176.35 176.75 1n8q s VAL 623 N 2.32 3.99 -0.15 -1.59 1.01 -0.98 -3.99 120.40 121.02 1n8q s VAL 623 Ca 0.18 1.38 -0.06 0.00 0.00 0.00 0.00 61.98 63.47 1n8q s VAL 623 Cb -0.16 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.36 1n8q s VAL 623 CO 0.13 0.03 0.13 -0.38 0.00 0.00 0.00 175.10 175.01 1n8q n ILE 624 N 4.41 -9.66 -0.03 2.22 5.41 -1.26 -4.68 119.36 115.77 1n8q n ILE 624 Ca 0.11 1.77 -0.15 0.00 1.00 0.00 0.00 62.75 65.48 1n8q n ILE 624 Cb 0.45 -5.75 -0.10 0.00 -0.71 0.00 0.00 39.64 33.54 1n8q n ILE 624 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1n8q h GLU 625 N 2.63 0.28 -3.83 0.38 4.81 -1.95 -3.35 114.58 113.56 1n8q h GLU 625 Ca -0.29 -0.23 -0.74 0.00 -0.13 0.00 0.00 59.36 57.97 1n8q h GLU 625 Cb 0.65 0.05 -0.11 0.00 0.63 0.00 0.00 28.75 29.97 1n8q h GLU 625 CO 0.02 0.88 2.41 -3.47 -0.73 0.00 0.00 179.01 178.12 1n8q n ASP 626 N -4.48 4.64 -3.98 1.04 -0.08 -1.26 -4.82 116.55 107.62 1n8q n ASP 626 Ca -0.08 -3.00 -0.31 0.00 -1.51 0.00 0.00 54.79 49.89 1n8q n ASP 626 Cb 0.48 -1.56 -0.14 0.00 2.34 0.00 0.00 41.12 42.24 1n8q n ASP 626 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1n8q s TYR 627 N 1.61 3.37 0.19 -0.67 6.14 -1.26 -4.75 117.35 121.99 1n8q s TYR 627 Ca 0.43 -3.10 -0.12 0.00 0.64 0.00 0.00 57.07 54.92 1n8q s TYR 627 Cb 0.10 -2.87 0.13 0.00 0.42 0.00 0.00 41.96 39.74 1n8q s TYR 627 CO -0.03 -0.81 1.85 -1.35 0.64 0.00 0.00 175.55 175.86 1n8q h PRO 628 N 6.87 0.82 -0.82 4.97 0.11 -1.88 -1.02 132.00 141.05 1n8q h PRO 628 Ca -0.07 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 66.06 1n8q h PRO 628 Cb 0.93 -0.19 -0.06 0.00 0.11 0.00 0.00 31.00 31.79 1n8q h PRO 628 CO 0.64 0.54 0.50 -0.92 -0.21 0.00 0.00 178.00 178.55 1n8q h TYR 629 N 0.85 0.92 0.12 0.65 3.20 -1.90 -1.52 116.97 119.28 1n8q h TYR 629 Ca 0.24 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.89 1n8q h TYR 629 Cb -0.07 -0.29 0.03 0.00 1.54 0.00 0.00 36.73 37.94 1n8q h TYR 629 CO -0.03 0.44 -1.08 1.15 -1.64 0.00 0.00 178.16 177.00 1n8q h THR 630 N 0.89 1.35 -0.21 1.81 2.02 -1.58 0.66 112.91 117.85 1n8q h THR 630 Ca 0.37 -2.44 -0.15 0.00 0.77 0.00 0.00 66.41 64.96 1n8q h THR 630 Cb 0.22 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.46 1n8q h THR 630 CO -0.19 0.72 -0.44 0.58 0.37 0.00 0.00 175.52 176.56 1n8q h VAL 631 N 0.06 1.32 -0.17 3.16 2.07 -1.13 -0.93 116.25 120.63 1n8q h VAL 631 Ca -0.17 -1.67 -0.06 0.00 0.82 0.00 0.00 66.70 65.62 1n8q h VAL 631 Cb 1.79 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 33.39 1n8q h VAL 631 CO 0.21 0.52 -0.15 0.44 0.02 0.00 0.00 177.57 178.61 1n8q h ASP 632 N 0.37 0.42 -0.65 0.57 5.19 -1.37 -3.25 116.42 117.70 1n8q h ASP 632 Ca 0.00 -0.47 0.03 0.00 -0.62 0.00 0.00 57.03 55.98 1n8q h ASP 632 Cb 1.05 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 40.40 1n8q h ASP 632 CO 0.10 0.80 0.43 1.23 -3.12 0.00 0.00 179.24 178.68 1n8q h GLY 633 N 0.05 0.89 1.57 2.75 0.00 -0.79 -2.63 103.07 104.90 1n8q h GLY 633 Ca 0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 1n8q h GLY 633 CO 0.04 0.27 0.25 1.41 0.00 0.00 0.00 176.54 178.51 1n8q h LEU 634 N 0.79 0.51 -0.39 3.11 4.07 -1.20 0.30 115.31 122.50 1n8q h LEU 634 Ca 0.26 -0.03 -0.06 0.00 0.08 0.00 0.00 57.88 58.13 1n8q h LEU 634 Cb 0.06 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.65 1n8q h LEU 634 CO -0.07 0.40 0.00 -0.33 -1.08 0.00 0.00 178.44 177.36 1n8q h GLU 635 N 0.59 0.68 -0.12 1.13 4.39 -1.53 -2.47 114.58 117.25 1n8q h GLU 635 Ca 0.15 -0.22 -0.19 0.00 0.34 0.00 0.00 59.36 59.45 1n8q h GLU 635 Cb -0.01 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1n8q h GLU 635 CO -0.03 0.78 -0.71 0.82 -1.16 0.00 0.00 179.01 178.72 1n8q h ILE 636 N 0.51 1.34 -0.23 3.13 2.04 -1.34 -1.33 117.51 121.63 1n8q h ILE 636 Ca 0.11 -2.02 0.00 0.00 1.00 0.00 0.00 64.86 63.95 1n8q h ILE 636 Cb 0.47 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.54 1n8q h ILE 636 CO 0.02 0.62 0.14 -0.25 0.00 0.00 0.00 178.15 178.69 1n8q h TRP 637 N 0.38 0.29 -0.72 1.37 2.91 -0.42 -1.22 115.95 118.55 1n8q h TRP 637 Ca -0.03 0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.94 1n8q h TRP 637 Cb 1.29 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 29.81 1n8q h TRP 637 CO 0.06 0.20 0.23 -0.44 -1.03 0.00 0.00 178.44 177.46 1n8q h ASP 638 N 0.30 1.05 -0.46 2.65 5.19 -1.41 0.23 116.42 123.96 1n8q h ASP 638 Ca 0.08 -0.21 -0.01 0.00 -0.62 0.00 0.00 57.03 56.27 1n8q h ASP 638 Cb -0.01 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.20 1n8q h ASP 638 CO -0.02 0.98 0.23 0.00 -3.12 0.00 0.00 179.24 177.31 1n8q h ALA 639 N 1.11 0.59 0.20 3.45 0.00 -0.97 -1.62 119.26 122.01 1n8q h ALA 639 Ca 0.23 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1n8q h ALA 639 Cb 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1n8q h ALA 639 CO -0.01 0.13 -0.13 0.82 0.00 0.00 0.00 179.25 180.06 1n8q h ILE 640 N 0.60 0.72 -0.46 0.00 2.04 -1.05 -2.24 117.51 117.11 1n8q h ILE 640 Ca 0.16 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.07 1n8q h ILE 640 Cb 0.09 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 1n8q h ILE 640 CO -0.02 0.00 0.20 0.50 0.00 0.00 0.00 178.15 178.83 1n8q h LYS 641 N -0.32 0.39 -0.02 2.37 1.63 -0.87 -0.05 116.57 119.69 1n8q h LYS 641 Ca -0.02 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1n8q h LYS 641 Cb 0.28 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 31.82 1n8q h LYS 641 CO 0.01 0.26 0.01 1.15 -3.45 0.00 0.00 179.45 177.43 1n8q h THR 642 N 0.40 1.07 -0.19 1.00 2.02 -1.30 0.58 112.91 116.49 1n8q h THR 642 Ca 0.21 -0.22 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1n8q h THR 642 Cb 0.17 1.19 -0.07 0.00 -1.74 0.00 0.00 68.15 67.70 1n8q h THR 642 CO -0.18 0.06 -0.32 -0.25 0.37 0.00 0.00 175.52 175.20 1n8q h TRP 643 N -0.06 -0.87 -0.70 3.16 -0.00 -1.05 -1.06 115.95 115.37 1n8q h TRP 643 Ca 0.01 0.04 -0.03 0.00 -0.00 0.00 0.00 58.89 58.91 1n8q h TRP 643 Cb 0.09 0.41 -0.03 0.00 -0.00 0.00 0.00 29.16 29.63 1n8q h TRP 643 CO -0.05 -0.39 0.33 0.28 -0.00 0.00 0.00 178.44 178.61 1n8q h VAL 644 N -0.36 1.23 -0.38 2.65 2.07 -0.87 -1.10 116.25 119.50 1n8q h VAL 644 Ca 0.11 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 66.97 1n8q h VAL 644 Cb 0.54 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1n8q h VAL 644 CO -0.39 0.28 0.23 -0.74 0.02 0.00 0.00 177.57 176.98 1n8q h HIS 645 N 0.98 0.44 -0.56 1.57 -0.00 -0.69 -1.13 115.15 115.76 1n8q h HIS 645 Ca 0.24 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.60 1n8q h HIS 645 Cb 0.14 -0.15 -0.03 0.00 -0.00 0.00 0.00 27.41 27.37 1n8q h HIS 645 CO 0.01 0.27 0.26 0.93 -0.00 0.00 0.00 177.93 179.39 1n8q h GLU 646 N 0.48 0.82 0.67 5.26 5.08 -1.00 -1.73 114.58 124.16 1n8q h GLU 646 Ca 0.14 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1n8q h GLU 646 Cb -0.02 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.09 1n8q h GLU 646 CO -0.05 0.68 -0.32 -0.92 -1.00 0.00 0.00 179.01 177.40 1n8q h TYR 647 N 0.76 -0.83 -0.74 4.33 5.03 -1.06 -2.07 116.97 122.38 1n8q h TYR 647 Ca 0.19 -0.02 0.16 0.00 2.58 0.00 0.00 58.73 61.64 1n8q h TYR 647 Cb 0.14 0.27 -0.11 0.00 1.55 0.00 0.00 36.73 38.59 1n8q h TYR 647 CO 0.00 -0.48 0.22 0.28 -1.32 0.00 0.00 178.16 176.85 1n8q h VAL 648 N -1.03 0.55 0.00 1.81 2.07 -1.24 -1.81 116.25 116.60 1n8q h VAL 648 Ca -0.09 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1n8q h VAL 648 Cb 0.72 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1n8q h VAL 648 CO 0.15 0.06 0.00 0.49 0.02 0.00 0.00 177.57 178.29 1n8q n PHE 649 N -5.11 0.52 0.18 1.57 3.01 -0.65 -1.52 117.46 115.45 1n8q n PHE 649 Ca 0.14 0.16 0.04 0.00 1.01 0.00 0.00 57.45 58.80 1n8q n PHE 649 Cb 0.45 -0.76 0.44 0.00 -0.01 0.00 0.00 39.48 39.60 1n8q n PHE 649 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1n8q h LEU 650 N 0.00 0.09 0.00 4.37 4.07 -0.59 -3.37 115.31 119.88 1n8q h LEU 650 Ca 0.00 -0.02 -0.24 0.00 0.08 0.00 0.00 57.88 57.70 1n8q h LEU 650 Cb 0.57 -0.02 -0.05 0.00 1.08 0.00 0.00 40.66 42.25 1n8q h LEU 650 CO 0.00 0.29 -1.92 -1.22 -1.08 0.00 0.00 178.44 174.51 1n8q n TYR 651 N -4.27 0.00 -3.59 1.13 4.01 -0.58 -4.89 117.16 108.96 1n8q n TYR 651 Ca -0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.32 1n8q n TYR 651 Cb 0.28 -0.65 -0.11 0.00 -0.31 0.00 0.00 39.34 38.54 1n8q n TYR 651 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1n8q s TYR 652 N -2.32 3.24 0.36 -0.72 2.02 -0.90 -4.95 117.35 114.07 1n8q s TYR 652 Ca -0.10 -0.88 0.25 0.00 -0.37 0.00 0.00 57.07 55.97 1n8q s TYR 652 Cb 0.04 -2.44 1.26 0.00 -0.40 0.00 0.00 41.96 40.42 1n8q s TYR 652 CO 0.51 -0.62 2.00 0.87 -1.57 0.00 0.00 175.55 176.74 1n8q h LYS 653 N 8.44 0.00 -3.01 -0.62 1.57 -1.90 -3.45 116.57 117.60 1n8q h LYS 653 Ca -0.26 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.55 1n8q h LYS 653 Cb 1.11 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.39 1n8q h LYS 653 CO 0.67 0.17 0.24 -1.54 -0.57 0.00 0.00 179.45 178.41 1n8q s SER 654 N -6.26 -0.16 0.38 0.86 1.04 -1.26 -5.03 113.70 103.27 1n8q s SER 654 Ca -0.02 -0.80 0.14 0.00 0.48 0.00 0.00 55.95 55.75 1n8q s SER 654 Cb 0.13 0.77 0.78 0.00 0.10 0.00 0.00 66.02 67.79 1n8q s SER 654 CO 0.61 -1.46 1.85 0.44 0.98 0.00 0.00 173.24 175.66 1n8q h ASP 655 N 2.00 0.00 -0.62 7.02 3.32 -1.90 -3.06 116.42 123.18 1n8q h ASP 655 Ca -0.24 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.80 1n8q h ASP 655 Cb 1.25 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 1n8q h ASP 655 CO 0.29 0.34 0.32 0.44 -1.72 0.00 0.00 179.24 178.92 1n8q h ASP 656 N 0.00 0.81 0.02 6.45 3.32 -1.96 -1.96 116.42 123.10 1n8q h ASP 656 Ca -0.00 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 56.91 1n8q h ASP 656 Cb 0.62 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1n8q h ASP 656 CO 0.04 0.67 -0.16 0.74 -1.72 0.00 0.00 179.24 178.82 1n8q h THR 657 N 0.90 1.20 0.12 0.35 2.02 -1.93 -0.00 112.91 115.57 1n8q h THR 657 Ca 0.23 -0.91 -0.29 0.00 0.77 0.00 0.00 66.41 66.21 1n8q h THR 657 Cb 0.07 1.26 0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1n8q h THR 657 CO -0.03 0.28 -1.23 0.25 0.37 0.00 0.00 175.52 175.16 1n8q h LEU 658 N 0.26 0.71 -1.73 2.58 6.46 -1.51 -2.71 115.31 119.37 1n8q h LEU 658 Ca 0.05 -0.68 -0.03 0.00 -0.12 0.00 0.00 57.88 57.10 1n8q h LEU 658 Cb 0.44 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.14 1n8q h LEU 658 CO 0.03 1.50 -0.13 0.03 -0.62 0.00 0.00 178.44 179.25 1n8q h ARG 659 N 0.20 0.00 0.00 1.25 3.08 -0.69 -2.76 114.38 115.46 1n8q h ARG 659 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1n8q h ARG 659 Cb 1.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.96 1n8q h ARG 659 CO 0.22 0.13 -0.74 1.49 -1.07 0.00 0.00 179.97 180.00 1n8q h GLU 660 N 0.00 0.00 -6.45 0.04 4.81 -0.93 -3.46 114.58 108.59 1n8q h GLU 660 Ca -0.00 0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.66 1n8q h GLU 660 Cb 0.44 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.77 1n8q h GLU 660 CO 0.02 0.00 1.13 0.34 -0.73 0.00 0.00 179.01 179.76 1n8q s ASP 661 N -4.95 6.18 0.26 1.04 -1.08 -1.03 -4.88 116.67 112.21 1n8q s ASP 661 Ca 0.03 0.84 0.11 0.00 -0.52 0.00 0.00 52.55 53.01 1n8q s ASP 661 Cb 0.11 -2.54 0.30 0.00 -1.46 0.00 0.00 42.92 39.33 1n8q s ASP 661 CO 0.75 -1.56 1.57 1.55 0.52 0.00 0.00 175.17 178.01 1n8q h PRO 662 N 11.33 0.00 -0.04 4.34 0.13 -1.88 -2.03 132.00 143.86 1n8q h PRO 662 Ca -0.29 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.81 1n8q h PRO 662 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1n8q h PRO 662 CO 1.09 0.65 -0.11 0.93 -0.23 0.00 0.00 178.00 180.33 1n8q h GLU 663 N 0.00 0.15 -0.54 0.86 5.08 -1.90 -1.14 114.58 117.09 1n8q h GLU 663 Ca -0.01 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1n8q h GLU 663 Cb 1.18 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1n8q h GLU 663 CO 0.08 0.72 0.34 1.25 -1.00 0.00 0.00 179.01 180.40 1n8q h LEU 664 N -0.40 0.64 -0.76 1.33 7.12 -1.81 -0.24 115.31 121.19 1n8q h LEU 664 Ca -0.00 -0.04 -0.06 0.00 0.13 0.00 0.00 57.88 57.91 1n8q h LEU 664 Cb 0.73 -0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 40.66 1n8q h LEU 664 CO 0.02 0.49 0.25 1.56 -0.13 0.00 0.00 178.44 180.64 1n8q h GLN 665 N 0.73 1.18 -0.28 1.25 1.08 -1.35 -0.92 115.11 116.81 1n8q h GLN 665 Ca 0.20 -0.25 -0.19 0.00 -1.45 0.00 0.00 58.65 56.96 1n8q h GLN 665 Cb -0.04 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.22 1n8q h GLN 665 CO -0.04 0.99 -0.57 0.00 -0.95 0.00 0.00 178.83 178.26 1n8q h ALA 666 N 1.13 0.45 -0.08 3.87 0.00 -1.14 -2.23 119.26 121.26 1n8q h ALA 666 Ca 0.25 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.67 1n8q h ALA 666 Cb 0.29 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1n8q h ALA 666 CO -0.01 0.68 -0.22 0.00 0.00 0.00 0.00 179.25 179.70 1n8q h TRP 668 N -0.31 0.92 -0.74 0.00 2.91 -1.19 -0.46 115.95 117.07 1n8q h TRP 668 Ca 0.09 -0.28 -0.02 0.00 1.13 0.00 0.00 58.89 59.80 1n8q h TRP 668 Cb 0.43 -0.19 -0.03 0.00 -0.51 0.00 0.00 29.16 28.85 1n8q h TRP 668 CO -0.30 1.05 0.38 -0.22 -1.03 0.00 0.00 178.44 178.32 1n8q h LYS 669 N 0.61 1.06 -0.03 2.65 3.64 -1.33 -1.34 116.57 121.84 1n8q h LYS 669 Ca 0.04 -0.14 -0.19 0.00 -1.27 0.00 0.00 60.65 59.08 1n8q h LYS 669 Cb 0.99 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1n8q h LYS 669 CO 0.09 0.81 -0.82 1.49 -2.27 0.00 0.00 179.45 178.76 1n8q h GLU 670 N 1.04 0.31 0.02 1.90 4.81 -1.02 -0.17 114.58 121.47 1n8q h GLU 670 Ca 0.26 -0.30 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1n8q h GLU 670 Cb 0.09 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.51 1n8q h GLU 670 CO -0.04 0.97 -0.22 1.25 -0.73 0.00 0.00 179.01 180.25 1n8q h LEU 671 N 0.19 -0.65 -0.28 1.64 7.12 -0.82 -0.38 115.31 122.14 1n8q h LEU 671 Ca -0.04 0.09 -0.12 0.00 0.13 0.00 0.00 57.88 57.94 1n8q h LEU 671 Cb 1.42 0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 41.81 1n8q h LEU 671 CO 0.13 -0.29 -0.28 0.58 -0.13 0.00 0.00 178.44 178.45 1n8q h VAL 672 N -0.36 1.30 0.00 1.05 2.07 -1.16 -0.27 116.25 118.88 1n8q h VAL 672 Ca 0.05 -1.45 0.00 0.00 0.82 0.00 0.00 66.70 66.13 1n8q h VAL 672 Cb 0.43 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1n8q h VAL 672 CO -0.19 0.46 -0.79 -0.62 0.02 0.00 0.00 177.57 176.46 1n8q n GLU 673 N -4.28 0.35 0.07 1.57 1.02 -0.09 -3.53 120.64 115.76 1n8q n GLU 673 Ca -0.04 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1n8q n GLU 673 Cb 0.47 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1n8q n GLU 673 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1n8q n VAL 674 N -2.18 0.83 -0.31 2.62 0.31 -0.19 -4.43 118.33 114.98 1n8q n VAL 674 Ca 0.02 0.27 -0.03 0.00 -0.01 0.00 0.00 64.34 64.60 1n8q n VAL 674 Cb 0.46 -1.24 0.12 0.00 -0.91 0.00 0.00 33.84 32.27 1n8q n VAL 674 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1n8q h GLY 675 N 0.00 1.29 -3.11 2.92 0.00 -0.96 -1.13 103.07 102.08 1n8q h GLY 675 Ca 0.00 -0.57 -0.42 0.00 0.00 0.00 0.00 47.33 46.35 1n8q h GLY 675 CO 0.00 0.55 -0.75 1.42 0.00 0.00 0.00 176.54 177.76 1n8q n HIS 676 N -4.34 2.08 0.30 5.60 8.25 -0.16 -0.98 115.22 125.97 1n8q n HIS 676 Ca 0.09 -2.04 0.19 0.00 -0.26 0.00 0.00 57.72 55.70 1n8q n HIS 676 Cb 0.09 -0.32 0.98 0.00 1.12 0.00 0.00 29.99 31.86 1n8q n HIS 676 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1n8q h GLY 677 N 1.90 0.00 2.00 -1.41 0.00 -1.24 0.62 103.07 104.93 1n8q h GLY 677 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1n8q h GLY 677 CO 0.57 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.33 1n8q n ASP 678 N -2.92 0.39 -1.00 0.19 8.00 -1.26 -2.86 116.55 117.10 1n8q n ASP 678 Ca -0.02 0.57 0.05 0.00 0.71 0.00 0.00 54.79 56.11 1n8q n ASP 678 Cb 0.12 -0.66 0.25 0.00 -0.02 0.00 0.00 41.12 40.80 1n8q n ASP 678 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1n8q n LYS 679 N -1.91 2.70 0.28 -1.24 5.02 0.21 -4.79 118.16 118.43 1n8q n LYS 679 Ca 0.04 -2.92 0.16 0.00 -2.02 0.00 0.00 58.31 53.56 1n8q n LYS 679 Cb 0.27 -1.86 0.84 0.00 -0.02 0.00 0.00 35.03 34.26 1n8q n LYS 679 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1n8q h LYS 680 N 1.63 0.00 -0.45 1.97 2.10 -1.59 -2.35 116.57 117.88 1n8q h LYS 680 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 1n8q h LYS 680 Cb 1.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.87 1n8q h LYS 680 CO 0.29 0.07 0.00 0.09 -2.00 0.00 0.00 179.45 177.89 1n8q n ASN 681 N -3.47 3.53 -4.74 7.07 5.03 -1.26 -4.92 115.26 116.50 1n8q n ASN 681 Ca -0.02 -1.99 -0.41 0.00 0.87 0.00 0.00 54.58 53.03 1n8q n ASN 681 Cb 0.20 -0.29 -0.03 0.00 -1.02 0.00 0.00 39.78 38.63 1n8q n ASN 681 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1n8q s GLU 682 N -1.37 4.43 0.00 3.52 0.41 -0.89 -4.93 118.70 119.89 1n8q s GLU 682 Ca 0.40 2.00 0.24 0.00 -0.41 0.00 0.00 54.97 57.20 1n8q s GLU 682 Cb 0.23 -3.19 1.12 0.00 -1.78 0.00 0.00 34.13 30.50 1n8q s GLU 682 CO 0.31 -0.16 1.78 -0.35 -0.49 0.00 0.00 175.26 176.35 1n8q n PRO 683 N 2.28 0.18 0.00 0.39 -0.04 -1.26 -3.47 135.00 133.08 1n8q n PRO 683 Ca 0.04 0.08 0.13 0.00 -0.04 0.00 0.00 63.50 63.71 1n8q n PRO 683 Cb 0.43 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.84 1n8q n PRO 683 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1n8q n TRP 684 N -1.39 0.00 -1.88 0.54 4.27 -1.26 -4.85 117.44 112.88 1n8q n TRP 684 Ca 0.09 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.28 1n8q n TRP 684 Cb 0.23 -0.14 -0.03 0.00 -1.36 0.00 0.00 31.31 30.01 1n8q n TRP 684 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 1n8q s TRP 685 N -2.49 3.02 0.44 -2.67 0.52 -1.23 -4.79 118.94 111.73 1n8q s TRP 685 Ca 0.26 0.56 -0.26 0.00 0.02 0.00 0.00 56.10 56.68 1n8q s TRP 685 Cb 0.19 -3.98 -0.09 0.00 -1.15 0.00 0.00 33.47 28.44 1n8q s TRP 685 CO 0.51 -3.65 1.44 -2.30 0.02 0.00 0.00 176.95 172.96 1n8q n PRO 686 N 3.93 2.32 -2.37 4.98 -0.02 -1.26 -5.01 135.00 137.57 1n8q n PRO 686 Ca 0.14 0.82 -0.25 0.00 -2.02 0.00 0.00 63.50 62.20 1n8q n PRO 686 Cb 0.38 -2.63 0.09 0.00 -0.02 0.00 0.00 33.50 31.32 1n8q n PRO 686 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1n8q s LYS 687 N -2.37 1.89 -0.73 -0.52 1.02 -1.26 -4.98 119.74 112.79 1n8q s LYS 687 Ca 0.60 -0.64 0.04 0.00 0.02 0.00 0.00 55.97 55.98 1n8q s LYS 687 Cb -0.46 -2.24 0.28 0.00 -0.52 0.00 0.00 37.83 34.89 1n8q s LYS 687 CO 0.59 -1.36 0.96 -1.33 -0.92 0.00 0.00 175.35 173.29 1n8q n MET 688 N -2.90 3.14 -0.16 1.68 2.81 -1.26 -4.68 117.12 115.76 1n8q n MET 688 Ca 0.11 -4.69 0.05 0.00 -1.81 0.00 0.00 57.70 51.36 1n8q n MET 688 Cb 0.60 -2.31 0.13 0.00 -0.71 0.00 0.00 33.22 30.94 1n8q n MET 688 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1n8q n GLN 689 N 0.70 2.89 -3.68 0.03 1.13 -1.26 -4.54 117.38 112.65 1n8q n GLN 689 Ca 0.30 -1.99 -0.13 0.00 -1.94 0.00 0.00 57.00 53.23 1n8q n GLN 689 Cb 0.39 -1.24 -0.08 0.00 0.11 0.00 0.00 30.24 29.41 1n8q n GLN 689 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1n8q s THR 690 N -1.03 -0.00 0.31 5.09 2.01 -1.26 -4.84 115.64 115.92 1n8q s THR 690 Ca 0.20 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.21 1n8q s THR 690 Cb 0.11 -0.80 0.18 0.00 0.01 0.00 0.00 72.50 72.00 1n8q s THR 690 CO 0.14 0.00 1.88 0.03 -0.69 0.00 0.00 174.62 175.97 1n8q h ARG 691 N 5.28 0.76 -0.77 4.92 3.08 -1.89 -2.07 114.38 123.69 1n8q h ARG 691 Ca -0.28 -0.13 0.10 0.00 0.07 0.00 0.00 59.98 59.74 1n8q h ARG 691 Cb 1.17 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 31.04 1n8q h ARG 691 CO 0.15 0.66 0.50 0.93 -1.07 0.00 0.00 179.97 181.14 1n8q h GLU 692 N 0.75 0.65 -0.13 0.04 3.07 -1.99 -0.13 114.58 116.84 1n8q h GLU 692 Ca 0.17 -0.04 -0.16 0.00 -0.50 0.00 0.00 59.36 58.84 1n8q h GLU 692 Cb 0.21 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.97 1n8q h GLU 692 CO -0.01 0.43 -0.58 0.93 -1.40 0.00 0.00 179.01 178.38 1n8q h GLU 693 N 0.67 0.42 -0.44 2.33 5.08 -1.72 -1.98 114.58 118.92 1n8q h GLU 693 Ca 0.36 -0.28 -0.14 0.00 -1.00 0.00 0.00 59.36 58.30 1n8q h GLU 693 Cb 0.49 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1n8q h GLU 693 CO -0.13 0.88 -0.26 1.25 -1.00 0.00 0.00 179.01 179.75 1n8q h LEU 694 N 0.31 1.00 -0.20 1.33 5.85 -1.14 -1.54 115.31 120.92 1n8q h LEU 694 Ca -0.00 -0.42 0.02 0.00 0.84 0.00 0.00 57.88 58.32 1n8q h LEU 694 Cb 1.11 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 1n8q h LEU 694 CO 0.10 1.20 0.06 0.58 -0.34 0.00 0.00 178.44 180.04 1n8q h VAL 695 N 0.80 0.94 -0.28 1.05 2.07 -0.94 -1.15 116.25 118.73 1n8q h VAL 695 Ca 0.09 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 1n8q h VAL 695 Cb 0.84 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1n8q h VAL 695 CO 0.07 0.03 0.07 -0.08 0.02 0.00 0.00 177.57 177.68 1n8q h GLU 696 N 0.15 0.45 -0.40 1.57 4.57 -1.27 0.12 114.58 119.77 1n8q h GLU 696 Ca 0.09 -0.11 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1n8q h GLU 696 Cb 0.06 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.58 1n8q h GLU 696 CO -0.10 0.54 0.23 0.00 -1.18 0.00 0.00 179.01 178.51 1n8q h ALA 697 N 0.89 0.51 -0.57 2.92 0.00 -1.22 -0.71 119.26 121.09 1n8q h ALA 697 Ca 0.09 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1n8q h ALA 697 Cb 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1n8q h ALA 697 CO 0.00 0.02 0.07 0.00 0.00 0.00 0.00 179.25 179.34 1n8q h ALA 699 N 1.00 0.84 -0.37 0.00 0.00 -0.56 -2.13 119.26 118.04 1n8q h ALA 699 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1n8q h ALA 699 Cb 0.45 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1n8q h ALA 699 CO 0.02 0.02 0.18 0.82 0.00 0.00 0.00 179.25 180.28 1n8q h ILE 700 N 0.65 1.16 0.29 0.00 2.04 -0.93 -0.57 117.51 120.15 1n8q h ILE 700 Ca 0.28 -0.46 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1n8q h ILE 700 Cb 0.18 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 1n8q h ILE 700 CO -0.18 0.17 -0.23 0.40 0.00 0.00 0.00 178.15 178.31 1n8q h ILE 701 N 0.46 0.50 -0.59 -0.67 2.04 -1.23 -0.71 117.51 117.31 1n8q h ILE 701 Ca 0.13 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 1n8q h ILE 701 Cb 0.11 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 1n8q h ILE 701 CO -0.02 0.00 0.32 0.40 0.00 0.00 0.00 178.15 178.85 1n8q h ILE 702 N -0.54 1.20 -0.43 -0.67 2.04 -1.40 -1.33 117.51 116.37 1n8q h ILE 702 Ca -0.02 -0.50 0.08 0.00 1.00 0.00 0.00 64.86 65.42 1n8q h ILE 702 Cb 0.47 0.45 -0.07 0.00 -0.74 0.00 0.00 36.82 36.93 1n8q h ILE 702 CO -0.02 0.21 0.01 -0.25 0.00 0.00 0.00 178.15 178.10 1n8q h TRP 703 N 0.80 -0.01 -0.08 1.37 2.91 -0.95 -0.50 115.95 119.50 1n8q h TRP 703 Ca 0.21 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.26 1n8q h TRP 703 Cb 0.06 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.77 1n8q h TRP 703 CO -0.01 -0.08 0.04 1.15 -1.03 0.00 0.00 178.44 178.51 1n8q h THR 704 N 0.12 1.01 0.00 2.65 2.02 -0.88 -0.41 112.91 117.42 1n8q h THR 704 Ca 0.21 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.29 1n8q h THR 704 Cb 0.31 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1n8q h THR 704 CO -0.35 0.02 -0.37 0.00 0.37 0.00 0.00 175.52 175.19 1n8q h ALA 705 N 1.04 1.04 -3.00 6.16 0.00 -1.08 -2.59 119.26 120.82 1n8q h ALA 705 Ca 0.03 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1n8q h ALA 705 Cb -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1n8q h ALA 705 CO -0.02 0.46 0.00 -1.13 0.00 0.00 0.00 179.25 178.56 1n8q n SER 706 N -3.59 0.00 0.08 0.00 3.41 -0.21 -2.82 113.62 110.49 1n8q n SER 706 Ca -0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.49 1n8q n SER 706 Cb 0.49 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 1n8q n SER 706 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n8q h ALA 707 N -0.99 0.38 -0.22 7.33 0.00 -1.58 -1.35 119.26 122.83 1n8q h ALA 707 Ca 0.00 -0.77 -0.02 0.00 0.00 0.00 0.00 54.91 54.12 1n8q h ALA 707 Cb 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1n8q h ALA 707 CO 0.00 0.93 0.04 1.25 0.00 0.00 0.00 179.25 181.47 1n8q h LEU 708 N 0.12 0.34 -0.50 0.00 5.85 -1.24 -0.63 115.31 119.25 1n8q h LEU 708 Ca -0.07 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1n8q h LEU 708 Cb 1.64 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.56 1n8q h LEU 708 CO 0.16 0.50 0.26 -0.74 -0.34 0.00 0.00 178.44 178.28 1n8q h HIS 709 N 0.16 0.70 -0.13 1.25 2.76 -1.46 -2.50 115.15 115.92 1n8q h HIS 709 Ca 0.07 -0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.25 1n8q h HIS 709 Cb 0.31 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.00 1n8q h HIS 709 CO 0.02 0.53 -0.13 0.00 -1.30 0.00 0.00 177.93 177.05 1n8q h ALA 710 N 1.10 -0.03 -0.14 5.26 0.00 -1.13 0.39 119.26 124.70 1n8q h ALA 710 Ca 0.17 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1n8q h ALA 710 Cb 0.08 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1n8q h ALA 710 CO -0.03 -0.58 0.03 0.00 0.00 0.00 0.00 179.25 178.67 1n8q h ALA 711 N 0.93 1.79 0.00 0.00 0.00 -0.91 -0.75 119.26 120.32 1n8q h ALA 711 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1n8q h ALA 711 Cb 0.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1n8q h ALA 711 CO -0.22 0.17 -1.29 0.28 0.00 0.00 0.00 179.25 178.19 1n8q n VAL 712 N -4.45 0.14 -0.11 0.00 0.31 -0.96 -4.55 118.33 108.71 1n8q n VAL 712 Ca -0.01 -0.31 -0.19 0.00 -0.01 0.00 0.00 64.34 63.83 1n8q n VAL 712 Cb 0.13 0.21 -0.09 0.00 -0.91 0.00 0.00 33.84 33.19 1n8q n VAL 712 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1n8q n ASN 713 N -2.04 1.99 -0.30 4.52 5.15 0.11 -4.70 115.26 119.99 1n8q n ASN 713 Ca 0.00 0.07 0.13 0.00 -0.60 0.00 0.00 54.58 54.19 1n8q n ASN 713 Cb 0.47 -0.48 0.61 0.00 -0.53 0.00 0.00 39.78 39.84 1n8q n ASN 713 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1n8q n PHE 714 N -3.53 0.05 0.48 1.20 3.72 -0.35 -2.66 117.46 116.37 1n8q n PHE 714 Ca -0.40 -0.02 0.12 0.00 -0.05 0.00 0.00 57.45 57.10 1n8q n PHE 714 Cb 0.85 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.60 1n8q n PHE 714 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n8q n GLY 715 N 1.06 1.54 0.07 1.37 0.00 -1.26 -4.61 105.19 103.36 1n8q n GLY 715 Ca 0.19 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 1n8q n GLY 715 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1n8q h GLN 716 N 4.42 0.11 -0.01 1.61 4.20 -1.80 -1.69 115.11 121.94 1n8q h GLN 716 Ca 0.00 -0.02 -0.12 0.00 0.06 0.00 0.00 58.65 58.57 1n8q h GLN 716 Cb 0.97 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.74 1n8q h GLN 716 CO 0.00 0.19 -0.47 -0.92 -0.67 0.00 0.00 178.83 176.96 1n8q h TYR 717 N 0.01 0.50 -0.76 2.96 3.20 -1.82 0.01 116.97 121.07 1n8q h TYR 717 Ca 0.03 -0.26 0.16 0.00 3.14 0.00 0.00 58.73 61.80 1n8q h TYR 717 Cb 0.11 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.27 1n8q h TYR 717 CO -0.03 1.06 0.51 -1.35 -1.64 0.00 0.00 178.16 176.71 1n8q h PRO 718 N -0.21 0.33 0.02 1.82 0.11 -1.80 0.50 132.00 132.77 1n8q h PRO 718 Ca -0.05 -0.02 -0.39 0.00 0.11 0.00 0.00 66.00 65.64 1n8q h PRO 718 Cb 1.18 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.16 1n8q h PRO 718 CO 0.09 0.22 -2.31 0.66 -0.21 0.00 0.00 178.00 176.45 1n8q n TYR 719 N -4.46 0.31 0.41 0.65 4.01 -0.64 -1.51 117.16 115.92 1n8q n TYR 719 Ca 0.15 0.09 0.12 0.00 -0.16 0.00 0.00 57.90 58.09 1n8q n TYR 719 Cb 0.59 -1.04 0.20 0.00 -0.31 0.00 0.00 39.34 38.78 1n8q n TYR 719 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n8q n GLY 720 N 1.86 1.64 0.00 2.72 0.00 -0.01 -4.23 105.19 107.16 1n8q n GLY 720 Ca -0.45 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 44.92 1n8q n GLY 720 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8q n GLY 721 N 1.49 -0.87 3.40 -0.02 0.00 0.17 -3.84 105.19 105.53 1n8q n GLY 721 Ca 0.19 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1n8q n GLY 721 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n8q s LEU 722 N -2.54 4.64 0.57 0.99 0.20 -1.26 -4.78 118.68 116.51 1n8q s LEU 722 Ca 0.18 -0.88 0.38 0.00 0.69 0.00 0.00 54.13 54.50 1n8q s LEU 722 Cb 0.12 -2.04 1.98 0.00 -0.43 0.00 0.00 46.19 45.83 1n8q s LEU 722 CO 0.27 -0.35 2.16 -0.29 -0.29 0.00 0.00 176.35 177.85 1n8q h ILE 723 N 5.79 0.00 -0.03 6.68 6.09 -1.86 -2.09 117.51 132.10 1n8q h ILE 723 Ca -0.27 -0.10 -0.15 0.00 -1.37 0.00 0.00 64.86 62.97 1n8q h ILE 723 Cb 1.12 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 39.38 1n8q h ILE 723 CO 0.66 0.00 -0.67 -0.07 -3.07 0.00 0.00 178.15 175.00 1n8q h LEU 724 N 0.00 0.17 0.17 2.19 4.07 -1.93 -1.97 115.31 118.01 1n8q h LEU 724 Ca 0.00 -0.11 -0.34 0.00 0.08 0.00 0.00 57.88 57.51 1n8q h LEU 724 Cb 0.10 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.80 1n8q h LEU 724 CO 0.00 0.79 -1.71 -1.13 -1.08 0.00 0.00 178.44 175.31 1n8q h ASN 725 N 0.10 0.56 -2.64 -0.43 -0.00 -1.68 -3.40 115.58 108.09 1n8q h ASN 725 Ca -0.01 -0.84 -0.60 0.00 -0.00 0.00 0.00 56.30 54.85 1n8q h ASN 725 Cb 1.20 -0.18 -0.41 0.00 -0.00 0.00 0.00 38.32 38.93 1n8q h ASN 725 CO 0.10 1.71 -0.71 0.54 -0.00 0.00 0.00 177.43 179.06 1n8q n ARG 726 N -3.55 1.55 -1.85 6.67 5.12 -1.15 -5.01 116.66 118.43 1n8q n ARG 726 Ca -0.23 -4.14 -0.36 0.00 -1.93 0.00 0.00 57.85 51.19 1n8q n ARG 726 Cb 1.07 -2.05 0.05 0.00 -1.16 0.00 0.00 32.46 30.37 1n8q n ARG 726 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1n8q s PRO 727 N -1.36 2.74 -0.01 5.56 0.04 -0.74 -4.75 135.00 136.48 1n8q s PRO 727 Ca 0.31 1.83 0.12 0.00 0.04 0.00 0.00 61.00 63.30 1n8q s PRO 727 Cb 0.04 -1.90 -0.17 0.00 0.04 0.00 0.00 34.50 32.51 1n8q s PRO 727 CO -0.14 -1.38 0.35 0.25 0.04 0.00 0.00 177.00 176.12 1n8q n THR 728 N -1.89 0.00 -3.73 1.26 -2.24 -1.26 -3.95 114.28 102.47 1n8q n THR 728 Ca 0.14 -0.26 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 1n8q n THR 728 Cb 0.50 0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 69.14 1n8q n THR 728 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1n8q s LEU 729 N -3.44 0.84 0.04 3.22 0.05 -1.26 -1.45 118.68 116.67 1n8q s LEU 729 Ca -0.02 -0.46 0.06 0.00 0.05 0.00 0.00 54.13 53.77 1n8q s LEU 729 Cb 0.08 1.49 -0.02 0.00 -2.05 0.00 0.00 46.19 45.69 1n8q s LEU 729 CO 0.51 -0.80 -0.18 -0.94 -0.55 0.00 0.00 176.35 174.38 1n8q s SER 730 N -2.83 2.19 -0.02 1.48 1.04 -1.26 -2.07 113.70 112.22 1n8q s SER 730 Ca 0.04 -0.48 0.03 0.00 0.48 0.00 0.00 55.95 56.02 1n8q s SER 730 Cb 0.03 -0.18 0.05 0.00 0.10 0.00 0.00 66.02 66.02 1n8q s SER 730 CO -0.12 0.13 0.86 -2.11 0.98 0.00 0.00 173.24 172.98 1n8q n ARG 731 N 1.94 0.76 -3.93 4.02 1.85 0.11 -0.91 116.66 120.50 1n8q n ARG 731 Ca -0.17 -1.20 -0.10 0.00 -1.00 0.00 0.00 57.85 55.38 1n8q n ARG 731 Cb 0.54 -0.76 -0.10 0.00 -1.05 0.00 0.00 32.46 31.08 1n8q n ARG 731 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1n8q s ARG 732 N -0.68 0.42 0.65 2.89 0.52 -1.26 -4.43 118.95 117.07 1n8q s ARG 732 Ca 0.06 -0.56 -0.06 0.00 -0.52 0.00 0.00 55.73 54.65 1n8q s ARG 732 Cb 0.05 0.16 0.04 0.00 0.52 0.00 0.00 34.95 35.72 1n8q s ARG 732 CO 0.01 -0.09 0.96 -0.06 0.02 0.00 0.00 175.30 176.14 1n8q s PHE 733 N -1.63 3.04 0.16 -0.53 0.08 -1.26 -4.80 117.98 113.04 1n8q s PHE 733 Ca -0.14 0.50 -0.32 0.00 0.12 0.00 0.00 56.93 57.09 1n8q s PHE 733 Cb -0.08 -3.00 -0.12 0.00 -0.57 0.00 0.00 43.02 39.25 1n8q s PHE 733 CO -0.01 -1.16 1.74 -0.12 -0.10 0.00 0.00 175.22 175.57 1n8q n MET 734 N -2.77 2.64 -1.69 0.44 1.56 -1.26 -4.95 117.12 111.10 1n8q n MET 734 Ca 0.07 0.96 -0.44 0.00 -0.27 0.00 0.00 57.70 58.01 1n8q n MET 734 Cb 0.59 -2.80 -0.04 0.00 2.15 0.00 0.00 33.22 33.12 1n8q n MET 734 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1n8q n PRO 735 N 4.46 2.48 -4.09 2.12 -0.04 -1.26 -5.01 135.00 133.66 1n8q n PRO 735 Ca 0.17 0.90 -0.29 0.00 -0.04 0.00 0.00 63.50 64.24 1n8q n PRO 735 Cb 0.34 -2.73 -0.07 0.00 -0.04 0.00 0.00 33.50 31.00 1n8q n PRO 735 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1n8q s GLU 736 N 1.86 2.74 0.00 0.54 2.12 -1.26 -4.89 118.70 119.81 1n8q s GLU 736 Ca 0.80 -0.81 0.00 0.00 0.36 0.00 0.00 54.97 55.33 1n8q s GLU 736 Cb -0.58 -2.62 0.00 0.00 0.26 0.00 0.00 34.13 31.18 1n8q s GLU 736 CO 0.38 0.53 0.00 1.63 -0.54 0.00 0.00 175.26 177.26 1n8q n LYS 737 N 0.27 0.00 -2.10 4.30 5.02 -1.26 -2.25 118.16 122.14 1n8q n LYS 737 Ca -0.09 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.90 1n8q n LYS 737 Cb 0.53 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.56 1n8q n LYS 737 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n8q n GLY 738 N 0.00 6.01 3.82 0.72 0.00 -1.26 -4.91 105.19 109.56 1n8q n GLY 738 Ca 0.00 -2.63 -0.30 0.00 0.00 0.00 0.00 46.02 43.09 1n8q n GLY 738 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n8q s SER 739 N -2.86 4.77 0.31 1.61 0.15 -0.96 -4.96 113.70 111.76 1n8q s SER 739 Ca 0.52 1.30 0.26 0.00 0.70 0.00 0.00 55.95 58.72 1n8q s SER 739 Cb 0.42 -2.06 0.81 0.00 -1.71 0.00 0.00 66.02 63.49 1n8q s SER 739 CO -0.15 -1.79 1.75 0.00 1.20 0.00 0.00 173.24 174.25 1n8q h ALA 740 N -0.96 1.00 0.05 5.45 0.00 -1.96 -2.96 119.26 119.87 1n8q h ALA 740 Ca -0.46 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.15 1n8q h ALA 740 Cb 1.26 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1n8q h ALA 740 CO 0.60 0.00 -1.62 1.05 0.00 0.00 0.00 179.25 179.28 1n8q h GLU 741 N 0.00 0.11 -0.82 0.00 9.09 -1.93 -2.85 114.58 118.19 1n8q h GLU 741 Ca 0.00 -0.20 0.02 0.00 0.05 0.00 0.00 59.36 59.23 1n8q h GLU 741 Cb 0.68 0.07 -0.04 0.00 -1.65 0.00 0.00 28.75 27.81 1n8q h GLU 741 CO 0.00 0.85 0.54 -0.92 0.05 0.00 0.00 179.01 179.52 1n8q h TYR 742 N 0.03 1.01 -0.25 2.06 3.20 -1.81 0.95 116.97 122.16 1n8q h TYR 742 Ca -0.26 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.48 1n8q h TYR 742 Cb 1.99 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 39.91 1n8q h TYR 742 CO 0.03 0.61 -0.45 1.49 -1.64 0.00 0.00 178.16 178.20 1n8q h GLU 743 N 1.07 0.63 -0.65 1.82 4.57 -1.61 -2.01 114.58 118.40 1n8q h GLU 743 Ca 0.31 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 1n8q h GLU 743 Cb -0.07 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 1n8q h GLU 743 CO -0.08 0.95 0.36 1.49 -1.18 0.00 0.00 179.01 180.54 1n8q h GLU 744 N 0.50 0.90 -0.32 1.92 4.81 -1.20 -1.02 114.58 120.16 1n8q h GLU 744 Ca 0.03 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1n8q h GLU 744 Cb 0.98 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 1n8q h GLU 744 CO 0.09 0.66 0.03 1.25 -0.73 0.00 0.00 179.01 180.31 1n8q h LEU 745 N 0.91 0.45 -0.03 1.64 6.46 -0.39 0.23 115.31 124.57 1n8q h LEU 745 Ca 0.23 -0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.91 1n8q h LEU 745 Cb 0.02 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 39.84 1n8q h LEU 745 CO -0.04 0.50 -0.02 -0.09 -0.62 0.00 0.00 178.44 178.17 1n8q h ARG 746 N 0.47 0.07 0.01 1.25 2.43 -0.57 -3.29 114.38 114.75 1n8q h ARG 746 Ca 0.11 -0.03 -0.26 0.00 -0.81 0.00 0.00 59.98 58.98 1n8q h ARG 746 Cb 0.27 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.78 1n8q h ARG 746 CO 0.00 0.49 -1.42 0.87 -1.51 0.00 0.00 179.97 178.41 1n8q h LYS 747 N -0.34 0.03 -1.78 0.20 1.79 -0.99 -3.41 116.57 112.06 1n8q h LYS 747 Ca 0.01 -0.05 -0.49 0.00 -2.18 0.00 0.00 60.65 57.94 1n8q h LYS 747 Cb 0.47 0.02 -0.33 0.00 -1.58 0.00 0.00 32.23 30.80 1n8q h LYS 747 CO 0.01 0.77 -0.93 -1.71 -1.08 0.00 0.00 179.45 176.50 1n8q n ASN 748 N -3.21 -0.80 0.25 0.86 2.85 0.79 -5.00 115.26 111.00 1n8q n ASN 748 Ca -0.10 -2.68 0.14 0.00 -0.11 0.00 0.00 54.58 51.83 1n8q n ASN 748 Cb 1.01 -0.07 0.55 0.00 1.24 0.00 0.00 39.78 42.51 1n8q n ASN 748 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1n8q h PRO 749 N 4.65 0.00 -0.45 1.20 0.13 -1.67 -2.65 132.00 133.22 1n8q h PRO 749 Ca 0.11 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.14 1n8q h PRO 749 Cb 0.93 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.05 1n8q h PRO 749 CO 0.37 0.08 -0.13 1.96 -0.23 0.00 0.00 178.00 180.05 1n8q h GLN 750 N 0.00 0.88 -0.30 0.86 4.20 -1.92 -1.14 115.11 117.69 1n8q h GLN 750 Ca -0.00 -0.35 -0.15 0.00 0.06 0.00 0.00 58.65 58.21 1n8q h GLN 750 Cb 0.64 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 1n8q h GLN 750 CO 0.01 0.99 -0.41 -0.22 -0.67 0.00 0.00 178.83 178.53 1n8q h LYS 751 N 0.71 0.73 -0.71 1.46 1.63 -1.67 -1.07 116.57 117.65 1n8q h LYS 751 Ca 0.11 -0.39 -0.03 0.00 -0.85 0.00 0.00 60.65 59.49 1n8q h LYS 751 Cb 0.68 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.29 1n8q h LYS 751 CO 0.05 1.01 0.31 0.00 -3.45 0.00 0.00 179.45 177.37 1n8q h ALA 752 N 0.94 0.92 -0.12 5.00 0.00 -1.37 -0.13 119.26 124.49 1n8q h ALA 752 Ca 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n8q h ALA 752 Cb 0.96 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1n8q h ALA 752 CO 0.09 0.51 0.08 -0.92 0.00 0.00 0.00 179.25 179.01 1n8q h TYR 753 N 1.00 0.16 -0.66 0.00 3.20 -1.08 -2.45 116.97 117.15 1n8q h TYR 753 Ca 0.24 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 1n8q h TYR 753 Cb 0.17 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 1n8q h TYR 753 CO 0.01 0.11 0.26 -0.07 -1.64 0.00 0.00 178.16 176.84 1n8q h LEU 754 N 0.16 0.88 -1.29 2.82 4.07 -1.01 -1.85 115.31 119.09 1n8q h LEU 754 Ca 0.05 -0.12 -0.01 0.00 0.08 0.00 0.00 57.88 57.87 1n8q h LEU 754 Cb -0.00 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 41.51 1n8q h LEU 754 CO -0.01 0.79 -0.07 0.11 -1.08 0.00 0.00 178.44 178.18 1n8q h LYS 755 N 0.95 0.00 0.23 1.13 1.57 -0.99 -3.16 116.57 116.30 1n8q h LYS 755 Ca 0.22 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.67 1n8q h LYS 755 Cb 0.18 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.53 1n8q h LYS 755 CO -0.02 0.07 -1.44 1.15 -0.57 0.00 0.00 179.45 178.64 1n8q h THR 756 N 0.00 1.31 -4.55 -0.16 2.02 -0.85 -3.41 112.91 107.26 1n8q h THR 756 Ca -0.00 -2.72 -0.26 0.00 0.77 0.00 0.00 66.41 64.20 1n8q h THR 756 Cb 0.60 3.00 0.05 0.00 -1.74 0.00 0.00 68.15 70.06 1n8q h THR 756 CO 0.01 0.81 0.06 2.30 0.37 0.00 0.00 175.52 179.07 1n8q n ILE 757 N -3.71 0.00 -1.64 3.11 -5.35 -0.87 0.06 119.36 110.96 1n8q n ILE 757 Ca -0.16 -0.88 -0.63 0.00 -0.27 0.00 0.00 62.75 60.81 1n8q n ILE 757 Cb 1.09 -1.10 -0.09 0.00 -1.74 0.00 0.00 39.64 37.80 1n8q n ILE 757 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1n8q n THR 758 N -2.18 0.02 -0.97 7.28 -1.04 -0.88 -4.71 114.28 111.79 1n8q n THR 758 Ca 0.09 -0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.81 1n8q n THR 758 Cb 0.33 -0.35 0.18 0.00 -1.82 0.00 0.00 70.33 68.66 1n8q n THR 758 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1n8q s PRO 759 N 1.72 0.51 0.21 -2.82 0.02 -1.26 -4.73 135.00 128.65 1n8q s PRO 759 Ca 0.98 0.86 -0.09 0.00 0.02 0.00 0.00 61.00 62.77 1n8q s PRO 759 Cb -1.36 -1.72 0.26 0.00 0.02 0.00 0.00 34.50 31.70 1n8q s PRO 759 CO 0.70 -2.76 1.79 -0.22 -0.33 0.00 0.00 177.00 176.17 1n8q h LYS 760 N -1.93 0.58 -0.44 5.54 3.64 -1.92 -0.79 116.57 121.25 1n8q h LYS 760 Ca -0.53 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.79 1n8q h LYS 760 Cb 1.30 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1n8q h LYS 760 CO 0.52 0.39 0.18 0.35 -2.27 0.00 0.00 179.45 178.62 1n8q h PHE 761 N 0.60 0.66 0.00 1.91 3.57 -1.93 -1.99 116.94 119.76 1n8q h PHE 761 Ca 0.31 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.69 1n8q h PHE 761 Cb 0.26 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1n8q h PHE 761 CO -0.10 0.57 -0.35 1.96 -2.23 0.00 0.00 178.31 178.16 1n8q h GLN 762 N 0.56 0.00 -0.30 1.11 7.50 -1.88 -2.41 115.11 119.70 1n8q h GLN 762 Ca 0.15 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.29 1n8q h GLN 762 Cb 0.19 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 1n8q h GLN 762 CO -0.01 0.35 0.17 1.15 -1.50 0.00 0.00 178.83 178.99 1n8q h THR 763 N 0.00 1.12 -0.47 -0.54 2.02 -0.66 -1.77 112.91 112.61 1n8q h THR 763 Ca -0.00 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 1n8q h THR 763 Cb 0.98 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1n8q h THR 763 CO 0.05 0.12 0.22 -0.07 0.37 0.00 0.00 175.52 176.20 1n8q h LEU 764 N 0.37 0.59 0.07 2.58 3.38 -0.88 -0.29 115.31 121.13 1n8q h LEU 764 Ca 0.10 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1n8q h LEU 764 Cb 0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1n8q h LEU 764 CO -0.02 0.52 -0.03 0.40 0.09 0.00 0.00 178.44 179.40 1n8q h ILE 765 N 0.66 1.13 -0.38 1.22 2.04 -1.46 -2.30 117.51 118.43 1n8q h ILE 765 Ca 0.17 -0.66 0.03 0.00 1.00 0.00 0.00 64.86 65.39 1n8q h ILE 765 Cb 0.09 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1n8q h ILE 765 CO -0.02 0.17 0.17 -0.78 0.00 0.00 0.00 178.15 177.68 1n8q h ASP 766 N -0.39 0.23 -0.48 1.72 3.58 -0.86 -1.97 116.42 118.26 1n8q h ASP 766 Ca -0.01 0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.38 1n8q h ASP 766 Cb 0.34 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.36 1n8q h ASP 766 CO 0.01 0.17 -0.02 -0.07 -2.88 0.00 0.00 179.24 176.46 1n8q h LEU 767 N 0.35 0.85 -1.09 2.28 4.07 -1.09 -1.30 115.31 119.39 1n8q h LEU 767 Ca 0.16 -0.32 -0.04 0.00 0.08 0.00 0.00 57.88 57.76 1n8q h LEU 767 Cb 0.09 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.58 1n8q h LEU 767 CO -0.13 0.96 0.16 0.28 -1.08 0.00 0.00 178.44 178.64 1n8q h SER 768 N 0.72 0.75 0.02 -0.43 0.02 -1.24 -1.14 113.55 112.25 1n8q h SER 768 Ca 0.14 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1n8q h SER 768 Cb 0.54 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1n8q h SER 768 CO 0.03 0.72 -0.16 0.58 -1.14 0.00 0.00 176.83 176.85 1n8q h VAL 769 N 0.79 1.66 0.00 2.27 2.07 -1.23 -3.23 116.25 118.58 1n8q h VAL 769 Ca 0.18 -2.16 0.00 0.00 0.82 0.00 0.00 66.70 65.54 1n8q h VAL 769 Cb 0.24 3.11 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 1n8q h VAL 769 CO -0.01 0.58 0.00 0.16 0.02 0.00 0.00 177.57 178.32 1n8q h ILE 770 N -0.75 0.00 -0.16 4.57 3.07 -1.20 -0.84 117.51 122.19 1n8q h ILE 770 Ca -0.03 -0.50 -0.10 0.00 1.55 0.00 0.00 64.86 65.79 1n8q h ILE 770 Cb 1.04 1.46 -0.01 0.00 -0.27 0.00 0.00 36.82 39.03 1n8q h ILE 770 CO 0.03 0.00 -0.34 -0.08 -1.05 0.00 0.00 178.15 176.71 1n8q h GLU 771 N 0.00 0.32 0.01 0.16 4.81 -1.30 -1.99 114.58 116.60 1n8q h GLU 771 Ca 0.00 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 1n8q h GLU 771 Cb 0.52 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1n8q h GLU 771 CO 0.00 0.63 -0.19 0.82 -0.73 0.00 0.00 179.01 179.54 1n8q h ILE 772 N 0.28 1.59 -0.55 2.32 2.04 -1.27 -3.31 117.51 118.61 1n8q h ILE 772 Ca 0.03 -1.99 0.11 0.00 1.00 0.00 0.00 64.86 64.02 1n8q h ILE 772 Cb 0.74 2.88 -0.03 0.00 -0.74 0.00 0.00 36.82 39.67 1n8q h ILE 772 CO 0.06 0.54 0.37 -0.07 0.00 0.00 0.00 178.15 179.05 1n8q h LEU 773 N -0.61 0.23 -1.17 1.44 3.38 -1.24 -2.29 115.31 115.05 1n8q h LEU 773 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1n8q h LEU 773 Cb 0.98 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1n8q h LEU 773 CO 0.04 0.14 0.00 -1.20 0.09 0.00 0.00 178.44 177.50 1n8q n SER 774 N -4.45 1.71 -4.80 -0.43 7.64 -0.75 -4.80 113.62 107.74 1n8q n SER 774 Ca 0.09 -1.92 -0.34 0.00 1.01 0.00 0.00 58.87 57.71 1n8q n SER 774 Cb 0.43 -0.19 -0.07 0.00 -1.01 0.00 0.00 64.21 63.37 1n8q n SER 774 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1n8q s ARG 775 N -1.62 3.17 -0.17 1.43 0.52 -0.86 -4.17 118.95 117.25 1n8q s ARG 775 Ca 0.25 -0.40 -0.11 0.00 -0.52 0.00 0.00 55.73 54.94 1n8q s ARG 775 Cb 0.13 -2.93 -0.05 0.00 0.52 0.00 0.00 34.95 32.62 1n8q s ARG 775 CO 0.18 0.68 0.20 -1.01 0.02 0.00 0.00 175.30 175.36 1n8q s HIS 776 N -1.15 3.46 0.74 -0.53 3.76 -0.60 -4.90 115.29 116.07 1n8q s HIS 776 Ca 0.21 0.47 -0.14 0.00 -0.15 0.00 0.00 55.06 55.46 1n8q s HIS 776 Cb -0.12 -2.20 0.05 0.00 1.11 0.00 0.00 32.58 31.42 1n8q s HIS 776 CO 0.12 0.34 1.15 0.00 -0.85 0.00 0.00 174.74 175.50 1n8q s ALA 777 N 0.17 2.14 -0.71 -1.40 0.00 -1.26 -1.27 121.76 119.42 1n8q s ALA 777 Ca 0.12 0.65 0.23 0.00 0.00 0.00 0.00 51.96 52.96 1n8q s ALA 777 Cb -0.12 -3.39 0.90 0.00 0.00 0.00 0.00 23.12 20.51 1n8q s ALA 777 CO 0.01 -1.82 1.71 -1.13 0.00 0.00 0.00 175.76 174.53 1n8q n SER 778 N -2.98 0.49 -0.95 0.00 3.41 -1.26 -2.69 113.62 109.64 1n8q n SER 778 Ca 0.12 0.59 0.04 0.00 -0.26 0.00 0.00 58.87 59.36 1n8q n SER 778 Cb 0.51 -0.71 0.23 0.00 -0.26 0.00 0.00 64.21 63.99 1n8q n SER 778 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1n8q n ASP 779 N -2.01 3.30 -4.76 4.04 5.75 -1.26 -5.00 116.55 116.62 1n8q n ASP 779 Ca 0.04 -3.29 -0.40 0.00 -0.01 0.00 0.00 54.79 51.13 1n8q n ASP 779 Cb 0.28 -0.57 0.02 0.00 -1.03 0.00 0.00 41.12 39.82 1n8q n ASP 779 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1n8q n GLU 780 N -0.80 2.24 -3.86 0.11 4.07 -1.10 -5.01 120.64 116.29 1n8q n GLU 780 Ca 0.26 0.80 -0.36 0.00 -0.06 0.00 0.00 57.16 57.79 1n8q n GLU 780 Cb 0.94 -2.62 -0.13 0.00 -0.06 0.00 0.00 31.44 29.57 1n8q n GLU 780 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1n8q s VAL 781 N -1.19 3.47 0.35 6.31 1.01 -1.26 -5.07 120.40 124.02 1n8q s VAL 781 Ca 0.61 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1n8q s VAL 781 Cb -0.45 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1n8q s VAL 781 CO 0.58 0.18 0.54 -0.31 0.00 0.00 0.00 175.10 176.08 1n8q s TYR 782 N 1.43 3.47 0.16 5.22 1.51 -1.26 -1.69 117.35 126.20 1n8q s TYR 782 Ca 0.02 0.30 -0.20 0.00 -1.01 0.00 0.00 57.07 56.18 1n8q s TYR 782 Cb -0.17 -1.90 0.08 0.00 -0.11 0.00 0.00 41.96 39.86 1n8q s TYR 782 CO -0.01 0.11 1.63 1.25 -1.11 0.00 0.00 175.55 177.42 1n8q h LEU 783 N 0.76 -0.69 -4.08 -1.29 5.85 -0.75 -2.24 115.31 112.87 1n8q h LEU 783 Ca -0.50 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1n8q h LEU 783 Cb 1.22 0.36 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1n8q h LEU 783 CO 0.61 -0.24 0.18 0.61 -0.34 0.00 0.00 178.44 179.26 1n8q n GLY 784 N -1.37 0.00 3.88 3.75 0.00 -1.26 -1.71 105.19 108.48 1n8q n GLY 784 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1n8q n GLY 784 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n8q n GLU 785 N 1.69 -0.93 -4.59 1.61 2.13 -1.26 -4.96 120.64 114.34 1n8q n GLU 785 Ca 0.00 0.07 -0.31 0.00 0.66 0.00 0.00 57.16 57.58 1n8q n GLU 785 Cb 0.09 -2.88 -0.12 0.00 0.27 0.00 0.00 31.44 28.80 1n8q n GLU 785 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1n8q s ARG 786 N -6.27 2.24 0.26 5.31 0.52 -0.70 -4.93 118.95 115.38 1n8q s ARG 786 Ca 0.10 -0.89 0.01 0.00 -0.52 0.00 0.00 55.73 54.43 1n8q s ARG 786 Cb -0.06 -2.30 -0.05 0.00 0.52 0.00 0.00 34.95 33.06 1n8q s ARG 786 CO 0.77 0.56 0.10 -0.51 0.02 0.00 0.00 175.30 176.24 1n8q s ASP 787 N -1.44 1.19 0.00 0.23 1.01 -1.26 -4.73 116.67 111.67 1n8q s ASP 787 Ca 0.16 -1.40 0.00 0.00 0.71 0.00 0.00 52.55 52.02 1n8q s ASP 787 Cb -0.11 0.18 0.00 0.00 1.01 0.00 0.00 42.92 44.01 1n8q s ASP 787 CO 0.06 -0.74 0.44 0.59 0.21 0.00 0.00 175.17 175.73 1n8q n ASN 788 N -0.49 0.00 0.00 0.27 5.03 -1.26 -5.00 115.26 113.81 1n8q n ASN 788 Ca 0.00 0.51 0.00 0.00 0.87 0.00 0.00 54.58 55.96 1n8q n ASN 788 Cb 0.66 -0.18 0.00 0.00 -1.02 0.00 0.00 39.78 39.24 1n8q n ASN 788 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1n8q n PRO 789 N -1.04 0.00 -2.71 3.52 -0.04 -1.26 -5.08 135.00 128.40 1n8q n PRO 789 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1n8q n PRO 789 Cb 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 33.54 1n8q n PRO 789 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1n8q n ASN 790 N -0.92 -2.11 0.33 3.54 3.02 -1.26 -5.06 115.26 112.80 1n8q n ASN 790 Ca 0.00 -2.99 0.21 0.00 -0.03 0.00 0.00 54.58 51.77 1n8q n ASN 790 Cb 0.00 1.60 1.12 0.00 -0.61 0.00 0.00 39.78 41.90 1n8q n ASN 790 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1n8q h TRP 791 N 3.07 0.00 -3.27 3.10 5.08 -1.98 -3.44 115.95 118.51 1n8q h TRP 791 Ca -0.17 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 59.70 1n8q h TRP 791 Cb 1.12 0.00 -0.17 0.00 -3.00 0.00 0.00 29.16 27.11 1n8q h TRP 791 CO 0.09 0.00 -0.25 -0.08 -1.28 0.00 0.00 178.44 176.92 1n8q s THR 792 N -4.19 0.08 -2.07 0.12 -1.32 -1.26 -4.89 115.64 102.11 1n8q s THR 792 Ca -0.05 -0.66 0.24 0.00 -1.21 0.00 0.00 61.69 60.02 1n8q s THR 792 Cb 0.12 -0.90 0.13 0.00 -1.51 0.00 0.00 72.50 70.35 1n8q s THR 792 CO 0.40 -0.36 1.30 -1.54 -2.21 0.00 0.00 174.62 172.21 1n8q n SER 793 N 0.67 1.77 -4.60 8.08 3.41 -1.07 -4.85 113.62 117.03 1n8q n SER 793 Ca -0.19 -1.36 -0.43 0.00 -0.26 0.00 0.00 58.87 56.63 1n8q n SER 793 Cb 0.59 0.29 -0.03 0.00 -0.26 0.00 0.00 64.21 64.81 1n8q n SER 793 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n8q s ASP 794 N -2.41 5.96 0.43 4.04 -1.08 -1.26 -4.90 116.67 117.44 1n8q s ASP 794 Ca 0.22 1.17 0.23 0.00 -0.52 0.00 0.00 52.55 53.66 1n8q s ASP 794 Cb 0.19 -2.53 0.84 0.00 -1.46 0.00 0.00 42.92 39.95 1n8q s ASP 794 CO 0.52 -1.68 1.79 0.71 0.52 0.00 0.00 175.17 177.03 1n8q h THR 795 N 6.74 0.55 -0.25 1.71 1.35 -2.00 -2.80 112.91 118.21 1n8q h THR 795 Ca -0.32 -1.20 -0.12 0.00 -0.55 0.00 0.00 66.41 64.22 1n8q h THR 795 Cb 1.16 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 69.39 1n8q h THR 795 CO 1.05 0.23 -0.33 0.03 -0.25 0.00 0.00 175.52 176.25 1n8q h ARG 796 N 0.00 0.54 -0.14 4.72 3.08 -1.99 -1.17 114.38 119.41 1n8q h ARG 796 Ca -0.00 -0.24 -0.18 0.00 0.07 0.00 0.00 59.98 59.63 1n8q h ARG 796 Cb 0.81 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.84 1n8q h ARG 796 CO 0.03 0.80 -0.66 0.00 -1.07 0.00 0.00 179.97 179.07 1n8q h ALA 797 N 1.19 0.58 -0.53 0.04 0.00 -1.92 -1.94 119.26 116.67 1n8q h ALA 797 Ca 0.05 -0.56 -0.07 0.00 0.00 0.00 0.00 54.91 54.33 1n8q h ALA 797 Cb 0.80 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1n8q h ALA 797 CO 0.06 0.72 0.05 -0.07 0.00 0.00 0.00 179.25 180.01 1n8q h LEU 798 N 0.40 0.88 -0.55 0.00 -0.00 -1.29 0.89 115.31 115.64 1n8q h LEU 798 Ca -0.02 -0.28 -0.09 0.00 -0.00 0.00 0.00 57.88 57.49 1n8q h LEU 798 Cb 1.23 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 41.64 1n8q h LEU 798 CO 0.12 0.94 -0.02 -0.33 -0.00 0.00 0.00 178.44 179.15 1n8q h GLU 799 N 0.79 0.99 -0.63 1.13 4.39 -1.23 0.68 114.58 120.70 1n8q h GLU 799 Ca 0.16 -0.33 -0.08 0.00 0.34 0.00 0.00 59.36 59.46 1n8q h GLU 799 Cb 0.46 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1n8q h GLU 799 CO 0.02 1.00 0.09 0.00 -1.16 0.00 0.00 179.01 178.96 1n8q h ALA 800 N 0.95 0.97 -0.57 3.43 0.00 -1.07 -1.56 119.26 121.42 1n8q h ALA 800 Ca 0.15 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1n8q h ALA 800 Cb 0.57 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1n8q h ALA 800 CO 0.03 0.64 0.09 0.35 0.00 0.00 0.00 179.25 180.37 1n8q h PHE 801 N 0.97 0.96 -0.50 0.00 3.57 -0.57 -1.90 116.94 119.47 1n8q h PHE 801 Ca 0.19 -0.12 0.05 0.00 3.53 0.00 0.00 57.97 61.63 1n8q h PHE 801 Cb 0.43 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 1n8q h PHE 801 CO 0.03 0.83 0.24 -0.22 -2.23 0.00 0.00 178.31 176.96 1n8q h LYS 802 N 0.87 0.45 -0.43 1.11 1.63 -0.52 -1.99 116.57 117.69 1n8q h LYS 802 Ca 0.18 -0.03 -0.05 0.00 -0.85 0.00 0.00 60.65 59.90 1n8q h LYS 802 Cb 0.39 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.89 1n8q h LYS 802 CO 0.01 0.30 0.07 0.00 -3.45 0.00 0.00 179.45 176.37 1n8q h ARG 803 N 0.47 0.66 -0.26 1.90 3.08 -0.96 -1.32 114.38 117.95 1n8q h ARG 803 Ca 0.23 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.15 1n8q h ARG 803 Cb 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1n8q h ARG 803 CO -0.18 0.64 0.16 0.35 -1.07 0.00 0.00 179.97 179.87 1n8q h PHE 804 N 0.64 0.31 -0.06 3.04 3.57 -0.91 -1.42 116.94 122.11 1n8q h PHE 804 Ca 0.14 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 1n8q h PHE 804 Cb 0.30 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1n8q h PHE 804 CO 0.01 0.19 -0.59 0.78 -2.23 0.00 0.00 178.31 176.47 1n8q h GLY 805 N 0.33 0.21 1.37 2.40 0.00 -0.85 -1.27 103.07 105.27 1n8q h GLY 805 Ca 0.10 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.11 1n8q h GLY 805 CO -0.03 0.23 0.03 3.43 0.00 0.00 0.00 176.54 180.20 1n8q h ASN 806 N 0.15 0.73 -0.60 0.19 2.35 -1.17 -0.38 115.58 116.85 1n8q h ASN 806 Ca -0.00 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.57 1n8q h ASN 806 Cb 1.08 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.22 1n8q h ASN 806 CO 0.09 0.78 0.31 0.50 -1.65 0.00 0.00 177.43 177.46 1n8q h LYS 807 N 0.73 0.85 -0.67 0.81 3.64 -1.12 -1.87 116.57 118.94 1n8q h LYS 807 Ca 0.15 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1n8q h LYS 807 Cb 0.40 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1n8q h LYS 807 CO 0.01 0.67 0.31 -0.07 -2.27 0.00 0.00 179.45 178.10 1n8q h LEU 808 N 0.81 0.90 -0.94 5.20 4.07 -0.53 0.32 115.31 125.14 1n8q h LEU 808 Ca 0.21 -0.15 -0.09 0.00 0.08 0.00 0.00 57.88 57.93 1n8q h LEU 808 Cb 0.09 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 1n8q h LEU 808 CO -0.03 0.79 -0.20 0.00 -1.08 0.00 0.00 178.44 177.93 1n8q h ALA 809 N 1.14 1.11 -0.18 1.53 0.00 -0.93 -0.40 119.26 121.53 1n8q h ALA 809 Ca 0.23 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 1n8q h ALA 809 Cb 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1n8q h ALA 809 CO -0.03 0.55 -0.54 0.37 0.00 0.00 0.00 179.25 179.60 1n8q h GLN 810 N 0.49 0.54 -0.52 0.00 4.15 -1.15 -2.93 115.11 115.70 1n8q h GLN 810 Ca 0.08 -0.34 -0.07 0.00 0.77 0.00 0.00 58.65 59.09 1n8q h GLN 810 Cb 0.62 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.33 1n8q h GLN 810 CO 0.04 0.94 0.07 0.82 -1.93 0.00 0.00 178.83 178.77 1n8q h ILE 811 N 0.42 1.25 -0.83 2.39 2.04 -0.46 -2.18 117.51 120.14 1n8q h ILE 811 Ca 0.01 -0.98 0.11 0.00 1.00 0.00 0.00 64.86 65.00 1n8q h ILE 811 Cb 1.08 0.88 -0.08 0.00 -0.74 0.00 0.00 36.82 37.96 1n8q h ILE 811 CO 0.10 0.35 0.46 -0.08 0.00 0.00 0.00 178.15 178.98 1n8q h GLU 812 N 0.75 0.70 -0.64 2.37 4.81 -1.04 -0.37 114.58 121.16 1n8q h GLU 812 Ca 0.15 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 1n8q h GLU 812 Cb 0.43 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 1n8q h GLU 812 CO 0.01 0.47 0.11 -0.91 -0.73 0.00 0.00 179.01 177.96 1n8q h ASN 813 N 0.72 1.02 -0.79 1.04 -0.26 -1.32 -1.06 115.58 114.94 1n8q h ASN 813 Ca 0.42 -0.26 -0.02 0.00 -0.56 0.00 0.00 56.30 55.89 1n8q h ASN 813 Cb 0.47 -0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 37.42 1n8q h ASN 813 CO -0.29 1.02 0.44 0.50 -1.06 0.00 0.00 177.43 178.04 1n8q h LYS 814 N 0.98 1.11 -0.09 0.81 3.64 -0.68 -1.48 116.57 120.86 1n8q h LYS 814 Ca 0.20 -0.12 -0.18 0.00 -1.27 0.00 0.00 60.65 59.27 1n8q h LYS 814 Cb 0.43 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1n8q h LYS 814 CO 0.01 0.81 -0.65 -0.07 -2.27 0.00 0.00 179.45 177.29 1n8q h LEU 815 N 1.11 0.72 -0.87 5.20 4.07 -0.89 -2.02 115.31 122.63 1n8q h LEU 815 Ca 0.28 -0.67 0.07 0.00 0.08 0.00 0.00 57.88 57.64 1n8q h LEU 815 Cb 0.02 -0.21 -0.07 0.00 1.08 0.00 0.00 40.66 41.48 1n8q h LEU 815 CO -0.05 1.28 0.54 0.28 -1.08 0.00 0.00 178.44 179.41 1n8q h SER 816 N 0.21 0.83 -0.64 -0.43 0.02 -1.10 -1.62 113.55 110.83 1n8q h SER 816 Ca -0.06 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1n8q h SER 816 Cb 1.30 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 63.64 1n8q h SER 816 CO 0.13 0.51 0.36 -0.33 -1.14 0.00 0.00 176.83 176.36 1n8q h GLU 817 N 0.95 0.65 -0.42 3.45 5.08 -1.10 -2.50 114.58 120.70 1n8q h GLU 817 Ca 0.39 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.68 1n8q h GLU 817 Cb 0.23 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1n8q h GLU 817 CO -0.19 0.43 0.10 0.00 -1.00 0.00 0.00 179.01 178.35 1n8q h ARG 818 N 0.67 0.62 0.00 2.33 3.08 -0.56 -2.05 114.38 118.46 1n8q h ARG 818 Ca 0.28 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 1n8q h ARG 818 Cb 0.15 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1n8q h ARG 818 CO -0.17 0.56 -0.11 -0.91 -1.07 0.00 0.00 179.97 178.28 1n8q h ASN 819 N 0.60 0.00 -0.28 7.04 -0.26 -0.94 -2.51 115.58 119.24 1n8q h ASN 819 Ca 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.88 1n8q h ASN 819 Cb 0.23 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 1n8q h ASN 819 CO -0.00 0.11 0.00 0.59 -1.06 0.00 0.00 177.43 177.06 1n8q n ASN 820 N -3.52 2.38 -4.56 5.81 4.13 -0.78 -4.86 115.26 113.86 1n8q n ASN 820 Ca -0.01 -1.85 -0.42 0.00 1.68 0.00 0.00 54.58 53.98 1n8q n ASN 820 Cb 0.25 -0.18 -0.07 0.00 -1.54 0.00 0.00 39.78 38.24 1n8q n ASN 820 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1n8q s ASP 821 N -1.47 6.38 0.43 6.41 -1.08 -0.95 -4.93 116.67 121.46 1n8q s ASP 821 Ca 0.34 0.02 0.13 0.00 -0.52 0.00 0.00 52.55 52.52 1n8q s ASP 821 Cb 0.19 -2.31 0.95 0.00 -1.46 0.00 0.00 42.92 40.30 1n8q s ASP 821 CO 0.27 -0.59 1.99 1.05 0.52 0.00 0.00 175.17 178.41 1n8q h GLU 822 N 8.52 0.11 0.00 4.34 9.09 -1.89 -1.72 114.58 133.03 1n8q h GLU 822 Ca -0.27 -0.02 -0.05 0.00 0.05 0.00 0.00 59.36 59.08 1n8q h GLU 822 Cb 1.11 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.19 1n8q h GLU 822 CO 0.83 0.23 -0.22 0.87 0.05 0.00 0.00 179.01 180.77 1n8q h LYS 823 N 0.11 0.00 -3.74 1.06 1.57 -1.96 -3.36 116.57 110.24 1n8q h LYS 823 Ca 0.02 0.00 -0.75 0.00 -1.87 0.00 0.00 60.65 58.05 1n8q h LYS 823 Cb 0.28 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.43 1n8q h LYS 823 CO 0.02 0.22 1.95 1.28 -0.57 0.00 0.00 179.45 182.35 1n8q n LEU 824 N -4.24 6.41 0.18 2.94 4.77 -0.65 -4.83 117.00 121.57 1n8q n LEU 824 Ca -0.02 -4.60 0.12 0.00 -0.03 0.00 0.00 56.01 51.48 1n8q n LEU 824 Cb 0.28 -1.51 0.65 0.00 -2.33 0.00 0.00 43.42 40.52 1n8q n LEU 824 CO 0.37 1.25 1.11 -0.09 -1.33 0.00 0.00 177.39 178.70 1n8q h ARG 825 N 5.99 0.00 0.00 3.23 1.12 -1.82 -2.42 114.38 120.49 1n8q h ARG 825 Ca 0.39 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.26 1n8q h ARG 825 Cb 0.67 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.63 1n8q h ARG 825 CO 1.57 0.00 0.00 0.09 -3.11 0.00 0.00 179.97 178.52 1n8q n ASN 826 N -4.49 0.07 0.22 -3.80 3.02 -1.26 -1.32 115.26 107.70 1n8q n ASN 826 Ca 0.01 0.51 0.12 0.00 -0.03 0.00 0.00 54.58 55.19 1n8q n ASN 826 Cb 0.25 -0.53 0.20 0.00 -0.61 0.00 0.00 39.78 39.09 1n8q n ASN 826 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1n8q h ARG 827 N 0.00 0.00 0.00 3.52 3.08 -1.77 -3.41 114.38 115.80 1n8q h ARG 827 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1n8q h ARG 827 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1n8q h ARG 827 CO 0.00 0.00 -0.64 0.00 -1.07 0.00 0.00 179.97 178.26 1n8q n GLY 829 N 2.69 -2.14 0.11 0.00 0.00 -0.43 -1.61 105.19 103.80 1n8q n GLY 829 Ca 0.00 -1.45 0.10 0.00 0.00 0.00 0.00 46.02 44.67 1n8q n GLY 829 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n8q n PRO 830 N -1.22 0.15 0.00 1.61 -0.04 -1.26 -1.87 135.00 132.37 1n8q n PRO 830 Ca 0.00 0.43 0.12 0.00 -0.04 0.00 0.00 63.50 64.02 1n8q n PRO 830 Cb 0.08 -1.81 0.27 0.00 -0.04 0.00 0.00 33.50 32.00 1n8q n PRO 830 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1n8q n VAL 831 N -2.09 0.00 -3.89 0.52 3.14 -1.26 -4.84 118.33 109.91 1n8q n VAL 831 Ca 0.02 -0.07 -0.35 0.00 -2.96 0.00 0.00 64.34 60.98 1n8q n VAL 831 Cb 0.18 0.41 0.01 0.00 -1.06 0.00 0.00 33.84 33.38 1n8q n VAL 831 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1n8q n GLN 832 N -1.04 -1.31 -3.85 1.45 6.02 -0.78 -4.61 117.38 113.26 1n8q n GLN 832 Ca 0.09 0.31 -0.29 0.00 -0.01 0.00 0.00 57.00 57.10 1n8q n GLN 832 Cb 0.35 -3.69 -0.13 0.00 1.02 0.00 0.00 30.24 27.80 1n8q n GLN 832 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1n8q s MET 833 N -6.62 2.07 0.10 -1.09 1.75 -0.64 -4.91 119.30 109.97 1n8q s MET 833 Ca 0.36 -2.90 -0.36 0.00 -1.25 0.00 0.00 55.69 51.54 1n8q s MET 833 Cb -0.16 -3.10 -0.16 0.00 2.84 0.00 0.00 34.83 34.25 1n8q s MET 833 CO 0.91 -1.23 1.35 -2.30 -0.65 0.00 0.00 175.02 173.10 1n8q n PRO 834 N 2.53 1.27 -2.28 4.11 -0.02 -1.26 -4.38 135.00 134.98 1n8q n PRO 834 Ca 0.15 0.46 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 1n8q n PRO 834 Cb 0.35 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.70 1n8q n PRO 834 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1n8q s TYR 835 N 0.46 1.95 -0.63 6.00 5.04 0.21 -4.78 117.35 125.60 1n8q s TYR 835 Ca 0.83 0.38 0.06 0.00 -2.44 0.00 0.00 57.07 55.90 1n8q s TYR 835 Cb -0.91 -4.34 0.10 0.00 0.35 0.00 0.00 41.96 37.16 1n8q s TYR 835 CO 0.46 -2.19 0.89 0.25 -1.34 0.00 0.00 175.55 173.62 1n8q n THR 836 N 6.85 0.45 0.30 4.34 -2.24 -1.26 -4.72 114.28 118.00 1n8q n THR 836 Ca 0.13 -0.73 0.19 0.00 -2.27 0.00 0.00 64.05 61.38 1n8q n THR 836 Cb 0.51 0.84 1.00 0.00 -2.10 0.00 0.00 70.33 70.57 1n8q n THR 836 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1n8q h LEU 837 N 1.13 0.00 -3.03 3.22 5.85 -1.78 -1.16 115.31 119.54 1n8q h LEU 837 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1n8q h LEU 837 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1n8q h LEU 837 CO 0.00 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.28 1n8q n LEU 838 N -3.25 3.50 -4.68 2.25 4.32 -1.26 -4.27 117.00 113.61 1n8q n LEU 838 Ca -0.02 -2.38 -0.42 0.00 -0.02 0.00 0.00 56.01 53.17 1n8q n LEU 838 Cb 0.22 -0.38 -0.03 0.00 -1.62 0.00 0.00 43.42 41.61 1n8q n LEU 838 CO 0.20 0.73 1.10 -0.76 -1.22 0.00 0.00 177.39 177.45 1n8q s LEU 839 N -1.69 4.27 0.26 2.23 1.02 -0.44 -4.93 118.68 119.41 1n8q s LEU 839 Ca 0.33 1.95 -0.05 0.00 0.02 0.00 0.00 54.13 56.39 1n8q s LEU 839 Cb 0.22 -3.55 0.31 0.00 0.02 0.00 0.00 46.19 43.19 1n8q s LEU 839 CO 0.15 -0.72 1.88 -0.65 0.02 0.00 0.00 176.35 177.03 1n8q h PRO 840 N 8.04 1.14 -6.24 1.29 0.11 -1.90 0.66 132.00 135.11 1n8q h PRO 840 Ca -0.34 -0.13 -0.49 0.00 0.11 0.00 0.00 66.00 65.14 1n8q h PRO 840 Cb 1.16 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 1n8q h PRO 840 CO 0.92 0.84 -0.37 -1.12 -0.21 0.00 0.00 178.00 178.06 1n8q s SER 841 N -6.32 6.33 0.17 -2.05 0.01 -1.26 -1.04 113.70 109.54 1n8q s SER 841 Ca -0.12 0.24 -0.22 0.00 1.31 0.00 0.00 55.95 57.15 1n8q s SER 841 Cb 0.17 -1.94 0.06 0.00 0.21 0.00 0.00 66.02 64.53 1n8q s SER 841 CO 0.82 -0.09 0.59 -0.55 0.41 0.00 0.00 173.24 174.42 1n8q s SER 842 N -3.69 -0.53 -0.05 2.44 0.15 -1.26 -3.71 113.70 107.06 1n8q s SER 842 Ca 0.36 -0.07 -0.07 0.00 0.70 0.00 0.00 55.95 56.87 1n8q s SER 842 Cb -0.10 0.60 -0.29 0.00 -1.71 0.00 0.00 66.02 64.52 1n8q s SER 842 CO 0.30 -0.99 0.66 0.50 1.20 0.00 0.00 173.24 174.92 1n8q h LYS 843 N 2.03 0.32 0.00 5.44 3.11 -1.99 -3.50 116.57 121.99 1n8q h LYS 843 Ca -0.33 -0.55 0.00 0.00 -2.81 0.00 0.00 60.65 56.96 1n8q h LYS 843 Cb 1.30 0.21 0.00 0.00 -1.00 0.00 0.00 32.23 32.74 1n8q h LYS 843 CO 0.38 1.22 0.00 -1.91 -2.81 0.00 0.00 179.45 176.33 1n8q n GLU 844 N -3.52 0.00 0.00 1.90 2.13 -1.26 -4.90 120.64 115.00 1n8q n GLU 844 Ca -0.24 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.58 1n8q n GLU 844 Cb 1.06 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.77 1n8q n GLU 844 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1n8q n GLY 845 N -1.34 -0.58 3.47 8.31 0.00 -0.40 -4.72 105.19 109.93 1n8q n GLY 845 Ca 0.00 -1.88 -0.44 0.00 0.00 0.00 0.00 46.02 43.70 1n8q n GLY 845 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n8q s LEU 846 N 0.00 4.98 -0.07 0.99 1.98 -1.26 -1.56 118.68 123.74 1n8q s LEU 846 Ca 0.00 -2.88 0.03 0.00 -2.89 0.00 0.00 54.13 48.39 1n8q s LEU 846 Cb 0.00 -2.41 -0.02 0.00 0.66 0.00 0.00 46.19 44.42 1n8q s LEU 846 CO 0.00 -0.80 -0.16 -0.89 -1.89 0.00 0.00 176.35 172.61 1n8q s THR 847 N 1.82 2.85 -0.54 3.68 2.01 -1.26 -4.99 115.64 119.21 1n8q s THR 847 Ca 0.42 -0.78 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 1n8q s THR 847 Cb -0.03 -2.13 0.34 0.00 0.01 0.00 0.00 72.50 70.70 1n8q s THR 847 CO -0.00 0.57 2.06 0.33 -0.69 0.00 0.00 174.62 176.88 1n8q n PHE 848 N 2.80 2.55 -3.77 4.92 7.35 -1.26 -4.88 117.46 125.17 1n8q n PHE 848 Ca -0.17 -2.58 -0.09 0.00 -0.76 0.00 0.00 57.45 53.85 1n8q n PHE 848 Cb 0.52 -1.26 -0.03 0.00 0.35 0.00 0.00 39.48 39.06 1n8q n PHE 848 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 1n8q s ARG 849 N -3.04 1.53 0.00 -4.13 1.70 -1.26 -2.40 118.95 111.35 1n8q s ARG 849 Ca 0.52 -0.90 0.00 0.00 -0.47 0.00 0.00 55.73 54.88 1n8q s ARG 849 Cb 0.41 0.56 0.00 0.00 -0.57 0.00 0.00 34.95 35.34 1n8q s ARG 849 CO -0.04 -0.67 0.00 0.41 -1.08 0.00 0.00 175.30 173.92 1n8q n GLY 850 N -0.39 2.01 3.19 3.88 0.00 0.22 -4.77 105.19 109.32 1n8q n GLY 850 Ca -0.08 -1.16 -0.38 0.00 0.00 0.00 0.00 46.02 44.40 1n8q n GLY 850 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n8q s ILE 851 N 0.00 3.76 0.67 -0.61 1.01 -0.21 -4.91 121.20 120.91 1n8q s ILE 851 Ca 0.00 -1.76 -0.16 0.00 0.00 0.00 0.00 60.65 58.72 1n8q s ILE 851 Cb 0.00 -3.45 0.01 0.00 0.01 0.00 0.00 42.46 39.03 1n8q s ILE 851 CO 0.00 -0.62 1.18 -2.84 0.00 0.00 0.00 174.94 172.66 1n8q s PRO 852 N 1.28 2.56 0.53 2.79 0.02 -1.26 -0.14 135.00 140.78 1n8q s PRO 852 Ca 0.05 1.69 0.23 0.00 0.02 0.00 0.00 61.00 62.99 1n8q s PRO 852 Cb -0.24 -1.89 1.38 0.00 0.02 0.00 0.00 34.50 33.78 1n8q s PRO 852 CO -0.01 -1.50 2.04 -0.91 -0.33 0.00 0.00 177.00 176.29 1n8q h ASN 853 N 0.15 0.00 -5.45 2.53 2.35 -1.55 -3.40 115.58 110.21 1n8q h ASN 853 Ca -0.48 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.01 1n8q h ASN 853 Cb 1.28 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.50 1n8q h ASN 853 CO 0.52 0.00 -0.62 -0.94 -1.65 0.00 0.00 177.43 174.74 1n8q s SER 854 N -6.39 0.28 -0.70 5.81 1.04 -1.24 -3.97 113.70 108.54 1n8q s SER 854 Ca -0.05 -1.39 -0.27 0.00 0.48 0.00 0.00 55.95 54.72 1n8q s SER 854 Cb 0.19 0.35 0.03 0.00 0.10 0.00 0.00 66.02 66.69 1n8q s SER 854 CO 0.70 -0.83 1.24 -0.63 0.98 0.00 0.00 173.24 174.71 1n8q s ILE 855 N -4.11 3.82 -0.70 -1.02 1.01 -1.13 -4.76 121.20 114.31 1n8q s ILE 855 Ca 0.39 0.50 0.08 0.00 0.00 0.00 0.00 60.65 61.63 1n8q s ILE 855 Cb 0.07 -4.86 -0.01 0.00 0.01 0.00 0.00 42.46 37.67 1n8q s ILE 855 CO 0.12 -1.71 0.53 -1.54 0.00 0.00 0.00 174.94 172.35 1n8q n SER 856 N 9.07 0.99 0.00 3.58 3.41 -1.26 -3.07 113.62 126.33 1n8q n SER 856 Ca 0.04 -0.99 0.00 0.00 -0.26 0.00 0.00 58.87 57.66 1n8q n SER 856 Cb 0.49 0.54 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 1n8q n SER 856 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88