#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g0c n HIS 37 N 0.00 0.00 -1.78 -1.40 -0.00 -1.26 -5.00 115.22 105.78 3g0c n HIS 37 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.72 57.36 3g0c n HIS 37 Cb 0.00 -1.94 0.06 0.00 -0.00 0.00 0.00 29.99 28.11 3g0c n HIS 37 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 3g0c s HIS 38 N -1.41 2.17 0.02 4.41 3.76 -1.26 -4.94 115.29 118.03 3g0c s HIS 38 Ca 0.00 1.51 -0.30 0.00 -0.15 0.00 0.00 55.06 56.12 3g0c s HIS 38 Cb 0.00 -3.60 -0.07 0.00 1.11 0.00 0.00 32.58 30.02 3g0c s HIS 38 CO 0.00 -2.68 1.61 -1.12 -0.85 0.00 0.00 174.74 171.71 3g0c s SER 39 N -1.53 6.67 0.00 1.40 0.01 -1.26 -4.87 113.70 114.11 3g0c s SER 39 Ca 0.80 2.34 0.00 0.00 1.31 0.00 0.00 55.95 60.40 3g0c s SER 39 Cb -0.34 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.33 3g0c s SER 39 CO 0.38 -0.87 0.00 0.54 0.41 0.00 0.00 173.24 173.70 3g0c n ARG 40 N 6.08 2.74 -1.64 12.44 3.00 -1.21 -4.82 116.66 133.25 3g0c n ARG 40 Ca 0.16 0.00 -0.35 0.00 -0.01 0.00 0.00 57.85 57.65 3g0c n ARG 40 Cb 0.42 -0.90 0.07 0.00 0.00 0.00 0.00 32.46 32.05 3g0c n ARG 40 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3g0c s LYS 41 N -1.75 2.46 0.18 5.56 3.01 -1.25 -4.89 119.74 123.07 3g0c s LYS 41 Ca 0.00 1.76 0.04 0.00 -1.01 0.00 0.00 55.97 56.76 3g0c s LYS 41 Cb 0.00 -1.87 -0.05 0.00 -1.01 0.00 0.00 37.83 34.90 3g0c s LYS 41 CO 0.00 -1.59 -0.06 0.95 0.51 0.00 0.00 175.35 175.17 3g0c s THR 42 N -1.87 1.08 -0.52 2.17 -4.23 -1.26 -0.15 115.64 110.86 3g0c s THR 42 Ca 0.75 -2.04 -0.26 0.00 -1.18 0.00 0.00 61.69 58.96 3g0c s THR 42 Cb -0.29 -2.06 0.03 0.00 1.34 0.00 0.00 72.50 71.52 3g0c s THR 42 CO 0.41 -0.56 1.01 -0.47 -0.54 0.00 0.00 174.62 174.47 3g0c s TYR 43 N -3.39 2.80 0.60 3.99 5.04 -1.26 -4.88 117.35 120.24 3g0c s TYR 43 Ca 0.22 0.28 -0.00 0.00 -2.44 0.00 0.00 57.07 55.13 3g0c s TYR 43 Cb 0.04 -4.17 0.05 0.00 0.35 0.00 0.00 41.96 38.23 3g0c s TYR 43 CO 0.04 -1.31 0.84 0.95 -1.34 0.00 0.00 175.55 174.73 3g0c s THR 44 N 4.15 2.54 0.15 4.34 -4.23 -1.26 -3.75 115.64 117.57 3g0c s THR 44 Ca 0.37 -0.60 -0.17 0.00 -1.18 0.00 0.00 61.69 60.11 3g0c s THR 44 Cb -0.10 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.81 3g0c s THR 44 CO 0.24 0.00 1.78 0.25 -0.54 0.00 0.00 174.62 176.35 3g0c h LEU 45 N -0.10 0.26 -0.93 4.79 5.85 -1.95 -2.22 115.31 121.00 3g0c h LEU 45 Ca -0.42 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.33 3g0c h LEU 45 Cb 1.30 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.25 3g0c h LEU 45 CO 0.52 0.19 0.62 0.74 -0.34 0.00 0.00 178.44 180.16 3g0c h THR 46 N 0.36 1.24 -0.67 1.05 2.02 -1.97 0.65 112.91 115.59 3g0c h THR 46 Ca 0.14 -0.43 0.08 0.00 0.77 0.00 0.00 66.41 66.97 3g0c h THR 46 Cb 0.05 -0.13 -0.07 0.00 -1.74 0.00 0.00 68.15 66.26 3g0c h THR 46 CO -0.10 0.23 0.32 0.44 0.37 0.00 0.00 175.52 176.79 3g0c h ASP 47 N 1.26 0.42 -0.35 4.18 3.32 -1.88 0.55 116.42 123.93 3g0c h ASP 47 Ca 0.34 0.06 -0.14 0.00 0.02 0.00 0.00 57.03 57.30 3g0c h ASP 47 Cb -0.15 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3g0c h ASP 47 CO -0.07 0.25 -0.35 0.22 -1.72 0.00 0.00 179.24 177.57 3g0c h TYR 48 N 0.57 1.02 0.00 4.55 3.20 -0.76 -1.67 116.97 123.87 3g0c h TYR 48 Ca 0.32 -0.31 -0.12 0.00 3.14 0.00 0.00 58.73 61.77 3g0c h TYR 48 Cb 0.32 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 3g0c h TYR 48 CO -0.11 1.11 -0.62 -0.07 -1.64 0.00 0.00 178.16 176.82 3g0c h LEU 49 N 0.64 0.00 -1.96 2.82 3.38 -0.26 -3.27 115.31 116.66 3g0c h LEU 49 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3g0c h LEU 49 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 3g0c h LEU 49 CO 0.09 0.56 0.00 0.29 0.09 0.00 0.00 178.44 179.46 3g0c n LYS 50 N -3.21 1.83 -3.52 1.13 4.76 0.19 -5.00 118.16 114.33 3g0c n LYS 50 Ca 0.01 -1.78 -0.20 0.00 -2.87 0.00 0.00 58.31 53.47 3g0c n LYS 50 Cb 0.76 -1.37 0.06 0.00 -1.84 0.00 0.00 35.03 32.64 3g0c n LYS 50 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3g0c n ASN 51 N 1.07 -3.28 -0.13 4.39 4.13 -0.85 -4.92 115.26 115.67 3g0c n ASN 51 Ca 0.13 -0.77 -0.12 0.00 1.68 0.00 0.00 54.58 55.49 3g0c n ASN 51 Cb 0.48 -4.50 -0.01 0.00 -1.54 0.00 0.00 39.78 34.21 3g0c n ASN 51 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 3g0c h THR 52 N -1.69 1.27 -3.63 3.41 2.02 -1.60 -3.39 112.91 109.31 3g0c h THR 52 Ca -0.61 -1.51 -0.69 0.00 0.77 0.00 0.00 66.41 64.37 3g0c h THR 52 Cb 1.34 1.31 -0.32 0.00 -1.74 0.00 0.00 68.15 68.74 3g0c h THR 52 CO 0.51 0.51 -0.61 -0.31 0.37 0.00 0.00 175.52 175.99 3g0c s TYR 53 N -4.47 3.37 -0.14 3.16 2.02 -1.26 -5.09 117.35 114.94 3g0c s TYR 53 Ca -0.11 -1.88 -0.04 0.00 -0.37 0.00 0.00 57.07 54.67 3g0c s TYR 53 Cb 0.12 -2.58 -0.03 0.00 -0.40 0.00 0.00 41.96 39.07 3g0c s TYR 53 CO 0.88 -0.84 -0.01 0.50 -1.57 0.00 0.00 175.55 174.50 3g0c s ARG 54 N 1.28 3.53 -0.25 -0.62 3.52 -1.26 -5.05 118.95 120.09 3g0c s ARG 54 Ca 0.01 -0.46 -0.29 0.00 -0.13 0.00 0.00 55.73 54.85 3g0c s ARG 54 Cb -0.21 -2.92 0.01 0.00 -1.56 0.00 0.00 34.95 30.26 3g0c s ARG 54 CO -0.01 0.37 1.11 -0.51 -0.81 0.00 0.00 175.30 175.46 3g0c s LEU 55 N 0.02 4.04 0.35 -0.88 1.43 -1.26 -4.77 118.68 117.62 3g0c s LEU 55 Ca 0.02 1.32 -0.26 0.00 -1.03 0.00 0.00 54.13 54.18 3g0c s LEU 55 Cb -0.13 -3.54 -0.09 0.00 0.03 0.00 0.00 46.19 42.46 3g0c s LEU 55 CO 0.02 -0.78 1.02 -0.54 0.23 0.00 0.00 176.35 176.30 3g0c s LYS 56 N 3.47 4.39 -0.00 1.70 1.02 -1.26 -5.06 119.74 123.99 3g0c s LYS 56 Ca 0.47 1.49 0.00 0.00 0.02 0.00 0.00 55.97 57.95 3g0c s LYS 56 Cb -0.15 -2.73 0.00 0.00 -0.52 0.00 0.00 37.83 34.43 3g0c s LYS 56 CO 0.12 0.07 -0.01 -0.48 -0.92 0.00 0.00 175.35 174.12 3g0c s LEU 57 N -2.25 1.91 -0.65 3.17 0.05 -1.26 -4.86 118.68 114.79 3g0c s LEU 57 Ca 0.53 -0.02 -0.14 0.00 0.05 0.00 0.00 54.13 54.55 3g0c s LEU 57 Cb -0.22 -0.08 0.17 0.00 -2.05 0.00 0.00 46.19 44.01 3g0c s LEU 57 CO 0.28 0.00 0.59 -0.47 -0.55 0.00 0.00 176.35 176.21 3g0c s TYR 58 N 0.09 3.47 -0.23 3.48 6.14 -1.26 -5.03 117.35 124.01 3g0c s TYR 58 Ca -0.01 -1.64 -0.08 0.00 0.64 0.00 0.00 57.07 55.98 3g0c s TYR 58 Cb -0.02 -3.77 -0.04 0.00 0.42 0.00 0.00 41.96 38.55 3g0c s TYR 58 CO -0.00 -1.00 0.10 -1.54 0.64 0.00 0.00 175.55 173.74 3g0c s SER 59 N 2.91 5.58 0.37 4.32 1.04 -1.26 -5.07 113.70 121.59 3g0c s SER 59 Ca 0.09 -0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.54 3g0c s SER 59 Cb -0.22 -1.99 -0.06 0.00 0.10 0.00 0.00 66.02 63.85 3g0c s SER 59 CO -0.02 0.06 0.05 -1.48 0.98 0.00 0.00 173.24 172.82 3g0c s LEU 60 N 1.09 2.37 -0.17 2.42 0.05 -1.26 -4.58 118.68 118.58 3g0c s LEU 60 Ca 0.05 -1.42 -0.04 0.00 0.05 0.00 0.00 54.13 52.77 3g0c s LEU 60 Cb -0.14 -0.53 0.08 0.00 -2.05 0.00 0.00 46.19 43.55 3g0c s LEU 60 CO 0.04 -0.61 0.20 0.00 -0.55 0.00 0.00 176.35 175.43 3g0c s ARG 61 N -3.82 0.15 0.28 1.48 1.70 -1.11 -4.98 118.95 112.64 3g0c s ARG 61 Ca 0.33 0.27 -0.30 0.00 -0.47 0.00 0.00 55.73 55.56 3g0c s ARG 61 Cb 0.08 -1.03 -0.11 0.00 -0.57 0.00 0.00 34.95 33.32 3g0c s ARG 61 CO 0.15 -0.57 1.57 -1.58 -1.08 0.00 0.00 175.30 173.79 3g0c s TRP 62 N 2.31 2.81 -0.13 5.89 0.52 -1.26 -1.70 118.94 127.37 3g0c s TRP 62 Ca 0.05 0.80 0.08 0.00 0.02 0.00 0.00 56.10 57.06 3g0c s TRP 62 Cb -0.15 -4.03 -0.11 0.00 -1.15 0.00 0.00 33.47 28.04 3g0c s TRP 62 CO -0.10 -3.45 0.22 1.51 0.02 0.00 0.00 176.95 175.15 3g0c n ILE 63 N 2.30 0.00 -2.53 2.03 0.00 -0.95 -4.92 119.36 115.31 3g0c n ILE 63 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 62.75 62.61 3g0c n ILE 63 Cb 0.38 0.55 0.00 0.00 0.00 0.00 0.00 39.64 40.57 3g0c n ILE 63 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3g0c n SER 64 N -1.57 0.00 0.20 9.51 3.41 -1.18 -5.01 113.62 118.98 3g0c n SER 64 Ca -0.00 -0.18 0.12 0.00 -0.26 0.00 0.00 58.87 58.54 3g0c n SER 64 Cb 0.18 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.34 3g0c n SER 64 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 3g0c h ASP 65 N 0.00 0.00 0.00 4.04 -0.00 -1.94 -2.94 116.42 115.58 3g0c h ASP 65 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3g0c h ASP 65 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 3g0c h ASP 65 CO 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 179.24 179.10 3g0c n HIS 66 N -2.96 0.00 -4.08 0.28 1.44 -1.26 -4.46 115.22 104.18 3g0c n HIS 66 Ca 0.04 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.61 3g0c n HIS 66 Cb 0.51 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.51 3g0c n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3g0c s GLU 67 N 0.00 0.58 0.07 -1.40 2.02 -1.26 -1.41 118.70 117.30 3g0c s GLU 67 Ca 0.00 -0.79 -0.09 0.00 0.02 0.00 0.00 54.97 54.11 3g0c s GLU 67 Cb 0.00 -0.38 0.00 0.00 0.10 0.00 0.00 34.13 33.85 3g0c s GLU 67 CO 0.00 0.07 0.19 1.52 0.02 0.00 0.00 175.26 177.06 3g0c s TYR 68 N -1.37 0.12 -0.07 1.61 -0.85 -0.66 -2.23 117.35 113.90 3g0c s TYR 68 Ca -0.09 -0.48 -0.05 0.00 -0.52 0.00 0.00 57.07 55.94 3g0c s TYR 68 Cb -0.10 -0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.15 3g0c s TYR 68 CO 0.01 -0.50 0.14 -0.51 -1.52 0.00 0.00 175.55 173.17 3g0c s LEU 69 N -2.59 4.29 -0.09 -3.49 1.43 -0.69 -0.24 118.68 117.30 3g0c s LEU 69 Ca 0.01 0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 53.41 3g0c s LEU 69 Cb 0.03 -2.27 0.03 0.00 0.03 0.00 0.00 46.19 44.00 3g0c s LEU 69 CO -0.08 0.34 0.24 -0.47 0.23 0.00 0.00 176.35 176.60 3g0c s TYR 70 N -1.14 -0.27 0.01 0.29 5.04 -0.65 -2.75 117.35 117.88 3g0c s TYR 70 Ca 0.20 0.65 -0.12 0.00 -2.44 0.00 0.00 57.07 55.37 3g0c s TYR 70 Cb -0.12 0.08 -0.06 0.00 0.35 0.00 0.00 41.96 42.21 3g0c s TYR 70 CO 0.10 -0.14 0.37 0.21 -1.34 0.00 0.00 175.55 174.75 3g0c s LYS 71 N 0.31 3.80 0.00 4.97 2.20 -1.26 -0.48 119.74 129.29 3g0c s LYS 71 Ca -0.02 0.26 0.00 0.00 -0.36 0.00 0.00 55.97 55.86 3g0c s LYS 71 Cb -0.03 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 3g0c s LYS 71 CO -0.01 0.66 0.00 1.04 -0.36 0.00 0.00 175.35 176.67 3g0c n GLN 72 N 1.50 0.00 -0.33 4.03 1.13 -1.26 -4.97 117.38 117.48 3g0c n GLN 72 Ca -0.12 0.00 0.02 0.00 -1.94 0.00 0.00 57.00 54.95 3g0c n GLN 72 Cb 0.53 -0.46 -0.01 0.00 0.11 0.00 0.00 30.24 30.40 3g0c n GLN 72 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3g0c n ASN 75 N -2.17 -1.80 -3.89 1.08 3.02 -1.26 -5.04 115.26 105.19 3g0c n ASN 75 Ca 0.00 0.37 -0.23 0.00 -0.03 0.00 0.00 54.58 54.69 3g0c n ASN 75 Cb 0.17 -0.71 -0.17 0.00 -0.61 0.00 0.00 39.78 38.46 3g0c n ASN 75 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3g0c s ILE 76 N -3.82 0.75 0.14 2.41 1.01 -0.62 -4.98 121.20 116.09 3g0c s ILE 76 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.54 3g0c s ILE 76 Cb 0.00 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 3g0c s ILE 76 CO 0.00 0.30 -0.04 -0.76 0.00 0.00 0.00 174.94 174.44 3g0c s LEU 77 N 1.33 3.23 -0.15 2.97 2.01 0.37 -0.59 118.68 127.85 3g0c s LEU 77 Ca -0.04 -0.38 -0.07 0.00 0.01 0.00 0.00 54.13 53.65 3g0c s LEU 77 Cb -0.14 -1.93 -0.04 0.00 0.01 0.00 0.00 46.19 44.09 3g0c s LEU 77 CO -0.03 0.13 0.11 -0.69 1.01 0.00 0.00 176.35 176.87 3g0c s VAL 78 N -1.53 5.20 -0.11 -1.59 1.01 -0.83 -1.64 120.40 120.91 3g0c s VAL 78 Ca 0.25 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.36 3g0c s VAL 78 Cb -0.10 -3.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 3g0c s VAL 78 CO 0.17 0.54 -0.19 -0.36 0.00 0.00 0.00 175.10 175.25 3g0c s PHE 79 N -0.37 2.66 -0.32 5.22 0.40 0.66 -3.01 117.98 123.23 3g0c s PHE 79 Ca 0.11 -0.87 -0.29 0.00 -0.60 0.00 0.00 56.93 55.28 3g0c s PHE 79 Cb -0.12 -1.76 0.01 0.00 0.51 0.00 0.00 43.02 41.66 3g0c s PHE 79 CO 0.01 -0.32 1.15 1.21 0.70 0.00 0.00 175.22 177.97 3g0c s ASN 80 N 0.32 6.84 0.36 1.36 2.47 -0.65 -1.66 114.94 123.99 3g0c s ASN 80 Ca -0.15 1.08 0.04 0.00 0.42 0.00 0.00 52.86 54.24 3g0c s ASN 80 Cb -0.17 -2.54 0.68 0.00 -1.45 0.00 0.00 41.25 37.76 3g0c s ASN 80 CO 0.07 -0.95 2.00 0.00 -3.72 0.00 0.00 177.10 174.50 3g0c h ALA 81 N 8.49 1.55 0.35 1.71 0.00 -1.57 -0.77 119.26 129.01 3g0c h ALA 81 Ca -0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 3g0c h ALA 81 Cb 1.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3g0c h ALA 81 CO 1.04 0.39 -0.17 1.49 0.00 0.00 0.00 179.25 182.00 3g0c h GLU 82 N 0.73 -0.46 0.03 0.00 4.22 -1.91 -3.39 114.58 113.80 3g0c h GLU 82 Ca 0.19 0.03 -0.35 0.00 0.08 0.00 0.00 59.36 59.31 3g0c h GLU 82 Cb -0.01 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.29 3g0c h GLU 82 CO -0.03 -0.14 -2.13 0.66 -2.18 0.00 0.00 179.01 175.19 3g0c n TYR 83 N -5.16 0.57 0.00 0.92 4.01 -1.20 -5.00 117.16 111.30 3g0c n TYR 83 Ca -0.10 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 3g0c n TYR 83 Cb 0.27 -1.09 0.00 0.00 -0.31 0.00 0.00 39.34 38.21 3g0c n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3g0c n GLY 84 N 1.86 2.60 3.69 2.72 0.00 -0.30 -5.06 105.19 110.70 3g0c n GLY 84 Ca -0.31 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.27 3g0c n GLY 84 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g0c n ASN 85 N 0.00 3.39 -3.99 1.61 6.94 -1.26 -4.66 115.26 117.29 3g0c n ASN 85 Ca 0.00 1.10 -0.20 0.00 -0.02 0.00 0.00 54.58 55.46 3g0c n ASN 85 Cb 0.00 -1.49 -0.15 0.00 -2.36 0.00 0.00 39.78 35.77 3g0c n ASN 85 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3g0c s SER 86 N 0.80 1.10 0.27 0.53 1.04 -1.26 -1.63 113.70 114.56 3g0c s SER 86 Ca 0.74 -0.17 0.10 0.00 0.48 0.00 0.00 55.95 57.10 3g0c s SER 86 Cb -0.60 -0.28 -0.05 0.00 0.10 0.00 0.00 66.02 65.19 3g0c s SER 86 CO 0.40 0.06 -0.05 -0.94 0.98 0.00 0.00 173.24 173.69 3g0c s SER 87 N 0.18 4.29 -0.18 7.02 1.04 -1.16 -4.98 113.70 119.90 3g0c s SER 87 Ca -0.03 -0.76 -0.29 0.00 0.48 0.00 0.00 55.95 55.36 3g0c s SER 87 Cb -0.08 -0.70 -0.01 0.00 0.10 0.00 0.00 66.02 65.34 3g0c s SER 87 CO 0.00 0.00 1.19 -0.69 0.98 0.00 0.00 173.24 174.72 3g0c s VAL 88 N -2.38 4.41 -0.02 5.02 1.01 -1.26 -1.96 120.40 125.22 3g0c s VAL 88 Ca 0.31 1.70 -0.09 0.00 0.00 0.00 0.00 61.98 63.91 3g0c s VAL 88 Cb -0.06 -4.10 -0.30 0.00 0.00 0.00 0.00 36.38 31.92 3g0c s VAL 88 CO 0.19 -0.15 0.78 0.15 0.00 0.00 0.00 175.10 176.07 3g0c h PHE 89 N 7.95 0.66 -2.16 5.22 3.04 -1.14 -3.46 116.94 127.04 3g0c h PHE 89 Ca -0.24 -0.48 -0.15 0.00 3.98 0.00 0.00 57.97 61.08 3g0c h PHE 89 Cb 1.09 -0.03 -0.30 0.00 2.56 0.00 0.00 35.95 39.28 3g0c h PHE 89 CO 0.78 1.55 -0.46 -1.17 -2.02 0.00 0.00 178.31 176.99 3g0c s LEU 90 N -7.22 -0.58 0.36 0.59 2.96 -0.76 -5.03 118.68 109.01 3g0c s LEU 90 Ca -0.12 0.42 -0.27 0.00 -0.22 0.00 0.00 54.13 53.94 3g0c s LEU 90 Cb 0.06 1.10 -0.09 0.00 0.50 0.00 0.00 46.19 47.76 3g0c s LEU 90 CO 0.87 -0.28 1.16 -1.61 -1.32 0.00 0.00 176.35 175.17 3g0c s GLU 91 N 2.54 4.24 0.64 1.98 8.01 -1.26 -1.59 118.70 133.26 3g0c s GLU 91 Ca 0.08 1.86 0.42 0.00 0.01 0.00 0.00 54.97 57.34 3g0c s GLU 91 Cb -0.14 -2.84 2.31 0.00 -4.31 0.00 0.00 34.13 29.15 3g0c s GLU 91 CO -0.14 -0.16 2.30 -2.95 0.01 0.00 0.00 175.26 174.32 3g0c h ASN 92 N 3.00 0.00 1.51 -0.19 7.08 -1.96 -3.01 115.58 122.01 3g0c h ASN 92 Ca -0.48 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.74 3g0c h ASN 92 Cb 1.23 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.47 3g0c h ASN 92 CO 0.64 0.00 -0.19 0.77 -2.08 0.00 0.00 177.43 176.56 3g0c h SER 93 N 0.00 0.00 -0.01 6.14 4.64 -2.04 -3.38 113.55 118.90 3g0c h SER 93 Ca 0.00 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.25 3g0c h SER 93 Cb 0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3g0c h SER 93 CO 0.00 0.02 -0.06 0.74 -0.87 0.00 0.00 176.83 176.65 3g0c h THR 94 N 0.00 1.13 -1.39 2.95 2.02 -1.93 -3.12 112.91 112.56 3g0c h THR 94 Ca 0.00 -0.54 -0.61 0.00 0.77 0.00 0.00 66.41 66.03 3g0c h THR 94 Cb 0.85 1.10 -0.40 0.00 -1.74 0.00 0.00 68.15 67.97 3g0c h THR 94 CO 0.00 0.17 -0.43 0.49 0.37 0.00 0.00 175.52 176.12 3g0c n PHE 95 N -4.36 3.21 -0.04 3.16 3.72 -1.26 -4.42 117.46 117.47 3g0c n PHE 95 Ca -0.01 -2.81 -0.02 0.00 -0.05 0.00 0.00 57.45 54.56 3g0c n PHE 95 Cb 0.20 -0.35 -0.08 0.00 -0.94 0.00 0.00 39.48 38.31 3g0c n PHE 95 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3g0c n ASP 96 N -0.56 2.43 0.22 4.37 10.43 -1.18 -4.04 116.55 128.21 3g0c n ASP 96 Ca 0.43 0.00 0.07 0.00 2.57 0.00 0.00 54.79 57.86 3g0c n ASP 96 Cb 0.67 0.98 0.51 0.00 1.84 0.00 0.00 41.12 45.12 3g0c n ASP 96 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 3g0c h GLU 97 N 0.00 0.00 -0.98 -1.24 3.07 -1.78 -3.24 114.58 110.41 3g0c h GLU 97 Ca -0.20 0.00 0.33 0.00 -0.50 0.00 0.00 59.36 58.99 3g0c h GLU 97 Cb 1.31 0.00 -0.16 0.00 -0.84 0.00 0.00 28.75 29.07 3g0c h GLU 97 CO 0.01 0.25 0.47 0.35 -1.40 0.00 0.00 179.01 178.69 3g0c h PHE 98 N 0.00 0.74 0.00 4.33 3.04 -1.81 -3.45 116.94 119.79 3g0c h PHE 98 Ca -0.00 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.99 3g0c h PHE 98 Cb 0.52 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.87 3g0c h PHE 98 CO 0.00 -0.27 0.00 0.41 -2.02 0.00 0.00 178.31 176.43 3g0c n GLY 99 N -1.31 3.22 3.55 2.40 0.00 -1.23 -5.03 105.19 106.79 3g0c n GLY 99 Ca 0.31 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.05 3g0c n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g0c s HIS 100 N -2.45 2.61 -0.28 1.61 3.76 -1.26 -5.10 115.29 114.18 3g0c s HIS 100 Ca 0.00 -0.23 -0.29 0.00 -0.15 0.00 0.00 55.06 54.39 3g0c s HIS 100 Cb 0.00 -1.31 0.01 0.00 1.11 0.00 0.00 32.58 32.39 3g0c s HIS 100 CO 0.00 0.47 1.13 0.45 -0.85 0.00 0.00 174.74 175.94 3g0c s SER 101 N -2.58 6.92 -0.41 1.40 0.15 -1.26 -4.93 113.70 112.99 3g0c s SER 101 Ca 0.23 1.21 -0.27 0.00 0.70 0.00 0.00 55.95 57.82 3g0c s SER 101 Cb -0.09 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.69 3g0c s SER 101 CO 0.14 -0.86 0.97 -0.63 1.20 0.00 0.00 173.24 174.06 3g0c s ILE 102 N 3.67 4.48 0.04 6.45 -1.09 -1.26 -4.41 121.20 129.08 3g0c s ILE 102 Ca 0.48 1.12 -0.16 0.00 -2.23 0.00 0.00 60.65 59.85 3g0c s ILE 102 Cb -0.14 -4.42 -0.28 0.00 -1.58 0.00 0.00 42.46 36.04 3g0c s ILE 102 CO 0.15 -0.70 1.09 -1.13 -1.23 0.00 0.00 174.94 173.12 3g0c h ASN 103 N 8.74 0.78 -5.11 3.58 -1.24 -0.96 -3.49 115.58 117.89 3g0c h ASN 103 Ca -0.23 -0.82 0.00 0.00 0.71 0.00 0.00 56.30 55.96 3g0c h ASN 103 Cb 1.07 -0.25 -0.08 0.00 0.73 0.00 0.00 38.32 39.80 3g0c h ASN 103 CO 1.02 1.52 0.06 -0.62 -1.29 0.00 0.00 177.43 178.12 3g0c s ASP 104 N -7.25 -0.20 0.17 1.15 -1.08 -1.04 -5.01 116.67 103.42 3g0c s ASP 104 Ca -0.11 -0.70 0.02 0.00 -0.52 0.00 0.00 52.55 51.25 3g0c s ASP 104 Cb 0.05 0.64 -0.05 0.00 -1.46 0.00 0.00 42.92 42.10 3g0c s ASP 104 CO 0.90 -1.21 -0.01 -0.72 0.52 0.00 0.00 175.17 174.66 3g0c s TYR 105 N -3.95 1.23 -0.23 -5.34 1.13 -1.26 -0.38 117.35 108.55 3g0c s TYR 105 Ca 0.15 -0.99 -0.04 0.00 -1.41 0.00 0.00 57.07 54.77 3g0c s TYR 105 Cb -0.03 -0.70 0.12 0.00 -1.10 0.00 0.00 41.96 40.25 3g0c s TYR 105 CO 0.06 -0.18 0.42 0.45 -2.51 0.00 0.00 175.55 173.78 3g0c s SER 106 N -3.18 -0.12 0.08 -0.18 0.15 -0.02 -4.97 113.70 105.46 3g0c s SER 106 Ca 0.23 0.62 -0.26 0.00 0.70 0.00 0.00 55.95 57.25 3g0c s SER 106 Cb 0.06 1.32 -0.06 0.00 -1.71 0.00 0.00 66.02 65.63 3g0c s SER 106 CO 0.04 -0.27 0.79 -0.63 1.20 0.00 0.00 173.24 174.37 3g0c s ILE 107 N 2.61 4.62 0.61 6.45 -1.09 -1.26 -0.10 121.20 133.03 3g0c s ILE 107 Ca 0.07 1.69 -0.19 0.00 -2.23 0.00 0.00 60.65 60.00 3g0c s ILE 107 Cb -0.14 -4.14 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 3g0c s ILE 107 CO -0.15 0.40 1.22 -0.94 -1.23 0.00 0.00 174.94 174.24 3g0c s SER 108 N -0.30 5.06 0.55 3.58 1.04 0.08 -4.90 113.70 118.82 3g0c s SER 108 Ca 0.39 2.42 0.30 0.00 0.48 0.00 0.00 55.95 59.55 3g0c s SER 108 Cb -0.21 -2.60 1.47 0.00 0.10 0.00 0.00 66.02 64.77 3g0c s SER 108 CO 0.24 -1.68 1.89 -0.65 0.98 0.00 0.00 173.24 174.03 3g0c h PRO 109 N 0.79 0.00 -0.65 4.02 0.11 -1.82 0.40 132.00 134.85 3g0c h PRO 109 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3g0c h PRO 109 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3g0c h PRO 109 CO 0.55 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.94 3g0c n ASP 110 N -4.14 4.50 -0.99 -2.05 3.85 -1.23 -4.80 116.55 111.69 3g0c n ASP 110 Ca 0.16 -2.43 -0.11 0.00 -0.71 0.00 0.00 54.79 51.70 3g0c n ASP 110 Cb 0.88 -0.56 -0.05 0.00 -1.35 0.00 0.00 41.12 40.04 3g0c n ASP 110 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3g0c n GLY 111 N 1.07 1.03 0.10 6.12 0.00 0.13 -4.81 105.19 108.84 3g0c n GLY 111 Ca 0.24 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.37 3g0c n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g0c n GLN 112 N -1.15 0.61 -3.98 1.61 6.02 -1.26 -4.88 117.38 114.35 3g0c n GLN 112 Ca -0.11 0.07 -0.09 0.00 -0.01 0.00 0.00 57.00 56.86 3g0c n GLN 112 Cb 0.48 -1.78 -0.11 0.00 1.02 0.00 0.00 30.24 29.86 3g0c n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3g0c s PHE 113 N -3.39 0.27 -0.05 1.08 0.08 -1.26 -1.88 117.98 112.82 3g0c s PHE 113 Ca -0.02 -0.55 0.04 0.00 0.12 0.00 0.00 56.93 56.52 3g0c s PHE 113 Cb 0.10 -0.20 0.00 0.00 -0.57 0.00 0.00 43.02 42.36 3g0c s PHE 113 CO 0.81 -0.22 -0.16 -1.50 -0.10 0.00 0.00 175.22 174.05 3g0c s ILE 114 N -1.73 1.34 -0.21 0.64 2.07 -0.41 -0.74 121.20 122.17 3g0c s ILE 114 Ca -0.13 -0.65 -0.17 0.00 -1.41 0.00 0.00 60.65 58.29 3g0c s ILE 114 Cb -0.08 -1.17 -0.04 0.00 0.13 0.00 0.00 42.46 41.30 3g0c s ILE 114 CO -0.02 0.39 0.44 -0.22 -1.91 0.00 0.00 174.94 173.63 3g0c s LEU 115 N 0.20 4.14 -0.25 8.50 2.96 0.86 -0.78 118.68 134.30 3g0c s LEU 115 Ca -0.07 0.56 -0.05 0.00 -0.22 0.00 0.00 54.13 54.34 3g0c s LEU 115 Cb -0.12 -2.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.98 3g0c s LEU 115 CO 0.03 -0.13 0.02 -0.76 -1.32 0.00 0.00 176.35 174.19 3g0c s LEU 116 N 1.50 3.31 -0.20 -0.68 1.43 0.32 -0.84 118.68 123.52 3g0c s LEU 116 Ca 0.21 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.74 3g0c s LEU 116 Cb -0.15 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 3g0c s LEU 116 CO 0.09 -0.08 0.16 -0.70 0.23 0.00 0.00 176.35 176.05 3g0c s GLU 117 N 1.51 4.18 0.30 1.70 2.12 0.48 -1.87 118.70 127.12 3g0c s GLU 117 Ca 0.05 -0.18 -0.04 0.00 0.36 0.00 0.00 54.97 55.16 3g0c s GLU 117 Cb -0.15 -3.44 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 3g0c s GLU 117 CO -0.00 0.25 0.41 1.52 -0.54 0.00 0.00 175.26 176.90 3g0c s TYR 118 N 0.50 0.96 -1.46 5.30 1.13 -0.34 -0.20 117.35 123.23 3g0c s TYR 118 Ca 0.09 -1.20 -0.04 0.00 -1.41 0.00 0.00 57.07 54.52 3g0c s TYR 118 Cb -0.12 -0.14 0.02 0.00 -1.10 0.00 0.00 41.96 40.62 3g0c s TYR 118 CO -0.00 -1.00 0.35 0.09 -2.51 0.00 0.00 175.55 172.48 3g0c n ASN 119 N -0.99 -5.18 -4.68 -0.18 3.02 -1.26 0.17 115.26 106.17 3g0c n ASN 119 Ca 0.01 -0.17 -0.44 0.00 -0.03 0.00 0.00 54.58 53.95 3g0c n ASN 119 Cb 0.62 -4.26 -0.04 0.00 -0.61 0.00 0.00 39.78 35.50 3g0c n ASN 119 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g0c n TYR 120 N -4.09 2.51 -3.94 3.10 9.36 -1.26 -4.27 117.16 118.57 3g0c n TYR 120 Ca -0.13 -0.09 -0.30 0.00 3.32 0.00 0.00 57.90 60.71 3g0c n TYR 120 Cb 0.62 -2.70 -0.16 0.00 -0.63 0.00 0.00 39.34 36.47 3g0c n TYR 120 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3g0c s VAL 121 N 2.90 1.47 0.60 2.97 1.01 0.70 -4.99 120.40 125.07 3g0c s VAL 121 Ca 0.84 -1.04 -0.19 0.00 0.00 0.00 0.00 61.98 61.59 3g0c s VAL 121 Cb -0.54 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 3g0c s VAL 121 CO 0.40 0.02 1.26 1.17 0.00 0.00 0.00 175.10 177.96 3g0c n LYS 122 N 4.72 1.28 0.00 2.72 4.81 -1.26 -1.20 118.16 129.23 3g0c n LYS 122 Ca -0.13 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 3g0c n LYS 122 Cb 0.45 -2.49 0.00 0.00 0.02 0.00 0.00 35.03 33.02 3g0c n LYS 122 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 3g0c n GLN 123 N -1.45 0.00 0.00 1.64 7.27 0.25 -4.85 117.38 120.25 3g0c n GLN 123 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.21 3g0c n GLN 123 Cb 0.47 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.12 3g0c n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 3g0c n TRP 124 N 0.00 0.00 0.11 3.69 5.03 -1.17 -4.93 117.44 120.17 3g0c n TRP 124 Ca 0.00 0.00 0.04 0.00 3.03 0.00 0.00 57.50 60.57 3g0c n TRP 124 Cb 0.00 0.00 0.46 0.00 -1.03 0.00 0.00 31.31 30.74 3g0c n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 3g0c h ARG 125 N 0.00 0.30 0.00 -0.99 2.43 -1.99 -3.36 114.38 110.77 3g0c h ARG 125 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3g0c h ARG 125 Cb 0.00 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 3g0c h ARG 125 CO 0.00 0.28 -0.87 0.72 -1.51 0.00 0.00 179.97 178.59 3g0c n HIS 126 N -4.41 0.00 -2.83 2.20 8.25 -1.26 -5.08 115.22 112.09 3g0c n HIS 126 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.10 3g0c n HIS 126 Cb 0.15 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.20 3g0c n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3g0c s SER 127 N -2.66 7.28 0.31 0.41 1.04 -1.26 -4.65 113.70 114.16 3g0c s SER 127 Ca 0.00 1.77 -0.19 0.00 0.48 0.00 0.00 55.95 58.00 3g0c s SER 127 Cb 0.00 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.60 3g0c s SER 127 CO 0.00 -0.07 0.74 -0.72 0.98 0.00 0.00 173.24 174.17 3g0c s TYR 128 N -1.63 -0.10 0.12 5.02 -0.85 -1.26 -0.58 117.35 118.06 3g0c s TYR 128 Ca 0.50 -0.42 0.11 0.00 -0.52 0.00 0.00 57.07 56.73 3g0c s TYR 128 Cb -0.18 0.74 -0.04 0.00 0.38 0.00 0.00 41.96 42.87 3g0c s TYR 128 CO 0.23 -1.33 -0.26 0.99 -1.52 0.00 0.00 175.55 173.65 3g0c s THR 129 N -3.48 2.28 0.08 -3.49 2.01 -0.34 -4.50 115.64 108.21 3g0c s THR 129 Ca 0.12 -1.69 -0.26 0.00 0.31 0.00 0.00 61.69 60.17 3g0c s THR 129 Cb -0.06 -1.99 0.08 0.00 0.01 0.00 0.00 72.50 70.54 3g0c s THR 129 CO 0.08 0.13 0.84 0.00 -0.69 0.00 0.00 174.62 174.98 3g0c s ALA 130 N -1.03 -1.70 0.15 7.40 0.00 -0.89 -0.21 121.76 125.48 3g0c s ALA 130 Ca 0.14 0.61 0.01 0.00 0.00 0.00 0.00 51.96 52.72 3g0c s ALA 130 Cb -0.10 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.58 3g0c s ALA 130 CO 0.06 -0.81 0.29 -1.12 0.00 0.00 0.00 175.76 174.18 3g0c s SER 131 N -2.67 6.35 -0.00 0.00 0.01 0.13 -2.00 113.70 115.52 3g0c s SER 131 Ca 0.06 0.24 0.01 0.00 1.31 0.00 0.00 55.95 57.57 3g0c s SER 131 Cb -0.01 -1.94 -0.00 0.00 0.21 0.00 0.00 66.02 64.27 3g0c s SER 131 CO -0.06 0.05 -0.03 -0.31 0.41 0.00 0.00 173.24 173.30 3g0c s TYR 132 N -1.73 0.26 0.09 2.43 1.51 -1.26 -1.20 117.35 117.45 3g0c s TYR 132 Ca 0.35 -0.05 0.06 0.00 -1.01 0.00 0.00 57.07 56.43 3g0c s TYR 132 Cb -0.11 -0.17 -0.03 0.00 -0.11 0.00 0.00 41.96 41.53 3g0c s TYR 132 CO 0.28 -0.01 -0.16 -0.51 -1.11 0.00 0.00 175.55 174.05 3g0c s ASP 133 N -0.05 2.04 -0.16 2.29 1.01 -0.78 -4.27 116.67 116.75 3g0c s ASP 133 Ca 0.01 -0.68 -0.02 0.00 0.71 0.00 0.00 52.55 52.56 3g0c s ASP 133 Cb -0.01 -0.08 -0.02 0.00 1.01 0.00 0.00 42.92 43.81 3g0c s ASP 133 CO -0.00 -0.05 -0.07 -0.63 0.21 0.00 0.00 175.17 174.63 3g0c s ILE 134 N -1.44 3.54 -0.23 0.77 1.01 -1.26 -0.52 121.20 123.07 3g0c s ILE 134 Ca 0.03 -0.48 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 3g0c s ILE 134 Cb -0.09 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.82 3g0c s ILE 134 CO 0.03 0.49 0.04 -0.47 0.00 0.00 0.00 174.94 175.03 3g0c s TYR 135 N 0.50 3.07 -0.15 3.97 5.04 0.04 -0.60 117.35 129.22 3g0c s TYR 135 Ca -0.05 -0.47 -0.28 0.00 -2.44 0.00 0.00 57.07 53.82 3g0c s TYR 135 Cb -0.15 -2.18 -0.01 0.00 0.35 0.00 0.00 41.96 39.98 3g0c s TYR 135 CO 0.03 -0.33 0.97 0.34 -1.34 0.00 0.00 175.55 175.23 3g0c s ASP 136 N 1.39 7.14 -0.07 4.32 -1.08 -0.55 -1.29 116.67 126.53 3g0c s ASP 136 Ca 0.05 1.40 -0.24 0.00 -0.52 0.00 0.00 52.55 53.25 3g0c s ASP 136 Cb -0.15 -2.53 -0.28 0.00 -1.46 0.00 0.00 42.92 38.51 3g0c s ASP 136 CO 0.02 -0.49 0.91 -0.07 0.52 0.00 0.00 175.17 176.06 3g0c h LEU 137 N 8.45 0.32 -1.32 -1.34 3.38 -1.69 0.56 115.31 123.68 3g0c h LEU 137 Ca -0.28 -0.92 -0.06 0.00 0.09 0.00 0.00 57.88 56.71 3g0c h LEU 137 Cb 1.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3g0c h LEU 137 CO 0.88 1.21 -0.30 0.78 0.09 0.00 0.00 178.44 181.10 3g0c h ASN 138 N -0.52 0.00 -0.01 -0.43 4.21 -1.91 -1.11 115.58 115.81 3g0c h ASN 138 Ca -0.08 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.43 3g0c h ASN 138 Cb 1.35 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.55 3g0c h ASN 138 CO 0.10 0.30 -0.77 0.29 -1.29 0.00 0.00 177.43 176.06 3g0c n LYS 139 N -3.76 0.55 -3.57 0.81 5.02 -1.26 -5.02 118.16 110.93 3g0c n LYS 139 Ca -0.01 -0.43 -0.20 0.00 -2.02 0.00 0.00 58.31 55.64 3g0c n LYS 139 Cb 0.40 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 33.99 3g0c n LYS 139 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3g0c n ARG 140 N -0.86 -6.26 -3.53 1.97 0.63 -0.02 -5.01 116.66 103.59 3g0c n ARG 140 Ca 0.06 0.76 -0.08 0.00 -0.92 0.00 0.00 57.85 57.68 3g0c n ARG 140 Cb 0.39 -5.65 -0.02 0.00 0.45 0.00 0.00 32.46 27.63 3g0c n ARG 140 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 3g0c s GLN 141 N -5.77 0.70 0.20 -0.14 -2.07 -0.04 -4.97 119.66 107.59 3g0c s GLN 141 Ca 0.13 -0.22 -0.32 0.00 -1.82 0.00 0.00 55.36 53.13 3g0c s GLN 141 Cb -0.06 0.32 -0.12 0.00 -1.09 0.00 0.00 33.01 32.06 3g0c s GLN 141 CO 0.76 -0.30 1.68 1.28 -1.32 0.00 0.00 175.29 177.39 3g0c n LEU 142 N -0.12 3.80 -4.68 2.60 4.77 -1.26 -1.48 117.00 120.63 3g0c n LEU 142 Ca -0.07 1.07 -0.42 0.00 -0.03 0.00 0.00 56.01 56.56 3g0c n LEU 142 Cb 0.61 -1.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.13 3g0c n LEU 142 CO 0.11 0.07 1.11 -0.63 -1.33 0.00 0.00 177.39 176.72 3g0c s ILE 143 N 1.03 3.90 -0.23 -0.08 1.09 0.23 -4.90 121.20 122.24 3g0c s ILE 143 Ca 0.75 1.22 0.00 0.00 -1.10 0.00 0.00 60.65 61.53 3g0c s ILE 143 Cb -0.55 -3.79 -0.19 0.00 -1.06 0.00 0.00 42.46 36.88 3g0c s ILE 143 CO 0.35 -0.04 -0.09 0.35 -0.10 0.00 0.00 174.94 175.41 3g0c n THR 144 N 4.89 1.55 -2.62 2.92 -2.24 -1.26 -4.65 114.28 112.87 3g0c n THR 144 Ca 0.13 -0.60 -0.34 0.00 -2.27 0.00 0.00 64.05 60.98 3g0c n THR 144 Cb 0.44 -1.47 -0.04 0.00 -2.10 0.00 0.00 70.33 67.16 3g0c n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3g0c s GLU 145 N -2.53 3.92 -1.10 -0.78 1.03 -1.26 -4.34 118.70 113.64 3g0c s GLU 145 Ca -0.32 1.30 -0.20 0.00 0.03 0.00 0.00 54.97 55.79 3g0c s GLU 145 Cb 0.08 -2.12 -0.01 0.00 -0.80 0.00 0.00 34.13 31.29 3g0c s GLU 145 CO 0.64 -0.32 0.78 0.39 -1.33 0.00 0.00 175.26 175.42 3g0c n GLU 146 N -0.87 -1.18 -1.73 -4.83 -0.58 -1.26 -4.70 120.64 105.48 3g0c n GLU 146 Ca 0.09 0.51 -0.31 0.00 -0.42 0.00 0.00 57.16 57.03 3g0c n GLU 146 Cb 0.53 -4.02 0.04 0.00 -0.57 0.00 0.00 31.44 27.42 3g0c n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3g0c s ARG 147 N -5.84 2.99 0.00 3.49 0.52 -1.26 -4.76 118.95 114.09 3g0c s ARG 147 Ca 0.43 0.73 -0.30 0.00 -0.52 0.00 0.00 55.73 56.07 3g0c s ARG 147 Cb -0.16 -2.01 -0.03 0.00 0.52 0.00 0.00 34.95 33.27 3g0c s ARG 147 CO 0.86 -1.00 1.00 0.42 0.02 0.00 0.00 175.30 176.60 3g0c s ILE 148 N -3.18 4.81 0.76 1.52 1.01 -1.26 -5.01 121.20 119.85 3g0c s ILE 148 Ca 0.58 2.01 -0.13 0.00 0.00 0.00 0.00 60.65 63.11 3g0c s ILE 148 Cb -0.12 -4.29 0.06 0.00 0.01 0.00 0.00 42.46 38.11 3g0c s ILE 148 CO 0.54 0.16 1.16 -2.16 0.00 0.00 0.00 174.94 174.63 3g0c s PRO 149 N 1.02 2.04 0.80 2.79 0.04 -1.26 -4.47 135.00 135.96 3g0c s PRO 149 Ca 0.52 1.57 -0.12 0.00 0.04 0.00 0.00 61.00 63.01 3g0c s PRO 149 Cb -0.22 -1.84 0.08 0.00 0.04 0.00 0.00 34.50 32.56 3g0c s PRO 149 CO 0.28 -1.87 1.15 -0.80 0.04 0.00 0.00 177.00 175.80 3g0c s ASN 150 N -2.46 3.88 -1.10 6.66 0.01 -1.26 -3.58 114.94 117.09 3g0c s ASN 150 Ca 0.70 2.15 0.00 0.00 -0.71 0.00 0.00 52.86 54.99 3g0c s ASN 150 Cb -0.25 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 38.85 3g0c s ASN 150 CO 0.49 -2.46 0.00 0.59 -1.51 0.00 0.00 177.10 174.20 3g0c n ASN 151 N -3.42 -4.01 -4.76 -1.22 4.13 -1.19 -4.99 115.26 99.81 3g0c n ASN 151 Ca 0.12 0.08 -0.41 0.00 1.68 0.00 0.00 54.58 56.04 3g0c n ASN 151 Cb 0.52 -3.03 -0.03 0.00 -1.54 0.00 0.00 39.78 35.70 3g0c n ASN 151 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3g0c s THR 152 N -2.55 2.88 -0.13 3.41 2.01 -0.84 -4.61 115.64 115.80 3g0c s THR 152 Ca 0.00 0.84 0.17 0.00 0.31 0.00 0.00 61.69 63.01 3g0c s THR 152 Cb 0.00 -3.53 -0.23 0.00 0.01 0.00 0.00 72.50 68.75 3g0c s THR 152 CO 0.00 0.18 0.44 0.00 -0.69 0.00 0.00 174.62 174.55 3g0c n GLN 153 N 1.36 0.66 -3.63 4.92 6.02 0.51 -2.10 117.38 125.13 3g0c n GLN 153 Ca 0.02 0.07 -0.12 0.00 -0.01 0.00 0.00 57.00 56.96 3g0c n GLN 153 Cb 0.42 -1.64 -0.07 0.00 1.02 0.00 0.00 30.24 29.97 3g0c n GLN 153 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 3g0c s TRP 154 N -2.79 -0.65 -0.01 1.08 -0.11 -1.22 -4.60 118.94 110.65 3g0c s TRP 154 Ca -0.07 1.55 0.02 0.00 1.22 0.00 0.00 56.10 58.82 3g0c s TRP 154 Cb 0.08 0.32 -0.00 0.00 -1.50 0.00 0.00 33.47 32.37 3g0c s TRP 154 CO 0.84 -0.33 -0.07 0.08 -4.62 0.00 0.00 176.95 172.85 3g0c s VAL 155 N 0.19 0.55 -0.20 5.86 1.01 -1.26 -0.44 120.40 126.10 3g0c s VAL 155 Ca 0.01 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 3g0c s VAL 155 Cb -0.05 -0.47 0.07 0.00 0.00 0.00 0.00 36.38 35.94 3g0c s VAL 155 CO -0.01 0.16 0.48 0.28 0.00 0.00 0.00 175.10 176.01 3g0c s THR 156 N -0.07 -0.22 0.62 3.92 -1.32 0.14 -4.99 115.64 113.73 3g0c s THR 156 Ca 0.01 0.09 -0.17 0.00 -1.21 0.00 0.00 61.69 60.41 3g0c s THR 156 Cb -0.04 -0.72 -0.02 0.00 -1.51 0.00 0.00 72.50 70.21 3g0c s THR 156 CO -0.00 0.04 1.13 0.26 -2.21 0.00 0.00 174.62 173.84 3g0c s TRP 157 N 1.81 2.58 0.87 9.09 0.52 -1.26 -0.98 118.94 131.57 3g0c s TRP 157 Ca -0.08 1.55 -0.10 0.00 0.02 0.00 0.00 56.10 57.49 3g0c s TRP 157 Cb -0.09 -3.26 0.11 0.00 -1.15 0.00 0.00 33.47 29.09 3g0c s TRP 157 CO -0.15 -1.76 1.11 -1.54 0.02 0.00 0.00 176.95 174.64 3g0c s SER 158 N -2.16 3.51 0.37 2.95 1.04 -0.75 -4.90 113.70 113.77 3g0c s SER 158 Ca 0.70 1.95 0.17 0.00 0.48 0.00 0.00 55.95 59.26 3g0c s SER 158 Cb -0.23 -2.50 0.71 0.00 0.10 0.00 0.00 66.02 64.09 3g0c s SER 158 CO 0.36 -2.69 1.76 -0.65 0.98 0.00 0.00 173.24 173.00 3g0c h PRO 159 N -1.58 0.00 -6.23 4.02 0.11 -1.82 -3.43 132.00 123.07 3g0c h PRO 159 Ca -0.45 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.09 3g0c h PRO 159 Cb 1.26 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.18 3g0c h PRO 159 CO 0.47 0.39 -0.80 0.14 -0.21 0.00 0.00 178.00 177.98 3g0c s VAL 160 N -3.76 2.02 0.00 3.15 -7.23 -1.26 -4.73 120.40 108.60 3g0c s VAL 160 Ca -0.01 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 3g0c s VAL 160 Cb 0.12 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 35.13 3g0c s VAL 160 CO 0.69 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.88 3g0c n GLY 161 N 0.35 0.07 2.08 2.32 0.00 -1.26 -4.53 105.19 104.22 3g0c n GLY 161 Ca -0.13 -0.94 -0.02 0.00 0.00 0.00 0.00 46.02 44.93 3g0c n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3g0c n HIS 162 N 0.00 0.99 -1.57 1.61 1.44 -1.26 -3.52 115.22 112.92 3g0c n HIS 162 Ca 0.00 -1.60 -0.32 0.00 -2.01 0.00 0.00 57.72 53.79 3g0c n HIS 162 Cb 0.00 -0.23 0.06 0.00 0.12 0.00 0.00 29.99 29.95 3g0c n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3g0c s LYS 163 N -2.59 2.61 -0.02 -1.40 1.02 -1.26 -4.60 119.74 113.50 3g0c s LYS 163 Ca 0.34 1.29 0.01 0.00 0.02 0.00 0.00 55.97 57.63 3g0c s LYS 163 Cb 0.36 -1.93 0.01 0.00 -0.52 0.00 0.00 37.83 35.74 3g0c s LYS 163 CO -0.07 -1.39 -0.05 -1.17 -0.92 0.00 0.00 175.35 171.76 3g0c s LEU 164 N -5.28 1.73 -0.09 3.17 2.96 0.03 -1.81 118.68 119.39 3g0c s LEU 164 Ca 0.64 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 54.47 3g0c s LEU 164 Cb -0.19 -0.32 0.02 0.00 0.50 0.00 0.00 46.19 46.19 3g0c s LEU 164 CO 0.47 0.02 -0.13 0.00 -1.32 0.00 0.00 176.35 175.39 3g0c s ALA 165 N 0.28 1.42 0.03 5.97 0.00 -0.15 -0.93 121.76 128.38 3g0c s ALA 165 Ca -0.03 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.39 3g0c s ALA 165 Cb -0.07 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.31 3g0c s ALA 165 CO -0.00 -0.03 -0.04 1.52 0.00 0.00 0.00 175.76 177.20 3g0c s TYR 166 N 0.94 0.38 -0.17 0.00 -0.85 -0.48 0.29 117.35 117.45 3g0c s TYR 166 Ca -0.09 -0.60 -0.04 0.00 -0.52 0.00 0.00 57.07 55.82 3g0c s TYR 166 Cb -0.15 -0.26 -0.02 0.00 0.38 0.00 0.00 41.96 41.91 3g0c s TYR 166 CO 0.00 -0.19 -0.04 0.08 -1.52 0.00 0.00 175.55 173.88 3g0c s VAL 167 N -1.82 3.73 -0.05 -3.49 1.01 0.41 -0.71 120.40 119.49 3g0c s VAL 167 Ca -0.11 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 3g0c s VAL 167 Cb -0.07 -2.65 0.04 0.00 0.00 0.00 0.00 36.38 33.69 3g0c s VAL 167 CO -0.02 0.47 0.09 0.86 0.00 0.00 0.00 175.10 176.50 3g0c s TRP 168 N 0.67 -0.06 -1.44 5.22 -0.00 -0.60 -0.36 118.94 122.37 3g0c s TRP 168 Ca -0.02 0.33 -0.08 0.00 -0.00 0.00 0.00 56.10 56.33 3g0c s TRP 168 Cb -0.14 -0.22 0.04 0.00 -0.00 0.00 0.00 33.47 33.14 3g0c s TRP 168 CO 0.02 -0.15 0.63 0.09 -0.00 0.00 0.00 176.95 177.54 3g0c n ASN 169 N 4.48 -5.11 -0.17 5.86 5.03 -1.26 -2.32 115.26 121.77 3g0c n ASN 169 Ca -0.21 -0.38 -0.02 0.00 0.87 0.00 0.00 54.58 54.83 3g0c n ASN 169 Cb 0.51 -4.15 -0.01 0.00 -1.02 0.00 0.00 39.78 35.11 3g0c n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3g0c n ASN 170 N -2.49 -3.60 -4.47 6.41 5.03 -1.26 -4.40 115.26 110.48 3g0c n ASN 170 Ca -0.05 0.05 -0.24 0.00 0.87 0.00 0.00 54.58 55.21 3g0c n ASN 170 Cb 0.58 -1.29 -0.10 0.00 -1.02 0.00 0.00 39.78 37.95 3g0c n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3g0c s ASP 171 N -2.46 3.57 -0.15 6.41 -0.00 -0.98 -2.17 116.67 120.89 3g0c s ASP 171 Ca 0.00 -1.05 -0.05 0.00 -0.00 0.00 0.00 52.55 51.45 3g0c s ASP 171 Cb 0.00 -0.30 -0.03 0.00 -0.00 0.00 0.00 42.92 42.59 3g0c s ASP 171 CO 0.00 0.01 0.01 -0.63 -0.00 0.00 0.00 175.17 174.56 3g0c s ILE 172 N -2.53 4.34 0.04 0.77 1.01 -1.26 -1.56 121.20 122.01 3g0c s ILE 172 Ca 0.30 -0.20 0.06 0.00 0.00 0.00 0.00 60.65 60.81 3g0c s ILE 172 Cb -0.04 -2.91 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 3g0c s ILE 172 CO 0.15 0.50 -0.19 -0.31 0.00 0.00 0.00 174.94 175.09 3g0c s TYR 173 N 0.14 1.65 -0.07 3.97 2.02 0.12 0.88 117.35 126.05 3g0c s TYR 173 Ca 0.02 -0.36 0.03 0.00 -0.37 0.00 0.00 57.07 56.39 3g0c s TYR 173 Cb -0.13 -0.99 0.01 0.00 -0.40 0.00 0.00 41.96 40.45 3g0c s TYR 173 CO 0.02 0.07 -0.17 0.08 -1.57 0.00 0.00 175.55 173.97 3g0c s VAL 174 N -0.77 1.47 -0.27 0.71 1.01 0.30 -1.39 120.40 121.46 3g0c s VAL 174 Ca 0.06 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 3g0c s VAL 174 Cb -0.08 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 35.01 3g0c s VAL 174 CO 0.01 0.43 0.04 -0.54 0.00 0.00 0.00 175.10 175.04 3g0c s LYS 175 N 0.41 3.14 0.14 2.72 1.02 -0.10 -0.40 119.74 126.67 3g0c s LYS 175 Ca -0.13 -0.81 -0.11 0.00 0.02 0.00 0.00 55.97 54.94 3g0c s LYS 175 Cb -0.15 -3.25 -0.05 0.00 -0.52 0.00 0.00 37.83 33.85 3g0c s LYS 175 CO 0.05 -0.38 1.46 0.82 -0.92 0.00 0.00 175.35 176.38 3g0c h ILE 176 N 5.86 1.27 -4.13 2.17 1.08 -1.84 0.13 117.51 122.05 3g0c h ILE 176 Ca -0.34 -1.60 -0.53 0.00 -0.39 0.00 0.00 64.86 62.00 3g0c h ILE 176 Cb 1.13 1.44 -0.26 0.00 -3.07 0.00 0.00 36.82 36.06 3g0c h ILE 176 CO 0.60 0.53 -0.82 -1.61 -0.69 0.00 0.00 178.15 176.16 3g0c s GLU 177 N -4.33 1.21 0.31 2.37 0.41 -1.26 -4.20 118.70 113.21 3g0c s GLU 177 Ca -0.11 -0.85 0.00 0.00 -0.41 0.00 0.00 54.97 53.60 3g0c s GLU 177 Cb 0.11 -1.28 0.50 0.00 -1.78 0.00 0.00 34.13 31.67 3g0c s GLU 177 CO 0.89 0.33 1.89 -1.35 -0.49 0.00 0.00 175.26 176.52 3g0c h PRO 178 N 4.94 0.80 -0.10 0.39 0.11 -1.85 -2.24 132.00 134.05 3g0c h PRO 178 Ca -0.40 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3g0c h PRO 178 Cb 1.17 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3g0c h PRO 178 CO 0.44 0.66 0.00 0.27 -0.21 0.00 0.00 178.00 179.16 3g0c n ASN 179 N -4.33 1.67 -4.98 -2.05 2.04 -1.26 -4.84 115.26 101.51 3g0c n ASN 179 Ca 0.05 -1.63 -0.20 0.00 -0.44 0.00 0.00 54.58 52.36 3g0c n ASN 179 Cb 0.16 -0.06 -0.01 0.00 -2.53 0.00 0.00 39.78 37.34 3g0c n ASN 179 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 3g0c s LEU 180 N -1.77 4.18 0.61 -4.53 1.43 -0.84 -4.49 118.68 113.26 3g0c s LEU 180 Ca 0.35 -0.03 -0.19 0.00 -1.03 0.00 0.00 54.13 53.24 3g0c s LEU 180 Cb 0.19 -2.82 -0.03 0.00 0.03 0.00 0.00 46.19 43.56 3g0c s LEU 180 CO 0.30 -0.22 1.23 -2.84 0.23 0.00 0.00 176.35 175.05 3g0c s PRO 181 N -4.06 2.87 -0.03 1.29 0.02 -1.26 -4.84 135.00 128.98 3g0c s PRO 181 Ca 0.38 1.89 -0.11 0.00 0.02 0.00 0.00 61.00 63.18 3g0c s PRO 181 Cb -0.09 -1.91 -0.05 0.00 0.02 0.00 0.00 34.50 32.47 3g0c s PRO 181 CO 0.30 -1.31 0.31 -1.54 -0.33 0.00 0.00 177.00 174.43 3g0c s SER 182 N -1.54 6.64 -0.01 2.53 1.04 -1.26 -4.68 113.70 116.42 3g0c s SER 182 Ca 0.79 0.76 -0.22 0.00 0.48 0.00 0.00 55.95 57.76 3g0c s SER 182 Cb -0.32 -2.17 -0.05 0.00 0.10 0.00 0.00 66.02 63.57 3g0c s SER 182 CO 0.35 0.34 0.64 -0.31 0.98 0.00 0.00 173.24 175.24 3g0c s TYR 183 N -1.10 3.67 -0.12 5.02 2.02 0.47 -4.85 117.35 122.45 3g0c s TYR 183 Ca 0.22 1.25 -0.25 0.00 -0.37 0.00 0.00 57.07 57.92 3g0c s TYR 183 Cb -0.15 -2.68 -0.02 0.00 -0.40 0.00 0.00 41.96 38.71 3g0c s TYR 183 CO 0.11 0.29 0.80 0.50 -1.57 0.00 0.00 175.55 175.67 3g0c s ARG 184 N 0.02 4.36 -0.15 -0.62 3.52 -1.26 -0.54 118.95 124.28 3g0c s ARG 184 Ca 0.33 0.99 -0.06 0.00 -0.13 0.00 0.00 55.73 56.86 3g0c s ARG 184 Cb -0.18 -3.53 -0.24 0.00 -1.56 0.00 0.00 34.95 29.44 3g0c s ARG 184 CO 0.18 -0.18 0.23 -0.89 -0.81 0.00 0.00 175.30 173.83 3g0c n ILE 185 N 4.36 1.71 -4.43 4.11 2.08 0.25 -4.50 119.36 122.94 3g0c n ILE 185 Ca 0.03 -0.60 -0.25 0.00 0.56 0.00 0.00 62.75 62.49 3g0c n ILE 185 Cb 0.50 -1.70 -0.10 0.00 -0.75 0.00 0.00 39.64 37.59 3g0c n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 3g0c s THR 186 N -2.54 2.52 -0.01 1.39 -4.23 -1.18 -4.79 115.64 106.81 3g0c s THR 186 Ca -0.26 -2.20 0.01 0.00 -1.18 0.00 0.00 61.69 58.06 3g0c s THR 186 Cb 0.07 -2.28 0.01 0.00 1.34 0.00 0.00 72.50 71.65 3g0c s THR 186 CO 0.72 -0.28 0.75 0.79 -0.54 0.00 0.00 174.62 176.07 3g0c n TRP 187 N -0.26 0.00 0.46 3.99 7.02 -1.26 -4.57 117.44 122.82 3g0c n TRP 187 Ca -0.08 -0.24 0.05 0.00 -1.02 0.00 0.00 57.50 56.21 3g0c n TRP 187 Cb 0.58 -0.03 -0.01 0.00 -2.42 0.00 0.00 31.31 29.44 3g0c n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3g0c n THR 188 N -0.26 0.00 -1.68 -0.99 -2.24 -1.26 -5.02 114.28 102.84 3g0c n THR 188 Ca 0.01 -0.38 -0.45 0.00 -2.27 0.00 0.00 64.05 60.95 3g0c n THR 188 Cb 0.42 1.11 -0.04 0.00 -2.10 0.00 0.00 70.33 69.72 3g0c n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g0c n GLY 189 N 0.94 1.18 3.06 3.38 0.00 -1.26 -4.69 105.19 107.81 3g0c n GLY 189 Ca 0.04 0.65 -0.12 0.00 0.00 0.00 0.00 46.02 46.59 3g0c n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g0c s LYS 190 N 0.97 0.20 0.02 1.61 2.20 -0.71 -4.88 119.74 119.15 3g0c s LYS 190 Ca 0.78 0.70 -0.36 0.00 -0.36 0.00 0.00 55.97 56.74 3g0c s LYS 190 Cb -0.65 -0.04 -0.14 0.00 -1.51 0.00 0.00 37.83 35.49 3g0c s LYS 190 CO 0.37 -0.23 1.61 -1.91 -0.36 0.00 0.00 175.35 174.84 3g0c n GLU 191 N 4.87 1.77 -0.26 4.03 2.13 -1.26 -0.21 120.64 131.71 3g0c n GLU 191 Ca -0.14 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.32 3g0c n GLU 191 Cb 0.51 -2.39 0.00 0.00 0.27 0.00 0.00 31.44 29.84 3g0c n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3g0c n ASP 192 N 4.23 0.00 0.00 4.31 8.00 -1.26 -4.75 116.55 127.09 3g0c n ASP 192 Ca 0.20 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.67 3g0c n ASP 192 Cb 0.24 -0.98 -0.01 0.00 -0.02 0.00 0.00 41.12 40.35 3g0c n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3g0c n ILE 193 N -2.00 1.22 -4.34 0.53 -0.00 0.21 -4.55 119.36 110.42 3g0c n ILE 193 Ca 0.00 0.31 -0.34 0.00 -0.00 0.00 0.00 62.75 62.72 3g0c n ILE 193 Cb 0.00 -1.79 -0.14 0.00 -0.00 0.00 0.00 39.64 37.70 3g0c n ILE 193 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 3g0c s ILE 194 N -2.20 3.12 -0.29 1.39 -1.09 0.70 -0.34 121.20 122.49 3g0c s ILE 194 Ca -0.09 -0.61 0.02 0.00 -2.23 0.00 0.00 60.65 57.74 3g0c s ILE 194 Cb 0.01 -2.36 0.07 0.00 -1.58 0.00 0.00 42.46 38.60 3g0c s ILE 194 CO 0.13 0.48 -0.05 -0.31 -1.23 0.00 0.00 174.94 173.97 3g0c s TYR 195 N 0.90 3.37 -0.31 3.97 1.51 -0.38 -1.73 117.35 124.68 3g0c s TYR 195 Ca -0.02 -2.37 -0.11 0.00 -1.01 0.00 0.00 57.07 53.56 3g0c s TYR 195 Cb -0.15 -2.19 -0.03 0.00 -0.11 0.00 0.00 41.96 39.48 3g0c s TYR 195 CO 0.00 -0.88 0.18 -0.80 -1.11 0.00 0.00 175.55 172.94 3g0c s ASN 196 N 1.12 5.81 0.00 2.29 0.01 -0.92 -0.82 114.94 122.44 3g0c s ASN 196 Ca -0.04 -0.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 3g0c s ASN 196 Cb -0.20 -2.07 0.00 0.00 0.41 0.00 0.00 41.25 39.39 3g0c s ASN 196 CO -0.05 -0.15 0.00 0.61 -1.51 0.00 0.00 177.10 176.00 3g0c n GLY 197 N 5.04 1.34 3.18 0.66 0.00 -0.61 -4.35 105.19 110.45 3g0c n GLY 197 Ca -0.14 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 3g0c n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g0c s ILE 198 N -3.69 1.10 0.56 -0.61 -4.36 -1.26 -0.19 121.20 112.74 3g0c s ILE 198 Ca 0.00 -1.43 -0.08 0.00 -0.26 0.00 0.00 60.65 58.88 3g0c s ILE 198 Cb 0.00 -1.19 -0.03 0.00 1.25 0.00 0.00 42.46 42.49 3g0c s ILE 198 CO 0.00 -0.32 0.91 0.42 0.24 0.00 0.00 174.94 176.19 3g0c s THR 199 N -1.64 4.71 0.30 8.37 -4.23 0.88 -4.73 115.64 119.31 3g0c s THR 199 Ca 0.01 0.51 -0.01 0.00 -1.18 0.00 0.00 61.69 61.02 3g0c s THR 199 Cb -0.08 -3.84 0.06 0.00 1.34 0.00 0.00 72.50 69.99 3g0c s THR 199 CO 0.02 -0.96 0.42 -0.90 -0.54 0.00 0.00 174.62 172.65 3g0c n ASP 200 N -2.53 0.48 -0.10 3.99 3.85 -1.26 -4.80 116.55 116.18 3g0c n ASP 200 Ca 0.03 -1.42 -0.06 0.00 -0.71 0.00 0.00 54.79 52.63 3g0c n ASP 200 Cb 0.55 -0.28 0.01 0.00 -1.35 0.00 0.00 41.12 40.05 3g0c n ASP 200 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.20 175.94 3g0c h TRP 201 N -0.57 -0.09 -0.13 2.11 7.01 -2.00 -1.04 115.95 121.24 3g0c h TRP 201 Ca -0.14 0.03 -0.23 0.00 2.11 0.00 0.00 58.89 60.66 3g0c h TRP 201 Cb 0.49 0.09 0.01 0.00 -2.10 0.00 0.00 29.16 27.65 3g0c h TRP 201 CO 0.00 -0.10 -0.82 -0.24 -2.79 0.00 0.00 178.44 174.49 3g0c h VAL 202 N 0.05 1.28 -0.29 2.65 3.04 -1.95 -1.79 116.25 119.24 3g0c h VAL 202 Ca 0.17 -2.03 -0.11 0.00 -1.01 0.00 0.00 66.70 63.72 3g0c h VAL 202 Cb 0.24 2.05 -0.01 0.00 -2.01 0.00 0.00 31.29 31.56 3g0c h VAL 202 CO -0.31 0.64 -0.29 1.88 -1.01 0.00 0.00 177.57 178.47 3g0c h TYR 203 N 0.51 0.69 0.29 3.17 -1.99 -1.92 0.43 116.97 118.16 3g0c h TYR 203 Ca -0.06 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.48 3g0c h TYR 203 Cb 1.45 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 40.03 3g0c h TYR 203 CO 0.09 0.83 -0.14 1.49 -0.00 0.00 0.00 178.16 180.43 3g0c h GLU 204 N 0.52 -0.37 0.06 4.88 4.81 -1.09 0.16 114.58 123.55 3g0c h GLU 204 Ca 0.07 0.03 -0.24 0.00 -0.13 0.00 0.00 59.36 59.08 3g0c h GLU 204 Cb 0.77 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 3g0c h GLU 204 CO 0.06 -0.22 -1.13 1.49 -0.73 0.00 0.00 179.01 178.48 3g0c h GLU 205 N -0.43 0.12 0.00 1.92 4.57 -1.19 -1.65 114.58 117.92 3g0c h GLU 205 Ca -0.04 -0.21 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 3g0c h GLU 205 Cb 0.33 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 3g0c h GLU 205 CO 0.07 1.09 -0.76 0.39 -1.18 0.00 0.00 179.01 178.62 3g0c n GLU 206 N -3.43 2.30 -0.02 1.92 -0.58 0.13 -4.65 120.64 116.32 3g0c n GLU 206 Ca -0.04 -0.02 -0.04 0.00 -0.42 0.00 0.00 57.16 56.64 3g0c n GLU 206 Cb 0.98 -0.90 -0.01 0.00 -0.57 0.00 0.00 31.44 30.93 3g0c n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3g0c n VAL 207 N -1.40 1.19 0.61 2.62 0.31 -0.98 -4.85 118.33 115.83 3g0c n VAL 207 Ca -0.00 0.26 0.11 0.00 -0.01 0.00 0.00 64.34 64.70 3g0c n VAL 207 Cb 0.06 -1.90 -0.04 0.00 -0.91 0.00 0.00 33.84 31.05 3g0c n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3g0c n PHE 208 N -3.81 0.13 -3.96 3.52 3.72 0.53 -4.98 117.46 112.61 3g0c n PHE 208 Ca -0.07 0.04 -0.31 0.00 -0.05 0.00 0.00 57.45 57.06 3g0c n PHE 208 Cb 0.24 -0.31 0.02 0.00 -0.94 0.00 0.00 39.48 38.49 3g0c n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3g0c n SER 209 N -1.86 -4.35 -3.58 4.37 7.64 -0.64 -4.92 113.62 110.28 3g0c n SER 209 Ca 0.02 -0.82 -0.11 0.00 1.01 0.00 0.00 58.87 58.97 3g0c n SER 209 Cb 0.42 -3.69 -0.05 0.00 -1.01 0.00 0.00 64.21 59.88 3g0c n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g0c s ALA 210 N -3.32 -1.93 0.12 -0.43 0.00 -1.13 -4.99 121.76 110.08 3g0c s ALA 210 Ca 0.64 1.60 -0.02 0.00 0.00 0.00 0.00 51.96 54.18 3g0c s ALA 210 Cb -0.33 -0.76 -0.12 0.00 0.00 0.00 0.00 23.12 21.92 3g0c s ALA 210 CO 0.85 -0.30 1.28 -0.92 0.00 0.00 0.00 175.76 176.67 3g0c h TYR 211 N 2.70 0.47 -4.17 0.00 -0.00 -1.88 -3.38 116.97 110.71 3g0c h TYR 211 Ca -0.19 -0.28 -0.47 0.00 -0.00 0.00 0.00 58.73 57.78 3g0c h TYR 211 Cb 1.16 -0.04 0.03 0.00 -0.00 0.00 0.00 36.73 37.88 3g0c h TYR 211 CO 0.30 1.13 0.37 -1.54 -0.00 0.00 0.00 178.16 178.42 3g0c s SER 212 N -7.05 6.39 -0.31 -2.11 1.04 -1.26 -0.08 113.70 110.33 3g0c s SER 212 Ca -0.04 1.68 0.19 0.00 0.48 0.00 0.00 55.95 58.26 3g0c s SER 212 Cb 0.09 -2.52 0.47 0.00 0.10 0.00 0.00 66.02 64.15 3g0c s SER 212 CO 0.86 -0.75 1.08 0.00 0.98 0.00 0.00 173.24 175.42 3g0c n ALA 213 N -1.57 2.89 -2.40 5.32 0.00 0.73 -4.57 120.51 120.92 3g0c n ALA 213 Ca 0.07 -2.70 -0.31 0.00 0.00 0.00 0.00 53.44 50.51 3g0c n ALA 213 Cb 0.54 -0.91 -0.14 0.00 0.00 0.00 0.00 19.45 18.93 3g0c n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3g0c s LEU 214 N -3.45 2.39 -0.19 0.00 1.43 -1.24 -2.26 118.68 115.36 3g0c s LEU 214 Ca 0.25 -0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 52.83 3g0c s LEU 214 Cb 0.40 -1.41 0.07 0.00 0.03 0.00 0.00 46.19 45.28 3g0c s LEU 214 CO -0.01 0.27 0.14 0.26 0.23 0.00 0.00 176.35 177.23 3g0c s TRP 215 N -0.83 0.05 0.28 0.29 0.51 0.17 -4.97 118.94 114.45 3g0c s TRP 215 Ca 0.13 -0.20 -0.29 0.00 -2.12 0.00 0.00 56.10 53.61 3g0c s TRP 215 Cb -0.10 -0.61 -0.10 0.00 -0.81 0.00 0.00 33.47 31.85 3g0c s TRP 215 CO 0.03 -0.57 1.15 -1.58 -0.51 0.00 0.00 176.95 175.47 3g0c s TRP 216 N 2.19 3.45 0.76 -1.98 0.52 -1.26 -0.53 118.94 122.10 3g0c s TRP 216 Ca 0.04 1.61 -0.12 0.00 0.02 0.00 0.00 56.10 57.66 3g0c s TRP 216 Cb -0.16 -3.38 0.05 0.00 -1.15 0.00 0.00 33.47 28.83 3g0c s TRP 216 CO -0.13 -0.89 1.11 -1.54 0.02 0.00 0.00 176.95 175.53 3g0c s SER 217 N -0.70 4.43 0.39 2.95 1.04 0.36 -4.88 113.70 117.28 3g0c s SER 217 Ca 0.46 1.97 0.19 0.00 0.48 0.00 0.00 55.95 59.05 3g0c s SER 217 Cb -0.34 -2.54 1.15 0.00 0.10 0.00 0.00 66.02 64.39 3g0c s SER 217 CO 0.43 -2.09 1.71 -0.65 0.98 0.00 0.00 173.24 173.62 3g0c h PRO 218 N -0.83 0.33 -0.55 4.02 0.11 -1.88 -0.15 132.00 133.04 3g0c h PRO 218 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g0c h PRO 218 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3g0c h PRO 218 CO 0.51 0.22 0.00 0.27 -0.21 0.00 0.00 178.00 178.78 3g0c n ASN 219 N -4.75 3.47 0.00 -2.05 0.23 -1.26 -4.41 115.26 106.49 3g0c n ASN 219 Ca 0.29 -2.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.34 3g0c n ASN 219 Cb 1.00 -0.37 0.00 0.00 -2.08 0.00 0.00 39.78 38.34 3g0c n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g0c n GLY 220 N 1.11 0.69 0.13 4.83 0.00 -0.07 -4.67 105.19 107.22 3g0c n GLY 220 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 3g0c n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3g0c h THR 221 N 0.00 0.94 -3.24 2.61 2.02 -1.94 -3.44 112.91 109.86 3g0c h THR 221 Ca 0.00 -0.55 -0.64 0.00 0.77 0.00 0.00 66.41 65.99 3g0c h THR 221 Cb 0.00 1.27 -0.11 0.00 -1.74 0.00 0.00 68.15 67.57 3g0c h THR 221 CO 0.00 0.13 -0.63 -0.36 0.37 0.00 0.00 175.52 175.02 3g0c s PHE 222 N -5.05 3.07 -0.24 3.16 0.08 -1.26 -0.30 117.98 117.43 3g0c s PHE 222 Ca -0.15 0.01 0.01 0.00 0.12 0.00 0.00 56.93 56.92 3g0c s PHE 222 Cb 0.03 -1.56 0.06 0.00 -0.57 0.00 0.00 43.02 40.98 3g0c s PHE 222 CO 0.62 0.50 -0.04 -1.17 -0.10 0.00 0.00 175.22 175.02 3g0c s LEU 223 N -2.40 2.66 0.08 -0.37 2.96 0.47 -0.49 118.68 121.59 3g0c s LEU 223 Ca 0.27 -1.24 -0.16 0.00 -0.22 0.00 0.00 54.13 52.78 3g0c s LEU 223 Cb -0.12 -1.18 -0.06 0.00 0.50 0.00 0.00 46.19 45.32 3g0c s LEU 223 CO 0.20 -0.25 0.51 0.00 -1.32 0.00 0.00 176.35 175.49 3g0c s ALA 224 N 1.38 3.62 0.13 5.97 0.00 0.31 -1.45 121.76 131.73 3g0c s ALA 224 Ca -0.04 -0.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.71 3g0c s ALA 224 Cb -0.19 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.42 3g0c s ALA 224 CO -0.07 0.45 0.28 1.52 0.00 0.00 0.00 175.76 177.94 3g0c s TYR 225 N -1.23 0.17 0.06 0.00 -0.85 0.26 0.44 117.35 116.19 3g0c s TYR 225 Ca 0.31 -0.55 0.05 0.00 -0.52 0.00 0.00 57.07 56.36 3g0c s TYR 225 Cb -0.17 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.16 3g0c s TYR 225 CO 0.18 -0.66 -0.08 0.00 -1.52 0.00 0.00 175.55 173.46 3g0c s ALA 226 N -3.89 2.99 -0.09 9.51 0.00 -0.96 -0.61 121.76 128.71 3g0c s ALA 226 Ca 0.10 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.95 3g0c s ALA 226 Cb 0.03 -1.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 3g0c s ALA 226 CO -0.06 0.63 -0.21 -1.14 0.00 0.00 0.00 175.76 174.98 3g0c s GLN 227 N -1.84 2.96 -0.09 0.00 0.74 -0.10 -1.57 119.66 119.76 3g0c s GLN 227 Ca 0.20 -0.82 0.01 0.00 0.05 0.00 0.00 55.36 54.80 3g0c s GLN 227 Cb -0.11 -2.36 -0.02 0.00 1.10 0.00 0.00 33.01 31.62 3g0c s GLN 227 CO 0.11 0.28 -0.12 -0.06 -0.55 0.00 0.00 175.29 174.95 3g0c s PHE 228 N 0.12 2.80 -0.25 1.67 0.08 0.00 -1.48 117.98 120.93 3g0c s PHE 228 Ca -0.10 -0.29 -0.03 0.00 0.12 0.00 0.00 56.93 56.63 3g0c s PHE 228 Cb -0.16 -1.74 0.02 0.00 -0.57 0.00 0.00 43.02 40.57 3g0c s PHE 228 CO 0.06 0.07 -0.04 1.21 -0.10 0.00 0.00 175.22 176.42 3g0c s ASN 229 N -0.31 4.41 -0.15 1.36 3.84 -0.55 -1.25 114.94 122.28 3g0c s ASN 229 Ca 0.03 -0.76 0.15 0.00 0.21 0.00 0.00 52.86 52.49 3g0c s ASN 229 Cb -0.13 -1.70 0.55 0.00 -0.55 0.00 0.00 41.25 39.42 3g0c s ASN 229 CO 0.03 -0.12 1.46 0.47 -2.79 0.00 0.00 177.10 176.15 3g0c n ASP 230 N 4.72 4.07 -0.23 -4.21 9.92 0.54 -1.87 116.55 129.49 3g0c n ASP 230 Ca -0.17 -2.79 -0.10 0.00 -0.53 0.00 0.00 54.79 51.21 3g0c n ASP 230 Cb 0.48 -0.52 -0.06 0.00 -0.64 0.00 0.00 41.12 40.39 3g0c n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3g0c h THR 231 N 2.36 0.05 -0.55 -3.53 2.02 -1.83 -1.94 112.91 109.48 3g0c h THR 231 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3g0c h THR 231 Cb 1.40 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 3g0c h THR 231 CO 0.23 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.50 3g0c n GLU 232 N -5.38 3.50 -2.88 6.66 1.02 -1.26 -4.90 120.64 117.40 3g0c n GLU 232 Ca 0.01 -2.49 -0.41 0.00 -0.02 0.00 0.00 57.16 54.25 3g0c n GLU 232 Cb 0.34 -1.86 -0.04 0.00 -0.02 0.00 0.00 31.44 29.86 3g0c n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3g0c s VAL 233 N -1.91 4.92 0.84 2.62 1.01 -0.73 -4.58 120.40 122.56 3g0c s VAL 233 Ca 0.44 1.71 -0.11 0.00 0.00 0.00 0.00 61.98 64.02 3g0c s VAL 233 Cb 0.29 -4.16 0.10 0.00 0.00 0.00 0.00 36.38 32.61 3g0c s VAL 233 CO 0.20 0.12 1.09 -2.84 0.00 0.00 0.00 175.10 173.67 3g0c s PRO 234 N 1.51 1.70 -0.09 2.72 0.02 -1.26 -4.73 135.00 134.87 3g0c s PRO 234 Ca 0.42 0.89 -0.02 0.00 0.02 0.00 0.00 61.00 62.32 3g0c s PRO 234 Cb -0.18 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.45 3g0c s PRO 234 CO 0.18 -1.95 -0.01 -0.51 -0.33 0.00 0.00 177.00 174.37 3g0c s LEU 235 N -6.05 3.48 -0.09 -5.54 1.43 -1.26 -1.00 118.68 109.64 3g0c s LEU 235 Ca 0.62 0.09 -0.17 0.00 -1.03 0.00 0.00 54.13 53.64 3g0c s LEU 235 Cb -0.17 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 3g0c s LEU 235 CO 0.56 0.36 0.44 -0.51 0.23 0.00 0.00 176.35 177.43 3g0c s ILE 236 N -0.76 5.15 -0.11 -0.59 1.10 -0.04 -4.90 121.20 121.04 3g0c s ILE 236 Ca 0.12 0.89 0.03 0.00 -0.51 0.00 0.00 60.65 61.18 3g0c s ILE 236 Cb -0.11 -3.77 0.00 0.00 0.15 0.00 0.00 42.46 38.73 3g0c s ILE 236 CO 0.02 0.40 -0.22 -1.61 -2.11 0.00 0.00 174.94 171.42 3g0c s GLU 237 N 0.13 2.95 0.07 3.50 2.02 -1.26 -2.04 118.70 124.07 3g0c s GLU 237 Ca 0.24 -0.84 -0.07 0.00 0.02 0.00 0.00 54.97 54.32 3g0c s GLU 237 Cb -0.15 -2.30 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 3g0c s GLU 237 CO 0.11 0.09 0.15 1.52 0.02 0.00 0.00 175.26 177.15 3g0c s TYR 238 N 0.56 0.18 0.06 1.61 -0.85 -0.98 -4.98 117.35 112.95 3g0c s TYR 238 Ca -0.14 -0.57 -0.27 0.00 -0.52 0.00 0.00 57.07 55.57 3g0c s TYR 238 Cb -0.17 -0.11 -0.05 0.00 0.38 0.00 0.00 41.96 42.01 3g0c s TYR 238 CO 0.04 -0.48 0.86 -1.12 -1.52 0.00 0.00 175.55 173.34 3g0c s SER 239 N -2.61 7.34 -0.19 -0.18 0.01 -1.26 -0.53 113.70 116.28 3g0c s SER 239 Ca 0.02 1.60 -0.04 0.00 1.31 0.00 0.00 55.95 58.84 3g0c s SER 239 Cb 0.03 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.72 3g0c s SER 239 CO -0.09 -0.05 -0.04 0.12 0.41 0.00 0.00 173.24 173.60 3g0c s PHE 240 N 0.10 2.98 -0.01 2.43 2.19 -0.42 -4.67 117.98 120.57 3g0c s PHE 240 Ca 0.43 -0.58 0.10 0.00 0.33 0.00 0.00 56.93 57.21 3g0c s PHE 240 Cb -0.22 -2.03 -0.23 0.00 -1.31 0.00 0.00 43.02 39.24 3g0c s PHE 240 CO 0.26 -0.28 0.79 1.88 1.83 0.00 0.00 175.22 179.70 3g0c h TYR 241 N 7.38 0.04 -0.71 10.12 -1.99 -1.96 -1.30 116.97 128.55 3g0c h TYR 241 Ca -0.35 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.35 3g0c h TYR 241 Cb 1.18 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 3g0c h TYR 241 CO 0.56 1.04 0.00 0.45 -0.00 0.00 0.00 178.16 180.22 3g0c n SER 242 N -3.14 -2.12 -4.72 3.88 2.88 -1.26 -4.77 113.62 104.37 3g0c n SER 242 Ca -0.14 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.07 3g0c n SER 242 Cb 1.03 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 64.60 3g0c n SER 242 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3g0c s ASP 243 N -4.00 3.94 0.04 -3.46 2.15 -1.26 -4.88 116.67 109.20 3g0c s ASP 243 Ca 0.00 2.24 0.10 0.00 0.43 0.00 0.00 52.55 55.32 3g0c s ASP 243 Cb 0.00 -2.57 0.45 0.00 -0.30 0.00 0.00 42.92 40.49 3g0c s ASP 243 CO 0.00 -2.43 1.32 -1.84 -0.17 0.00 0.00 175.17 172.05 3g0c n GLU 244 N -3.18 0.03 0.02 4.34 0.28 -1.26 -1.92 120.64 118.95 3g0c n GLU 244 Ca 0.12 0.39 0.13 0.00 -0.16 0.00 0.00 57.16 57.64 3g0c n GLU 244 Cb 0.51 -1.56 0.43 0.00 1.43 0.00 0.00 31.44 32.25 3g0c n GLU 244 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 3g0c n SER 245 N -1.61 0.35 -4.62 -1.84 3.41 -1.26 -4.71 113.62 103.33 3g0c n SER 245 Ca 0.02 0.26 -0.43 0.00 -0.26 0.00 0.00 58.87 58.46 3g0c n SER 245 Cb 0.10 -0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 3g0c n SER 245 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3g0c s LEU 246 N -3.39 3.79 0.07 1.04 0.20 -0.81 -4.92 118.68 114.66 3g0c s LEU 246 Ca 0.12 1.10 -0.16 0.00 0.69 0.00 0.00 54.13 55.88 3g0c s LEU 246 Cb 0.17 -3.54 -0.15 0.00 -0.43 0.00 0.00 46.19 42.24 3g0c s LEU 246 CO 0.61 -1.19 1.30 -0.61 -0.29 0.00 0.00 176.35 176.16 3g0c h GLN 247 N 9.77 0.64 -5.17 1.98 4.15 -1.89 -3.43 115.11 121.15 3g0c h GLN 247 Ca -0.27 -0.47 -0.66 0.00 0.77 0.00 0.00 58.65 58.03 3g0c h GLN 247 Cb 1.10 0.08 -0.28 0.00 0.21 0.00 0.00 27.48 28.59 3g0c h GLN 247 CO 1.05 1.09 -0.77 0.71 -1.93 0.00 0.00 178.83 178.98 3g0c s TYR 248 N -3.87 2.85 0.60 3.99 2.02 -1.26 -5.09 117.35 116.60 3g0c s TYR 248 Ca -0.12 -0.89 -0.19 0.00 -0.37 0.00 0.00 57.07 55.49 3g0c s TYR 248 Cb 0.07 -1.94 -0.03 0.00 -0.40 0.00 0.00 41.96 39.66 3g0c s TYR 248 CO 0.85 -0.41 1.20 -2.30 -1.57 0.00 0.00 175.55 173.31 3g0c n PRO 249 N 4.11 1.19 -2.62 -1.71 -0.02 -1.26 -4.99 135.00 129.71 3g0c n PRO 249 Ca -0.19 0.45 -0.31 0.00 -2.02 0.00 0.00 63.50 61.44 3g0c n PRO 249 Cb 0.52 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 3g0c n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3g0c s LYS 250 N -3.02 3.85 -0.19 -0.52 2.20 -0.49 -4.94 119.74 116.64 3g0c s LYS 250 Ca 0.77 0.70 -0.02 0.00 -0.36 0.00 0.00 55.97 57.06 3g0c s LYS 250 Cb -0.41 -2.26 -0.01 0.00 -1.51 0.00 0.00 37.83 33.64 3g0c s LYS 250 CO 0.45 -0.16 -0.09 0.99 -0.36 0.00 0.00 175.35 176.18 3g0c s THR 251 N -2.51 3.12 -0.06 3.43 2.01 -1.26 -1.31 115.64 119.06 3g0c s THR 251 Ca 0.55 -0.60 -0.17 0.00 0.31 0.00 0.00 61.69 61.78 3g0c s THR 251 Cb -0.10 -2.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 3g0c s THR 251 CO 0.32 0.47 0.46 -0.69 -0.69 0.00 0.00 174.62 174.49 3g0c s VAL 252 N 1.10 5.08 -0.20 3.82 1.01 0.31 -4.94 120.40 126.58 3g0c s VAL 252 Ca 0.01 0.94 0.00 0.00 0.00 0.00 0.00 61.98 62.93 3g0c s VAL 252 Cb -0.15 -3.79 0.05 0.00 0.00 0.00 0.00 36.38 32.50 3g0c s VAL 252 CO -0.02 0.44 -0.06 -0.13 0.00 0.00 0.00 175.10 175.33 3g0c s ARG 253 N -0.13 1.59 -0.09 2.72 0.52 -1.26 -2.31 118.95 119.98 3g0c s ARG 253 Ca 0.25 -0.79 0.04 0.00 -0.52 0.00 0.00 55.73 54.72 3g0c s ARG 253 Cb -0.16 -2.36 -0.00 0.00 0.52 0.00 0.00 34.95 32.95 3g0c s ARG 253 CO 0.12 -0.52 -0.23 0.08 0.02 0.00 0.00 175.30 174.77 3g0c s VAL 254 N 1.50 1.98 -0.14 3.52 1.01 -0.86 -4.95 120.40 122.46 3g0c s VAL 254 Ca -0.03 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 60.69 3g0c s VAL 254 Cb -0.17 -1.71 -0.06 0.00 0.00 0.00 0.00 36.38 34.43 3g0c s VAL 254 CO -0.07 0.54 2.14 -2.84 0.00 0.00 0.00 175.10 174.87 3g0c s PRO 255 N 0.31 3.45 -0.21 2.72 0.02 -1.26 -0.86 135.00 139.17 3g0c s PRO 255 Ca -0.17 2.22 -0.04 0.00 0.02 0.00 0.00 61.00 63.03 3g0c s PRO 255 Cb -0.17 -4.31 0.10 0.00 0.02 0.00 0.00 34.50 30.13 3g0c s PRO 255 CO 0.08 -1.75 0.22 -0.47 -0.33 0.00 0.00 177.00 174.75 3g0c s TYR 256 N 7.10 -0.26 -0.40 6.54 5.04 -0.17 -4.51 117.35 130.69 3g0c s TYR 256 Ca 0.97 0.15 -0.25 0.00 -2.44 0.00 0.00 57.07 55.49 3g0c s TYR 256 Cb -0.36 -0.39 0.02 0.00 0.35 0.00 0.00 41.96 41.57 3g0c s TYR 256 CO 0.37 -0.63 0.91 -1.25 -1.34 0.00 0.00 175.55 173.61 3g0c s PRO 257 N 2.32 3.74 0.58 4.97 0.04 -1.26 -4.52 135.00 140.86 3g0c s PRO 257 Ca 0.07 0.42 -0.11 0.00 0.04 0.00 0.00 61.00 61.41 3g0c s PRO 257 Cb -0.16 -3.84 -0.05 0.00 0.04 0.00 0.00 34.50 30.49 3g0c s PRO 257 CO -0.14 -1.02 0.99 0.15 0.04 0.00 0.00 177.00 177.02 3g0c s LYS 258 N 3.52 3.67 -0.13 4.56 1.02 -1.26 -1.29 119.74 129.82 3g0c s LYS 258 Ca 0.37 0.73 -0.42 0.00 0.02 0.00 0.00 55.97 56.67 3g0c s LYS 258 Cb -0.11 -2.13 -0.20 0.00 -0.52 0.00 0.00 37.83 34.87 3g0c s LYS 258 CO 0.21 -0.46 1.23 0.00 -0.92 0.00 0.00 175.35 175.40 3g0c n ALA 259 N -2.44 -2.93 -0.41 5.17 0.00 -0.28 -0.86 120.51 118.77 3g0c n ALA 259 Ca 0.05 0.57 0.00 0.00 0.00 0.00 0.00 53.44 54.06 3g0c n ALA 259 Cb 0.54 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3g0c n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g0c n GLY 260 N 2.22 1.22 3.97 0.00 0.00 -1.26 -4.90 105.19 106.44 3g0c n GLY 260 Ca 0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 3g0c n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g0c s ALA 261 N -3.04 3.14 -0.20 4.61 0.00 -0.04 -4.99 121.76 121.24 3g0c s ALA 261 Ca 0.00 -1.51 -0.29 0.00 0.00 0.00 0.00 51.96 50.16 3g0c s ALA 261 Cb 0.00 -2.31 -0.02 0.00 0.00 0.00 0.00 23.12 20.79 3g0c s ALA 261 CO 0.00 -1.82 1.41 0.08 0.00 0.00 0.00 175.76 175.43 3g0c s VAL 262 N -3.42 4.01 0.50 0.00 1.01 -1.26 -4.92 120.40 116.32 3g0c s VAL 262 Ca 0.69 1.19 -0.19 0.00 0.00 0.00 0.00 61.98 63.67 3g0c s VAL 262 Cb -0.05 -3.90 -0.08 0.00 0.00 0.00 0.00 36.38 32.35 3g0c s VAL 262 CO 0.48 -0.26 1.01 0.20 0.00 0.00 0.00 175.10 176.53 3g0c s ASN 263 N 2.90 6.39 0.46 3.32 0.01 -1.26 -4.37 114.94 122.40 3g0c s ASN 263 Ca 0.61 1.79 -0.25 0.00 -0.71 0.00 0.00 52.86 54.30 3g0c s ASN 263 Cb -0.23 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 38.81 3g0c s ASN 263 CO 0.22 -0.74 1.44 -2.16 -1.51 0.00 0.00 177.10 174.35 3g0c s PRO 264 N -3.56 3.62 0.38 -0.60 0.04 -1.26 -4.86 135.00 128.76 3g0c s PRO 264 Ca 0.64 2.44 -0.00 0.00 0.04 0.00 0.00 61.00 64.12 3g0c s PRO 264 Cb -0.14 -2.62 -0.03 0.00 0.04 0.00 0.00 34.50 31.76 3g0c s PRO 264 CO 0.24 -0.88 0.60 0.95 0.04 0.00 0.00 177.00 177.95 3g0c s THR 265 N -1.20 4.88 -0.01 1.26 -4.23 -0.78 -4.91 115.64 110.64 3g0c s THR 265 Ca 0.62 -0.38 0.01 0.00 -1.18 0.00 0.00 61.69 60.76 3g0c s THR 265 Cb -0.44 -3.79 0.01 0.00 1.34 0.00 0.00 72.50 69.61 3g0c s THR 265 CO 0.57 -0.56 -0.04 0.54 -0.54 0.00 0.00 174.62 174.59 3g0c s VAL 266 N -2.41 0.38 0.19 2.29 0.11 -1.26 -1.49 120.40 118.21 3g0c s VAL 266 Ca 0.42 -0.14 0.11 0.00 -2.93 0.00 0.00 61.98 59.44 3g0c s VAL 266 Cb -0.10 -0.36 -0.04 0.00 -1.53 0.00 0.00 36.38 34.35 3g0c s VAL 266 CO 0.38 0.14 -0.23 -0.54 -3.33 0.00 0.00 175.10 171.51 3g0c s LYS 267 N 0.25 1.47 -0.02 1.54 1.02 -0.55 -4.98 119.74 118.47 3g0c s LYS 267 Ca -0.03 -1.51 0.06 0.00 0.02 0.00 0.00 55.97 54.52 3g0c s LYS 267 Cb -0.06 -1.75 -0.01 0.00 -0.52 0.00 0.00 37.83 35.48 3g0c s LYS 267 CO -0.00 0.37 -0.22 0.12 -0.92 0.00 0.00 175.35 174.71 3g0c s PHE 268 N -1.74 1.96 0.11 3.18 5.36 -1.26 -0.93 117.98 124.66 3g0c s PHE 268 Ca 0.20 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.78 3g0c s PHE 268 Cb -0.08 -1.27 -0.04 0.00 -0.34 0.00 0.00 43.02 41.29 3g0c s PHE 268 CO 0.09 -0.06 -0.07 -0.06 -1.46 0.00 0.00 175.22 173.66 3g0c s PHE 269 N -0.42 0.95 -0.02 10.12 0.40 0.22 -1.42 117.98 127.82 3g0c s PHE 269 Ca 0.06 -0.88 0.00 0.00 -0.60 0.00 0.00 56.93 55.51 3g0c s PHE 269 Cb -0.09 -0.54 0.03 0.00 0.51 0.00 0.00 43.02 42.93 3g0c s PHE 269 CO -0.00 -0.11 0.02 0.08 0.70 0.00 0.00 175.22 175.91 3g0c s VAL 270 N -3.53 0.02 -0.08 -0.44 1.01 -0.36 -0.57 120.40 116.44 3g0c s VAL 270 Ca 0.12 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.32 3g0c s VAL 270 Cb 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 36.29 3g0c s VAL 270 CO -0.04 0.11 -0.21 0.54 0.00 0.00 0.00 175.10 175.50 3g0c s VAL 271 N 1.04 1.78 -0.37 2.92 0.11 -0.53 -0.85 120.40 124.50 3g0c s VAL 271 Ca -0.09 -0.87 -0.29 0.00 -2.93 0.00 0.00 61.98 57.80 3g0c s VAL 271 Cb -0.13 -1.55 0.01 0.00 -1.53 0.00 0.00 36.38 33.19 3g0c s VAL 271 CO -0.03 0.50 1.26 0.21 -3.33 0.00 0.00 175.10 173.71 3g0c s ASN 272 N 0.30 6.62 0.00 3.54 3.84 -1.26 -0.39 114.94 127.58 3g0c s ASN 272 Ca -0.14 0.92 0.30 0.00 0.21 0.00 0.00 52.86 54.16 3g0c s ASN 272 Cb -0.16 -2.54 1.56 0.00 -0.55 0.00 0.00 41.25 39.55 3g0c s ASN 272 CO 0.06 -1.17 2.04 0.35 -2.79 0.00 0.00 177.10 175.59 3g0c n THR 273 N 6.51 0.00 0.09 -5.21 -2.24 0.59 -3.42 114.28 110.60 3g0c n THR 273 Ca 0.14 -0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.95 3g0c n THR 273 Cb 0.48 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.42 3g0c n THR 273 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3g0c h ASP 274 N 0.45 0.00 -0.64 3.42 3.45 -1.89 -3.35 116.42 117.86 3g0c h ASP 274 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3g0c h ASP 274 Cb 0.21 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.98 3g0c h ASP 274 CO 0.00 0.18 0.00 -1.54 -1.57 0.00 0.00 179.24 176.31 3g0c n SER 275 N -2.76 3.80 -4.78 6.45 3.41 -1.22 -4.96 113.62 113.55 3g0c n SER 275 Ca -0.03 -2.04 -0.41 0.00 -0.26 0.00 0.00 58.87 56.13 3g0c n SER 275 Cb 0.64 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 3g0c n SER 275 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3g0c s LEU 276 N -1.08 4.28 0.03 1.04 1.02 -1.25 -5.01 118.68 117.70 3g0c s LEU 276 Ca 0.44 3.01 0.02 0.00 0.02 0.00 0.00 54.13 57.62 3g0c s LEU 276 Cb 0.23 -3.72 -0.02 0.00 0.02 0.00 0.00 46.19 42.70 3g0c s LEU 276 CO 0.29 -0.93 -0.07 -0.94 0.02 0.00 0.00 176.35 174.72 3g0c s SER 277 N -0.24 0.84 0.00 2.29 1.04 -1.26 -5.02 113.70 111.35 3g0c s SER 277 Ca 0.54 -0.41 0.13 0.00 0.48 0.00 0.00 55.95 56.70 3g0c s SER 277 Cb -0.46 -0.00 0.80 0.00 0.10 0.00 0.00 66.02 66.46 3g0c s SER 277 CO 0.61 -0.11 1.48 -1.54 0.98 0.00 0.00 173.24 174.66 3g0c n SER 278 N 1.94 0.00 -0.12 7.02 3.41 -1.26 -3.51 113.62 121.10 3g0c n SER 278 Ca -0.19 -1.47 -0.20 0.00 -0.26 0.00 0.00 58.87 56.75 3g0c n SER 278 Cb 0.56 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.39 3g0c n SER 278 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3g0c n VAL 279 N -0.72 1.51 -4.32 -3.33 0.31 -1.26 -5.00 118.33 105.52 3g0c n VAL 279 Ca 0.10 -0.55 -0.27 0.00 -0.01 0.00 0.00 64.34 63.61 3g0c n VAL 279 Cb 0.05 -1.50 -0.10 0.00 -0.91 0.00 0.00 33.84 31.37 3g0c n VAL 279 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3g0c s THR 280 N -2.52 2.94 0.43 2.52 -4.23 -1.23 -5.11 115.64 108.44 3g0c s THR 280 Ca -0.35 -1.71 -0.25 0.00 -1.18 0.00 0.00 61.69 58.20 3g0c s THR 280 Cb 0.10 -2.43 -0.08 0.00 1.34 0.00 0.00 72.50 71.42 3g0c s THR 280 CO 0.60 -0.07 1.33 0.20 -0.54 0.00 0.00 174.62 176.14 3g0c s ASN 281 N -2.67 6.14 0.45 3.99 0.01 -1.26 -4.44 114.94 117.17 3g0c s ASN 281 Ca 0.23 2.72 -0.24 0.00 -0.71 0.00 0.00 52.86 54.86 3g0c s ASN 281 Cb -0.09 -2.64 -0.07 0.00 0.41 0.00 0.00 41.25 38.86 3g0c s ASN 281 CO 0.13 -0.97 1.21 0.00 -1.51 0.00 0.00 177.10 175.96 3g0c s ALA 282 N -1.26 3.03 -0.23 0.60 0.00 -1.26 -4.98 121.76 117.67 3g0c s ALA 282 Ca 0.59 1.04 -0.10 0.00 0.00 0.00 0.00 51.96 53.49 3g0c s ALA 282 Cb -0.39 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.25 3g0c s ALA 282 CO 0.50 -0.76 0.15 -0.08 0.00 0.00 0.00 175.76 175.57 3g0c s THR 283 N -1.44 5.34 -0.22 0.00 -1.32 -1.26 -5.02 115.64 111.71 3g0c s THR 283 Ca 0.62 0.17 -0.05 0.00 -1.21 0.00 0.00 61.69 61.23 3g0c s THR 283 Cb -0.32 -3.47 -0.01 0.00 -1.51 0.00 0.00 72.50 67.18 3g0c s THR 283 CO 0.39 0.38 -0.01 -0.44 -2.21 0.00 0.00 174.62 172.73 3g0c s SER 284 N 0.83 4.54 -0.21 8.08 0.01 -1.26 -4.48 113.70 121.20 3g0c s SER 284 Ca 0.07 -0.32 -0.25 0.00 1.31 0.00 0.00 55.95 56.76 3g0c s SER 284 Cb -0.13 -1.79 -0.01 0.00 0.21 0.00 0.00 66.02 64.31 3g0c s SER 284 CO 0.02 -0.01 0.86 -0.63 0.41 0.00 0.00 173.24 173.90 3g0c s ILE 285 N 1.42 4.83 0.24 1.44 -1.09 -0.03 -4.84 121.20 123.17 3g0c s ILE 285 Ca 0.05 1.66 -0.30 0.00 -2.23 0.00 0.00 60.65 59.83 3g0c s ILE 285 Cb -0.14 -4.15 -0.09 0.00 -1.58 0.00 0.00 42.46 36.50 3g0c s ILE 285 CO -0.01 -0.05 1.01 -1.58 -1.23 0.00 0.00 174.94 173.08 3g0c s GLN 286 N 2.63 4.75 -0.25 2.79 0.74 -1.26 -1.23 119.66 127.83 3g0c s GLN 286 Ca 0.37 1.61 -0.01 0.00 0.05 0.00 0.00 55.36 57.38 3g0c s GLN 286 Cb -0.16 -3.26 0.03 0.00 1.10 0.00 0.00 33.01 30.73 3g0c s GLN 286 CO 0.09 0.36 -0.07 0.42 -0.55 0.00 0.00 175.29 175.54 3g0c s ILE 287 N -1.01 2.75 0.34 -2.34 1.01 -0.50 -4.84 121.20 116.61 3g0c s ILE 287 Ca 0.43 -1.12 -0.13 0.00 0.00 0.00 0.00 60.65 59.83 3g0c s ILE 287 Cb -0.28 -2.43 -0.08 0.00 0.01 0.00 0.00 42.46 39.68 3g0c s ILE 287 CO 0.35 0.16 0.74 0.42 0.00 0.00 0.00 174.94 176.61 3g0c s THR 288 N 1.29 4.73 0.72 2.92 -4.23 -1.26 -4.11 115.64 115.70 3g0c s THR 288 Ca -0.01 0.82 -0.14 0.00 -1.18 0.00 0.00 61.69 61.17 3g0c s THR 288 Cb -0.17 -3.65 0.03 0.00 1.34 0.00 0.00 72.50 70.06 3g0c s THR 288 CO -0.05 -0.28 1.17 0.00 -0.54 0.00 0.00 174.62 174.92 3g0c s ALA 289 N -2.10 2.19 0.95 3.99 0.00 -1.26 -5.00 121.76 120.54 3g0c s ALA 289 Ca 0.53 0.73 -0.11 0.00 0.00 0.00 0.00 51.96 53.11 3g0c s ALA 289 Cb -0.10 -3.41 0.13 0.00 0.00 0.00 0.00 23.12 19.74 3g0c s ALA 289 CO 0.22 -1.73 0.94 -0.35 0.00 0.00 0.00 175.76 174.83 3g0c n PRO 290 N -2.75 -0.58 -0.23 0.00 -0.04 -1.26 -4.75 135.00 125.39 3g0c n PRO 290 Ca 0.12 -0.11 0.01 0.00 -0.04 0.00 0.00 63.50 63.48 3g0c n PRO 290 Cb 0.51 -2.22 0.13 0.00 -0.04 0.00 0.00 33.50 31.87 3g0c n PRO 290 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3g0c h ALA 291 N -1.88 0.91 0.00 0.55 0.00 -1.99 -1.76 119.26 115.08 3g0c h ALA 291 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3g0c h ALA 291 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3g0c h ALA 291 CO 0.40 -0.12 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 3g0c n SER 292 N -4.93 0.00 -0.09 0.00 3.41 -1.26 -2.31 113.62 108.45 3g0c n SER 292 Ca 0.10 0.26 -0.11 0.00 -0.26 0.00 0.00 58.87 58.86 3g0c n SER 292 Cb 0.29 -0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 63.82 3g0c n SER 292 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3g0c n MET 293 N -1.32 0.88 0.00 4.33 2.00 -0.68 -4.43 117.12 117.90 3g0c n MET 293 Ca 0.02 0.07 0.06 0.00 0.00 0.00 0.00 57.70 57.85 3g0c n MET 293 Cb 0.04 -1.37 0.30 0.00 0.00 0.00 0.00 33.22 32.19 3g0c n MET 293 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3g0c n LEU 294 N -2.87 0.00 0.21 4.03 4.77 -0.98 -2.84 117.00 119.33 3g0c n LEU 294 Ca -0.30 0.23 0.11 0.00 -0.03 0.00 0.00 56.01 56.02 3g0c n LEU 294 Cb 0.90 -0.23 0.26 0.00 -2.33 0.00 0.00 43.42 42.01 3g0c n LEU 294 CO 0.23 -0.14 0.77 -0.29 -1.33 0.00 0.00 177.39 176.63 3g0c h ILE 295 N 0.00 0.25 -1.41 -0.08 6.09 -1.76 -3.47 117.51 117.13 3g0c h ILE 295 Ca 0.00 -1.19 0.00 0.00 -1.37 0.00 0.00 64.86 62.30 3g0c h ILE 295 Cb 0.09 1.98 0.00 0.00 0.47 0.00 0.00 36.82 39.36 3g0c h ILE 295 CO 0.00 0.13 0.00 0.61 -3.07 0.00 0.00 178.15 175.82 3g0c n GLY 296 N 0.83 2.53 3.72 8.18 0.00 -1.13 -5.13 105.19 114.19 3g0c n GLY 296 Ca 0.03 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 3g0c n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g0c s ASP 297 N 0.69 6.57 0.29 1.61 1.01 -1.26 -4.96 116.67 120.63 3g0c s ASP 297 Ca 0.00 2.67 0.05 0.00 0.71 0.00 0.00 52.55 55.97 3g0c s ASP 297 Cb 0.00 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.30 3g0c s ASP 297 CO 0.00 -0.82 0.24 -1.38 0.21 0.00 0.00 175.17 173.42 3g0c s HIS 298 N 0.89 1.57 0.10 4.23 -3.43 -1.26 -0.55 115.29 116.84 3g0c s HIS 298 Ca 0.68 -1.58 0.05 0.00 -0.80 0.00 0.00 55.06 53.41 3g0c s HIS 298 Cb -0.44 -0.66 -0.04 0.00 -1.43 0.00 0.00 32.58 30.01 3g0c s HIS 298 CO 0.34 -0.81 -0.12 0.71 -2.00 0.00 0.00 174.74 172.86 3g0c s TYR 299 N -3.65 1.19 -0.37 0.38 2.02 0.27 -4.81 117.35 112.39 3g0c s TYR 299 Ca 0.40 -0.61 -0.19 0.00 -0.37 0.00 0.00 57.07 56.31 3g0c s TYR 299 Cb 0.04 -0.64 0.00 0.00 -0.40 0.00 0.00 41.96 40.96 3g0c s TYR 299 CO 0.23 0.06 0.54 -1.17 -1.57 0.00 0.00 175.55 173.64 3g0c s LEU 300 N -2.41 4.41 -0.00 -1.29 2.96 -1.26 -0.89 118.68 120.19 3g0c s LEU 300 Ca 0.06 -0.11 0.11 0.00 -0.22 0.00 0.00 54.13 53.97 3g0c s LEU 300 Cb -0.04 -2.61 -0.13 0.00 0.50 0.00 0.00 46.19 43.91 3g0c s LEU 300 CO 0.01 -0.55 0.41 0.00 -1.32 0.00 0.00 176.35 174.90 3g0c s ASP 302 N -2.27 -0.69 -0.08 0.00 -1.08 -1.08 -4.91 116.67 106.57 3g0c s ASP 302 Ca 0.02 1.28 0.00 0.00 -0.52 0.00 0.00 52.55 53.33 3g0c s ASP 302 Cb 0.08 1.29 0.02 0.00 -1.46 0.00 0.00 42.92 42.86 3g0c s ASP 302 CO 0.44 -0.22 -0.05 -0.69 0.52 0.00 0.00 175.17 175.18 3g0c s VAL 303 N 0.58 0.73 -0.22 1.11 1.01 -1.26 -0.64 120.40 121.71 3g0c s VAL 303 Ca -0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.78 3g0c s VAL 303 Cb -0.05 -0.78 0.10 0.00 0.00 0.00 0.00 36.38 35.65 3g0c s VAL 303 CO -0.05 0.30 0.23 -0.89 0.00 0.00 0.00 175.10 174.69 3g0c s THR 304 N 1.45 -0.32 0.31 3.92 2.01 -0.41 -5.02 115.64 117.58 3g0c s THR 304 Ca -0.02 -0.18 -0.29 0.00 0.31 0.00 0.00 61.69 61.51 3g0c s THR 304 Cb -0.13 -0.72 -0.12 0.00 0.01 0.00 0.00 72.50 71.53 3g0c s THR 304 CO -0.04 -0.25 1.44 0.79 -0.69 0.00 0.00 174.62 175.87 3g0c n TRP 305 N 5.32 2.58 -0.09 4.92 7.02 -1.26 -0.79 117.44 135.13 3g0c n TRP 305 Ca -0.05 0.42 -0.10 0.00 -1.02 0.00 0.00 57.50 56.75 3g0c n TRP 305 Cb 0.49 -2.50 -0.12 0.00 -2.42 0.00 0.00 31.31 26.75 3g0c n TRP 305 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3g0c n ALA 306 N 1.19 1.57 -3.21 6.99 0.00 0.30 -4.86 120.51 122.50 3g0c n ALA 306 Ca 0.06 -1.07 -0.01 0.00 0.00 0.00 0.00 53.44 52.42 3g0c n ALA 306 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3g0c n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3g0c n THR 307 N -2.75 0.00 0.02 0.00 -2.24 -0.94 -4.30 114.28 104.07 3g0c n THR 307 Ca -0.30 -0.30 0.19 0.00 -2.27 0.00 0.00 64.05 61.37 3g0c n THR 307 Cb 1.01 0.25 0.69 0.00 -2.10 0.00 0.00 70.33 70.18 3g0c n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3g0c h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.97 -3.17 115.11 110.27 3g0c h GLN 308 Ca -0.08 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.07 3g0c h GLN 308 Cb 0.30 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 27.62 3g0c h GLN 308 CO 0.10 0.00 -0.54 0.39 -0.95 0.00 0.00 178.83 177.83 3g0c n GLU 309 N -4.38 0.71 -3.69 1.46 1.02 -1.26 -4.84 120.64 109.67 3g0c n GLU 309 Ca 0.09 -2.25 -0.15 0.00 -0.02 0.00 0.00 57.16 54.83 3g0c n GLU 309 Cb 0.57 -0.89 -0.15 0.00 -0.02 0.00 0.00 31.44 30.96 3g0c n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3g0c s ARG 310 N -1.51 0.09 0.05 3.49 3.52 -1.20 -1.81 118.95 121.58 3g0c s ARG 310 Ca 0.27 0.58 0.08 0.00 -0.13 0.00 0.00 55.73 56.53 3g0c s ARG 310 Cb 0.27 -0.18 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 3g0c s ARG 310 CO -0.06 -0.26 -0.23 -1.50 -0.81 0.00 0.00 175.30 172.44 3g0c s ILE 311 N 2.03 1.88 -0.09 4.11 2.07 -0.55 0.11 121.20 130.76 3g0c s ILE 311 Ca -0.01 -1.29 0.02 0.00 -1.41 0.00 0.00 60.65 57.96 3g0c s ILE 311 Cb -0.12 -1.62 -0.02 0.00 0.13 0.00 0.00 42.46 40.83 3g0c s ILE 311 CO -0.07 0.27 -0.15 -0.94 -1.91 0.00 0.00 174.94 172.14 3g0c s SER 312 N -1.22 3.90 0.03 4.50 1.04 0.03 -0.94 113.70 121.04 3g0c s SER 312 Ca 0.09 -0.30 0.05 0.00 0.48 0.00 0.00 55.95 56.28 3g0c s SER 312 Cb -0.09 -1.21 -0.03 0.00 0.10 0.00 0.00 66.02 64.78 3g0c s SER 312 CO 0.02 0.25 -0.11 -0.76 0.98 0.00 0.00 173.24 173.61 3g0c s LEU 313 N -0.15 2.94 -0.08 2.42 1.02 0.76 -1.29 118.68 124.30 3g0c s LEU 313 Ca -0.01 -0.29 0.02 0.00 0.02 0.00 0.00 54.13 53.87 3g0c s LEU 313 Cb -0.14 -1.72 0.01 0.00 0.02 0.00 0.00 46.19 44.37 3g0c s LEU 313 CO 0.03 0.25 -0.15 -1.10 0.02 0.00 0.00 176.35 175.41 3g0c s GLN 314 N -1.56 2.03 0.17 1.70 -0.21 0.19 -0.38 119.66 121.59 3g0c s GLN 314 Ca 0.17 -0.51 0.11 0.00 0.02 0.00 0.00 55.36 55.14 3g0c s GLN 314 Cb -0.11 -1.67 -0.04 0.00 1.00 0.00 0.00 33.01 32.19 3g0c s GLN 314 CO 0.08 0.01 -0.22 -1.58 -2.12 0.00 0.00 175.29 171.46 3g0c s TRP 315 N 0.74 2.38 -0.02 0.91 0.52 -0.32 -0.55 118.94 122.60 3g0c s TRP 315 Ca -0.12 -0.33 0.02 0.00 0.02 0.00 0.00 56.10 55.68 3g0c s TRP 315 Cb -0.16 -1.21 0.00 0.00 -1.15 0.00 0.00 33.47 30.96 3g0c s TRP 315 CO 0.03 0.45 -0.08 -1.17 0.02 0.00 0.00 176.95 176.20 3g0c s LEU 316 N -2.49 1.75 0.56 2.99 0.20 -0.07 -1.37 118.68 120.26 3g0c s LEU 316 Ca 0.19 -0.16 -0.18 0.00 0.69 0.00 0.00 54.13 54.68 3g0c s LEU 316 Cb -0.09 -0.48 -0.05 0.00 -0.43 0.00 0.00 46.19 45.15 3g0c s LEU 316 CO 0.10 0.05 1.09 -0.13 -0.29 0.00 0.00 176.35 177.16 3g0c s ARG 317 N 0.25 3.35 0.33 1.98 0.52 -0.88 0.95 118.95 125.44 3g0c s ARG 317 Ca -0.03 1.41 0.04 0.00 -0.52 0.00 0.00 55.73 56.62 3g0c s ARG 317 Cb -0.08 -2.02 0.64 0.00 0.52 0.00 0.00 34.95 34.00 3g0c s ARG 317 CO 0.00 -0.81 1.91 -0.09 0.02 0.00 0.00 175.30 176.33 3g0c h ARG 318 N 0.88 0.87 -6.37 3.54 2.43 -1.14 -2.97 114.38 111.62 3g0c h ARG 318 Ca -0.48 -0.05 -0.54 0.00 -0.81 0.00 0.00 59.98 58.09 3g0c h ARG 318 Cb 1.24 -0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 30.52 3g0c h ARG 318 CO 0.57 0.58 1.08 0.42 -1.51 0.00 0.00 179.97 181.10 3g0c s ILE 319 N -5.81 3.74 0.00 1.20 1.01 -1.26 -4.78 121.20 115.30 3g0c s ILE 319 Ca -0.11 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.03 3g0c s ILE 319 Cb 0.20 -4.76 0.00 0.00 0.01 0.00 0.00 42.46 37.91 3g0c s ILE 319 CO 0.79 -1.64 1.28 0.00 0.00 0.00 0.00 174.94 175.37 3g0c n GLN 320 N 9.16 0.80 -0.07 2.79 6.02 -1.12 -3.83 117.38 131.11 3g0c n GLN 320 Ca 0.06 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.15 3g0c n GLN 320 Cb 0.49 -1.10 0.13 0.00 1.02 0.00 0.00 30.24 30.78 3g0c n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3g0c n ASN 321 N 1.21 2.91 -3.67 1.08 0.23 -1.26 -1.74 115.26 114.02 3g0c n ASN 321 Ca 0.00 -1.88 -0.21 0.00 -0.53 0.00 0.00 54.58 51.96 3g0c n ASN 321 Cb 0.40 -0.10 -0.18 0.00 -2.08 0.00 0.00 39.78 37.82 3g0c n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 3g0c s TYR 322 N -1.52 0.13 0.11 -2.53 5.04 -1.25 -1.75 117.35 115.58 3g0c s TYR 322 Ca 0.28 0.11 0.06 0.00 -2.44 0.00 0.00 57.07 55.08 3g0c s TYR 322 Cb 0.18 -0.55 -0.04 0.00 0.35 0.00 0.00 41.96 41.91 3g0c s TYR 322 CO 0.26 -0.27 -0.16 -1.54 -1.34 0.00 0.00 175.55 172.51 3g0c s SER 323 N 2.15 2.08 -0.09 4.32 1.04 0.57 -2.06 113.70 121.71 3g0c s SER 323 Ca 0.04 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.72 3g0c s SER 323 Cb -0.13 -0.08 0.02 0.00 0.10 0.00 0.00 66.02 65.93 3g0c s SER 323 CO -0.04 -0.09 -0.07 -0.69 0.98 0.00 0.00 173.24 173.33 3g0c s VAL 324 N -1.80 0.86 -0.20 5.02 1.01 -0.47 -1.03 120.40 123.79 3g0c s VAL 324 Ca 0.07 -0.22 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 3g0c s VAL 324 Cb -0.07 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 3g0c s VAL 324 CO 0.03 0.33 0.47 -0.32 0.00 0.00 0.00 175.10 175.61 3g0c s MET 325 N 1.45 4.17 -0.14 2.72 1.75 0.21 -1.17 119.30 128.30 3g0c s MET 325 Ca -0.01 0.31 -0.05 0.00 -1.25 0.00 0.00 55.69 54.69 3g0c s MET 325 Cb -0.13 -3.56 -0.04 0.00 2.84 0.00 0.00 34.83 33.94 3g0c s MET 325 CO -0.04 -0.11 0.04 -0.51 -0.65 0.00 0.00 175.02 173.74 3g0c s ASP 326 N 1.14 5.49 -0.26 1.11 -0.00 0.49 -0.32 116.67 124.33 3g0c s ASP 326 Ca 0.22 0.12 -0.02 0.00 -0.00 0.00 0.00 52.55 52.87 3g0c s ASP 326 Cb -0.15 -1.80 0.03 0.00 -0.00 0.00 0.00 42.92 40.99 3g0c s ASP 326 CO 0.09 0.26 -0.05 -0.63 -0.00 0.00 0.00 175.17 174.85 3g0c s ILE 327 N -0.18 2.95 -0.05 0.77 1.01 -1.26 -0.17 121.20 124.26 3g0c s ILE 327 Ca 0.07 -1.04 0.04 0.00 0.00 0.00 0.00 60.65 59.72 3g0c s ILE 327 Cb -0.12 -2.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3g0c s ILE 327 CO 0.02 0.16 -0.17 0.00 0.00 0.00 0.00 174.94 174.95 3g0c s ASP 329 N -0.63 3.58 0.25 0.00 1.11 -0.48 -1.48 116.67 119.02 3g0c s ASP 329 Ca 0.09 -0.35 -0.30 0.00 0.18 0.00 0.00 52.55 52.18 3g0c s ASP 329 Cb -0.11 -0.59 -0.09 0.00 1.07 0.00 0.00 42.92 43.20 3g0c s ASP 329 CO 0.01 0.32 1.16 -0.47 1.18 0.00 0.00 175.17 177.36 3g0c s TYR 330 N -0.72 3.47 -0.25 4.23 5.04 -0.75 -0.85 117.35 127.51 3g0c s TYR 330 Ca 0.11 1.57 -0.07 0.00 -2.44 0.00 0.00 57.07 56.25 3g0c s TYR 330 Cb -0.10 -3.38 -0.02 0.00 0.35 0.00 0.00 41.96 38.81 3g0c s TYR 330 CO 0.01 -0.93 0.06 0.34 -1.34 0.00 0.00 175.55 173.69 3g0c s ASP 331 N -0.47 5.00 0.12 4.32 -1.08 -0.29 -4.94 116.67 119.33 3g0c s ASP 331 Ca 0.48 -0.33 -0.25 0.00 -0.52 0.00 0.00 52.55 51.93 3g0c s ASP 331 Cb -0.33 -1.89 -0.05 0.00 -1.46 0.00 0.00 42.92 39.19 3g0c s ASP 331 CO 0.41 -0.06 1.65 -0.33 0.52 0.00 0.00 175.17 177.35 3g0c h GLU 332 N 8.22 -0.35 0.00 4.34 5.08 -1.96 0.14 114.58 130.05 3g0c h GLU 332 Ca -0.38 0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 57.93 3g0c h GLU 332 Cb 1.16 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 3g0c h GLU 332 CO 0.59 -0.23 -0.39 0.66 -1.00 0.00 0.00 179.01 178.63 3g0c h SER 333 N -0.36 0.00 0.00 1.42 4.64 -1.97 -3.31 113.55 113.97 3g0c h SER 333 Ca 0.06 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.28 3g0c h SER 333 Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 3g0c h SER 333 CO -0.21 0.39 -0.61 0.28 -0.87 0.00 0.00 176.83 175.82 3g0c h SER 334 N 0.00 0.00 0.00 4.97 0.02 -1.94 -3.48 113.55 113.12 3g0c h SER 334 Ca -0.00 -0.60 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 3g0c h SER 334 Cb 0.93 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.47 3g0c h SER 334 CO 0.05 1.16 0.00 0.61 -1.14 0.00 0.00 176.83 177.51 3g0c n GLY 335 N 1.55 0.77 3.61 -3.77 0.00 0.46 -5.07 105.19 102.73 3g0c n GLY 335 Ca -0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 3g0c n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g0c s ARG 336 N -0.54 2.12 -0.08 1.61 0.52 -1.25 -4.90 118.95 116.44 3g0c s ARG 336 Ca 0.00 -1.56 -0.04 0.00 -0.52 0.00 0.00 55.73 53.61 3g0c s ARG 336 Cb 0.00 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 33.40 3g0c s ARG 336 CO 0.00 0.30 0.09 -1.58 0.02 0.00 0.00 175.30 174.14 3g0c s TRP 337 N -2.41 3.41 -0.08 -0.53 0.52 -1.26 -1.14 118.94 117.44 3g0c s TRP 337 Ca 0.32 0.35 0.01 0.00 0.02 0.00 0.00 56.10 56.80 3g0c s TRP 337 Cb -0.05 -1.85 0.02 0.00 -1.15 0.00 0.00 33.47 30.45 3g0c s TRP 337 CO 0.19 0.62 -0.10 1.21 0.02 0.00 0.00 176.95 178.89 3g0c s ASN 338 N -1.22 1.89 -0.70 2.95 3.84 -0.03 -4.93 114.94 116.73 3g0c s ASN 338 Ca 0.17 -0.29 -0.09 0.00 0.21 0.00 0.00 52.86 52.87 3g0c s ASN 338 Cb -0.12 -0.80 0.18 0.00 -0.55 0.00 0.00 41.25 39.96 3g0c s ASN 338 CO 0.07 -0.04 0.58 0.00 -2.79 0.00 0.00 177.10 174.92 3g0c n LEU 340 N 3.91 2.83 0.26 0.00 4.32 -1.25 -4.88 117.00 122.19 3g0c n LEU 340 Ca 0.08 1.12 0.14 0.00 -0.02 0.00 0.00 56.01 57.34 3g0c n LEU 340 Cb 0.42 -1.39 0.68 0.00 -1.62 0.00 0.00 43.42 41.52 3g0c n LEU 340 CO 0.35 -0.56 0.95 0.58 -1.22 0.00 0.00 177.39 177.48 3g0c h VAL 341 N 3.18 0.36 0.00 4.08 2.07 -1.96 -1.93 116.25 122.04 3g0c h VAL 341 Ca -0.45 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.41 3g0c h VAL 341 Cb 1.28 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 3g0c h VAL 341 CO 0.79 0.11 0.00 0.00 0.02 0.00 0.00 177.57 178.48 3g0c h ALA 342 N 1.89 1.00 -0.31 1.67 0.00 -1.96 -2.87 119.26 118.68 3g0c h ALA 342 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g0c h ALA 342 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3g0c h ALA 342 CO 0.01 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.80 3g0c n ARG 343 N -2.73 2.41 -2.57 0.00 1.74 -0.73 -4.71 116.66 110.08 3g0c n ARG 343 Ca 0.02 -2.12 -0.41 0.00 -0.77 0.00 0.00 57.85 54.57 3g0c n ARG 343 Cb 0.29 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.19 3g0c n ARG 343 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3g0c s GLN 344 N -1.61 4.65 -0.14 5.56 0.74 -1.08 -4.30 119.66 123.47 3g0c s GLN 344 Ca 0.37 1.66 0.02 0.00 0.05 0.00 0.00 55.36 57.46 3g0c s GLN 344 Cb 0.22 -3.28 0.01 0.00 1.10 0.00 0.00 33.01 31.06 3g0c s GLN 344 CO 0.31 0.17 -0.20 -1.01 -0.55 0.00 0.00 175.29 174.01 3g0c s HIS 345 N -0.46 2.52 -0.07 1.67 3.76 0.57 -4.96 115.29 118.32 3g0c s HIS 345 Ca 0.47 -1.28 -0.12 0.00 -0.15 0.00 0.00 55.06 53.98 3g0c s HIS 345 Cb -0.28 -1.74 -0.05 0.00 1.11 0.00 0.00 32.58 31.62 3g0c s HIS 345 CO 0.35 -0.60 0.30 0.42 -0.85 0.00 0.00 174.74 174.35 3g0c s ILE 346 N 0.90 5.24 -0.03 0.60 1.01 -1.26 0.66 121.20 128.32 3g0c s ILE 346 Ca -0.06 0.58 0.00 0.00 0.00 0.00 0.00 60.65 61.17 3g0c s ILE 346 Cb -0.15 -3.59 0.03 0.00 0.01 0.00 0.00 42.46 38.75 3g0c s ILE 346 CO -0.03 0.56 0.01 -0.70 0.00 0.00 0.00 174.94 174.78 3g0c s GLU 347 N -0.81 0.24 0.30 2.79 2.12 -0.20 -4.98 118.70 118.16 3g0c s GLU 347 Ca 0.20 0.11 -0.04 0.00 0.36 0.00 0.00 54.97 55.59 3g0c s GLU 347 Cb -0.14 -0.46 -0.01 0.00 0.26 0.00 0.00 34.13 33.78 3g0c s GLU 347 CO 0.09 -0.15 0.42 0.00 -0.54 0.00 0.00 175.26 175.08 3g0c s MET 348 N 1.10 1.73 -0.08 4.30 0.23 -1.26 -0.32 119.30 125.00 3g0c s MET 348 Ca -0.09 -1.64 -0.06 0.00 -1.03 0.00 0.00 55.69 52.87 3g0c s MET 348 Cb -0.13 0.42 0.03 0.00 -1.53 0.00 0.00 34.83 33.62 3g0c s MET 348 CO -0.02 -0.70 0.21 0.45 -2.03 0.00 0.00 175.02 172.93 3g0c s SER 349 N -3.18 -0.22 0.12 -1.18 0.15 -0.72 -4.95 113.70 103.73 3g0c s SER 349 Ca 0.30 0.44 0.23 0.00 0.70 0.00 0.00 55.95 57.62 3g0c s SER 349 Cb 0.01 0.40 -0.01 0.00 -1.71 0.00 0.00 66.02 64.70 3g0c s SER 349 CO 0.17 -0.11 0.97 0.35 1.20 0.00 0.00 173.24 175.83 3g0c n THR 350 N 3.45 0.40 0.61 6.45 -2.24 -1.26 -4.39 114.28 117.29 3g0c n THR 350 Ca -0.18 -0.45 0.07 0.00 -2.27 0.00 0.00 64.05 61.23 3g0c n THR 350 Cb 0.56 -0.15 0.03 0.00 -2.10 0.00 0.00 70.33 68.68 3g0c n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3g0c n THR 351 N -2.40 0.00 0.00 4.28 -2.24 -1.26 -5.07 114.28 107.59 3g0c n THR 351 Ca 0.00 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3g0c n THR 351 Cb 0.52 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.99 3g0c n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g0c n GLY 352 N 0.93 -0.89 3.96 3.38 0.00 -1.26 -4.83 105.19 106.48 3g0c n GLY 352 Ca 0.07 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 3g0c n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3g0c s TRP 353 N -4.00 2.16 -0.22 1.61 -2.14 -1.26 -4.58 118.94 110.51 3g0c s TRP 353 Ca 0.00 0.07 -0.11 0.00 2.66 0.00 0.00 56.10 58.72 3g0c s TRP 353 Cb 0.00 -3.21 -0.05 0.00 -3.10 0.00 0.00 33.47 27.11 3g0c s TRP 353 CO 0.00 -1.66 0.18 0.54 -2.66 0.00 0.00 176.95 173.35 3g0c s VAL 354 N -3.25 5.36 0.05 -0.66 0.11 -0.71 -4.74 120.40 116.56 3g0c s VAL 354 Ca 0.64 0.25 0.00 0.00 -2.93 0.00 0.00 61.98 59.94 3g0c s VAL 354 Cb -0.07 -3.52 0.00 0.00 -1.53 0.00 0.00 36.38 31.26 3g0c s VAL 354 CO 0.45 0.37 0.00 0.61 -3.33 0.00 0.00 175.10 173.20 3g0c n GLY 355 N 3.96 -1.94 0.07 6.54 0.00 -1.26 -3.32 105.19 109.24 3g0c n GLY 355 Ca -0.15 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 3g0c n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3g0c h ARG 356 N -0.13 -0.06 0.00 1.61 3.08 -1.94 -3.39 114.38 113.55 3g0c h ARG 356 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g0c h ARG 356 Cb 0.13 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3g0c h ARG 356 CO 0.00 0.14 -0.02 1.19 -1.07 0.00 0.00 179.97 180.22 3g0c n PHE 357 N -5.03 0.00 -3.60 3.04 3.72 -1.26 -4.91 117.46 109.43 3g0c n PHE 357 Ca -0.08 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.29 3g0c n PHE 357 Cb 0.13 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.66 3g0c n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3g0c s ARG 358 N -0.46 0.35 0.62 -1.08 1.70 -1.25 -5.01 118.95 113.82 3g0c s ARG 358 Ca 0.00 -0.14 -0.18 0.00 -0.47 0.00 0.00 55.73 54.94 3g0c s ARG 358 Cb 0.00 0.15 -0.05 0.00 -0.57 0.00 0.00 34.95 34.48 3g0c s ARG 358 CO 0.00 -0.15 0.82 -2.30 -1.08 0.00 0.00 175.30 172.59 3g0c n PRO 359 N -0.16 0.70 -1.82 3.89 -0.02 -1.21 -4.30 135.00 132.08 3g0c n PRO 359 Ca -0.01 0.28 -0.32 0.00 -2.02 0.00 0.00 63.50 61.43 3g0c n PRO 359 Cb 0.59 -2.03 0.03 0.00 -0.02 0.00 0.00 33.50 32.07 3g0c n PRO 359 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3g0c s SER 360 N -1.30 5.63 0.19 2.55 0.15 -1.26 -4.97 113.70 114.69 3g0c s SER 360 Ca 0.74 1.69 -0.13 0.00 0.70 0.00 0.00 55.95 58.94 3g0c s SER 360 Cb -0.41 -2.51 -0.07 0.00 -1.71 0.00 0.00 66.02 61.32 3g0c s SER 360 CO 0.49 -1.27 0.58 -1.83 1.20 0.00 0.00 173.24 172.41 3g0c s GLU 361 N -4.60 3.95 0.37 5.44 1.03 -1.26 -4.91 118.70 118.72 3g0c s GLU 361 Ca 0.60 0.47 -0.17 0.00 0.03 0.00 0.00 54.97 55.91 3g0c s GLU 361 Cb -0.14 -2.81 -0.09 0.00 -0.80 0.00 0.00 34.13 30.28 3g0c s GLU 361 CO 0.46 0.41 0.81 -1.25 -1.33 0.00 0.00 175.26 174.36 3g0c s PRO 362 N -2.26 4.06 -0.23 -4.83 0.04 -1.26 -4.56 135.00 125.95 3g0c s PRO 362 Ca 0.42 0.81 0.01 0.00 0.04 0.00 0.00 61.00 62.28 3g0c s PRO 362 Cb -0.14 -2.34 0.04 0.00 0.04 0.00 0.00 34.50 32.10 3g0c s PRO 362 CO 0.20 0.07 -0.12 -1.01 0.04 0.00 0.00 177.00 176.18 3g0c s HIS 363 N -2.09 3.07 0.24 0.56 3.76 0.58 -4.95 115.29 116.46 3g0c s HIS 363 Ca 0.57 -1.92 -0.16 0.00 -0.15 0.00 0.00 55.06 53.40 3g0c s HIS 363 Cb -0.10 -1.96 -0.08 0.00 1.11 0.00 0.00 32.58 31.55 3g0c s HIS 363 CO 0.17 -0.82 0.66 -0.06 -0.85 0.00 0.00 174.74 173.85 3g0c s PHE 364 N 1.22 3.52 0.65 1.40 0.40 -1.26 -0.71 117.98 123.21 3g0c s PHE 364 Ca -0.02 1.19 -0.15 0.00 -0.60 0.00 0.00 56.93 57.35 3g0c s PHE 364 Cb -0.17 -2.49 -0.00 0.00 0.51 0.00 0.00 43.02 40.87 3g0c s PHE 364 CO -0.07 0.27 1.10 0.95 0.70 0.00 0.00 175.22 178.18 3g0c s THR 365 N -1.69 3.32 0.28 0.64 -4.23 -0.80 -4.88 115.64 108.27 3g0c s THR 365 Ca 0.46 0.61 -0.06 0.00 -1.18 0.00 0.00 61.69 61.52 3g0c s THR 365 Cb -0.14 -3.13 0.43 0.00 1.34 0.00 0.00 72.50 71.01 3g0c s THR 365 CO 0.19 -0.38 1.57 0.25 -0.54 0.00 0.00 174.62 175.71 3g0c h LEU 366 N 0.04 -0.79 0.00 4.79 5.85 -1.92 0.69 115.31 123.98 3g0c h LEU 366 Ca -0.47 0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.54 3g0c h LEU 366 Cb 1.24 0.57 0.00 0.00 0.37 0.00 0.00 40.66 42.84 3g0c h LEU 366 CO 0.54 -0.33 0.00 -0.90 -0.34 0.00 0.00 178.44 177.42 3g0c n ASP 367 N -5.58 0.00 -2.06 1.25 3.85 -1.26 -4.86 116.55 107.90 3g0c n ASP 367 Ca 0.17 -1.45 -0.13 0.00 -0.71 0.00 0.00 54.79 52.68 3g0c n ASP 367 Cb 0.55 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.30 3g0c n ASP 367 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3g0c n GLY 368 N 0.48 0.11 0.02 6.12 0.00 0.24 -4.81 105.19 107.36 3g0c n GLY 368 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.20 3g0c n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g0c n ASN 369 N -1.32 0.56 -4.13 1.61 3.02 -1.26 -4.95 115.26 108.79 3g0c n ASN 369 Ca -0.14 -0.38 -0.10 0.00 -0.03 0.00 0.00 54.58 53.92 3g0c n ASN 369 Cb 0.54 1.19 -0.09 0.00 -0.61 0.00 0.00 39.78 40.81 3g0c n ASN 369 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3g0c s SER 370 N -3.83 0.18 0.07 6.41 0.01 -1.26 -1.45 113.70 113.82 3g0c s SER 370 Ca 0.02 -1.20 -0.24 0.00 1.31 0.00 0.00 55.95 55.84 3g0c s SER 370 Cb 0.15 0.37 0.06 0.00 0.21 0.00 0.00 66.02 66.81 3g0c s SER 370 CO 0.85 -0.83 0.56 0.72 0.41 0.00 0.00 173.24 174.96 3g0c s PHE 371 N -4.07 -0.48 -0.07 2.43 -0.12 -0.18 -1.91 117.98 113.57 3g0c s PHE 371 Ca 0.28 0.50 0.02 0.00 -0.05 0.00 0.00 56.93 57.68 3g0c s PHE 371 Cb 0.06 0.41 -0.03 0.00 -0.63 0.00 0.00 43.02 42.84 3g0c s PHE 371 CO 0.06 -0.70 -0.11 0.71 -0.05 0.00 0.00 175.22 175.13 3g0c s TYR 372 N -2.71 2.82 -0.18 3.49 2.02 0.11 -0.08 117.35 122.81 3g0c s TYR 372 Ca -0.04 -0.16 -0.16 0.00 -0.37 0.00 0.00 57.07 56.34 3g0c s TYR 372 Cb -0.00 -1.71 0.05 0.00 -0.40 0.00 0.00 41.96 39.90 3g0c s TYR 372 CO -0.04 0.17 0.48 0.21 -1.57 0.00 0.00 175.55 174.81 3g0c s LYS 373 N -0.55 0.55 -0.15 -0.62 2.20 -0.73 -0.31 119.74 120.13 3g0c s LYS 373 Ca 0.08 0.70 -0.29 0.00 -0.36 0.00 0.00 55.97 56.09 3g0c s LYS 373 Cb -0.12 0.25 -0.01 0.00 -1.51 0.00 0.00 37.83 36.44 3g0c s LYS 373 CO 0.02 -0.08 1.07 0.42 -0.36 0.00 0.00 175.35 176.42 3g0c s ILE 374 N 0.39 4.63 0.11 5.43 1.01 -1.26 -0.69 121.20 130.82 3g0c s ILE 374 Ca -0.01 1.93 -0.03 0.00 0.00 0.00 0.00 60.65 62.54 3g0c s ILE 374 Cb -0.04 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.16 3g0c s ILE 374 CO -0.01 -0.08 0.09 0.27 0.00 0.00 0.00 174.94 175.21 3g0c s ILE 375 N 2.60 0.13 -0.00 2.92 -4.36 -0.73 -4.48 121.20 117.27 3g0c s ILE 375 Ca 0.48 -1.72 -0.28 0.00 -0.26 0.00 0.00 60.65 58.88 3g0c s ILE 375 Cb -0.18 -1.81 -0.04 0.00 1.25 0.00 0.00 42.46 41.68 3g0c s ILE 375 CO 0.14 -0.58 0.88 -0.94 0.24 0.00 0.00 174.94 174.67 3g0c s SER 376 N -2.98 7.25 1.16 4.36 1.04 -1.26 -0.51 113.70 122.76 3g0c s SER 376 Ca 0.17 1.51 -0.18 0.00 0.48 0.00 0.00 55.95 57.93 3g0c s SER 376 Cb 0.07 -2.52 0.27 0.00 0.10 0.00 0.00 66.02 63.94 3g0c s SER 376 CO -0.03 -0.17 1.12 0.54 0.98 0.00 0.00 173.24 175.68 3g0c s ASN 377 N 0.75 1.31 0.32 7.02 2.20 0.25 -4.82 114.94 121.97 3g0c s ASN 377 Ca 0.46 0.70 0.16 0.00 -0.94 0.00 0.00 52.86 53.24 3g0c s ASN 377 Cb -0.20 -1.01 0.87 0.00 -2.00 0.00 0.00 41.25 38.91 3g0c s ASN 377 CO 0.25 -3.89 1.42 -1.84 -2.94 0.00 0.00 177.10 170.10 3g0c n GLU 378 N -4.62 0.11 -1.54 3.55 0.00 -1.26 -1.42 120.64 115.47 3g0c n GLU 378 Ca 0.12 0.59 -0.08 0.00 0.00 0.00 0.00 57.16 57.79 3g0c n GLU 378 Cb 0.59 -2.05 0.09 0.00 0.00 0.00 0.00 31.44 30.08 3g0c n GLU 378 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3g0c n GLU 379 N -2.12 2.36 -1.00 3.44 0.28 -1.26 -4.97 120.64 117.37 3g0c n GLU 379 Ca -0.01 -3.60 0.00 0.00 -0.16 0.00 0.00 57.16 53.39 3g0c n GLU 379 Cb 0.22 -1.77 0.00 0.00 1.43 0.00 0.00 31.44 31.32 3g0c n GLU 379 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3g0c n GLY 380 N -0.74 0.53 3.60 -1.84 0.00 -0.51 -4.81 105.19 101.41 3g0c n GLY 380 Ca 0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 3g0c n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g0c s TYR 381 N -2.14 3.22 -0.23 1.61 1.51 -1.26 -0.52 117.35 119.55 3g0c s TYR 381 Ca 0.00 -0.00 -0.29 0.00 -1.01 0.00 0.00 57.07 55.77 3g0c s TYR 381 Cb 0.00 -2.14 -0.01 0.00 -0.11 0.00 0.00 41.96 39.70 3g0c s TYR 381 CO 0.00 0.03 1.31 1.03 -1.11 0.00 0.00 175.55 176.81 3g0c s ARG 382 N 0.75 4.07 0.15 -0.62 0.52 -1.26 0.86 118.95 123.41 3g0c s ARG 382 Ca 0.04 1.49 -0.01 0.00 -0.52 0.00 0.00 55.73 56.73 3g0c s ARG 382 Cb -0.13 -3.84 -0.04 0.00 0.52 0.00 0.00 34.95 31.46 3g0c s ARG 382 CO 0.02 -0.93 0.06 -1.01 0.02 0.00 0.00 175.30 173.47 3g0c s HIS 383 N 4.00 0.95 -0.22 -0.53 3.76 0.34 -1.44 115.29 122.15 3g0c s HIS 383 Ca 0.57 -1.24 -0.29 0.00 -0.15 0.00 0.00 55.06 53.95 3g0c s HIS 383 Cb -0.20 -0.52 0.00 0.00 1.11 0.00 0.00 32.58 32.98 3g0c s HIS 383 CO 0.19 -0.51 1.11 0.42 -0.85 0.00 0.00 174.74 175.11 3g0c s ILE 384 N -4.03 4.55 -0.12 0.60 1.01 -1.26 -1.78 121.20 120.17 3g0c s ILE 384 Ca 0.26 1.87 -0.05 0.00 0.00 0.00 0.00 60.65 62.74 3g0c s ILE 384 Cb 0.07 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 3g0c s ILE 384 CO 0.04 -0.18 0.05 0.00 0.00 0.00 0.00 174.94 174.84 3g0c s TYR 386 N -0.53 3.26 -0.05 0.00 6.04 -0.16 -1.77 117.35 124.14 3g0c s TYR 386 Ca 0.10 0.39 0.04 0.00 0.04 0.00 0.00 57.07 57.64 3g0c s TYR 386 Cb -0.12 -2.53 -0.02 0.00 -1.04 0.00 0.00 41.96 38.25 3g0c s TYR 386 CO 0.02 -0.18 -0.17 -0.06 -1.54 0.00 0.00 175.55 173.62 3g0c s PHE 387 N 1.91 2.62 0.09 4.97 0.08 0.88 -2.51 117.98 126.02 3g0c s PHE 387 Ca 0.14 -0.24 -0.14 0.00 0.12 0.00 0.00 56.93 56.81 3g0c s PHE 387 Cb -0.16 -1.61 -0.06 0.00 -0.57 0.00 0.00 43.02 40.62 3g0c s PHE 387 CO 0.10 0.12 0.48 -0.65 -0.10 0.00 0.00 175.22 175.17 3g0c s GLN 388 N -0.66 3.93 0.57 0.44 -1.52 -1.26 -1.01 119.66 120.15 3g0c s GLN 388 Ca 0.10 0.41 0.29 0.00 -1.95 0.00 0.00 55.36 54.21 3g0c s GLN 388 Cb -0.11 -3.03 1.71 0.00 -0.22 0.00 0.00 33.01 31.36 3g0c s GLN 388 CO 0.00 0.56 2.20 0.97 -0.25 0.00 0.00 175.29 178.77 3g0c h ILE 389 N 3.05 0.55 0.00 1.08 6.09 -1.61 -2.84 117.51 123.82 3g0c h ILE 389 Ca -0.49 -0.16 -0.20 0.00 -1.37 0.00 0.00 64.86 62.63 3g0c h ILE 389 Cb 1.20 1.10 -0.04 0.00 0.47 0.00 0.00 36.82 39.56 3g0c h ILE 389 CO 0.65 0.04 -1.80 0.47 -3.07 0.00 0.00 178.15 174.43 3g0c n ASP 390 N -3.80 0.46 -4.91 2.19 8.00 -1.26 -4.44 116.55 112.79 3g0c n ASP 390 Ca -0.03 0.20 -0.32 0.00 0.71 0.00 0.00 54.79 55.36 3g0c n ASP 390 Cb 0.13 0.73 -0.04 0.00 -0.02 0.00 0.00 41.12 41.91 3g0c n ASP 390 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3g0c s LYS 391 N -2.90 3.49 -0.06 -1.24 2.47 -1.07 -4.83 119.74 115.59 3g0c s LYS 391 Ca -0.06 -0.32 -0.27 0.00 -1.56 0.00 0.00 55.97 53.76 3g0c s LYS 391 Cb 0.09 -3.01 -0.22 0.00 -1.46 0.00 0.00 37.83 33.22 3g0c s LYS 391 CO 0.84 0.59 1.07 0.87 0.16 0.00 0.00 175.35 178.88 3g0c h LYS 392 N 3.18 0.03 -6.72 4.03 6.56 -1.92 -3.42 116.57 118.30 3g0c h LYS 392 Ca -0.46 -0.02 -0.50 0.00 -1.06 0.00 0.00 60.65 58.60 3g0c h LYS 392 Cb 1.17 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.83 3g0c h LYS 392 CO 0.74 0.71 0.42 -0.51 -2.06 0.00 0.00 179.45 178.75 3g0c s ASP 393 N -5.95 7.42 0.42 0.86 -0.00 -1.26 -5.00 116.67 113.16 3g0c s ASP 393 Ca -0.17 2.07 0.07 0.00 -0.00 0.00 0.00 52.55 54.52 3g0c s ASP 393 Cb 0.00 -2.61 -0.05 0.00 -0.00 0.00 0.00 42.92 40.26 3g0c s ASP 393 CO 0.69 -0.05 0.18 0.00 -0.00 0.00 0.00 175.17 175.99 3g0c s THR 395 N -2.62 2.75 0.05 0.00 -4.23 -1.05 -4.92 115.64 105.63 3g0c s THR 395 Ca 0.40 -0.81 -0.30 0.00 -1.18 0.00 0.00 61.69 59.80 3g0c s THR 395 Cb 0.04 -2.09 -0.05 0.00 1.34 0.00 0.00 72.50 71.74 3g0c s THR 395 CO 0.22 0.56 1.14 -0.36 -0.54 0.00 0.00 174.62 175.64 3g0c s PHE 396 N -0.16 3.50 -0.54 3.99 0.08 -1.26 -0.99 117.98 122.60 3g0c s PHE 396 Ca -0.02 1.40 0.22 0.00 0.12 0.00 0.00 56.93 58.65 3g0c s PHE 396 Cb -0.14 -3.34 -0.23 0.00 -0.57 0.00 0.00 43.02 38.74 3g0c s PHE 396 CO 0.04 -0.95 0.75 0.44 -0.10 0.00 0.00 175.22 175.39 3g0c n ILE 397 N 3.91 0.03 -4.33 0.64 -5.35 -0.35 -4.90 119.36 109.01 3g0c n ILE 397 Ca 0.08 -0.24 -0.26 0.00 -0.27 0.00 0.00 62.75 62.06 3g0c n ILE 397 Cb 0.48 0.47 -0.13 0.00 -1.74 0.00 0.00 39.64 38.72 3g0c n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3g0c s THR 398 N -3.24 1.96 0.06 7.28 -4.23 -1.25 -4.92 115.64 111.29 3g0c s THR 398 Ca 0.01 -1.67 -0.05 0.00 -1.18 0.00 0.00 61.69 58.80 3g0c s THR 398 Cb 0.15 -1.77 -0.02 0.00 1.34 0.00 0.00 72.50 72.20 3g0c s THR 398 CO 0.88 -0.02 0.08 -0.54 -0.54 0.00 0.00 174.62 174.48 3g0c s LYS 399 N -2.05 0.67 0.00 3.99 1.02 -1.26 -4.61 119.74 117.50 3g0c s LYS 399 Ca 0.10 -0.96 0.00 0.00 0.02 0.00 0.00 55.97 55.13 3g0c s LYS 399 Cb -0.10 0.26 0.00 0.00 -0.52 0.00 0.00 37.83 37.47 3g0c s LYS 399 CO 0.05 -0.17 0.00 0.41 -0.92 0.00 0.00 175.35 174.72 3g0c n GLY 400 N 0.33 2.66 2.63 -3.33 0.00 -1.26 -4.89 105.19 101.33 3g0c n GLY 400 Ca -0.16 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 43.99 3g0c n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g0c n THR 401 N -1.68 3.51 -3.77 2.61 -2.24 -1.26 -4.80 114.28 106.64 3g0c n THR 401 Ca 0.00 -3.51 -0.07 0.00 -2.27 0.00 0.00 64.05 58.20 3g0c n THR 401 Cb 0.00 -1.49 -0.01 0.00 -2.10 0.00 0.00 70.33 66.73 3g0c n THR 401 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 3g0c n TRP 402 N 0.42 -1.01 -3.97 4.78 4.27 -1.26 -5.05 117.44 115.62 3g0c n TRP 402 Ca 0.51 -1.14 -0.09 0.00 -3.89 0.00 0.00 57.50 52.89 3g0c n TRP 402 Cb 0.43 0.29 -0.11 0.00 -1.36 0.00 0.00 31.31 30.57 3g0c n TRP 402 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 3g0c s GLU 403 N -2.36 0.33 -0.04 -2.67 2.02 -1.26 -4.53 118.70 110.18 3g0c s GLU 403 Ca 0.14 -0.60 -0.24 0.00 0.02 0.00 0.00 54.97 54.29 3g0c s GLU 403 Cb -0.01 0.12 -0.04 0.00 0.10 0.00 0.00 34.13 34.30 3g0c s GLU 403 CO 0.10 -0.06 0.74 0.08 0.02 0.00 0.00 175.26 176.15 3g0c s VAL 404 N -1.47 4.99 -0.12 2.63 1.01 -0.52 -2.78 120.40 124.14 3g0c s VAL 404 Ca -0.16 1.55 -0.08 0.00 0.00 0.00 0.00 61.98 63.29 3g0c s VAL 404 Cb -0.10 -4.08 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 3g0c s VAL 404 CO -0.01 0.25 0.10 0.40 0.00 0.00 0.00 175.10 175.85 3g0c h ILE 405 N 4.69 0.34 -2.96 2.22 1.08 -0.64 -3.46 117.51 118.78 3g0c h ILE 405 Ca -0.41 -1.29 -0.12 0.00 -0.39 0.00 0.00 64.86 62.65 3g0c h ILE 405 Cb 1.20 0.68 -0.21 0.00 -3.07 0.00 0.00 36.82 35.42 3g0c h ILE 405 CO 0.75 0.12 -0.27 -0.83 -0.69 0.00 0.00 178.15 177.23 3g0c s GLY 406 N -3.88 -0.20 -0.24 5.37 0.00 -1.10 -5.00 107.32 102.28 3g0c s GLY 406 Ca -0.08 0.53 -0.29 0.00 0.00 0.00 0.00 44.72 44.88 3g0c s GLY 406 CO 0.19 0.33 1.04 -0.42 0.00 0.00 0.00 173.10 174.24 3g0c s ILE 407 N -0.94 4.66 -0.12 0.90 1.01 -1.26 -1.00 121.20 124.45 3g0c s ILE 407 Ca -0.10 1.98 0.20 0.00 0.00 0.00 0.00 60.65 62.72 3g0c s ILE 407 Cb -0.04 -4.32 -0.23 0.00 0.01 0.00 0.00 42.46 37.88 3g0c s ILE 407 CO 0.03 -0.22 0.52 -0.62 0.00 0.00 0.00 174.94 174.65 3g0c n GLU 408 N 6.39 0.65 -3.63 2.79 -0.58 0.83 -4.97 120.64 122.13 3g0c n GLU 408 Ca 0.12 -0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.81 3g0c n GLU 408 Cb 0.46 -1.63 -0.05 0.00 -0.57 0.00 0.00 31.44 29.65 3g0c n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3g0c s ALA 409 N -3.07 -2.10 -0.00 0.62 0.00 -1.10 -4.87 121.76 111.24 3g0c s ALA 409 Ca -0.06 1.79 0.02 0.00 0.00 0.00 0.00 51.96 53.71 3g0c s ALA 409 Cb 0.10 -1.42 -0.01 0.00 0.00 0.00 0.00 23.12 21.80 3g0c s ALA 409 CO 0.85 -0.22 -0.08 -0.48 0.00 0.00 0.00 175.76 175.83 3g0c s LEU 410 N -0.72 2.03 0.00 0.00 2.34 -1.26 0.33 118.68 121.39 3g0c s LEU 410 Ca 0.06 -0.16 0.00 0.00 0.06 0.00 0.00 54.13 54.09 3g0c s LEU 410 Cb -0.02 -0.38 0.00 0.00 -0.56 0.00 0.00 46.19 45.23 3g0c s LEU 410 CO -0.08 0.08 0.00 0.35 -1.06 0.00 0.00 176.35 175.64 3g0c n THR 411 N 2.83 0.00 0.08 5.48 -2.24 0.13 -5.02 114.28 115.53 3g0c n THR 411 Ca -0.14 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 3g0c n THR 411 Cb 0.57 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.72 3g0c n THR 411 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3g0c h SER 412 N 0.00 -0.12 0.04 3.42 0.02 -2.01 -3.35 113.55 111.55 3g0c h SER 412 Ca 0.00 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 3g0c h SER 412 Cb 0.00 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 3g0c h SER 412 CO 0.00 0.04 -1.97 0.47 -1.14 0.00 0.00 176.83 174.22 3g0c n ASP 413 N -5.09 0.03 -4.10 3.07 8.00 -1.26 -4.86 116.55 112.34 3g0c n ASP 413 Ca -0.08 0.01 -0.16 0.00 0.71 0.00 0.00 54.79 55.27 3g0c n ASP 413 Cb 0.13 1.91 -0.12 0.00 -0.02 0.00 0.00 41.12 43.02 3g0c n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3g0c s TYR 414 N -3.48 0.90 -0.10 1.24 1.51 -1.26 -0.68 117.35 115.48 3g0c s TYR 414 Ca -0.08 -0.44 0.03 0.00 -1.01 0.00 0.00 57.07 55.57 3g0c s TYR 414 Cb 0.14 -0.52 -0.01 0.00 -0.11 0.00 0.00 41.96 41.45 3g0c s TYR 414 CO 0.90 -0.02 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.97 3g0c s LEU 415 N -1.46 2.40 -0.14 -1.29 1.98 -0.59 -0.70 118.68 118.88 3g0c s LEU 415 Ca -0.05 -0.42 -0.02 0.00 -2.89 0.00 0.00 54.13 50.75 3g0c s LEU 415 Cb -0.09 -1.50 -0.02 0.00 0.66 0.00 0.00 46.19 45.24 3g0c s LEU 415 CO 0.01 0.20 -0.08 -0.31 -1.89 0.00 0.00 176.35 174.28 3g0c s TYR 416 N 0.10 2.92 0.03 5.38 2.02 0.15 -1.13 117.35 126.82 3g0c s TYR 416 Ca -0.09 -0.45 -0.10 0.00 -0.37 0.00 0.00 57.07 56.06 3g0c s TYR 416 Cb -0.15 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.52 3g0c s TYR 416 CO 0.06 -0.11 0.21 1.52 -1.57 0.00 0.00 175.55 175.65 3g0c s TYR 417 N 0.32 0.02 -0.17 2.71 -0.85 -0.80 -0.12 117.35 118.46 3g0c s TYR 417 Ca -0.07 -0.18 -0.08 0.00 -0.52 0.00 0.00 57.07 56.22 3g0c s TYR 417 Cb -0.15 -0.01 -0.04 0.00 0.38 0.00 0.00 41.96 42.14 3g0c s TYR 417 CO 0.04 -0.41 0.11 0.42 -1.52 0.00 0.00 175.55 174.20 3g0c s ILE 418 N -2.25 5.24 0.25 -3.49 -1.09 -0.17 0.05 121.20 119.75 3g0c s ILE 418 Ca -0.07 0.12 -0.05 0.00 -2.23 0.00 0.00 60.65 58.42 3g0c s ILE 418 Cb -0.03 -3.35 -0.02 0.00 -1.58 0.00 0.00 42.46 37.49 3g0c s ILE 418 CO -0.02 0.50 0.33 -0.94 -1.23 0.00 0.00 174.94 173.58 3g0c s SER 419 N -0.07 0.31 -0.37 3.58 1.04 -0.76 0.14 113.70 117.58 3g0c s SER 419 Ca 0.09 -1.27 0.06 0.00 0.48 0.00 0.00 55.95 55.31 3g0c s SER 419 Cb -0.12 0.52 0.48 0.00 0.10 0.00 0.00 66.02 67.01 3g0c s SER 419 CO 0.00 -1.05 1.49 -0.46 0.98 0.00 0.00 173.24 174.20 3g0c n ASN 420 N -0.62 4.30 -0.06 7.02 0.23 -1.12 -1.64 115.26 123.37 3g0c n ASN 420 Ca 0.01 -3.78 -0.15 0.00 -0.53 0.00 0.00 54.58 50.12 3g0c n ASN 420 Cb 0.63 -0.61 -0.06 0.00 -2.08 0.00 0.00 39.78 37.66 3g0c n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3g0c h GLU 421 N 1.58 0.71 -6.02 -3.83 4.81 -1.84 -3.33 114.58 106.66 3g0c h GLU 421 Ca 0.35 -0.49 -0.70 0.00 -0.13 0.00 0.00 59.36 58.40 3g0c h GLU 421 Cb 1.47 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.91 3g0c h GLU 421 CO 0.76 1.11 1.31 0.98 -0.73 0.00 0.00 179.01 182.44 3g0c n TYR 422 N -4.13 1.62 -1.31 0.92 4.19 -1.26 -0.92 117.16 116.26 3g0c n TYR 422 Ca -0.06 0.39 -0.11 0.00 3.31 0.00 0.00 57.90 61.44 3g0c n TYR 422 Cb 0.60 -2.48 -0.05 0.00 0.49 0.00 0.00 39.34 37.90 3g0c n TYR 422 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 3g0c n LYS 423 N 7.60 -1.03 -3.56 2.98 5.02 -1.26 -2.97 118.16 124.94 3g0c n LYS 423 Ca 0.41 0.85 -0.25 0.00 -2.02 0.00 0.00 58.31 57.29 3g0c n LYS 423 Cb 0.17 -4.90 0.06 0.00 -0.02 0.00 0.00 35.03 30.33 3g0c n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g0c n GLY 424 N -1.11 -0.53 3.24 0.72 0.00 -0.10 -4.96 105.19 102.44 3g0c n GLY 424 Ca -0.11 0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3g0c n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g0c s MET 425 N -6.27 2.53 0.61 1.61 -1.94 -1.16 -4.97 119.30 109.71 3g0c s MET 425 Ca 0.55 -1.62 0.32 0.00 -1.71 0.00 0.00 55.69 53.23 3g0c s MET 425 Cb -0.25 -3.85 1.89 0.00 2.01 0.00 0.00 34.83 34.62 3g0c s MET 425 CO 0.68 -1.08 2.23 -1.35 -0.01 0.00 0.00 175.02 175.48 3g0c h PRO 426 N 8.43 0.00 -0.29 2.03 0.11 -1.89 -1.80 132.00 138.59 3g0c h PRO 426 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3g0c h PRO 426 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3g0c h PRO 426 CO 0.81 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.01 3g0c n GLY 427 N -1.30 1.08 3.95 -0.55 0.00 -1.26 -4.86 105.19 102.25 3g0c n GLY 427 Ca -0.02 -0.59 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 3g0c n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g0c s GLY 428 N -1.51 1.50 -0.12 -0.02 0.00 -0.68 -2.72 107.32 103.78 3g0c s GLY 428 Ca 0.35 -0.97 -0.05 0.00 0.00 0.00 0.00 44.72 44.05 3g0c s GLY 428 CO 0.29 -0.82 0.27 0.50 0.00 0.00 0.00 173.10 173.33 3g0c s ARG 429 N -4.52 0.19 0.04 2.90 1.81 -0.25 -4.23 118.95 114.90 3g0c s ARG 429 Ca 0.46 0.65 0.02 0.00 -1.72 0.00 0.00 55.73 55.14 3g0c s ARG 429 Cb -0.10 -0.07 -0.03 0.00 -0.45 0.00 0.00 34.95 34.31 3g0c s ARG 429 CO 0.38 -0.22 -0.06 -0.80 -0.68 0.00 0.00 175.30 173.92 3g0c s ASN 430 N 1.82 0.72 -0.04 0.23 -0.87 -0.65 -0.72 114.94 115.42 3g0c s ASN 430 Ca -0.04 -0.59 -0.25 0.00 -1.57 0.00 0.00 52.86 50.40 3g0c s ASN 430 Cb -0.11 0.06 -0.04 0.00 -0.02 0.00 0.00 41.25 41.15 3g0c s ASN 430 CO -0.09 -0.26 0.78 -0.22 -2.57 0.00 0.00 177.10 174.75 3g0c s LEU 431 N -1.71 4.34 0.27 0.60 2.96 -1.26 -1.83 118.68 122.05 3g0c s LEU 431 Ca -0.09 1.33 0.08 0.00 -0.22 0.00 0.00 54.13 55.23 3g0c s LEU 431 Cb -0.08 -3.23 -0.06 0.00 0.50 0.00 0.00 46.19 43.32 3g0c s LEU 431 CO -0.01 -0.15 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.46 3g0c s TYR 432 N 0.84 2.01 -0.12 5.38 2.02 0.11 -0.69 117.35 126.89 3g0c s TYR 432 Ca 0.42 -0.59 -0.03 0.00 -0.37 0.00 0.00 57.07 56.50 3g0c s TYR 432 Cb -0.19 -1.06 0.04 0.00 -0.40 0.00 0.00 41.96 40.35 3g0c s TYR 432 CO 0.21 0.40 0.04 0.21 -1.57 0.00 0.00 175.55 174.84 3g0c s LYS 433 N -3.66 0.41 -0.13 -0.62 2.20 0.75 -1.91 119.74 116.78 3g0c s LYS 433 Ca 0.28 -0.05 -0.02 0.00 -0.36 0.00 0.00 55.97 55.83 3g0c s LYS 433 Cb 0.01 -1.41 -0.02 0.00 -1.51 0.00 0.00 37.83 34.89 3g0c s LYS 433 CO 0.12 -0.48 -0.07 -1.50 -0.36 0.00 0.00 175.35 173.06 3g0c s ILE 434 N 2.00 3.62 -0.17 5.43 2.07 -0.29 -0.14 121.20 133.72 3g0c s ILE 434 Ca 0.03 -0.47 -0.29 0.00 -1.41 0.00 0.00 60.65 58.51 3g0c s ILE 434 Cb -0.14 -2.55 -0.01 0.00 0.13 0.00 0.00 42.46 39.89 3g0c s ILE 434 CO -0.06 0.52 1.14 -1.58 -1.91 0.00 0.00 174.94 173.05 3g0c s GLN 435 N 0.12 4.28 0.56 3.50 0.74 -0.49 -1.54 119.66 126.83 3g0c s GLN 435 Ca -0.03 1.51 0.37 0.00 0.05 0.00 0.00 55.36 57.27 3g0c s GLN 435 Cb -0.14 -3.67 1.98 0.00 1.10 0.00 0.00 33.01 32.28 3g0c s GLN 435 CO 0.03 -0.60 2.14 -0.07 -0.55 0.00 0.00 175.29 176.24 3g0c h LEU 436 N 9.26 0.00 -1.39 3.68 4.07 -1.24 -1.46 115.31 128.24 3g0c h LEU 436 Ca -0.25 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.71 3g0c h LEU 436 Cb 1.10 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.84 3g0c h LEU 436 CO 0.95 0.00 -0.04 -1.54 -1.08 0.00 0.00 178.44 176.73 3g0c n SER 437 N -2.85 1.97 -3.27 -0.43 3.41 -1.26 -4.81 113.62 106.38 3g0c n SER 437 Ca -0.02 -1.49 -0.06 0.00 -0.26 0.00 0.00 58.87 57.05 3g0c n SER 437 Cb 0.09 0.08 -0.05 0.00 -0.26 0.00 0.00 64.21 64.08 3g0c n SER 437 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3g0c s ASP 438 N -1.18 -0.14 0.52 4.04 3.68 -0.55 -5.03 116.67 118.01 3g0c s ASP 438 Ca 0.14 -0.18 0.26 0.00 2.13 0.00 0.00 52.55 54.91 3g0c s ASP 438 Cb 0.11 1.35 1.42 0.00 -1.45 0.00 0.00 42.92 44.35 3g0c s ASP 438 CO 0.19 -0.34 2.07 1.88 0.13 0.00 0.00 175.17 179.10 3g0c h TYR 439 N 8.12 0.00 0.00 -5.34 0.05 -1.87 -0.96 116.97 116.97 3g0c h TYR 439 Ca -0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.70 3g0c h TYR 439 Cb 1.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.88 3g0c h TYR 439 CO 0.26 0.12 0.00 0.25 -1.05 0.00 0.00 178.16 177.74 3g0c n THR 440 N -3.68 0.13 -3.21 -2.88 -2.24 -1.26 -4.35 114.28 96.78 3g0c n THR 440 Ca -0.02 0.03 -0.45 0.00 -2.27 0.00 0.00 64.05 61.34 3g0c n THR 440 Cb 0.24 -0.61 -0.01 0.00 -2.10 0.00 0.00 70.33 67.85 3g0c n THR 440 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3g0c s LYS 441 N -2.43 3.92 -0.16 -0.78 1.02 -0.36 -5.00 119.74 115.95 3g0c s LYS 441 Ca 0.28 -2.68 -0.01 0.00 0.02 0.00 0.00 55.97 53.59 3g0c s LYS 441 Cb 0.18 -4.66 -0.01 0.00 -0.52 0.00 0.00 37.83 32.82 3g0c s LYS 441 CO 0.37 -1.42 -0.11 0.08 -0.92 0.00 0.00 175.35 173.35 3g0c s VAL 442 N 0.21 3.01 -0.11 3.17 1.01 -1.26 -1.39 120.40 125.05 3g0c s VAL 442 Ca 0.29 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.63 3g0c s VAL 442 Cb -0.08 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 3g0c s VAL 442 CO -0.07 0.50 -0.12 -0.89 0.00 0.00 0.00 175.10 174.51 3g0c s THR 443 N 0.82 3.16 -0.07 3.92 2.01 0.81 -4.96 115.64 121.33 3g0c s THR 443 Ca -0.04 -0.64 -0.26 0.00 0.31 0.00 0.00 61.69 61.06 3g0c s THR 443 Cb -0.15 -2.31 -0.03 0.00 0.01 0.00 0.00 72.50 70.02 3g0c s THR 443 CO 0.01 0.55 0.81 0.00 -0.69 0.00 0.00 174.62 175.29 3g0c n LEU 445 N 4.10 0.57 0.00 0.00 4.77 0.14 -4.54 117.00 122.03 3g0c n LEU 445 Ca 0.02 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 3g0c n LEU 445 Cb 0.51 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3g0c n LEU 445 CO 0.49 0.10 -0.17 -1.54 -1.33 0.00 0.00 177.39 174.93 3g0c n SER 446 N -1.90 1.69 -0.13 -1.43 3.41 -1.21 -4.79 113.62 109.26 3g0c n SER 446 Ca 0.01 -0.21 -0.04 0.00 -0.26 0.00 0.00 58.87 58.37 3g0c n SER 446 Cb 0.44 0.76 0.04 0.00 -0.26 0.00 0.00 64.21 65.18 3g0c n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g0c n GLU 448 N -5.14 1.69 -0.14 0.00 4.07 -1.26 -4.32 120.64 115.54 3g0c n GLU 448 Ca 0.03 -1.39 -0.03 0.00 -0.06 0.00 0.00 57.16 55.71 3g0c n GLU 448 Cb 0.21 -1.47 0.05 0.00 -0.06 0.00 0.00 31.44 30.16 3g0c n GLU 448 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 3g0c h LEU 449 N 3.40 -0.05 -5.01 4.31 3.38 -1.84 -3.37 115.31 116.12 3g0c h LEU 449 Ca 0.00 0.09 -0.20 0.00 0.09 0.00 0.00 57.88 57.86 3g0c h LEU 449 Cb 0.86 0.13 -0.15 0.00 0.09 0.00 0.00 40.66 41.59 3g0c h LEU 449 CO 0.00 0.01 -0.50 -3.20 0.09 0.00 0.00 178.44 174.84 3g0c n ASN 450 N -5.14 -3.09 0.27 -0.43 2.85 -1.26 -5.05 115.26 103.41 3g0c n ASN 450 Ca 0.04 -3.16 0.12 0.00 -0.11 0.00 0.00 54.58 51.48 3g0c n ASN 450 Cb 0.22 1.79 0.77 0.00 1.24 0.00 0.00 39.78 43.80 3g0c n ASN 450 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3g0c h PRO 451 N 4.38 0.00 0.17 1.20 0.13 -1.75 -0.62 132.00 135.51 3g0c h PRO 451 Ca -0.07 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.75 3g0c h PRO 451 Cb 1.06 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.22 3g0c h PRO 451 CO 0.21 0.07 -1.33 1.49 -0.23 0.00 0.00 178.00 178.20 3g0c h GLU 452 N 0.00 0.52 0.00 0.86 4.81 -1.96 -3.36 114.58 115.45 3g0c h GLU 452 Ca -0.00 -0.79 0.00 0.00 -0.13 0.00 0.00 59.36 58.44 3g0c h GLU 452 Cb 0.16 0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.82 3g0c h GLU 452 CO 0.01 1.37 -1.11 2.89 -0.73 0.00 0.00 179.01 181.43 3g0c n ARG 453 N -3.71 1.25 -4.01 1.92 1.85 -1.11 -4.66 116.66 108.20 3g0c n ARG 453 Ca -0.14 -0.05 -0.31 0.00 -1.00 0.00 0.00 57.85 56.35 3g0c n ARG 453 Cb 1.04 -1.31 -0.15 0.00 -1.05 0.00 0.00 32.46 30.98 3g0c n ARG 453 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3g0c n GLN 455 N 4.57 0.06 -3.71 0.00 6.02 0.12 -4.50 117.38 119.95 3g0c n GLN 455 Ca -0.14 -0.27 -0.29 0.00 -0.01 0.00 0.00 57.00 56.29 3g0c n GLN 455 Cb 0.44 -0.55 -0.16 0.00 1.02 0.00 0.00 30.24 30.99 3g0c n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3g0c s TYR 456 N -0.04 1.18 0.14 1.08 6.14 -1.10 -1.09 117.35 123.66 3g0c s TYR 456 Ca 0.00 -1.19 0.10 0.00 0.64 0.00 0.00 57.07 56.62 3g0c s TYR 456 Cb 0.00 -1.26 -0.04 0.00 0.42 0.00 0.00 41.96 41.08 3g0c s TYR 456 CO 0.00 -0.74 -0.20 0.71 0.64 0.00 0.00 175.55 175.96 3g0c s TYR 457 N 1.80 2.47 0.08 4.97 2.02 0.10 -0.72 117.35 128.07 3g0c s TYR 457 Ca 0.04 -0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.44 3g0c s TYR 457 Cb -0.17 -1.29 -0.04 0.00 -0.40 0.00 0.00 41.96 40.05 3g0c s TYR 457 CO -0.19 0.40 -0.01 -1.54 -1.57 0.00 0.00 175.55 172.64 3g0c s SER 458 N -2.26 0.55 0.08 2.29 1.04 -0.42 -4.61 113.70 110.38 3g0c s SER 458 Ca 0.18 -1.05 0.04 0.00 0.48 0.00 0.00 55.95 55.59 3g0c s SER 458 Cb -0.10 0.21 -0.03 0.00 0.10 0.00 0.00 66.02 66.19 3g0c s SER 458 CO 0.10 -0.61 -0.10 0.54 0.98 0.00 0.00 173.24 174.14 3g0c s VAL 459 N -3.91 0.89 -0.19 5.02 0.11 -1.26 -1.23 120.40 119.84 3g0c s VAL 459 Ca 0.12 -1.52 -0.02 0.00 -2.93 0.00 0.00 61.98 57.63 3g0c s VAL 459 Cb 0.07 -1.22 0.06 0.00 -1.53 0.00 0.00 36.38 33.77 3g0c s VAL 459 CO -0.06 -0.50 0.02 -0.55 -3.33 0.00 0.00 175.10 170.68 3g0c s SER 460 N -2.24 2.87 0.29 3.54 0.15 -0.14 -4.97 113.70 113.20 3g0c s SER 460 Ca 0.02 -0.78 -0.10 0.00 0.70 0.00 0.00 55.95 55.80 3g0c s SER 460 Cb -0.05 -0.65 -0.07 0.00 -1.71 0.00 0.00 66.02 63.54 3g0c s SER 460 CO 0.00 -0.28 0.62 -0.36 1.20 0.00 0.00 173.24 174.42 3g0c s PHE 461 N 1.81 3.43 1.14 3.44 0.40 -1.26 -0.21 117.98 126.74 3g0c s PHE 461 Ca -0.01 0.91 -0.17 0.00 -0.60 0.00 0.00 56.93 57.06 3g0c s PHE 461 Cb -0.17 -2.30 0.26 0.00 0.51 0.00 0.00 43.02 41.32 3g0c s PHE 461 CO -0.08 0.16 1.11 -1.54 0.70 0.00 0.00 175.22 175.57 3g0c s SER 462 N -2.64 1.46 0.63 1.36 1.04 0.80 -4.84 113.70 111.52 3g0c s SER 462 Ca 0.48 0.80 0.31 0.00 0.48 0.00 0.00 55.95 58.03 3g0c s SER 462 Cb -0.11 -1.18 1.72 0.00 0.10 0.00 0.00 66.02 66.55 3g0c s SER 462 CO 0.24 -3.81 2.04 0.50 0.98 0.00 0.00 173.24 173.19 3g0c h LYS 463 N -2.36 0.00 0.00 4.02 1.63 -1.75 -1.36 116.57 116.75 3g0c h LYS 463 Ca -0.48 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.22 3g0c h LYS 463 Cb 1.31 0.00 -0.21 0.00 -0.60 0.00 0.00 32.23 32.72 3g0c h LYS 463 CO 0.42 0.00 -0.77 -1.91 -3.45 0.00 0.00 179.45 173.74 3g0c n GLU 464 N -3.36 0.21 -1.48 1.90 2.13 -1.26 -4.96 120.64 113.82 3g0c n GLU 464 Ca 0.01 -1.84 -0.17 0.00 0.66 0.00 0.00 57.16 55.83 3g0c n GLU 464 Cb 0.37 -0.38 -0.07 0.00 0.27 0.00 0.00 31.44 31.63 3g0c n GLU 464 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3g0c n ALA 465 N 0.10 -0.25 0.01 4.31 0.00 -0.51 -4.90 120.51 119.26 3g0c n ALA 465 Ca 0.06 0.27 -0.06 0.00 0.00 0.00 0.00 53.44 53.71 3g0c n ALA 465 Cb 0.94 -1.75 0.14 0.00 0.00 0.00 0.00 19.45 18.78 3g0c n ALA 465 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3g0c h LYS 466 N 0.00 0.50 -5.43 0.00 1.57 -1.81 -3.42 116.57 107.98 3g0c h LYS 466 Ca -0.34 -0.24 -0.44 0.00 -1.87 0.00 0.00 60.65 57.76 3g0c h LYS 466 Cb 1.10 -0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.26 3g0c h LYS 466 CO 0.50 0.81 -0.71 0.71 -0.57 0.00 0.00 179.45 180.18 3g0c s TYR 467 N -4.27 1.69 -0.09 -1.35 1.51 -1.26 -0.87 117.35 112.72 3g0c s TYR 467 Ca -0.07 -0.67 -0.16 0.00 -1.01 0.00 0.00 57.07 55.17 3g0c s TYR 467 Cb 0.13 -0.86 0.03 0.00 -0.11 0.00 0.00 41.96 41.15 3g0c s TYR 467 CO 0.81 0.26 0.39 1.52 -1.11 0.00 0.00 175.55 177.42 3g0c s TYR 468 N -3.08 -0.35 -0.12 2.71 1.13 0.06 -0.14 117.35 117.57 3g0c s TYR 468 Ca 0.24 0.75 -0.16 0.00 -1.41 0.00 0.00 57.07 56.49 3g0c s TYR 468 Cb 0.01 0.15 -0.05 0.00 -1.10 0.00 0.00 41.96 40.98 3g0c s TYR 468 CO 0.07 -0.31 0.40 -1.14 -2.51 0.00 0.00 175.55 172.06 3g0c s GLN 469 N -0.52 4.24 -0.15 -3.49 0.74 0.71 -0.79 119.66 120.40 3g0c s GLN 469 Ca -0.06 0.31 -0.07 0.00 0.05 0.00 0.00 55.36 55.59 3g0c s GLN 469 Cb -0.04 -3.40 -0.04 0.00 1.10 0.00 0.00 33.01 30.64 3g0c s GLN 469 CO 0.03 0.27 0.09 -0.51 -0.55 0.00 0.00 175.29 174.62 3g0c s LEU 470 N 0.30 4.02 -0.15 3.68 1.43 0.16 -0.97 118.68 127.14 3g0c s LEU 470 Ca 0.22 0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.57 3g0c s LEU 470 Cb -0.15 -2.00 0.01 0.00 0.03 0.00 0.00 46.19 44.09 3g0c s LEU 470 CO 0.08 0.27 -0.21 -0.13 0.23 0.00 0.00 176.35 176.60 3g0c s ARG 471 N -0.22 3.04 -0.19 1.70 3.00 -0.37 -1.20 118.95 124.72 3g0c s ARG 471 Ca 0.09 -0.83 -0.03 0.00 0.00 0.00 0.00 55.73 54.96 3g0c s ARG 471 Cb -0.12 -2.50 -0.01 0.00 0.00 0.00 0.00 34.95 32.32 3g0c s ARG 471 CO 0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 175.30 175.18 3g0c n SER 473 N 4.31 1.61 0.00 0.00 7.64 0.10 -1.50 113.62 125.77 3g0c n SER 473 Ca -0.18 -1.25 0.00 0.00 1.01 0.00 0.00 58.87 58.45 3g0c n SER 473 Cb 0.51 0.40 0.00 0.00 -1.01 0.00 0.00 64.21 64.11 3g0c n SER 473 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g0c n GLY 474 N 1.40 -1.74 0.28 0.23 0.00 -1.26 0.15 105.19 104.26 3g0c n GLY 474 Ca 0.10 -1.43 0.17 0.00 0.00 0.00 0.00 46.02 44.86 3g0c n GLY 474 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3g0c h PRO 475 N 1.35 0.00 0.00 1.61 0.11 -0.73 0.35 132.00 134.69 3g0c h PRO 475 Ca 0.00 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 3g0c h PRO 475 Cb 0.00 0.00 0.05 0.00 0.11 0.00 0.00 31.00 31.16 3g0c h PRO 475 CO 0.00 0.04 0.10 0.41 -0.21 0.00 0.00 178.00 178.34 3g0c n GLY 476 N -0.28 -1.36 3.75 -0.55 0.00 0.46 -4.53 105.19 102.68 3g0c n GLY 476 Ca -0.01 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 3g0c n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g0c s LEU 477 N 0.00 4.38 0.19 0.99 1.02 -1.26 -4.58 118.68 119.42 3g0c s LEU 477 Ca 0.20 2.78 -0.31 0.00 0.02 0.00 0.00 54.13 56.82 3g0c s LEU 477 Cb -0.01 -3.64 -0.16 0.00 0.02 0.00 0.00 46.19 42.41 3g0c s LEU 477 CO 0.14 -0.74 0.89 -2.65 0.02 0.00 0.00 176.35 174.01 3g0c n PRO 478 N 1.82 0.67 -4.53 1.29 -0.02 -1.26 -4.75 135.00 128.22 3g0c n PRO 478 Ca 0.05 0.24 -0.21 0.00 -2.02 0.00 0.00 63.50 61.56 3g0c n PRO 478 Cb 0.40 -1.53 -0.15 0.00 -0.02 0.00 0.00 33.50 32.20 3g0c n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3g0c s LEU 479 N 1.34 1.98 -0.14 2.45 2.96 -0.56 -4.24 118.68 122.46 3g0c s LEU 479 Ca 0.69 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.39 3g0c s LEU 479 Cb -0.89 -0.63 0.02 0.00 0.50 0.00 0.00 46.19 45.19 3g0c s LEU 479 CO 0.56 0.13 -0.17 -0.31 -1.32 0.00 0.00 176.35 175.25 3g0c s TYR 480 N -0.18 2.32 0.08 5.38 2.02 0.27 -1.03 117.35 126.20 3g0c s TYR 480 Ca 0.03 -1.26 0.04 0.00 -0.37 0.00 0.00 57.07 55.50 3g0c s TYR 480 Cb -0.06 -1.65 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 3g0c s TYR 480 CO -0.00 -0.65 -0.10 0.95 -1.57 0.00 0.00 175.55 174.18 3g0c s THR 481 N 1.24 0.88 -0.06 -0.71 -4.23 -0.34 0.24 115.64 112.68 3g0c s THR 481 Ca 0.01 -1.45 0.04 0.00 -1.18 0.00 0.00 61.69 59.11 3g0c s THR 481 Cb -0.14 -1.14 -0.02 0.00 1.34 0.00 0.00 72.50 72.54 3g0c s THR 481 CO -0.08 -0.45 -0.15 -0.22 -0.54 0.00 0.00 174.62 173.18 3g0c s LEU 482 N -2.11 2.67 0.02 4.79 0.20 -0.66 0.38 118.68 123.97 3g0c s LEU 482 Ca 0.00 -0.23 -0.00 0.00 0.69 0.00 0.00 54.13 54.59 3g0c s LEU 482 Cb -0.06 -1.54 -0.02 0.00 -0.43 0.00 0.00 46.19 44.14 3g0c s LEU 482 CO 0.00 0.32 -0.02 -1.00 -0.29 0.00 0.00 176.35 175.37 3g0c s HIS 483 N -0.60 0.24 -0.14 5.38 3.76 0.03 -0.55 115.29 123.41 3g0c s HIS 483 Ca 0.09 -0.50 -0.12 0.00 -0.15 0.00 0.00 55.06 54.38 3g0c s HIS 483 Cb -0.11 -0.18 -0.05 0.00 1.11 0.00 0.00 32.58 33.35 3g0c s HIS 483 CO 0.01 -0.19 0.26 -1.54 -0.85 0.00 0.00 174.74 172.42 3g0c s SER 484 N -1.44 6.44 0.00 1.40 1.04 -1.12 -0.76 113.70 119.26 3g0c s SER 484 Ca -0.16 0.52 0.27 0.00 0.48 0.00 0.00 55.95 57.06 3g0c s SER 484 Cb -0.10 -2.16 0.93 0.00 0.10 0.00 0.00 66.02 64.80 3g0c s SER 484 CO -0.01 0.19 1.69 -1.54 0.98 0.00 0.00 173.24 174.56 3g0c n SER 485 N 3.06 0.46 0.08 7.02 3.41 -0.05 -1.34 113.62 126.26 3g0c n SER 485 Ca -0.14 -0.29 -0.13 0.00 -0.26 0.00 0.00 58.87 58.05 3g0c n SER 485 Cb 0.52 -0.03 -0.08 0.00 -0.26 0.00 0.00 64.21 64.36 3g0c n SER 485 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3g0c h VAL 486 N 0.35 0.98 0.00 -3.33 3.04 -1.90 -3.33 116.25 112.06 3g0c h VAL 486 Ca 0.00 -0.42 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 3g0c h VAL 486 Cb 0.45 1.24 0.00 0.00 -2.01 0.00 0.00 31.29 30.98 3g0c h VAL 486 CO 0.00 0.10 -1.19 -0.46 -1.01 0.00 0.00 177.57 175.01 3g0c n ASN 487 N -5.07 1.27 -0.40 3.17 0.23 -1.25 -5.00 115.26 108.20 3g0c n ASN 487 Ca -0.09 -0.37 -0.05 0.00 -0.53 0.00 0.00 54.58 53.54 3g0c n ASN 487 Cb 0.17 1.35 -0.02 0.00 -2.08 0.00 0.00 39.78 39.20 3g0c n ASN 487 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3g0c n ASP 488 N -1.69 -3.92 -4.80 0.53 9.92 -0.45 -5.03 116.55 111.11 3g0c n ASP 488 Ca -0.00 0.13 -0.34 0.00 -0.53 0.00 0.00 54.79 54.04 3g0c n ASP 488 Cb 0.30 -1.87 -0.06 0.00 -0.64 0.00 0.00 41.12 38.85 3g0c n ASP 488 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 3g0c s LYS 489 N -2.07 4.16 0.15 -1.24 -2.85 -1.20 -4.84 119.74 111.84 3g0c s LYS 489 Ca 0.00 1.27 -0.30 0.00 -1.00 0.00 0.00 55.97 55.94 3g0c s LYS 489 Cb 0.00 -2.31 -0.07 0.00 -2.06 0.00 0.00 37.83 33.39 3g0c s LYS 489 CO 0.00 -0.11 1.23 0.20 0.10 0.00 0.00 175.35 176.78 3g0c s GLY 490 N -1.95 2.50 -0.21 0.59 0.00 -1.26 -2.79 107.32 104.20 3g0c s GLY 490 Ca 0.61 0.96 0.02 0.00 0.00 0.00 0.00 44.72 46.31 3g0c s GLY 490 CO 0.19 1.98 -0.01 1.04 0.00 0.00 0.00 173.10 176.30 3g0c n LEU 491 N 3.04 2.45 -3.64 0.66 4.77 0.29 -4.97 117.00 119.60 3g0c n LEU 491 Ca 0.07 -0.01 -0.02 0.00 -0.03 0.00 0.00 56.01 56.01 3g0c n LEU 491 Cb 0.45 -0.75 -0.03 0.00 -2.33 0.00 0.00 43.42 40.76 3g0c n LEU 491 CO 0.56 0.84 1.17 0.00 -1.33 0.00 0.00 177.39 178.63 3g0c s ARG 492 N -2.53 0.05 -0.07 3.23 1.70 -1.21 -5.02 118.95 115.10 3g0c s ARG 492 Ca -0.28 -0.01 -0.30 0.00 -0.47 0.00 0.00 55.73 54.68 3g0c s ARG 492 Cb 0.08 0.02 -0.03 0.00 -0.57 0.00 0.00 34.95 34.45 3g0c s ARG 492 CO 0.68 -0.02 1.15 0.08 -1.08 0.00 0.00 175.30 176.11 3g0c s VAL 493 N -1.62 4.39 -0.16 4.99 1.01 -1.26 -1.65 120.40 126.09 3g0c s VAL 493 Ca 0.11 1.70 -0.21 0.00 0.00 0.00 0.00 61.98 63.57 3g0c s VAL 493 Cb -0.01 -4.09 -0.19 0.00 0.00 0.00 0.00 36.38 32.09 3g0c s VAL 493 CO -0.05 -0.00 0.38 -0.07 0.00 0.00 0.00 175.10 175.36 3g0c h LEU 494 N 8.16 0.00 -7.29 3.92 3.38 -0.56 -3.48 115.31 119.44 3g0c h LEU 494 Ca -0.33 -0.61 -0.18 0.00 0.09 0.00 0.00 57.88 56.85 3g0c h LEU 494 Cb 1.16 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.61 3g0c h LEU 494 CO 0.87 1.12 -0.45 -0.70 0.09 0.00 0.00 178.44 179.38 3g0c s GLU 495 N -2.21 0.24 0.00 1.13 2.56 -1.11 -5.00 118.70 114.30 3g0c s GLU 495 Ca -0.21 0.64 0.06 0.00 0.00 0.00 0.00 54.97 55.47 3g0c s GLU 495 Cb 0.01 -0.07 0.09 0.00 2.00 0.00 0.00 34.13 36.17 3g0c s GLU 495 CO 0.54 -0.19 0.86 -0.40 -0.56 0.00 0.00 175.26 175.51 3g0c n ASP 496 N 4.48 1.88 -4.15 -1.70 3.85 -1.26 -0.57 116.55 119.09 3g0c n ASP 496 Ca -0.21 -1.54 -0.32 0.00 -0.71 0.00 0.00 54.79 52.01 3g0c n ASP 496 Cb 0.53 -0.05 -0.03 0.00 -1.35 0.00 0.00 41.12 40.22 3g0c n ASP 496 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 3g0c n ASN 497 N 0.23 -1.83 0.14 -1.12 3.02 -1.26 -4.88 115.26 109.56 3g0c n ASN 497 Ca 0.05 -1.04 0.06 0.00 -0.03 0.00 0.00 54.58 53.61 3g0c n ASN 497 Cb 0.22 -2.71 0.05 0.00 -0.61 0.00 0.00 39.78 36.73 3g0c n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3g0c h SER 498 N -1.63 0.00 -0.42 6.41 4.64 -1.95 -2.07 113.55 118.53 3g0c h SER 498 Ca -0.61 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.69 3g0c h SER 498 Cb 1.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.45 3g0c h SER 498 CO 0.72 0.32 0.18 0.00 -0.87 0.00 0.00 176.83 177.19 3g0c h ALA 499 N 1.68 0.55 -0.72 5.18 0.00 -1.99 -0.78 119.26 123.17 3g0c h ALA 499 Ca -0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3g0c h ALA 499 Cb 1.27 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 3g0c h ALA 499 CO 0.04 0.14 0.44 1.25 0.00 0.00 0.00 179.25 181.12 3g0c h LEU 500 N 0.54 0.86 -1.04 0.00 5.85 -1.84 -2.50 115.31 117.18 3g0c h LEU 500 Ca 0.14 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3g0c h LEU 500 Cb 0.17 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 3g0c h LEU 500 CO -0.01 0.66 0.54 -0.78 -0.34 0.00 0.00 178.44 178.51 3g0c h ASP 501 N 0.98 1.06 -0.23 1.25 1.82 -1.19 -0.99 116.42 119.12 3g0c h ASP 501 Ca 0.26 -0.06 -0.05 0.00 -0.39 0.00 0.00 57.03 56.79 3g0c h ASP 501 Cb -0.05 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 39.68 3g0c h ASP 501 CO -0.05 0.81 -0.01 0.11 -1.61 0.00 0.00 179.24 178.48 3g0c h LYS 502 N 1.22 0.54 0.14 0.28 1.57 -0.76 -2.89 116.57 116.67 3g0c h LYS 502 Ca 0.32 -0.12 -0.29 0.00 -1.87 0.00 0.00 60.65 58.69 3g0c h LYS 502 Cb -0.06 -0.08 0.02 0.00 0.08 0.00 0.00 32.23 32.19 3g0c h LYS 502 CO -0.06 0.58 -1.27 0.52 -0.57 0.00 0.00 179.45 178.65 3g0c h MET 503 N 0.51 0.42 0.00 3.15 2.86 -0.95 -3.30 114.93 117.62 3g0c h MET 503 Ca 0.11 -0.65 0.00 0.00 -2.06 0.00 0.00 59.70 57.10 3g0c h MET 503 Cb 0.36 0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.25 3g0c h MET 503 CO 0.01 1.29 0.00 1.28 1.06 0.00 0.00 176.91 180.55 3g0c n LEU 504 N -3.65 0.59 0.27 1.22 4.32 -0.44 -3.77 117.00 115.54 3g0c n LEU 504 Ca -0.11 0.61 0.18 0.00 -0.02 0.00 0.00 56.01 56.67 3g0c n LEU 504 Cb 1.01 -0.50 0.92 0.00 -1.62 0.00 0.00 43.42 43.24 3g0c n LEU 504 CO 0.56 -0.39 1.15 -0.61 -1.22 0.00 0.00 177.39 176.88 3g0c h GLN 505 N 0.00 0.00 0.00 3.23 4.15 -1.59 -1.60 115.11 119.30 3g0c h GLN 505 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3g0c h GLN 505 Cb 0.46 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.15 3g0c h GLN 505 CO 0.00 0.00 -0.52 -1.71 -1.93 0.00 0.00 178.83 174.67 3g0c n ASN 506 N -3.41 0.75 -4.78 -0.69 4.05 -1.25 -4.93 115.26 105.00 3g0c n ASN 506 Ca -0.00 -0.60 -0.38 0.00 0.45 0.00 0.00 54.58 54.05 3g0c n ASN 506 Cb 0.28 1.05 -0.06 0.00 1.23 0.00 0.00 39.78 42.28 3g0c n ASN 506 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3g0c s VAL 507 N -1.88 5.09 -0.96 3.44 1.01 -0.60 -3.31 120.40 123.18 3g0c s VAL 507 Ca 0.02 0.90 -0.24 0.00 0.00 0.00 0.00 61.98 62.66 3g0c s VAL 507 Cb 0.06 -3.77 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 3g0c s VAL 507 CO 0.34 0.46 1.72 -1.10 0.00 0.00 0.00 175.10 176.51 3g0c s GLN 508 N -0.26 3.04 0.25 2.72 -0.21 0.79 -4.97 119.66 121.03 3g0c s GLN 508 Ca 0.25 -0.70 -0.13 0.00 0.02 0.00 0.00 55.36 54.80 3g0c s GLN 508 Cb -0.16 -5.21 -0.08 0.00 1.00 0.00 0.00 33.01 28.57 3g0c s GLN 508 CO 0.12 -2.84 0.62 -1.64 -2.12 0.00 0.00 175.29 169.43 3g0c s MET 509 N 6.05 3.93 0.80 2.91 -1.94 -1.26 -4.39 119.30 125.40 3g0c s MET 509 Ca 0.59 0.48 -0.11 0.00 -1.71 0.00 0.00 55.69 54.94 3g0c s MET 509 Cb -0.03 -2.64 0.07 0.00 2.01 0.00 0.00 34.83 34.24 3g0c s MET 509 CO -0.05 0.30 1.09 -1.25 -0.01 0.00 0.00 175.02 175.10 3g0c s PRO 510 N -2.67 2.05 0.24 2.03 0.04 -1.26 -4.23 135.00 131.20 3g0c s PRO 510 Ca 0.48 0.87 0.11 0.00 0.04 0.00 0.00 61.00 62.49 3g0c s PRO 510 Cb -0.12 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 3g0c s PRO 510 CO 0.20 -1.70 -0.13 -1.54 0.04 0.00 0.00 177.00 173.87 3g0c s SER 511 N -3.64 3.98 -0.16 6.66 1.04 -0.70 -4.93 113.70 115.96 3g0c s SER 511 Ca 0.61 -0.80 -0.02 0.00 0.48 0.00 0.00 55.95 56.22 3g0c s SER 511 Cb -0.16 -0.54 -0.02 0.00 0.10 0.00 0.00 66.02 65.41 3g0c s SER 511 CO 0.56 0.05 -0.08 -0.75 0.98 0.00 0.00 173.24 173.99 3g0c s LYS 512 N -3.31 3.47 -0.23 4.02 2.20 -1.26 -0.36 119.74 124.27 3g0c s LYS 512 Ca 0.28 -0.62 -0.07 0.00 -0.36 0.00 0.00 55.97 55.20 3g0c s LYS 512 Cb -0.07 -2.80 -0.03 0.00 -1.51 0.00 0.00 37.83 33.43 3g0c s LYS 512 CO 0.16 0.14 0.06 0.21 -0.36 0.00 0.00 175.35 175.56 3g0c s LYS 513 N 0.59 3.71 -0.21 4.03 2.20 0.15 -4.94 119.74 125.27 3g0c s LYS 513 Ca -0.05 -0.46 -0.05 0.00 -0.36 0.00 0.00 55.97 55.05 3g0c s LYS 513 Cb -0.15 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 3g0c s LYS 513 CO 0.03 -0.09 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.76 3g0c s LEU 514 N 1.33 3.14 0.00 5.43 0.20 -1.26 -0.66 118.68 126.86 3g0c s LEU 514 Ca 0.05 -0.28 -0.06 0.00 0.69 0.00 0.00 54.13 54.53 3g0c s LEU 514 Cb -0.15 -1.80 0.02 0.00 -0.43 0.00 0.00 46.19 43.83 3g0c s LEU 514 CO 0.03 0.02 0.32 -0.67 -0.29 0.00 0.00 176.35 175.76 3g0c n ASP 515 N 4.56 -0.94 -4.24 3.68 4.64 -0.75 -5.02 116.55 118.48 3g0c n ASP 515 Ca -0.17 -1.68 -0.13 0.00 -1.38 0.00 0.00 54.79 51.42 3g0c n ASP 515 Cb 0.51 1.57 -0.10 0.00 -1.04 0.00 0.00 41.12 42.06 3g0c n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 3g0c s PHE 516 N -5.95 1.21 0.02 -0.67 -0.12 -1.26 -0.26 117.98 110.94 3g0c s PHE 516 Ca 0.07 -0.97 0.04 0.00 -0.05 0.00 0.00 56.93 56.02 3g0c s PHE 516 Cb -0.02 -0.68 -0.02 0.00 -0.63 0.00 0.00 43.02 41.67 3g0c s PHE 516 CO 0.05 -0.16 -0.13 0.96 -0.05 0.00 0.00 175.22 175.90 3g0c s ILE 517 N -3.60 1.00 -0.12 -4.49 -4.36 -0.32 -4.91 121.20 104.40 3g0c s ILE 517 Ca 0.22 -0.80 -0.26 0.00 -0.26 0.00 0.00 60.65 59.55 3g0c s ILE 517 Cb 0.06 -0.89 -0.02 0.00 1.25 0.00 0.00 42.46 42.86 3g0c s ILE 517 CO 0.03 0.09 0.85 -0.63 0.24 0.00 0.00 174.94 175.52 3g0c s ILE 518 N -0.64 4.90 -0.03 8.37 -1.09 -1.26 -0.95 121.20 130.51 3g0c s ILE 518 Ca 0.02 1.71 0.01 0.00 -2.23 0.00 0.00 60.65 60.16 3g0c s ILE 518 Cb -0.07 -4.17 0.02 0.00 -1.58 0.00 0.00 42.46 36.67 3g0c s ILE 518 CO 0.01 0.08 -0.02 -0.76 -1.23 0.00 0.00 174.94 173.02 3g0c s LEU 519 N 1.72 1.39 -1.51 2.97 1.43 0.25 -4.81 118.68 120.12 3g0c s LEU 519 Ca 0.41 -0.06 -0.15 0.00 -1.03 0.00 0.00 54.13 53.31 3g0c s LEU 519 Cb -0.18 -0.26 0.12 0.00 0.03 0.00 0.00 46.19 45.90 3g0c s LEU 519 CO 0.16 -0.06 0.71 0.59 0.23 0.00 0.00 176.35 177.99 3g0c n ASN 520 N 3.85 -3.71 -1.25 2.29 3.02 -1.26 0.26 115.26 118.47 3g0c n ASN 520 Ca -0.24 -0.74 -0.16 0.00 -0.03 0.00 0.00 54.58 53.42 3g0c n ASN 520 Cb 0.52 -3.03 -0.07 0.00 -0.61 0.00 0.00 39.78 36.59 3g0c n ASN 520 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3g0c n GLU 521 N -4.18 -1.28 -5.06 3.52 4.71 -1.26 -5.00 120.64 112.09 3g0c n GLU 521 Ca 0.04 1.07 -0.32 0.00 -0.01 0.00 0.00 57.16 57.94 3g0c n GLU 521 Cb 0.51 -5.33 -0.15 0.00 -1.01 0.00 0.00 31.44 25.47 3g0c n GLU 521 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 3g0c s THR 522 N -2.53 2.56 0.09 2.62 2.01 0.14 -5.08 115.64 115.45 3g0c s THR 522 Ca 0.00 -0.88 -0.31 0.00 0.31 0.00 0.00 61.69 60.81 3g0c s THR 522 Cb 0.00 -1.98 -0.06 0.00 0.01 0.00 0.00 72.50 70.46 3g0c s THR 522 CO 0.00 0.57 1.24 -0.54 -0.69 0.00 0.00 174.62 175.20 3g0c s LYS 523 N -0.26 4.41 -0.13 4.92 1.02 -1.26 -0.58 119.74 127.87 3g0c s LYS 523 Ca 0.00 1.85 -0.01 0.00 0.02 0.00 0.00 55.97 57.84 3g0c s LYS 523 Cb -0.13 -3.31 0.04 0.00 -0.52 0.00 0.00 37.83 33.91 3g0c s LYS 523 CO 0.03 -0.28 -0.03 -0.06 -0.92 0.00 0.00 175.35 174.09 3g0c s PHE 524 N 0.92 1.25 0.31 3.18 0.08 -0.12 -4.95 117.98 118.65 3g0c s PHE 524 Ca 0.59 -0.69 -0.19 0.00 0.12 0.00 0.00 56.93 56.77 3g0c s PHE 524 Cb -0.32 -1.10 -0.09 0.00 -0.57 0.00 0.00 43.02 40.94 3g0c s PHE 524 CO 0.30 -0.50 0.79 -1.58 -0.10 0.00 0.00 175.22 174.14 3g0c s TRP 525 N 1.78 3.48 0.05 0.36 0.52 -1.25 -1.18 118.94 122.70 3g0c s TRP 525 Ca 0.03 1.40 -0.02 0.00 0.02 0.00 0.00 56.10 57.53 3g0c s TRP 525 Cb -0.14 -2.66 -0.03 0.00 -1.15 0.00 0.00 33.47 29.49 3g0c s TRP 525 CO -0.07 0.14 0.01 1.52 0.02 0.00 0.00 176.95 178.57 3g0c s TYR 526 N -1.85 0.44 0.00 -1.98 -0.85 0.64 -1.50 117.35 112.25 3g0c s TYR 526 Ca 0.52 -0.95 0.04 0.00 -0.52 0.00 0.00 57.07 56.16 3g0c s TYR 526 Cb -0.13 -0.32 -0.01 0.00 0.38 0.00 0.00 41.96 41.88 3g0c s TYR 526 CO 0.18 -0.40 -0.11 1.14 -1.52 0.00 0.00 175.55 174.84 3g0c s GLN 527 N -3.76 0.85 -0.12 -3.49 -2.07 -0.55 -1.80 119.66 108.72 3g0c s GLN 527 Ca 0.05 -0.48 0.02 0.00 -1.82 0.00 0.00 55.36 53.14 3g0c s GLN 527 Cb 0.06 -0.82 0.01 0.00 -1.09 0.00 0.00 33.01 31.17 3g0c s GLN 527 CO -0.10 0.22 -0.20 -1.64 -1.32 0.00 0.00 175.29 172.25 3g0c s MET 528 N -0.50 2.76 -0.43 9.60 -1.94 0.17 -1.59 119.30 127.37 3g0c s MET 528 Ca 0.03 -0.76 -0.24 0.00 -1.71 0.00 0.00 55.69 53.01 3g0c s MET 528 Cb -0.05 -2.23 0.02 0.00 2.01 0.00 0.00 34.83 34.58 3g0c s MET 528 CO -0.00 -0.01 0.81 0.42 -0.01 0.00 0.00 175.02 176.24 3g0c s ILE 529 N 0.81 4.63 -0.14 2.53 -1.09 -0.38 -0.67 121.20 126.88 3g0c s ILE 529 Ca -0.08 0.62 -0.06 0.00 -2.23 0.00 0.00 60.65 58.89 3g0c s ILE 529 Cb -0.16 -4.32 -0.04 0.00 -1.58 0.00 0.00 42.46 36.37 3g0c s ILE 529 CO -0.01 -0.66 0.08 -0.76 -1.23 0.00 0.00 174.94 172.36 3g0c s LEU 530 N 3.34 4.00 0.68 2.97 1.43 0.51 -2.45 118.68 129.16 3g0c s LEU 530 Ca 0.32 0.24 -0.17 0.00 -1.03 0.00 0.00 54.13 53.49 3g0c s LEU 530 Cb -0.12 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 3g0c s LEU 530 CO 0.22 0.30 0.94 -2.65 0.23 0.00 0.00 176.35 175.38 3g0c n PRO 531 N 2.73 0.63 -1.67 1.29 -0.02 -1.26 -1.73 135.00 134.97 3g0c n PRO 531 Ca -0.18 0.26 -0.38 0.00 -2.02 0.00 0.00 63.50 61.19 3g0c n PRO 531 Cb 0.53 -2.18 0.05 0.00 -0.02 0.00 0.00 33.50 31.89 3g0c n PRO 531 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3g0c n PRO 532 N -1.51 1.10 -3.91 0.52 -0.04 -1.26 -2.53 135.00 127.37 3g0c n PRO 532 Ca 0.13 0.42 -0.29 0.00 -0.04 0.00 0.00 63.50 63.72 3g0c n PRO 532 Cb 0.49 -2.33 0.02 0.00 -0.04 0.00 0.00 33.50 31.64 3g0c n PRO 532 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3g0c n HIS 533 N -1.63 -2.15 -1.68 0.54 8.25 -1.26 -4.86 115.22 112.43 3g0c n HIS 533 Ca 0.14 0.88 -0.45 0.00 -0.26 0.00 0.00 57.72 58.03 3g0c n HIS 533 Cb 0.47 -3.95 -0.04 0.00 1.12 0.00 0.00 29.99 27.59 3g0c n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3g0c n PHE 534 N -4.57 2.40 -4.06 4.41 7.35 -1.05 -4.99 117.46 116.95 3g0c n PHE 534 Ca -0.04 0.24 -0.32 0.00 -0.76 0.00 0.00 57.45 56.57 3g0c n PHE 534 Cb 0.56 -2.56 -0.15 0.00 0.35 0.00 0.00 39.48 37.68 3g0c n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3g0c s ASP 535 N 0.85 4.43 0.63 -2.13 -1.08 -1.26 -5.00 116.67 113.12 3g0c s ASP 535 Ca 0.76 -1.42 0.32 0.00 -0.52 0.00 0.00 52.55 51.69 3g0c s ASP 535 Cb -0.63 -1.53 1.77 0.00 -1.46 0.00 0.00 42.92 41.07 3g0c s ASP 535 CO 0.39 -0.20 2.06 0.11 0.52 0.00 0.00 175.17 178.05 3g0c h LYS 536 N 7.77 0.00 0.00 4.34 1.57 -1.97 -2.66 116.57 125.62 3g0c h LYS 536 Ca -0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3g0c h LYS 536 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.35 3g0c h LYS 536 CO 0.46 0.00 -0.62 -1.13 -0.57 0.00 0.00 179.45 177.59 3g0c n SER 537 N -3.30 0.58 -4.87 0.86 3.41 -1.26 -4.35 113.62 104.69 3g0c n SER 537 Ca 0.00 -0.13 -0.21 0.00 -0.26 0.00 0.00 58.87 58.27 3g0c n SER 537 Cb 0.34 0.30 -0.03 0.00 -0.26 0.00 0.00 64.21 64.56 3g0c n SER 537 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3g0c s LYS 538 N -3.08 2.76 -0.25 4.33 -2.85 -1.00 -5.01 119.74 114.63 3g0c s LYS 538 Ca 0.08 -1.28 -0.10 0.00 -1.00 0.00 0.00 55.97 53.68 3g0c s LYS 538 Cb 0.16 -2.51 -0.04 0.00 -2.06 0.00 0.00 37.83 33.37 3g0c s LYS 538 CO 0.72 0.07 0.14 0.15 0.10 0.00 0.00 175.35 176.54 3g0c s LYS 539 N -4.02 3.91 0.10 1.78 -0.14 -1.26 -4.46 119.74 115.64 3g0c s LYS 539 Ca 0.42 -0.35 0.03 0.00 -1.36 0.00 0.00 55.97 54.71 3g0c s LYS 539 Cb -0.06 -3.51 -0.04 0.00 -1.68 0.00 0.00 37.83 32.54 3g0c s LYS 539 CO 0.27 -0.09 0.15 0.71 -0.76 0.00 0.00 175.35 175.63 3g0c s TYR 540 N 1.44 3.29 0.60 3.18 2.02 -0.68 -4.54 117.35 122.67 3g0c s TYR 540 Ca 0.07 0.10 -0.17 0.00 -0.37 0.00 0.00 57.07 56.69 3g0c s TYR 540 Cb -0.15 -1.63 -0.03 0.00 -0.40 0.00 0.00 41.96 39.75 3g0c s TYR 540 CO 0.07 0.54 1.11 -1.25 -1.57 0.00 0.00 175.55 174.44 3g0c s PRO 541 N -2.70 3.09 -0.04 -1.71 0.04 -1.26 -0.51 135.00 131.92 3g0c s PRO 541 Ca 0.32 1.46 0.03 0.00 0.04 0.00 0.00 61.00 62.84 3g0c s PRO 541 Cb -0.12 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.45 3g0c s PRO 541 CO 0.24 -1.04 -0.11 -1.17 0.04 0.00 0.00 177.00 174.97 3g0c s LEU 542 N -4.39 1.75 -0.17 -3.56 0.20 -0.76 -1.43 118.68 110.33 3g0c s LEU 542 Ca 0.69 -0.23 -0.02 0.00 0.69 0.00 0.00 54.13 55.26 3g0c s LEU 542 Cb -0.21 -0.65 -0.02 0.00 -0.43 0.00 0.00 46.19 44.88 3g0c s LEU 542 CO 0.35 0.07 -0.07 -0.22 -0.29 0.00 0.00 176.35 176.18 3g0c s LEU 543 N 0.28 2.92 -0.28 -0.68 2.96 0.11 -0.78 118.68 123.21 3g0c s LEU 543 Ca -0.05 -0.30 -0.24 0.00 -0.22 0.00 0.00 54.13 53.31 3g0c s LEU 543 Cb -0.11 -1.70 -0.00 0.00 0.50 0.00 0.00 46.19 44.88 3g0c s LEU 543 CO 0.01 0.09 0.81 -0.22 -1.32 0.00 0.00 176.35 175.72 3g0c s LEU 544 N 0.79 4.07 -0.25 -0.68 2.96 0.75 -0.45 118.68 125.88 3g0c s LEU 544 Ca -0.03 0.82 -0.12 0.00 -0.22 0.00 0.00 54.13 54.58 3g0c s LEU 544 Cb -0.15 -3.12 -0.05 0.00 0.50 0.00 0.00 46.19 43.37 3g0c s LEU 544 CO 0.01 -0.58 0.25 -0.62 -1.32 0.00 0.00 176.35 174.10 3g0c s ASP 545 N 1.51 6.17 -0.04 3.68 3.68 0.29 -1.09 116.67 130.87 3g0c s ASP 545 Ca 0.33 0.18 0.05 0.00 2.13 0.00 0.00 52.55 55.24 3g0c s ASP 545 Cb -0.15 -2.15 -0.01 0.00 -1.45 0.00 0.00 42.92 39.17 3g0c s ASP 545 CO 0.10 -0.04 -0.19 -0.69 0.13 0.00 0.00 175.17 174.49 3g0c s VAL 546 N 1.48 1.55 0.00 1.11 1.01 -0.64 -4.28 120.40 120.63 3g0c s VAL 546 Ca 0.11 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.30 3g0c s VAL 546 Cb -0.15 -1.32 0.00 0.00 0.00 0.00 0.00 36.38 34.91 3g0c s VAL 546 CO 0.08 0.44 0.00 0.00 0.00 0.00 0.00 175.10 175.62 3g0c n TYR 547 N 3.08 0.00 -1.68 5.22 9.36 -1.26 -4.18 117.16 127.69 3g0c n TYR 547 Ca -0.18 0.00 -0.19 0.00 3.32 0.00 0.00 57.90 60.86 3g0c n TYR 547 Cb 0.53 0.04 -0.07 0.00 -0.63 0.00 0.00 39.34 39.21 3g0c n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3g0c n ALA 548 N -2.35 -0.33 -1.91 2.98 0.00 -1.26 -3.26 120.51 114.38 3g0c n ALA 548 Ca 0.00 0.27 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 3g0c n ALA 548 Cb 0.00 -1.91 0.11 0.00 0.00 0.00 0.00 19.45 17.65 3g0c n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3g0c s GLY 549 N -2.69 1.64 0.02 0.00 0.00 -1.26 -4.88 107.32 100.14 3g0c s GLY 549 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 44.72 43.64 3g0c s GLY 549 CO 0.00 -0.24 1.95 -4.14 0.00 0.00 0.00 173.10 170.68 3g0c s PRO 550 N -5.63 4.11 -0.37 2.90 0.02 -1.26 -1.19 135.00 133.57 3g0c s PRO 550 Ca 0.65 2.56 0.00 0.00 0.02 0.00 0.00 61.00 64.22 3g0c s PRO 550 Cb -0.09 -4.16 0.00 0.00 0.02 0.00 0.00 34.50 30.27 3g0c s PRO 550 CO 0.50 -0.99 0.00 0.00 -0.33 0.00 0.00 177.00 176.17 3g0c s SER 552 N -2.86 5.57 -0.26 0.00 1.04 -0.34 -4.00 113.70 112.86 3g0c s SER 552 Ca 0.00 1.01 -0.02 0.00 0.48 0.00 0.00 55.95 57.42 3g0c s SER 552 Cb 0.00 -1.90 0.15 0.00 0.10 0.00 0.00 66.02 64.37 3g0c s SER 552 CO 0.00 -1.19 0.45 -1.58 0.98 0.00 0.00 173.24 171.89 3g0c s GLN 553 N -5.21 0.42 0.00 4.02 0.74 -1.26 -1.22 119.66 117.15 3g0c s GLN 553 Ca 0.56 0.66 0.12 0.00 0.05 0.00 0.00 55.36 56.75 3g0c s GLN 553 Cb -0.11 -0.16 0.01 0.00 1.10 0.00 0.00 33.01 33.85 3g0c s GLN 553 CO 0.49 -0.65 0.72 1.63 -0.55 0.00 0.00 175.29 176.94 3g0c n LYS 554 N 5.38 1.79 -3.61 1.67 4.76 -1.26 -4.88 118.16 122.01 3g0c n LYS 554 Ca -0.03 -0.74 -0.40 0.00 -2.87 0.00 0.00 58.31 54.27 3g0c n LYS 554 Cb 0.50 -1.15 -0.10 0.00 -1.84 0.00 0.00 35.03 32.44 3g0c n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g0c s ALA 555 N -1.43 3.27 0.37 7.82 0.00 -1.26 -4.74 121.76 125.78 3g0c s ALA 555 Ca 0.10 -1.98 -0.06 0.00 0.00 0.00 0.00 51.96 50.02 3g0c s ALA 555 Cb 0.09 -2.61 0.02 0.00 0.00 0.00 0.00 23.12 20.63 3g0c s ALA 555 CO 0.27 -1.55 0.59 0.16 0.00 0.00 0.00 175.76 175.24 3g0c s ASP 556 N 1.89 0.67 0.00 0.00 1.47 -1.26 -4.37 116.67 115.08 3g0c s ASP 556 Ca 0.02 -1.41 0.23 0.00 1.18 0.00 0.00 52.55 52.58 3g0c s ASP 556 Cb -0.22 0.74 0.50 0.00 -0.34 0.00 0.00 42.92 43.61 3g0c s ASP 556 CO 0.04 -1.45 1.45 0.35 0.68 0.00 0.00 175.17 176.23 3g0c n THR 557 N -0.57 0.64 -2.10 2.11 -2.24 -1.10 -4.97 114.28 106.04 3g0c n THR 557 Ca -0.02 -0.81 -0.41 0.00 -2.27 0.00 0.00 64.05 60.54 3g0c n THR 557 Cb 0.61 0.81 -0.02 0.00 -2.10 0.00 0.00 70.33 69.63 3g0c n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3g0c s VAL 558 N -1.36 2.71 -0.13 2.28 1.01 -1.26 -1.43 120.40 122.21 3g0c s VAL 558 Ca 0.42 0.70 -0.21 0.00 0.00 0.00 0.00 61.98 62.89 3g0c s VAL 558 Cb 0.24 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 3g0c s VAL 558 CO 0.32 0.16 0.61 0.12 0.00 0.00 0.00 175.10 176.31 3g0c s PHE 559 N -0.99 3.48 -0.02 5.22 5.36 0.12 -4.88 117.98 126.28 3g0c s PHE 559 Ca 0.50 1.02 0.04 0.00 -0.96 0.00 0.00 56.93 57.53 3g0c s PHE 559 Cb -0.40 -2.73 -0.01 0.00 -0.34 0.00 0.00 43.02 39.54 3g0c s PHE 559 CO 0.52 0.01 -0.15 1.03 -1.46 0.00 0.00 175.22 175.17 3g0c s ARG 560 N 1.18 1.31 -0.58 10.12 0.52 -1.26 -4.90 118.95 125.34 3g0c s ARG 560 Ca 0.31 -0.52 -0.05 0.00 -0.52 0.00 0.00 55.73 54.95 3g0c s ARG 560 Cb -0.16 -1.22 0.15 0.00 0.52 0.00 0.00 34.95 34.24 3g0c s ARG 560 CO 0.13 0.27 0.41 -0.51 0.02 0.00 0.00 175.30 175.61 3g0c s LEU 561 N -0.17 5.45 0.00 2.53 1.43 -1.26 -4.83 118.68 121.83 3g0c s LEU 561 Ca 0.02 -2.53 0.00 0.00 -1.03 0.00 0.00 54.13 50.59 3g0c s LEU 561 Cb -0.08 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.24 3g0c s LEU 561 CO 0.00 -0.47 0.00 -0.46 0.23 0.00 0.00 176.35 175.65 3g0c n ASN 562 N 3.97 0.13 -0.32 2.29 0.23 -1.26 -5.01 115.26 115.29 3g0c n ASN 562 Ca 0.04 -0.47 0.03 0.00 -0.53 0.00 0.00 54.58 53.65 3g0c n ASN 562 Cb 0.40 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.32 3g0c n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 3g0c h TRP 563 N 0.47 1.09 -0.23 -2.53 7.01 -1.97 -2.07 115.95 117.72 3g0c h TRP 563 Ca 0.00 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 60.99 3g0c h TRP 563 Cb 0.00 -0.36 -0.01 0.00 -2.10 0.00 0.00 29.16 26.69 3g0c h TRP 563 CO 0.00 0.58 -0.04 0.00 -2.79 0.00 0.00 178.44 176.19 3g0c h ALA 564 N 1.49 1.49 -0.55 2.65 0.00 -1.97 -2.10 119.26 120.28 3g0c h ALA 564 Ca 0.40 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 3g0c h ALA 564 Cb 0.16 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3g0c h ALA 564 CO -0.15 0.36 0.10 1.15 0.00 0.00 0.00 179.25 180.72 3g0c h THR 565 N 0.35 1.25 0.29 0.00 2.02 -1.70 -1.54 112.91 113.58 3g0c h THR 565 Ca 0.08 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 3g0c h THR 565 Cb 0.30 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3g0c h THR 565 CO 0.01 0.34 -0.14 0.22 0.37 0.00 0.00 175.52 176.32 3g0c h TYR 566 N 0.79 -0.36 -0.99 3.16 5.03 -1.35 -0.97 116.97 122.27 3g0c h TYR 566 Ca 0.17 -0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.57 3g0c h TYR 566 Cb 0.39 0.12 -0.08 0.00 1.55 0.00 0.00 36.73 38.71 3g0c h TYR 566 CO 0.03 -0.21 0.63 -0.07 -1.32 0.00 0.00 178.16 177.22 3g0c h LEU 567 N -0.40 0.96 0.31 2.82 3.38 -1.21 0.31 115.31 121.48 3g0c h LEU 567 Ca -0.04 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3g0c h LEU 567 Cb 0.31 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3g0c h LEU 567 CO 0.07 0.56 -0.15 0.00 0.09 0.00 0.00 178.44 179.00 3g0c h ALA 568 N 1.51 -0.42 0.78 1.53 0.00 -1.27 -0.83 119.26 120.56 3g0c h ALA 568 Ca 0.47 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 3g0c h ALA 568 Cb 0.36 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3g0c h ALA 568 CO -0.22 -0.42 -0.48 1.03 0.00 0.00 0.00 179.25 179.16 3g0c h SER 569 N -1.05 -1.23 0.00 0.00 0.87 -0.89 -1.52 113.55 109.73 3g0c h SER 569 Ca -0.04 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3g0c h SER 569 Cb 0.43 0.36 -0.00 0.00 -0.44 0.00 0.00 62.40 62.75 3g0c h SER 569 CO 0.07 -0.74 -0.01 0.74 -0.53 0.00 0.00 176.83 176.36 3g0c h THR 570 N -1.19 1.67 -0.02 2.23 2.02 -0.47 -3.40 112.91 113.75 3g0c h THR 570 Ca -0.10 -2.25 0.00 0.00 0.77 0.00 0.00 66.41 64.82 3g0c h THR 570 Cb 0.95 3.15 0.00 0.00 -1.74 0.00 0.00 68.15 70.52 3g0c h THR 570 CO 0.10 0.57 -0.09 -0.62 0.37 0.00 0.00 175.52 175.84 3g0c n GLU 571 N -4.62 1.72 -2.31 6.66 -0.58 -1.03 -4.96 120.64 115.52 3g0c n GLU 571 Ca -0.09 -1.23 -0.19 0.00 -0.42 0.00 0.00 57.16 55.22 3g0c n GLU 571 Cb 0.45 -1.47 -0.01 0.00 -0.57 0.00 0.00 31.44 29.83 3g0c n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3g0c n ASN 572 N 0.43 -5.56 -4.77 1.62 5.03 -0.48 -4.94 115.26 106.60 3g0c n ASN 572 Ca 0.15 0.02 -0.37 0.00 0.87 0.00 0.00 54.58 55.25 3g0c n ASN 572 Cb 0.45 -4.61 -0.07 0.00 -1.02 0.00 0.00 39.78 34.53 3g0c n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3g0c s ILE 573 N -2.95 5.29 -0.15 2.41 1.01 -0.44 -4.50 121.20 121.87 3g0c s ILE 573 Ca 0.00 0.53 -0.29 0.00 0.00 0.00 0.00 60.65 60.89 3g0c s ILE 573 Cb 0.00 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 3g0c s ILE 573 CO 0.00 0.46 1.03 -0.63 0.00 0.00 0.00 174.94 175.80 3g0c s ILE 574 N -0.05 4.72 -0.25 2.92 1.01 -0.51 -3.48 121.20 125.57 3g0c s ILE 574 Ca 0.17 2.02 -0.05 0.00 0.00 0.00 0.00 60.65 62.79 3g0c s ILE 574 Cb -0.13 -4.30 -0.00 0.00 0.01 0.00 0.00 42.46 38.04 3g0c s ILE 574 CO 0.05 -0.06 0.00 0.54 0.00 0.00 0.00 174.94 175.47 3g0c s VAL 575 N 2.45 3.56 0.23 2.92 0.11 -1.03 0.06 120.40 128.70 3g0c s VAL 575 Ca 0.47 -0.60 0.10 0.00 -2.93 0.00 0.00 61.98 59.02 3g0c s VAL 575 Cb -0.17 -2.72 -0.04 0.00 -1.53 0.00 0.00 36.38 31.91 3g0c s VAL 575 CO 0.14 0.28 -0.11 0.00 -3.33 0.00 0.00 175.10 172.08 3g0c s ALA 576 N 1.47 2.92 0.02 1.54 0.00 0.40 -1.25 121.76 126.86 3g0c s ALA 576 Ca 0.04 -1.64 -0.01 0.00 0.00 0.00 0.00 51.96 50.36 3g0c s ALA 576 Cb -0.16 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 3g0c s ALA 576 CO -0.01 0.36 -0.02 -1.12 0.00 0.00 0.00 175.76 174.97 3g0c s SER 577 N -3.22 0.25 -0.05 0.00 0.01 -0.62 0.11 113.70 110.17 3g0c s SER 577 Ca 0.28 -0.52 -0.02 0.00 1.31 0.00 0.00 55.95 56.99 3g0c s SER 577 Cb -0.07 0.12 0.04 0.00 0.21 0.00 0.00 66.02 66.31 3g0c s SER 577 CO 0.16 -0.33 0.11 0.12 0.41 0.00 0.00 173.24 173.70 3g0c s PHE 578 N -1.68 -0.10 -0.51 2.43 5.36 -1.26 -1.48 117.98 120.75 3g0c s PHE 578 Ca -0.14 0.38 -0.17 0.00 -0.96 0.00 0.00 56.93 56.04 3g0c s PHE 578 Cb -0.08 -0.16 0.08 0.00 -0.34 0.00 0.00 43.02 42.52 3g0c s PHE 578 CO -0.02 -0.15 0.53 -0.51 -1.46 0.00 0.00 175.22 173.61 3g0c s ASP 579 N 1.25 6.18 0.00 6.13 1.01 -0.56 -4.80 116.67 125.88 3g0c s ASP 579 Ca -0.08 -1.26 0.00 0.00 0.71 0.00 0.00 52.55 51.92 3g0c s ASP 579 Cb -0.12 -2.24 0.00 0.00 1.01 0.00 0.00 42.92 41.57 3g0c s ASP 579 CO -0.05 -0.82 0.00 0.61 0.21 0.00 0.00 175.17 175.13 3g0c n GLY 580 N 5.21 2.02 3.73 0.21 0.00 -1.26 -3.97 105.19 111.13 3g0c n GLY 580 Ca -0.10 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 3g0c n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g0c s ARG 581 N 3.92 4.42 0.00 1.61 0.52 -1.26 -2.59 118.95 125.57 3g0c s ARG 581 Ca 0.00 1.94 0.00 0.00 -0.52 0.00 0.00 55.73 57.15 3g0c s ARG 581 Cb 0.00 -3.25 0.00 0.00 0.52 0.00 0.00 34.95 32.22 3g0c s ARG 581 CO 0.00 -0.24 0.00 0.41 0.02 0.00 0.00 175.30 175.49 3g0c n GLY 582 N 2.73 1.31 3.86 -3.53 0.00 -0.11 -3.93 105.19 105.52 3g0c n GLY 582 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3g0c n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g0c s SER 583 N -1.81 5.04 0.46 1.61 1.04 -1.07 0.34 113.70 119.31 3g0c s SER 583 Ca 0.00 1.16 0.07 0.00 0.48 0.00 0.00 55.95 57.66 3g0c s SER 583 Cb 0.00 -1.91 0.00 0.00 0.10 0.00 0.00 66.02 64.21 3g0c s SER 583 CO 0.00 -1.60 0.41 -0.83 0.98 0.00 0.00 173.24 172.20 3g0c s GLY 584 N -4.22 2.17 -1.19 7.32 0.00 -0.35 -3.55 107.32 107.49 3g0c s GLY 584 Ca 0.59 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 43.54 3g0c s GLY 584 CO 0.52 -1.76 0.00 -1.72 0.00 0.00 0.00 173.10 170.14 3g0c n TYR 585 N -1.65 -0.00 -0.55 1.90 4.02 -1.26 -4.83 117.16 114.79 3g0c n TYR 585 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 3g0c n TYR 585 Cb 0.62 -2.10 0.00 0.00 -0.02 0.00 0.00 39.34 37.84 3g0c n TYR 585 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3g0c n GLN 586 N -2.67 1.09 0.00 -0.72 6.02 -1.26 -4.56 117.38 115.28 3g0c n GLN 586 Ca -0.11 -0.85 0.00 0.00 -0.01 0.00 0.00 57.00 56.03 3g0c n GLN 586 Cb 0.37 -0.73 0.00 0.00 1.02 0.00 0.00 30.24 30.90 3g0c n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g0c n GLY 587 N -0.19 2.17 0.16 1.08 0.00 -1.26 -4.76 105.19 102.39 3g0c n GLY 587 Ca 0.00 -1.94 0.02 0.00 0.00 0.00 0.00 46.02 44.10 3g0c n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g0c h ASP 588 N 0.00 0.00 -0.57 1.61 3.32 -1.12 -1.63 116.42 118.03 3g0c h ASP 588 Ca 0.00 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.15 3g0c h ASP 588 Cb 0.00 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.47 3g0c h ASP 588 CO 0.00 0.49 0.13 0.50 -1.72 0.00 0.00 179.24 178.64 3g0c h LYS 589 N 0.00 0.26 0.03 3.56 1.63 -1.89 0.14 116.57 120.30 3g0c h LYS 589 Ca -0.00 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3g0c h LYS 589 Cb 0.96 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.53 3g0c h LYS 589 CO 0.06 0.17 -0.01 0.82 -3.45 0.00 0.00 179.45 177.04 3g0c h ILE 590 N 0.27 1.41 -0.58 2.00 2.04 -1.83 -3.31 117.51 117.50 3g0c h ILE 590 Ca 0.29 -1.73 -0.05 0.00 1.00 0.00 0.00 64.86 64.37 3g0c h ILE 590 Cb 0.42 2.52 -0.03 0.00 -0.74 0.00 0.00 36.82 38.99 3g0c h ILE 590 CO -0.37 0.42 0.16 -0.03 0.00 0.00 0.00 178.15 178.34 3g0c h MET 591 N -0.84 0.89 -0.01 2.37 4.05 -1.03 -0.19 114.93 120.18 3g0c h MET 591 Ca -0.00 -0.18 0.00 0.00 -0.28 0.00 0.00 59.70 59.24 3g0c h MET 591 Cb 0.72 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.38 3g0c h MET 591 CO 0.01 0.78 -0.13 0.72 0.23 0.00 0.00 176.91 178.52 3g0c n HIS 592 N -4.28 0.00 0.27 1.39 8.25 0.46 -4.25 115.22 117.06 3g0c n HIS 592 Ca 0.04 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.66 3g0c n HIS 592 Cb 0.22 -0.10 0.89 0.00 1.12 0.00 0.00 29.99 32.11 3g0c n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3g0c h ALA 593 N 3.86 1.62 -0.62 -1.41 0.00 -1.58 0.06 119.26 121.19 3g0c h ALA 593 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g0c h ALA 593 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3g0c h ALA 593 CO 0.00 -0.10 0.00 0.44 0.00 0.00 0.00 179.25 179.59 3g0c n ILE 594 N -3.84 2.02 -1.68 0.00 -0.00 -1.26 -4.94 119.36 109.66 3g0c n ILE 594 Ca -0.01 -1.26 -0.45 0.00 -0.00 0.00 0.00 62.75 61.02 3g0c n ILE 594 Cb 0.16 0.05 -0.04 0.00 -0.00 0.00 0.00 39.64 39.81 3g0c n ILE 594 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 3g0c n ASN 595 N 0.97 3.70 -0.42 7.28 4.05 0.00 -1.21 115.26 129.64 3g0c n ASN 595 Ca 0.26 0.99 -0.06 0.00 0.45 0.00 0.00 54.58 56.22 3g0c n ASN 595 Cb 0.94 -1.47 -0.02 0.00 1.23 0.00 0.00 39.78 40.46 3g0c n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3g0c n ARG 596 N 5.78 -1.29 -2.79 1.20 1.74 0.14 -4.85 116.66 116.58 3g0c n ARG 596 Ca 0.19 0.60 -0.02 0.00 -0.77 0.00 0.00 57.85 57.86 3g0c n ARG 596 Cb 0.34 -4.70 0.05 0.00 -1.02 0.00 0.00 32.46 27.12 3g0c n ARG 596 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3g0c n ARG 597 N -1.02 1.68 -1.68 5.56 5.12 -0.35 -4.92 116.66 121.05 3g0c n ARG 597 Ca -0.06 -3.49 -0.45 0.00 -1.93 0.00 0.00 57.85 51.93 3g0c n ARG 597 Cb 0.41 -1.57 -0.03 0.00 -1.16 0.00 0.00 32.46 30.11 3g0c n ARG 597 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3g0c n LEU 598 N -0.52 3.20 0.00 0.55 4.32 -1.22 -2.70 117.00 120.63 3g0c n LEU 598 Ca 0.08 1.14 0.00 0.00 -0.02 0.00 0.00 56.01 57.21 3g0c n LEU 598 Cb 0.81 -1.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.17 3g0c n LEU 598 CO 0.11 -0.42 0.00 0.61 -1.22 0.00 0.00 177.39 176.47 3g0c n GLY 599 N 2.29 0.73 0.00 -0.72 0.00 -1.26 -4.88 105.19 101.35 3g0c n GLY 599 Ca 0.12 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3g0c n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g0c n THR 600 N -2.46 0.00 -0.16 2.61 -2.24 -1.10 -4.73 114.28 106.20 3g0c n THR 600 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 3g0c n THR 600 Cb 0.00 -0.11 -0.00 0.00 -2.10 0.00 0.00 70.33 68.13 3g0c n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3g0c h PHE 601 N 0.00 0.80 -0.71 4.78 0.04 -1.92 0.46 116.94 120.40 3g0c h PHE 601 Ca 0.00 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.64 3g0c h PHE 601 Cb 0.00 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 37.89 3g0c h PHE 601 CO 0.00 0.75 0.37 1.05 -0.60 0.00 0.00 178.31 179.88 3g0c h GLU 602 N 0.63 0.99 0.06 1.51 9.09 -1.91 0.43 114.58 125.37 3g0c h GLU 602 Ca 0.14 -0.12 -0.00 0.00 0.05 0.00 0.00 59.36 59.43 3g0c h GLU 602 Cb 0.37 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 3g0c h GLU 602 CO 0.01 0.74 -0.03 0.28 0.05 0.00 0.00 179.01 180.06 3g0c h VAL 603 N 0.99 1.12 -0.51 -1.06 2.07 -1.76 -2.93 116.25 114.17 3g0c h VAL 603 Ca 0.25 -0.58 0.04 0.00 0.82 0.00 0.00 66.70 67.23 3g0c h VAL 603 Cb 0.05 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3g0c h VAL 603 CO -0.04 0.15 0.34 -0.33 0.02 0.00 0.00 177.57 177.70 3g0c h GLU 604 N -0.33 0.54 0.00 1.57 5.08 -0.14 -2.65 114.58 118.65 3g0c h GLU 604 Ca -0.01 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 3g0c h GLU 604 Cb 0.30 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3g0c h GLU 604 CO 0.01 0.36 -0.41 -0.44 -1.00 0.00 0.00 179.01 177.53 3g0c h ASP 605 N 0.55 0.00 -0.19 1.42 3.32 -0.12 -1.73 116.42 119.68 3g0c h ASP 605 Ca 0.21 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.07 3g0c h ASP 605 Cb 0.13 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 3g0c h ASP 605 CO -0.05 0.41 -0.57 1.56 -1.72 0.00 0.00 179.24 178.87 3g0c h GLN 606 N 0.00 0.79 -0.35 3.56 1.08 -1.29 0.15 115.11 119.05 3g0c h GLN 606 Ca -0.00 -0.51 -0.03 0.00 -1.45 0.00 0.00 58.65 56.66 3g0c h GLN 606 Cb 1.16 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.64 3g0c h GLN 606 CO 0.05 1.14 0.10 0.82 -0.95 0.00 0.00 178.83 179.99 3g0c h ILE 607 N 0.60 1.21 -0.53 2.54 2.04 -1.36 -2.45 117.51 119.56 3g0c h ILE 607 Ca 0.01 -0.70 -0.07 0.00 1.00 0.00 0.00 64.86 65.10 3g0c h ILE 607 Cb 1.16 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 3g0c h ILE 607 CO 0.12 0.24 0.06 -0.08 0.00 0.00 0.00 178.15 178.49 3g0c h GLU 608 N 0.42 0.86 -0.28 2.37 4.57 -1.30 -2.09 114.58 119.12 3g0c h GLU 608 Ca 0.11 -0.21 0.06 0.00 -1.18 0.00 0.00 59.36 58.14 3g0c h GLU 608 Cb 0.27 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 28.68 3g0c h GLU 608 CO -0.00 0.82 -0.13 0.00 -1.18 0.00 0.00 179.01 178.52 3g0c h ALA 609 N 1.25 0.11 -0.76 2.92 0.00 -0.77 -0.48 119.26 121.53 3g0c h ALA 609 Ca 0.16 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3g0c h ALA 609 Cb 0.40 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 3g0c h ALA 609 CO 0.01 -0.52 0.50 0.00 0.00 0.00 0.00 179.25 179.23 3g0c h ALA 610 N 1.16 0.97 -0.20 0.00 0.00 -1.09 0.40 119.26 120.50 3g0c h ALA 610 Ca 0.15 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3g0c h ALA 610 Cb 0.30 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3g0c h ALA 610 CO -0.34 0.35 0.01 0.00 0.00 0.00 0.00 179.25 179.27 3g0c h ARG 611 N 1.00 0.28 -0.20 0.00 3.08 -0.87 -1.64 114.38 116.04 3g0c h ARG 611 Ca 0.28 -0.04 -0.21 0.00 0.07 0.00 0.00 59.98 60.08 3g0c h ARG 611 Cb -0.08 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 29.92 3g0c h ARG 611 CO -0.07 0.30 -0.70 1.96 -1.07 0.00 0.00 179.97 180.39 3g0c h GLN 612 N 0.28 0.82 -0.24 0.04 1.08 -0.17 -2.38 115.11 114.54 3g0c h GLN 612 Ca 0.07 -0.62 -0.03 0.00 -1.45 0.00 0.00 58.65 56.62 3g0c h GLN 612 Cb 0.18 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 3g0c h GLN 612 CO 0.00 1.23 0.03 0.74 -0.95 0.00 0.00 178.83 179.89 3g0c h PHE 613 N 0.58 0.43 -0.71 2.96 0.04 -0.55 -2.57 116.94 117.13 3g0c h PHE 613 Ca -0.03 -0.06 0.05 0.00 2.80 0.00 0.00 57.97 60.72 3g0c h PHE 613 Cb 1.33 -0.12 -0.05 0.00 2.20 0.00 0.00 35.95 39.31 3g0c h PHE 613 CO 0.08 0.53 0.43 0.66 -0.60 0.00 0.00 178.31 179.41 3g0c h SER 614 N 0.20 0.68 0.01 2.17 4.64 -1.37 -2.30 113.55 117.58 3g0c h SER 614 Ca 0.07 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3g0c h SER 614 Cb 0.34 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3g0c h SER 614 CO 0.01 0.45 0.00 0.29 -0.87 0.00 0.00 176.83 176.71 3g0c n LYS 615 N -4.70 0.27 0.02 4.77 5.02 -0.90 -0.43 118.16 122.21 3g0c n LYS 615 Ca 0.09 0.01 0.12 0.00 -2.02 0.00 0.00 58.31 56.50 3g0c n LYS 615 Cb 0.13 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 33.82 3g0c n LYS 615 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3g0c n MET 616 N -1.01 0.12 -0.02 1.97 2.81 -0.86 -4.99 117.12 115.13 3g0c n MET 616 Ca 0.06 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 3g0c n MET 616 Cb 0.03 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 30.98 3g0c n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g0c n GLY 617 N 1.44 0.79 1.06 3.03 0.00 0.43 -4.91 105.19 107.03 3g0c n GLY 617 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.06 3g0c n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3g0c n PHE 618 N -2.00 1.04 -4.82 1.61 -1.74 -1.26 -4.73 117.46 105.55 3g0c n PHE 618 Ca 0.00 -1.38 -0.30 0.00 -0.56 0.00 0.00 57.45 55.21 3g0c n PHE 618 Cb 0.00 -0.44 -0.17 0.00 1.52 0.00 0.00 39.48 40.40 3g0c n PHE 618 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 3g0c s VAL 619 N -3.12 1.75 -0.43 1.97 1.01 -1.26 -1.68 120.40 118.64 3g0c s VAL 619 Ca 0.44 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 3g0c s VAL 619 Cb 0.38 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 35.23 3g0c s VAL 619 CO 0.03 0.49 1.35 -0.62 0.00 0.00 0.00 175.10 176.34 3g0c s ASP 620 N 0.64 6.41 0.00 3.32 3.68 0.34 -4.76 116.67 126.29 3g0c s ASP 620 Ca -0.13 0.74 0.30 0.00 2.13 0.00 0.00 52.55 55.59 3g0c s ASP 620 Cb -0.16 -2.54 1.48 0.00 -1.45 0.00 0.00 42.92 40.24 3g0c s ASP 620 CO 0.04 -1.39 1.99 -0.46 0.13 0.00 0.00 175.17 175.47 3g0c n ASN 621 N 8.59 0.68 0.24 -0.34 0.23 -1.26 -1.96 115.26 121.44 3g0c n ASN 621 Ca 0.15 -1.17 0.14 0.00 -0.53 0.00 0.00 54.58 53.17 3g0c n ASN 621 Cb 0.48 -0.01 0.33 0.00 -2.08 0.00 0.00 39.78 38.51 3g0c n ASN 621 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 3g0c h LYS 622 N 1.05 0.00 -2.54 -3.83 1.57 -1.91 -3.39 116.57 107.51 3g0c h LYS 622 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 3g0c h LYS 622 Cb 0.25 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.15 3g0c h LYS 622 CO 0.00 0.01 -0.75 0.54 -0.57 0.00 0.00 179.45 178.67 3g0c n ARG 623 N -3.10 1.45 -4.55 3.15 1.74 -0.83 -4.77 116.66 109.75 3g0c n ARG 623 Ca 0.03 -4.04 -0.26 0.00 -0.77 0.00 0.00 57.85 52.81 3g0c n ARG 623 Cb 0.46 -1.98 -0.17 0.00 -1.02 0.00 0.00 32.46 29.76 3g0c n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3g0c s ILE 624 N -1.31 1.28 0.36 0.55 1.01 -1.26 -1.83 121.20 120.00 3g0c s ILE 624 Ca 0.32 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.46 3g0c s ILE 624 Cb 0.06 -1.17 -0.05 0.00 0.01 0.00 0.00 42.46 41.30 3g0c s ILE 624 CO -0.13 0.39 0.07 0.00 0.00 0.00 0.00 174.94 175.27 3g0c s ALA 625 N 0.79 2.67 -0.10 9.38 0.00 0.04 -0.75 121.76 133.80 3g0c s ALA 625 Ca -0.12 -1.73 -0.09 0.00 0.00 0.00 0.00 51.96 50.02 3g0c s ALA 625 Cb -0.16 0.62 0.03 0.00 0.00 0.00 0.00 23.12 23.61 3g0c s ALA 625 CO 0.02 -0.29 0.26 -1.50 0.00 0.00 0.00 175.76 174.25 3g0c s ILE 626 N -3.22 -0.00 0.03 0.00 2.07 -1.06 -0.18 121.20 118.84 3g0c s ILE 626 Ca 0.31 0.01 -0.11 0.00 -1.41 0.00 0.00 60.65 59.44 3g0c s ILE 626 Cb 0.07 -0.37 0.01 0.00 0.13 0.00 0.00 42.46 42.30 3g0c s ILE 626 CO 0.14 0.00 0.25 -1.66 -1.91 0.00 0.00 174.94 171.76 3g0c s TRP 627 N 0.20 -0.03 0.11 3.50 1.48 -0.25 -1.78 118.94 122.18 3g0c s TRP 627 Ca -0.01 -0.13 -0.25 0.00 -1.06 0.00 0.00 56.10 54.66 3g0c s TRP 627 Cb -0.02 0.03 0.07 0.00 -1.16 0.00 0.00 33.47 32.39 3g0c s TRP 627 CO -0.00 -0.45 0.79 0.20 -4.06 0.00 0.00 176.95 173.43 3g0c s GLY 628 N -1.98 -0.42 0.09 3.67 0.00 -0.94 -1.63 107.32 106.11 3g0c s GLY 628 Ca -0.06 0.51 0.09 0.00 0.00 0.00 0.00 44.72 45.25 3g0c s GLY 628 CO -0.03 0.16 -0.20 0.86 0.00 0.00 0.00 173.10 173.89 3g0c s TRP 629 N -3.46 2.48 0.00 1.90 -0.11 -1.26 -1.53 118.94 116.96 3g0c s TRP 629 Ca 0.06 -0.30 0.00 0.00 1.22 0.00 0.00 56.10 57.08 3g0c s TRP 629 Cb -0.02 -1.37 0.00 0.00 -1.50 0.00 0.00 33.47 30.58 3g0c s TRP 629 CO -0.06 0.31 0.00 0.43 -4.62 0.00 0.00 176.95 173.01 3g0c n SER 630 N 1.16 0.00 -0.17 5.86 7.64 -0.90 -0.45 113.62 126.77 3g0c n SER 630 Ca -0.16 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.67 3g0c n SER 630 Cb 0.52 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.86 3g0c n SER 630 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3g0c h TYR 631 N 0.00 0.97 -0.79 1.43 3.20 -1.86 -2.46 116.97 117.46 3g0c h TYR 631 Ca 0.00 -0.10 0.03 0.00 3.14 0.00 0.00 58.73 61.79 3g0c h TYR 631 Cb 0.00 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 37.95 3g0c h TYR 631 CO 0.00 0.81 0.52 0.78 -1.64 0.00 0.00 178.16 178.63 3g0c h GLY 632 N 1.02 1.11 1.03 1.82 0.00 -0.74 -0.50 103.07 106.81 3g0c h GLY 632 Ca 0.19 -0.39 -0.08 0.00 0.00 0.00 0.00 47.33 47.05 3g0c h GLY 632 CO 0.00 0.35 0.02 -1.33 0.00 0.00 0.00 176.54 175.58 3g0c h GLY 633 N 0.99 1.03 0.98 4.60 0.00 -1.37 0.11 103.07 109.41 3g0c h GLY 633 Ca 0.31 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 3g0c h GLY 633 CO -0.09 0.68 -0.00 -1.82 0.00 0.00 0.00 176.54 175.32 3g0c h TYR 634 N 0.84 -0.00 -0.64 5.60 5.03 -0.92 -0.54 116.97 126.34 3g0c h TYR 634 Ca 0.16 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.45 3g0c h TYR 634 Cb 0.51 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 38.76 3g0c h TYR 634 CO 0.04 0.02 0.34 0.28 -1.32 0.00 0.00 178.16 177.51 3g0c h VAL 635 N -0.02 1.21 -0.25 1.81 2.07 -1.04 0.13 116.25 120.15 3g0c h VAL 635 Ca -0.00 -0.54 0.05 0.00 0.82 0.00 0.00 66.70 67.03 3g0c h VAL 635 Cb 0.02 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 3g0c h VAL 635 CO 0.00 0.23 -0.09 0.74 0.02 0.00 0.00 177.57 178.47 3g0c h THR 636 N 0.88 0.69 -0.10 2.57 2.02 -0.54 0.21 112.91 118.64 3g0c h THR 636 Ca 0.22 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.40 3g0c h THR 636 Cb 0.06 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 3g0c h THR 636 CO -0.03 0.00 0.06 0.28 0.37 0.00 0.00 175.52 176.20 3g0c h SER 637 N -0.04 0.12 -0.97 4.18 0.02 -0.73 -0.75 113.55 115.38 3g0c h SER 637 Ca 0.13 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 3g0c h SER 637 Cb 0.23 -0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.68 3g0c h SER 637 CO -0.28 0.14 0.63 0.24 -1.14 0.00 0.00 176.83 176.42 3g0c h MET 638 N 0.10 1.16 -0.05 3.45 2.07 -0.32 -0.64 114.93 120.71 3g0c h MET 638 Ca 0.04 -0.07 -0.00 0.00 -2.07 0.00 0.00 59.70 57.59 3g0c h MET 638 Cb 0.04 -0.26 -0.00 0.00 -1.87 0.00 0.00 31.60 29.50 3g0c h MET 638 CO -0.01 0.77 0.02 0.28 1.07 0.00 0.00 176.91 179.04 3g0c h VAL 639 N 1.20 1.16 0.00 -2.22 2.07 -0.17 -2.48 116.25 115.81 3g0c h VAL 639 Ca 0.39 -0.47 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 3g0c h VAL 639 Cb 0.05 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 3g0c h VAL 639 CO -0.13 0.13 -0.11 -0.07 0.02 0.00 0.00 177.57 177.41 3g0c h LEU 640 N -0.10 0.00 -1.59 2.57 3.38 -0.69 -1.79 115.31 117.09 3g0c h LEU 640 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3g0c h LEU 640 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3g0c h LEU 640 CO -0.00 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.25 3g0c n GLY 641 N -0.56 0.81 0.15 0.83 0.00 -0.29 -4.34 105.19 101.79 3g0c n GLY 641 Ca -0.01 -0.56 0.13 0.00 0.00 0.00 0.00 46.02 45.57 3g0c n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g0c h SER 642 N 3.32 0.00 -0.56 1.61 4.64 -0.84 -3.43 113.55 118.29 3g0c h SER 642 Ca 0.00 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 3g0c h SER 642 Cb 0.72 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.79 3g0c h SER 642 CO 0.00 0.01 -0.12 0.61 -0.87 0.00 0.00 176.83 176.45 3g0c n GLY 643 N 1.23 0.40 0.16 -0.77 0.00 -1.26 -4.95 105.19 99.99 3g0c n GLY 643 Ca 0.05 -0.73 -0.03 0.00 0.00 0.00 0.00 46.02 45.31 3g0c n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g0c h SER 644 N 0.00 0.14 0.00 1.61 4.64 -1.91 -3.47 113.55 114.57 3g0c h SER 644 Ca -0.12 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 3g0c h SER 644 Cb 0.80 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 3g0c h SER 644 CO 0.15 0.70 0.00 0.61 -0.87 0.00 0.00 176.83 177.42 3g0c n GLY 645 N 0.19 0.96 0.14 -0.77 0.00 -1.26 -4.93 105.19 99.52 3g0c n GLY 645 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 3g0c n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3g0c h VAL 646 N 0.00 1.03 -3.10 1.61 2.07 -1.95 -3.47 116.25 112.45 3g0c h VAL 646 Ca 0.00 -2.58 -0.63 0.00 0.82 0.00 0.00 66.70 64.31 3g0c h VAL 646 Cb 0.00 2.82 -0.12 0.00 -1.52 0.00 0.00 31.29 32.48 3g0c h VAL 646 CO 0.00 0.85 -0.51 -0.36 0.02 0.00 0.00 177.57 177.56 3g0c s PHE 647 N -2.59 3.41 0.05 1.57 0.40 -1.26 -4.58 117.98 114.98 3g0c s PHE 647 Ca -0.14 0.31 0.05 0.00 -0.60 0.00 0.00 56.93 56.55 3g0c s PHE 647 Cb 0.05 -2.05 -0.24 0.00 0.51 0.00 0.00 43.02 41.29 3g0c s PHE 647 CO 0.87 0.40 1.01 -0.22 0.70 0.00 0.00 175.22 177.98 3g0c h LYS 648 N 6.08 0.09 -2.85 0.44 3.64 -1.24 -3.45 116.57 119.28 3g0c h LYS 648 Ca -0.45 -0.15 0.08 0.00 -1.27 0.00 0.00 60.65 58.86 3g0c h LYS 648 Cb 1.18 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.99 3g0c h LYS 648 CO 0.68 0.93 0.28 0.00 -2.27 0.00 0.00 179.45 179.08 3g0c s GLY 650 N -2.90 -0.43 -0.10 0.00 0.00 -0.28 -2.56 107.32 101.05 3g0c s GLY 650 Ca 0.10 0.67 0.01 0.00 0.00 0.00 0.00 44.72 45.51 3g0c s GLY 650 CO 0.04 0.21 -0.12 -0.42 0.00 0.00 0.00 173.10 172.81 3g0c s ILE 651 N -3.30 1.28 -0.18 0.90 1.01 -0.73 -1.49 121.20 118.68 3g0c s ILE 651 Ca 0.06 -0.50 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 3g0c s ILE 651 Cb -0.01 -1.19 -0.01 0.00 0.01 0.00 0.00 42.46 41.25 3g0c s ILE 651 CO -0.07 0.40 -0.09 0.00 0.00 0.00 0.00 174.94 175.18 3g0c s ALA 652 N 1.09 2.70 -0.15 9.38 0.00 -0.18 -2.20 121.76 132.40 3g0c s ALA 652 Ca -0.06 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 3g0c s ALA 652 Cb -0.14 -1.46 -0.02 0.00 0.00 0.00 0.00 23.12 21.50 3g0c s ALA 652 CO -0.02 -0.13 -0.09 0.08 0.00 0.00 0.00 175.76 175.60 3g0c s VAL 653 N 0.98 3.32 -1.33 0.00 1.01 -0.58 -1.36 120.40 122.42 3g0c s VAL 653 Ca -0.01 -0.55 -0.22 0.00 0.00 0.00 0.00 61.98 61.20 3g0c s VAL 653 Cb -0.15 -2.43 0.03 0.00 0.00 0.00 0.00 36.38 33.83 3g0c s VAL 653 CO -0.01 0.50 0.45 0.00 0.00 0.00 0.00 175.10 176.04 3g0c n ALA 654 N 3.79 -2.39 -2.08 5.51 0.00 0.16 -2.11 120.51 123.38 3g0c n ALA 654 Ca -0.18 -0.51 -0.31 0.00 0.00 0.00 0.00 53.44 52.43 3g0c n ALA 654 Cb 0.52 -2.02 -0.04 0.00 0.00 0.00 0.00 19.45 17.91 3g0c n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3g0c s PRO 655 N -7.35 3.91 0.11 0.00 0.04 -1.26 -3.20 135.00 127.25 3g0c s PRO 655 Ca 0.31 0.67 -0.30 0.00 0.04 0.00 0.00 61.00 61.72 3g0c s PRO 655 Cb -0.17 -2.34 -0.06 0.00 0.04 0.00 0.00 34.50 31.97 3g0c s PRO 655 CO 0.98 -0.02 1.14 0.08 0.04 0.00 0.00 177.00 179.21 3g0c s VAL 656 N -2.29 4.01 -0.14 -0.36 1.01 -1.23 -4.49 120.40 116.91 3g0c s VAL 656 Ca 0.54 1.56 0.00 0.00 0.00 0.00 0.00 61.98 64.09 3g0c s VAL 656 Cb -0.10 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.19 3g0c s VAL 656 CO 0.26 0.19 -0.13 -1.54 0.00 0.00 0.00 175.10 173.88 3g0c n SER 657 N 3.19 2.80 -3.75 3.32 3.41 -1.26 -4.17 113.62 117.16 3g0c n SER 657 Ca 0.06 -0.06 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 3g0c n SER 657 Cb 0.47 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 64.04 3g0c n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g0c s ARG 658 N -2.28 0.09 0.51 4.33 1.70 -1.26 -0.70 118.95 121.35 3g0c s ARG 658 Ca -0.19 0.37 0.29 0.00 -0.47 0.00 0.00 55.73 55.73 3g0c s ARG 658 Cb 0.05 -0.18 1.40 0.00 -0.57 0.00 0.00 34.95 35.65 3g0c s ARG 658 CO 0.32 -0.16 1.88 -1.49 -1.08 0.00 0.00 175.30 174.77 3g0c h TRP 659 N 7.22 0.11 0.00 5.89 4.06 -1.88 0.18 115.95 131.53 3g0c h TRP 659 Ca -0.43 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.52 3g0c h TRP 659 Cb 1.14 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 29.27 3g0c h TRP 659 CO 0.43 0.03 0.00 0.39 -3.56 0.00 0.00 178.44 175.72 3g0c n GLU 660 N -4.32 0.04 0.07 0.49 1.02 -1.26 -1.91 120.64 114.77 3g0c n GLU 660 Ca 0.19 0.41 0.05 0.00 -0.02 0.00 0.00 57.16 57.79 3g0c n GLU 660 Cb 0.90 -1.60 -0.04 0.00 -0.02 0.00 0.00 31.44 30.69 3g0c n GLU 660 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3g0c h TYR 661 N 0.00 0.00 -3.47 -0.32 0.05 -1.01 -3.34 116.97 108.88 3g0c h TYR 661 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 3g0c h TYR 661 Cb 0.14 0.00 0.07 0.00 1.01 0.00 0.00 36.73 37.94 3g0c h TYR 661 CO 0.00 0.31 0.16 -0.47 -1.05 0.00 0.00 178.16 177.11 3g0c s TYR 662 N -3.13 2.98 0.62 4.88 5.04 -0.80 -4.82 117.35 122.12 3g0c s TYR 662 Ca -0.01 0.39 -0.17 0.00 -2.44 0.00 0.00 57.07 54.84 3g0c s TYR 662 Cb 0.09 -2.99 -0.02 0.00 0.35 0.00 0.00 41.96 39.39 3g0c s TYR 662 CO 0.80 -1.16 1.14 0.16 -1.34 0.00 0.00 175.55 175.15 3g0c s ASP 663 N -4.45 5.25 0.06 4.32 1.47 -1.26 -1.13 116.67 120.93 3g0c s ASP 663 Ca 0.58 2.14 -0.26 0.00 1.18 0.00 0.00 52.55 56.19 3g0c s ASP 663 Cb -0.11 -2.57 -0.17 0.00 -0.34 0.00 0.00 42.92 39.74 3g0c s ASP 663 CO 0.43 -1.54 1.60 0.77 0.68 0.00 0.00 175.17 177.11 3g0c h SER 664 N 0.51 -0.19 -0.31 2.11 4.64 -1.40 -1.98 113.55 116.92 3g0c h SER 664 Ca -0.48 -0.08 0.05 0.00 -0.47 0.00 0.00 61.79 60.81 3g0c h SER 664 Cb 1.26 0.05 -0.05 0.00 -0.31 0.00 0.00 62.40 63.35 3g0c h SER 664 CO 0.55 -0.05 -0.00 0.58 -0.87 0.00 0.00 176.83 177.04 3g0c h VAL 665 N -0.33 0.77 0.18 0.95 2.07 -1.94 -0.24 116.25 117.71 3g0c h VAL 665 Ca -0.02 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 3g0c h VAL 665 Cb 0.26 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3g0c h VAL 665 CO 0.04 0.02 -0.09 0.22 0.02 0.00 0.00 177.57 177.78 3g0c h TYR 666 N 0.09 -0.23 -0.26 1.57 3.20 -1.92 -3.07 116.97 116.35 3g0c h TYR 666 Ca 0.15 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 3g0c h TYR 666 Cb 0.20 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 3g0c h TYR 666 CO -0.23 0.17 0.10 1.15 -1.64 0.00 0.00 178.16 177.72 3g0c h THR 667 N -0.73 1.17 0.00 1.81 2.02 -1.22 -2.90 112.91 113.05 3g0c h THR 667 Ca -0.03 -0.52 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 3g0c h THR 667 Cb 0.50 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3g0c h THR 667 CO 0.04 0.17 -0.31 -0.33 0.37 0.00 0.00 175.52 175.47 3g0c h GLU 668 N 0.27 0.00 -0.92 6.66 5.08 -1.19 0.12 114.58 124.59 3g0c h GLU 668 Ca 0.09 0.00 0.23 0.00 -1.00 0.00 0.00 59.36 58.67 3g0c h GLU 668 Cb 0.18 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.36 3g0c h GLU 668 CO -0.01 0.31 0.62 -0.09 -1.00 0.00 0.00 179.01 178.84 3g0c h ARG 669 N 0.00 0.29 0.00 2.33 2.43 -1.41 -2.01 114.38 116.01 3g0c h ARG 669 Ca -0.00 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.00 3g0c h ARG 669 Cb 0.58 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 3g0c h ARG 669 CO 0.04 0.19 -1.58 0.66 -1.51 0.00 0.00 179.97 177.77 3g0c n TYR 670 N -4.46 0.00 0.73 2.20 4.01 -0.89 -4.54 117.16 114.21 3g0c n TYR 670 Ca 0.20 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 58.02 3g0c n TYR 670 Cb 0.80 -0.41 -0.10 0.00 -0.31 0.00 0.00 39.34 39.31 3g0c n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3g0c n MET 671 N -2.32 1.16 0.00 -0.72 2.81 0.35 0.24 117.12 118.64 3g0c n MET 671 Ca -0.14 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.73 3g0c n MET 671 Cb 0.77 -1.33 0.00 0.00 -0.71 0.00 0.00 33.22 31.95 3g0c n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g0c n GLY 672 N 1.42 0.49 3.84 3.03 0.00 -0.76 -4.67 105.19 108.54 3g0c n GLY 672 Ca 0.03 -0.80 -0.37 0.00 0.00 0.00 0.00 46.02 44.88 3g0c n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g0c s LEU 673 N 0.00 4.37 -0.45 0.99 1.02 -1.26 -4.27 118.68 119.08 3g0c s LEU 673 Ca 0.00 0.56 -0.06 0.00 0.02 0.00 0.00 54.13 54.65 3g0c s LEU 673 Cb 0.00 -2.22 -0.17 0.00 0.02 0.00 0.00 46.19 43.82 3g0c s LEU 673 CO 0.00 0.33 2.85 -0.81 0.02 0.00 0.00 176.35 178.74 3g0c n PRO 674 N 2.30 2.07 -4.41 1.29 -0.04 -1.26 -1.87 135.00 133.07 3g0c n PRO 674 Ca -0.17 -1.17 -0.27 0.00 -0.04 0.00 0.00 63.50 61.85 3g0c n PRO 674 Cb 0.54 -2.16 -0.12 0.00 -0.04 0.00 0.00 33.50 31.72 3g0c n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3g0c s THR 675 N 1.87 2.32 0.46 0.52 -4.23 -1.26 -4.59 115.64 110.73 3g0c s THR 675 Ca 0.54 -1.96 0.19 0.00 -1.18 0.00 0.00 61.69 59.28 3g0c s THR 675 Cb 0.22 -2.09 0.38 0.00 1.34 0.00 0.00 72.50 72.34 3g0c s THR 675 CO -0.02 -0.07 1.92 -0.65 -0.54 0.00 0.00 174.62 175.27 3g0c h PRO 676 N 3.37 0.29 -0.82 3.99 0.11 -1.97 0.31 132.00 137.28 3g0c h PRO 676 Ca -0.47 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.46 3g0c h PRO 676 Cb 1.20 -0.07 -0.09 0.00 0.11 0.00 0.00 31.00 32.15 3g0c h PRO 676 CO 0.46 0.19 0.20 -0.85 -0.21 0.00 0.00 178.00 177.79 3g0c n GLU 677 N -4.45 3.03 0.00 1.05 0.00 -1.26 -4.69 120.64 114.32 3g0c n GLU 677 Ca 0.14 -2.24 0.00 0.00 0.00 0.00 0.00 57.16 55.06 3g0c n GLU 677 Cb 0.60 -1.97 0.00 0.00 0.00 0.00 0.00 31.44 30.07 3g0c n GLU 677 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3g0c n ASP 678 N -0.03 0.00 -0.94 -1.84 4.64 0.06 -5.07 116.55 113.37 3g0c n ASP 678 Ca 0.30 0.00 0.02 0.00 -1.38 0.00 0.00 54.79 53.73 3g0c n ASP 678 Cb 1.11 0.00 0.01 0.00 -1.04 0.00 0.00 41.12 41.20 3g0c n ASP 678 CO 0.00 0.00 0.00 -3.20 -0.82 0.00 0.00 177.20 173.18 3g0c n ASN 679 N 0.00 0.42 -0.30 1.67 5.15 -0.78 -4.87 115.26 116.54 3g0c n ASN 679 Ca 0.00 -1.98 0.07 0.00 -0.60 0.00 0.00 54.58 52.07 3g0c n ASN 679 Cb 0.00 -0.23 0.23 0.00 -0.53 0.00 0.00 39.78 39.25 3g0c n ASN 679 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3g0c h LEU 680 N 0.44 0.59 -0.49 1.20 5.85 -1.53 -2.41 115.31 118.95 3g0c h LEU 680 Ca -0.11 0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.79 3g0c h LEU 680 Cb 1.61 -0.01 -0.10 0.00 0.37 0.00 0.00 40.66 42.53 3g0c h LEU 680 CO 0.04 0.26 -0.22 0.44 -0.34 0.00 0.00 178.44 178.62 3g0c h ASP 681 N 0.67 -0.76 0.78 1.25 3.32 -1.89 -0.68 116.42 119.11 3g0c h ASP 681 Ca 0.47 0.18 -0.14 0.00 0.02 0.00 0.00 57.03 57.55 3g0c h ASP 681 Cb 0.64 0.42 -0.02 0.00 0.22 0.00 0.00 39.33 40.58 3g0c h ASP 681 CO -0.35 -0.25 -0.68 -0.74 -1.72 0.00 0.00 179.24 175.51 3g0c h HIS 682 N -0.11 0.00 -0.27 4.55 2.76 -1.82 -1.06 115.15 119.20 3g0c h HIS 682 Ca 0.23 0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.44 3g0c h HIS 682 Cb 0.47 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 3g0c h HIS 682 CO -0.50 0.68 -0.00 1.88 -1.30 0.00 0.00 177.93 178.69 3g0c h TYR 683 N 0.00 -0.02 0.00 5.26 0.05 -0.98 -2.22 116.97 119.06 3g0c h TYR 683 Ca -0.01 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.71 3g0c h TYR 683 Cb 1.25 0.05 -0.01 0.00 1.01 0.00 0.00 36.73 39.03 3g0c h TYR 683 CO 0.00 -0.05 -0.40 0.00 -1.05 0.00 0.00 178.16 176.66 3g0c h ARG 684 N 0.08 0.00 -0.00 4.88 2.47 -0.90 -3.12 114.38 117.79 3g0c h ARG 684 Ca 0.13 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.85 3g0c h ARG 684 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 3g0c h ARG 684 CO -0.22 0.40 -0.13 -1.71 0.56 0.00 0.00 179.97 178.87 3g0c n ASN 685 N -3.88 0.26 -0.16 7.04 4.05 -0.42 -4.21 115.26 117.94 3g0c n ASN 685 Ca -0.01 -0.12 0.07 0.00 0.45 0.00 0.00 54.58 54.97 3g0c n ASN 685 Cb 0.45 -0.18 0.10 0.00 1.23 0.00 0.00 39.78 41.39 3g0c n ASN 685 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 3g0c n SER 686 N -1.27 1.79 -4.83 1.20 3.41 -0.88 -5.04 113.62 108.00 3g0c n SER 686 Ca 0.10 -2.79 -0.32 0.00 -0.26 0.00 0.00 58.87 55.60 3g0c n SER 686 Cb 0.30 -0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 3g0c n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3g0c s THR 687 N -2.15 4.30 0.07 6.66 -4.23 -1.26 -4.84 115.64 114.19 3g0c s THR 687 Ca 0.24 1.13 0.15 0.00 -1.18 0.00 0.00 61.69 62.03 3g0c s THR 687 Cb 0.21 -3.61 0.05 0.00 1.34 0.00 0.00 72.50 70.49 3g0c s THR 687 CO 0.02 -0.60 1.58 -0.37 -0.54 0.00 0.00 174.62 174.71 3g0c h VAL 688 N 0.86 1.03 -0.42 2.29 -1.51 -1.25 -3.34 116.25 113.91 3g0c h VAL 688 Ca -0.47 -2.03 0.08 0.00 -1.23 0.00 0.00 66.70 63.05 3g0c h VAL 688 Cb 1.20 2.22 -0.07 0.00 -2.13 0.00 0.00 31.29 32.50 3g0c h VAL 688 CO 0.60 0.51 -0.04 0.24 -1.23 0.00 0.00 177.57 177.65 3g0c h MET 689 N 0.00 0.06 0.00 5.19 2.86 -1.92 -1.66 114.93 119.47 3g0c h MET 689 Ca -0.01 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3g0c h MET 689 Cb 1.18 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.82 3g0c h MET 689 CO 0.07 0.04 0.00 -1.13 1.06 0.00 0.00 176.91 176.95 3g0c n SER 690 N -5.25 0.24 -1.01 1.22 3.41 -1.25 -1.66 113.62 109.32 3g0c n SER 690 Ca 0.03 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.34 3g0c n SER 690 Cb 0.23 -0.63 0.18 0.00 -0.26 0.00 0.00 64.21 63.72 3g0c n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3g0c n ARG 691 N -1.80 2.30 -0.29 4.33 1.74 -0.63 -4.65 116.66 117.66 3g0c n ARG 691 Ca 0.01 -2.10 0.11 0.00 -0.77 0.00 0.00 57.85 55.10 3g0c n ARG 691 Cb 0.09 -1.45 0.28 0.00 -1.02 0.00 0.00 32.46 30.35 3g0c n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g0c h ALA 692 N 4.05 1.31 -0.88 7.54 0.00 -1.33 -1.96 119.26 127.99 3g0c h ALA 692 Ca 0.00 0.17 0.20 0.00 0.00 0.00 0.00 54.91 55.28 3g0c h ALA 692 Cb 0.91 0.18 -0.12 0.00 0.00 0.00 0.00 17.79 18.76 3g0c h ALA 692 CO 0.00 -0.34 0.41 1.49 0.00 0.00 0.00 179.25 180.81 3g0c h GLU 693 N 0.36 0.46 0.00 0.00 4.57 -1.85 -0.96 114.58 117.16 3g0c h GLU 693 Ca 0.52 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.68 3g0c h GLU 693 Cb 0.98 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 3g0c h GLU 693 CO -0.53 0.30 0.00 -0.91 -1.18 0.00 0.00 179.01 176.69 3g0c h ASN 694 N 0.47 0.00 0.28 1.04 2.35 -1.62 -2.89 115.58 115.21 3g0c h ASN 694 Ca 0.53 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.28 3g0c h ASN 694 Cb 0.94 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.31 3g0c h ASN 694 CO -0.48 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 175.79 3g0c n PHE 695 N -2.30 0.00 0.29 1.19 3.01 -0.36 -2.69 117.46 116.60 3g0c n PHE 695 Ca 0.01 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.63 3g0c n PHE 695 Cb 0.19 -0.33 0.78 0.00 -0.01 0.00 0.00 39.48 40.11 3g0c n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 3g0c h LYS 696 N 0.00 0.00 0.00 -1.08 1.57 -1.69 -2.83 116.57 112.54 3g0c h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g0c h LYS 696 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3g0c h LYS 696 CO 0.00 0.00 -0.75 1.04 -0.57 0.00 0.00 179.45 179.17 3g0c n GLN 697 N -2.67 0.04 -4.22 3.15 6.02 -1.09 -4.99 117.38 113.62 3g0c n GLN 697 Ca -0.01 -0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.85 3g0c n GLN 697 Cb 0.14 -1.51 -0.10 0.00 1.02 0.00 0.00 30.24 29.78 3g0c n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3g0c s VAL 698 N -3.03 0.39 -0.18 5.09 -7.23 -1.07 -4.94 120.40 109.43 3g0c s VAL 698 Ca 0.09 -1.97 -0.11 0.00 -1.81 0.00 0.00 61.98 58.19 3g0c s VAL 698 Cb 0.16 -2.25 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 3g0c s VAL 698 CO 0.77 -0.32 0.17 -1.61 -0.31 0.00 0.00 175.10 173.81 3g0c s GLU 699 N -4.01 4.13 -0.07 4.82 2.02 -0.43 -4.98 118.70 120.18 3g0c s GLU 699 Ca 0.29 -0.13 0.01 0.00 0.02 0.00 0.00 54.97 55.16 3g0c s GLU 699 Cb 0.07 -3.40 0.02 0.00 0.10 0.00 0.00 34.13 30.92 3g0c s GLU 699 CO 0.06 0.34 -0.08 -0.47 0.02 0.00 0.00 175.26 175.13 3g0c s TYR 700 N 0.24 1.25 -0.19 1.61 5.04 -1.26 -1.12 117.35 122.91 3g0c s TYR 700 Ca 0.11 -0.49 -0.02 0.00 -2.44 0.00 0.00 57.07 54.22 3g0c s TYR 700 Cb -0.12 -1.01 -0.00 0.00 0.35 0.00 0.00 41.96 41.18 3g0c s TYR 700 CO 0.00 -0.33 -0.10 -1.17 -1.34 0.00 0.00 175.55 172.62 3g0c s LEU 701 N 1.12 2.69 -0.15 6.97 2.96 -0.56 -0.17 118.68 131.55 3g0c s LEU 701 Ca -0.07 -0.43 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 3g0c s LEU 701 Cb -0.14 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 44.90 3g0c s LEU 701 CO -0.01 0.02 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.62 3g0c s LEU 702 N 1.20 2.20 -0.03 -0.68 2.96 0.07 -1.01 118.68 123.40 3g0c s LEU 702 Ca 0.02 -0.57 0.03 0.00 -0.22 0.00 0.00 54.13 53.39 3g0c s LEU 702 Cb -0.14 -1.48 0.00 0.00 0.50 0.00 0.00 46.19 45.07 3g0c s LEU 702 CO -0.03 0.08 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.34 3g0c s ILE 703 N 0.84 0.91 -0.26 6.68 1.01 -0.47 -1.12 121.20 128.78 3g0c s ILE 703 Ca -0.06 -0.43 -0.19 0.00 0.00 0.00 0.00 60.65 59.97 3g0c s ILE 703 Cb -0.15 -0.80 0.07 0.00 0.01 0.00 0.00 42.46 41.59 3g0c s ILE 703 CO -0.02 0.28 0.67 -2.28 0.00 0.00 0.00 174.94 173.58 3g0c s HIS 704 N 0.16 -0.90 0.15 3.97 2.46 -0.70 0.36 115.29 120.80 3g0c s HIS 704 Ca -0.03 1.95 -0.28 0.00 0.47 0.00 0.00 55.06 57.17 3g0c s HIS 704 Cb -0.09 0.45 -0.07 0.00 -0.13 0.00 0.00 32.58 32.74 3g0c s HIS 704 CO 0.01 -0.45 0.88 0.20 -2.47 0.00 0.00 174.74 172.91 3g0c s GLY 705 N 1.09 2.98 0.50 1.59 0.00 -1.26 -1.21 107.32 111.00 3g0c s GLY 705 Ca -0.06 0.49 0.29 0.00 0.00 0.00 0.00 44.72 45.44 3g0c s GLY 705 CO -0.11 1.18 1.91 -0.91 0.00 0.00 0.00 173.10 175.17 3g0c h THR 706 N 3.62 0.31 -0.81 0.90 1.35 -0.72 -3.13 112.91 114.43 3g0c h THR 706 Ca -0.45 -0.81 -0.53 0.00 -0.55 0.00 0.00 66.41 64.08 3g0c h THR 706 Cb 1.21 1.63 -0.29 0.00 -1.73 0.00 0.00 68.15 68.96 3g0c h THR 706 CO 0.69 0.11 0.23 0.00 -0.25 0.00 0.00 175.52 176.30 3g0c n ALA 707 N -2.17 5.52 -2.61 6.62 0.00 -0.44 -4.67 120.51 122.77 3g0c n ALA 707 Ca 0.00 -3.42 -0.43 0.00 0.00 0.00 0.00 53.44 49.60 3g0c n ALA 707 Cb 0.36 -1.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 3g0c n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3g0c s ASP 708 N -2.35 6.42 0.22 0.00 3.68 -1.18 -4.17 116.67 119.29 3g0c s ASP 708 Ca 0.56 -0.09 0.26 0.00 2.13 0.00 0.00 52.55 55.41 3g0c s ASP 708 Cb 0.46 -2.46 0.78 0.00 -1.45 0.00 0.00 42.92 40.26 3g0c s ASP 708 CO 0.02 -1.18 1.76 -2.24 0.13 0.00 0.00 175.17 173.67 3g0c h ASP 709 N 9.23 0.00 0.00 -0.34 2.03 -1.92 -3.33 116.42 122.09 3g0c h ASP 709 Ca -0.25 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 3g0c h ASP 709 Cb 1.07 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.57 3g0c h ASP 709 CO 1.07 0.00 -0.12 -3.20 -1.03 0.00 0.00 179.24 175.96 3g0c n ASN 710 N -2.31 0.33 -4.35 4.15 4.05 -1.26 -4.74 115.26 111.13 3g0c n ASN 710 Ca 0.05 0.23 -0.43 0.00 0.45 0.00 0.00 54.58 54.89 3g0c n ASN 710 Cb 0.44 -0.56 -0.09 0.00 1.23 0.00 0.00 39.78 40.80 3g0c n ASN 710 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3g0c s VAL 711 N -1.26 4.84 0.61 3.44 1.01 -1.26 -4.79 120.40 122.98 3g0c s VAL 711 Ca -0.04 -1.14 -0.18 0.00 0.00 0.00 0.00 61.98 60.63 3g0c s VAL 711 Cb 0.00 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 3g0c s VAL 711 CO 0.05 -0.51 1.17 -1.00 0.00 0.00 0.00 175.10 174.81 3g0c s HIS 712 N 1.56 2.46 0.42 5.22 3.76 -1.25 -4.71 115.29 122.76 3g0c s HIS 712 Ca 0.04 1.54 0.20 0.00 -0.15 0.00 0.00 55.06 56.68 3g0c s HIS 712 Cb -0.23 -3.38 1.15 0.00 1.11 0.00 0.00 32.58 31.23 3g0c s HIS 712 CO 0.05 -2.00 1.81 0.35 -0.85 0.00 0.00 174.74 174.10 3g0c h PHE 713 N 0.70 0.54 -0.90 1.40 3.57 -1.80 -0.99 116.94 119.46 3g0c h PHE 713 Ca -0.49 0.02 0.26 0.00 3.53 0.00 0.00 57.97 61.28 3g0c h PHE 713 Cb 1.28 -0.16 -0.17 0.00 2.79 0.00 0.00 35.95 39.69 3g0c h PHE 713 CO 0.49 0.08 0.06 0.94 -2.23 0.00 0.00 178.31 177.65 3g0c n GLN 714 N -4.54 -0.07 -0.25 1.11 7.27 -1.26 -0.77 117.38 118.87 3g0c n GLN 714 Ca 0.23 1.34 -0.05 0.00 0.07 0.00 0.00 57.00 58.59 3g0c n GLN 714 Cb 0.85 -2.15 0.11 0.00 2.41 0.00 0.00 30.24 31.46 3g0c n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3g0c h GLN 715 N 0.00 1.10 -0.00 3.69 4.20 -1.49 0.10 115.11 122.72 3g0c h GLN 715 Ca 0.57 -0.20 -0.19 0.00 0.06 0.00 0.00 58.65 58.89 3g0c h GLN 715 Cb 1.21 -0.18 0.02 0.00 0.30 0.00 0.00 27.48 28.82 3g0c h GLN 715 CO -0.83 0.90 -0.73 0.77 -0.67 0.00 0.00 178.83 178.26 3g0c h SER 716 N 1.07 0.65 -0.84 1.46 0.02 -1.28 -2.77 113.55 111.87 3g0c h SER 716 Ca 0.25 -0.75 0.19 0.00 -0.84 0.00 0.00 61.79 60.63 3g0c h SER 716 Cb 0.22 -0.20 -0.11 0.00 0.14 0.00 0.00 62.40 62.44 3g0c h SER 716 CO -0.02 1.32 0.34 0.00 -1.14 0.00 0.00 176.83 177.33 3g0c h ALA 717 N 0.34 1.26 -0.09 3.77 0.00 -0.61 -0.06 119.26 123.88 3g0c h ALA 717 Ca -0.09 0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 3g0c h ALA 717 Cb 1.43 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 3g0c h ALA 717 CO 0.14 -0.29 -0.63 1.96 0.00 0.00 0.00 179.25 180.43 3g0c h GLN 718 N 0.40 0.35 0.18 0.00 1.08 -0.81 -2.35 115.11 113.96 3g0c h GLN 718 Ca 0.50 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 57.44 3g0c h GLN 718 Cb 0.88 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.35 3g0c h GLN 718 CO -0.49 0.86 -0.09 0.82 -0.95 0.00 0.00 178.83 178.99 3g0c h ILE 719 N 0.25 0.90 -0.76 2.54 2.04 -0.95 -2.94 117.51 118.59 3g0c h ILE 719 Ca -0.01 -0.41 0.10 0.00 1.00 0.00 0.00 64.86 65.54 3g0c h ILE 719 Cb 1.16 1.15 -0.07 0.00 -0.74 0.00 0.00 36.82 38.32 3g0c h ILE 719 CO 0.10 0.10 0.40 0.77 0.00 0.00 0.00 178.15 179.52 3g0c h SER 720 N -0.45 0.53 -0.92 1.72 4.64 -1.04 -1.34 113.55 116.69 3g0c h SER 720 Ca -0.03 0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.36 3g0c h SER 720 Cb 0.34 -0.03 -0.05 0.00 -0.31 0.00 0.00 62.40 62.36 3g0c h SER 720 CO 0.04 0.29 0.61 0.50 -0.87 0.00 0.00 176.83 177.41 3g0c h LYS 721 N 0.66 1.22 -0.40 4.77 3.64 -1.44 -0.48 116.57 124.54 3g0c h LYS 721 Ca 0.38 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 59.53 3g0c h LYS 721 Cb 0.40 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 3g0c h LYS 721 CO -0.27 0.81 -0.35 0.00 -2.27 0.00 0.00 179.45 177.36 3g0c h ALA 722 N 1.42 0.58 -0.50 5.00 0.00 -1.10 -1.20 119.26 123.47 3g0c h ALA 722 Ca 0.34 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 3g0c h ALA 722 Cb -0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3g0c h ALA 722 CO -0.07 0.66 -0.07 -0.07 0.00 0.00 0.00 179.25 179.70 3g0c h LEU 723 N 0.77 0.92 -1.14 0.00 3.38 -0.94 -2.52 115.31 115.78 3g0c h LEU 723 Ca 0.07 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3g0c h LEU 723 Cb 0.95 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 3g0c h LEU 723 CO 0.09 1.04 0.55 0.58 0.09 0.00 0.00 178.44 180.79 3g0c h VAL 724 N 0.78 1.22 0.00 1.22 2.07 -0.94 -1.07 116.25 119.53 3g0c h VAL 724 Ca 0.13 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 3g0c h VAL 724 Cb 0.61 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3g0c h VAL 724 CO 0.04 0.22 -0.21 0.44 0.02 0.00 0.00 177.57 178.08 3g0c h ASP 725 N 1.16 0.00 -0.47 0.57 3.45 -0.81 -2.62 116.42 117.71 3g0c h ASP 725 Ca 0.31 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.77 3g0c h ASP 725 Cb -0.11 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.66 3g0c h ASP 725 CO -0.06 0.21 0.00 1.33 -1.57 0.00 0.00 179.24 179.14 3g0c n VAL 726 N -3.51 0.67 -2.66 -1.35 0.24 -1.01 -4.98 118.33 105.73 3g0c n VAL 726 Ca -0.01 -0.84 -0.12 0.00 -2.04 0.00 0.00 64.34 61.34 3g0c n VAL 726 Cb 0.37 0.81 0.02 0.00 -1.47 0.00 0.00 33.84 33.57 3g0c n VAL 726 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g0c n GLY 727 N 1.40 0.06 3.67 7.63 0.00 -0.99 -4.99 105.19 111.98 3g0c n GLY 727 Ca 0.19 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 3g0c n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g0c s VAL 728 N -2.87 5.20 0.40 1.61 1.01 -0.44 -5.03 120.40 120.28 3g0c s VAL 728 Ca 0.16 0.70 -0.23 0.00 0.00 0.00 0.00 61.98 62.62 3g0c s VAL 728 Cb -0.07 -3.73 -0.10 0.00 0.00 0.00 0.00 36.38 32.48 3g0c s VAL 728 CO 0.20 0.24 0.97 -0.62 0.00 0.00 0.00 175.10 175.89 3g0c s ASP 729 N 1.08 6.96 0.16 3.32 3.68 -1.26 -4.43 116.67 126.18 3g0c s ASP 729 Ca 0.19 1.80 -0.24 0.00 2.13 0.00 0.00 52.55 56.42 3g0c s ASP 729 Cb -0.15 -2.56 0.06 0.00 -1.45 0.00 0.00 42.92 38.82 3g0c s ASP 729 CO 0.08 -0.34 0.90 0.72 0.13 0.00 0.00 175.17 176.66 3g0c s PHE 730 N -1.95 -0.17 -0.08 -5.34 -0.12 -1.26 -4.75 117.98 104.31 3g0c s PHE 730 Ca 0.59 -0.15 -0.04 0.00 -0.05 0.00 0.00 56.93 57.27 3g0c s PHE 730 Cb -0.14 0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 3g0c s PHE 730 CO 0.18 -0.88 0.11 -0.65 -0.05 0.00 0.00 175.22 173.93 3g0c s GLN 731 N -3.40 3.30 0.08 1.99 -1.52 0.77 -5.02 119.66 115.86 3g0c s GLN 731 Ca 0.11 -0.26 0.02 0.00 -1.95 0.00 0.00 55.36 53.29 3g0c s GLN 731 Cb -0.02 -3.06 -0.03 0.00 -0.22 0.00 0.00 33.01 29.68 3g0c s GLN 731 CO 0.02 0.73 -0.08 0.00 -0.25 0.00 0.00 175.29 175.71 3g0c s ALA 732 N -1.07 0.88 -0.21 6.09 0.00 -1.26 -0.75 121.76 125.43 3g0c s ALA 732 Ca 0.18 -1.10 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 3g0c s ALA 732 Cb -0.12 0.08 0.09 0.00 0.00 0.00 0.00 23.12 23.17 3g0c s ALA 732 CO 0.07 -0.10 0.47 1.41 0.00 0.00 0.00 175.76 177.62 3g0c s MET 733 N -2.73 0.40 0.21 0.00 1.75 -0.28 -4.91 119.30 113.74 3g0c s MET 733 Ca 0.02 1.07 0.04 0.00 -1.25 0.00 0.00 55.69 55.57 3g0c s MET 733 Cb -0.03 0.35 -0.03 0.00 2.84 0.00 0.00 34.83 37.96 3g0c s MET 733 CO -0.02 -0.22 0.34 1.67 -0.65 0.00 0.00 175.02 176.15 3g0c s TRP 734 N 2.39 3.47 -0.27 4.11 -2.14 -1.26 -1.73 118.94 123.52 3g0c s TRP 734 Ca -0.04 0.06 0.02 0.00 2.66 0.00 0.00 56.10 58.80 3g0c s TRP 734 Cb -0.11 -1.63 0.07 0.00 -3.10 0.00 0.00 33.47 28.70 3g0c s TRP 734 CO -0.14 0.45 -0.04 0.71 -2.66 0.00 0.00 176.95 175.27 3g0c s TYR 735 N -1.90 2.85 -0.01 1.66 2.02 -0.35 -4.91 117.35 116.71 3g0c s TYR 735 Ca 0.35 -2.16 -0.34 0.00 -0.37 0.00 0.00 57.07 54.55 3g0c s TYR 735 Cb -0.10 -1.96 -0.12 0.00 -0.40 0.00 0.00 41.96 39.38 3g0c s TYR 735 CO 0.29 -0.85 1.82 2.41 -1.57 0.00 0.00 175.55 177.65 3g0c n THR 736 N 4.54 0.45 -0.75 -0.71 -1.04 -1.26 -0.42 114.28 115.09 3g0c n THR 736 Ca -0.08 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 3g0c n THR 736 Cb 0.43 -1.85 0.00 0.00 -1.82 0.00 0.00 70.33 67.09 3g0c n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3g0c n ASP 737 N 5.92 -0.02 -4.81 8.00 10.43 -1.26 -4.86 116.55 129.96 3g0c n ASP 737 Ca 0.21 0.00 -0.34 0.00 2.57 0.00 0.00 54.79 57.23 3g0c n ASP 737 Cb 0.31 -1.28 -0.06 0.00 1.84 0.00 0.00 41.12 41.93 3g0c n ASP 737 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 3g0c s GLU 738 N -0.51 4.16 0.00 -1.24 0.41 -1.09 -4.61 118.70 115.82 3g0c s GLU 738 Ca 0.00 1.24 0.00 0.00 -0.41 0.00 0.00 54.97 55.80 3g0c s GLU 738 Cb 0.00 -2.26 0.00 0.00 -1.78 0.00 0.00 34.13 30.09 3g0c s GLU 738 CO 0.00 -0.10 0.00 -0.40 -0.49 0.00 0.00 175.26 174.27 3g0c n ASP 739 N -0.53 0.26 -0.08 -0.19 3.85 -1.26 -1.32 116.55 117.28 3g0c n ASP 739 Ca 0.07 -0.10 0.08 0.00 -0.71 0.00 0.00 54.79 54.13 3g0c n ASP 739 Cb 0.53 0.00 0.44 0.00 -1.35 0.00 0.00 41.12 40.74 3g0c n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.01 0.00 0.00 177.20 175.45 3g0c h HIS 740 N 0.01 0.54 0.00 2.11 -0.00 -1.91 -1.20 115.15 114.71 3g0c h HIS 740 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 3g0c h HIS 740 Cb 0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 27.23 3g0c h HIS 740 CO 0.00 0.29 0.00 0.78 -0.00 0.00 0.00 177.93 179.00 3g0c h GLY 741 N 0.54 0.00 -6.80 5.26 0.00 -1.99 -3.47 103.07 96.61 3g0c h GLY 741 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.29 3g0c h GLY 741 CO -0.07 0.00 -0.53 1.39 0.00 0.00 0.00 176.54 177.33 3g0c n ILE 742 N -2.50 -1.41 -0.02 2.60 5.41 -0.45 -4.83 119.36 118.15 3g0c n ILE 742 Ca 0.03 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3g0c n ILE 742 Cb 0.31 -1.22 0.00 0.00 -0.71 0.00 0.00 39.64 38.02 3g0c n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g0c n ALA 743 N -2.59 2.00 -1.73 -1.39 0.00 -1.26 -3.91 120.51 111.62 3g0c n ALA 743 Ca -0.09 -1.03 -0.37 0.00 0.00 0.00 0.00 53.44 51.95 3g0c n ALA 743 Cb 0.31 -0.01 0.06 0.00 0.00 0.00 0.00 19.45 19.81 3g0c n ALA 743 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3g0c s SER 744 N -1.03 4.73 0.16 0.00 0.01 -1.26 -4.78 113.70 111.53 3g0c s SER 744 Ca 0.01 2.67 -0.20 0.00 1.31 0.00 0.00 55.95 59.73 3g0c s SER 744 Cb 0.00 -2.62 0.07 0.00 0.21 0.00 0.00 66.02 63.68 3g0c s SER 744 CO 0.00 -1.92 1.64 -1.28 0.41 0.00 0.00 173.24 172.08 3g0c h SER 745 N 0.74 -0.69 0.42 2.44 0.87 -1.99 0.26 113.55 115.60 3g0c h SER 745 Ca -0.51 0.15 -0.17 0.00 -1.23 0.00 0.00 61.79 60.03 3g0c h SER 745 Cb 1.33 0.35 -0.01 0.00 -0.44 0.00 0.00 62.40 63.63 3g0c h SER 745 CO 0.54 -0.24 -0.71 0.71 -0.53 0.00 0.00 176.83 176.60 3g0c h THR 746 N -0.16 1.42 -0.20 2.23 1.35 -1.99 -2.57 112.91 112.99 3g0c h THR 746 Ca 0.17 -2.22 -0.19 0.00 -0.55 0.00 0.00 66.41 63.63 3g0c h THR 746 Cb 0.43 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 3g0c h THR 746 CO -0.44 0.65 -0.64 0.00 -0.25 0.00 0.00 175.52 174.84 3g0c h ALA 747 N 1.08 0.49 -0.48 6.62 0.00 -1.85 -2.52 119.26 122.59 3g0c h ALA 747 Ca -0.02 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 3g0c h ALA 747 Cb 1.27 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3g0c h ALA 747 CO 0.11 0.69 0.13 1.25 0.00 0.00 0.00 179.25 181.44 3g0c h HIS 748 N 0.53 0.79 -0.64 0.00 2.76 -0.44 -2.60 115.15 115.56 3g0c h HIS 748 Ca -0.01 -0.09 -0.04 0.00 -2.20 0.00 0.00 60.37 58.03 3g0c h HIS 748 Cb 1.24 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 29.94 3g0c h HIS 748 CO 0.07 0.71 0.23 1.96 -1.30 0.00 0.00 177.93 179.59 3g0c h GLN 749 N 0.65 0.94 -0.19 5.26 4.20 -1.48 -2.99 115.11 121.51 3g0c h GLN 749 Ca 0.15 -0.17 -0.21 0.00 0.06 0.00 0.00 58.65 58.49 3g0c h GLN 749 Cb 0.30 -0.16 0.01 0.00 0.30 0.00 0.00 27.48 27.93 3g0c h GLN 749 CO -0.00 0.79 -0.70 1.25 -0.67 0.00 0.00 178.83 179.50 3g0c h HIS 750 N 0.92 1.04 -0.10 2.96 2.76 -1.25 -2.57 115.15 118.91 3g0c h HIS 750 Ca 0.21 -0.43 -0.23 0.00 -2.20 0.00 0.00 60.37 57.72 3g0c h HIS 750 Cb 0.22 -0.17 0.01 0.00 1.55 0.00 0.00 27.41 29.02 3g0c h HIS 750 CO 0.02 1.25 -0.85 0.97 -1.30 0.00 0.00 177.93 178.02 3g0c h ILE 751 N 0.56 1.28 -0.62 6.26 2.10 -1.48 -1.05 117.51 124.57 3g0c h ILE 751 Ca -0.03 -2.06 -0.08 0.00 1.08 0.00 0.00 64.86 63.77 3g0c h ILE 751 Cb 1.31 2.14 -0.02 0.00 -1.09 0.00 0.00 36.82 39.16 3g0c h ILE 751 CO 0.15 0.65 0.07 1.88 -1.08 0.00 0.00 178.15 179.81 3g0c h TYR 752 N 0.46 1.10 -0.20 2.19 -1.99 -1.58 0.18 116.97 117.12 3g0c h TYR 752 Ca -0.08 -0.16 0.00 0.00 2.00 0.00 0.00 58.73 60.50 3g0c h TYR 752 Cb 1.49 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 39.91 3g0c h TYR 752 CO 0.10 0.94 0.13 1.15 -0.00 0.00 0.00 178.16 180.47 3g0c h THR 753 N 0.96 1.07 -0.44 -2.88 2.02 -1.46 -0.26 112.91 111.92 3g0c h THR 753 Ca 0.19 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 3g0c h THR 753 Cb 0.45 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 3g0c h THR 753 CO 0.02 0.07 0.25 -0.74 0.37 0.00 0.00 175.52 175.48 3g0c h HIS 754 N 0.26 0.59 -0.75 3.16 -0.00 -0.87 -2.00 115.15 115.54 3g0c h HIS 754 Ca 0.07 -0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.39 3g0c h HIS 754 Cb 0.00 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 27.19 3g0c h HIS 754 CO -0.06 0.44 0.28 0.52 -0.00 0.00 0.00 177.93 179.12 3g0c h MET 755 N 0.58 1.14 -0.48 5.26 2.07 -0.57 -2.40 114.93 120.52 3g0c h MET 755 Ca 0.16 -0.22 -0.01 0.00 -2.07 0.00 0.00 59.70 57.56 3g0c h MET 755 Cb 0.03 -0.18 -0.02 0.00 -1.87 0.00 0.00 31.60 29.56 3g0c h MET 755 CO -0.03 0.94 0.28 0.77 1.07 0.00 0.00 176.91 179.94 3g0c h SER 756 N 1.10 0.59 -0.75 1.22 0.02 -0.71 -1.42 113.55 113.59 3g0c h SER 756 Ca 0.25 -0.07 0.04 0.00 -0.84 0.00 0.00 61.79 61.17 3g0c h SER 756 Cb 0.24 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.58 3g0c h SER 756 CO -0.02 0.49 0.47 0.45 -1.14 0.00 0.00 176.83 177.08 3g0c h HIS 757 N 0.64 0.88 -0.43 3.45 3.86 -1.25 -1.20 115.15 121.10 3g0c h HIS 757 Ca 0.17 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.37 3g0c h HIS 757 Cb 0.02 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.19 3g0c h HIS 757 CO -0.02 0.48 0.15 0.35 0.86 0.00 0.00 177.93 179.75 3g0c h PHE 758 N 0.90 0.68 -0.11 2.45 3.57 -0.90 -1.49 116.94 122.04 3g0c h PHE 758 Ca 0.31 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 3g0c h PHE 758 Cb 0.06 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 3g0c h PHE 758 CO -0.04 0.61 -0.16 0.82 -2.23 0.00 0.00 178.31 177.32 3g0c h ILE 759 N 0.55 1.37 -0.92 1.41 1.08 -1.20 -1.61 117.51 118.19 3g0c h ILE 759 Ca 0.14 -1.38 0.12 0.00 -0.39 0.00 0.00 64.86 63.35 3g0c h ILE 759 Cb 0.24 2.02 -0.07 0.00 -3.07 0.00 0.00 36.82 35.94 3g0c h ILE 759 CO -0.01 0.40 0.59 0.11 -0.69 0.00 0.00 178.15 178.55 3g0c h LYS 760 N -0.12 0.82 -0.04 2.37 1.57 -1.17 -0.28 116.57 119.72 3g0c h LYS 760 Ca 0.01 -0.05 -0.25 0.00 -1.87 0.00 0.00 60.65 58.50 3g0c h LYS 760 Cb 0.71 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 32.85 3g0c h LYS 760 CO 0.04 0.54 -0.96 -0.56 -0.57 0.00 0.00 179.45 177.94 3g0c h GLN 761 N 0.84 0.66 0.00 3.15 -0.00 -1.21 0.38 115.11 118.93 3g0c h GLN 761 Ca 0.45 -0.66 -0.03 0.00 -0.00 0.00 0.00 58.65 58.41 3g0c h GLN 761 Cb 0.55 0.18 -0.00 0.00 -0.00 0.00 0.00 27.48 28.21 3g0c h GLN 761 CO -0.21 1.26 -0.15 0.00 -0.00 0.00 0.00 178.83 179.73 3g0c n PHE 763 N -4.26 0.00 -3.24 0.00 3.72 -0.19 -4.97 117.46 108.51 3g0c n PHE 763 Ca -0.02 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.19 3g0c n PHE 763 Cb 0.22 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 38.81 3g0c n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3g0c n SER 764 N 0.73 -5.47 -4.70 4.37 7.64 -0.81 -5.01 113.62 110.36 3g0c n SER 764 Ca 0.13 -0.38 -0.38 0.00 1.01 0.00 0.00 58.87 59.26 3g0c n SER 764 Cb 0.52 -4.15 -0.07 0.00 -1.01 0.00 0.00 64.21 59.51 3g0c n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3g0c s LEU 765 N -5.92 4.22 0.00 -3.43 1.43 0.13 -5.03 118.68 110.08 3g0c s LEU 765 Ca 0.41 0.61 0.16 0.00 -1.03 0.00 0.00 54.13 54.28 3g0c s LEU 765 Cb -0.18 -2.54 0.93 0.00 0.03 0.00 0.00 46.19 44.43 3g0c s LEU 765 CO 0.50 -0.01 1.35 -0.81 0.23 0.00 0.00 176.35 177.61