#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4e s VAL 16 N 0.00 5.24 0.16 2.53 1.01 -1.26 -5.07 120.40 123.00 1a4e s VAL 16 Ca 0.00 0.12 -0.31 0.00 0.00 0.00 0.00 61.98 61.79 1a4e s VAL 16 Cb 0.00 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 32.95 1a4e s VAL 16 CO 0.00 0.51 1.44 0.00 0.00 0.00 0.00 175.10 177.05 1a4e s ARG 17 N -0.13 4.29 0.53 2.72 1.70 -1.26 -4.94 118.95 121.87 1a4e s ARG 17 Ca 0.09 2.18 0.29 0.00 -0.47 0.00 0.00 55.73 57.83 1a4e s ARG 17 Cb -0.12 -3.20 1.48 0.00 -0.57 0.00 0.00 34.95 32.55 1a4e s ARG 17 CO 0.00 -0.46 2.07 0.93 -1.08 0.00 0.00 175.30 176.76 1a4e h GLU 18 N 6.40 0.00 0.00 3.89 5.08 -2.00 -1.21 114.58 126.74 1a4e h GLU 18 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1a4e h GLU 18 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1a4e h GLU 18 CO 0.86 0.11 0.00 -0.40 -1.00 0.00 0.00 179.01 178.57 1a4e n ASP 19 N -3.53 0.00 -3.66 1.42 5.75 -1.26 -4.95 116.55 110.32 1a4e n ASP 19 Ca -0.02 0.33 -0.28 0.00 -0.01 0.00 0.00 54.79 54.82 1a4e n ASP 19 Cb 0.24 -0.44 0.02 0.00 -1.03 0.00 0.00 41.12 39.91 1a4e n ASP 19 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1a4e n ARG 20 N -1.44 -4.68 -2.58 0.11 1.74 -0.46 -4.95 116.66 104.40 1a4e n ARG 20 Ca 0.09 0.59 -0.43 0.00 -0.77 0.00 0.00 57.85 57.33 1a4e n ARG 20 Cb 0.30 -5.41 -0.02 0.00 -1.02 0.00 0.00 32.46 26.30 1a4e n ARG 20 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1a4e s VAL 21 N -3.17 4.54 -0.05 1.55 1.01 -1.26 -5.00 120.40 118.02 1a4e s VAL 21 Ca 0.55 1.84 -0.29 0.00 0.00 0.00 0.00 61.98 64.07 1a4e s VAL 21 Cb -0.28 -4.18 -0.02 0.00 0.00 0.00 0.00 36.38 31.90 1a4e s VAL 21 CO 0.68 -0.03 0.98 -0.69 0.00 0.00 0.00 175.10 176.04 1a4e s VAL 22 N 2.34 4.84 0.39 2.92 1.01 -1.26 -5.01 120.40 125.63 1a4e s VAL 22 Ca 0.51 2.03 0.04 0.00 0.00 0.00 0.00 61.98 64.55 1a4e s VAL 22 Cb -0.20 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 31.82 1a4e s VAL 22 CO 0.18 0.09 0.06 0.42 0.00 0.00 0.00 175.10 175.85 1a4e s THR 23 N 1.48 1.14 0.04 3.92 -4.23 -1.26 -1.56 115.64 115.16 1a4e s THR 23 Ca 0.50 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1a4e s THR 23 Cb -0.20 -2.60 0.01 0.00 1.34 0.00 0.00 72.50 71.05 1a4e s THR 23 CO 0.23 0.00 0.05 -0.46 -0.54 0.00 0.00 174.62 173.90 1a4e n ASN 24 N -0.99 0.04 0.12 3.99 0.23 -0.40 -4.81 115.26 113.44 1a4e n ASN 24 Ca -0.06 -1.04 0.07 0.00 -0.53 0.00 0.00 54.58 53.02 1a4e n ASN 24 Cb 0.66 -0.04 0.55 0.00 -2.08 0.00 0.00 39.78 38.87 1a4e n ASN 24 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1a4e h SER 25 N -0.05 0.21 -0.76 0.53 0.02 -1.95 -2.38 113.55 109.18 1a4e h SER 25 Ca -0.02 -0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.63 1a4e h SER 25 Cb 0.06 -0.05 -0.18 0.00 0.14 0.00 0.00 62.40 62.37 1a4e h SER 25 CO 0.02 0.15 0.37 0.35 -1.14 0.00 0.00 176.83 176.58 1a4e n THR 26 N -4.50 2.80 -0.98 -2.27 -2.24 -1.26 -4.93 114.28 100.91 1a4e n THR 26 Ca 0.01 -1.55 0.00 0.00 -2.27 0.00 0.00 64.05 60.24 1a4e n THR 26 Cb 0.13 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1a4e n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a4e n GLY 27 N -0.41 0.34 3.70 3.38 0.00 -0.90 -5.00 105.19 106.30 1a4e n GLY 27 Ca 0.43 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 1a4e n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a4e s ASN 28 N -2.06 7.26 0.24 1.61 0.02 -1.26 -4.76 114.94 115.98 1a4e s ASN 28 Ca 0.00 1.53 -0.30 0.00 -1.02 0.00 0.00 52.86 53.06 1a4e s ASN 28 Cb 0.00 -2.53 -0.10 0.00 0.02 0.00 0.00 41.25 38.64 1a4e s ASN 28 CO 0.00 -0.28 1.46 -2.84 0.02 0.00 0.00 177.10 175.47 1a4e s PRO 29 N 1.22 4.25 -0.17 -0.60 0.02 -1.26 -1.28 135.00 137.18 1a4e s PRO 29 Ca 0.48 2.32 -0.18 0.00 0.02 0.00 0.00 61.00 63.64 1a4e s PRO 29 Cb -0.20 -3.11 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 1a4e s PRO 29 CO 0.24 -0.46 0.47 0.42 -0.33 0.00 0.00 177.00 177.34 1a4e s ILE 30 N 0.18 5.16 0.13 2.83 1.01 -0.60 -4.89 121.20 125.01 1a4e s ILE 30 Ca 0.61 0.89 -0.19 0.00 0.00 0.00 0.00 60.65 61.96 1a4e s ILE 30 Cb -0.42 -3.80 -0.05 0.00 0.01 0.00 0.00 42.46 38.19 1a4e s ILE 30 CO 0.41 0.24 1.78 0.78 0.00 0.00 0.00 174.94 178.16 1a4e h ASN 31 N 7.20 0.29 -3.45 3.58 -0.26 -1.94 -3.45 115.58 117.55 1a4e h ASN 31 Ca -0.37 -0.01 -0.16 0.00 -0.56 0.00 0.00 56.30 55.20 1a4e h ASN 31 Cb 1.16 -0.07 -0.28 0.00 -1.06 0.00 0.00 38.32 38.07 1a4e h ASN 31 CO 0.74 0.21 -0.40 -0.70 -1.06 0.00 0.00 177.43 176.22 1a4e s GLU 32 N -6.15 0.29 0.34 0.81 -6.30 -1.26 -5.09 118.70 101.34 1a4e s GLU 32 Ca -0.13 0.57 0.06 0.00 -2.50 0.00 0.00 54.97 52.97 1a4e s GLU 32 Cb 0.09 -0.02 0.72 0.00 0.00 0.00 0.00 34.13 34.92 1a4e s GLU 32 CO 0.70 -0.13 1.89 -1.00 0.02 0.00 0.00 175.26 176.74 1a4e h PRO 33 N 6.77 0.78 -0.03 4.30 0.13 -2.01 -3.26 132.00 138.67 1a4e h PRO 33 Ca -0.36 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1a4e h PRO 33 Cb 1.17 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1a4e h PRO 33 CO 0.34 0.51 0.00 1.19 -0.23 0.00 0.00 178.00 179.81 1a4e n PHE 34 N -4.53 0.04 -2.11 1.56 3.72 -1.26 -5.04 117.46 109.84 1a4e n PHE 34 Ca 0.15 -0.34 -0.41 0.00 -0.05 0.00 0.00 57.45 56.80 1a4e n PHE 34 Cb 0.35 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 38.84 1a4e n PHE 34 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1a4e s VAL 35 N -0.72 2.80 -0.01 -4.37 -7.23 -1.23 -5.03 120.40 104.60 1a4e s VAL 35 Ca 0.03 0.73 0.03 0.00 -1.81 0.00 0.00 61.98 60.96 1a4e s VAL 35 Cb 0.01 -3.46 -0.01 0.00 0.56 0.00 0.00 36.38 33.48 1a4e s VAL 35 CO 0.02 0.14 -0.11 0.42 -0.31 0.00 0.00 175.10 175.26 1a4e s THR 36 N -0.54 0.87 0.17 5.32 -4.23 -1.26 -4.95 115.64 111.02 1a4e s THR 36 Ca 0.54 -0.46 -0.30 0.00 -1.18 0.00 0.00 61.69 60.29 1a4e s THR 36 Cb -0.40 -0.73 -0.08 0.00 1.34 0.00 0.00 72.50 72.63 1a4e s THR 36 CO 0.47 0.25 1.12 -1.10 -0.54 0.00 0.00 174.62 174.82 1a4e s GLN 37 N -0.18 4.57 0.20 3.99 -0.21 -1.26 -5.05 119.66 121.72 1a4e s GLN 37 Ca 0.03 1.74 -0.14 0.00 0.02 0.00 0.00 55.36 57.01 1a4e s GLN 37 Cb -0.05 -3.28 0.01 0.00 1.00 0.00 0.00 33.01 30.69 1a4e s GLN 37 CO -0.00 0.04 0.44 -0.98 -2.12 0.00 0.00 175.29 172.66 1a4e s ARG 38 N -0.29 1.35 -0.22 2.91 1.70 -1.26 -2.03 118.95 121.11 1a4e s ARG 38 Ca 0.50 -1.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.41 1a4e s ARG 38 Cb -0.30 0.46 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 1a4e s ARG 38 CO 0.35 -0.55 1.10 0.42 -1.08 0.00 0.00 175.30 175.54 1a4e s ILE 39 N -3.94 4.55 0.00 4.99 -1.09 -1.14 -4.78 121.20 119.79 1a4e s ILE 39 Ca 0.15 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.44 1a4e s ILE 39 Cb 0.00 -4.24 0.00 0.00 -1.58 0.00 0.00 42.46 36.65 1a4e s ILE 39 CO 0.01 -0.20 0.00 0.61 -1.23 0.00 0.00 174.94 174.13 1a4e n GLY 40 N 3.47 0.41 0.05 6.18 0.00 -1.26 -1.72 105.19 112.31 1a4e n GLY 40 Ca 0.13 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.39 1a4e n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a4e n GLU 41 N 0.00 0.65 -1.02 1.61 1.02 -1.26 -4.61 120.64 117.03 1a4e n GLU 41 Ca 0.00 -0.09 0.03 0.00 -0.02 0.00 0.00 57.16 57.08 1a4e n GLU 41 Cb 0.00 -1.59 0.04 0.00 -0.02 0.00 0.00 31.44 29.86 1a4e n GLU 41 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1a4e n HIS 42 N -2.44 0.00 -2.47 -0.32 8.25 -1.26 -5.02 115.22 111.95 1a4e n HIS 42 Ca -0.08 -0.44 -0.18 0.00 -0.26 0.00 0.00 57.72 56.75 1a4e n HIS 42 Cb 0.67 -0.13 0.10 0.00 1.12 0.00 0.00 29.99 31.75 1a4e n HIS 42 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a4e n GLY 43 N 0.10 0.52 3.76 -1.41 0.00 -0.70 -5.04 105.19 102.42 1a4e n GLY 43 Ca 0.06 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 1a4e n GLY 43 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a4e s PRO 44 N -4.56 2.69 0.38 1.61 0.04 -1.26 -4.37 135.00 129.52 1a4e s PRO 44 Ca 0.52 1.54 -0.26 0.00 0.04 0.00 0.00 61.00 62.84 1a4e s PRO 44 Cb -0.03 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 1a4e s PRO 44 CO 0.35 -1.36 1.16 -0.51 0.04 0.00 0.00 177.00 176.67 1a4e s LEU 45 N -4.78 4.26 -0.01 -3.56 1.02 -1.26 -2.89 118.68 111.45 1a4e s LEU 45 Ca 0.70 2.33 -0.10 0.00 0.02 0.00 0.00 54.13 57.08 1a4e s LEU 45 Cb -0.24 -3.95 -0.05 0.00 0.02 0.00 0.00 46.19 41.97 1a4e s LEU 45 CO 0.40 -0.57 0.32 -0.76 0.02 0.00 0.00 176.35 175.76 1a4e s LEU 46 N -2.31 4.41 0.36 1.79 1.43 -0.86 -4.97 118.68 118.53 1a4e s LEU 46 Ca 0.55 0.74 0.03 0.00 -1.03 0.00 0.00 54.13 54.42 1a4e s LEU 46 Cb -0.31 -2.58 0.66 0.00 0.03 0.00 0.00 46.19 43.99 1a4e s LEU 46 CO 0.39 0.29 1.98 0.25 0.23 0.00 0.00 176.35 179.50 1a4e h LEU 47 N 4.39 0.63 0.00 1.79 6.46 -1.96 -3.00 115.31 123.62 1a4e h LEU 47 Ca -0.51 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.20 1a4e h LEU 47 Cb 1.21 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.98 1a4e h LEU 47 CO 0.63 0.51 0.00 0.00 -0.62 0.00 0.00 178.44 178.96 1a4e n GLN 48 N -4.40 0.21 -2.76 1.25 10.64 -1.26 -4.30 117.38 116.76 1a4e n GLN 48 Ca 0.04 0.09 -0.43 0.00 -1.83 0.00 0.00 57.00 54.87 1a4e n GLN 48 Cb 0.10 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 27.97 1a4e n GLN 48 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1a4e s ASP 49 N -2.24 6.80 0.46 2.61 -1.08 -1.14 -4.77 116.67 117.31 1a4e s ASP 49 Ca 0.11 -2.33 0.25 0.00 -0.52 0.00 0.00 52.55 50.07 1a4e s ASP 49 Cb 0.06 -2.48 0.99 0.00 -1.46 0.00 0.00 42.92 40.02 1a4e s ASP 49 CO 0.11 -1.08 1.85 0.10 0.52 0.00 0.00 175.17 176.67 1a4e h TYR 50 N 8.16 0.00 -0.06 -5.34 -0.00 -1.90 -2.99 116.97 114.84 1a4e h TYR 50 Ca 0.30 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.89 1a4e h TYR 50 Cb 0.93 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.65 1a4e h TYR 50 CO 1.24 0.19 -0.57 -0.91 -0.00 0.00 0.00 178.16 178.11 1a4e h ASN 51 N 0.00 0.20 -0.10 0.10 2.35 -1.96 -0.78 115.58 115.39 1a4e h ASN 51 Ca -0.00 -0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.58 1a4e h ASN 51 Cb 0.71 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 39.02 1a4e h ASN 51 CO 0.02 0.73 -0.16 0.25 -1.65 0.00 0.00 177.43 176.62 1a4e h LEU 52 N 0.14 0.31 -1.08 1.61 5.85 -1.90 -2.67 115.31 117.57 1a4e h LEU 52 Ca -0.00 -0.54 -0.08 0.00 0.84 0.00 0.00 57.88 58.10 1a4e h LEU 52 Cb 1.05 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 1a4e h LEU 52 CO 0.09 0.80 -0.19 0.40 -0.34 0.00 0.00 178.44 179.19 1a4e h ILE 53 N -0.16 1.24 -0.34 4.05 2.04 -1.53 -0.95 117.51 121.86 1a4e h ILE 53 Ca 0.01 -1.11 -0.00 0.00 1.00 0.00 0.00 64.86 64.75 1a4e h ILE 53 Cb 0.73 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1a4e h ILE 53 CO 0.04 0.35 0.21 -0.78 0.00 0.00 0.00 178.15 177.97 1a4e h ASP 54 N 0.38 0.41 -0.14 1.72 3.58 -1.14 -0.01 116.42 121.23 1a4e h ASP 54 Ca 0.06 -0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 1a4e h ASP 54 Cb 0.56 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.51 1a4e h ASP 54 CO 0.04 0.33 -0.04 -1.28 -2.88 0.00 0.00 179.24 175.41 1a4e h SER 55 N 0.45 0.27 -0.30 2.28 0.87 -1.27 -2.26 113.55 113.58 1a4e h SER 55 Ca 0.12 -0.38 -0.14 0.00 -1.23 0.00 0.00 61.79 60.16 1a4e h SER 55 Cb -0.00 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1a4e h SER 55 CO -0.02 0.59 -0.32 -0.07 -0.53 0.00 0.00 176.83 176.47 1a4e h LEU 56 N -0.05 0.86 -0.58 2.23 3.38 -1.08 -1.47 115.31 118.60 1a4e h LEU 56 Ca 0.03 -0.36 -0.13 0.00 0.09 0.00 0.00 57.88 57.51 1a4e h LEU 56 Cb 0.47 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1a4e h LEU 56 CO 0.01 1.11 -0.27 0.00 0.09 0.00 0.00 178.44 179.38 1a4e h ALA 57 N 0.94 0.76 -0.13 1.53 0.00 -1.07 -1.51 119.26 119.78 1a4e h ALA 57 Ca 0.07 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 1a4e h ALA 57 Cb 0.88 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1a4e h ALA 57 CO 0.08 0.66 -0.44 1.25 0.00 0.00 0.00 179.25 180.79 1a4e h HIS 58 N 0.72 0.36 -0.72 0.00 -0.00 -1.27 -2.84 115.15 111.40 1a4e h HIS 58 Ca 0.09 -0.11 -0.00 0.00 -0.00 0.00 0.00 60.37 60.35 1a4e h HIS 58 Cb 0.82 -0.08 -0.04 0.00 -0.00 0.00 0.00 27.41 28.12 1a4e h HIS 58 CO 0.05 0.70 0.45 0.35 -0.00 0.00 0.00 177.93 179.48 1a4e h PHE 59 N 0.25 0.94 0.00 5.26 3.57 -0.92 -1.94 116.94 124.10 1a4e h PHE 59 Ca 0.02 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1a4e h PHE 59 Cb 0.89 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1a4e h PHE 59 CO 0.02 0.62 0.00 -0.91 -2.23 0.00 0.00 178.31 175.81 1a4e h ASN 60 N 0.99 0.00 -0.31 0.41 2.35 -1.04 -2.97 115.58 115.02 1a4e h ASN 60 Ca 0.26 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.93 1a4e h ASN 60 Cb -0.06 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.26 1a4e h ASN 60 CO -0.05 0.00 -0.01 0.54 -1.65 0.00 0.00 177.43 176.26 1a4e n ARG 61 N -2.93 2.46 0.12 0.81 1.74 -0.74 -4.67 116.66 113.44 1a4e n ARG 61 Ca -0.02 -2.96 -0.03 0.00 -0.77 0.00 0.00 57.85 54.08 1a4e n ARG 61 Cb 0.14 -1.84 0.16 0.00 -1.02 0.00 0.00 32.46 29.90 1a4e n ARG 61 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1a4e h GLU 62 N 1.43 0.10 -5.96 5.56 5.08 -1.44 -3.45 114.58 115.90 1a4e h GLU 62 Ca 0.10 -0.07 -0.61 0.00 -1.00 0.00 0.00 59.36 57.78 1a4e h GLU 62 Cb 1.55 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.75 1a4e h GLU 62 CO 0.30 0.66 -0.21 -0.80 -1.00 0.00 0.00 179.01 177.97 1a4e s ASN 63 N -6.87 6.78 0.22 1.42 0.01 -1.26 -5.10 114.94 110.13 1a4e s ASN 63 Ca -0.03 0.92 0.07 0.00 -0.71 0.00 0.00 52.86 53.12 1a4e s ASN 63 Cb 0.13 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.50 1a4e s ASN 63 CO 0.77 0.29 0.11 0.27 -1.51 0.00 0.00 177.10 177.04 1a4e s ILE 64 N -0.88 4.16 0.30 0.60 -4.36 -1.26 -5.10 121.20 114.66 1a4e s ILE 64 Ca 0.23 -1.42 -0.29 0.00 -0.26 0.00 0.00 60.65 58.91 1a4e s ILE 64 Cb -0.16 -3.19 -0.13 0.00 1.25 0.00 0.00 42.46 40.23 1a4e s ILE 64 CO 0.13 -0.26 1.35 -2.65 0.24 0.00 0.00 174.94 173.75 1a4e n PRO 65 N -0.75 2.14 -1.86 0.37 -0.02 -1.26 -4.97 135.00 128.64 1a4e n PRO 65 Ca -0.08 0.75 -0.33 0.00 -2.02 0.00 0.00 63.50 61.83 1a4e n PRO 65 Cb 0.57 -2.38 0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1a4e n PRO 65 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1a4e s GLN 66 N -1.28 2.99 0.41 -0.52 -2.07 -1.26 -4.95 119.66 112.97 1a4e s GLN 66 Ca 0.60 1.33 -0.26 0.00 -1.82 0.00 0.00 55.36 55.21 1a4e s GLN 66 Cb -0.59 -1.98 -0.10 0.00 -1.09 0.00 0.00 33.01 29.25 1a4e s GLN 66 CO 0.57 -1.09 1.32 0.54 -1.32 0.00 0.00 175.29 175.30 1a4e n ARG 67 N -2.26 2.07 -3.93 9.60 1.74 -1.26 -4.97 116.66 117.64 1a4e n ARG 67 Ca 0.10 0.73 -0.31 0.00 -0.77 0.00 0.00 57.85 57.61 1a4e n ARG 67 Cb 0.52 -2.44 -0.15 0.00 -1.02 0.00 0.00 32.46 29.38 1a4e n ARG 67 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1a4e s ASN 68 N -0.46 4.41 0.00 0.55 2.47 -1.26 -3.45 114.94 117.20 1a4e s ASN 68 Ca 0.59 -1.82 0.00 0.00 0.42 0.00 0.00 52.86 52.05 1a4e s ASN 68 Cb -0.51 -1.34 0.00 0.00 -1.45 0.00 0.00 41.25 37.95 1a4e s ASN 68 CO 0.59 -0.36 0.00 -0.81 -3.72 0.00 0.00 177.10 172.80 1a4e n PRO 69 N 4.49 2.95 -3.32 0.43 -0.04 -1.26 -5.06 135.00 133.19 1a4e n PRO 69 Ca -0.01 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.27 1a4e n PRO 69 Cb 0.42 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 33.95 1a4e n PRO 69 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1a4e n HIS 70 N 0.00 -2.19 -0.07 0.54 8.25 -0.57 -4.95 115.22 116.24 1a4e n HIS 70 Ca 0.00 0.81 -0.01 0.00 -0.26 0.00 0.00 57.72 58.25 1a4e n HIS 70 Cb 0.00 -4.34 0.25 0.00 1.12 0.00 0.00 29.99 27.02 1a4e n HIS 70 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a4e h ALA 71 N 0.80 1.31 -3.11 -1.41 0.00 -1.70 -3.43 119.26 111.72 1a4e h ALA 71 Ca -0.47 -0.19 -0.62 0.00 0.00 0.00 0.00 54.91 53.64 1a4e h ALA 71 Cb 1.29 -0.19 -0.14 0.00 0.00 0.00 0.00 17.79 18.75 1a4e h ALA 71 CO 0.44 0.48 -0.51 -1.58 0.00 0.00 0.00 179.25 178.09 1a4e s HIS 72 N -5.15 3.32 0.16 0.00 5.65 -1.26 -4.51 115.29 113.50 1a4e s HIS 72 Ca -0.09 0.22 -0.22 0.00 0.25 0.00 0.00 55.06 55.22 1a4e s HIS 72 Cb 0.16 -2.25 0.08 0.00 -1.18 0.00 0.00 32.58 29.38 1a4e s HIS 72 CO 0.78 0.09 1.05 0.41 -0.65 0.00 0.00 174.74 176.42 1a4e n GLY 73 N 4.19 0.56 3.21 1.59 0.00 -1.26 -1.66 105.19 111.82 1a4e n GLY 73 Ca -0.15 -1.14 -0.12 0.00 0.00 0.00 0.00 46.02 44.61 1a4e n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a4e s SER 74 N -3.46 1.15 0.20 1.61 0.01 0.08 -4.98 113.70 108.30 1a4e s SER 74 Ca 0.24 -1.12 -0.14 0.00 1.31 0.00 0.00 55.95 56.23 1a4e s SER 74 Cb -0.03 0.12 0.01 0.00 0.21 0.00 0.00 66.02 66.33 1a4e s SER 74 CO 0.05 -0.54 0.45 -0.83 0.41 0.00 0.00 173.24 172.78 1a4e s GLY 75 N -3.12 0.17 -0.07 3.44 0.00 -1.26 0.15 107.32 106.63 1a4e s GLY 75 Ca 0.20 -0.52 -0.30 0.00 0.00 0.00 0.00 44.72 44.10 1a4e s GLY 75 CO 0.01 -0.48 0.82 0.00 0.00 0.00 0.00 173.10 173.44 1a4e s ALA 76 N -3.92 -1.82 0.45 3.20 0.00 -0.56 -4.62 121.76 114.48 1a4e s ALA 76 Ca 0.14 1.32 -0.00 0.00 0.00 0.00 0.00 51.96 53.41 1a4e s ALA 76 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 1a4e s ALA 76 CO 0.00 -0.41 0.68 -0.06 0.00 0.00 0.00 175.76 175.96 1a4e s PHE 77 N -1.58 3.28 0.00 0.00 0.08 0.31 -1.23 117.98 118.84 1a4e s PHE 77 Ca -0.05 0.30 0.00 0.00 0.12 0.00 0.00 56.93 57.31 1a4e s PHE 77 Cb -0.00 -2.29 0.00 0.00 -0.57 0.00 0.00 43.02 40.16 1a4e s PHE 77 CO 0.03 -0.33 0.00 0.41 -0.10 0.00 0.00 175.22 175.23 1a4e n GLY 78 N -2.09 1.34 3.34 4.36 0.00 -0.34 -1.73 105.19 110.08 1a4e n GLY 78 Ca 0.01 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1a4e n GLY 78 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1a4e s TYR 79 N 0.10 -0.29 -0.09 1.61 -0.85 -0.38 -1.47 117.35 115.97 1a4e s TYR 79 Ca 0.00 0.07 -0.00 0.00 -0.52 0.00 0.00 57.07 56.61 1a4e s TYR 79 Cb 0.00 0.32 -0.03 0.00 0.38 0.00 0.00 41.96 42.63 1a4e s TYR 79 CO 0.00 -0.71 -0.06 0.12 -1.52 0.00 0.00 175.55 173.39 1a4e s PHE 80 N -3.50 2.97 -0.08 -3.49 5.36 0.32 -0.99 117.98 118.57 1a4e s PHE 80 Ca 0.01 -0.06 0.02 0.00 -0.96 0.00 0.00 56.93 55.94 1a4e s PHE 80 Cb 0.01 -1.78 0.01 0.00 -0.34 0.00 0.00 43.02 40.93 1a4e s PHE 80 CO -0.10 0.25 -0.13 -2.00 -1.46 0.00 0.00 175.22 171.78 1a4e s GLU 81 N -0.52 1.81 -0.19 10.12 2.12 0.02 -1.12 118.70 130.94 1a4e s GLU 81 Ca 0.08 -0.43 -0.29 0.00 0.36 0.00 0.00 54.97 54.68 1a4e s GLU 81 Cb -0.12 -1.53 -0.02 0.00 0.26 0.00 0.00 34.13 32.72 1a4e s GLU 81 CO 0.02 -0.02 1.43 0.08 -0.54 0.00 0.00 175.26 176.23 1a4e s VAL 82 N 0.83 3.99 -0.71 3.70 1.01 -0.74 -0.93 120.40 127.53 1a4e s VAL 82 Ca -0.11 1.16 0.16 0.00 0.00 0.00 0.00 61.98 63.19 1a4e s VAL 82 Cb -0.15 -3.87 -0.18 0.00 0.00 0.00 0.00 36.38 32.18 1a4e s VAL 82 CO 0.02 -0.23 0.66 0.35 0.00 0.00 0.00 175.10 175.89 1a4e n THR 83 N 5.82 0.00 -4.05 3.92 -2.24 -0.36 -0.68 114.28 116.69 1a4e n THR 83 Ca 0.16 -0.14 -0.07 0.00 -2.27 0.00 0.00 64.05 61.73 1a4e n THR 83 Cb 0.45 0.95 -0.09 0.00 -2.10 0.00 0.00 70.33 69.53 1a4e n THR 83 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1a4e s ASP 84 N -2.59 0.41 -0.36 3.42 1.11 -0.93 -4.94 116.67 112.80 1a4e s ASP 84 Ca 0.05 -0.94 -0.19 0.00 0.18 0.00 0.00 52.55 51.64 1a4e s ASP 84 Cb 0.12 0.23 0.00 0.00 1.07 0.00 0.00 42.92 44.34 1a4e s ASP 84 CO 0.66 -0.63 0.59 -0.62 1.18 0.00 0.00 175.17 176.34 1a4e s ASP 85 N -2.92 6.38 -0.18 0.27 2.15 -1.26 -4.84 116.67 116.28 1a4e s ASP 85 Ca 0.08 0.06 0.13 0.00 0.43 0.00 0.00 52.55 53.25 1a4e s ASP 85 Cb 0.07 -2.30 0.41 0.00 -0.30 0.00 0.00 42.92 40.80 1a4e s ASP 85 CO -0.10 -0.55 1.21 2.30 -0.17 0.00 0.00 175.17 177.86 1a4e n ILE 86 N 5.53 1.87 0.36 4.11 -5.35 -1.26 -4.81 119.36 119.80 1a4e n ILE 86 Ca -0.03 -2.87 0.13 0.00 -0.27 0.00 0.00 62.75 59.71 1a4e n ILE 86 Cb 0.49 -0.06 0.54 0.00 -1.74 0.00 0.00 39.64 38.86 1a4e n ILE 86 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1a4e h THR 87 N 1.83 0.00 0.00 7.28 1.35 -1.85 -0.90 112.91 120.61 1a4e h THR 87 Ca -0.03 -0.24 -0.05 0.00 -0.55 0.00 0.00 66.41 65.54 1a4e h THR 87 Cb 1.13 0.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 1a4e h THR 87 CO 0.01 0.00 -0.26 -2.24 -0.25 0.00 0.00 175.52 172.79 1a4e h ASP 88 N 0.00 0.00 0.02 5.36 2.03 -1.99 -3.33 116.42 118.51 1a4e h ASP 88 Ca 0.00 0.00 -0.37 0.00 -0.73 0.00 0.00 57.03 55.93 1a4e h ASP 88 Cb 0.34 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.79 1a4e h ASP 88 CO 0.00 0.26 -2.11 -0.38 -1.03 0.00 0.00 179.24 175.98 1a4e n ILE 89 N -3.48 1.56 -4.32 4.15 2.08 -0.44 -4.51 119.36 114.40 1a4e n ILE 89 Ca -0.00 -0.37 -0.23 0.00 0.56 0.00 0.00 62.75 62.72 1a4e n ILE 89 Cb 0.43 -1.81 -0.17 0.00 -0.75 0.00 0.00 39.64 37.34 1a4e n ILE 89 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1a4e n GLY 91 N 4.04 1.51 3.76 0.00 0.00 0.01 -4.27 105.19 110.24 1a4e n GLY 91 Ca -0.23 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 1a4e n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a4e s SER 92 N -0.98 6.61 0.51 1.61 0.01 -1.26 -4.87 113.70 115.33 1a4e s SER 92 Ca 0.35 2.77 0.24 0.00 1.31 0.00 0.00 55.95 60.63 1a4e s SER 92 Cb 0.19 -2.64 1.34 0.00 0.21 0.00 0.00 66.02 65.11 1a4e s SER 92 CO 0.23 -0.69 1.98 0.00 0.41 0.00 0.00 173.24 175.17 1a4e h ALA 93 N 4.02 2.45 0.00 1.44 0.00 -1.93 -1.94 119.26 123.31 1a4e h ALA 93 Ca -0.48 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 1a4e h ALA 93 Cb 1.23 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1a4e h ALA 93 CO 0.71 -0.62 -0.01 0.00 0.00 0.00 0.00 179.25 179.33 1a4e h MET 94 N 0.08 0.00 -0.27 0.00 -0.00 -1.98 -2.31 114.93 110.45 1a4e h MET 94 Ca 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.98 1a4e h MET 94 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.63 1a4e h MET 94 CO -0.02 0.01 0.00 1.19 -0.00 0.00 0.00 176.91 178.08 1a4e n PHE 95 N -3.11 0.34 0.16 -0.10 3.72 -0.73 -4.74 117.46 112.99 1a4e n PHE 95 Ca -0.01 -0.20 0.04 0.00 -0.05 0.00 0.00 57.45 57.23 1a4e n PHE 95 Cb 0.21 -0.00 0.47 0.00 -0.94 0.00 0.00 39.48 39.21 1a4e n PHE 95 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1a4e h SER 96 N 3.84 0.14 -4.33 4.37 4.64 -1.44 -3.44 113.55 117.34 1a4e h SER 96 Ca 0.00 -0.02 -0.38 0.00 -0.47 0.00 0.00 61.79 60.92 1a4e h SER 96 Cb 0.87 -0.04 -0.25 0.00 -0.31 0.00 0.00 62.40 62.67 1a4e h SER 96 CO 0.00 0.26 -0.77 -0.54 -0.87 0.00 0.00 176.83 174.91 1a4e s LYS 97 N -4.82 0.73 0.11 4.77 -0.14 -1.26 -5.03 119.74 114.10 1a4e s LYS 97 Ca -0.05 -0.61 -0.30 0.00 -1.36 0.00 0.00 55.97 53.64 1a4e s LYS 97 Cb 0.16 -0.67 -0.06 0.00 -1.68 0.00 0.00 37.83 35.57 1a4e s LYS 97 CO 0.71 0.17 1.13 0.42 -0.76 0.00 0.00 175.35 177.02 1a4e s ILE 98 N -0.78 4.02 0.00 2.17 1.01 -1.26 -2.68 121.20 123.67 1a4e s ILE 98 Ca -0.01 1.58 0.00 0.00 0.00 0.00 0.00 60.65 62.23 1a4e s ILE 98 Cb -0.07 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.39 1a4e s ILE 98 CO 0.01 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1a4e n GLY 99 N 2.59 1.22 3.70 6.18 0.00 0.14 -5.00 105.19 114.03 1a4e n GLY 99 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1a4e n GLY 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1a4e s LYS 100 N -0.94 4.23 -0.02 1.61 2.20 -1.09 -4.69 119.74 121.03 1a4e s LYS 100 Ca 0.00 2.27 0.00 0.00 -0.36 0.00 0.00 55.97 57.88 1a4e s LYS 100 Cb 0.00 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1a4e s LYS 100 CO 0.00 -0.63 0.02 1.03 -0.36 0.00 0.00 175.35 175.41 1a4e s ARG 101 N 1.85 2.91 -0.06 4.03 0.52 -1.26 -1.80 118.95 125.14 1a4e s ARG 101 Ca 0.70 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 55.39 1a4e s ARG 101 Cb -0.40 -2.76 0.02 0.00 0.52 0.00 0.00 34.95 32.34 1a4e s ARG 101 CO 0.31 0.65 -0.03 0.99 0.02 0.00 0.00 175.30 177.24 1a4e s THR 102 N -1.06 0.51 0.37 0.02 2.01 -0.27 -4.96 115.64 112.26 1a4e s THR 102 Ca 0.19 -0.05 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 1a4e s THR 102 Cb -0.12 -0.59 -0.10 0.00 0.01 0.00 0.00 72.50 71.71 1a4e s THR 102 CO 0.09 0.25 1.40 -0.75 -0.69 0.00 0.00 174.62 174.92 1a4e s LYS 103 N 1.35 4.13 0.18 4.92 2.20 -1.26 -0.52 119.74 130.73 1a4e s LYS 103 Ca -0.04 2.38 0.01 0.00 -0.36 0.00 0.00 55.97 57.96 1a4e s LYS 103 Cb -0.13 -2.94 -0.05 0.00 -1.51 0.00 0.00 37.83 33.20 1a4e s LYS 103 CO -0.02 -0.44 0.04 0.00 -0.36 0.00 0.00 175.35 174.56 1a4e s LEU 105 N -3.16 1.23 -0.08 0.00 2.96 -0.50 -1.19 118.68 117.93 1a4e s LEU 105 Ca 0.27 -0.28 -0.00 0.00 -0.22 0.00 0.00 54.13 53.89 1a4e s LEU 105 Cb 0.07 -0.79 -0.03 0.00 0.50 0.00 0.00 46.19 45.93 1a4e s LEU 105 CO 0.05 -0.10 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.06 1a4e s THR 106 N 1.51 3.99 -0.14 3.68 2.01 -0.36 -0.65 115.64 125.68 1a4e s THR 106 Ca 0.01 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.64 1a4e s THR 106 Cb -0.13 -2.65 0.02 0.00 0.01 0.00 0.00 72.50 69.75 1a4e s THR 106 CO -0.06 0.60 -0.12 -0.60 -0.69 0.00 0.00 174.62 173.75 1a4e s ARG 107 N -0.82 2.04 0.29 4.92 3.52 0.03 -1.49 118.95 127.45 1a4e s ARG 107 Ca 0.12 -0.49 -0.03 0.00 -0.13 0.00 0.00 55.73 55.20 1a4e s ARG 107 Cb -0.11 -1.98 -0.05 0.00 -1.56 0.00 0.00 34.95 31.25 1a4e s ARG 107 CO 0.02 -0.26 0.53 -0.06 -0.81 0.00 0.00 175.30 174.71 1a4e s PHE 108 N 1.55 3.49 0.14 5.12 0.08 0.12 -1.75 117.98 126.72 1a4e s PHE 108 Ca 0.04 0.52 -0.25 0.00 0.12 0.00 0.00 56.93 57.37 1a4e s PHE 108 Cb -0.13 -2.02 0.07 0.00 -0.57 0.00 0.00 43.02 40.38 1a4e s PHE 108 CO -0.10 0.18 1.01 -1.54 -0.10 0.00 0.00 175.22 174.68 1a4e s SER 109 N -3.39 -0.13 0.00 1.36 1.04 -1.02 -0.74 113.70 110.81 1a4e s SER 109 Ca 0.42 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.43 1a4e s SER 109 Cb -0.10 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1a4e s SER 109 CO 0.32 -0.85 0.00 0.35 0.98 0.00 0.00 173.24 174.04 1a4e n THR 110 N -0.51 0.00 0.01 2.02 -2.24 -0.67 -0.65 114.28 112.25 1a4e n THR 110 Ca -0.06 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.71 1a4e n THR 110 Cb 0.61 -0.99 -0.00 0.00 -2.10 0.00 0.00 70.33 67.84 1a4e n THR 110 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1a4e n VAL 111 N -0.85 0.93 0.06 2.28 0.31 -1.24 -3.95 118.33 115.87 1a4e n VAL 111 Ca 0.00 0.28 -0.17 0.00 -0.01 0.00 0.00 64.34 64.45 1a4e n VAL 111 Cb 0.00 -1.57 -0.07 0.00 -0.91 0.00 0.00 33.84 31.29 1a4e n VAL 111 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1a4e h GLY 112 N -0.15 0.61 -2.00 2.92 0.00 -1.92 -1.51 103.07 101.01 1a4e h GLY 112 Ca 0.00 -1.07 -0.52 0.00 0.00 0.00 0.00 47.33 45.74 1a4e h GLY 112 CO 0.00 0.94 0.44 -0.32 0.00 0.00 0.00 176.54 177.60 1a4e s GLY 113 N -4.37 2.59 1.07 4.60 0.00 -1.26 -4.75 107.32 105.20 1a4e s GLY 113 Ca -0.08 0.89 -0.17 0.00 0.00 0.00 0.00 44.72 45.36 1a4e s GLY 113 CO 0.89 1.27 1.20 0.99 0.00 0.00 0.00 173.10 177.45 1a4e s ASP 114 N -1.82 2.12 0.34 1.64 1.01 -1.26 -4.09 116.67 114.61 1a4e s ASP 114 Ca 0.75 0.51 0.10 0.00 0.71 0.00 0.00 52.55 54.61 1a4e s ASP 114 Cb -0.27 -0.70 0.85 0.00 1.01 0.00 0.00 42.92 43.81 1a4e s ASP 114 CO 0.34 -3.37 1.80 0.50 0.21 0.00 0.00 175.17 174.65 1a4e h LYS 115 N -2.07 0.64 -0.45 8.23 3.64 -1.95 -1.85 116.57 122.75 1a4e h LYS 115 Ca -0.45 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1a4e h LYS 115 Cb 1.27 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1a4e h LYS 115 CO 0.39 0.42 0.00 0.41 -2.27 0.00 0.00 179.45 178.40 1a4e n GLY 116 N -1.39 1.08 3.81 5.01 0.00 -1.26 -4.66 105.19 107.79 1a4e n GLY 116 Ca 0.22 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 1a4e n GLY 116 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a4e s SER 117 N -0.95 4.68 0.57 1.61 1.04 -0.70 -5.02 113.70 114.93 1a4e s SER 117 Ca 0.28 1.34 -0.17 0.00 0.48 0.00 0.00 55.95 57.89 1a4e s SER 117 Cb 0.15 -2.10 -0.05 0.00 0.10 0.00 0.00 66.02 64.12 1a4e s SER 117 CO 0.18 -1.85 1.06 0.00 0.98 0.00 0.00 173.24 173.61 1a4e s ALA 118 N -3.15 2.77 0.16 5.32 0.00 -1.26 -4.91 121.76 120.69 1a4e s ALA 118 Ca 0.60 0.45 -0.05 0.00 0.00 0.00 0.00 51.96 52.96 1a4e s ALA 118 Cb -0.14 -3.24 0.03 0.00 0.00 0.00 0.00 23.12 19.77 1a4e s ALA 118 CO 0.54 -0.70 1.43 -0.44 0.00 0.00 0.00 175.76 176.59 1a4e h ASP 119 N 0.70 0.65 -2.60 0.00 3.32 -1.22 -3.37 116.42 113.89 1a4e h ASP 119 Ca -0.47 -0.39 -0.81 0.00 0.02 0.00 0.00 57.03 55.37 1a4e h ASP 119 Cb 1.22 -0.19 -0.27 0.00 0.22 0.00 0.00 39.33 40.31 1a4e h ASP 119 CO 0.58 1.14 0.91 0.35 -1.72 0.00 0.00 179.24 180.50 1a4e n THR 120 N -3.91 5.69 -4.30 0.35 -2.24 -1.26 -4.93 114.28 103.68 1a4e n THR 120 Ca -0.05 -5.95 -0.24 0.00 -2.27 0.00 0.00 64.05 55.54 1a4e n THR 120 Cb 0.68 -1.84 -0.08 0.00 -2.10 0.00 0.00 70.33 66.98 1a4e n THR 120 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1a4e s VAL 121 N -3.47 2.76 -0.22 2.28 -7.23 -1.26 -4.27 120.40 109.00 1a4e s VAL 121 Ca 0.35 -1.94 -0.28 0.00 -1.81 0.00 0.00 61.98 58.30 1a4e s VAL 121 Cb 0.11 -2.81 0.00 0.00 0.56 0.00 0.00 36.38 34.25 1a4e s VAL 121 CO 0.00 -0.22 0.98 -0.60 -0.31 0.00 0.00 175.10 174.95 1a4e s ARG 122 N -3.72 4.25 -0.08 4.82 3.52 -1.26 -4.64 118.95 121.84 1a4e s ARG 122 Ca 0.35 1.24 -0.32 0.00 -0.13 0.00 0.00 55.73 56.87 1a4e s ARG 122 Cb -0.01 -3.63 0.12 0.00 -1.56 0.00 0.00 34.95 29.86 1a4e s ARG 122 CO 0.20 -0.57 1.07 -0.51 -0.81 0.00 0.00 175.30 174.68 1a4e s ASP 123 N 1.23 -0.22 0.72 -2.12 1.01 -0.87 -5.01 116.67 111.39 1a4e s ASP 123 Ca 0.42 -0.04 -0.16 0.00 0.71 0.00 0.00 52.55 53.48 1a4e s ASP 123 Cb -0.15 0.26 0.03 0.00 1.01 0.00 0.00 42.92 44.07 1a4e s ASP 123 CO 0.07 -0.44 1.24 -2.84 0.21 0.00 0.00 175.17 173.42 1a4e s PRO 124 N -2.75 2.17 -0.07 8.23 0.02 -1.26 -4.69 135.00 136.65 1a4e s PRO 124 Ca 0.08 1.87 0.02 0.00 0.02 0.00 0.00 61.00 63.00 1a4e s PRO 124 Cb -0.01 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.66 1a4e s PRO 124 CO -0.06 -1.84 -0.12 1.03 -0.33 0.00 0.00 177.00 175.69 1a4e s ARG 125 N -3.76 2.70 0.41 5.54 1.81 -1.26 -3.72 118.95 120.66 1a4e s ARG 125 Ca 0.77 -0.65 -0.22 0.00 -1.72 0.00 0.00 55.73 53.92 1a4e s ARG 125 Cb -0.32 -2.48 -0.11 0.00 -0.45 0.00 0.00 34.95 31.59 1a4e s ARG 125 CO 0.44 0.58 0.95 0.20 -0.68 0.00 0.00 175.30 176.79 1a4e s GLY 126 N -0.61 2.45 -0.42 -3.53 0.00 0.18 -0.52 107.32 104.87 1a4e s GLY 126 Ca 0.09 0.42 0.04 0.00 0.00 0.00 0.00 44.72 45.27 1a4e s GLY 126 CO 0.01 0.72 0.40 -0.12 0.00 0.00 0.00 173.10 174.11 1a4e s PHE 127 N -2.09 0.52 -0.24 1.90 2.19 -0.05 -2.44 117.98 117.77 1a4e s PHE 127 Ca 0.60 -1.89 -0.09 0.00 0.33 0.00 0.00 56.93 55.88 1a4e s PHE 127 Cb -0.10 -0.68 -0.04 0.00 -1.31 0.00 0.00 43.02 40.89 1a4e s PHE 127 CO 0.15 -0.91 0.13 0.00 1.83 0.00 0.00 175.22 176.41 1a4e s ALA 128 N 0.36 3.47 -0.04 11.12 0.00 -0.72 -2.27 121.76 133.68 1a4e s ALA 128 Ca 0.30 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.39 1a4e s ALA 128 Cb -0.00 -2.22 -0.01 0.00 0.00 0.00 0.00 23.12 20.88 1a4e s ALA 128 CO -0.15 -0.23 -0.24 0.99 0.00 0.00 0.00 175.76 176.13 1a4e s THR 129 N 1.13 1.97 -0.16 0.00 2.01 -0.55 -0.79 115.64 119.24 1a4e s THR 129 Ca 0.06 -1.04 -0.03 0.00 0.31 0.00 0.00 61.69 61.00 1a4e s THR 129 Cb -0.14 -1.65 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 1a4e s THR 129 CO 0.05 0.55 -0.06 -0.75 -0.69 0.00 0.00 174.62 173.71 1a4e s LYS 130 N -0.31 3.53 -0.14 4.92 2.20 0.18 -0.76 119.74 129.36 1a4e s LYS 130 Ca 0.01 -0.59 -0.01 0.00 -0.36 0.00 0.00 55.97 55.02 1a4e s LYS 130 Cb -0.12 -2.85 -0.02 0.00 -1.51 0.00 0.00 37.83 33.33 1a4e s LYS 130 CO 0.02 0.14 -0.11 -0.06 -0.36 0.00 0.00 175.35 174.98 1a4e s PHE 131 N 0.60 2.86 -1.03 4.03 0.40 0.30 -1.41 117.98 123.73 1a4e s PHE 131 Ca -0.04 -0.59 -0.15 0.00 -0.60 0.00 0.00 56.93 55.55 1a4e s PHE 131 Cb -0.15 -1.88 0.18 0.00 0.51 0.00 0.00 43.02 41.69 1a4e s PHE 131 CO 0.03 -0.19 1.16 0.71 0.70 0.00 0.00 175.22 177.63 1a4e s TYR 132 N 0.39 3.52 0.55 0.36 1.51 -0.84 -1.31 117.35 121.53 1a4e s TYR 132 Ca -0.09 -1.92 0.03 0.00 -1.01 0.00 0.00 57.07 54.08 1a4e s TYR 132 Cb -0.15 -4.15 0.05 0.00 -0.11 0.00 0.00 41.96 37.59 1a4e s TYR 132 CO 0.05 -1.30 0.77 0.95 -1.11 0.00 0.00 175.55 174.91 1a4e s THR 133 N 1.34 2.61 -0.26 -0.71 -4.23 -1.04 -4.60 115.64 108.76 1a4e s THR 133 Ca 0.33 -0.73 0.27 0.00 -1.18 0.00 0.00 61.69 60.38 1a4e s THR 133 Cb -0.06 -2.89 0.29 0.00 1.34 0.00 0.00 72.50 71.19 1a4e s THR 133 CO -0.06 0.00 1.81 -0.33 -0.54 0.00 0.00 174.62 175.49 1a4e h GLU 134 N 0.08 0.00 -0.42 3.99 5.08 -1.96 -2.34 114.58 119.01 1a4e h GLU 134 Ca -0.40 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 57.83 1a4e h GLU 134 Cb 1.29 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.46 1a4e h GLU 134 CO 0.49 0.00 0.06 0.39 -1.00 0.00 0.00 179.01 178.95 1a4e n GLU 135 N -2.50 2.70 0.00 2.33 1.02 -1.26 -4.57 120.64 118.35 1a4e n GLU 135 Ca 0.01 -3.02 0.00 0.00 -0.02 0.00 0.00 57.16 54.14 1a4e n GLU 135 Cb 0.23 -1.93 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 1a4e n GLU 135 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4e n GLY 136 N -0.68 0.43 3.79 0.62 0.00 -0.88 -4.65 105.19 103.84 1a4e n GLY 136 Ca 0.31 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 1a4e n GLY 136 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a4e s ASN 137 N -0.32 6.56 -0.12 1.61 0.01 -1.26 -2.48 114.94 118.94 1a4e s ASN 137 Ca 0.00 1.93 0.02 0.00 -0.71 0.00 0.00 52.86 54.10 1a4e s ASN 137 Cb 0.00 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 39.11 1a4e s ASN 137 CO 0.00 -0.63 -0.17 -0.22 -1.51 0.00 0.00 177.10 174.57 1a4e s LEU 138 N -3.16 1.82 -0.19 0.60 0.20 -0.43 -3.79 118.68 113.72 1a4e s LEU 138 Ca 0.63 -0.48 -0.03 0.00 0.69 0.00 0.00 54.13 54.95 1a4e s LEU 138 Cb -0.17 -1.19 -0.01 0.00 -0.43 0.00 0.00 46.19 44.39 1a4e s LEU 138 CO 0.21 0.03 -0.05 -1.81 -0.29 0.00 0.00 176.35 174.44 1a4e s ASP 139 N 0.98 4.38 -0.72 3.68 1.01 -0.20 -0.54 116.67 125.25 1a4e s ASP 139 Ca -0.06 -0.32 -0.12 0.00 0.71 0.00 0.00 52.55 52.76 1a4e s ASP 139 Cb -0.15 -1.73 0.19 0.00 1.01 0.00 0.00 42.92 42.24 1a4e s ASP 139 CO -0.02 0.05 0.63 0.26 0.21 0.00 0.00 175.17 176.31 1a4e s TRP 140 N 1.04 3.60 -0.97 4.23 0.52 0.06 -4.62 118.94 122.80 1a4e s TRP 140 Ca 0.01 -2.00 -0.16 0.00 0.02 0.00 0.00 56.10 53.97 1a4e s TRP 140 Cb -0.15 -3.68 0.17 0.00 -1.15 0.00 0.00 33.47 28.66 1a4e s TRP 140 CO -0.00 -0.97 1.10 0.08 0.02 0.00 0.00 176.95 177.18 1a4e s VAL 141 N 0.45 5.09 0.34 4.03 1.01 -1.26 -1.49 120.40 128.57 1a4e s VAL 141 Ca 0.14 -2.12 0.08 0.00 0.00 0.00 0.00 61.98 60.08 1a4e s VAL 141 Cb -0.16 -4.72 -0.03 0.00 0.00 0.00 0.00 36.38 31.47 1a4e s VAL 141 CO -0.05 -1.39 0.23 -0.31 0.00 0.00 0.00 175.10 173.58 1a4e s TYR 142 N 1.59 2.83 0.49 5.22 2.02 -0.96 -4.98 117.35 123.57 1a4e s TYR 142 Ca 0.31 -0.33 0.04 0.00 -0.37 0.00 0.00 57.07 56.72 1a4e s TYR 142 Cb -0.06 -1.73 -0.01 0.00 -0.40 0.00 0.00 41.96 39.76 1a4e s TYR 142 CO -0.08 0.25 0.14 -0.80 -1.57 0.00 0.00 175.55 173.49 1a4e s ASN 143 N -3.94 4.29 -0.07 2.29 0.01 -1.16 -0.87 114.94 115.50 1a4e s ASN 143 Ca 0.39 -1.42 0.10 0.00 -0.71 0.00 0.00 52.86 51.23 1a4e s ASN 143 Cb -0.05 0.22 0.41 0.00 0.41 0.00 0.00 41.25 42.25 1a4e s ASN 143 CO 0.25 -0.82 1.25 -0.46 -1.51 0.00 0.00 177.10 175.80 1a4e n ASN 144 N -1.36 2.94 -4.24 -1.22 2.04 0.32 -0.83 115.26 112.91 1a4e n ASN 144 Ca -0.10 -2.27 -0.25 0.00 -0.44 0.00 0.00 54.58 51.53 1a4e n ASN 144 Cb 0.66 -0.45 -0.14 0.00 -2.53 0.00 0.00 39.78 37.33 1a4e n ASN 144 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 1a4e s THR 145 N -1.72 1.61 0.38 5.53 -1.32 -1.26 -4.64 115.64 114.22 1a4e s THR 145 Ca 0.29 -1.24 0.11 0.00 -1.21 0.00 0.00 61.69 59.64 1a4e s THR 145 Cb 0.19 -1.42 0.13 0.00 -1.51 0.00 0.00 72.50 69.89 1a4e s THR 145 CO 0.14 0.13 1.88 -0.65 -2.21 0.00 0.00 174.62 173.90 1a4e h PRO 146 N 4.73 0.13 0.00 7.08 0.11 -1.92 -3.41 132.00 138.71 1a4e h PRO 146 Ca -0.43 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1a4e h PRO 146 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1a4e h PRO 146 CO 0.43 0.37 0.00 1.33 -0.21 0.00 0.00 178.00 179.92 1a4e n VAL 147 N -4.20 0.00 -4.04 3.15 0.24 -1.26 -3.97 118.33 108.25 1a4e n VAL 147 Ca -0.01 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.17 1a4e n VAL 147 Cb 0.33 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.65 1a4e n VAL 147 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1a4e s PHE 148 N -0.64 0.66 0.25 6.34 5.36 -1.21 -4.97 117.98 123.77 1a4e s PHE 148 Ca 0.00 -0.98 0.19 0.00 -0.96 0.00 0.00 56.93 55.17 1a4e s PHE 148 Cb 0.00 0.06 0.79 0.00 -0.34 0.00 0.00 43.02 43.53 1a4e s PHE 148 CO 0.00 -1.04 1.80 0.74 -1.46 0.00 0.00 175.22 175.25 1a4e h PHE 149 N 2.23 0.00 -3.31 10.12 -1.00 -1.93 -3.41 116.94 119.64 1a4e h PHE 149 Ca -0.28 0.00 -0.38 0.00 2.81 0.00 0.00 57.97 60.12 1a4e h PHE 149 Cb 1.25 0.00 -0.16 0.00 3.61 0.00 0.00 35.95 40.65 1a4e h PHE 149 CO 0.82 0.35 -0.73 0.96 -1.61 0.00 0.00 178.31 178.09 1a4e s ILE 150 N -3.80 1.36 0.00 -0.55 -4.36 -1.26 -3.53 121.20 109.05 1a4e s ILE 150 Ca -0.01 -2.01 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 1a4e s ILE 150 Cb 0.12 -1.81 0.00 0.00 1.25 0.00 0.00 42.46 42.02 1a4e s ILE 150 CO 0.68 -0.62 0.55 -2.11 0.24 0.00 0.00 174.94 173.68 1a4e n ARG 151 N -0.04 0.60 -4.04 0.37 1.85 -1.26 -4.65 116.66 109.49 1a4e n ARG 151 Ca -0.11 -0.70 -0.34 0.00 -1.00 0.00 0.00 57.85 55.70 1a4e n ARG 151 Cb 0.60 -0.80 -0.15 0.00 -1.05 0.00 0.00 32.46 31.06 1a4e n ARG 151 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1a4e s ASP 152 N -0.30 3.92 0.46 2.89 1.01 -1.26 -4.46 116.67 118.93 1a4e s ASP 152 Ca 0.00 -0.46 0.22 0.00 0.71 0.00 0.00 52.55 53.02 1a4e s ASP 152 Cb 0.00 -1.65 1.13 0.00 1.01 0.00 0.00 42.92 43.41 1a4e s ASP 152 CO 0.00 0.00 1.95 1.55 0.21 0.00 0.00 175.17 178.88 1a4e h PRO 153 N 7.95 0.00 0.00 8.23 0.13 -1.92 -2.38 132.00 144.01 1a4e h PRO 153 Ca -0.42 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1a4e h PRO 153 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1a4e h PRO 153 CO 0.61 0.21 -0.00 0.66 -0.23 0.00 0.00 178.00 179.25 1a4e h SER 154 N 0.00 0.00 1.41 1.44 4.64 -1.95 -2.61 113.55 116.48 1a4e h SER 154 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1a4e h SER 154 Cb 0.50 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1a4e h SER 154 CO 0.03 0.00 -0.15 0.50 -0.87 0.00 0.00 176.83 176.34 1a4e h LYS 155 N 0.00 0.00 -0.32 4.77 1.63 -1.86 -3.39 116.57 117.40 1a4e h LYS 155 Ca -0.00 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.84 1a4e h LYS 155 Cb 0.41 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.00 1a4e h LYS 155 CO 0.00 0.15 0.10 0.35 -3.45 0.00 0.00 179.45 176.60 1a4e h PHE 156 N 0.00 0.17 -0.62 1.91 3.57 -1.60 -0.90 116.94 119.47 1a4e h PHE 156 Ca -0.00 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1a4e h PHE 156 Cb 0.90 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.55 1a4e h PHE 156 CO 0.00 0.07 0.28 -1.35 -2.23 0.00 0.00 178.31 175.07 1a4e h PRO 157 N 0.23 0.49 -0.26 6.41 0.11 -1.81 -2.10 132.00 135.06 1a4e h PRO 157 Ca 0.15 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 1a4e h PRO 157 Cb 0.13 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1a4e h PRO 157 CO -0.16 0.32 0.16 0.45 -0.21 0.00 0.00 178.00 178.55 1a4e h HIS 158 N 0.50 0.34 0.09 0.65 3.86 -1.73 -2.33 115.15 116.54 1a4e h HIS 158 Ca 0.30 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.50 1a4e h HIS 158 Cb 0.31 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1a4e h HIS 158 CO -0.13 0.26 -0.05 0.35 0.86 0.00 0.00 177.93 179.23 1a4e h PHE 159 N 0.32 -0.12 -0.28 2.45 3.57 -0.99 -2.61 116.94 119.28 1a4e h PHE 159 Ca 0.09 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 1a4e h PHE 159 Cb 0.02 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 1a4e h PHE 159 CO -0.04 0.07 0.03 0.82 -2.23 0.00 0.00 178.31 176.96 1a4e h ILE 160 N -0.29 1.15 -0.68 1.41 1.08 -1.37 -2.12 117.51 116.69 1a4e h ILE 160 Ca -0.01 -0.57 0.02 0.00 -0.39 0.00 0.00 64.86 63.90 1a4e h ILE 160 Cb 0.24 0.91 -0.04 0.00 -3.07 0.00 0.00 36.82 34.86 1a4e h ILE 160 CO 0.02 0.20 0.44 0.45 -0.69 0.00 0.00 178.15 178.57 1a4e h HIS 161 N 0.40 0.83 0.00 1.37 3.86 -1.30 -2.11 115.15 118.20 1a4e h HIS 161 Ca 0.09 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1a4e h HIS 161 Cb 0.21 -0.28 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 1a4e h HIS 161 CO 0.01 0.50 -0.09 1.79 0.86 0.00 0.00 177.93 181.00 1a4e h THR 162 N 0.88 0.19 0.00 2.45 1.35 -1.01 -2.65 112.91 114.11 1a4e h THR 162 Ca 0.26 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1a4e h THR 162 Cb -0.04 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 1a4e h THR 162 CO -0.08 0.09 -0.06 1.56 -0.25 0.00 0.00 175.52 176.77 1a4e h GLN 163 N 0.00 0.00 0.00 4.72 1.08 -0.89 -3.29 115.11 116.73 1a4e h GLN 163 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1a4e h GLN 163 Cb 0.76 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.19 1a4e h GLN 163 CO 0.01 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.52 1a4e n LYS 164 N -2.36 0.00 -5.06 1.46 5.02 -0.85 -4.82 118.16 111.55 1a4e n LYS 164 Ca 0.05 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.03 1a4e n LYS 164 Cb 0.44 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 35.31 1a4e n LYS 164 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1a4e s ARG 165 N 3.15 2.16 0.20 1.97 0.52 -1.26 -4.25 118.95 121.45 1a4e s ARG 165 Ca 0.00 -0.90 -0.32 0.00 -0.52 0.00 0.00 55.73 53.99 1a4e s ARG 165 Cb 0.00 -2.14 -0.15 0.00 0.52 0.00 0.00 34.95 33.19 1a4e s ARG 165 CO 0.00 0.57 1.27 -1.71 0.02 0.00 0.00 175.30 175.45 1a4e n ASN 166 N 2.20 1.97 -0.04 0.23 2.85 -0.11 -4.84 115.26 117.52 1a4e n ASN 166 Ca -0.16 1.14 0.14 0.00 -0.11 0.00 0.00 54.58 55.59 1a4e n ASN 166 Cb 0.52 -1.31 0.56 0.00 1.24 0.00 0.00 39.78 40.78 1a4e n ASN 166 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1a4e h PRO 167 N 3.75 0.27 0.00 1.20 0.13 -1.96 -1.72 132.00 133.67 1a4e h PRO 167 Ca -0.44 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.60 1a4e h PRO 167 Cb 1.31 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1a4e h PRO 167 CO 0.73 0.18 -0.99 0.94 -0.23 0.00 0.00 178.00 178.63 1a4e n GLN 168 N -4.45 0.51 0.22 0.86 7.27 -1.26 -4.60 117.38 115.92 1a4e n GLN 168 Ca 0.09 0.40 0.14 0.00 0.07 0.00 0.00 57.00 57.70 1a4e n GLN 168 Cb 0.42 -1.59 0.47 0.00 2.41 0.00 0.00 30.24 31.94 1a4e n GLN 168 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1a4e h THR 169 N -1.00 0.00 -2.25 1.69 1.35 -1.97 -3.46 112.91 107.27 1a4e h THR 169 Ca -0.12 -0.60 -0.33 0.00 -0.55 0.00 0.00 66.41 64.80 1a4e h THR 169 Cb 0.89 1.56 -0.08 0.00 -1.73 0.00 0.00 68.15 68.80 1a4e h THR 169 CO -0.07 0.00 -0.36 -3.20 -0.25 0.00 0.00 175.52 171.64 1a4e n ASN 170 N -2.85 -4.57 -4.84 5.36 4.05 -0.65 -4.97 115.26 106.80 1a4e n ASN 170 Ca 0.02 0.26 -0.28 0.00 0.45 0.00 0.00 54.58 55.03 1a4e n ASN 170 Cb 0.37 -3.99 -0.05 0.00 1.23 0.00 0.00 39.78 37.34 1a4e n ASN 170 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1a4e s LEU 171 N -4.94 4.00 0.10 1.20 1.43 -1.26 -4.73 118.68 114.48 1a4e s LEU 171 Ca 0.00 0.04 -0.31 0.00 -1.03 0.00 0.00 54.13 52.83 1a4e s LEU 171 Cb 0.00 -2.62 -0.07 0.00 0.03 0.00 0.00 46.19 43.53 1a4e s LEU 171 CO 0.00 0.12 1.28 -0.13 0.23 0.00 0.00 176.35 177.85 1a4e s ARG 172 N -2.78 4.39 -0.23 1.70 0.52 -1.26 -0.94 118.95 120.35 1a4e s ARG 172 Ca 0.32 1.92 -0.01 0.00 -0.52 0.00 0.00 55.73 57.43 1a4e s ARG 172 Cb -0.11 -3.29 0.02 0.00 0.52 0.00 0.00 34.95 32.08 1a4e s ARG 172 CO 0.25 -0.33 -0.10 0.34 0.02 0.00 0.00 175.30 175.48 1a4e s ASP 173 N 1.00 4.02 0.39 0.23 -1.08 -1.26 -4.93 116.67 115.05 1a4e s ASP 173 Ca 0.61 -0.78 0.16 0.00 -0.52 0.00 0.00 52.55 52.02 1a4e s ASP 173 Cb -0.33 -1.62 0.82 0.00 -1.46 0.00 0.00 42.92 40.33 1a4e s ASP 173 CO 0.30 -0.08 1.84 0.00 0.52 0.00 0.00 175.17 177.75 1a4e h ALA 174 N 7.99 1.28 -0.14 3.66 0.00 -1.91 -2.77 119.26 127.37 1a4e h ALA 174 Ca -0.36 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.22 1a4e h ALA 174 Cb 1.12 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1a4e h ALA 174 CO 0.59 0.43 0.00 -0.44 0.00 0.00 0.00 179.25 179.83 1a4e h ASP 175 N 0.00 0.23 -0.09 0.00 3.32 -1.94 -2.18 116.42 115.75 1a4e h ASP 175 Ca -0.00 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 56.76 1a4e h ASP 175 Cb 0.67 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1a4e h ASP 175 CO 0.04 0.47 0.02 0.24 -1.72 0.00 0.00 179.24 178.30 1a4e h MET 176 N -0.02 0.06 0.01 3.56 2.86 -1.86 0.83 114.93 120.37 1a4e h MET 176 Ca 0.04 -0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1a4e h MET 176 Cb 0.35 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.95 1a4e h MET 176 CO 0.01 0.04 -0.38 0.35 1.06 0.00 0.00 176.91 177.99 1a4e h PHE 177 N 0.07 -1.05 0.00 -0.22 3.04 -1.52 -1.49 116.94 115.77 1a4e h PHE 177 Ca 0.04 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 61.98 1a4e h PHE 177 Cb 0.03 0.46 -0.01 0.00 2.56 0.00 0.00 35.95 38.99 1a4e h PHE 177 CO -0.11 -0.46 -0.23 -1.49 -2.02 0.00 0.00 178.31 174.00 1a4e h TRP 178 N -0.54 0.00 -0.32 0.41 4.06 -1.33 -3.09 115.95 115.15 1a4e h TRP 178 Ca 0.05 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.92 1a4e h TRP 178 Cb 0.62 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.77 1a4e h TRP 178 CO -0.38 0.18 -0.12 0.22 -3.56 0.00 0.00 178.44 174.78 1a4e h ASP 179 N 0.00 0.65 0.28 -3.49 3.58 -0.49 -1.49 116.42 115.46 1a4e h ASP 179 Ca -0.00 -0.39 -0.01 0.00 0.42 0.00 0.00 57.03 57.04 1a4e h ASP 179 Cb 1.14 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.02 1a4e h ASP 179 CO 0.02 0.90 -0.14 0.15 -2.88 0.00 0.00 179.24 177.29 1a4e h PHE 180 N 0.41 -0.35 0.00 0.28 3.57 -1.33 -2.81 116.94 116.70 1a4e h PHE 180 Ca 0.07 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 1a4e h PHE 180 Cb 0.63 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.49 1a4e h PHE 180 CO 0.06 -0.13 -0.09 -0.07 -2.23 0.00 0.00 178.31 175.85 1a4e h LEU 181 N -0.51 0.00 -1.50 0.59 3.38 -1.51 -2.74 115.31 113.02 1a4e h LEU 181 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1a4e h LEU 181 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1a4e h LEU 181 CO 0.06 0.09 -0.11 0.35 0.09 0.00 0.00 178.44 178.92 1a4e n THR 182 N -4.03 0.00 -1.86 0.22 -2.24 -0.57 -3.98 114.28 101.83 1a4e n THR 182 Ca -0.03 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 60.95 1a4e n THR 182 Cb 0.17 1.22 -0.03 0.00 -2.10 0.00 0.00 70.33 69.60 1a4e n THR 182 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a4e s THR 183 N -2.13 2.74 0.23 4.28 2.01 -1.03 -4.87 115.64 116.86 1a4e s THR 183 Ca 0.27 0.32 -0.12 0.00 0.31 0.00 0.00 61.69 62.48 1a4e s THR 183 Cb 0.20 -3.21 0.29 0.00 0.01 0.00 0.00 72.50 69.79 1a4e s THR 183 CO 0.37 0.01 1.61 -0.65 -0.69 0.00 0.00 174.62 175.27 1a4e h PRO 184 N 7.96 0.01 0.00 4.92 0.11 -1.90 0.16 132.00 143.27 1a4e h PRO 184 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1a4e h PRO 184 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1a4e h PRO 184 CO 0.93 0.01 0.00 -0.85 -0.21 0.00 0.00 178.00 177.88 1a4e n GLU 185 N -5.46 0.11 0.00 1.05 0.00 -1.26 -2.48 120.64 112.60 1a4e n GLU 185 Ca 0.10 0.39 0.08 0.00 0.00 0.00 0.00 57.16 57.74 1a4e n GLU 185 Cb 0.38 -1.73 -0.01 0.00 0.00 0.00 0.00 31.44 30.08 1a4e n GLU 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1a4e n ASN 186 N -1.94 1.66 0.00 -1.84 3.02 0.02 -2.54 115.26 113.64 1a4e n ASN 186 Ca 0.02 -1.33 0.05 0.00 -0.03 0.00 0.00 54.58 53.29 1a4e n ASN 186 Cb 0.17 0.50 0.27 0.00 -0.61 0.00 0.00 39.78 40.11 1a4e n ASN 186 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a4e n GLN 187 N -0.16 0.15 0.11 3.52 6.02 -1.04 -1.73 117.38 124.26 1a4e n GLN 187 Ca 0.07 0.18 0.09 0.00 -0.01 0.00 0.00 57.00 57.33 1a4e n GLN 187 Cb 0.36 -1.50 0.43 0.00 1.02 0.00 0.00 30.24 30.54 1a4e n GLN 187 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1a4e n VAL 188 N -1.28 1.21 0.35 5.09 3.14 -1.26 -1.67 118.33 123.90 1a4e n VAL 188 Ca 0.05 0.56 0.10 0.00 -2.96 0.00 0.00 64.34 62.10 1a4e n VAL 188 Cb 0.08 -1.53 0.45 0.00 -1.06 0.00 0.00 33.84 31.78 1a4e n VAL 188 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1a4e n ALA 189 N -1.70 1.51 -0.19 1.55 0.00 -0.70 -4.12 120.51 116.87 1a4e n ALA 189 Ca -0.00 0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.64 1a4e n ALA 189 Cb 0.07 -1.33 0.44 0.00 0.00 0.00 0.00 19.45 18.63 1a4e n ALA 189 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1a4e h ILE 190 N 0.00 0.87 -0.42 0.00 -0.00 -1.59 -0.43 117.51 115.94 1a4e h ILE 190 Ca 0.00 -0.19 -0.03 0.00 -0.00 0.00 0.00 64.86 64.64 1a4e h ILE 190 Cb 0.26 0.26 -0.02 0.00 -0.00 0.00 0.00 36.82 37.32 1a4e h ILE 190 CO 0.00 0.10 0.16 -0.74 -0.00 0.00 0.00 178.15 177.67 1a4e h HIS 191 N 0.56 0.65 -0.19 2.19 2.76 -1.84 -1.92 115.15 117.36 1a4e h HIS 191 Ca 0.37 -0.05 -0.14 0.00 -2.20 0.00 0.00 60.37 58.34 1a4e h HIS 191 Cb 0.65 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 29.41 1a4e h HIS 191 CO -0.00 0.58 -0.47 0.37 -1.30 0.00 0.00 177.93 177.11 1a4e h GLN 192 N 0.53 0.49 -0.46 5.26 5.75 -1.62 -2.74 115.11 122.33 1a4e h GLN 192 Ca 0.14 -0.27 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 1a4e h GLN 192 Cb 0.21 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.75 1a4e h GLN 192 CO -0.01 0.86 0.16 0.28 -2.65 0.00 0.00 178.83 177.47 1a4e h VAL 193 N 0.39 1.18 -0.35 2.39 2.07 -0.84 -0.86 116.25 120.22 1a4e h VAL 193 Ca 0.02 -0.59 -0.06 0.00 0.82 0.00 0.00 66.70 66.89 1a4e h VAL 193 Cb 0.97 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1a4e h VAL 193 CO 0.09 0.22 -0.03 0.24 0.02 0.00 0.00 177.57 178.11 1a4e h MET 194 N 0.65 0.64 -0.45 1.57 2.86 -1.14 -2.08 114.93 116.98 1a4e h MET 194 Ca 0.16 -0.22 -0.12 0.00 -2.06 0.00 0.00 59.70 57.45 1a4e h MET 194 Cb 0.16 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1a4e h MET 194 CO -0.01 0.77 -0.21 0.82 1.06 0.00 0.00 176.91 179.34 1a4e h ILE 195 N 0.44 1.27 -0.48 -1.22 2.04 -1.25 -2.71 117.51 115.60 1a4e h ILE 195 Ca 0.10 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.59 1a4e h ILE 195 Cb 0.50 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1a4e h ILE 195 CO 0.02 0.47 0.26 0.25 0.00 0.00 0.00 178.15 179.15 1a4e h LEU 196 N 0.80 0.61 -0.93 1.44 5.85 -1.08 -2.88 115.31 119.12 1a4e h LEU 196 Ca 0.11 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1a4e h LEU 196 Cb 0.77 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1a4e h LEU 196 CO 0.06 0.53 0.00 0.49 -0.34 0.00 0.00 178.44 179.18 1a4e n PHE 197 N -4.66 0.23 -2.21 1.25 3.72 -0.79 -3.63 117.46 111.37 1a4e n PHE 197 Ca 0.02 -0.12 -0.26 0.00 -0.05 0.00 0.00 57.45 57.04 1a4e n PHE 197 Cb 0.09 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.74 1a4e n PHE 197 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1a4e s SER 198 N -1.40 4.23 0.00 4.37 1.04 -1.03 -4.43 113.70 116.49 1a4e s SER 198 Ca 0.28 0.21 0.15 0.00 0.48 0.00 0.00 55.95 57.07 1a4e s SER 198 Cb 0.14 -0.63 0.73 0.00 0.10 0.00 0.00 66.02 66.37 1a4e s SER 198 CO 0.21 -1.98 1.44 0.47 0.98 0.00 0.00 173.24 174.37 1a4e n ASP 199 N -3.14 0.00 0.27 7.02 8.00 -1.26 -1.38 116.55 126.06 1a4e n ASP 199 Ca 0.12 0.19 0.15 0.00 0.71 0.00 0.00 54.79 55.95 1a4e n ASP 199 Cb 0.60 -0.34 0.72 0.00 -0.02 0.00 0.00 41.12 42.08 1a4e n ASP 199 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1a4e h ARG 200 N 0.00 0.00 0.00 -1.24 2.47 -1.88 -2.08 114.38 111.65 1a4e h ARG 200 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1a4e h ARG 200 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 1a4e h ARG 200 CO 0.00 0.09 0.00 0.41 0.56 0.00 0.00 179.97 181.03 1a4e n GLY 201 N -0.34 -1.18 2.39 0.04 0.00 -0.48 -3.90 105.19 101.73 1a4e n GLY 201 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1a4e n GLY 201 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a4e n THR 202 N -1.84 0.63 -1.84 2.61 -2.24 -0.78 -2.05 114.28 108.77 1a4e n THR 202 Ca 0.03 -4.48 -0.36 0.00 -2.27 0.00 0.00 64.05 56.98 1a4e n THR 202 Cb 0.22 -2.00 0.05 0.00 -2.10 0.00 0.00 70.33 66.50 1a4e n THR 202 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1a4e s PRO 203 N -1.53 2.73 0.39 -0.78 0.04 -1.25 -1.17 135.00 133.43 1a4e s PRO 203 Ca 0.35 1.82 0.07 0.00 0.04 0.00 0.00 61.00 63.28 1a4e s PRO 203 Cb 0.12 -1.90 0.80 0.00 0.04 0.00 0.00 34.50 33.56 1a4e s PRO 203 CO -0.09 -1.39 1.99 0.00 0.04 0.00 0.00 177.00 177.54 1a4e h ALA 204 N 0.53 1.60 -1.67 8.56 0.00 -1.36 -3.41 119.26 123.51 1a4e h ALA 204 Ca -0.50 -0.11 0.30 0.00 0.00 0.00 0.00 54.91 54.61 1a4e h ALA 204 Cb 1.30 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.85 1a4e h ALA 204 CO 0.54 0.31 0.78 0.54 0.00 0.00 0.00 179.25 181.42 1a4e s ASN 205 N -6.76 -0.07 0.57 0.00 2.20 -1.26 -4.88 114.94 104.74 1a4e s ASN 205 Ca -0.07 -0.20 0.34 0.00 -0.94 0.00 0.00 52.86 51.99 1a4e s ASN 205 Cb 0.16 0.22 1.71 0.00 -2.00 0.00 0.00 41.25 41.34 1a4e s ASN 205 CO 0.74 -0.41 2.13 1.88 -2.94 0.00 0.00 177.10 178.50 1a4e h TYR 206 N 2.00 0.00 0.00 1.54 0.05 -1.90 -2.64 116.97 116.02 1a4e h TYR 206 Ca -0.29 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.49 1a4e h TYR 206 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 1a4e h TYR 206 CO 0.46 0.05 -0.01 0.00 -1.05 0.00 0.00 178.16 177.61 1a4e h ARG 207 N 0.00 0.00 -1.81 4.88 3.08 -1.96 -3.35 114.38 115.22 1a4e h ARG 207 Ca -0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1a4e h ARG 207 Cb 0.29 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 29.93 1a4e h ARG 207 CO 0.01 0.00 -0.59 -1.13 -1.07 0.00 0.00 179.97 177.18 1a4e n SER 208 N -2.85 4.81 -3.86 7.04 3.41 -0.99 -4.46 113.62 116.71 1a4e n SER 208 Ca 0.04 -3.71 -0.09 0.00 -0.26 0.00 0.00 58.87 54.85 1a4e n SER 208 Cb 0.50 -0.53 -0.08 0.00 -0.26 0.00 0.00 64.21 63.84 1a4e n SER 208 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a4e s MET 209 N -3.56 0.76 0.51 4.33 0.23 -1.26 -2.69 119.30 117.62 1a4e s MET 209 Ca 0.48 -0.81 0.02 0.00 -1.03 0.00 0.00 55.69 54.36 1a4e s MET 209 Cb 0.36 0.31 0.02 0.00 -1.53 0.00 0.00 34.83 33.99 1a4e s MET 209 CO -0.18 -0.23 0.72 -1.01 -2.03 0.00 0.00 175.02 172.29 1a4e s HIS 210 N -3.22 2.92 0.02 3.16 3.76 -1.26 -4.18 115.29 116.48 1a4e s HIS 210 Ca 0.00 -0.04 0.06 0.00 -0.15 0.00 0.00 55.06 54.93 1a4e s HIS 210 Cb 0.02 -2.61 -0.02 0.00 1.11 0.00 0.00 32.58 31.09 1a4e s HIS 210 CO -0.07 -0.70 -0.17 0.20 -0.85 0.00 0.00 174.74 173.14 1a4e s GLY 211 N -4.37 0.89 0.01 -2.22 0.00 0.11 -4.16 107.32 97.58 1a4e s GLY 211 Ca 0.55 -0.84 -0.00 0.00 0.00 0.00 0.00 44.72 44.43 1a4e s GLY 211 CO 0.37 -0.75 -0.01 -0.19 0.00 0.00 0.00 173.10 172.52 1a4e s TYR 212 N -0.61 0.16 0.21 1.90 1.51 -0.01 -0.39 117.35 120.12 1a4e s TYR 212 Ca 0.06 -0.33 -0.10 0.00 -1.01 0.00 0.00 57.07 55.69 1a4e s TYR 212 Cb -0.07 -0.12 0.20 0.00 -0.11 0.00 0.00 41.96 41.86 1a4e s TYR 212 CO 0.00 -0.13 1.84 1.03 -1.11 0.00 0.00 175.55 177.18 1a4e h SER 213 N 5.16 0.67 0.00 2.29 0.87 -1.58 -3.06 113.55 117.90 1a4e h SER 213 Ca -0.29 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 1a4e h SER 213 Cb 1.21 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1a4e h SER 213 CO 0.44 0.45 0.00 0.61 -0.53 0.00 0.00 176.83 177.81 1a4e n GLY 214 N -1.29 2.15 3.87 5.77 0.00 -1.25 -4.81 105.19 109.62 1a4e n GLY 214 Ca 0.08 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1a4e n GLY 214 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1a4e s HIS 215 N 0.00 3.32 0.13 1.61 3.76 -1.26 -4.80 115.29 118.05 1a4e s HIS 215 Ca 0.00 1.14 -0.23 0.00 -0.15 0.00 0.00 55.06 55.82 1a4e s HIS 215 Cb 0.00 -2.98 -0.07 0.00 1.11 0.00 0.00 32.58 30.63 1a4e s HIS 215 CO 0.00 -1.14 0.70 0.99 -0.85 0.00 0.00 174.74 174.44 1a4e s THR 216 N -3.27 4.51 0.36 1.30 2.01 -1.26 -4.68 115.64 114.60 1a4e s THR 216 Ca 0.58 1.53 0.08 0.00 0.31 0.00 0.00 61.69 64.19 1a4e s THR 216 Cb -0.12 -4.06 -0.07 0.00 0.01 0.00 0.00 72.50 68.27 1a4e s THR 216 CO 0.53 0.53 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.64 1a4e s TYR 217 N -1.08 2.33 -0.25 4.92 1.51 -0.13 -3.37 117.35 121.27 1a4e s TYR 217 Ca 0.33 -0.63 -0.01 0.00 -1.01 0.00 0.00 57.07 55.76 1a4e s TYR 217 Cb -0.22 -1.47 0.04 0.00 -0.11 0.00 0.00 41.96 40.20 1a4e s TYR 217 CO 0.24 0.43 -0.07 0.15 -1.11 0.00 0.00 175.55 175.19 1a4e s LYS 218 N -3.69 2.66 -0.06 -0.62 1.02 0.02 -0.55 119.74 118.52 1a4e s LYS 218 Ca 0.33 -1.09 0.01 0.00 0.02 0.00 0.00 55.97 55.24 1a4e s LYS 218 Cb 0.06 -2.96 -0.03 0.00 -0.52 0.00 0.00 37.83 34.38 1a4e s LYS 218 CO 0.16 -0.45 -0.05 -1.58 -0.92 0.00 0.00 175.35 172.51 1a4e s TRP 219 N 1.27 2.99 0.07 3.18 0.52 -0.73 -1.06 118.94 125.18 1a4e s TRP 219 Ca -0.02 0.06 0.03 0.00 0.02 0.00 0.00 56.10 56.18 1a4e s TRP 219 Cb -0.17 -1.72 -0.03 0.00 -1.15 0.00 0.00 33.47 30.40 1a4e s TRP 219 CO -0.05 0.37 -0.09 -1.54 0.02 0.00 0.00 176.95 175.67 1a4e s SER 220 N -0.91 1.11 0.80 2.95 1.04 -0.63 -1.33 113.70 116.73 1a4e s SER 220 Ca 0.13 -0.72 -0.06 0.00 0.48 0.00 0.00 55.95 55.79 1a4e s SER 220 Cb -0.11 0.04 0.15 0.00 0.10 0.00 0.00 66.02 66.20 1a4e s SER 220 CO 0.03 -0.27 1.10 0.54 0.98 0.00 0.00 173.24 175.62 1a4e s ASN 221 N -2.11 3.94 0.08 7.02 2.20 -0.29 -0.81 114.94 124.96 1a4e s ASN 221 Ca -0.01 -0.16 0.16 0.00 -0.94 0.00 0.00 52.86 51.91 1a4e s ASN 221 Cb -0.05 -0.10 0.70 0.00 -2.00 0.00 0.00 41.25 39.79 1a4e s ASN 221 CO -0.01 -2.15 1.51 0.29 -2.94 0.00 0.00 177.10 173.80 1a4e n LYS 222 N -3.14 0.06 -0.16 3.55 5.02 -1.26 -2.26 118.16 119.95 1a4e n LYS 222 Ca 0.15 0.32 0.10 0.00 -2.02 0.00 0.00 58.31 56.86 1a4e n LYS 222 Cb 0.60 -1.61 0.28 0.00 -0.02 0.00 0.00 35.03 34.28 1a4e n LYS 222 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1a4e n ASN 223 N -1.72 2.60 0.00 4.39 3.02 -1.26 -4.95 115.26 117.35 1a4e n ASN 223 Ca 0.03 -1.89 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 1a4e n ASN 223 Cb 0.18 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 1a4e n ASN 223 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4e n GLY 224 N 1.32 0.70 3.77 7.41 0.00 -0.96 -5.03 105.19 112.39 1a4e n GLY 224 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1a4e n GLY 224 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a4e s ASP 225 N -2.32 7.24 0.19 1.61 1.01 -1.26 -4.91 116.67 118.24 1a4e s ASP 225 Ca 0.00 1.48 0.04 0.00 0.71 0.00 0.00 52.55 54.78 1a4e s ASP 225 Cb 0.00 -2.46 -0.05 0.00 1.01 0.00 0.00 42.92 41.43 1a4e s ASP 225 CO 0.00 0.14 -0.05 -1.66 0.21 0.00 0.00 175.17 173.81 1a4e s TRP 226 N -0.67 1.43 0.00 4.23 1.48 -1.26 -1.14 118.94 123.01 1a4e s TRP 226 Ca 0.35 -0.83 -0.05 0.00 -1.06 0.00 0.00 56.10 54.51 1a4e s TRP 226 Cb -0.21 -0.78 -0.00 0.00 -1.16 0.00 0.00 33.47 31.31 1a4e s TRP 226 CO 0.23 0.03 0.09 -1.01 -4.06 0.00 0.00 176.95 172.23 1a4e s HIS 227 N -3.36 0.08 0.07 1.66 3.76 -0.44 -4.77 115.29 112.29 1a4e s HIS 227 Ca 0.23 -0.19 -0.30 0.00 -0.15 0.00 0.00 55.06 54.64 1a4e s HIS 227 Cb 0.04 -0.08 -0.05 0.00 1.11 0.00 0.00 32.58 33.60 1a4e s HIS 227 CO 0.05 -0.23 1.06 0.71 -0.85 0.00 0.00 174.74 175.48 1a4e s TYR 228 N -1.23 3.61 0.05 1.40 2.02 0.38 -1.77 117.35 121.82 1a4e s TYR 228 Ca -0.13 1.58 0.05 0.00 -0.37 0.00 0.00 57.07 58.20 1a4e s TYR 228 Cb -0.07 -3.22 -0.02 0.00 -0.40 0.00 0.00 41.96 38.24 1a4e s TYR 228 CO 0.01 -0.45 -0.14 0.08 -1.57 0.00 0.00 175.55 173.47 1a4e s VAL 229 N 0.61 1.14 -0.03 0.71 1.01 0.29 -0.89 120.40 123.24 1a4e s VAL 229 Ca 0.53 -1.11 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1a4e s VAL 229 Cb -0.25 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.08 1a4e s VAL 229 CO 0.30 -0.06 -0.07 -1.10 0.00 0.00 0.00 175.10 174.18 1a4e s GLN 230 N -1.34 0.80 -0.10 2.72 -0.21 -0.58 -0.96 119.66 120.00 1a4e s GLN 230 Ca 0.01 -0.21 -0.05 0.00 0.02 0.00 0.00 55.36 55.13 1a4e s GLN 230 Cb -0.09 -0.77 -0.04 0.00 1.00 0.00 0.00 33.01 33.12 1a4e s GLN 230 CO 0.02 0.04 0.09 0.08 -2.12 0.00 0.00 175.29 173.40 1a4e s VAL 231 N 0.38 5.09 -0.12 1.09 1.01 -1.26 -0.87 120.40 125.72 1a4e s VAL 231 Ca -0.05 0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.96 1a4e s VAL 231 Cb -0.09 -3.21 0.02 0.00 0.00 0.00 0.00 36.38 33.10 1a4e s VAL 231 CO 0.00 0.59 -0.13 -1.00 0.00 0.00 0.00 175.10 174.57 1a4e s HIS 232 N -1.00 1.88 -0.47 5.22 3.76 -0.08 -1.52 115.29 123.08 1a4e s HIS 232 Ca 0.15 -0.96 -0.03 0.00 -0.15 0.00 0.00 55.06 54.07 1a4e s HIS 232 Cb -0.12 -1.41 0.13 0.00 1.11 0.00 0.00 32.58 32.28 1a4e s HIS 232 CO 0.04 -0.54 0.28 0.42 -0.85 0.00 0.00 174.74 174.09 1a4e s ILE 233 N 1.34 3.47 -0.07 0.60 1.01 0.48 -0.75 121.20 127.28 1a4e s ILE 233 Ca 0.00 -2.29 -0.19 0.00 0.00 0.00 0.00 60.65 58.17 1a4e s ILE 233 Cb -0.14 -3.34 -0.05 0.00 0.01 0.00 0.00 42.46 38.95 1a4e s ILE 233 CO -0.06 -0.75 0.54 -0.54 0.00 0.00 0.00 174.94 174.12 1a4e s LYS 234 N 0.82 4.32 0.11 2.79 -0.14 -0.25 -0.71 119.74 126.68 1a4e s LYS 234 Ca 0.10 0.59 -0.31 0.00 -1.36 0.00 0.00 55.97 54.99 1a4e s LYS 234 Cb -0.22 -3.40 -0.08 0.00 -1.68 0.00 0.00 37.83 32.45 1a4e s LYS 234 CO -0.04 0.23 1.34 -0.08 -0.76 0.00 0.00 175.35 176.05 1a4e s THR 235 N 0.32 3.45 -0.65 2.17 -1.32 -1.26 -0.43 115.64 117.92 1a4e s THR 235 Ca 0.29 1.05 0.25 0.00 -1.21 0.00 0.00 61.69 62.07 1a4e s THR 235 Cb -0.16 -3.67 0.29 0.00 -1.51 0.00 0.00 72.50 67.44 1a4e s THR 235 CO 0.14 0.09 1.72 0.44 -2.21 0.00 0.00 174.62 174.79 1a4e h ASP 236 N 6.68 0.00 1.82 8.08 3.32 -1.68 -3.11 116.42 131.52 1a4e h ASP 236 Ca -0.42 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1a4e h ASP 236 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1a4e h ASP 236 CO 0.85 0.00 -0.01 1.56 -1.72 0.00 0.00 179.24 179.91 1a4e h GLN 237 N 0.00 0.00 0.00 3.56 7.50 -1.78 -3.50 115.11 120.89 1a4e h GLN 237 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1a4e h GLN 237 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.33 1a4e h GLN 237 CO 0.00 0.00 0.00 0.41 -1.50 0.00 0.00 178.83 177.74 1a4e n GLY 238 N 1.17 0.26 3.69 3.46 0.00 -1.18 -4.94 105.19 107.65 1a4e n GLY 238 Ca 0.04 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 1a4e n GLY 238 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4e s ILE 239 N -2.78 3.77 -0.02 -0.61 -1.09 -1.26 -4.49 121.20 114.72 1a4e s ILE 239 Ca 0.00 1.16 0.00 0.00 -2.23 0.00 0.00 60.65 59.59 1a4e s ILE 239 Cb 0.00 -3.75 0.02 0.00 -1.58 0.00 0.00 42.46 37.16 1a4e s ILE 239 CO 0.00 0.01 0.01 -0.75 -1.23 0.00 0.00 174.94 172.97 1a4e s LYS 240 N 2.24 0.18 0.24 2.79 2.20 -1.10 -5.05 119.74 121.24 1a4e s LYS 240 Ca 0.63 0.08 0.08 0.00 -0.36 0.00 0.00 55.97 56.40 1a4e s LYS 240 Cb -0.31 -0.36 -0.05 0.00 -1.51 0.00 0.00 37.83 35.60 1a4e s LYS 240 CO 0.26 -0.12 -0.12 -0.80 -0.36 0.00 0.00 175.35 174.21 1a4e s ASN 241 N 0.87 2.75 0.19 1.43 0.01 -1.26 -1.09 114.94 117.83 1a4e s ASN 241 Ca -0.08 -1.07 0.05 0.00 -0.71 0.00 0.00 52.86 51.04 1a4e s ASN 241 Cb -0.12 -0.16 -0.04 0.00 0.41 0.00 0.00 41.25 41.34 1a4e s ASN 241 CO -0.02 -0.20 0.18 -0.76 -1.51 0.00 0.00 177.10 174.79 1a4e s LEU 242 N -3.38 3.91 0.66 0.60 1.43 -0.32 -4.60 118.68 116.98 1a4e s LEU 242 Ca 0.25 -0.10 -0.06 0.00 -1.03 0.00 0.00 54.13 53.19 1a4e s LEU 242 Cb 0.00 -2.49 0.04 0.00 0.03 0.00 0.00 46.19 43.77 1a4e s LEU 242 CO 0.09 0.04 0.97 0.42 0.23 0.00 0.00 176.35 178.10 1a4e s THR 243 N -1.85 2.85 0.34 5.49 -4.23 -1.26 -4.71 115.64 112.28 1a4e s THR 243 Ca 0.32 -0.14 0.10 0.00 -1.18 0.00 0.00 61.69 60.79 1a4e s THR 243 Cb -0.10 -3.19 0.08 0.00 1.34 0.00 0.00 72.50 70.63 1a4e s THR 243 CO 0.25 -0.20 1.78 -0.29 -0.54 0.00 0.00 174.62 175.62 1a4e h ILE 244 N -0.43 1.28 -0.42 2.99 6.09 -1.97 -1.68 117.51 123.38 1a4e h ILE 244 Ca -0.45 -1.35 -0.07 0.00 -1.37 0.00 0.00 64.86 61.62 1a4e h ILE 244 Cb 1.29 1.66 -0.01 0.00 0.47 0.00 0.00 36.82 40.23 1a4e h ILE 244 CO 0.60 0.39 -0.02 -0.33 -3.07 0.00 0.00 178.15 175.72 1a4e h GLU 245 N 0.09 0.75 -0.40 2.19 3.07 -1.99 -1.00 114.58 117.29 1a4e h GLU 245 Ca 0.01 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 58.60 1a4e h GLU 245 Cb 0.70 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.53 1a4e h GLU 245 CO 0.05 0.84 0.17 0.93 -1.40 0.00 0.00 179.01 179.60 1a4e h GLU 246 N 0.58 0.58 -0.66 2.33 5.08 -1.90 -2.22 114.58 118.38 1a4e h GLU 246 Ca 0.12 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1a4e h GLU 246 Cb 0.52 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1a4e h GLU 246 CO 0.03 0.54 0.24 0.00 -1.00 0.00 0.00 179.01 178.81 1a4e h ALA 247 N 1.01 1.18 -0.41 3.43 0.00 -1.19 -1.47 119.26 121.81 1a4e h ALA 247 Ca 0.13 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1a4e h ALA 247 Cb 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1a4e h ALA 247 CO -0.01 0.58 -0.32 1.15 0.00 0.00 0.00 179.25 180.65 1a4e h THR 248 N 0.95 1.27 -0.59 0.00 2.02 -1.08 -0.85 112.91 114.64 1a4e h THR 248 Ca 0.22 -1.49 -0.09 0.00 0.77 0.00 0.00 66.41 65.82 1a4e h THR 248 Cb 0.22 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1a4e h THR 248 CO -0.01 0.50 0.02 0.11 0.37 0.00 0.00 175.52 176.51 1a4e h LYS 249 N 0.77 1.03 0.00 6.66 1.57 -1.12 -2.78 116.57 122.71 1a4e h LYS 249 Ca 0.08 -0.32 -0.09 0.00 -1.87 0.00 0.00 60.65 58.45 1a4e h LYS 249 Cb 0.90 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1a4e h LYS 249 CO 0.08 1.01 -0.43 0.82 -0.57 0.00 0.00 179.45 180.36 1a4e h ILE 250 N 0.93 0.99 -0.52 1.86 2.04 -1.21 -2.33 117.51 119.28 1a4e h ILE 250 Ca 0.17 -1.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.33 1a4e h ILE 250 Cb 0.53 2.01 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 1a4e h ILE 250 CO 0.03 0.43 0.32 0.00 0.00 0.00 0.00 178.15 178.92 1a4e h ALA 251 N 1.57 1.59 0.12 1.87 0.00 -0.86 0.74 119.26 124.29 1a4e h ALA 251 Ca -0.00 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 1a4e h ALA 251 Cb 0.98 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1a4e h ALA 251 CO 0.06 0.36 -1.15 0.78 0.00 0.00 0.00 179.25 179.30 1a4e h GLY 252 N 0.73 0.29 0.88 0.00 0.00 -1.50 -3.30 103.07 100.16 1a4e h GLY 252 Ca 0.19 -0.73 -0.04 0.00 0.00 0.00 0.00 47.33 46.74 1a4e h GLY 252 CO -0.04 0.64 -0.38 0.23 0.00 0.00 0.00 176.54 177.00 1a4e h SER 253 N -0.37 -0.89 -3.01 0.19 0.87 -1.26 -3.41 113.55 105.67 1a4e h SER 253 Ca -0.24 0.02 -0.57 0.00 -1.23 0.00 0.00 61.79 59.77 1a4e h SER 253 Cb 1.68 0.23 -0.40 0.00 -0.44 0.00 0.00 62.40 63.48 1a4e h SER 253 CO 0.08 -0.57 -0.77 0.21 -0.53 0.00 0.00 176.83 175.26 1a4e s ASN 254 N -4.32 3.73 0.65 6.23 2.47 0.24 -5.00 114.94 118.95 1a4e s ASN 254 Ca -0.17 -1.66 0.42 0.00 0.42 0.00 0.00 52.86 51.88 1a4e s ASN 254 Cb 0.02 -0.66 2.28 0.00 -1.45 0.00 0.00 41.25 41.44 1a4e s ASN 254 CO 0.54 -0.40 2.33 -0.65 -3.72 0.00 0.00 177.10 175.20 1a4e h PRO 255 N 7.98 0.00 -0.46 0.43 0.11 -1.67 -2.77 132.00 135.62 1a4e h PRO 255 Ca -0.13 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.77 1a4e h PRO 255 Cb 1.00 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.98 1a4e h PRO 255 CO 0.44 0.00 0.06 -0.25 -0.21 0.00 0.00 178.00 178.04 1a4e n ASP 256 N -3.18 2.90 -0.13 -2.05 8.00 -1.26 -0.73 116.55 120.10 1a4e n ASP 256 Ca -0.03 -3.65 -0.05 0.00 0.71 0.00 0.00 54.79 51.77 1a4e n ASP 256 Cb 0.09 -0.66 0.02 0.00 -0.02 0.00 0.00 41.12 40.55 1a4e n ASP 256 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1a4e h TYR 257 N 1.14 -0.30 -0.06 1.24 3.20 -1.84 -0.72 116.97 119.64 1a4e h TYR 257 Ca 0.27 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 62.04 1a4e h TYR 257 Cb 1.85 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 40.30 1a4e h TYR 257 CO 1.08 -0.21 -0.57 0.00 -1.64 0.00 0.00 178.16 176.81 1a4e h GLN 259 N 0.13 0.50 -0.66 0.00 5.75 -1.81 -2.15 115.11 116.87 1a4e h GLN 259 Ca -0.00 -0.11 -0.04 0.00 -0.15 0.00 0.00 58.65 58.35 1a4e h GLN 259 Cb 1.05 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.50 1a4e h GLN 259 CO 0.09 0.54 0.27 0.37 -2.65 0.00 0.00 178.83 177.44 1a4e h GLN 260 N 0.37 0.99 -0.51 1.69 4.15 -1.01 -1.42 115.11 119.38 1a4e h GLN 260 Ca 0.10 -0.18 -0.05 0.00 0.77 0.00 0.00 58.65 59.30 1a4e h GLN 260 Cb 0.24 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 1a4e h GLN 260 CO -0.00 0.83 0.14 0.22 -1.93 0.00 0.00 178.83 178.09 1a4e h ASP 261 N 0.94 0.76 -0.27 -0.69 1.82 -1.19 -0.81 116.42 116.97 1a4e h ASP 261 Ca 0.22 -0.22 -0.06 0.00 -0.39 0.00 0.00 57.03 56.59 1a4e h ASP 261 Cb 0.21 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.01 1a4e h ASP 261 CO -0.02 0.78 -0.05 0.25 -1.61 0.00 0.00 179.24 178.59 1a4e h LEU 262 N 0.70 0.51 0.14 2.28 5.85 -1.20 -1.75 115.31 121.83 1a4e h LEU 262 Ca 0.16 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1a4e h LEU 262 Cb 0.30 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1a4e h LEU 262 CO -0.00 0.74 -0.07 0.15 -0.34 0.00 0.00 178.44 178.92 1a4e h PHE 263 N 0.27 -0.17 -0.43 1.25 3.04 -1.19 -2.62 116.94 117.09 1a4e h PHE 263 Ca 0.07 -0.00 -0.08 0.00 3.98 0.00 0.00 57.97 61.94 1a4e h PHE 263 Cb 0.51 0.06 -0.02 0.00 2.56 0.00 0.00 35.95 39.05 1a4e h PHE 263 CO 0.05 -0.05 -0.05 0.93 -2.02 0.00 0.00 178.31 177.16 1a4e h GLU 264 N -0.24 0.73 -0.63 1.11 5.08 -1.20 -1.10 114.58 118.32 1a4e h GLU 264 Ca -0.02 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.09 1a4e h GLU 264 Cb 0.19 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1a4e h GLU 264 CO 0.03 0.78 0.24 0.00 -1.00 0.00 0.00 179.01 179.06 1a4e h ALA 265 N 1.27 0.82 -0.12 3.43 0.00 -1.24 -0.92 119.26 122.50 1a4e h ALA 265 Ca 0.13 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 1a4e h ALA 265 Cb 0.50 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1a4e h ALA 265 CO 0.03 0.45 -0.71 0.82 0.00 0.00 0.00 179.25 179.84 1a4e h ILE 266 N 0.89 1.34 -0.26 0.00 2.04 -1.31 0.19 117.51 120.41 1a4e h ILE 266 Ca 0.21 -2.04 -0.07 0.00 1.00 0.00 0.00 64.86 63.96 1a4e h ILE 266 Cb 0.22 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1a4e h ILE 266 CO -0.02 0.62 -0.14 -0.61 0.00 0.00 0.00 178.15 178.01 1a4e h GLN 267 N 0.37 0.44 -0.05 2.37 4.15 -1.03 -2.18 115.11 119.18 1a4e h GLN 267 Ca -0.03 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.27 1a4e h GLN 267 Cb 1.29 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.93 1a4e h GLN 267 CO 0.13 0.58 0.00 0.09 -1.93 0.00 0.00 178.83 177.70 1a4e n ASN 268 N -4.20 0.93 0.00 -0.69 3.02 -0.37 -4.92 115.26 109.03 1a4e n ASN 268 Ca 0.00 -1.45 0.00 0.00 -0.03 0.00 0.00 54.58 53.11 1a4e n ASN 268 Cb 0.32 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 1a4e n ASN 268 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4e n GLY 269 N 1.04 0.62 2.94 7.41 0.00 -0.82 -4.95 105.19 111.42 1a4e n GLY 269 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1a4e n GLY 269 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1a4e n ASN 270 N 0.00 5.58 -4.67 1.61 4.05 0.66 -4.99 115.26 117.50 1a4e n ASN 270 Ca 0.00 -3.21 -0.42 0.00 0.45 0.00 0.00 54.58 51.39 1a4e n ASN 270 Cb 0.00 -1.41 -0.03 0.00 1.23 0.00 0.00 39.78 39.58 1a4e n ASN 270 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1a4e s TYR 271 N -0.74 2.01 0.30 1.20 2.02 -1.26 -4.38 117.35 116.50 1a4e s TYR 271 Ca 0.36 0.09 -0.29 0.00 -0.37 0.00 0.00 57.07 56.87 1a4e s TYR 271 Cb 0.07 -4.02 -0.10 0.00 -0.40 0.00 0.00 41.96 37.52 1a4e s TYR 271 CO 0.04 -4.26 1.22 -1.25 -1.57 0.00 0.00 175.55 169.72 1a4e s PRO 272 N 3.53 4.48 0.09 -1.71 0.04 -1.24 -4.90 135.00 135.30 1a4e s PRO 272 Ca 0.77 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.86 1a4e s PRO 272 Cb -0.38 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1a4e s PRO 272 CO 0.33 -0.02 -0.07 -1.54 0.04 0.00 0.00 177.00 175.74 1a4e s SER 273 N -0.61 1.16 0.01 6.66 1.04 -1.26 -1.50 113.70 119.20 1a4e s SER 273 Ca 0.47 -0.92 0.01 0.00 0.48 0.00 0.00 55.95 55.99 1a4e s SER 273 Cb -0.36 0.07 -0.01 0.00 0.10 0.00 0.00 66.02 65.82 1a4e s SER 273 CO 0.47 -0.40 -0.05 0.26 0.98 0.00 0.00 173.24 174.50 1a4e s TRP 274 N -3.17 0.42 -0.25 5.02 0.51 -0.36 -1.89 118.94 119.22 1a4e s TRP 274 Ca 0.08 -0.23 -0.10 0.00 -2.12 0.00 0.00 56.10 53.73 1a4e s TRP 274 Cb 0.02 -0.27 -0.05 0.00 -0.81 0.00 0.00 33.47 32.37 1a4e s TRP 274 CO -0.03 -0.05 0.15 0.99 -0.51 0.00 0.00 176.95 177.50 1a4e s THR 275 N -0.59 5.23 -0.13 2.01 2.01 0.43 -1.56 115.64 123.05 1a4e s THR 275 Ca -0.04 0.14 -0.23 0.00 0.31 0.00 0.00 61.69 61.87 1a4e s THR 275 Cb -0.05 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 1a4e s THR 275 CO -0.00 0.33 0.69 -0.69 -0.69 0.00 0.00 174.62 174.26 1a4e s VAL 276 N 1.22 5.02 0.12 3.82 1.01 -0.45 -1.09 120.40 130.05 1a4e s VAL 276 Ca 0.07 1.37 0.07 0.00 0.00 0.00 0.00 61.98 63.48 1a4e s VAL 276 Cb -0.14 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 1a4e s VAL 276 CO 0.06 0.17 -0.16 -0.31 0.00 0.00 0.00 175.10 174.86 1a4e s TYR 277 N 1.38 1.52 0.10 5.22 1.51 0.08 -0.74 117.35 126.43 1a4e s TYR 277 Ca 0.34 -0.50 0.07 0.00 -1.01 0.00 0.00 57.07 55.96 1a4e s TYR 277 Cb -0.17 -0.80 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1a4e s TYR 277 CO 0.14 0.18 -0.17 0.96 -1.11 0.00 0.00 175.55 175.55 1a4e s ILE 278 N -1.87 1.46 -0.13 2.71 -4.36 0.31 -0.90 121.20 118.43 1a4e s ILE 278 Ca 0.09 -1.55 -0.02 0.00 -0.26 0.00 0.00 60.65 58.91 1a4e s ILE 278 Cb -0.06 -1.44 -0.03 0.00 1.25 0.00 0.00 42.46 42.18 1a4e s ILE 278 CO 0.04 -0.21 -0.06 -1.10 0.24 0.00 0.00 174.94 173.84 1a4e s GLN 279 N -2.12 3.36 0.27 0.37 -0.21 -0.05 -0.87 119.66 120.41 1a4e s GLN 279 Ca 0.05 -0.56 0.11 0.00 0.02 0.00 0.00 55.36 54.99 1a4e s GLN 279 Cb -0.08 -2.77 -0.05 0.00 1.00 0.00 0.00 33.01 31.11 1a4e s GLN 279 CO 0.04 0.36 -0.14 0.95 -2.12 0.00 0.00 175.29 174.37 1a4e s THR 280 N 0.03 2.78 -0.18 -0.19 -4.23 -1.26 -1.52 115.64 111.06 1a4e s THR 280 Ca -0.01 -2.21 -0.25 0.00 -1.18 0.00 0.00 61.69 58.05 1a4e s THR 280 Cb -0.14 -2.46 0.06 0.00 1.34 0.00 0.00 72.50 71.31 1a4e s THR 280 CO 0.03 -0.36 0.65 -0.32 -0.54 0.00 0.00 174.62 174.08 1a4e s MET 281 N -3.47 0.84 0.65 3.99 0.00 -0.07 -4.94 119.30 116.30 1a4e s MET 281 Ca 0.30 0.69 -0.01 0.00 0.00 0.00 0.00 55.69 56.66 1a4e s MET 281 Cb -0.06 0.40 0.08 0.00 0.00 0.00 0.00 34.83 35.25 1a4e s MET 281 CO 0.16 -0.16 0.91 0.95 0.00 0.00 0.00 175.02 176.88 1a4e s THR 282 N -0.14 2.38 0.19 10.11 -4.23 -1.26 -0.47 115.64 122.22 1a4e s THR 282 Ca -0.04 -0.57 -0.11 0.00 -1.18 0.00 0.00 61.69 59.79 1a4e s THR 282 Cb -0.03 -2.80 0.11 0.00 1.34 0.00 0.00 72.50 71.12 1a4e s THR 282 CO 0.03 0.00 1.82 -0.08 -0.54 0.00 0.00 174.62 175.85 1a4e h GLU 283 N -0.30 0.91 -0.72 3.99 4.81 -1.99 -2.29 114.58 119.00 1a4e h GLU 283 Ca -0.40 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1a4e h GLU 283 Cb 1.29 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 1a4e h GLU 283 CO 0.48 0.67 0.46 0.00 -0.73 0.00 0.00 179.01 179.89 1a4e h ARG 284 N 0.91 0.95 -0.66 1.92 3.08 -2.00 -2.52 114.38 116.05 1a4e h ARG 284 Ca 0.24 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 1a4e h ARG 284 Cb 0.00 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 1a4e h ARG 284 CO -0.04 0.65 0.30 -0.44 -1.07 0.00 0.00 179.97 179.37 1a4e h ASP 285 N 0.97 0.85 -0.92 7.04 3.32 -1.90 -3.06 116.42 122.73 1a4e h ASP 285 Ca 0.26 -0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.24 1a4e h ASP 285 Cb -0.09 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.20 1a4e h ASP 285 CO -0.05 0.73 0.60 0.00 -1.72 0.00 0.00 179.24 178.80 1a4e h ALA 286 N 1.40 1.38 0.00 3.45 0.00 -0.97 -2.50 119.26 122.02 1a4e h ALA 286 Ca 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a4e h ALA 286 Cb 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1a4e h ALA 286 CO -0.03 0.56 0.00 1.63 0.00 0.00 0.00 179.25 181.41 1a4e n LYS 287 N -4.41 0.15 0.06 0.00 5.02 -1.16 -2.69 118.16 115.12 1a4e n LYS 287 Ca 0.11 0.22 0.12 0.00 -2.02 0.00 0.00 58.31 56.75 1a4e n LYS 287 Cb 0.05 -1.71 0.15 0.00 -0.02 0.00 0.00 35.03 33.50 1a4e n LYS 287 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1a4e h LYS 288 N 0.00 0.00 -6.95 1.97 1.57 -1.48 -3.48 116.57 108.21 1a4e h LYS 288 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1a4e h LYS 288 Cb 0.51 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.92 1a4e h LYS 288 CO 0.00 0.00 0.67 -0.51 -0.57 0.00 0.00 179.45 179.04 1a4e s LEU 289 N -4.29 4.24 0.00 2.94 1.43 -1.10 -4.93 118.68 116.97 1a4e s LEU 289 Ca 0.06 2.80 0.19 0.00 -1.03 0.00 0.00 54.13 56.14 1a4e s LEU 289 Cb 0.13 -3.83 1.14 0.00 0.03 0.00 0.00 46.19 43.66 1a4e s LEU 289 CO 0.73 -0.89 1.53 -0.81 0.23 0.00 0.00 176.35 177.15 1a4e n PRO 290 N 0.21 0.59 -4.15 1.29 -0.04 -1.26 -4.77 135.00 126.87 1a4e n PRO 290 Ca 0.03 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.36 1a4e n PRO 290 Cb 0.42 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.30 1a4e n PRO 290 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1a4e s PHE 291 N -2.01 1.10 0.10 0.54 -0.12 -1.26 -5.09 117.98 111.24 1a4e s PHE 291 Ca 0.29 -1.29 -0.22 0.00 -0.05 0.00 0.00 56.93 55.66 1a4e s PHE 291 Cb 0.13 -0.35 -0.07 0.00 -0.63 0.00 0.00 43.02 42.10 1a4e s PHE 291 CO 0.22 -0.85 0.66 0.45 -0.05 0.00 0.00 175.22 175.65 1a4e s SER 292 N -3.19 7.19 0.32 1.98 0.15 -1.26 -4.96 113.70 113.92 1a4e s SER 292 Ca 0.34 1.41 0.25 0.00 0.70 0.00 0.00 55.95 58.65 1a4e s SER 292 Cb 0.03 -2.42 1.10 0.00 -1.71 0.00 0.00 66.02 63.03 1a4e s SER 292 CO 0.16 0.23 1.76 -0.37 1.20 0.00 0.00 173.24 176.22 1a4e h VAL 293 N 3.53 0.00 -0.23 4.45 -1.51 -1.97 -2.70 116.25 117.81 1a4e h VAL 293 Ca -0.48 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1a4e h VAL 293 Cb 1.21 0.98 0.00 0.00 -2.13 0.00 0.00 31.29 31.35 1a4e h VAL 293 CO 0.65 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 177.48 1a4e n PHE 294 N -2.39 0.31 -3.58 5.19 3.72 -1.26 -4.34 117.46 115.11 1a4e n PHE 294 Ca 0.01 -0.15 -0.40 0.00 -0.05 0.00 0.00 57.45 56.86 1a4e n PHE 294 Cb 0.21 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.64 1a4e n PHE 294 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1a4e s ASP 295 N -1.34 5.84 0.50 4.37 -1.08 -1.02 -4.31 116.67 119.62 1a4e s ASP 295 Ca 0.29 -0.56 0.23 0.00 -0.52 0.00 0.00 52.55 51.98 1a4e s ASP 295 Cb 0.15 -2.08 1.30 0.00 -1.46 0.00 0.00 42.92 40.84 1a4e s ASP 295 CO 0.22 -0.25 2.05 0.25 0.52 0.00 0.00 175.17 177.96 1a4e h LEU 296 N 8.44 0.00 -0.33 -1.34 6.46 -1.87 -2.75 115.31 123.93 1a4e h LEU 296 Ca -0.31 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.45 1a4e h LEU 296 Cb 1.14 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.07 1a4e h LEU 296 CO 0.64 0.14 0.00 0.35 -0.62 0.00 0.00 178.44 178.95 1a4e n THR 297 N -3.90 0.08 -4.96 1.05 -2.24 -1.26 -3.31 114.28 99.74 1a4e n THR 297 Ca -0.02 -0.11 -0.31 0.00 -2.27 0.00 0.00 64.05 61.34 1a4e n THR 297 Cb 0.23 -0.06 -0.14 0.00 -2.10 0.00 0.00 70.33 68.26 1a4e n THR 297 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1a4e s LYS 298 N -1.92 2.10 0.15 -0.78 -0.14 -1.04 -4.88 119.74 113.23 1a4e s LYS 298 Ca 0.23 -0.94 0.06 0.00 -1.36 0.00 0.00 55.97 53.97 1a4e s LYS 298 Cb 0.11 -2.13 -0.04 0.00 -1.68 0.00 0.00 37.83 34.09 1a4e s LYS 298 CO 0.18 0.56 0.02 0.14 -0.76 0.00 0.00 175.35 175.48 1a4e s VAL 299 N -0.76 3.89 -0.18 3.17 -7.23 -1.26 -4.91 120.40 113.11 1a4e s VAL 299 Ca 0.12 -1.27 -0.19 0.00 -1.81 0.00 0.00 61.98 58.83 1a4e s VAL 299 Cb -0.10 -2.93 -0.03 0.00 0.56 0.00 0.00 36.38 33.87 1a4e s VAL 299 CO 0.02 -0.05 0.55 0.26 -0.31 0.00 0.00 175.10 175.56 1a4e s TRP 300 N -1.62 3.40 0.05 2.82 0.51 -1.26 -5.03 118.94 117.80 1a4e s TRP 300 Ca 0.27 0.85 -0.35 0.00 -2.12 0.00 0.00 56.10 54.75 1a4e s TRP 300 Cb -0.10 -2.69 -0.14 0.00 -0.81 0.00 0.00 33.47 29.73 1a4e s TRP 300 CO 0.19 -0.07 1.66 -2.30 -0.51 0.00 0.00 176.95 175.91 1a4e n PRO 301 N 4.66 1.99 0.24 4.98 -0.02 -1.26 -4.90 135.00 140.68 1a4e n PRO 301 Ca -0.04 0.72 0.13 0.00 -2.02 0.00 0.00 63.50 62.29 1a4e n PRO 301 Cb 0.50 -2.50 0.46 0.00 -0.02 0.00 0.00 33.50 31.95 1a4e n PRO 301 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1a4e h GLN 302 N 6.88 0.00 -0.27 -0.52 4.20 -1.97 -1.30 115.11 122.13 1a4e h GLN 302 Ca -0.46 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.24 1a4e h GLN 302 Cb 1.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.04 1a4e h GLN 302 CO 0.90 0.10 0.14 0.78 -0.67 0.00 0.00 178.83 180.08 1a4e h GLY 303 N 2.56 0.41 1.51 3.46 0.00 -1.99 -2.80 103.07 106.22 1a4e h GLY 303 Ca -0.00 -0.19 -0.26 0.00 0.00 0.00 0.00 47.33 46.88 1a4e h GLY 303 CO 0.01 0.18 -1.34 1.46 0.00 0.00 0.00 176.54 176.86 1a4e h GLN 304 N 0.32 0.08 -2.94 4.80 4.20 -1.95 -3.41 115.11 116.21 1a4e h GLN 304 Ca 0.09 -0.13 -0.61 0.00 0.06 0.00 0.00 58.65 58.06 1a4e h GLN 304 Cb 0.08 0.05 -0.40 0.00 0.30 0.00 0.00 27.48 27.50 1a4e h GLN 304 CO -0.01 0.90 -0.71 -0.06 -0.67 0.00 0.00 178.83 178.28 1a4e s PHE 305 N -2.65 2.55 0.66 2.96 0.08 -0.50 -5.10 117.98 115.98 1a4e s PHE 305 Ca -0.03 -2.84 -0.15 0.00 0.12 0.00 0.00 56.93 54.02 1a4e s PHE 305 Cb 0.09 -2.11 0.00 0.00 -0.57 0.00 0.00 43.02 40.43 1a4e s PHE 305 CO 0.83 -0.70 1.12 -1.25 -0.10 0.00 0.00 175.22 175.13 1a4e s PRO 306 N -0.48 2.76 0.15 0.24 0.04 -1.06 -4.27 135.00 132.38 1a4e s PRO 306 Ca 0.23 1.44 -0.30 0.00 0.04 0.00 0.00 61.00 62.41 1a4e s PRO 306 Cb -0.11 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 1a4e s PRO 306 CO -0.10 -1.29 1.27 -0.51 0.04 0.00 0.00 177.00 176.40 1a4e s LEU 307 N -4.84 4.41 -0.19 -3.56 1.43 -1.26 -4.55 118.68 110.12 1a4e s LEU 307 Ca 0.68 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 56.03 1a4e s LEU 307 Cb -0.22 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.42 1a4e s LEU 307 CO 0.41 -0.49 -0.17 -0.60 0.23 0.00 0.00 176.35 175.73 1a4e s ARG 308 N 0.36 3.07 0.39 1.70 3.52 -0.05 -4.92 118.95 123.02 1a4e s ARG 308 Ca 0.58 -0.79 -0.25 0.00 -0.13 0.00 0.00 55.73 55.13 1a4e s ARG 308 Cb -0.34 -2.65 -0.09 0.00 -1.56 0.00 0.00 34.95 30.31 1a4e s ARG 308 CO 0.34 -0.20 1.17 0.50 -0.81 0.00 0.00 175.30 176.29 1a4e s ARG 309 N 1.32 4.10 0.07 5.12 3.52 -1.26 -0.53 118.95 131.29 1a4e s ARG 309 Ca 0.05 1.84 0.00 0.00 -0.13 0.00 0.00 55.73 57.48 1a4e s ARG 309 Cb -0.13 -2.71 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 1a4e s ARG 309 CO -0.11 -0.28 0.00 0.28 -0.81 0.00 0.00 175.30 174.38 1a4e n VAL 310 N 0.15 0.65 -2.05 7.11 0.31 0.08 -4.67 118.33 119.91 1a4e n VAL 310 Ca 0.04 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 1a4e n VAL 310 Cb 0.46 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 1a4e n VAL 310 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a4e n GLY 311 N 3.09 2.19 2.97 2.92 0.00 -1.18 -1.22 105.19 113.95 1a4e n GLY 311 Ca 0.00 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.28 1a4e n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a4e s LYS 312 N 1.36 0.49 -0.20 1.61 1.02 -0.10 -1.34 119.74 122.57 1a4e s LYS 312 Ca 0.00 -0.21 -0.04 0.00 0.02 0.00 0.00 55.97 55.74 1a4e s LYS 312 Cb 0.00 -0.47 -0.02 0.00 -0.52 0.00 0.00 37.83 36.82 1a4e s LYS 312 CO 0.00 0.12 -0.02 0.42 -0.92 0.00 0.00 175.35 174.95 1a4e s ILE 313 N -0.10 3.78 -0.16 2.17 1.01 -0.60 -0.80 121.20 126.50 1a4e s ILE 313 Ca 0.02 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.31 1a4e s ILE 313 Cb -0.03 -2.70 0.02 0.00 0.01 0.00 0.00 42.46 39.76 1a4e s ILE 313 CO -0.00 0.44 -0.19 -0.69 0.00 0.00 0.00 174.94 174.50 1a4e s VAL 314 N 1.01 1.91 -0.30 2.92 1.01 -0.17 -1.22 120.40 125.56 1a4e s VAL 314 Ca 0.01 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.00 1a4e s VAL 314 Cb -0.14 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1a4e s VAL 314 CO 0.01 0.52 0.31 -0.76 0.00 0.00 0.00 175.10 175.18 1a4e s LEU 315 N 1.26 4.19 -0.01 3.92 1.43 -0.56 -1.24 118.68 127.67 1a4e s LEU 315 Ca 0.03 -0.00 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1a4e s LEU 315 Cb -0.13 -2.30 0.01 0.00 0.03 0.00 0.00 46.19 43.80 1a4e s LEU 315 CO -0.10 -0.20 0.70 -0.46 0.23 0.00 0.00 176.35 176.51 1a4e n ASN 316 N 5.27 0.33 -3.70 2.29 6.94 -0.71 -3.63 115.26 122.05 1a4e n ASN 316 Ca -0.10 -1.42 -0.14 0.00 -0.02 0.00 0.00 54.58 52.89 1a4e n ASN 316 Cb 0.51 -0.06 -0.14 0.00 -2.36 0.00 0.00 39.78 37.72 1a4e n ASN 316 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1a4e s GLU 317 N -0.23 0.13 0.43 -3.83 2.12 -1.02 -5.00 118.70 111.29 1a4e s GLU 317 Ca 0.01 0.59 -0.22 0.00 0.36 0.00 0.00 54.97 55.72 1a4e s GLU 317 Cb 0.01 -0.13 -0.10 0.00 0.26 0.00 0.00 34.13 34.17 1a4e s GLU 317 CO 0.00 -0.24 0.99 -0.80 -0.54 0.00 0.00 175.26 174.67 1a4e s ASN 318 N 1.87 6.80 0.43 -1.70 0.01 -1.26 -0.53 114.94 120.57 1a4e s ASN 318 Ca -0.03 1.83 -0.26 0.00 -0.71 0.00 0.00 52.86 53.69 1a4e s ASN 318 Cb -0.11 -2.56 -0.09 0.00 0.41 0.00 0.00 41.25 38.90 1a4e s ASN 318 CO -0.08 -0.46 1.39 -2.65 -1.51 0.00 0.00 177.10 173.80 1a4e n PRO 319 N -0.48 2.20 0.07 -0.60 -0.02 -1.26 -4.82 135.00 130.09 1a4e n PRO 319 Ca 0.07 0.78 -0.17 0.00 -2.02 0.00 0.00 63.50 62.15 1a4e n PRO 319 Cb 0.52 -2.56 -0.09 0.00 -0.02 0.00 0.00 33.50 31.36 1a4e n PRO 319 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1a4e h LEU 320 N 2.31 0.71 -7.42 2.45 3.38 -2.01 -3.44 115.31 111.28 1a4e h LEU 320 Ca -0.50 -0.60 -0.46 0.00 0.09 0.00 0.00 57.88 56.41 1a4e h LEU 320 Cb 1.27 -0.22 -0.39 0.00 0.09 0.00 0.00 40.66 41.42 1a4e h LEU 320 CO 0.61 1.41 -0.77 0.21 0.09 0.00 0.00 178.44 179.99 1a4e s ASN 321 N -7.23 2.00 0.15 -0.43 2.47 -1.26 -5.05 114.94 105.59 1a4e s ASN 321 Ca -0.08 -0.31 -0.16 0.00 0.42 0.00 0.00 52.86 52.73 1a4e s ASN 321 Cb 0.07 -0.50 0.01 0.00 -1.45 0.00 0.00 41.25 39.38 1a4e s ASN 321 CO 0.90 -0.23 1.77 0.15 -3.72 0.00 0.00 177.10 175.98 1a4e h PHE 322 N 8.30 0.52 0.48 0.43 3.57 -1.97 -2.15 116.94 126.12 1a4e h PHE 322 Ca -0.19 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.28 1a4e h PHE 322 Cb 1.12 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.70 1a4e h PHE 322 CO 0.42 0.38 -0.23 0.35 -2.23 0.00 0.00 178.31 176.99 1a4e h PHE 323 N 0.52 -0.60 -0.22 0.41 3.57 -1.96 0.68 116.94 119.34 1a4e h PHE 323 Ca 0.14 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 1a4e h PHE 323 Cb 0.01 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1a4e h PHE 323 CO -0.03 -0.33 -0.04 0.00 -2.23 0.00 0.00 178.31 175.68 1a4e h ALA 324 N -0.25 1.53 0.00 2.41 0.00 -1.96 -0.36 119.26 120.63 1a4e h ALA 324 Ca -0.07 -0.17 -0.24 0.00 0.00 0.00 0.00 54.91 54.44 1a4e h ALA 324 Cb 0.54 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1a4e h ALA 324 CO 0.11 0.34 -1.89 1.04 0.00 0.00 0.00 179.25 178.85 1a4e n GLN 325 N -4.32 1.73 -0.11 0.00 6.02 -0.81 -4.32 117.38 115.57 1a4e n GLN 325 Ca 0.00 0.01 -0.22 0.00 -0.01 0.00 0.00 57.00 56.78 1a4e n GLN 325 Cb 0.22 -1.33 -0.08 0.00 1.02 0.00 0.00 30.24 30.07 1a4e n GLN 325 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1a4e n VAL 326 N -2.53 1.20 -0.13 5.09 0.31 0.11 -4.06 118.33 118.32 1a4e n VAL 326 Ca -0.22 -0.33 -0.09 0.00 -0.01 0.00 0.00 64.34 63.69 1a4e n VAL 326 Cb 0.91 -1.71 0.05 0.00 -0.91 0.00 0.00 33.84 32.18 1a4e n VAL 326 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1a4e h GLU 327 N -0.66 0.88 -0.02 5.55 4.57 -0.99 -2.77 114.58 121.15 1a4e h GLU 327 Ca -0.54 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 57.28 1a4e h GLU 327 Cb 1.52 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 30.07 1a4e h GLU 327 CO -0.30 1.00 0.00 1.04 -1.18 0.00 0.00 179.01 179.57 1a4e n GLN 328 N -4.12 1.29 -2.16 1.92 6.02 -0.16 -4.89 117.38 115.28 1a4e n GLN 328 Ca 0.00 -0.43 -0.40 0.00 -0.01 0.00 0.00 57.00 56.17 1a4e n GLN 328 Cb 0.43 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.20 1a4e n GLN 328 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a4e s ALA 329 N -1.99 3.41 -0.13 -1.58 0.00 -1.05 -4.86 121.76 115.57 1a4e s ALA 329 Ca 0.42 1.19 -0.00 0.00 0.00 0.00 0.00 51.96 53.56 1a4e s ALA 329 Cb 0.21 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.89 1a4e s ALA 329 CO 0.34 -0.61 -0.11 0.00 0.00 0.00 0.00 175.76 175.38 1a4e s ALA 330 N -1.19 1.55 -0.06 0.00 0.00 -1.26 -5.04 121.76 115.76 1a4e s ALA 330 Ca 0.51 -0.69 0.06 0.00 0.00 0.00 0.00 51.96 51.83 1a4e s ALA 330 Cb -0.38 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 21.77 1a4e s ALA 330 CO 0.49 -0.38 -0.24 -0.06 0.00 0.00 0.00 175.76 175.57 1a4e s PHE 331 N 1.58 2.47 -0.11 0.00 0.40 -1.26 -4.95 117.98 116.09 1a4e s PHE 331 Ca 0.04 -0.70 -0.07 0.00 -0.60 0.00 0.00 56.93 55.60 1a4e s PHE 331 Cb -0.13 -1.61 0.04 0.00 0.51 0.00 0.00 43.02 41.83 1a4e s PHE 331 CO -0.09 -0.20 0.28 0.00 0.70 0.00 0.00 175.22 175.91 1a4e s ALA 332 N -0.17 -0.67 0.56 5.36 0.00 -1.26 -4.80 121.76 120.79 1a4e s ALA 332 Ca -0.03 1.01 0.25 0.00 0.00 0.00 0.00 51.96 53.19 1a4e s ALA 332 Cb -0.14 -0.62 1.56 0.00 0.00 0.00 0.00 23.12 23.92 1a4e s ALA 332 CO 0.04 -0.19 2.13 -1.35 0.00 0.00 0.00 175.76 176.39 1a4e h PRO 333 N 6.73 0.00 0.00 0.00 0.11 -1.82 -1.70 132.00 135.33 1a4e h PRO 333 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1a4e h PRO 333 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1a4e h PRO 333 CO 0.35 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.01 1a4e n SER 334 N -4.07 0.00 -4.45 -2.05 3.41 -1.26 -4.26 113.62 100.93 1a4e n SER 334 Ca 0.01 0.45 -0.43 0.00 -0.26 0.00 0.00 58.87 58.63 1a4e n SER 334 Cb 0.27 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 1a4e n SER 334 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1a4e s THR 335 N -2.96 4.52 0.02 6.66 2.01 -0.64 -4.97 115.64 120.30 1a4e s THR 335 Ca 0.10 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.10 1a4e s THR 335 Cb 0.13 -4.75 -0.02 0.00 0.01 0.00 0.00 72.50 67.87 1a4e s THR 335 CO 0.35 -1.50 -0.04 0.28 -0.69 0.00 0.00 174.62 173.02 1a4e s THR 336 N 3.38 0.26 0.55 -0.82 -1.32 -1.25 -1.03 115.64 115.40 1a4e s THR 336 Ca 0.28 -0.84 -0.03 0.00 -1.21 0.00 0.00 61.69 59.89 1a4e s THR 336 Cb -0.10 -0.35 0.01 0.00 -1.51 0.00 0.00 72.50 70.54 1a4e s THR 336 CO -0.01 -0.38 0.82 0.68 -2.21 0.00 0.00 174.62 173.52 1a4e s VAL 337 N -1.22 3.59 0.39 5.08 -7.23 -1.26 -4.91 120.40 114.83 1a4e s VAL 337 Ca -0.12 -0.25 -0.23 0.00 -1.81 0.00 0.00 61.98 59.57 1a4e s VAL 337 Cb -0.09 -3.39 -0.13 0.00 0.56 0.00 0.00 36.38 33.33 1a4e s VAL 337 CO -0.00 -0.35 0.54 -2.65 -0.31 0.00 0.00 175.10 172.33 1a4e n PRO 338 N -2.41 0.54 -0.92 4.82 -0.02 -1.26 -2.73 135.00 133.01 1a4e n PRO 338 Ca 0.04 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1a4e n PRO 338 Cb 0.58 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.61 1a4e n PRO 338 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1a4e n TYR 339 N -0.71 0.00 -3.89 6.00 4.01 -1.26 -4.18 117.16 117.13 1a4e n TYR 339 Ca 0.12 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.57 1a4e n TYR 339 Cb 0.38 -0.87 -0.16 0.00 -0.31 0.00 0.00 39.34 38.38 1a4e n TYR 339 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1a4e s GLN 340 N -0.79 1.43 0.22 -0.72 -0.21 -1.11 -1.60 119.66 116.88 1a4e s GLN 340 Ca 0.00 -0.59 0.04 0.00 0.02 0.00 0.00 55.36 54.82 1a4e s GLN 340 Cb 0.00 -2.12 -0.05 0.00 1.00 0.00 0.00 33.01 31.84 1a4e s GLN 340 CO 0.00 -0.47 -0.02 -1.21 -2.12 0.00 0.00 175.29 171.47 1a4e s GLU 341 N 1.61 1.29 0.38 2.91 0.41 -0.22 -4.52 118.70 120.55 1a4e s GLU 341 Ca -0.00 -1.64 -0.17 0.00 -0.41 0.00 0.00 54.97 52.75 1a4e s GLU 341 Cb -0.16 -0.60 -0.09 0.00 -1.78 0.00 0.00 34.13 31.50 1a4e s GLU 341 CO -0.08 -0.08 0.83 0.00 -0.49 0.00 0.00 175.26 175.45 1a4e s ALA 342 N -3.42 3.21 0.81 5.21 0.00 -1.26 -0.80 121.76 125.51 1a4e s ALA 342 Ca 0.27 0.15 -0.06 0.00 0.00 0.00 0.00 51.96 52.32 1a4e s ALA 342 Cb 0.05 -2.91 0.16 0.00 0.00 0.00 0.00 23.12 20.42 1a4e s ALA 342 CO 0.07 0.21 1.12 -1.54 0.00 0.00 0.00 175.76 175.62 1a4e s SER 343 N -2.36 3.85 0.00 0.00 1.04 -1.22 -4.55 113.70 110.47 1a4e s SER 343 Ca 0.57 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.81 1a4e s SER 343 Cb -0.10 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.99 1a4e s SER 343 CO 0.18 -2.21 0.73 0.00 0.98 0.00 0.00 173.24 172.92 1a4e n ALA 344 N -3.18 2.45 -1.68 5.32 0.00 -1.26 -4.59 120.51 117.57 1a4e n ALA 344 Ca 0.16 0.00 -0.48 0.00 0.00 0.00 0.00 53.44 53.12 1a4e n ALA 344 Cb 0.60 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.01 1a4e n ALA 344 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1a4e n ASP 345 N -0.25 3.49 -0.05 0.00 -0.08 -1.26 -4.86 116.55 113.54 1a4e n ASP 345 Ca 0.00 0.94 0.05 0.00 -1.51 0.00 0.00 54.79 54.27 1a4e n ASP 345 Cb 0.11 -1.39 0.41 0.00 2.34 0.00 0.00 41.12 42.60 1a4e n ASP 345 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1a4e h PRO 346 N 9.52 0.59 -0.09 -0.67 0.11 -1.83 -1.05 132.00 138.58 1a4e h PRO 346 Ca -0.48 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1a4e h PRO 346 Cb 1.27 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1a4e h PRO 346 CO 0.95 0.39 -0.12 0.28 -0.21 0.00 0.00 178.00 179.29 1a4e h VAL 347 N 0.61 1.38 -0.76 3.15 2.07 -1.89 -2.50 116.25 118.30 1a4e h VAL 347 Ca 0.20 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1a4e h VAL 347 Cb 0.04 2.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 1a4e h VAL 347 CO -0.05 0.38 0.48 0.25 0.02 0.00 0.00 177.57 178.65 1a4e h LEU 348 N -0.19 0.90 -0.74 2.57 5.85 -1.72 -2.10 115.31 119.88 1a4e h LEU 348 Ca 0.01 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1a4e h LEU 348 Cb 0.67 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1a4e h LEU 348 CO 0.03 0.68 0.47 1.56 -0.34 0.00 0.00 178.44 180.84 1a4e h GLN 349 N 1.05 0.99 -0.08 1.25 1.08 -1.15 -1.70 115.11 116.55 1a4e h GLN 349 Ca 0.28 -0.07 -0.15 0.00 -1.45 0.00 0.00 58.65 57.25 1a4e h GLN 349 Cb -0.07 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.13 1a4e h GLN 349 CO -0.06 0.68 -0.61 0.00 -0.95 0.00 0.00 178.83 177.89 1a4e h ALA 350 N 1.26 0.80 0.00 3.87 0.00 -1.14 -3.00 119.26 121.05 1a4e h ALA 350 Ca 0.27 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1a4e h ALA 350 Cb -0.08 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1a4e h ALA 350 CO -0.06 0.73 -0.08 0.00 0.00 0.00 0.00 179.25 179.84 1a4e h ARG 351 N 0.22 0.00 0.00 0.00 3.08 -0.74 -1.24 114.38 115.70 1a4e h ARG 351 Ca -0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1a4e h ARG 351 Cb 1.13 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.18 1a4e h ARG 351 CO 0.10 0.08 -0.15 -0.07 -1.07 0.00 0.00 179.97 178.86 1a4e h LEU 352 N 0.00 0.00 0.00 3.04 4.07 -1.18 -3.22 115.31 118.03 1a4e h LEU 352 Ca -0.00 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.68 1a4e h LEU 352 Cb 0.36 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.06 1a4e h LEU 352 CO 0.01 0.15 -1.60 0.33 -1.08 0.00 0.00 178.44 176.25 1a4e n PHE 353 N -3.72 0.68 -0.21 1.13 7.35 -0.60 -4.57 117.46 117.52 1a4e n PHE 353 Ca -0.02 0.30 0.02 0.00 -0.76 0.00 0.00 57.45 56.98 1a4e n PHE 353 Cb 0.26 -1.04 0.13 0.00 0.35 0.00 0.00 39.48 39.19 1a4e n PHE 353 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1a4e h SER 354 N -1.00 0.11 0.10 -2.13 0.02 -1.28 -3.03 113.55 106.35 1a4e h SER 354 Ca -0.43 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1a4e h SER 354 Cb 1.34 0.12 0.00 0.00 0.14 0.00 0.00 62.40 64.00 1a4e h SER 354 CO -0.26 0.06 -0.05 1.88 -1.14 0.00 0.00 176.83 177.32 1a4e h TYR 355 N 0.33 -0.13 -0.07 3.45 -1.99 -1.86 -1.67 116.97 115.04 1a4e h TYR 355 Ca 0.34 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 61.05 1a4e h TYR 355 Cb 0.48 0.04 -0.00 0.00 2.00 0.00 0.00 36.73 39.25 1a4e h TYR 355 CO -0.21 0.25 0.00 0.00 -0.00 0.00 0.00 178.16 178.20 1a4e h ALA 356 N 0.31 1.88 -0.33 3.88 0.00 -1.86 -0.72 119.26 122.41 1a4e h ALA 356 Ca -0.01 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1a4e h ALA 356 Cb 0.43 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1a4e h ALA 356 CO 0.02 0.10 -0.25 0.22 0.00 0.00 0.00 179.25 179.34 1a4e h ASP 357 N 0.09 0.80 -0.50 0.00 3.58 -1.44 -2.59 116.42 116.36 1a4e h ASP 357 Ca 0.02 -0.44 -0.05 0.00 0.42 0.00 0.00 57.03 56.98 1a4e h ASP 357 Cb 0.07 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 40.87 1a4e h ASP 357 CO 0.00 1.07 0.13 0.00 -2.88 0.00 0.00 179.24 177.56 1a4e h ALA 358 N 0.75 1.19 -0.38 -0.78 0.00 -0.36 -2.94 119.26 116.74 1a4e h ALA 358 Ca 0.06 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1a4e h ALA 358 Cb 0.81 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1a4e h ALA 358 CO 0.07 0.55 -0.11 0.45 0.00 0.00 0.00 179.25 180.21 1a4e h HIS 359 N 0.82 0.73 0.00 0.00 3.86 -1.02 0.32 115.15 119.86 1a4e h HIS 359 Ca 0.18 -0.12 -0.06 0.00 -1.16 0.00 0.00 60.37 59.20 1a4e h HIS 359 Cb 0.30 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 1a4e h HIS 359 CO 0.02 0.75 -0.30 0.00 0.86 0.00 0.00 177.93 179.26 1a4e h ARG 360 N 0.61 0.00 0.00 2.45 3.08 -1.29 -1.12 114.38 118.12 1a4e h ARG 360 Ca 0.11 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1a4e h ARG 360 Cb 0.55 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1a4e h ARG 360 CO 0.03 0.30 -0.14 -0.92 -1.07 0.00 0.00 179.97 178.18 1a4e h TYR 361 N 0.00 0.00 0.02 3.04 3.20 -1.31 -3.06 116.97 118.87 1a4e h TYR 361 Ca -0.00 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.89 1a4e h TYR 361 Cb 0.62 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.85 1a4e h TYR 361 CO 0.00 0.17 -0.20 -0.09 -1.64 0.00 0.00 178.16 176.40 1a4e h ARG 362 N -1.00 -0.32 0.00 1.82 2.43 -1.00 -3.35 114.38 112.96 1a4e h ARG 362 Ca -0.01 0.02 -0.40 0.00 -0.81 0.00 0.00 59.98 58.78 1a4e h ARG 362 Cb 0.26 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 29.81 1a4e h ARG 362 CO -0.01 -0.21 -2.46 1.28 -1.51 0.00 0.00 179.97 177.06 1a4e n LEU 363 N -5.33 2.74 0.00 3.80 4.77 -0.48 -4.55 117.00 117.95 1a4e n LEU 363 Ca -0.05 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1a4e n LEU 363 Cb 0.24 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1a4e n LEU 363 CO 0.24 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 177.77 1a4e n GLY 364 N 2.03 3.47 0.34 -0.72 0.00 -0.84 -4.81 105.19 104.65 1a4e n GLY 364 Ca -0.47 -1.79 0.14 0.00 0.00 0.00 0.00 46.02 43.90 1a4e n GLY 364 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a4e h PRO 365 N 0.00 0.59 -0.91 1.61 0.11 -1.84 -2.06 132.00 129.49 1a4e h PRO 365 Ca 0.00 -0.04 -0.57 0.00 0.11 0.00 0.00 66.00 65.50 1a4e h PRO 365 Cb 0.00 -0.13 -0.29 0.00 0.11 0.00 0.00 31.00 30.68 1a4e h PRO 365 CO 0.00 0.39 0.54 0.09 -0.21 0.00 0.00 178.00 178.81 1a4e n ASN 366 N -4.88 5.84 0.16 -2.05 3.02 -1.26 -4.71 115.26 111.38 1a4e n ASN 366 Ca 0.24 -3.74 0.17 0.00 -0.03 0.00 0.00 54.58 51.22 1a4e n ASN 366 Cb 0.65 -0.84 0.77 0.00 -0.61 0.00 0.00 39.78 39.74 1a4e n ASN 366 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 1a4e h PHE 367 N 1.65 0.00 0.00 3.10 -0.00 -1.68 -1.28 116.94 118.73 1a4e h PHE 367 Ca 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.53 1a4e h PHE 367 Cb 1.53 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.48 1a4e h PHE 367 CO 1.38 0.00 0.00 -2.39 -0.00 0.00 0.00 178.31 177.30 1a4e n HIS 368 N -4.03 0.06 1.04 6.09 1.44 -1.26 -2.07 115.22 116.49 1a4e n HIS 368 Ca 0.03 0.02 0.12 0.00 -2.01 0.00 0.00 57.72 55.89 1a4e n HIS 368 Cb 0.37 -0.54 0.34 0.00 0.12 0.00 0.00 29.99 30.28 1a4e n HIS 368 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1a4e n GLN 369 N -1.56 0.10 -2.13 -1.40 6.02 -0.48 -3.20 117.38 114.73 1a4e n GLN 369 Ca 0.05 -0.05 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 1a4e n GLN 369 Cb 0.24 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 1a4e n GLN 369 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1a4e s ILE 370 N -2.94 3.18 0.27 5.09 1.01 -0.88 -4.85 121.20 122.09 1a4e s ILE 370 Ca 0.13 0.86 -0.06 0.00 0.00 0.00 0.00 60.65 61.58 1a4e s ILE 370 Cb 0.18 -3.55 0.35 0.00 0.01 0.00 0.00 42.46 39.45 1a4e s ILE 370 CO 0.65 0.07 1.60 -0.65 0.00 0.00 0.00 174.94 176.61 1a4e h PRO 371 N 6.72 0.04 0.00 2.79 0.11 -1.89 -0.46 132.00 139.32 1a4e h PRO 371 Ca -0.42 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1a4e h PRO 371 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1a4e h PRO 371 CO 0.87 0.03 -0.01 -0.39 -0.21 0.00 0.00 178.00 178.29 1a4e h VAL 372 N 0.04 0.02 0.00 3.15 -1.51 -1.92 -2.39 116.25 113.65 1a4e h VAL 372 Ca 0.46 -0.48 0.00 0.00 -1.23 0.00 0.00 66.70 65.45 1a4e h VAL 372 Cb 0.83 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 31.46 1a4e h VAL 372 CO -0.81 0.01 -0.71 0.59 -1.23 0.00 0.00 177.57 175.42 1a4e n ASN 373 N -3.10 0.68 -4.72 4.19 3.02 -0.24 -4.92 115.26 110.16 1a4e n ASN 373 Ca 0.00 -0.49 -0.42 0.00 -0.03 0.00 0.00 54.58 53.64 1a4e n ASN 373 Cb 0.29 0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 39.97 1a4e n ASN 373 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a4e s PRO 375 N 1.03 3.36 0.32 0.00 0.04 -1.26 -4.85 135.00 133.64 1a4e s PRO 375 Ca 0.62 -1.35 0.11 0.00 0.04 0.00 0.00 61.00 60.42 1a4e s PRO 375 Cb -0.34 -5.36 0.53 0.00 0.04 0.00 0.00 34.50 29.37 1a4e s PRO 375 CO 0.30 -2.78 1.72 0.10 0.04 0.00 0.00 177.00 176.38 1a4e h TYR 376 N 9.14 0.02 -0.00 0.56 -0.00 -1.91 -2.69 116.97 122.09 1a4e h TYR 376 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 58.73 59.01 1a4e h TYR 376 Cb 0.94 -0.01 0.00 0.00 0.00 0.00 0.00 36.73 37.67 1a4e h TYR 376 CO 1.31 0.51 -0.06 0.00 -0.00 0.00 0.00 178.16 179.92 1a4e n ALA 377 N -2.45 2.63 -2.93 0.10 0.00 -1.26 -4.29 120.51 112.31 1a4e n ALA 377 Ca -0.02 -0.20 -0.07 0.00 0.00 0.00 0.00 53.44 53.15 1a4e n ALA 377 Cb 0.51 -1.41 -0.01 0.00 0.00 0.00 0.00 19.45 18.53 1a4e n ALA 377 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1a4e s SER 378 N -2.55 -0.97 0.32 0.00 0.15 -1.04 -4.43 113.70 105.18 1a4e s SER 378 Ca 0.28 -1.78 -0.27 0.00 0.70 0.00 0.00 55.95 54.87 1a4e s SER 378 Cb 0.20 1.54 -0.13 0.00 -1.71 0.00 0.00 66.02 65.92 1a4e s SER 378 CO 0.48 -0.09 1.06 0.29 1.20 0.00 0.00 173.24 176.18 1a4e n LYS 379 N 3.18 1.51 -2.10 5.44 5.02 -1.06 -4.65 118.16 125.50 1a4e n LYS 379 Ca 0.18 0.53 -0.42 0.00 -2.02 0.00 0.00 58.31 56.58 1a4e n LYS 379 Cb 0.55 -1.97 -0.03 0.00 -0.02 0.00 0.00 35.03 33.56 1a4e n LYS 379 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1a4e s PHE 380 N -1.10 2.62 -0.15 2.13 5.36 -1.26 -5.00 117.98 120.57 1a4e s PHE 380 Ca 0.58 0.59 -0.06 0.00 -0.96 0.00 0.00 56.93 57.09 1a4e s PHE 380 Cb -0.65 -3.79 0.07 0.00 -0.34 0.00 0.00 43.02 38.31 1a4e s PHE 380 CO 0.60 -3.06 0.32 0.12 -1.46 0.00 0.00 175.22 171.74 1a4e s PHE 381 N 2.68 -0.56 -0.29 10.12 5.36 -1.26 -5.10 117.98 128.92 1a4e s PHE 381 Ca 0.68 1.17 -0.05 0.00 -0.96 0.00 0.00 56.93 57.77 1a4e s PHE 381 Cb -0.34 0.09 0.16 0.00 -0.34 0.00 0.00 43.02 42.58 1a4e s PHE 381 CO 0.28 -0.40 0.59 1.21 -1.46 0.00 0.00 175.22 175.45 1a4e s ASN 382 N 2.47 -1.10 0.54 6.13 3.84 -1.26 -5.04 114.94 120.52 1a4e s ASN 382 Ca 0.00 1.12 0.24 0.00 0.21 0.00 0.00 52.86 54.43 1a4e s ASN 382 Cb -0.12 2.10 1.42 0.00 -0.55 0.00 0.00 41.25 44.10 1a4e s ASN 382 CO -0.10 -0.24 2.05 1.55 -2.79 0.00 0.00 177.10 177.56 1a4e h PRO 383 N 8.02 0.00 -0.00 0.43 0.13 -1.90 -2.60 132.00 136.08 1a4e h PRO 383 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 1a4e h PRO 383 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1a4e h PRO 383 CO 0.19 0.00 -0.58 0.00 -0.23 0.00 0.00 178.00 177.38 1a4e n ALA 384 N -2.55 3.77 -3.29 -0.56 0.00 -1.26 -4.18 120.51 112.45 1a4e n ALA 384 Ca 0.05 -0.45 -0.46 0.00 0.00 0.00 0.00 53.44 52.58 1a4e n ALA 384 Cb 0.44 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 1a4e n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1a4e s ILE 385 N -2.86 5.39 0.27 0.00 1.01 -0.98 -5.01 121.20 119.02 1a4e s ILE 385 Ca 0.13 -2.02 0.03 0.00 0.00 0.00 0.00 60.65 58.79 1a4e s ILE 385 Cb 0.18 -4.45 -0.06 0.00 0.01 0.00 0.00 42.46 38.14 1a4e s ILE 385 CO 0.70 -1.01 0.05 -0.13 0.00 0.00 0.00 174.94 174.54 1a4e s ARG 386 N 0.92 1.47 3.80 2.79 1.81 -1.26 -4.81 118.95 123.67 1a4e s ARG 386 Ca 0.14 -1.79 0.00 0.00 -1.72 0.00 0.00 55.73 52.36 1a4e s ARG 386 Cb -0.17 -0.62 0.00 0.00 -0.45 0.00 0.00 34.95 33.71 1a4e s ARG 386 CO -0.04 -0.18 0.00 -0.25 -0.68 0.00 0.00 175.30 174.15 1a4e n ASP 387 N -0.53 0.00 0.00 0.23 8.00 -1.26 -5.06 116.55 117.93 1a4e n ASP 387 Ca -0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.47 1a4e n ASP 387 Cb 0.66 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1a4e n ASP 387 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a4e n GLY 388 N 0.00 0.04 3.78 0.44 0.00 -1.26 -4.72 105.19 103.47 1a4e n GLY 388 Ca 0.00 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 1a4e n GLY 388 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a4e n PRO 389 N 0.41 2.71 -3.50 1.61 -0.04 -1.26 -3.29 135.00 131.64 1a4e n PRO 389 Ca 0.00 0.95 -0.19 0.00 -0.04 0.00 0.00 63.50 64.22 1a4e n PRO 389 Cb 0.00 -2.69 0.08 0.00 -0.04 0.00 0.00 33.50 30.85 1a4e n PRO 389 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1a4e n MET 390 N 0.60 -6.66 -2.72 0.54 2.81 -1.26 -4.32 117.12 106.11 1a4e n MET 390 Ca 0.02 0.81 -0.42 0.00 -1.81 0.00 0.00 57.70 56.30 1a4e n MET 390 Cb 0.39 -5.79 -0.03 0.00 -0.71 0.00 0.00 33.22 27.08 1a4e n MET 390 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1a4e s ASN 391 N -4.15 6.27 0.00 7.83 3.84 -1.21 -4.83 114.94 122.69 1a4e s ASN 391 Ca 0.12 -0.47 0.15 0.00 0.21 0.00 0.00 52.86 52.88 1a4e s ASN 391 Cb -0.06 -2.49 -0.16 0.00 -0.55 0.00 0.00 41.25 38.00 1a4e s ASN 391 CO 0.74 -1.49 0.66 1.33 -2.79 0.00 0.00 177.10 175.55 1a4e n VAL 392 N 6.26 0.00 0.69 -5.21 0.24 -1.26 -4.58 118.33 114.47 1a4e n VAL 392 Ca 0.02 -0.15 0.07 0.00 -2.04 0.00 0.00 64.34 62.24 1a4e n VAL 392 Cb 0.48 1.01 0.20 0.00 -1.47 0.00 0.00 33.84 34.06 1a4e n VAL 392 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1a4e n ASN 393 N -1.30 2.24 0.00 -1.34 0.23 -1.26 -4.90 115.26 108.93 1a4e n ASN 393 Ca 0.03 -1.98 0.00 0.00 -0.53 0.00 0.00 54.58 52.10 1a4e n ASN 393 Cb 0.24 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 1a4e n ASN 393 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1a4e n GLY 394 N 1.18 2.75 3.74 4.83 0.00 -1.26 -4.66 105.19 111.76 1a4e n GLY 394 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 1a4e n GLY 394 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1a4e n ASN 395 N 0.00 -5.50 -1.39 1.61 5.15 -1.26 -2.17 115.26 111.69 1a4e n ASN 395 Ca 0.00 -0.65 -0.15 0.00 -0.60 0.00 0.00 54.58 53.18 1a4e n ASN 395 Cb 0.00 -4.51 -0.06 0.00 -0.53 0.00 0.00 39.78 34.67 1a4e n ASN 395 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1a4e n PHE 396 N -4.84 -0.24 0.00 1.20 3.72 -1.26 -4.77 117.46 111.27 1a4e n PHE 396 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 1a4e n PHE 396 Cb 0.55 -2.82 0.00 0.00 -0.94 0.00 0.00 39.48 36.27 1a4e n PHE 396 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a4e n GLY 397 N -0.24 3.47 0.60 1.37 0.00 -0.92 -1.95 105.19 107.51 1a4e n GLY 397 Ca -0.15 -0.07 0.05 0.00 0.00 0.00 0.00 46.02 45.85 1a4e n GLY 397 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4e n SER 398 N 4.48 1.73 -4.64 1.61 3.41 -1.26 -4.93 113.62 114.01 1a4e n SER 398 Ca 0.00 -2.04 -0.46 0.00 -0.26 0.00 0.00 58.87 56.11 1a4e n SER 398 Cb 0.00 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 1a4e n SER 398 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1a4e n GLU 399 N 0.36 1.74 -1.58 4.33 -0.58 -0.82 -4.93 120.64 119.15 1a4e n GLU 399 Ca 0.10 0.62 -0.41 0.00 -0.42 0.00 0.00 57.16 57.05 1a4e n GLU 399 Cb 0.29 -2.21 0.01 0.00 -0.57 0.00 0.00 31.44 28.96 1a4e n GLU 399 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1a4e n PRO 400 N 1.87 1.18 -0.61 3.49 -0.02 -1.26 -4.91 135.00 134.75 1a4e n PRO 400 Ca 0.12 0.43 -0.01 0.00 -2.02 0.00 0.00 63.50 62.02 1a4e n PRO 400 Cb 0.29 -1.96 0.21 0.00 -0.02 0.00 0.00 33.50 32.02 1a4e n PRO 400 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1a4e n THR 401 N -0.65 1.87 -3.82 3.45 -2.24 -1.26 -4.68 114.28 106.95 1a4e n THR 401 Ca 0.10 -0.94 -0.10 0.00 -2.27 0.00 0.00 64.05 60.84 1a4e n THR 401 Cb 0.40 -0.46 -0.00 0.00 -2.10 0.00 0.00 70.33 68.17 1a4e n THR 401 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a4e n TYR 402 N 0.12 -1.75 -2.76 4.78 4.11 -1.26 -4.24 117.16 116.17 1a4e n TYR 402 Ca 0.23 -1.79 -0.43 0.00 -0.00 0.00 0.00 57.90 55.90 1a4e n TYR 402 Cb 0.94 0.63 -0.02 0.00 -0.00 0.00 0.00 39.34 40.90 1a4e n TYR 402 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1a4e s LEU 403 N 0.00 4.37 0.23 -3.48 1.43 -1.26 -4.87 118.68 115.10 1a4e s LEU 403 Ca 0.19 -2.13 -0.30 0.00 -1.03 0.00 0.00 54.13 50.86 1a4e s LEU 403 Cb -0.03 -2.48 -0.10 0.00 0.03 0.00 0.00 46.19 43.61 1a4e s LEU 403 CO 0.14 -1.15 1.41 0.00 0.23 0.00 0.00 176.35 176.97 1a4e s ALA 404 N 3.43 3.60 0.14 4.21 0.00 -1.26 -4.94 121.76 126.95 1a4e s ALA 404 Ca 0.42 1.27 0.26 0.00 0.00 0.00 0.00 51.96 53.91 1a4e s ALA 404 Cb -0.01 -3.54 1.04 0.00 0.00 0.00 0.00 23.12 20.61 1a4e s ALA 404 CO -0.05 -0.69 1.87 -0.91 0.00 0.00 0.00 175.76 175.99 1a4e h ASN 405 N 5.19 0.00 -0.06 0.00 2.35 -2.03 -2.46 115.58 118.57 1a4e h ASN 405 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 1a4e h ASN 405 Cb 1.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1a4e h ASN 405 CO 0.78 0.17 0.00 -0.90 -1.65 0.00 0.00 177.43 175.83 1a4e n ASP 406 N -3.34 0.65 -4.41 5.81 5.75 -1.26 -4.85 116.55 114.90 1a4e n ASP 406 Ca 0.00 -1.54 -0.21 0.00 -0.01 0.00 0.00 54.79 53.04 1a4e n ASP 406 Cb 0.39 -0.04 -0.10 0.00 -1.03 0.00 0.00 41.12 40.34 1a4e n ASP 406 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1a4e s LYS 407 N -1.92 1.49 -0.07 0.11 1.02 -0.93 -5.15 119.74 114.29 1a4e s LYS 407 Ca 0.29 -1.71 -0.03 0.00 0.02 0.00 0.00 55.97 54.54 1a4e s LYS 407 Cb 0.14 -1.27 -0.04 0.00 -0.52 0.00 0.00 37.83 36.14 1a4e s LYS 407 CO 0.23 0.16 0.07 0.45 -0.92 0.00 0.00 175.35 175.34 1a4e s SER 408 N -3.41 5.74 -0.03 2.83 0.15 -1.26 -4.81 113.70 112.91 1a4e s SER 408 Ca 0.27 0.25 -0.01 0.00 0.70 0.00 0.00 55.95 57.16 1a4e s SER 408 Cb 0.00 -1.71 0.02 0.00 -1.71 0.00 0.00 66.02 62.62 1a4e s SER 408 CO 0.10 0.36 0.06 -0.31 1.20 0.00 0.00 173.24 174.65 1a4e s TYR 409 N -1.02 -0.04 -0.18 3.44 2.02 -1.26 -5.10 117.35 115.20 1a4e s TYR 409 Ca 0.17 0.20 -0.05 0.00 -0.37 0.00 0.00 57.07 57.02 1a4e s TYR 409 Cb -0.12 -0.10 -0.03 0.00 -0.40 0.00 0.00 41.96 41.31 1a4e s TYR 409 CO 0.06 -0.08 0.01 0.99 -1.57 0.00 0.00 175.55 174.96 1a4e s THR 410 N 0.68 4.14 -0.30 -0.71 2.01 -1.26 -5.06 115.64 115.14 1a4e s THR 410 Ca -0.05 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 61.69 1a4e s THR 410 Cb -0.08 -2.86 0.06 0.00 0.01 0.00 0.00 72.50 69.64 1a4e s THR 410 CO -0.02 0.45 -0.01 -0.31 -0.69 0.00 0.00 174.62 174.03 1a4e s TYR 411 N 0.68 3.34 0.49 4.92 2.02 -1.26 -5.11 117.35 122.44 1a4e s TYR 411 Ca 0.00 -2.17 -0.03 0.00 -0.37 0.00 0.00 57.07 54.50 1a4e s TYR 411 Cb -0.14 -2.22 -0.01 0.00 -0.40 0.00 0.00 41.96 39.19 1a4e s TYR 411 CO 0.02 -0.86 0.77 0.96 -1.57 0.00 0.00 175.55 174.87 1a4e s ILE 412 N 1.16 4.31 -1.47 2.71 -4.36 -1.26 -4.39 121.20 117.90 1a4e s ILE 412 Ca -0.04 -0.11 -0.09 0.00 -0.26 0.00 0.00 60.65 60.15 1a4e s ILE 412 Cb -0.20 -3.64 0.06 0.00 1.25 0.00 0.00 42.46 39.93 1a4e s ILE 412 CO -0.03 -0.57 0.82 0.00 0.24 0.00 0.00 174.94 175.40 1a4e n GLN 413 N -2.26 -4.89 -0.22 0.37 6.02 -1.26 -4.90 117.38 110.25 1a4e n GLN 413 Ca 0.01 0.56 0.09 0.00 -0.01 0.00 0.00 57.00 57.66 1a4e n GLN 413 Cb 0.57 -5.26 0.37 0.00 1.02 0.00 0.00 30.24 26.94 1a4e n GLN 413 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1a4e h GLN 414 N -1.95 0.69 -0.50 -1.09 4.20 -2.04 -2.22 115.11 112.20 1a4e h GLN 414 Ca -0.60 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.07 1a4e h GLN 414 Cb 1.37 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1a4e h GLN 414 CO 0.65 0.46 0.00 -0.25 -0.67 0.00 0.00 178.83 179.01 1a4e n ASP 415 N -4.51 3.47 -4.71 1.46 8.00 -1.26 -4.92 116.55 114.08 1a4e n ASP 415 Ca 0.13 -1.97 -0.42 0.00 0.71 0.00 0.00 54.79 53.25 1a4e n ASP 415 Cb 0.34 -0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 41.08 1a4e n ASP 415 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1a4e s ARG 416 N -1.14 4.43 0.52 -1.24 3.52 -0.84 -5.02 118.95 119.19 1a4e s ARG 416 Ca 0.38 1.74 -0.18 0.00 -0.13 0.00 0.00 55.73 57.54 1a4e s ARG 416 Cb 0.21 -3.38 -0.07 0.00 -1.56 0.00 0.00 34.95 30.15 1a4e s ARG 416 CO 0.28 -0.27 1.03 -1.25 -0.81 0.00 0.00 175.30 174.28 1a4e s PRO 417 N 1.19 3.68 -0.03 5.12 0.04 -1.26 -5.02 135.00 138.71 1a4e s PRO 417 Ca 0.58 1.24 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 1a4e s PRO 417 Cb -0.28 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1a4e s PRO 417 CO 0.28 -0.52 -0.04 -0.89 0.04 0.00 0.00 177.00 175.87 1a4e n ILE 418 N -1.40 0.26 -0.93 0.56 5.41 -1.26 -4.88 119.36 117.13 1a4e n ILE 418 Ca 0.09 0.44 0.00 0.00 1.00 0.00 0.00 62.75 64.28 1a4e n ILE 418 Cb 0.53 -1.66 0.00 0.00 -0.71 0.00 0.00 39.64 37.80 1a4e n ILE 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1a4e n GLN 419 N -2.75 0.06 -0.16 0.38 6.02 -1.26 -4.87 117.38 114.81 1a4e n GLN 419 Ca -0.02 -0.29 0.01 0.00 -0.01 0.00 0.00 57.00 56.70 1a4e n GLN 419 Cb 0.07 -0.54 0.28 0.00 1.02 0.00 0.00 30.24 31.07 1a4e n GLN 419 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1a4e h GLN 420 N 0.00 0.87 0.00 -1.09 7.50 -1.94 -2.37 115.11 118.08 1a4e h GLN 420 Ca 0.00 -0.06 0.00 0.00 0.50 0.00 0.00 58.65 59.09 1a4e h GLN 420 Cb 0.70 -0.19 0.00 0.00 0.05 0.00 0.00 27.48 28.04 1a4e h GLN 420 CO 0.00 0.59 0.00 -2.39 -1.50 0.00 0.00 178.83 175.53 1a4e n HIS 421 N -4.42 0.00 0.00 2.96 1.44 -1.26 -4.79 115.22 109.15 1a4e n HIS 421 Ca 0.07 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.78 1a4e n HIS 421 Cb 0.05 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.16 1a4e n HIS 421 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1a4e n GLN 422 N -0.97 2.53 -1.90 -1.40 6.02 -0.89 -4.98 117.38 115.78 1a4e n GLN 422 Ca 0.15 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.76 1a4e n GLN 422 Cb 0.07 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.36 1a4e n GLN 422 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1a4e s GLU 423 N 4.84 3.21 -0.27 -1.09 8.01 -1.26 -5.01 118.70 127.14 1a4e s GLU 423 Ca 0.00 2.09 -0.09 0.00 0.01 0.00 0.00 54.97 56.98 1a4e s GLU 423 Cb 0.00 -2.23 -0.04 0.00 -4.31 0.00 0.00 34.13 27.55 1a4e s GLU 423 CO 0.00 -1.09 0.13 0.08 0.01 0.00 0.00 175.26 174.39 1a4e s VAL 424 N -1.39 4.77 0.17 2.63 1.01 -1.26 -4.99 120.40 121.34 1a4e s VAL 424 Ca 0.71 -0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.54 1a4e s VAL 424 Cb -0.37 -3.27 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 1a4e s VAL 424 CO 0.43 0.28 0.51 0.26 0.00 0.00 0.00 175.10 176.58 1a4e s TRP 425 N 1.68 3.52 -0.12 5.22 0.52 -1.26 -5.09 118.94 123.41 1a4e s TRP 425 Ca 0.07 0.89 -0.07 0.00 0.02 0.00 0.00 56.10 57.01 1a4e s TRP 425 Cb -0.16 -2.26 0.05 0.00 -1.15 0.00 0.00 33.47 29.96 1a4e s TRP 425 CO 0.07 0.38 0.29 1.21 0.02 0.00 0.00 176.95 178.92 1a4e s ASN 426 N -2.04 -0.33 0.00 2.95 3.84 -1.26 -5.14 114.94 112.97 1a4e s ASN 426 Ca 0.41 0.62 0.00 0.00 0.21 0.00 0.00 52.86 54.09 1a4e s ASN 426 Cb -0.13 0.51 0.00 0.00 -0.55 0.00 0.00 41.25 41.08 1a4e s ASN 426 CO 0.20 -0.17 0.00 0.61 -2.79 0.00 0.00 177.10 174.96 1a4e n GLY 427 N 4.11 2.76 3.81 1.21 0.00 -1.26 -5.13 105.19 110.70 1a4e n GLY 427 Ca -0.24 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 1a4e n GLY 427 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a4e s PRO 428 N -2.00 0.65 -0.69 1.61 0.04 -1.26 -4.98 135.00 128.36 1a4e s PRO 428 Ca 0.00 -0.03 -0.27 0.00 0.04 0.00 0.00 61.00 60.74 1a4e s PRO 428 Cb 0.00 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 32.74 1a4e s PRO 428 CO 0.00 -2.47 1.51 0.00 0.04 0.00 0.00 177.00 176.09 1a4e s ALA 429 N -3.47 2.52 -0.23 8.56 0.00 -1.26 -4.99 121.76 122.89 1a4e s ALA 429 Ca 0.68 -1.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.47 1a4e s ALA 429 Cb -0.10 -4.28 -0.05 0.00 0.00 0.00 0.00 23.12 18.70 1a4e s ALA 429 CO 0.53 -3.53 0.13 0.42 0.00 0.00 0.00 175.76 173.31 1a4e s ILE 430 N 7.09 5.18 -0.23 0.00 1.01 -1.26 -5.06 121.20 127.93 1a4e s ILE 430 Ca 0.48 0.12 -0.29 0.00 0.00 0.00 0.00 60.65 60.96 1a4e s ILE 430 Cb -0.10 -3.40 -0.02 0.00 0.01 0.00 0.00 42.46 38.95 1a4e s ILE 430 CO 0.17 0.37 1.52 -2.16 0.00 0.00 0.00 174.94 174.85 1a4e s PRO 431 N 0.92 3.87 -0.01 2.79 0.04 -1.26 -5.01 135.00 136.33 1a4e s PRO 431 Ca 0.07 1.59 0.05 0.00 0.04 0.00 0.00 61.00 62.75 1a4e s PRO 431 Cb -0.13 -3.98 -0.01 0.00 0.04 0.00 0.00 34.50 30.42 1a4e s PRO 431 CO 0.03 -1.19 -0.16 -0.47 0.04 0.00 0.00 177.00 175.25 1a4e s TYR 432 N 4.84 1.40 -0.27 0.56 5.04 -1.26 -5.10 117.35 122.56 1a4e s TYR 432 Ca 0.67 -0.27 0.03 0.00 -2.44 0.00 0.00 57.07 55.06 1a4e s TYR 432 Cb -0.23 -0.90 0.07 0.00 0.35 0.00 0.00 41.96 41.24 1a4e s TYR 432 CO 0.27 -0.03 -0.08 -1.58 -1.34 0.00 0.00 175.55 172.80 1a4e s HIS 433 N -0.36 3.19 -1.55 4.97 5.65 -1.26 -5.03 115.29 120.89 1a4e s HIS 433 Ca 0.06 -2.33 -0.09 0.00 0.25 0.00 0.00 55.06 52.95 1a4e s HIS 433 Cb -0.06 -2.01 -0.04 0.00 -1.18 0.00 0.00 32.58 29.29 1a4e s HIS 433 CO -0.01 -0.87 2.81 1.87 -0.65 0.00 0.00 174.74 177.89 1a4e n TRP 434 N 4.45 2.48 -0.64 3.88 -0.00 -1.26 -4.97 117.44 121.38 1a4e n TRP 434 Ca -0.11 -3.03 -0.31 0.00 -0.00 0.00 0.00 57.50 54.05 1a4e n TRP 434 Cb 0.42 -2.34 0.18 0.00 -0.00 0.00 0.00 31.31 29.58 1a4e n TRP 434 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1a4e n ALA 435 N 3.17 -1.35 -1.69 5.87 0.00 -1.26 -4.84 120.51 120.42 1a4e n ALA 435 Ca 0.74 -0.69 -0.55 0.00 0.00 0.00 0.00 53.44 52.94 1a4e n ALA 435 Cb 0.24 -2.13 -0.07 0.00 0.00 0.00 0.00 19.45 17.49 1a4e n ALA 435 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1a4e n THR 436 N -4.38 0.29 -1.90 0.00 -1.04 -1.05 -4.92 114.28 101.28 1a4e n THR 436 Ca 0.10 -0.05 -0.36 0.00 -2.04 0.00 0.00 64.05 61.70 1a4e n THR 436 Cb 0.53 -1.27 0.05 0.00 -1.82 0.00 0.00 70.33 67.81 1a4e n THR 436 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1a4e s SER 437 N 3.06 4.99 0.66 8.00 0.01 -1.26 -4.93 113.70 124.22 1a4e s SER 437 Ca 0.95 2.42 -0.18 0.00 1.31 0.00 0.00 55.95 60.45 1a4e s SER 437 Cb -0.98 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 62.64 1a4e s SER 437 CO 0.60 -1.73 1.27 -2.65 0.41 0.00 0.00 173.24 171.14 1a4e n PRO 438 N -1.78 1.05 0.00 12.44 -0.02 -1.26 -4.77 135.00 140.65 1a4e n PRO 438 Ca 0.14 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1a4e n PRO 438 Cb 0.49 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 1a4e n PRO 438 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a4e n GLY 439 N 0.92 -1.09 0.00 -1.23 0.00 -1.26 -4.37 105.19 98.16 1a4e n GLY 439 Ca 0.16 -1.27 0.12 0.00 0.00 0.00 0.00 46.02 45.03 1a4e n GLY 439 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a4e n ASP 440 N 0.37 0.58 -0.31 1.61 2.03 -1.26 -4.66 116.55 114.90 1a4e n ASP 440 Ca 0.00 -0.36 0.15 0.00 0.52 0.00 0.00 54.79 55.10 1a4e n ASP 440 Cb 0.00 0.37 0.39 0.00 -0.72 0.00 0.00 41.12 41.16 1a4e n ASP 440 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1a4e h VAL 441 N 0.00 0.72 -0.33 5.18 3.04 -1.89 -0.85 116.25 122.12 1a4e h VAL 441 Ca 0.00 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.47 1a4e h VAL 441 Cb 0.50 0.03 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 1a4e h VAL 441 CO 0.00 0.12 0.00 0.47 -1.01 0.00 0.00 177.57 177.15 1a4e n ASP 442 N -4.64 2.25 -0.00 3.17 8.00 -1.26 -3.91 116.55 120.16 1a4e n ASP 442 Ca 0.21 -1.89 0.02 0.00 0.71 0.00 0.00 54.79 53.83 1a4e n ASP 442 Cb 0.60 -0.22 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 1a4e n ASP 442 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1a4e n PHE 443 N 0.71 0.00 0.06 1.24 3.01 -0.41 -4.68 117.46 117.39 1a4e n PHE 443 Ca 0.16 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.51 1a4e n PHE 443 Cb 0.39 -0.06 -0.04 0.00 -0.01 0.00 0.00 39.48 39.75 1a4e n PHE 443 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1a4e h VAL 444 N 0.00 0.42 0.00 -4.37 2.07 -1.44 -1.61 116.25 111.32 1a4e h VAL 444 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1a4e h VAL 444 Cb 0.14 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1a4e h VAL 444 CO 0.00 0.00 -0.12 1.56 0.02 0.00 0.00 177.57 179.03 1a4e h GLN 445 N -0.39 0.00 -0.23 1.57 4.20 -1.87 -1.36 115.11 117.03 1a4e h GLN 445 Ca 0.06 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.58 1a4e h GLN 445 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 1a4e h GLN 445 CO -0.23 0.12 -0.62 0.00 -0.67 0.00 0.00 178.83 177.44 1a4e h ALA 446 N 1.88 0.47 -0.34 3.87 0.00 -1.80 -2.05 119.26 121.29 1a4e h ALA 446 Ca -0.00 -0.54 -0.16 0.00 0.00 0.00 0.00 54.91 54.20 1a4e h ALA 446 Cb 0.58 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1a4e h ALA 446 CO 0.02 0.69 -0.43 -0.09 0.00 0.00 0.00 179.25 179.43 1a4e h ARG 447 N 0.59 0.86 0.00 0.00 2.43 -0.67 -2.14 114.38 115.45 1a4e h ARG 447 Ca -0.01 -0.48 -0.03 0.00 -0.81 0.00 0.00 59.98 58.66 1a4e h ARG 447 Cb 1.22 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1a4e h ARG 447 CO 0.13 1.12 -0.13 -0.91 -1.51 0.00 0.00 179.97 178.67 1a4e h ASN 448 N 0.69 0.00 0.05 -3.80 2.35 -1.31 -2.54 115.58 111.02 1a4e h ASN 448 Ca 0.05 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.64 1a4e h ASN 448 Cb 1.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 1a4e h ASN 448 CO 0.10 0.13 -0.55 0.25 -1.65 0.00 0.00 177.43 175.71 1a4e h LEU 449 N 0.00 0.59 -0.93 1.61 7.12 -1.16 -2.33 115.31 120.20 1a4e h LEU 449 Ca -0.00 -0.31 -0.07 0.00 0.13 0.00 0.00 57.88 57.63 1a4e h LEU 449 Cb 0.88 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 40.82 1a4e h LEU 449 CO 0.02 1.02 0.03 0.22 -0.13 0.00 0.00 178.44 179.59 1a4e h TYR 450 N 0.41 0.85 -0.28 1.25 3.20 -1.07 -2.06 116.97 119.26 1a4e h TYR 450 Ca 0.01 -0.11 -0.12 0.00 3.14 0.00 0.00 58.73 61.64 1a4e h TYR 450 Cb 1.08 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 1a4e h TYR 450 CO 0.04 0.77 -0.33 0.00 -1.64 0.00 0.00 178.16 177.00 1a4e h ARG 451 N 0.76 0.62 -0.49 1.82 3.08 -1.36 -2.61 114.38 116.20 1a4e h ARG 451 Ca 0.15 -0.28 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 1a4e h ARG 451 Cb 0.42 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1a4e h ARG 451 CO 0.02 0.86 0.02 0.28 -1.07 0.00 0.00 179.97 180.08 1a4e h VAL 452 N 0.52 1.24 0.00 2.04 2.07 -1.14 -1.70 116.25 119.29 1a4e h VAL 452 Ca 0.06 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.59 1a4e h VAL 452 Cb 0.82 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1a4e h VAL 452 CO 0.07 0.35 0.00 -0.07 0.02 0.00 0.00 177.57 177.94 1a4e h LEU 453 N 0.76 0.00 -0.54 2.57 3.38 -1.17 -2.74 115.31 117.57 1a4e h LEU 453 Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1a4e h LEU 453 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1a4e h LEU 453 CO 0.02 0.00 -0.33 1.23 0.09 0.00 0.00 178.44 179.45 1a4e h GLY 454 N 2.28 0.00 2.00 0.83 0.00 -0.92 -3.10 103.07 104.16 1a4e h GLY 454 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1a4e h GLY 454 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.04 1a4e h LYS 455 N 0.00 0.00 -4.22 4.80 1.57 -1.44 -3.41 116.57 113.86 1a4e h LYS 455 Ca -0.00 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.05 1a4e h LYS 455 Cb 1.05 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.06 1a4e h LYS 455 CO 0.04 0.00 -0.36 -0.65 -0.57 0.00 0.00 179.45 177.92 1a4e s GLN 456 N -3.23 2.56 0.23 3.15 -0.21 -1.17 -5.06 119.66 115.93 1a4e s GLN 456 Ca 0.07 -1.85 -0.32 0.00 0.02 0.00 0.00 55.36 53.29 1a4e s GLN 456 Cb 0.07 -3.96 -0.12 0.00 1.00 0.00 0.00 33.01 30.01 1a4e s GLN 456 CO 0.63 -1.21 1.67 -0.35 -2.12 0.00 0.00 175.29 173.92 1a4e n PRO 457 N 4.79 2.69 0.00 2.91 -0.04 -1.26 -2.52 135.00 141.57 1a4e n PRO 457 Ca -0.06 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.36 1a4e n PRO 457 Cb 0.41 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 1a4e n PRO 457 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a4e n GLY 458 N 3.44 3.23 0.23 0.55 0.00 -1.26 -4.94 105.19 106.44 1a4e n GLY 458 Ca 0.14 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.23 1a4e n GLY 458 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1a4e h GLN 459 N 1.77 0.00 -0.06 1.61 1.08 -1.69 -1.32 115.11 116.51 1a4e h GLN 459 Ca 0.00 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 1a4e h GLN 459 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1a4e h GLN 459 CO 0.00 0.21 -0.80 1.96 -0.95 0.00 0.00 178.83 179.24 1a4e h GLN 460 N 0.00 0.43 -0.24 1.46 4.20 -1.81 -1.43 115.11 117.72 1a4e h GLN 460 Ca -0.00 -0.39 -0.18 0.00 0.06 0.00 0.00 58.65 58.15 1a4e h GLN 460 Cb 0.42 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1a4e h GLN 460 CO 0.03 1.03 -0.56 0.87 -0.67 0.00 0.00 178.83 179.53 1a4e h LYS 461 N 0.28 0.72 -0.40 1.46 1.57 -1.88 -2.52 116.57 115.80 1a4e h LYS 461 Ca -0.05 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.16 1a4e h LYS 461 Cb 1.40 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.75 1a4e h LYS 461 CO 0.14 1.09 -0.17 -0.91 -0.57 0.00 0.00 179.45 179.02 1a4e h ASN 462 N 0.55 0.75 -0.33 0.86 2.35 -1.28 -0.77 115.58 117.72 1a4e h ASN 462 Ca 0.01 -0.25 -0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1a4e h ASN 462 Cb 1.14 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.29 1a4e h ASN 462 CO 0.12 0.92 0.20 0.25 -1.65 0.00 0.00 177.43 177.27 1a4e h LEU 463 N 0.67 0.40 -1.07 1.61 5.85 -1.17 0.51 115.31 122.10 1a4e h LEU 463 Ca 0.10 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1a4e h LEU 463 Cb 0.66 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 1a4e h LEU 463 CO 0.05 0.34 0.12 0.00 -0.34 0.00 0.00 178.44 178.61 1a4e h ALA 464 N 1.08 1.25 -0.18 1.25 0.00 -1.25 -2.09 119.26 119.31 1a4e h ALA 464 Ca 0.12 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1a4e h ALA 464 Cb 0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1a4e h ALA 464 CO -0.02 0.52 -0.29 -0.92 0.00 0.00 0.00 179.25 178.54 1a4e h TYR 465 N 0.76 0.64 -0.71 0.00 3.20 -0.69 -0.41 116.97 119.75 1a4e h TYR 465 Ca 0.17 -0.22 -0.02 0.00 3.14 0.00 0.00 58.73 61.80 1a4e h TYR 465 Cb 0.29 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1a4e h TYR 465 CO 0.02 0.93 0.37 -0.91 -1.64 0.00 0.00 178.16 176.93 1a4e h ASN 466 N 0.17 0.89 0.01 -2.11 2.35 -0.76 -1.20 115.58 114.94 1a4e h ASN 466 Ca 0.02 -0.08 -0.16 0.00 -0.55 0.00 0.00 56.30 55.53 1a4e h ASN 466 Cb 0.87 -0.23 0.01 0.00 0.05 0.00 0.00 38.32 39.03 1a4e h ASN 466 CO 0.07 0.73 -0.61 0.40 -1.65 0.00 0.00 177.43 176.36 1a4e h ILE 467 N 1.00 1.44 -0.75 2.81 2.04 -1.39 -3.27 117.51 119.38 1a4e h ILE 467 Ca 0.25 -2.12 0.03 0.00 1.00 0.00 0.00 64.86 64.02 1a4e h ILE 467 Cb 0.05 2.66 -0.05 0.00 -0.74 0.00 0.00 36.82 38.74 1a4e h ILE 467 CO -0.04 0.61 0.47 1.23 0.00 0.00 0.00 178.15 180.43 1a4e h GLY 468 N -0.14 1.09 2.00 5.37 0.00 -0.57 0.14 103.07 110.96 1a4e h GLY 468 Ca -0.08 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 46.83 1a4e h GLY 468 CO 0.12 0.30 -0.30 0.16 0.00 0.00 0.00 176.54 176.82 1a4e h ILE 469 N 0.92 0.67 0.14 2.60 3.07 -1.38 -1.99 117.51 121.54 1a4e h ILE 469 Ca 0.30 -1.40 -0.20 0.00 1.55 0.00 0.00 64.86 65.12 1a4e h ILE 469 Cb 0.03 1.92 0.02 0.00 -0.27 0.00 0.00 36.82 38.53 1a4e h ILE 469 CO -0.12 0.29 -0.88 -0.74 -1.05 0.00 0.00 178.15 175.66 1a4e h HIS 470 N 0.00 0.53 0.00 0.16 2.76 -1.45 -3.35 115.15 113.81 1a4e h HIS 470 Ca -0.00 -0.39 -0.05 0.00 -2.20 0.00 0.00 60.37 57.73 1a4e h HIS 470 Cb 0.90 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.83 1a4e h HIS 470 CO 0.00 1.34 -0.23 0.28 -1.30 0.00 0.00 177.93 178.02 1a4e h VAL 471 N -0.37 0.90 -0.81 5.26 2.07 -0.98 -3.01 116.25 119.31 1a4e h VAL 471 Ca -0.16 -0.88 0.11 0.00 0.82 0.00 0.00 66.70 66.59 1a4e h VAL 471 Cb 1.66 1.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.88 1a4e h VAL 471 CO 0.14 0.23 0.53 -0.08 0.02 0.00 0.00 177.57 178.41 1a4e h GLU 472 N 0.00 0.69 0.00 1.57 4.22 -1.48 -1.20 114.58 118.38 1a4e h GLU 472 Ca -0.00 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.40 1a4e h GLU 472 Cb 0.50 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1a4e h GLU 472 CO 0.03 0.45 0.00 0.41 -2.18 0.00 0.00 179.01 177.72 1a4e n GLY 473 N -1.45 -1.37 3.87 1.92 0.00 -1.14 -4.82 105.19 102.21 1a4e n GLY 473 Ca 0.14 0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1a4e n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4e s ALA 474 N -3.28 3.16 0.47 4.61 0.00 -0.45 -4.69 121.76 121.57 1a4e s ALA 474 Ca 0.05 -0.11 -0.20 0.00 0.00 0.00 0.00 51.96 51.70 1a4e s ALA 474 Cb 0.10 -2.98 -0.09 0.00 0.00 0.00 0.00 23.12 20.15 1a4e s ALA 474 CO 0.43 -0.50 0.99 0.00 0.00 0.00 0.00 175.76 176.69 1a4e h PRO 476 N 1.64 0.00 -0.21 0.00 0.13 -1.96 -1.98 132.00 129.62 1a4e h PRO 476 Ca -0.49 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1a4e h PRO 476 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1a4e h PRO 476 CO 0.60 0.00 -0.04 1.96 -0.23 0.00 0.00 178.00 180.29 1a4e h GLN 477 N 0.00 0.40 -0.17 0.86 4.20 -2.00 -1.71 115.11 116.69 1a4e h GLN 477 Ca 0.46 -0.14 -0.14 0.00 0.06 0.00 0.00 58.65 58.88 1a4e h GLN 477 Cb 1.86 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.61 1a4e h GLN 477 CO -0.00 0.63 -0.50 0.82 -0.67 0.00 0.00 178.83 179.10 1a4e h ILE 478 N 0.13 1.33 -0.76 2.54 2.04 -1.79 -2.85 117.51 118.16 1a4e h ILE 478 Ca 0.06 -1.73 0.03 0.00 1.00 0.00 0.00 64.86 64.21 1a4e h ILE 478 Cb 0.47 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 1a4e h ILE 478 CO 0.02 0.53 0.48 1.56 0.00 0.00 0.00 178.15 180.74 1a4e h GLN 479 N 0.36 0.92 -0.53 2.37 4.20 -1.26 -1.90 115.11 119.27 1a4e h GLN 479 Ca 0.02 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1a4e h GLN 479 Cb 1.00 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.55 1a4e h GLN 479 CO 0.09 0.61 0.15 1.96 -0.67 0.00 0.00 178.83 180.97 1a4e h GLN 480 N 0.95 0.80 -0.28 1.46 1.08 -1.18 -1.73 115.11 116.23 1a4e h GLN 480 Ca 0.30 -0.15 -0.11 0.00 -1.45 0.00 0.00 58.65 57.24 1a4e h GLN 480 Cb -0.01 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 1a4e h GLN 480 CO -0.10 0.71 -0.29 0.00 -0.95 0.00 0.00 178.83 178.20 1a4e h ARG 481 N 0.78 0.56 -0.42 1.46 3.08 -1.23 -1.67 114.38 116.95 1a4e h ARG 481 Ca 0.18 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1a4e h ARG 481 Cb 0.26 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1a4e h ARG 481 CO -0.01 0.79 0.06 0.28 -1.07 0.00 0.00 179.97 180.02 1a4e h VAL 482 N 0.48 1.25 -0.65 2.04 2.07 -0.97 -1.20 116.25 119.27 1a4e h VAL 482 Ca 0.06 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 1a4e h VAL 482 Cb 0.75 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1a4e h VAL 482 CO 0.06 0.31 0.28 1.88 0.02 0.00 0.00 177.57 180.12 1a4e h TYR 483 N 0.55 0.97 -0.72 1.57 0.05 -1.18 -1.88 116.97 116.33 1a4e h TYR 483 Ca 0.13 -0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 1a4e h TYR 483 Cb 0.39 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 1a4e h TYR 483 CO 0.03 0.75 0.42 -0.44 -1.05 0.00 0.00 178.16 177.86 1a4e h ASP 484 N 0.91 0.88 -0.50 3.88 5.19 -1.13 0.37 116.42 126.02 1a4e h ASP 484 Ca 0.22 -0.08 -0.08 0.00 -0.62 0.00 0.00 57.03 56.47 1a4e h ASP 484 Cb 0.17 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.44 1a4e h ASP 484 CO -0.02 0.70 -0.00 -0.03 -3.12 0.00 0.00 179.24 176.77 1a4e h MET 485 N 0.99 0.89 0.00 3.56 4.05 -0.99 -2.83 114.93 120.60 1a4e h MET 485 Ca 0.26 -0.29 -0.02 0.00 -0.28 0.00 0.00 59.70 59.37 1a4e h MET 485 Cb -0.00 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 30.71 1a4e h MET 485 CO -0.05 0.92 -0.09 0.74 0.23 0.00 0.00 176.91 178.67 1a4e h PHE 486 N 0.76 0.00 0.00 1.39 0.04 -1.14 -2.87 116.94 115.12 1a4e h PHE 486 Ca 0.14 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.85 1a4e h PHE 486 Cb 0.52 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.66 1a4e h PHE 486 CO 0.04 0.09 -0.28 0.00 -0.60 0.00 0.00 178.31 177.56 1a4e h ALA 487 N 1.91 1.15 0.00 2.45 0.00 -0.73 -1.70 119.26 122.34 1a4e h ALA 487 Ca -0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1a4e h ALA 487 Cb 0.94 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1a4e h ALA 487 CO 0.01 0.35 -0.15 -0.09 0.00 0.00 0.00 179.25 179.37 1a4e h ARG 488 N 0.00 0.00 0.00 0.00 2.43 -1.27 -3.17 114.38 112.37 1a4e h ARG 488 Ca -0.00 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1a4e h ARG 488 Cb 0.68 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 1a4e h ARG 488 CO 0.04 0.15 -0.47 0.28 -1.51 0.00 0.00 179.97 178.46 1a4e h VAL 489 N 0.00 0.89 -1.88 0.20 2.07 -1.49 -3.48 116.25 112.55 1a4e h VAL 489 Ca -0.00 -1.82 0.08 0.00 0.82 0.00 0.00 66.70 65.78 1a4e h VAL 489 Cb 0.58 1.83 -0.21 0.00 -1.52 0.00 0.00 31.29 31.98 1a4e h VAL 489 CO 0.02 0.30 -0.03 -0.62 0.02 0.00 0.00 177.57 177.26 1a4e s ASP 490 N -6.21 -1.01 0.47 0.57 2.15 -0.70 -4.82 116.67 107.13 1a4e s ASP 490 Ca -0.18 1.45 0.19 0.00 0.43 0.00 0.00 52.55 54.44 1a4e s ASP 490 Cb 0.01 1.96 1.16 0.00 -0.30 0.00 0.00 42.92 45.75 1a4e s ASP 490 CO 0.45 -0.21 2.02 0.11 -0.17 0.00 0.00 175.17 177.37 1a4e h LYS 491 N 7.61 0.00 -0.34 4.34 1.57 -1.78 -2.43 116.57 125.53 1a4e h LYS 491 Ca -0.21 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1a4e h LYS 491 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1a4e h LYS 491 CO 0.12 0.17 -0.06 0.78 -0.57 0.00 0.00 179.45 179.88 1a4e h GLY 492 N 0.64 0.70 0.72 3.86 0.00 -1.92 -2.46 103.07 104.62 1a4e h GLY 492 Ca -0.00 -0.57 0.04 0.00 0.00 0.00 0.00 47.33 46.80 1a4e h GLY 492 CO 0.02 0.52 0.13 -2.00 0.00 0.00 0.00 176.54 175.21 1a4e h LEU 493 N 0.44 0.15 -0.60 3.11 6.46 -1.77 -1.79 115.31 121.31 1a4e h LEU 493 Ca 0.09 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.91 1a4e h LEU 493 Cb 0.56 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.47 1a4e h LEU 493 CO 0.03 0.12 0.37 -1.28 -0.62 0.00 0.00 178.44 177.06 1a4e h SER 494 N 0.28 0.61 -0.68 1.25 0.87 -1.43 -1.14 113.55 113.31 1a4e h SER 494 Ca 0.15 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 1a4e h SER 494 Cb 0.12 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 1a4e h SER 494 CO -0.15 0.43 0.22 -0.33 -0.53 0.00 0.00 176.83 176.47 1a4e h GLU 495 N 0.74 1.05 -0.35 2.24 4.39 -1.12 -2.03 114.58 119.50 1a4e h GLU 495 Ca 0.24 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.62 1a4e h GLU 495 Cb -0.00 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.48 1a4e h GLU 495 CO -0.09 0.90 -0.16 0.00 -1.16 0.00 0.00 179.01 178.50 1a4e h ALA 496 N 1.10 1.07 -0.46 3.43 0.00 -1.00 -1.46 119.26 121.95 1a4e h ALA 496 Ca 0.22 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1a4e h ALA 496 Cb 0.29 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1a4e h ALA 496 CO -0.01 0.57 -0.05 0.82 0.00 0.00 0.00 179.25 180.58 1a4e h ILE 497 N 0.57 1.27 -0.55 0.00 2.04 -1.07 -2.81 117.51 116.96 1a4e h ILE 497 Ca 0.09 -1.14 -0.05 0.00 1.00 0.00 0.00 64.86 64.76 1a4e h ILE 497 Cb 0.60 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 1a4e h ILE 497 CO 0.04 0.39 0.12 0.50 0.00 0.00 0.00 178.15 179.20 1a4e h LYS 498 N 0.68 0.85 -0.47 2.37 3.64 -1.10 -1.40 116.57 121.14 1a4e h LYS 498 Ca 0.12 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1a4e h LYS 498 Cb 0.57 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1a4e h LYS 498 CO 0.03 0.77 0.21 0.87 -2.27 0.00 0.00 179.45 179.07 1a4e h LYS 499 N 0.81 0.69 -0.27 1.90 1.57 -1.11 -1.66 116.57 118.51 1a4e h LYS 499 Ca 0.18 -0.11 -0.19 0.00 -1.87 0.00 0.00 60.65 58.65 1a4e h LYS 499 Cb 0.32 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1a4e h LYS 499 CO 0.00 0.60 -0.58 0.28 -0.57 0.00 0.00 179.45 179.18 1a4e h VAL 500 N 0.62 1.28 0.00 0.50 2.07 -1.37 -3.21 116.25 116.14 1a4e h VAL 500 Ca 0.16 -1.77 -0.01 0.00 0.82 0.00 0.00 66.70 65.90 1a4e h VAL 500 Cb 0.15 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1a4e h VAL 500 CO -0.02 0.57 -0.06 0.00 0.02 0.00 0.00 177.57 178.09 1a4e h ALA 501 N 0.69 1.01 0.00 1.67 0.00 -1.13 -3.44 119.26 118.06 1a4e h ALA 501 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1a4e h ALA 501 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1a4e h ALA 501 CO 0.13 0.07 0.00 0.39 0.00 0.00 0.00 179.25 179.84