#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d4l s ARG 40 N 0.00 3.01 0.84 1.09 1.70 -1.26 -5.10 118.95 119.23 3d4l s ARG 40 Ca 0.00 -0.97 -0.12 0.00 -0.47 0.00 0.00 55.73 54.17 3d4l s ARG 40 Cb 0.00 -2.75 0.09 0.00 -0.57 0.00 0.00 34.95 31.72 3d4l s ARG 40 CO 0.00 -0.11 1.10 -1.59 -1.08 0.00 0.00 175.30 173.62 3d4l s LYS 41 N -4.30 1.75 0.49 3.89 -2.85 -1.25 -4.72 119.74 112.76 3d4l s LYS 41 Ca 0.48 0.68 0.07 0.00 -1.00 0.00 0.00 55.97 56.21 3d4l s LYS 41 Cb -0.10 -1.88 0.03 0.00 -2.06 0.00 0.00 37.83 33.82 3d4l s LYS 41 CO 0.33 -1.86 0.49 0.95 0.10 0.00 0.00 175.35 175.35 3d4l s THR 42 N -3.09 2.22 -0.45 3.79 -4.23 -1.26 -0.53 115.64 112.09 3d4l s THR 42 Ca 0.62 -1.30 -0.23 0.00 -1.18 0.00 0.00 61.69 59.60 3d4l s THR 42 Cb -0.16 -2.52 0.03 0.00 1.34 0.00 0.00 72.50 71.19 3d4l s THR 42 CO 0.55 0.00 0.81 -0.47 -0.54 0.00 0.00 174.62 174.97 3d4l s TYR 43 N -2.61 2.98 0.57 3.99 5.04 -1.26 -4.81 117.35 121.25 3d4l s TYR 43 Ca 0.47 0.20 0.00 0.00 -2.44 0.00 0.00 57.07 55.30 3d4l s TYR 43 Cb -0.04 -3.71 0.04 0.00 0.35 0.00 0.00 41.96 38.60 3d4l s TYR 43 CO 0.28 -1.00 0.81 0.95 -1.34 0.00 0.00 175.55 175.25 3d4l s THR 44 N 3.36 2.60 0.23 4.34 -4.23 -1.26 -3.87 115.64 116.82 3d4l s THR 44 Ca 0.31 -0.62 -0.07 0.00 -1.18 0.00 0.00 61.69 60.14 3d4l s THR 44 Cb -0.12 -2.99 0.19 0.00 1.34 0.00 0.00 72.50 70.93 3d4l s THR 44 CO 0.23 0.00 1.83 0.25 -0.54 0.00 0.00 174.62 176.39 3d4l h LEU 45 N -0.03 1.10 -0.97 4.79 5.85 -1.96 -1.66 115.31 122.43 3d4l h LEU 45 Ca -0.42 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.10 3d4l h LEU 45 Cb 1.30 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 3d4l h LEU 45 CO 0.53 0.93 0.03 0.74 -0.34 0.00 0.00 178.44 180.32 3d4l h THR 46 N 1.21 1.23 -0.59 1.05 2.02 -1.98 0.05 112.91 115.91 3d4l h THR 46 Ca 0.29 -0.94 0.01 0.00 0.77 0.00 0.00 66.41 66.54 3d4l h THR 46 Cb 0.11 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 3d4l h THR 46 CO -0.04 0.33 0.39 0.44 0.37 0.00 0.00 175.52 177.01 3d4l h ASP 47 N 0.73 0.66 -0.02 4.18 3.45 -1.71 0.18 116.42 123.89 3d4l h ASP 47 Ca 0.15 -0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.59 3d4l h ASP 47 Cb 0.40 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 39.01 3d4l h ASP 47 CO 0.01 0.48 -0.00 0.22 -1.57 0.00 0.00 179.24 178.38 3d4l h TYR 48 N 0.79 0.05 0.00 4.55 3.20 -0.86 -1.92 116.97 122.78 3d4l h TYR 48 Ca 0.22 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.02 3d4l h TYR 48 Cb -0.08 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 3d4l h TYR 48 CO -0.04 0.35 -0.30 -0.07 -1.64 0.00 0.00 178.16 176.46 3d4l h LEU 49 N -0.27 0.00 -2.71 2.82 3.38 -0.81 -3.03 115.31 114.68 3d4l h LEU 49 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3d4l h LEU 49 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3d4l h LEU 49 CO 0.00 0.30 0.00 0.29 0.09 0.00 0.00 178.44 179.12 3d4l n LYS 50 N -4.14 2.69 -3.98 1.13 4.76 0.61 -4.98 118.16 114.25 3d4l n LYS 50 Ca -0.02 -2.42 -0.30 0.00 -2.87 0.00 0.00 58.31 52.70 3d4l n LYS 50 Cb 0.35 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 3d4l n LYS 50 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3d4l n ASN 51 N 1.30 -2.88 -0.21 4.39 3.02 -0.76 -4.87 115.26 115.25 3d4l n ASN 51 Ca 0.20 -0.90 -0.01 0.00 -0.03 0.00 0.00 54.58 53.83 3d4l n ASN 51 Cb 0.56 -3.41 0.09 0.00 -0.61 0.00 0.00 39.78 36.41 3d4l n ASN 51 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3d4l h THR 52 N -1.84 0.90 -3.39 3.41 2.02 -1.72 -3.35 112.91 108.93 3d4l h THR 52 Ca -0.60 -0.19 -0.72 0.00 0.77 0.00 0.00 66.41 65.67 3d4l h THR 52 Cb 1.38 0.30 -0.27 0.00 -1.74 0.00 0.00 68.15 67.82 3d4l h THR 52 CO 0.68 0.10 -0.42 -0.31 0.37 0.00 0.00 175.52 175.94 3d4l s TYR 53 N -6.10 3.33 -0.15 3.16 2.02 -1.26 -5.07 117.35 113.28 3d4l s TYR 53 Ca -0.13 -1.44 -0.08 0.00 -0.37 0.00 0.00 57.07 55.05 3d4l s TYR 53 Cb 0.16 -3.10 -0.04 0.00 -0.40 0.00 0.00 41.96 38.57 3d4l s TYR 53 CO 0.75 -0.86 0.14 0.50 -1.57 0.00 0.00 175.55 174.50 3d4l s ARG 54 N 1.47 3.69 0.04 -0.62 6.06 -1.26 -5.06 118.95 123.26 3d4l s ARG 54 Ca 0.04 -0.16 -0.25 0.00 -2.50 0.00 0.00 55.73 52.86 3d4l s ARG 54 Cb -0.24 -3.27 -0.05 0.00 0.06 0.00 0.00 34.95 31.45 3d4l s ARG 54 CO 0.03 0.62 0.77 -0.51 -2.50 0.00 0.00 175.30 173.70 3d4l s LEU 55 N -0.57 4.44 0.17 -0.88 1.02 -1.26 -4.80 118.68 116.80 3d4l s LEU 55 Ca 0.13 1.43 -0.12 0.00 0.02 0.00 0.00 54.13 55.59 3d4l s LEU 55 Cb -0.12 -3.23 -0.07 0.00 0.02 0.00 0.00 46.19 42.80 3d4l s LEU 55 CO 0.02 -0.00 0.52 -0.54 0.02 0.00 0.00 176.35 176.37 3d4l s LYS 56 N 0.03 3.87 0.48 1.70 1.02 -1.26 -5.09 119.74 120.48 3d4l s LYS 56 Ca 0.39 0.35 0.02 0.00 0.02 0.00 0.00 55.97 56.75 3d4l s LYS 56 Cb -0.20 -2.84 -0.02 0.00 -0.52 0.00 0.00 37.83 34.25 3d4l s LYS 56 CO 0.23 0.43 0.03 -0.51 -0.92 0.00 0.00 175.35 174.61 3d4l s LEU 57 N -2.28 2.29 -0.44 3.17 1.02 -1.26 -4.89 118.68 116.29 3d4l s LEU 57 Ca 0.41 -1.63 0.05 0.00 0.02 0.00 0.00 54.13 52.98 3d4l s LEU 57 Cb -0.13 -0.61 0.18 0.00 0.02 0.00 0.00 46.19 45.64 3d4l s LEU 57 CO 0.20 -0.82 0.47 0.00 0.02 0.00 0.00 176.35 176.22 3d4l n TYR 58 N -1.15 -1.86 -2.91 0.29 9.36 -1.26 -4.99 117.16 114.65 3d4l n TYR 58 Ca -0.15 -2.69 -0.43 0.00 3.32 0.00 0.00 57.90 57.95 3d4l n TYR 58 Cb 0.67 0.64 -0.05 0.00 -0.63 0.00 0.00 39.34 39.97 3d4l n TYR 58 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 3d4l s SER 59 N 0.24 6.36 0.33 2.98 0.01 -1.26 -5.03 113.70 117.33 3d4l s SER 59 Ca 0.32 -0.30 0.08 0.00 1.31 0.00 0.00 55.95 57.36 3d4l s SER 59 Cb 0.03 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 3d4l s SER 59 CO -0.15 -1.08 0.17 -1.48 0.41 0.00 0.00 173.24 171.11 3d4l s LEU 60 N 3.60 3.36 -0.19 2.44 0.05 -1.26 -4.60 118.68 122.08 3d4l s LEU 60 Ca 0.29 -0.67 -0.01 0.00 0.05 0.00 0.00 54.13 53.79 3d4l s LEU 60 Cb -0.13 -1.88 0.05 0.00 -2.05 0.00 0.00 46.19 42.18 3d4l s LEU 60 CO 0.20 -0.28 -0.04 -0.13 -0.55 0.00 0.00 176.35 175.56 3d4l s ARG 61 N -3.87 1.35 0.19 1.48 0.52 0.12 -4.94 118.95 113.79 3d4l s ARG 61 Ca 0.38 -0.64 -0.30 0.00 -0.52 0.00 0.00 55.73 54.65 3d4l s ARG 61 Cb -0.04 -2.19 -0.09 0.00 0.52 0.00 0.00 34.95 33.15 3d4l s ARG 61 CO 0.23 -0.52 1.35 -1.58 0.02 0.00 0.00 175.30 174.81 3d4l s TRP 62 N 1.61 3.21 -0.34 -0.53 0.52 -1.26 0.36 118.94 122.50 3d4l s TRP 62 Ca -0.01 1.12 0.03 0.00 0.02 0.00 0.00 56.10 57.26 3d4l s TRP 62 Cb -0.17 -3.67 0.01 0.00 -1.15 0.00 0.00 33.47 28.50 3d4l s TRP 62 CO -0.07 -2.16 0.50 0.44 0.02 0.00 0.00 176.95 175.68 3d4l n ILE 63 N 2.86 0.00 -2.87 2.03 -5.35 -0.75 -4.90 119.36 110.38 3d4l n ILE 63 Ca 0.07 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 3d4l n ILE 63 Cb 0.42 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.37 3d4l n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3d4l n SER 64 N -0.09 0.00 0.06 7.28 3.41 -1.21 -4.98 113.62 118.09 3d4l n SER 64 Ca 0.02 -0.44 0.13 0.00 -0.26 0.00 0.00 58.87 58.31 3d4l n SER 64 Cb 0.07 0.00 0.36 0.00 -0.26 0.00 0.00 64.21 64.38 3d4l n SER 64 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3d4l n ASP 65 N -0.25 0.60 0.00 4.04 5.75 -1.26 -2.30 116.55 123.12 3d4l n ASP 65 Ca 0.00 0.33 0.00 0.00 -0.01 0.00 0.00 54.79 55.11 3d4l n ASP 65 Cb 0.00 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.75 3d4l n ASP 65 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d4l n HIS 66 N -1.99 0.00 -4.15 2.11 1.44 -1.26 -4.43 115.22 106.94 3d4l n HIS 66 Ca 0.05 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.65 3d4l n HIS 66 Cb 0.41 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.41 3d4l n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3d4l s GLU 67 N -0.09 0.77 0.06 -1.40 2.02 -1.26 -0.77 118.70 118.03 3d4l s GLU 67 Ca 0.00 -1.21 -0.04 0.00 0.02 0.00 0.00 54.97 53.73 3d4l s GLU 67 Cb 0.00 -0.23 -0.02 0.00 0.10 0.00 0.00 34.13 33.97 3d4l s GLU 67 CO 0.00 -0.00 0.07 1.52 0.02 0.00 0.00 175.26 176.87 3d4l s TYR 68 N -3.13 0.33 -0.11 1.61 -0.85 -0.74 -1.81 117.35 112.65 3d4l s TYR 68 Ca 0.07 -0.78 -0.06 0.00 -0.52 0.00 0.00 57.07 55.78 3d4l s TYR 68 Cb 0.02 -0.22 -0.04 0.00 0.38 0.00 0.00 41.96 42.10 3d4l s TYR 68 CO -0.04 -0.43 0.11 -0.51 -1.52 0.00 0.00 175.55 173.17 3d4l s LEU 69 N -2.72 4.20 -0.07 -3.49 1.43 0.16 -0.39 118.68 117.81 3d4l s LEU 69 Ca 0.04 0.39 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 3d4l s LEU 69 Cb 0.05 -2.04 0.04 0.00 0.03 0.00 0.00 46.19 44.26 3d4l s LEU 69 CO -0.09 0.39 0.15 -0.47 0.23 0.00 0.00 176.35 176.57 3d4l s TYR 70 N -1.01 -0.17 -0.19 0.29 5.04 -0.54 -0.71 117.35 120.05 3d4l s TYR 70 Ca 0.15 0.49 -0.20 0.00 -2.44 0.00 0.00 57.07 55.08 3d4l s TYR 70 Cb -0.12 -0.06 -0.03 0.00 0.35 0.00 0.00 41.96 42.10 3d4l s TYR 70 CO 0.04 -0.16 0.58 0.21 -1.34 0.00 0.00 175.55 174.88 3d4l s LYS 71 N 1.05 4.21 -0.04 4.97 2.20 -1.26 -1.01 119.74 129.86 3d4l s LYS 71 Ca -0.08 0.53 -0.02 0.00 -0.36 0.00 0.00 55.97 56.04 3d4l s LYS 71 Cb -0.10 -3.56 0.03 0.00 -1.51 0.00 0.00 37.83 32.69 3d4l s LYS 71 CO -0.05 -0.18 0.07 -1.14 -0.36 0.00 0.00 175.35 173.68 3d4l s GLN 72 N 1.73 -0.06 -1.35 4.03 0.74 0.15 -4.82 119.66 120.07 3d4l s GLN 72 Ca 0.27 0.37 -0.04 0.00 0.05 0.00 0.00 55.36 56.02 3d4l s GLN 72 Cb -0.16 -0.46 0.00 0.00 1.10 0.00 0.00 33.01 33.50 3d4l s GLN 72 CO 0.10 -0.31 0.47 0.39 -0.55 0.00 0.00 175.29 175.40 3d4l n GLU 73 N 5.17 -3.94 -0.77 1.67 1.02 -1.26 -1.17 120.64 121.36 3d4l n GLU 73 Ca -0.06 0.79 0.00 0.00 -0.02 0.00 0.00 57.16 57.87 3d4l n GLU 73 Cb 0.50 -5.37 0.00 0.00 -0.02 0.00 0.00 31.44 26.55 3d4l n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3d4l n ASN 74 N -1.84 0.00 -4.87 1.62 3.02 -1.26 -4.80 115.26 107.13 3d4l n ASN 74 Ca -0.11 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.07 3d4l n ASN 74 Cb 0.61 -1.03 -0.06 0.00 -0.61 0.00 0.00 39.78 38.69 3d4l n ASN 74 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3d4l s ASN 75 N -2.60 6.50 -0.31 6.41 0.01 -0.32 -3.91 114.94 120.71 3d4l s ASN 75 Ca 0.00 0.59 -0.14 0.00 -0.71 0.00 0.00 52.86 52.61 3d4l s ASN 75 Cb 0.00 -2.11 -0.03 0.00 0.41 0.00 0.00 41.25 39.52 3d4l s ASN 75 CO 0.00 0.38 0.30 -0.63 -1.51 0.00 0.00 177.10 175.64 3d4l s ILE 76 N -1.06 5.23 0.18 0.60 1.01 -0.58 0.33 121.20 126.90 3d4l s ILE 76 Ca 0.18 0.15 0.06 0.00 0.00 0.00 0.00 60.65 61.04 3d4l s ILE 76 Cb -0.13 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 3d4l s ILE 76 CO 0.07 0.07 0.11 -0.76 0.00 0.00 0.00 174.94 174.43 3d4l s LEU 77 N 1.91 3.67 -0.13 2.97 1.43 -0.18 0.10 118.68 128.45 3d4l s LEU 77 Ca 0.10 -0.22 -0.00 0.00 -1.03 0.00 0.00 54.13 52.98 3d4l s LEU 77 Cb -0.16 -2.28 -0.01 0.00 0.03 0.00 0.00 46.19 43.76 3d4l s LEU 77 CO 0.11 0.06 -0.13 0.54 0.23 0.00 0.00 176.35 177.16 3d4l s VAL 78 N -1.80 2.98 0.01 -1.59 0.11 0.04 -1.47 120.40 118.69 3d4l s VAL 78 Ca 0.30 -0.68 0.04 0.00 -2.93 0.00 0.00 61.98 58.71 3d4l s VAL 78 Cb -0.10 -2.25 -0.03 0.00 -1.53 0.00 0.00 36.38 32.47 3d4l s VAL 78 CO 0.22 0.52 -0.07 -0.36 -3.33 0.00 0.00 175.10 172.09 3d4l s PHE 79 N 0.42 2.88 -0.21 1.54 0.08 0.48 -1.50 117.98 121.67 3d4l s PHE 79 Ca -0.10 -0.05 -0.16 0.00 0.12 0.00 0.00 56.93 56.74 3d4l s PHE 79 Cb -0.16 -1.59 -0.04 0.00 -0.57 0.00 0.00 43.02 40.66 3d4l s PHE 79 CO 0.05 0.38 0.43 1.21 -0.10 0.00 0.00 175.22 177.19 3d4l s ASN 80 N -1.51 6.44 0.15 1.36 3.84 -0.35 -1.79 114.94 123.08 3d4l s ASN 80 Ca 0.18 0.52 -0.12 0.00 0.21 0.00 0.00 52.86 53.66 3d4l s ASN 80 Cb -0.11 -2.25 0.01 0.00 -0.55 0.00 0.00 41.25 38.35 3d4l s ASN 80 CO 0.08 -0.12 1.57 0.00 -2.79 0.00 0.00 177.10 175.84 3d4l h ALA 81 N 7.52 0.66 -0.34 1.71 0.00 -1.28 0.35 119.26 127.89 3d4l h ALA 81 Ca -0.35 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 3d4l h ALA 81 Cb 1.16 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3d4l h ALA 81 CO 0.71 0.55 0.21 1.49 0.00 0.00 0.00 179.25 182.21 3d4l h GLU 82 N 0.77 0.45 0.00 0.00 4.57 -1.94 -3.34 114.58 115.09 3d4l h GLU 82 Ca 0.12 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 3d4l h GLU 82 Cb 0.64 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3d4l h GLU 82 CO 0.04 0.34 -1.56 0.66 -1.18 0.00 0.00 179.01 177.31 3d4l n TYR 83 N -4.82 0.00 -0.71 0.92 4.02 -1.23 -5.00 117.16 110.33 3d4l n TYR 83 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 3d4l n TYR 83 Cb 0.05 -0.30 0.00 0.00 -0.02 0.00 0.00 39.34 39.06 3d4l n TYR 83 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3d4l n GLY 84 N 1.57 0.90 3.81 2.72 0.00 0.11 -5.03 105.19 109.27 3d4l n GLY 84 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3d4l n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d4l s ASN 85 N -3.01 6.14 0.22 1.61 4.22 -1.25 -4.77 114.94 118.09 3d4l s ASN 85 Ca 0.00 1.77 -0.00 0.00 -2.14 0.00 0.00 52.86 52.49 3d4l s ASN 85 Cb 0.00 -2.53 -0.04 0.00 1.28 0.00 0.00 41.25 39.95 3d4l s ASN 85 CO 0.00 -0.92 0.11 -0.94 -2.04 0.00 0.00 177.10 173.31 3d4l s SER 86 N -2.68 0.55 0.07 3.54 1.04 -1.26 -1.22 113.70 113.73 3d4l s SER 86 Ca 0.63 -1.38 -0.04 0.00 0.48 0.00 0.00 55.95 55.64 3d4l s SER 86 Cb -0.14 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.25 3d4l s SER 86 CO 0.31 -0.79 0.06 -0.44 0.98 0.00 0.00 173.24 173.36 3d4l s SER 87 N -3.21 0.34 0.04 7.02 0.01 -0.57 -4.97 113.70 112.36 3d4l s SER 87 Ca 0.38 -0.86 -0.30 0.00 1.31 0.00 0.00 55.95 56.48 3d4l s SER 87 Cb 0.07 0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.52 3d4l s SER 87 CO 0.12 -0.65 0.98 -0.69 0.41 0.00 0.00 173.24 173.42 3d4l s VAL 88 N -3.88 4.69 -0.24 3.43 1.01 -1.26 -0.78 120.40 123.37 3d4l s VAL 88 Ca 0.06 2.03 0.06 0.00 0.00 0.00 0.00 61.98 64.13 3d4l s VAL 88 Cb 0.07 -4.30 -0.19 0.00 0.00 0.00 0.00 36.38 31.95 3d4l s VAL 88 CO -0.10 0.21 -0.14 0.33 0.00 0.00 0.00 175.10 175.40 3d4l n PHE 89 N 3.50 0.03 -3.66 5.22 -0.00 0.29 -4.82 117.46 118.02 3d4l n PHE 89 Ca 0.05 0.01 -0.07 0.00 -0.00 0.00 0.00 57.45 57.43 3d4l n PHE 89 Cb 0.50 -1.00 -0.08 0.00 -0.00 0.00 0.00 39.48 38.89 3d4l n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 3d4l s LEU 90 N -6.29 -0.68 0.31 -2.13 2.96 -0.30 -4.98 118.68 107.57 3d4l s LEU 90 Ca -0.29 1.13 -0.29 0.00 -0.22 0.00 0.00 54.13 54.46 3d4l s LEU 90 Cb 0.08 1.62 -0.11 0.00 0.50 0.00 0.00 46.19 48.29 3d4l s LEU 90 CO 0.66 -0.22 1.51 -1.61 -1.32 0.00 0.00 176.35 175.37 3d4l s GLU 91 N 2.40 4.16 0.57 1.98 0.41 -1.26 -1.53 118.70 125.44 3d4l s GLU 91 Ca -0.04 2.49 0.34 0.00 -0.41 0.00 0.00 54.97 57.35 3d4l s GLU 91 Cb -0.11 -3.03 1.68 0.00 -1.78 0.00 0.00 34.13 30.90 3d4l s GLU 91 CO -0.15 -0.53 2.12 -2.95 -0.49 0.00 0.00 175.26 173.27 3d4l h ASN 92 N 4.28 0.00 0.77 -0.19 -1.07 -1.87 -1.98 115.58 115.52 3d4l h ASN 92 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.89 3d4l h ASN 92 Cb 1.23 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.48 3d4l h ASN 92 CO 0.74 0.05 -0.66 -1.54 0.07 0.00 0.00 177.43 176.09 3d4l n SER 93 N -3.30 0.66 -0.37 6.14 3.41 -1.26 -4.20 113.62 114.70 3d4l n SER 93 Ca -0.01 0.04 0.38 0.00 -0.26 0.00 0.00 58.87 59.01 3d4l n SER 93 Cb 0.22 0.25 0.72 0.00 -0.26 0.00 0.00 64.21 65.14 3d4l n SER 93 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3d4l h THR 94 N 0.00 0.22 -0.48 6.66 2.02 -1.73 0.13 112.91 119.74 3d4l h THR 94 Ca 0.00 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.84 3d4l h THR 94 Cb 0.71 0.25 -0.24 0.00 -1.74 0.00 0.00 68.15 67.13 3d4l h THR 94 CO 0.00 0.00 -0.51 0.49 0.37 0.00 0.00 175.52 175.87 3d4l n PHE 95 N -3.90 1.69 -0.20 3.16 3.72 -1.26 -4.79 117.46 115.89 3d4l n PHE 95 Ca 0.28 -1.96 0.04 0.00 -0.05 0.00 0.00 57.45 55.76 3d4l n PHE 95 Cb 1.44 -0.40 0.31 0.00 -0.94 0.00 0.00 39.48 39.88 3d4l n PHE 95 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3d4l h ASP 96 N 1.63 0.75 -0.63 4.37 3.32 -0.99 -1.83 116.42 123.05 3d4l h ASP 96 Ca 0.25 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3d4l h ASP 96 Cb 1.35 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3d4l h ASP 96 CO 0.52 0.51 0.00 -0.62 -1.72 0.00 0.00 179.24 177.93 3d4l n GLU 97 N -4.46 3.94 -0.19 3.56 4.71 -1.26 -4.56 120.64 122.37 3d4l n GLU 97 Ca 0.10 -2.94 0.11 0.00 -0.01 0.00 0.00 57.16 54.42 3d4l n GLU 97 Cb 0.16 -1.96 0.43 0.00 -1.01 0.00 0.00 31.44 29.06 3d4l n GLU 97 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 3d4l h PHE 98 N 4.06 0.65 0.00 -0.32 3.57 -1.68 -3.46 116.94 119.76 3d4l h PHE 98 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3d4l h PHE 98 Cb 1.55 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 40.08 3d4l h PHE 98 CO 0.82 0.28 0.00 0.41 -2.23 0.00 0.00 178.31 177.59 3d4l n GLY 99 N -1.48 2.64 3.81 2.40 0.00 -1.26 -5.01 105.19 106.30 3d4l n GLY 99 Ca 0.14 -0.41 -0.24 0.00 0.00 0.00 0.00 46.02 45.51 3d4l n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3d4l s HIS 100 N -1.23 3.14 -0.24 1.61 3.76 -1.26 -5.08 115.29 115.98 3d4l s HIS 100 Ca 0.00 -0.06 -0.21 0.00 -0.15 0.00 0.00 55.06 54.64 3d4l s HIS 100 Cb 0.00 -1.46 -0.02 0.00 1.11 0.00 0.00 32.58 32.21 3d4l s HIS 100 CO 0.00 0.52 0.66 0.45 -0.85 0.00 0.00 174.74 175.52 3d4l s SER 101 N -3.48 6.64 -0.08 1.40 0.15 -1.26 -5.02 113.70 112.05 3d4l s SER 101 Ca 0.32 0.79 -0.30 0.00 0.70 0.00 0.00 55.95 57.46 3d4l s SER 101 Cb -0.09 -2.36 -0.02 0.00 -1.71 0.00 0.00 66.02 61.84 3d4l s SER 101 CO 0.24 -0.37 1.11 -0.63 1.20 0.00 0.00 173.24 174.79 3d4l s ILE 102 N 2.44 4.50 -0.07 6.45 1.01 -1.26 -4.40 121.20 129.87 3d4l s ILE 102 Ca 0.28 1.79 -0.22 0.00 0.00 0.00 0.00 60.65 62.51 3d4l s ILE 102 Cb -0.16 -4.15 -0.30 0.00 0.01 0.00 0.00 42.46 37.86 3d4l s ILE 102 CO 0.09 -0.00 0.80 -1.13 0.00 0.00 0.00 174.94 174.69 3d4l h ASN 103 N 7.30 0.39 -5.08 3.58 -1.24 0.08 -3.49 115.58 117.12 3d4l h ASN 103 Ca -0.32 -0.93 0.01 0.00 0.71 0.00 0.00 56.30 55.77 3d4l h ASN 103 Cb 1.15 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 40.03 3d4l h ASN 103 CO 0.87 1.39 0.14 -0.62 -1.29 0.00 0.00 177.43 177.92 3d4l s ASP 104 N -6.90 -0.13 0.04 1.15 -1.08 -1.19 -5.02 116.67 103.55 3d4l s ASP 104 Ca -0.16 -0.81 -0.00 0.00 -0.52 0.00 0.00 52.55 51.06 3d4l s ASP 104 Cb 0.01 0.71 -0.03 0.00 -1.46 0.00 0.00 42.92 42.15 3d4l s ASP 104 CO 0.80 -1.36 -0.04 -0.72 0.52 0.00 0.00 175.17 174.37 3d4l s TYR 105 N -3.64 0.47 -0.12 -5.34 1.13 -1.26 -1.00 117.35 107.58 3d4l s TYR 105 Ca 0.15 -0.82 -0.04 0.00 -1.41 0.00 0.00 57.07 54.95 3d4l s TYR 105 Cb -0.04 -0.33 0.06 0.00 -1.10 0.00 0.00 41.96 40.55 3d4l s TYR 105 CO 0.09 -0.27 0.21 0.45 -2.51 0.00 0.00 175.55 173.51 3d4l s SER 106 N -2.31 0.75 -0.02 -0.18 0.15 -0.24 -4.97 113.70 106.88 3d4l s SER 106 Ca -0.02 0.31 -0.19 0.00 0.70 0.00 0.00 55.95 56.75 3d4l s SER 106 Cb 0.00 0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 64.69 3d4l s SER 106 CO -0.06 -0.26 0.55 -0.63 1.20 0.00 0.00 173.24 174.05 3d4l s ILE 107 N 2.34 4.97 0.68 6.45 1.01 -1.26 0.37 121.20 135.76 3d4l s ILE 107 Ca 0.03 1.14 -0.17 0.00 0.00 0.00 0.00 60.65 61.66 3d4l s ILE 107 Cb -0.13 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.47 3d4l s ILE 107 CO -0.08 0.42 1.27 -0.94 0.00 0.00 0.00 174.94 175.62 3d4l s SER 108 N -0.18 4.41 0.40 3.58 1.04 0.06 -4.86 113.70 118.16 3d4l s SER 108 Ca 0.29 2.56 0.15 0.00 0.48 0.00 0.00 55.95 59.43 3d4l s SER 108 Cb -0.18 -2.61 1.01 0.00 0.10 0.00 0.00 66.02 64.34 3d4l s SER 108 CO 0.16 -2.13 1.87 -0.65 0.98 0.00 0.00 173.24 173.47 3d4l h PRO 109 N 0.26 0.47 -0.12 4.02 0.11 -1.82 0.14 132.00 135.05 3d4l h PRO 109 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3d4l h PRO 109 Cb 1.33 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3d4l h PRO 109 CO 0.52 0.31 0.00 -0.40 -0.21 0.00 0.00 178.00 178.22 3d4l n ASP 110 N -4.52 0.84 0.00 -2.05 3.85 -1.12 -4.86 116.55 108.70 3d4l n ASP 110 Ca 0.18 -1.76 0.00 0.00 -0.71 0.00 0.00 54.79 52.49 3d4l n ASP 110 Cb 0.60 -0.08 0.00 0.00 -1.35 0.00 0.00 41.12 40.29 3d4l n ASP 110 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3d4l n GLY 111 N 0.87 0.17 0.12 6.12 0.00 0.50 -4.88 105.19 108.09 3d4l n GLY 111 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3d4l n GLY 111 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3d4l h GLN 112 N 0.39 0.00 -4.71 1.61 4.20 -1.91 -3.46 115.11 111.23 3d4l h GLN 112 Ca 0.00 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.47 3d4l h GLN 112 Cb 0.59 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.23 3d4l h GLN 112 CO 0.00 0.58 -0.70 -0.06 -0.67 0.00 0.00 178.83 177.98 3d4l s PHE 113 N -2.91 0.95 -0.06 2.96 0.08 -1.26 -0.87 117.98 116.87 3d4l s PHE 113 Ca 0.03 -0.89 -0.00 0.00 0.12 0.00 0.00 56.93 56.19 3d4l s PHE 113 Cb 0.08 -0.53 0.02 0.00 -0.57 0.00 0.00 43.02 42.02 3d4l s PHE 113 CO 0.77 -0.11 -0.03 -1.50 -0.10 0.00 0.00 175.22 174.24 3d4l s ILE 114 N -3.58 0.53 -0.14 0.64 2.07 -0.72 -0.76 121.20 119.24 3d4l s ILE 114 Ca 0.13 -0.04 -0.24 0.00 -1.41 0.00 0.00 60.65 59.08 3d4l s ILE 114 Cb 0.05 -0.61 -0.02 0.00 0.13 0.00 0.00 42.46 42.01 3d4l s ILE 114 CO -0.04 0.26 0.76 -0.22 -1.91 0.00 0.00 174.94 173.78 3d4l s LEU 115 N 1.43 4.21 -0.22 8.50 2.96 0.16 -1.45 118.68 134.27 3d4l s LEU 115 Ca -0.03 1.12 -0.07 0.00 -0.22 0.00 0.00 54.13 54.93 3d4l s LEU 115 Cb -0.13 -3.13 -0.03 0.00 0.50 0.00 0.00 46.19 43.39 3d4l s LEU 115 CO -0.03 -0.29 0.07 -0.76 -1.32 0.00 0.00 176.35 174.03 3d4l s LEU 116 N 1.68 3.61 -0.19 -0.68 1.43 0.14 -1.08 118.68 123.59 3d4l s LEU 116 Ca 0.36 -0.08 -0.08 0.00 -1.03 0.00 0.00 54.13 53.30 3d4l s LEU 116 Cb -0.17 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 3d4l s LEU 116 CO 0.14 0.05 0.08 -0.70 0.23 0.00 0.00 176.35 176.16 3d4l s GLU 117 N 1.11 4.01 0.33 1.70 2.12 -0.17 -1.68 118.70 126.13 3d4l s GLU 117 Ca 0.04 -0.32 -0.05 0.00 0.36 0.00 0.00 54.97 55.00 3d4l s GLU 117 Cb -0.14 -3.29 0.01 0.00 0.26 0.00 0.00 34.13 30.97 3d4l s GLU 117 CO 0.03 0.24 0.50 1.52 -0.54 0.00 0.00 175.26 177.02 3d4l s TYR 118 N 0.48 0.86 -1.46 5.30 1.13 -0.50 0.85 117.35 124.01 3d4l s TYR 118 Ca 0.05 -1.16 -0.09 0.00 -1.41 0.00 0.00 57.07 54.46 3d4l s TYR 118 Cb -0.12 0.05 0.04 0.00 -1.10 0.00 0.00 41.96 40.82 3d4l s TYR 118 CO 0.00 -1.16 0.84 0.09 -2.51 0.00 0.00 175.55 172.82 3d4l n ASN 119 N -1.24 -5.56 -4.72 -0.18 3.02 -1.26 0.04 115.26 105.35 3d4l n ASN 119 Ca -0.00 -0.49 -0.43 0.00 -0.03 0.00 0.00 54.58 53.63 3d4l n ASN 119 Cb 0.61 -4.45 -0.02 0.00 -0.61 0.00 0.00 39.78 35.31 3d4l n ASN 119 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d4l n TYR 120 N -4.62 2.67 -3.65 3.10 9.36 -1.26 -4.33 117.16 118.42 3d4l n TYR 120 Ca -0.03 0.23 -0.27 0.00 3.32 0.00 0.00 57.90 61.15 3d4l n TYR 120 Cb 0.57 -2.59 -0.17 0.00 -0.63 0.00 0.00 39.34 36.52 3d4l n TYR 120 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3d4l s VAL 121 N 0.37 0.14 0.41 2.97 1.01 -0.27 -5.01 120.40 120.03 3d4l s VAL 121 Ca 0.69 -0.34 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 3d4l s VAL 121 Cb -0.54 -0.76 -0.08 0.00 0.00 0.00 0.00 36.38 34.99 3d4l s VAL 121 CO 0.44 -0.27 1.25 -0.75 0.00 0.00 0.00 175.10 175.77 3d4l s LYS 122 N 2.03 3.97 0.00 2.72 2.20 -1.26 -1.41 119.74 128.00 3d4l s LYS 122 Ca 0.01 2.04 0.00 0.00 -0.36 0.00 0.00 55.97 57.66 3d4l s LYS 122 Cb -0.16 -2.71 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 3d4l s LYS 122 CO -0.10 -0.45 0.00 0.94 -0.36 0.00 0.00 175.35 175.38 3d4l n GLN 123 N 0.08 0.00 0.00 4.03 7.27 0.16 -4.88 117.38 124.03 3d4l n GLN 123 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.11 3d4l n GLN 123 Cb 0.45 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.10 3d4l n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 3d4l n TRP 124 N 0.00 0.00 -0.15 3.69 5.03 -1.19 -4.92 117.44 119.90 3d4l n TRP 124 Ca 0.00 0.00 -0.04 0.00 3.03 0.00 0.00 57.50 60.49 3d4l n TRP 124 Cb 0.00 0.00 0.15 0.00 -1.03 0.00 0.00 31.31 30.43 3d4l n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 3d4l h ARG 125 N 0.00 0.88 0.00 -0.99 2.43 -1.98 -3.36 114.38 111.36 3d4l h ARG 125 Ca 0.00 -0.20 -0.06 0.00 -0.81 0.00 0.00 59.98 58.90 3d4l h ARG 125 Cb 0.00 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 3d4l h ARG 125 CO 0.00 0.81 -1.24 0.72 -1.51 0.00 0.00 179.97 178.75 3d4l n HIS 126 N -4.25 0.00 -2.05 2.20 8.25 -1.26 -5.06 115.22 113.05 3d4l n HIS 126 Ca 0.04 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.17 3d4l n HIS 126 Cb 0.25 -0.17 0.01 0.00 1.12 0.00 0.00 29.99 31.20 3d4l n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3d4l s SER 127 N -3.49 5.67 -0.09 0.41 1.04 -1.26 -4.69 113.70 111.29 3d4l s SER 127 Ca -0.02 1.92 -0.32 0.00 0.48 0.00 0.00 55.95 58.00 3d4l s SER 127 Cb 0.01 -2.55 0.13 0.00 0.10 0.00 0.00 66.02 63.71 3d4l s SER 127 CO 0.14 -1.25 1.21 -0.72 0.98 0.00 0.00 173.24 173.61 3d4l s TYR 128 N -2.30 -0.10 0.23 5.02 -0.85 -1.26 -0.67 117.35 117.42 3d4l s TYR 128 Ca 0.66 0.01 0.10 0.00 -0.52 0.00 0.00 57.07 57.32 3d4l s TYR 128 Cb -0.18 0.54 -0.05 0.00 0.38 0.00 0.00 41.96 42.65 3d4l s TYR 128 CO 0.35 -0.28 -0.19 0.95 -1.52 0.00 0.00 175.55 174.86 3d4l s THR 129 N -2.50 2.15 0.25 -3.49 -4.23 -0.50 -4.63 115.64 102.69 3d4l s THR 129 Ca 0.11 -2.22 -0.21 0.00 -1.18 0.00 0.00 61.69 58.19 3d4l s THR 129 Cb 0.01 -2.13 0.04 0.00 1.34 0.00 0.00 72.50 71.77 3d4l s THR 129 CO -0.04 -0.40 0.83 0.00 -0.54 0.00 0.00 174.62 174.47 3d4l s ALA 130 N -2.44 -1.30 0.14 3.99 0.00 -0.85 -1.11 121.76 120.19 3d4l s ALA 130 Ca 0.24 -0.25 0.04 0.00 0.00 0.00 0.00 51.96 51.99 3d4l s ALA 130 Cb -0.04 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 3d4l s ALA 130 CO 0.11 -1.04 0.16 -1.12 0.00 0.00 0.00 175.76 173.87 3d4l s SER 131 N -2.99 5.73 0.04 0.00 0.01 0.11 -1.89 113.70 114.71 3d4l s SER 131 Ca 0.13 -0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.38 3d4l s SER 131 Cb -0.04 -1.57 -0.03 0.00 0.21 0.00 0.00 66.02 64.59 3d4l s SER 131 CO 0.06 0.09 -0.06 -0.31 0.41 0.00 0.00 173.24 173.44 3d4l s TYR 132 N -1.66 0.54 0.01 2.43 1.51 -1.26 -1.41 117.35 117.51 3d4l s TYR 132 Ca 0.32 -0.60 -0.00 0.00 -1.01 0.00 0.00 57.07 55.77 3d4l s TYR 132 Cb -0.11 -0.34 -0.01 0.00 -0.11 0.00 0.00 41.96 41.39 3d4l s TYR 132 CO 0.24 -0.15 -0.01 -0.51 -1.11 0.00 0.00 175.55 174.01 3d4l s ASP 133 N -1.79 0.17 -0.13 2.29 1.01 -0.67 -4.51 116.67 113.04 3d4l s ASP 133 Ca -0.09 -0.37 -0.00 0.00 0.71 0.00 0.00 52.55 52.80 3d4l s ASP 133 Cb -0.07 0.09 -0.02 0.00 1.01 0.00 0.00 42.92 43.93 3d4l s ASP 133 CO -0.01 -0.24 -0.13 -0.63 0.21 0.00 0.00 175.17 174.37 3d4l s ILE 134 N -1.12 3.10 -0.14 0.77 1.01 -1.26 0.27 121.20 123.83 3d4l s ILE 134 Ca -0.12 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 59.87 3d4l s ILE 134 Cb -0.08 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 3d4l s ILE 134 CO -0.01 0.53 -0.09 -0.47 0.00 0.00 0.00 174.94 174.90 3d4l s TYR 135 N 0.30 2.90 -0.20 3.97 5.04 -0.53 -0.32 117.35 128.51 3d4l s TYR 135 Ca -0.10 -0.50 -0.27 0.00 -2.44 0.00 0.00 57.07 53.76 3d4l s TYR 135 Cb -0.16 -1.89 -0.00 0.00 0.35 0.00 0.00 41.96 40.26 3d4l s TYR 135 CO 0.05 -0.14 0.92 0.34 -1.34 0.00 0.00 175.55 175.39 3d4l s ASP 136 N 0.34 7.01 0.13 4.32 -1.08 0.23 -1.76 116.67 125.87 3d4l s ASP 136 Ca -0.08 1.26 0.03 0.00 -0.52 0.00 0.00 52.55 53.23 3d4l s ASP 136 Cb -0.15 -2.49 -0.12 0.00 -1.46 0.00 0.00 42.92 38.70 3d4l s ASP 136 CO 0.05 -0.52 1.30 -0.07 0.52 0.00 0.00 175.17 176.44 3d4l h LEU 137 N 8.86 0.20 -0.07 -1.34 3.38 -1.30 -1.34 115.31 123.71 3d4l h LEU 137 Ca -0.25 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 3d4l h LEU 137 Cb 1.10 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3d4l h LEU 137 CO 0.89 1.07 -0.12 0.78 0.09 0.00 0.00 178.44 181.16 3d4l h ASN 138 N 0.06 0.22 -0.24 -0.43 2.35 -1.91 -3.13 115.58 112.49 3d4l h ASN 138 Ca -0.05 -0.55 0.00 0.00 -0.55 0.00 0.00 56.30 55.15 3d4l h ASN 138 Cb 1.68 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.99 3d4l h ASN 138 CO 0.15 0.72 0.00 2.29 -1.65 0.00 0.00 177.43 178.94 3d4l n LYS 139 N -4.65 1.90 -4.07 0.81 2.85 -1.26 -4.94 118.16 108.80 3d4l n LYS 139 Ca -0.08 -1.36 -0.29 0.00 -1.05 0.00 0.00 58.31 55.53 3d4l n LYS 139 Cb 0.35 -1.40 -0.03 0.00 -0.65 0.00 0.00 35.03 33.30 3d4l n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3d4l n ARG 140 N 0.59 -2.94 -4.04 -1.58 5.12 -0.58 -4.95 116.66 108.28 3d4l n ARG 140 Ca 0.16 0.35 -0.12 0.00 -1.93 0.00 0.00 57.85 56.31 3d4l n ARG 140 Cb 0.38 -4.55 -0.12 0.00 -1.16 0.00 0.00 32.46 27.02 3d4l n ARG 140 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3d4l s GLN 141 N -6.77 0.41 0.09 5.56 0.74 -0.76 -4.96 119.66 113.98 3d4l s GLN 141 Ca 0.19 -0.58 -0.27 0.00 0.05 0.00 0.00 55.36 54.75 3d4l s GLN 141 Cb -0.11 -0.17 -0.06 0.00 1.10 0.00 0.00 33.01 33.77 3d4l s GLN 141 CO 0.91 0.03 0.86 -1.17 -0.55 0.00 0.00 175.29 175.37 3d4l s LEU 142 N -1.22 4.48 -0.04 3.68 2.96 -1.26 0.77 118.68 128.05 3d4l s LEU 142 Ca -0.09 1.62 -0.28 0.00 -0.22 0.00 0.00 54.13 55.16 3d4l s LEU 142 Cb -0.08 -3.40 -0.03 0.00 0.50 0.00 0.00 46.19 43.18 3d4l s LEU 142 CO -0.00 -0.01 0.92 -0.63 -1.32 0.00 0.00 176.35 175.31 3d4l s ILE 143 N -0.12 4.89 -0.28 6.68 1.01 0.57 -4.91 121.20 129.03 3d4l s ILE 143 Ca 0.42 1.91 0.08 0.00 0.00 0.00 0.00 60.65 63.06 3d4l s ILE 143 Cb -0.22 -4.25 -0.09 0.00 0.01 0.00 0.00 42.46 37.91 3d4l s ILE 143 CO 0.26 0.15 0.29 0.35 0.00 0.00 0.00 174.94 176.00 3d4l n THR 144 N 4.01 0.00 -3.42 2.92 -2.24 -1.26 -4.60 114.28 109.69 3d4l n THR 144 Ca 0.05 -0.29 -0.37 0.00 -2.27 0.00 0.00 64.05 61.17 3d4l n THR 144 Cb 0.51 0.85 -0.06 0.00 -2.10 0.00 0.00 70.33 69.53 3d4l n THR 144 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3d4l s GLU 145 N -1.91 3.97 -1.44 -0.78 2.02 -1.26 -4.48 118.70 114.83 3d4l s GLU 145 Ca 0.02 0.47 -0.03 0.00 0.02 0.00 0.00 54.97 55.45 3d4l s GLU 145 Cb 0.06 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 31.18 3d4l s GLU 145 CO 0.32 0.60 0.30 0.39 0.02 0.00 0.00 175.26 176.88 3d4l n GLU 146 N 1.35 -2.20 -2.12 1.61 -0.58 -1.26 -4.67 120.64 112.77 3d4l n GLU 146 Ca -0.10 0.28 -0.32 0.00 -0.42 0.00 0.00 57.16 56.60 3d4l n GLU 146 Cb 0.52 -4.07 -0.00 0.00 -0.57 0.00 0.00 31.44 27.32 3d4l n GLU 146 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 3d4l s ARG 147 N -6.87 3.55 0.29 3.49 1.70 -1.26 -4.82 118.95 115.03 3d4l s ARG 147 Ca 0.05 1.04 -0.30 0.00 -0.47 0.00 0.00 55.73 56.05 3d4l s ARG 147 Cb -0.02 -2.07 -0.12 0.00 -0.57 0.00 0.00 34.95 32.16 3d4l s ARG 147 CO 0.93 -0.61 1.49 -0.89 -1.08 0.00 0.00 175.30 175.15 3d4l n ILE 148 N -2.03 1.23 -0.81 4.99 5.41 -1.26 -4.94 119.36 121.94 3d4l n ILE 148 Ca 0.08 -0.31 -0.30 0.00 1.00 0.00 0.00 62.75 63.21 3d4l n ILE 148 Cb 0.53 -1.78 0.17 0.00 -0.71 0.00 0.00 39.64 37.85 3d4l n ILE 148 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 3d4l s PRO 149 N -0.82 0.86 0.69 0.38 0.02 -1.26 -4.61 135.00 130.26 3d4l s PRO 149 Ca 0.63 1.27 -0.11 0.00 0.02 0.00 0.00 61.00 62.81 3d4l s PRO 149 Cb -0.55 -1.73 0.01 0.00 0.02 0.00 0.00 34.50 32.26 3d4l s PRO 149 CO 0.52 -2.65 1.08 -0.80 -0.33 0.00 0.00 177.00 174.82 3d4l s ASN 150 N -2.84 5.49 -1.70 2.53 0.01 -1.26 -3.88 114.94 113.29 3d4l s ASN 150 Ca 0.66 1.12 0.00 0.00 -0.71 0.00 0.00 52.86 53.92 3d4l s ASN 150 Cb -0.22 -1.94 0.00 0.00 0.41 0.00 0.00 41.25 39.51 3d4l s ASN 150 CO 0.59 -1.30 0.00 0.59 -1.51 0.00 0.00 177.10 175.47 3d4l n ASN 151 N -2.97 -5.66 -4.73 -1.22 3.02 -1.19 -4.95 115.26 97.56 3d4l n ASN 151 Ca 0.07 -0.01 -0.41 0.00 -0.03 0.00 0.00 54.58 54.20 3d4l n ASN 151 Cb 0.57 -4.69 -0.03 0.00 -0.61 0.00 0.00 39.78 35.01 3d4l n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3d4l s THR 152 N -2.98 3.53 -0.05 3.41 2.01 -0.79 -4.63 115.64 116.14 3d4l s THR 152 Ca 0.00 1.26 0.13 0.00 0.31 0.00 0.00 61.69 63.39 3d4l s THR 152 Cb 0.00 -3.80 -0.14 0.00 0.01 0.00 0.00 72.50 68.56 3d4l s THR 152 CO 0.00 0.19 1.00 1.56 -0.69 0.00 0.00 174.62 176.68 3d4l h GLN 153 N 5.46 0.00 -1.75 4.92 4.20 -1.32 -2.26 115.11 124.36 3d4l h GLN 153 Ca -0.44 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.29 3d4l h GLN 153 Cb 1.21 0.00 -0.23 0.00 0.30 0.00 0.00 27.48 28.77 3d4l h GLN 153 CO 0.76 0.56 0.36 -0.46 -0.67 0.00 0.00 178.83 179.38 3d4l s TRP 154 N -2.79 -0.54 -0.08 2.96 -0.11 -1.21 -4.66 118.94 112.51 3d4l s TRP 154 Ca -0.01 1.14 -0.13 0.00 1.22 0.00 0.00 56.10 58.32 3d4l s TRP 154 Cb 0.09 0.38 0.03 0.00 -1.50 0.00 0.00 33.47 32.47 3d4l s TRP 154 CO 0.81 -0.37 0.32 0.54 -4.62 0.00 0.00 176.95 173.62 3d4l s VAL 155 N -0.45 0.02 -0.21 5.86 0.11 -1.26 -0.77 120.40 123.70 3d4l s VAL 155 Ca -0.02 -0.19 -0.19 0.00 -2.93 0.00 0.00 61.98 58.65 3d4l s VAL 155 Cb -0.03 -0.52 0.06 0.00 -1.53 0.00 0.00 36.38 34.36 3d4l s VAL 155 CO 0.01 -0.10 0.56 0.28 -3.33 0.00 0.00 175.10 172.52 3d4l s THR 156 N -0.40 -0.00 0.67 5.04 -1.32 -0.40 -5.01 115.64 114.23 3d4l s THR 156 Ca -0.05 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.31 3d4l s THR 156 Cb -0.03 -0.79 0.00 0.00 -1.51 0.00 0.00 72.50 70.17 3d4l s THR 156 CO 0.02 0.00 1.07 0.26 -2.21 0.00 0.00 174.62 173.76 3d4l s TRP 157 N 0.36 2.95 0.82 9.09 0.52 -1.26 -1.71 118.94 129.70 3d4l s TRP 157 Ca -0.01 1.48 -0.11 0.00 0.02 0.00 0.00 56.10 57.48 3d4l s TRP 157 Cb -0.04 -2.97 0.08 0.00 -1.15 0.00 0.00 33.47 29.39 3d4l s TRP 157 CO -0.00 -1.32 1.09 -1.54 0.02 0.00 0.00 176.95 175.19 3d4l s SER 158 N -3.33 4.23 0.52 2.95 1.04 -0.28 -4.89 113.70 113.94 3d4l s SER 158 Ca 0.61 1.52 0.30 0.00 0.48 0.00 0.00 55.95 58.85 3d4l s SER 158 Cb -0.16 -2.24 1.39 0.00 0.10 0.00 0.00 66.02 65.11 3d4l s SER 158 CO 0.49 -2.17 2.02 1.55 0.98 0.00 0.00 173.24 176.11 3d4l h PRO 159 N -1.22 0.00 -5.27 4.02 0.13 -1.83 -3.43 132.00 124.40 3d4l h PRO 159 Ca -0.47 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.27 3d4l h PRO 159 Cb 1.26 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.19 3d4l h PRO 159 CO 0.56 0.11 -0.76 0.08 -0.23 0.00 0.00 178.00 177.75 3d4l s VAL 160 N -3.94 1.12 0.00 1.56 1.01 -1.26 -4.78 120.40 114.11 3d4l s VAL 160 Ca -0.01 -1.45 0.00 0.00 0.00 0.00 0.00 61.98 60.51 3d4l s VAL 160 Cb 0.11 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.28 3d4l s VAL 160 CO 0.57 -0.33 0.00 0.61 0.00 0.00 0.00 175.10 175.95 3d4l n GLY 161 N 0.99 1.05 1.84 4.51 0.00 -1.26 -4.48 105.19 107.83 3d4l n GLY 161 Ca -0.19 -0.68 -0.02 0.00 0.00 0.00 0.00 46.02 45.13 3d4l n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3d4l n HIS 162 N 12.49 -0.32 -1.71 1.61 1.44 -1.26 -2.78 115.22 124.69 3d4l n HIS 162 Ca 0.00 -1.08 -0.31 0.00 -2.01 0.00 0.00 57.72 54.32 3d4l n HIS 162 Cb 0.00 0.50 0.03 0.00 0.12 0.00 0.00 29.99 30.65 3d4l n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3d4l s LYS 163 N -0.59 3.22 0.04 -1.40 1.02 -1.26 -4.58 119.74 116.19 3d4l s LYS 163 Ca 0.14 0.88 0.04 0.00 0.02 0.00 0.00 55.97 57.05 3d4l s LYS 163 Cb 0.26 -2.03 -0.02 0.00 -0.52 0.00 0.00 37.83 35.52 3d4l s LYS 163 CO -0.08 -0.87 -0.12 -0.51 -0.92 0.00 0.00 175.35 172.85 3d4l s LEU 164 N -5.36 2.18 -0.05 3.17 1.43 -0.21 -1.12 118.68 118.72 3d4l s LEU 164 Ca 0.57 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 53.24 3d4l s LEU 164 Cb -0.13 -0.46 0.02 0.00 0.03 0.00 0.00 46.19 45.65 3d4l s LEU 164 CO 0.54 -0.02 -0.06 0.00 0.23 0.00 0.00 176.35 177.03 3d4l s ALA 165 N -0.91 0.79 0.05 4.21 0.00 -0.70 -0.52 121.76 124.68 3d4l s ALA 165 Ca -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.80 3d4l s ALA 165 Cb -0.08 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 3d4l s ALA 165 CO 0.01 0.03 -0.02 1.52 0.00 0.00 0.00 175.76 177.31 3d4l s TYR 166 N 0.78 0.44 -0.10 0.00 1.13 -0.09 -1.28 117.35 118.24 3d4l s TYR 166 Ca -0.12 -0.92 0.02 0.00 -1.41 0.00 0.00 57.07 54.64 3d4l s TYR 166 Cb -0.14 -0.33 -0.01 0.00 -1.10 0.00 0.00 41.96 40.37 3d4l s TYR 166 CO 0.01 -0.35 -0.16 0.08 -2.51 0.00 0.00 175.55 172.62 3d4l s VAL 167 N -3.39 2.81 -0.07 -3.49 1.01 0.05 -0.49 120.40 116.84 3d4l s VAL 167 Ca 0.02 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 3d4l s VAL 167 Cb 0.04 -2.14 0.04 0.00 0.00 0.00 0.00 36.38 34.32 3d4l s VAL 167 CO -0.08 0.55 0.16 0.86 0.00 0.00 0.00 175.10 176.58 3d4l s TRP 168 N 0.10 -0.18 -1.47 5.22 -0.00 -0.46 -0.98 118.94 121.17 3d4l s TRP 168 Ca -0.07 0.53 -0.10 0.00 -0.00 0.00 0.00 56.10 56.45 3d4l s TRP 168 Cb -0.15 -0.08 0.05 0.00 -0.00 0.00 0.00 33.47 33.29 3d4l s TRP 168 CO 0.05 -0.18 0.87 0.09 -0.00 0.00 0.00 176.95 177.78 3d4l n ASN 169 N 4.30 -5.23 -0.54 5.86 5.03 -1.26 -1.90 115.26 121.53 3d4l n ASN 169 Ca -0.25 -0.57 -0.07 0.00 0.87 0.00 0.00 54.58 54.56 3d4l n ASN 169 Cb 0.52 -4.19 -0.03 0.00 -1.02 0.00 0.00 39.78 35.06 3d4l n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3d4l n ASN 170 N -2.72 -4.49 -4.33 6.41 5.03 -1.26 -4.36 115.26 109.54 3d4l n ASN 170 Ca -0.00 0.17 -0.25 0.00 0.87 0.00 0.00 54.58 55.37 3d4l n ASN 170 Cb 0.55 -2.61 -0.12 0.00 -1.02 0.00 0.00 39.78 36.58 3d4l n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3d4l s ASP 171 N -2.53 2.81 -0.02 6.41 -0.00 -0.80 -2.15 116.67 120.39 3d4l s ASP 171 Ca 0.00 -0.75 -0.17 0.00 -0.00 0.00 0.00 52.55 51.63 3d4l s ASP 171 Cb 0.00 -0.17 -0.05 0.00 -0.00 0.00 0.00 42.92 42.70 3d4l s ASP 171 CO 0.00 0.07 0.47 -0.63 -0.00 0.00 0.00 175.17 175.08 3d4l s ILE 172 N -1.34 5.01 0.05 0.77 1.01 -1.26 -1.36 121.20 124.08 3d4l s ILE 172 Ca 0.11 0.96 0.05 0.00 0.00 0.00 0.00 60.65 61.77 3d4l s ILE 172 Cb -0.09 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 3d4l s ILE 172 CO 0.06 0.49 -0.14 -0.31 0.00 0.00 0.00 174.94 175.04 3d4l s TYR 173 N -0.55 1.21 -0.04 3.97 1.51 0.36 -0.02 117.35 123.79 3d4l s TYR 173 Ca 0.26 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.95 3d4l s TYR 173 Cb -0.17 -0.70 0.00 0.00 -0.11 0.00 0.00 41.96 40.98 3d4l s TYR 173 CO 0.14 0.04 -0.13 0.08 -1.11 0.00 0.00 175.55 174.57 3d4l s VAL 174 N -1.05 1.09 -0.21 0.71 1.01 -0.65 -0.91 120.40 120.39 3d4l s VAL 174 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.46 3d4l s VAL 174 Cb -0.09 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.35 3d4l s VAL 174 CO 0.02 0.33 -0.14 -0.54 0.00 0.00 0.00 175.10 174.76 3d4l s LYS 175 N 0.21 2.93 0.21 2.72 1.02 0.33 -0.66 119.74 126.49 3d4l s LYS 175 Ca -0.05 -0.89 0.04 0.00 0.02 0.00 0.00 55.97 55.09 3d4l s LYS 175 Cb -0.11 -2.74 0.15 0.00 -0.52 0.00 0.00 37.83 34.62 3d4l s LYS 175 CO 0.02 -0.28 1.49 0.82 -0.92 0.00 0.00 175.35 176.47 3d4l h ILE 176 N 6.04 1.42 -3.99 2.17 1.08 -1.85 -0.54 117.51 121.84 3d4l h ILE 176 Ca -0.40 -2.21 -0.37 0.00 -0.39 0.00 0.00 64.86 61.49 3d4l h ILE 176 Cb 1.13 2.17 -0.28 0.00 -3.07 0.00 0.00 36.82 36.77 3d4l h ILE 176 CO 0.60 0.65 -0.77 -1.61 -0.69 0.00 0.00 178.15 176.33 3d4l s GLU 177 N -3.56 0.65 0.43 2.37 0.41 -1.26 -4.37 118.70 113.36 3d4l s GLU 177 Ca -0.04 -0.36 0.17 0.00 -0.41 0.00 0.00 54.97 54.34 3d4l s GLU 177 Cb 0.11 -0.61 1.09 0.00 -1.78 0.00 0.00 34.13 32.94 3d4l s GLU 177 CO 0.81 0.16 1.89 -1.35 -0.49 0.00 0.00 175.26 176.28 3d4l h PRO 178 N 5.75 0.38 -0.02 0.39 0.11 -1.85 -1.91 132.00 134.85 3d4l h PRO 178 Ca -0.31 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3d4l h PRO 178 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3d4l h PRO 178 CO 0.49 0.25 -0.26 0.27 -0.21 0.00 0.00 178.00 178.53 3d4l n ASN 179 N -4.48 1.82 -4.91 -2.05 0.23 -1.26 -4.83 115.26 99.78 3d4l n ASN 179 Ca 0.17 -1.41 -0.28 0.00 -0.53 0.00 0.00 54.58 52.52 3d4l n ASN 179 Cb 0.63 0.23 -0.03 0.00 -2.08 0.00 0.00 39.78 38.52 3d4l n ASN 179 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3d4l s LEU 180 N -2.34 4.17 0.59 -4.53 1.43 -0.72 -4.46 118.68 112.82 3d4l s LEU 180 Ca 0.25 0.55 -0.20 0.00 -1.03 0.00 0.00 54.13 53.69 3d4l s LEU 180 Cb 0.19 -3.33 -0.03 0.00 0.03 0.00 0.00 46.19 43.05 3d4l s LEU 180 CO 0.48 -0.09 1.32 -0.81 0.23 0.00 0.00 176.35 177.48 3d4l n PRO 181 N -0.68 1.42 -2.91 1.29 -0.04 -1.26 -4.78 135.00 128.04 3d4l n PRO 181 Ca -0.03 0.54 -0.30 0.00 -0.04 0.00 0.00 63.50 63.66 3d4l n PRO 181 Cb 0.54 -2.55 -0.03 0.00 -0.04 0.00 0.00 33.50 31.42 3d4l n PRO 181 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3d4l s SER 182 N -1.12 6.51 -0.22 3.54 1.04 -1.26 -4.74 113.70 117.45 3d4l s SER 182 Ca 0.77 1.08 -0.11 0.00 0.48 0.00 0.00 55.95 58.16 3d4l s SER 182 Cb -0.40 -2.30 -0.05 0.00 0.10 0.00 0.00 66.02 63.37 3d4l s SER 182 CO 0.45 -0.37 0.20 -0.31 0.98 0.00 0.00 173.24 174.19 3d4l s TYR 183 N -2.34 3.36 -0.09 5.02 2.02 0.16 -4.90 117.35 120.59 3d4l s TYR 183 Ca 0.50 0.34 -0.30 0.00 -0.37 0.00 0.00 57.07 57.25 3d4l s TYR 183 Cb -0.10 -2.29 -0.03 0.00 -0.40 0.00 0.00 41.96 39.14 3d4l s TYR 183 CO 0.31 0.13 1.24 0.50 -1.57 0.00 0.00 175.55 176.16 3d4l s ARG 184 N 0.86 4.30 -0.14 -0.62 3.00 -1.26 -1.64 118.95 123.45 3d4l s ARG 184 Ca 0.10 1.70 0.01 0.00 -1.00 0.00 0.00 55.73 56.54 3d4l s ARG 184 Cb -0.13 -3.64 -0.24 0.00 0.00 0.00 0.00 34.95 30.95 3d4l s ARG 184 CO 0.03 -0.55 0.27 -0.89 0.00 0.00 0.00 175.30 174.16 3d4l n ILE 185 N 4.89 1.66 -4.25 4.11 2.08 0.97 -4.38 119.36 124.44 3d4l n ILE 185 Ca 0.12 -0.68 -0.20 0.00 0.56 0.00 0.00 62.75 62.55 3d4l n ILE 185 Cb 0.45 -1.43 -0.12 0.00 -0.75 0.00 0.00 39.64 37.80 3d4l n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 3d4l s THR 186 N -2.55 1.43 0.00 1.39 -4.23 -1.19 -4.78 115.64 105.72 3d4l s THR 186 Ca -0.21 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 3d4l s THR 186 Cb 0.07 -1.47 0.00 0.00 1.34 0.00 0.00 72.50 72.44 3d4l s THR 186 CO 0.75 -0.28 0.54 0.79 -0.54 0.00 0.00 174.62 175.89 3d4l n TRP 187 N 0.80 0.00 1.16 3.99 7.02 -1.26 -4.45 117.44 124.70 3d4l n TRP 187 Ca -0.17 -0.15 0.12 0.00 -1.02 0.00 0.00 57.50 56.28 3d4l n TRP 187 Cb 0.55 -0.01 0.24 0.00 -2.42 0.00 0.00 31.31 29.67 3d4l n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3d4l n THR 188 N -0.15 0.00 -1.61 -0.99 -2.24 -1.26 -4.97 114.28 103.06 3d4l n THR 188 Ca 0.00 -0.18 -0.49 0.00 -2.27 0.00 0.00 64.05 61.11 3d4l n THR 188 Cb 0.25 0.72 -0.05 0.00 -2.10 0.00 0.00 70.33 69.15 3d4l n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d4l n GLY 189 N 1.37 0.43 3.21 3.38 0.00 -1.26 -4.69 105.19 107.63 3d4l n GLY 189 Ca 0.11 0.60 -0.08 0.00 0.00 0.00 0.00 46.02 46.65 3d4l n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3d4l s LYS 190 N 0.08 0.34 -0.09 1.61 2.20 -0.75 -4.90 119.74 118.22 3d4l s LYS 190 Ca 0.77 0.96 -0.41 0.00 -0.36 0.00 0.00 55.97 56.93 3d4l s LYS 190 Cb -0.84 0.21 -0.19 0.00 -1.51 0.00 0.00 37.83 35.50 3d4l s LYS 190 CO 0.48 -0.33 1.22 -1.91 -0.36 0.00 0.00 175.35 174.46 3d4l n GLU 191 N 5.39 0.18 -1.07 4.03 2.13 -1.26 -0.67 120.64 129.37 3d4l n GLU 191 Ca -0.08 0.06 -0.02 0.00 0.66 0.00 0.00 57.16 57.79 3d4l n GLU 191 Cb 0.50 -1.59 -0.01 0.00 0.27 0.00 0.00 31.44 30.61 3d4l n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3d4l n ASP 192 N 2.21 -5.64 0.09 4.31 8.00 -1.26 -4.71 116.55 119.56 3d4l n ASP 192 Ca 0.22 0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.78 3d4l n ASP 192 Cb 0.07 -3.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.82 3d4l n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3d4l n ILE 193 N -2.15 0.44 -4.05 0.53 2.08 0.16 -4.70 119.36 111.67 3d4l n ILE 193 Ca -0.02 0.15 -0.34 0.00 0.56 0.00 0.00 62.75 63.09 3d4l n ILE 193 Cb 0.47 -0.88 -0.14 0.00 -0.75 0.00 0.00 39.64 38.34 3d4l n ILE 193 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 3d4l s ILE 194 N -1.87 3.05 -0.28 1.39 -1.09 -0.27 -0.46 121.20 121.68 3d4l s ILE 194 Ca 0.00 -0.61 -0.02 0.00 -2.23 0.00 0.00 60.65 57.79 3d4l s ILE 194 Cb 0.00 -2.36 0.04 0.00 -1.58 0.00 0.00 42.46 38.56 3d4l s ILE 194 CO 0.00 0.46 -0.02 -0.31 -1.23 0.00 0.00 174.94 173.84 3d4l s TYR 195 N 1.31 3.18 -0.31 3.97 1.51 -0.01 -1.80 117.35 125.20 3d4l s TYR 195 Ca 0.04 -1.73 -0.09 0.00 -1.01 0.00 0.00 57.07 54.28 3d4l s TYR 195 Cb -0.14 -2.09 -0.01 0.00 -0.11 0.00 0.00 41.96 39.61 3d4l s TYR 195 CO -0.04 -0.77 0.15 -0.80 -1.11 0.00 0.00 175.55 172.97 3d4l s ASN 196 N 1.29 5.52 0.00 2.29 0.01 -0.91 -0.42 114.94 122.71 3d4l s ASN 196 Ca -0.03 -0.52 0.00 0.00 -0.71 0.00 0.00 52.86 51.60 3d4l s ASN 196 Cb -0.18 -1.99 0.00 0.00 0.41 0.00 0.00 41.25 39.48 3d4l s ASN 196 CO -0.02 -0.19 0.00 0.61 -1.51 0.00 0.00 177.10 175.99 3d4l n GLY 197 N 4.97 1.14 3.08 0.66 0.00 -0.33 -4.33 105.19 110.39 3d4l n GLY 197 Ca -0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 3d4l n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d4l s ILE 198 N -3.87 0.48 0.42 -0.61 -4.36 -1.26 -0.71 121.20 111.30 3d4l s ILE 198 Ca 0.00 -1.38 -0.04 0.00 -0.26 0.00 0.00 60.65 58.97 3d4l s ILE 198 Cb 0.00 -0.97 -0.04 0.00 1.25 0.00 0.00 42.46 42.70 3d4l s ILE 198 CO 0.00 -0.61 0.70 0.42 0.24 0.00 0.00 174.94 175.69 3d4l s THR 199 N -2.32 4.97 0.72 8.37 -4.23 0.58 -4.71 115.64 119.01 3d4l s THR 199 Ca -0.03 0.03 -0.05 0.00 -1.18 0.00 0.00 61.69 60.47 3d4l s THR 199 Cb -0.04 -3.84 0.15 0.00 1.34 0.00 0.00 72.50 70.11 3d4l s THR 199 CO -0.02 -0.69 0.98 -0.90 -0.54 0.00 0.00 174.62 173.44 3d4l n ASP 200 N -1.93 0.84 -0.01 3.99 5.75 -1.26 -4.75 116.55 119.19 3d4l n ASP 200 Ca -0.01 -1.82 -0.09 0.00 -0.01 0.00 0.00 54.79 52.85 3d4l n ASP 200 Cb 0.55 -0.68 -0.03 0.00 -1.03 0.00 0.00 41.12 39.93 3d4l n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3d4l h TRP 201 N -0.94 -0.59 -0.45 2.11 7.01 -2.00 -0.76 115.95 120.34 3d4l h TRP 201 Ca -0.32 0.03 -0.11 0.00 2.11 0.00 0.00 58.89 60.59 3d4l h TRP 201 Cb 1.07 0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 28.40 3d4l h TRP 201 CO 0.00 -0.30 -0.18 -0.24 -2.79 0.00 0.00 178.44 174.93 3d4l h VAL 202 N -0.28 1.27 -0.13 2.65 3.04 -1.94 -1.77 116.25 119.08 3d4l h VAL 202 Ca 0.11 -1.30 -0.12 0.00 -1.01 0.00 0.00 66.70 64.38 3d4l h VAL 202 Cb 0.43 1.11 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 3d4l h VAL 202 CO -0.30 0.44 -0.44 1.88 -1.01 0.00 0.00 177.57 178.14 3d4l h TYR 203 N 0.76 0.38 -0.01 3.17 -1.99 -1.90 -0.36 116.97 117.03 3d4l h TYR 203 Ca 0.11 -0.11 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 3d4l h TYR 203 Cb 0.70 -0.08 -0.00 0.00 2.00 0.00 0.00 36.73 39.35 3d4l h TYR 203 CO 0.04 0.71 0.00 1.49 -0.00 0.00 0.00 178.16 180.40 3d4l h GLU 204 N 0.26 0.01 -0.02 4.88 4.81 -0.90 -1.31 114.58 122.32 3d4l h GLU 204 Ca 0.02 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 3d4l h GLU 204 Cb 0.89 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.27 3d4l h GLU 204 CO 0.07 0.25 -0.13 1.49 -0.73 0.00 0.00 179.01 179.96 3d4l h GLU 205 N -0.23 0.13 0.00 1.92 4.57 -1.23 -2.26 114.58 117.49 3d4l h GLU 205 Ca 0.00 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 3d4l h GLU 205 Cb 0.24 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 3d4l h GLU 205 CO 0.00 0.78 -1.98 0.39 -1.18 0.00 0.00 179.01 177.02 3d4l n GLU 206 N -4.62 0.66 -0.02 1.92 -0.58 -0.16 -4.48 120.64 113.37 3d4l n GLU 206 Ca -0.09 -0.17 -0.03 0.00 -0.42 0.00 0.00 57.16 56.45 3d4l n GLU 206 Cb 0.41 -1.53 -0.01 0.00 -0.57 0.00 0.00 31.44 29.73 3d4l n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3d4l n VAL 207 N -2.31 0.90 0.97 2.62 0.31 -1.02 -4.83 118.33 114.97 3d4l n VAL 207 Ca -0.06 0.27 0.12 0.00 -0.01 0.00 0.00 64.34 64.66 3d4l n VAL 207 Cb 0.61 -1.74 0.21 0.00 -0.91 0.00 0.00 33.84 32.01 3d4l n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3d4l n PHE 208 N -3.48 0.03 -4.11 3.52 3.72 -0.52 -4.95 117.46 111.66 3d4l n PHE 208 Ca -0.05 0.01 -0.31 0.00 -0.05 0.00 0.00 57.45 57.05 3d4l n PHE 208 Cb 0.18 -0.26 -0.03 0.00 -0.94 0.00 0.00 39.48 38.43 3d4l n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3d4l n SER 209 N -1.54 -1.84 -3.56 4.37 7.64 -0.87 -4.90 113.62 112.92 3d4l n SER 209 Ca 0.05 -1.02 -0.07 0.00 1.01 0.00 0.00 58.87 58.84 3d4l n SER 209 Cb 0.34 -2.83 -0.03 0.00 -1.01 0.00 0.00 64.21 60.68 3d4l n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3d4l s ALA 210 N -3.64 -1.94 -0.01 -0.43 0.00 -1.10 -4.98 121.76 109.66 3d4l s ALA 210 Ca 0.39 1.38 0.12 0.00 0.00 0.00 0.00 51.96 53.84 3d4l s ALA 210 Cb -0.21 -0.14 -0.20 0.00 0.00 0.00 0.00 23.12 22.57 3d4l s ALA 210 CO 0.91 -0.54 0.89 -0.92 0.00 0.00 0.00 175.76 176.11 3d4l h TYR 211 N 2.15 0.00 -3.51 0.00 3.20 -1.87 -3.39 116.97 113.56 3d4l h TYR 211 Ca -0.17 0.00 -0.52 0.00 3.14 0.00 0.00 58.73 61.18 3d4l h TYR 211 Cb 1.20 0.00 0.05 0.00 1.54 0.00 0.00 36.73 39.52 3d4l h TYR 211 CO 0.27 0.93 0.70 0.45 -1.64 0.00 0.00 178.16 178.87 3d4l s SER 212 N -6.24 6.75 -0.26 -2.11 0.15 -1.26 -0.31 113.70 110.41 3d4l s SER 212 Ca -0.02 2.60 0.20 0.00 0.70 0.00 0.00 55.95 59.43 3d4l s SER 212 Cb 0.09 -2.63 0.50 0.00 -1.71 0.00 0.00 66.02 62.27 3d4l s SER 212 CO 0.82 -0.61 1.12 0.00 1.20 0.00 0.00 173.24 175.77 3d4l n ALA 213 N 2.02 2.97 -2.32 5.45 0.00 0.12 -4.65 120.51 124.09 3d4l n ALA 213 Ca 0.05 -2.91 -0.31 0.00 0.00 0.00 0.00 53.44 50.27 3d4l n ALA 213 Cb 0.41 -0.79 -0.16 0.00 0.00 0.00 0.00 19.45 18.92 3d4l n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3d4l s LEU 214 N -3.74 2.10 -0.21 0.00 1.43 -1.24 -2.26 118.68 114.75 3d4l s LEU 214 Ca 0.31 -0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 52.87 3d4l s LEU 214 Cb 0.33 -1.33 0.09 0.00 0.03 0.00 0.00 46.19 45.31 3d4l s LEU 214 CO -0.03 0.30 0.18 0.26 0.23 0.00 0.00 176.35 177.29 3d4l s TRP 215 N -0.67 -0.07 0.39 0.29 0.51 0.44 -4.99 118.94 114.84 3d4l s TRP 215 Ca 0.11 -0.14 -0.25 0.00 -2.12 0.00 0.00 56.10 53.70 3d4l s TRP 215 Cb -0.10 -0.55 -0.09 0.00 -0.81 0.00 0.00 33.47 31.92 3d4l s TRP 215 CO -0.00 -0.64 1.11 -1.58 -0.51 0.00 0.00 176.95 175.33 3d4l s TRP 216 N 2.24 3.21 0.82 -1.98 0.52 -1.26 -0.46 118.94 122.02 3d4l s TRP 216 Ca 0.06 1.61 -0.11 0.00 0.02 0.00 0.00 56.10 57.68 3d4l s TRP 216 Cb -0.16 -3.26 0.08 0.00 -1.15 0.00 0.00 33.47 28.99 3d4l s TRP 216 CO -0.17 -0.92 1.09 -1.54 0.02 0.00 0.00 176.95 175.43 3d4l s SER 217 N -1.32 4.23 0.31 2.95 1.04 0.14 -4.90 113.70 116.14 3d4l s SER 217 Ca 0.56 1.44 0.06 0.00 0.48 0.00 0.00 55.95 58.49 3d4l s SER 217 Cb -0.27 -2.16 0.83 0.00 0.10 0.00 0.00 66.02 64.52 3d4l s SER 217 CO 0.33 -2.15 1.64 -0.65 0.98 0.00 0.00 173.24 173.39 3d4l h PRO 218 N -1.21 0.18 -0.44 4.02 0.11 -1.90 -1.34 132.00 131.41 3d4l h PRO 218 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3d4l h PRO 218 Cb 1.27 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3d4l h PRO 218 CO 0.57 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.75 3d4l n ASN 219 N -5.23 3.31 0.00 -2.05 0.23 -1.26 -4.43 115.26 105.83 3d4l n ASN 219 Ca 0.25 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.35 3d4l n ASN 219 Cb 0.79 -0.29 0.00 0.00 -2.08 0.00 0.00 39.78 38.20 3d4l n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3d4l n GLY 220 N 1.17 0.79 0.21 4.83 0.00 -0.51 -4.63 105.19 107.06 3d4l n GLY 220 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 3d4l n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3d4l h THR 221 N 0.00 0.67 -2.68 2.61 2.02 -1.93 -3.45 112.91 110.15 3d4l h THR 221 Ca 0.00 -0.16 -0.56 0.00 0.77 0.00 0.00 66.41 66.45 3d4l h THR 221 Cb 0.00 0.76 -0.05 0.00 -1.74 0.00 0.00 68.15 67.12 3d4l h THR 221 CO 0.00 0.03 -0.52 -0.36 0.37 0.00 0.00 175.52 175.04 3d4l s PHE 222 N -5.75 3.30 -0.19 3.16 0.08 -1.26 -0.69 117.98 116.63 3d4l s PHE 222 Ca -0.15 0.05 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 3d4l s PHE 222 Cb 0.04 -1.59 0.05 0.00 -0.57 0.00 0.00 43.02 40.95 3d4l s PHE 222 CO 0.62 0.52 -0.02 -1.17 -0.10 0.00 0.00 175.22 175.07 3d4l s LEU 223 N -3.10 1.73 0.16 -0.37 2.96 -0.23 -0.69 118.68 119.14 3d4l s LEU 223 Ca 0.32 -0.85 -0.05 0.00 -0.22 0.00 0.00 54.13 53.33 3d4l s LEU 223 Cb -0.11 -0.87 -0.06 0.00 0.50 0.00 0.00 46.19 45.65 3d4l s LEU 223 CO 0.26 -0.24 0.40 0.00 -1.32 0.00 0.00 176.35 175.45 3d4l s ALA 224 N 1.65 3.76 0.13 5.97 0.00 0.39 -1.11 121.76 132.54 3d4l s ALA 224 Ca -0.02 -0.53 -0.19 0.00 0.00 0.00 0.00 51.96 51.22 3d4l s ALA 224 Cb -0.17 -2.17 0.05 0.00 0.00 0.00 0.00 23.12 20.83 3d4l s ALA 224 CO -0.07 0.64 0.49 1.52 0.00 0.00 0.00 175.76 178.34 3d4l s TYR 225 N -1.69 -0.35 0.18 0.00 1.13 0.13 -0.42 117.35 116.32 3d4l s TYR 225 Ca 0.42 0.12 0.07 0.00 -1.41 0.00 0.00 57.07 56.27 3d4l s TYR 225 Cb -0.12 0.38 -0.04 0.00 -1.10 0.00 0.00 41.96 41.08 3d4l s TYR 225 CO 0.24 -0.75 0.04 0.00 -2.51 0.00 0.00 175.55 172.57 3d4l s ALA 226 N -3.60 3.29 -0.11 9.51 0.00 -0.96 -0.59 121.76 129.30 3d4l s ALA 226 Ca 0.01 -1.35 0.01 0.00 0.00 0.00 0.00 51.96 50.63 3d4l s ALA 226 Cb 0.00 -1.07 0.02 0.00 0.00 0.00 0.00 23.12 22.07 3d4l s ALA 226 CO -0.11 0.46 -0.11 -1.14 0.00 0.00 0.00 175.76 174.86 3d4l s GLN 227 N -3.06 1.83 -0.09 0.00 0.74 0.16 -1.19 119.66 118.06 3d4l s GLN 227 Ca 0.29 -0.40 -0.03 0.00 0.05 0.00 0.00 55.36 55.26 3d4l s GLN 227 Cb -0.09 -1.69 -0.03 0.00 1.10 0.00 0.00 33.01 32.30 3d4l s GLN 227 CO 0.20 -0.15 0.03 -0.06 -0.55 0.00 0.00 175.29 174.76 3d4l s PHE 228 N 1.26 3.24 -0.27 1.67 0.08 0.44 -1.47 117.98 122.94 3d4l s PHE 228 Ca -0.02 0.26 0.03 0.00 0.12 0.00 0.00 56.93 57.31 3d4l s PHE 228 Cb -0.14 -1.82 0.07 0.00 -0.57 0.00 0.00 43.02 40.56 3d4l s PHE 228 CO -0.04 0.52 -0.07 1.21 -0.10 0.00 0.00 175.22 176.74 3d4l s ASN 229 N -0.92 4.40 -0.09 1.36 3.84 -0.27 -0.83 114.94 122.43 3d4l s ASN 229 Ca 0.14 -1.49 0.17 0.00 0.21 0.00 0.00 52.86 51.89 3d4l s ASN 229 Cb -0.11 -1.49 0.62 0.00 -0.55 0.00 0.00 41.25 39.71 3d4l s ASN 229 CO 0.03 -0.23 1.53 0.47 -2.79 0.00 0.00 177.10 176.11 3d4l n ASP 230 N 4.45 4.27 -0.35 -4.21 9.92 0.40 -1.43 116.55 129.60 3d4l n ASP 230 Ca -0.11 -2.39 0.07 0.00 -0.53 0.00 0.00 54.79 51.84 3d4l n ASP 230 Cb 0.42 -0.51 0.16 0.00 -0.64 0.00 0.00 41.12 40.56 3d4l n ASP 230 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 3d4l n THR 231 N 0.89 -0.41 -0.60 -3.53 -1.04 -1.25 -1.04 114.28 107.29 3d4l n THR 231 Ca 0.23 2.24 0.10 0.00 -2.04 0.00 0.00 64.05 64.57 3d4l n THR 231 Cb 0.78 -3.12 0.35 0.00 -1.82 0.00 0.00 70.33 66.52 3d4l n THR 231 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3d4l n GLU 232 N -5.58 3.63 -2.79 -2.82 1.02 -1.26 -4.93 120.64 107.90 3d4l n GLU 232 Ca 0.17 -2.86 -0.42 0.00 -0.02 0.00 0.00 57.16 54.04 3d4l n GLU 232 Cb 0.53 -1.85 -0.03 0.00 -0.02 0.00 0.00 31.44 30.07 3d4l n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3d4l s VAL 233 N -1.78 4.89 0.80 2.62 1.01 -0.20 -4.71 120.40 123.02 3d4l s VAL 233 Ca 0.50 1.89 -0.12 0.00 0.00 0.00 0.00 61.98 64.25 3d4l s VAL 233 Cb 0.32 -4.25 0.08 0.00 0.00 0.00 0.00 36.38 32.53 3d4l s VAL 233 CO 0.25 0.13 1.16 -2.84 0.00 0.00 0.00 175.10 173.80 3d4l s PRO 234 N 1.31 1.80 -0.11 2.72 0.02 -1.26 -4.71 135.00 134.77 3d4l s PRO 234 Ca 0.47 1.56 -0.03 0.00 0.02 0.00 0.00 61.00 63.02 3d4l s PRO 234 Cb -0.19 -1.81 -0.03 0.00 0.02 0.00 0.00 34.50 32.48 3d4l s PRO 234 CO 0.22 -2.05 0.01 -0.51 -0.33 0.00 0.00 177.00 174.34 3d4l s LEU 235 N -5.78 3.58 0.09 -5.54 1.02 -1.26 -1.38 118.68 109.40 3d4l s LEU 235 Ca 0.69 0.10 -0.22 0.00 0.02 0.00 0.00 54.13 54.71 3d4l s LEU 235 Cb -0.24 -1.84 -0.07 0.00 0.02 0.00 0.00 46.19 44.06 3d4l s LEU 235 CO 0.51 0.31 0.68 -0.51 0.02 0.00 0.00 176.35 177.36 3d4l s ILE 236 N -0.49 4.63 -0.04 -0.59 1.10 0.34 -4.84 121.20 121.31 3d4l s ILE 236 Ca 0.09 1.46 0.05 0.00 -0.51 0.00 0.00 60.65 61.73 3d4l s ILE 236 Cb -0.12 -4.02 -0.01 0.00 0.15 0.00 0.00 42.46 38.46 3d4l s ILE 236 CO 0.02 0.50 -0.19 -1.61 -2.11 0.00 0.00 174.94 171.55 3d4l s GLU 237 N -0.83 1.89 0.11 3.50 2.02 -1.26 -1.05 118.70 123.09 3d4l s GLU 237 Ca 0.33 -0.67 -0.15 0.00 0.02 0.00 0.00 54.97 54.50 3d4l s GLU 237 Cb -0.21 -1.65 0.03 0.00 0.10 0.00 0.00 34.13 32.40 3d4l s GLU 237 CO 0.22 0.28 0.38 1.52 0.02 0.00 0.00 175.26 177.68 3d4l s TYR 238 N -0.05 -0.17 0.37 1.61 1.13 -0.69 -4.97 117.35 114.59 3d4l s TYR 238 Ca -0.03 -0.14 -0.19 0.00 -1.41 0.00 0.00 57.07 55.30 3d4l s TYR 238 Cb -0.11 0.22 -0.10 0.00 -1.10 0.00 0.00 41.96 40.86 3d4l s TYR 238 CO 0.02 -0.67 0.85 -1.12 -2.51 0.00 0.00 175.55 172.12 3d4l s SER 239 N -2.75 6.90 -0.09 -0.18 0.01 -1.26 0.13 113.70 116.46 3d4l s SER 239 Ca 0.02 1.52 0.00 0.00 1.31 0.00 0.00 55.95 58.80 3d4l s SER 239 Cb 0.02 -2.47 0.02 0.00 0.21 0.00 0.00 66.02 63.80 3d4l s SER 239 CO -0.11 -0.26 -0.08 0.12 0.41 0.00 0.00 173.24 173.32 3d4l s PHE 240 N -2.04 1.35 0.03 2.43 5.36 0.21 -4.66 117.98 120.66 3d4l s PHE 240 Ca 0.57 -0.61 0.08 0.00 -0.96 0.00 0.00 56.93 56.02 3d4l s PHE 240 Cb -0.10 -1.12 -0.23 0.00 -0.34 0.00 0.00 43.02 41.23 3d4l s PHE 240 CO 0.16 -0.42 0.95 1.88 -1.46 0.00 0.00 175.22 176.33 3d4l h TYR 241 N 7.85 0.05 -1.06 10.12 -1.99 -1.96 0.42 116.97 130.40 3d4l h TYR 241 Ca -0.30 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.39 3d4l h TYR 241 Cb 1.14 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.87 3d4l h TYR 241 CO 0.48 1.05 0.00 0.45 -0.00 0.00 0.00 178.16 180.14 3d4l n SER 242 N -3.23 -3.18 -4.75 3.88 2.88 -1.26 -4.74 113.62 103.23 3d4l n SER 242 Ca -0.10 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.12 3d4l n SER 242 Cb 1.00 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.55 3d4l n SER 242 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 3d4l s ASP 243 N -4.00 4.41 0.55 -3.46 1.01 -1.26 -4.88 116.67 109.04 3d4l s ASP 243 Ca 0.00 2.02 0.30 0.00 0.71 0.00 0.00 52.55 55.58 3d4l s ASP 243 Cb 0.00 -2.55 1.47 0.00 1.01 0.00 0.00 42.92 42.85 3d4l s ASP 243 CO 0.00 -2.10 1.89 -0.08 0.21 0.00 0.00 175.17 175.09 3d4l h GLU 244 N -0.73 0.00 0.00 8.23 4.81 -2.05 -0.80 114.58 124.04 3d4l h GLU 244 Ca -0.45 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 3d4l h GLU 244 Cb 1.25 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 3d4l h GLU 244 CO 0.50 0.00 -0.04 0.66 -0.73 0.00 0.00 179.01 179.41 3d4l h SER 245 N 0.00 0.00 -2.95 1.04 4.64 -1.94 -3.42 113.55 110.92 3d4l h SER 245 Ca 0.35 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.11 3d4l h SER 245 Cb 1.52 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.57 3d4l h SER 245 CO -0.00 0.04 1.00 -0.22 -0.87 0.00 0.00 176.83 176.77 3d4l s LEU 246 N -6.36 4.00 0.13 5.97 2.96 -0.31 -4.91 118.68 120.16 3d4l s LEU 246 Ca -0.00 1.51 -0.12 0.00 -0.22 0.00 0.00 54.13 55.30 3d4l s LEU 246 Cb 0.10 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 43.18 3d4l s LEU 246 CO 0.54 -1.02 1.42 -0.61 -1.32 0.00 0.00 176.35 175.36 3d4l h GLN 247 N 9.32 0.90 -5.26 1.98 4.15 -1.89 -3.43 115.11 120.89 3d4l h GLN 247 Ca -0.29 -0.55 -0.67 0.00 0.77 0.00 0.00 58.65 57.92 3d4l h GLN 247 Cb 1.12 0.05 -0.30 0.00 0.21 0.00 0.00 27.48 28.56 3d4l h GLN 247 CO 1.00 1.19 -0.81 0.71 -1.93 0.00 0.00 178.83 178.99 3d4l s TYR 248 N -4.20 2.74 0.65 3.99 2.02 -1.26 -5.11 117.35 116.19 3d4l s TYR 248 Ca -0.11 -0.92 -0.17 0.00 -0.37 0.00 0.00 57.07 55.49 3d4l s TYR 248 Cb 0.10 -1.84 -0.03 0.00 -0.40 0.00 0.00 41.96 39.80 3d4l s TYR 248 CO 0.89 -0.38 0.99 -2.30 -1.57 0.00 0.00 175.55 173.17 3d4l n PRO 249 N 3.79 0.77 -3.70 -1.71 -0.02 -1.26 -4.98 135.00 127.89 3d4l n PRO 249 Ca -0.19 0.31 -0.33 0.00 -2.02 0.00 0.00 63.50 61.27 3d4l n PRO 249 Cb 0.52 -2.22 -0.05 0.00 -0.02 0.00 0.00 33.50 31.74 3d4l n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3d4l s LYS 250 N -3.02 3.62 -0.27 -0.52 2.20 0.14 -4.89 119.74 117.00 3d4l s LYS 250 Ca 0.76 -0.06 -0.08 0.00 -0.36 0.00 0.00 55.97 56.24 3d4l s LYS 250 Cb -0.39 -2.97 -0.02 0.00 -1.51 0.00 0.00 37.83 32.95 3d4l s LYS 250 CO 0.47 0.55 0.10 0.99 -0.36 0.00 0.00 175.35 177.11 3d4l s THR 251 N -1.48 4.43 0.02 3.43 2.01 -1.26 0.63 115.64 123.42 3d4l s THR 251 Ca 0.35 -0.25 -0.21 0.00 0.31 0.00 0.00 61.69 61.88 3d4l s THR 251 Cb -0.13 -3.15 -0.06 0.00 0.01 0.00 0.00 72.50 69.18 3d4l s THR 251 CO 0.21 0.24 0.62 -0.69 -0.69 0.00 0.00 174.62 174.30 3d4l s VAL 252 N 1.62 4.85 -0.11 3.82 1.01 0.12 -4.91 120.40 126.79 3d4l s VAL 252 Ca 0.06 1.30 0.01 0.00 0.00 0.00 0.00 61.98 63.34 3d4l s VAL 252 Cb -0.16 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.29 3d4l s VAL 252 CO 0.05 0.43 -0.12 -0.13 0.00 0.00 0.00 175.10 175.34 3d4l s ARG 253 N -0.33 1.89 -0.08 2.72 0.52 -1.26 -1.70 118.95 120.71 3d4l s ARG 253 Ca 0.32 -0.42 0.01 0.00 -0.52 0.00 0.00 55.73 55.12 3d4l s ARG 253 Cb -0.19 -1.74 0.02 0.00 0.52 0.00 0.00 34.95 33.56 3d4l s ARG 253 CO 0.18 -0.16 -0.09 0.08 0.02 0.00 0.00 175.30 175.33 3d4l s VAL 254 N 1.31 1.00 -0.17 3.52 1.01 -0.21 -4.94 120.40 121.91 3d4l s VAL 254 Ca -0.01 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.33 3d4l s VAL 254 Cb -0.14 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 3d4l s VAL 254 CO -0.05 0.34 1.90 -2.84 0.00 0.00 0.00 175.10 174.45 3d4l s PRO 255 N 1.09 3.62 -0.18 2.72 0.02 -1.26 -0.50 135.00 140.51 3d4l s PRO 255 Ca -0.07 1.98 -0.04 0.00 0.02 0.00 0.00 61.00 62.89 3d4l s PRO 255 Cb -0.14 -4.19 0.09 0.00 0.02 0.00 0.00 34.50 30.28 3d4l s PRO 255 CO -0.01 -1.52 0.22 -0.47 -0.33 0.00 0.00 177.00 174.89 3d4l s TYR 256 N 6.16 -0.29 -0.34 6.54 6.14 -0.48 -4.52 117.35 130.56 3d4l s TYR 256 Ca 0.85 0.35 -0.25 0.00 0.64 0.00 0.00 57.07 58.65 3d4l s TYR 256 Cb -0.31 -0.31 0.01 0.00 0.42 0.00 0.00 41.96 41.76 3d4l s TYR 256 CO 0.34 -0.54 0.90 -1.25 0.64 0.00 0.00 175.55 175.64 3d4l s PRO 257 N 2.33 3.90 0.78 4.97 0.04 -1.26 -4.57 135.00 141.20 3d4l s PRO 257 Ca 0.06 0.63 -0.11 0.00 0.04 0.00 0.00 61.00 61.63 3d4l s PRO 257 Cb -0.15 -3.77 0.08 0.00 0.04 0.00 0.00 34.50 30.69 3d4l s PRO 257 CO -0.11 -0.87 1.14 0.15 0.04 0.00 0.00 177.00 177.35 3d4l s LYS 258 N 3.34 1.99 0.05 4.56 1.02 -1.26 -0.88 119.74 128.56 3d4l s LYS 258 Ca 0.37 -0.00 -0.37 0.00 0.02 0.00 0.00 55.97 55.99 3d4l s LYS 258 Cb -0.13 -2.01 -0.16 0.00 -0.52 0.00 0.00 37.83 35.01 3d4l s LYS 258 CO 0.16 -1.52 1.42 0.00 -0.92 0.00 0.00 175.35 174.49 3d4l n ALA 259 N -3.22 -0.63 -0.27 5.17 0.00 -0.20 -1.40 120.51 119.96 3d4l n ALA 259 Ca 0.08 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.01 3d4l n ALA 259 Cb 0.61 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.93 3d4l n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d4l n GLY 260 N 2.83 2.29 3.92 0.00 0.00 -1.26 -4.86 105.19 108.12 3d4l n GLY 260 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 3d4l n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d4l s ALA 261 N -3.21 2.49 0.08 4.61 0.00 -0.49 -4.99 121.76 120.25 3d4l s ALA 261 Ca 0.00 -1.00 -0.31 0.00 0.00 0.00 0.00 51.96 50.65 3d4l s ALA 261 Cb 0.00 -2.81 -0.08 0.00 0.00 0.00 0.00 23.12 20.24 3d4l s ALA 261 CO 0.00 -2.06 1.46 0.08 0.00 0.00 0.00 175.76 175.24 3d4l s VAL 262 N -3.72 3.30 0.37 0.00 1.01 -1.26 -4.90 120.40 115.20 3d4l s VAL 262 Ca 0.69 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.51 3d4l s VAL 262 Cb -0.07 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 3d4l s VAL 262 CO 0.51 0.03 0.58 0.20 0.00 0.00 0.00 175.10 176.42 3d4l s ASN 263 N 1.58 6.23 0.69 3.32 0.01 -1.26 -4.43 114.94 121.07 3d4l s ASN 263 Ca 0.67 0.45 -0.13 0.00 -0.71 0.00 0.00 52.86 53.14 3d4l s ASN 263 Cb -0.37 -1.97 0.01 0.00 0.41 0.00 0.00 41.25 39.34 3d4l s ASN 263 CO 0.30 -0.37 1.08 -2.16 -1.51 0.00 0.00 177.10 174.44 3d4l s PRO 264 N -4.38 2.79 0.33 -0.60 0.04 -1.26 -4.80 135.00 127.12 3d4l s PRO 264 Ca 0.42 1.17 0.08 0.00 0.04 0.00 0.00 61.00 62.71 3d4l s PRO 264 Cb -0.10 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3d4l s PRO 264 CO 0.37 -1.23 0.26 0.95 0.04 0.00 0.00 177.00 177.39 3d4l s THR 265 N -2.71 3.52 0.02 1.26 -4.23 -0.51 -4.92 115.64 108.08 3d4l s THR 265 Ca 0.62 -1.42 0.00 0.00 -1.18 0.00 0.00 61.69 59.71 3d4l s THR 265 Cb -0.17 -3.17 -0.02 0.00 1.34 0.00 0.00 72.50 70.49 3d4l s THR 265 CO 0.48 -0.19 -0.03 0.54 -0.54 0.00 0.00 174.62 174.88 3d4l s VAL 266 N -2.31 0.17 0.08 2.29 0.11 -1.26 -1.11 120.40 118.36 3d4l s VAL 266 Ca 0.40 -0.81 0.03 0.00 -2.93 0.00 0.00 61.98 58.66 3d4l s VAL 266 Cb -0.05 -0.28 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 3d4l s VAL 266 CO 0.26 -0.41 -0.08 -0.54 -3.33 0.00 0.00 175.10 170.99 3d4l s LYS 267 N -1.28 0.73 -0.03 1.54 1.02 -0.54 -4.98 119.74 116.20 3d4l s LYS 267 Ca -0.13 -1.07 0.05 0.00 0.02 0.00 0.00 55.97 54.84 3d4l s LYS 267 Cb -0.09 -0.34 -0.01 0.00 -0.52 0.00 0.00 37.83 36.87 3d4l s LYS 267 CO -0.01 0.04 -0.18 0.12 -0.92 0.00 0.00 175.35 174.40 3d4l s PHE 268 N -2.43 1.73 0.10 3.18 5.36 -1.26 -0.67 117.98 124.00 3d4l s PHE 268 Ca 0.02 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.59 3d4l s PHE 268 Cb -0.03 -1.14 -0.04 0.00 -0.34 0.00 0.00 43.02 41.47 3d4l s PHE 268 CO -0.01 -0.10 -0.05 -0.06 -1.46 0.00 0.00 175.22 173.53 3d4l s PHE 269 N -0.22 0.90 -0.03 10.12 0.40 0.24 -1.60 117.98 127.80 3d4l s PHE 269 Ca 0.02 -0.94 0.00 0.00 -0.60 0.00 0.00 56.93 55.41 3d4l s PHE 269 Cb -0.09 -0.53 0.03 0.00 0.51 0.00 0.00 43.02 42.94 3d4l s PHE 269 CO 0.01 -0.17 0.00 0.08 0.70 0.00 0.00 175.22 175.84 3d4l s VAL 270 N -3.65 0.16 0.03 -0.44 1.01 -0.01 -0.70 120.40 116.80 3d4l s VAL 270 Ca 0.13 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.30 3d4l s VAL 270 Cb 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 3d4l s VAL 270 CO -0.04 0.15 -0.25 0.54 0.00 0.00 0.00 175.10 175.49 3d4l s VAL 271 N 1.10 2.03 -0.36 2.92 0.11 -0.27 -0.90 120.40 125.03 3d4l s VAL 271 Ca -0.09 -1.29 -0.21 0.00 -2.93 0.00 0.00 61.98 57.46 3d4l s VAL 271 Cb -0.13 -1.73 0.00 0.00 -1.53 0.00 0.00 36.38 32.99 3d4l s VAL 271 CO -0.02 0.38 0.69 0.21 -3.33 0.00 0.00 175.10 173.03 3d4l s ASN 272 N -1.09 6.48 0.00 3.54 3.84 -1.26 -1.07 114.94 125.38 3d4l s ASN 272 Ca 0.11 0.24 0.29 0.00 0.21 0.00 0.00 52.86 53.70 3d4l s ASN 272 Cb -0.10 -2.35 1.23 0.00 -0.55 0.00 0.00 41.25 39.48 3d4l s ASN 272 CO 0.01 -0.64 1.87 0.35 -2.79 0.00 0.00 177.10 175.90 3d4l n THR 273 N 5.64 0.00 0.86 -5.21 -2.24 0.13 -3.38 114.28 110.09 3d4l n THR 273 Ca 0.00 -0.05 0.12 0.00 -2.27 0.00 0.00 64.05 61.85 3d4l n THR 273 Cb 0.48 -0.13 0.27 0.00 -2.10 0.00 0.00 70.33 68.85 3d4l n THR 273 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3d4l n ASP 274 N -1.02 0.51 -1.67 3.42 8.00 -1.25 -4.02 116.55 120.52 3d4l n ASP 274 Ca 0.14 -0.05 -0.17 0.00 0.71 0.00 0.00 54.79 55.43 3d4l n ASP 274 Cb 0.28 0.13 0.07 0.00 -0.02 0.00 0.00 41.12 41.58 3d4l n ASP 274 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3d4l n SER 275 N -1.69 4.16 -4.79 -2.24 3.41 -1.22 -5.04 113.62 106.21 3d4l n SER 275 Ca 0.05 -3.79 -0.37 0.00 -0.26 0.00 0.00 58.87 54.50 3d4l n SER 275 Cb 0.37 -0.40 -0.06 0.00 -0.26 0.00 0.00 64.21 63.85 3d4l n SER 275 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3d4l s LEU 276 N -3.51 4.36 -0.01 1.04 1.43 -1.26 -5.00 118.68 115.72 3d4l s LEU 276 Ca 0.48 1.71 0.05 0.00 -1.03 0.00 0.00 54.13 55.34 3d4l s LEU 276 Cb 0.40 -3.85 -0.01 0.00 0.03 0.00 0.00 46.19 42.76 3d4l s LEU 276 CO 0.01 -0.02 -0.17 -0.55 0.23 0.00 0.00 176.35 175.85 3d4l s SER 277 N -1.60 2.03 0.00 2.29 0.15 -1.26 -5.01 113.70 110.30 3d4l s SER 277 Ca 0.47 -0.31 0.27 0.00 0.70 0.00 0.00 55.95 57.08 3d4l s SER 277 Cb -0.18 -0.23 1.32 0.00 -1.71 0.00 0.00 66.02 65.22 3d4l s SER 277 CO 0.23 0.21 1.89 -1.54 1.20 0.00 0.00 173.24 175.23 3d4l n SER 278 N 2.66 0.79 -0.02 5.45 3.41 -1.26 -3.43 113.62 121.21 3d4l n SER 278 Ca -0.15 -1.34 0.03 0.00 -0.26 0.00 0.00 58.87 57.16 3d4l n SER 278 Cb 0.54 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.37 3d4l n SER 278 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3d4l n VAL 279 N -0.35 0.23 -4.24 -3.33 0.31 -1.26 -5.00 118.33 104.69 3d4l n VAL 279 Ca 0.20 -0.37 -0.20 0.00 -0.01 0.00 0.00 64.34 63.96 3d4l n VAL 279 Cb 0.23 -0.04 -0.12 0.00 -0.91 0.00 0.00 33.84 33.00 3d4l n VAL 279 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3d4l s THR 280 N -2.77 1.41 0.37 2.52 2.01 -1.22 -5.13 115.64 112.82 3d4l s THR 280 Ca -0.05 -1.57 -0.25 0.00 0.31 0.00 0.00 61.69 60.13 3d4l s THR 280 Cb 0.07 -1.43 -0.09 0.00 0.01 0.00 0.00 72.50 71.07 3d4l s THR 280 CO 0.55 -0.26 1.04 0.20 -0.69 0.00 0.00 174.62 175.47 3d4l s ASN 281 N -2.11 6.90 0.46 3.53 0.01 -1.26 -4.31 114.94 118.16 3d4l s ASN 281 Ca 0.06 2.05 -0.24 0.00 -0.71 0.00 0.00 52.86 54.01 3d4l s ASN 281 Cb -0.08 -2.59 -0.07 0.00 0.41 0.00 0.00 41.25 38.92 3d4l s ASN 281 CO 0.03 -0.39 1.34 0.00 -1.51 0.00 0.00 177.10 176.57 3d4l s ALA 282 N -1.58 3.10 -0.27 0.60 0.00 -1.26 -4.96 121.76 117.39 3d4l s ALA 282 Ca 0.55 1.29 -0.11 0.00 0.00 0.00 0.00 51.96 53.69 3d4l s ALA 282 Cb -0.23 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.32 3d4l s ALA 282 CO 0.29 -1.06 0.17 0.99 0.00 0.00 0.00 175.76 176.16 3d4l s THR 283 N -1.29 5.20 -0.19 0.00 2.01 -1.26 -5.02 115.64 115.09 3d4l s THR 283 Ca 0.63 0.13 -0.09 0.00 0.31 0.00 0.00 61.69 62.67 3d4l s THR 283 Cb -0.39 -3.47 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 3d4l s THR 283 CO 0.49 0.27 0.11 -0.44 -0.69 0.00 0.00 174.62 174.36 3d4l s SER 284 N 1.69 6.05 -0.23 3.53 0.01 -1.26 -4.51 113.70 118.98 3d4l s SER 284 Ca 0.07 0.19 -0.16 0.00 1.31 0.00 0.00 55.95 57.36 3d4l s SER 284 Cb -0.16 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 63.98 3d4l s SER 284 CO 0.10 0.18 0.42 -0.63 0.41 0.00 0.00 173.24 173.72 3d4l s ILE 285 N 0.32 5.17 0.21 1.44 -1.09 -0.08 -4.87 121.20 122.30 3d4l s ILE 285 Ca 0.07 0.72 -0.23 0.00 -2.23 0.00 0.00 60.65 58.98 3d4l s ILE 285 Cb -0.11 -3.74 -0.08 0.00 -1.58 0.00 0.00 42.46 36.94 3d4l s ILE 285 CO -0.01 0.20 0.76 -1.58 -1.23 0.00 0.00 174.94 173.08 3d4l s GLN 286 N 1.67 4.41 -0.26 2.79 0.74 -1.26 -0.83 119.66 126.92 3d4l s GLN 286 Ca 0.19 1.03 0.00 0.00 0.05 0.00 0.00 55.36 56.63 3d4l s GLN 286 Cb -0.15 -3.03 0.04 0.00 1.10 0.00 0.00 33.01 30.97 3d4l s GLN 286 CO 0.09 0.46 -0.08 0.42 -0.55 0.00 0.00 175.29 175.63 3d4l s ILE 287 N -1.37 2.59 0.45 -2.34 1.01 -0.63 -4.89 121.20 116.03 3d4l s ILE 287 Ca 0.40 -1.30 -0.13 0.00 0.00 0.00 0.00 60.65 59.61 3d4l s ILE 287 Cb -0.20 -2.40 -0.07 0.00 0.01 0.00 0.00 42.46 39.80 3d4l s ILE 287 CO 0.23 0.09 0.87 0.42 0.00 0.00 0.00 174.94 176.55 3d4l s THR 288 N 1.23 4.66 0.62 2.92 -4.23 -1.26 -4.19 115.64 115.39 3d4l s THR 288 Ca -0.04 0.91 -0.15 0.00 -1.18 0.00 0.00 61.69 61.24 3d4l s THR 288 Cb -0.18 -3.72 -0.02 0.00 1.34 0.00 0.00 72.50 69.92 3d4l s THR 288 CO -0.05 -0.59 1.07 0.00 -0.54 0.00 0.00 174.62 174.51 3d4l s ALA 289 N -2.47 2.68 0.87 3.99 0.00 -1.26 -5.01 121.76 120.55 3d4l s ALA 289 Ca 0.55 0.36 -0.10 0.00 0.00 0.00 0.00 51.96 52.77 3d4l s ALA 289 Cb -0.10 -3.24 0.12 0.00 0.00 0.00 0.00 23.12 19.90 3d4l s ALA 289 CO 0.31 -0.97 1.13 -1.25 0.00 0.00 0.00 175.76 174.98 3d4l s PRO 290 N -4.25 1.44 0.32 0.00 0.04 -1.26 -4.70 135.00 126.58 3d4l s PRO 290 Ca 0.63 1.40 0.00 0.00 0.04 0.00 0.00 61.00 63.08 3d4l s PRO 290 Cb -0.16 -1.79 0.54 0.00 0.04 0.00 0.00 34.50 33.13 3d4l s PRO 290 CO 0.41 -2.29 1.96 0.00 0.04 0.00 0.00 177.00 177.11 3d4l h ALA 291 N -1.62 1.50 0.00 8.56 0.00 -1.98 -0.76 119.26 124.96 3d4l h ALA 291 Ca -0.43 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3d4l h ALA 291 Cb 1.26 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3d4l h ALA 291 CO 0.45 0.42 0.00 -1.13 0.00 0.00 0.00 179.25 178.99 3d4l n SER 292 N -4.45 0.17 -0.12 0.00 3.41 -1.26 -2.30 113.62 109.09 3d4l n SER 292 Ca 0.10 0.56 -0.20 0.00 -0.26 0.00 0.00 58.87 59.07 3d4l n SER 292 Cb 0.10 -0.59 -0.10 0.00 -0.26 0.00 0.00 64.21 63.36 3d4l n SER 292 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 3d4l n MET 293 N -1.72 0.54 0.15 4.33 0.00 -0.40 -4.50 117.12 115.52 3d4l n MET 293 Ca 0.01 0.17 0.11 0.00 0.00 0.00 0.00 57.70 58.00 3d4l n MET 293 Cb 0.08 -1.41 0.55 0.00 0.00 0.00 0.00 33.22 32.44 3d4l n MET 293 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3d4l n LEU 294 N -3.59 0.59 0.30 -0.89 4.77 -0.57 -2.47 117.00 115.14 3d4l n LEU 294 Ca -0.44 0.73 0.18 0.00 -0.03 0.00 0.00 56.01 56.46 3d4l n LEU 294 Cb 0.89 -0.75 0.91 0.00 -2.33 0.00 0.00 43.42 42.14 3d4l n LEU 294 CO 0.13 -0.83 1.07 0.16 -1.33 0.00 0.00 177.39 176.59 3d4l h ILE 295 N 0.00 0.16 -1.69 -0.08 3.07 -1.70 -3.46 117.51 113.80 3d4l h ILE 295 Ca 0.00 -0.31 0.00 0.00 1.55 0.00 0.00 64.86 66.10 3d4l h ILE 295 Cb 0.11 1.26 0.00 0.00 -0.27 0.00 0.00 36.82 37.92 3d4l h ILE 295 CO 0.00 0.03 0.00 0.61 -1.05 0.00 0.00 178.15 177.74 3d4l n GLY 296 N -0.61 2.80 3.76 0.16 0.00 -1.03 -5.14 105.19 105.13 3d4l n GLY 296 Ca -0.01 -1.09 -0.37 0.00 0.00 0.00 0.00 46.02 44.54 3d4l n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d4l s ASP 297 N -0.15 5.73 0.36 1.61 1.01 -1.26 -4.96 116.67 119.02 3d4l s ASP 297 Ca 0.00 2.50 -0.16 0.00 0.71 0.00 0.00 52.55 55.60 3d4l s ASP 297 Cb 0.00 -2.62 0.04 0.00 1.01 0.00 0.00 42.92 41.36 3d4l s ASP 297 CO 0.00 -1.23 0.75 -1.38 0.21 0.00 0.00 175.17 173.52 3d4l s HIS 298 N -1.45 0.12 0.08 4.23 -3.43 -1.26 -1.76 115.29 111.81 3d4l s HIS 298 Ca 0.68 -0.72 0.01 0.00 -0.80 0.00 0.00 55.06 54.23 3d4l s HIS 298 Cb -0.34 0.75 -0.04 0.00 -1.43 0.00 0.00 32.58 31.52 3d4l s HIS 298 CO 0.40 -1.47 -0.05 0.71 -2.00 0.00 0.00 174.74 172.33 3d4l s TYR 299 N -2.71 0.75 -0.28 0.38 2.02 0.64 -4.83 117.35 113.32 3d4l s TYR 299 Ca 0.16 -0.95 -0.11 0.00 -0.37 0.00 0.00 57.07 55.80 3d4l s TYR 299 Cb -0.05 -0.47 -0.05 0.00 -0.40 0.00 0.00 41.96 41.00 3d4l s TYR 299 CO 0.11 -0.23 0.17 -1.17 -1.57 0.00 0.00 175.55 172.87 3d4l s LEU 300 N -2.95 3.95 -0.00 -1.29 2.96 -1.26 -1.01 118.68 119.09 3d4l s LEU 300 Ca 0.09 -0.05 0.07 0.00 -0.22 0.00 0.00 54.13 54.02 3d4l s LEU 300 Cb 0.06 -2.09 -0.07 0.00 0.50 0.00 0.00 46.19 44.58 3d4l s LEU 300 CO -0.06 -0.05 0.28 0.00 -1.32 0.00 0.00 176.35 175.20 3d4l s ASP 302 N -1.63 -0.72 -0.08 0.00 -1.08 -1.15 -4.87 116.67 107.15 3d4l s ASP 302 Ca 0.03 1.25 -0.02 0.00 -0.52 0.00 0.00 52.55 53.29 3d4l s ASP 302 Cb 0.05 1.21 0.03 0.00 -1.46 0.00 0.00 42.92 42.75 3d4l s ASP 302 CO 0.27 -0.34 0.01 -0.69 0.52 0.00 0.00 175.17 174.94 3d4l s VAL 303 N -0.03 0.36 -0.05 1.11 1.01 -1.26 -1.00 120.40 120.53 3d4l s VAL 303 Ca -0.03 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 3d4l s VAL 303 Cb -0.04 -0.55 0.03 0.00 0.00 0.00 0.00 36.38 35.83 3d4l s VAL 303 CO 0.03 0.22 0.07 -0.89 0.00 0.00 0.00 175.10 174.53 3d4l s THR 304 N 1.98 -0.12 0.29 3.92 2.01 -0.61 -5.02 115.64 118.08 3d4l s THR 304 Ca 0.05 0.39 -0.29 0.00 0.31 0.00 0.00 61.69 62.15 3d4l s THR 304 Cb -0.13 -0.18 -0.10 0.00 0.01 0.00 0.00 72.50 72.11 3d4l s THR 304 CO -0.05 0.15 1.18 0.26 -0.69 0.00 0.00 174.62 175.47 3d4l s TRP 305 N 2.18 3.37 -0.27 4.92 0.52 -1.26 -1.25 118.94 127.16 3d4l s TRP 305 Ca 0.05 1.57 -0.09 0.00 0.02 0.00 0.00 56.10 57.65 3d4l s TRP 305 Cb -0.12 -3.44 -0.14 0.00 -1.15 0.00 0.00 33.47 28.61 3d4l s TRP 305 CO -0.03 -1.09 -0.27 0.00 0.02 0.00 0.00 176.95 175.58 3d4l n ALA 306 N 1.16 1.24 -3.12 0.98 0.00 0.84 -4.88 120.51 116.72 3d4l n ALA 306 Ca -0.00 -1.06 -0.02 0.00 0.00 0.00 0.00 53.44 52.36 3d4l n ALA 306 Cb 0.44 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.89 3d4l n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3d4l n THR 307 N -3.94 0.00 0.30 0.00 -2.24 -0.78 -4.57 114.28 103.06 3d4l n THR 307 Ca -0.50 -0.22 0.17 0.00 -2.27 0.00 0.00 64.05 61.22 3d4l n THR 307 Cb 0.91 0.13 0.95 0.00 -2.10 0.00 0.00 70.33 70.22 3d4l n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3d4l h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.98 -3.11 115.11 110.32 3d4l h GLN 308 Ca -0.03 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 3d4l h GLN 308 Cb 0.13 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.54 3d4l h GLN 308 CO 0.04 0.02 -0.36 0.39 -0.95 0.00 0.00 178.83 177.97 3d4l n GLU 309 N -3.62 0.49 -3.78 1.46 1.02 -1.26 -4.88 120.64 110.08 3d4l n GLU 309 Ca -0.03 -1.67 -0.17 0.00 -0.02 0.00 0.00 57.16 55.27 3d4l n GLU 309 Cb 0.11 -0.85 -0.17 0.00 -0.02 0.00 0.00 31.44 30.51 3d4l n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3d4l s ARG 310 N -1.09 0.07 0.05 3.49 3.52 -1.18 -1.05 118.95 122.77 3d4l s ARG 310 Ca 0.14 0.21 0.07 0.00 -0.13 0.00 0.00 55.73 56.01 3d4l s ARG 310 Cb 0.13 -0.42 -0.03 0.00 -1.56 0.00 0.00 34.95 33.07 3d4l s ARG 310 CO -0.00 -0.21 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.59 3d4l s ILE 311 N 1.40 1.48 0.08 4.11 2.07 -0.13 -0.11 121.20 130.09 3d4l s ILE 311 Ca -0.05 -1.20 0.08 0.00 -1.41 0.00 0.00 60.65 58.07 3d4l s ILE 311 Cb -0.13 -1.31 -0.04 0.00 0.13 0.00 0.00 42.46 41.11 3d4l s ILE 311 CO -0.03 0.08 -0.17 -0.94 -1.91 0.00 0.00 174.94 171.98 3d4l s SER 312 N -1.30 3.93 -0.00 4.50 1.04 -0.38 -0.15 113.70 121.33 3d4l s SER 312 Ca 0.05 -0.46 0.01 0.00 0.48 0.00 0.00 55.95 56.02 3d4l s SER 312 Cb -0.09 -0.63 -0.00 0.00 0.10 0.00 0.00 66.02 65.40 3d4l s SER 312 CO 0.02 0.22 -0.02 -0.76 0.98 0.00 0.00 173.24 173.68 3d4l s LEU 313 N -1.80 1.99 -0.06 2.42 1.43 -0.51 -1.58 118.68 120.58 3d4l s LEU 313 Ca 0.17 -0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.27 3d4l s LEU 313 Cb -0.11 -0.10 -0.02 0.00 0.03 0.00 0.00 46.19 46.00 3d4l s LEU 313 CO 0.08 0.02 -0.17 -1.10 0.23 0.00 0.00 176.35 175.42 3d4l s GLN 314 N -0.03 2.63 0.11 1.70 -0.21 -0.17 -0.66 119.66 123.02 3d4l s GLN 314 Ca 0.01 -0.75 0.10 0.00 0.02 0.00 0.00 55.36 54.73 3d4l s GLN 314 Cb -0.01 -2.36 -0.04 0.00 1.00 0.00 0.00 33.01 31.61 3d4l s GLN 314 CO -0.00 0.51 -0.22 -1.58 -2.12 0.00 0.00 175.29 171.87 3d4l s TRP 315 N -0.44 2.43 -0.04 0.91 0.52 0.32 -0.88 118.94 121.77 3d4l s TRP 315 Ca 0.05 -0.32 0.03 0.00 0.02 0.00 0.00 56.10 55.88 3d4l s TRP 315 Cb -0.12 -1.33 0.01 0.00 -1.15 0.00 0.00 33.47 30.88 3d4l s TRP 315 CO 0.02 0.33 -0.11 -1.17 0.02 0.00 0.00 176.95 176.04 3d4l s LEU 316 N -1.94 1.72 0.67 2.99 2.96 -0.18 -0.77 118.68 124.13 3d4l s LEU 316 Ca 0.15 -0.24 -0.15 0.00 -0.22 0.00 0.00 54.13 53.68 3d4l s LEU 316 Cb -0.10 -0.68 0.00 0.00 0.50 0.00 0.00 46.19 45.91 3d4l s LEU 316 CO 0.07 0.06 1.10 -0.13 -1.32 0.00 0.00 176.35 176.14 3d4l s ARG 317 N 0.36 2.78 0.51 1.98 0.52 -0.67 -0.26 118.95 124.17 3d4l s ARG 317 Ca -0.07 1.35 0.16 0.00 -0.52 0.00 0.00 55.73 56.65 3d4l s ARG 317 Cb -0.11 -1.95 1.23 0.00 0.52 0.00 0.00 34.95 34.64 3d4l s ARG 317 CO 0.02 -1.26 2.13 -0.09 0.02 0.00 0.00 175.30 176.12 3d4l h ARG 318 N -0.07 0.06 -5.32 3.54 2.43 -1.67 -3.00 114.38 110.36 3d4l h ARG 318 Ca -0.46 -0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.06 3d4l h ARG 318 Cb 1.24 -0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 30.63 3d4l h ARG 318 CO 0.54 0.04 0.56 0.42 -1.51 0.00 0.00 179.97 180.02 3d4l s ILE 319 N -5.11 4.42 0.00 1.20 -1.09 -1.26 -4.81 121.20 114.54 3d4l s ILE 319 Ca -0.05 -0.60 0.00 0.00 -2.23 0.00 0.00 60.65 57.76 3d4l s ILE 319 Cb 0.17 -4.69 0.00 0.00 -1.58 0.00 0.00 42.46 36.37 3d4l s ILE 319 CO 0.68 -1.44 0.35 0.00 -1.23 0.00 0.00 174.94 173.30 3d4l n GLN 320 N 7.43 0.26 -0.20 2.79 6.02 -1.13 -3.66 117.38 128.89 3d4l n GLN 320 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.05 3d4l n GLN 320 Cb 0.46 -1.37 0.15 0.00 1.02 0.00 0.00 30.24 30.50 3d4l n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3d4l n ASN 321 N 1.18 2.91 -3.66 1.08 0.23 -1.26 -1.14 115.26 114.60 3d4l n ASN 321 Ca 0.00 -2.52 -0.19 0.00 -0.53 0.00 0.00 54.58 51.34 3d4l n ASN 321 Cb 0.13 -0.32 -0.16 0.00 -2.08 0.00 0.00 39.78 37.35 3d4l n ASN 321 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 3d4l s TYR 322 N -1.92 -0.07 0.09 -2.53 6.14 -1.24 -1.78 117.35 116.05 3d4l s TYR 322 Ca 0.26 0.40 0.07 0.00 0.64 0.00 0.00 57.07 58.44 3d4l s TYR 322 Cb 0.19 -0.38 -0.03 0.00 0.42 0.00 0.00 41.96 42.16 3d4l s TYR 322 CO 0.08 -0.27 -0.17 0.45 0.64 0.00 0.00 175.55 176.28 3d4l s SER 323 N 2.24 2.11 -0.04 4.32 0.15 0.72 -1.67 113.70 121.53 3d4l s SER 323 Ca 0.04 -0.67 0.01 0.00 0.70 0.00 0.00 55.95 56.03 3d4l s SER 323 Cb -0.12 -0.09 0.02 0.00 -1.71 0.00 0.00 66.02 64.11 3d4l s SER 323 CO -0.05 -0.02 -0.04 -0.69 1.20 0.00 0.00 173.24 173.63 3d4l s VAL 324 N -1.34 0.48 -0.17 4.45 1.01 0.05 -0.72 120.40 124.17 3d4l s VAL 324 Ca 0.03 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 3d4l s VAL 324 Cb -0.09 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 3d4l s VAL 324 CO 0.03 0.20 0.03 -0.32 0.00 0.00 0.00 175.10 175.05 3d4l s MET 325 N 0.76 3.81 -0.00 2.72 1.75 0.68 -0.52 119.30 128.51 3d4l s MET 325 Ca -0.10 -0.39 0.03 0.00 -1.25 0.00 0.00 55.69 53.98 3d4l s MET 325 Cb -0.13 -3.10 -0.03 0.00 2.84 0.00 0.00 34.83 34.40 3d4l s MET 325 CO 0.00 0.31 -0.06 -0.51 -0.65 0.00 0.00 175.02 174.11 3d4l s ASP 326 N 0.23 4.65 -0.21 1.11 1.01 0.16 -1.44 116.67 122.18 3d4l s ASP 326 Ca 0.02 -0.13 0.01 0.00 0.71 0.00 0.00 52.55 53.17 3d4l s ASP 326 Cb -0.13 -1.10 0.04 0.00 1.01 0.00 0.00 42.92 42.75 3d4l s ASP 326 CO 0.01 0.29 -0.13 -0.63 0.21 0.00 0.00 175.17 174.92 3d4l s ILE 327 N -0.99 1.85 -0.08 0.77 1.01 -1.26 -1.42 121.20 121.08 3d4l s ILE 327 Ca 0.17 -1.13 0.02 0.00 0.00 0.00 0.00 60.65 59.71 3d4l s ILE 327 Cb -0.11 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.47 3d4l s ILE 327 CO 0.07 0.21 -0.12 0.00 0.00 0.00 0.00 174.94 175.10 3d4l s ASP 329 N -0.43 3.97 0.21 0.00 1.11 -0.39 -0.96 116.67 120.18 3d4l s ASP 329 Ca 0.06 -0.22 -0.30 0.00 0.18 0.00 0.00 52.55 52.27 3d4l s ASP 329 Cb -0.12 -0.89 -0.08 0.00 1.07 0.00 0.00 42.92 42.90 3d4l s ASP 329 CO 0.02 0.33 1.15 -0.47 1.18 0.00 0.00 175.17 177.38 3d4l s TYR 330 N -0.63 3.50 -0.37 4.23 5.04 -0.21 -1.54 117.35 127.36 3d4l s TYR 330 Ca 0.09 1.55 -0.06 0.00 -2.44 0.00 0.00 57.07 56.21 3d4l s TYR 330 Cb -0.11 -3.36 0.07 0.00 0.35 0.00 0.00 41.96 38.91 3d4l s TYR 330 CO 0.01 -0.89 0.15 0.34 -1.34 0.00 0.00 175.55 173.82 3d4l s ASP 331 N -0.24 5.32 0.35 4.32 -1.08 0.60 -4.96 116.67 120.99 3d4l s ASP 331 Ca 0.49 -1.44 0.06 0.00 -0.52 0.00 0.00 52.55 51.14 3d4l s ASP 331 Cb -0.32 -1.87 0.74 0.00 -1.46 0.00 0.00 42.92 40.02 3d4l s ASP 331 CO 0.38 -0.42 1.92 -0.33 0.52 0.00 0.00 175.17 177.24 3d4l h GLU 332 N 8.20 0.74 0.33 4.34 5.08 -1.95 1.05 114.58 132.38 3d4l h GLU 332 Ca -0.21 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 3d4l h GLU 332 Cb 1.07 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.16 3d4l h GLU 332 CO 0.65 0.49 -0.16 0.77 -1.00 0.00 0.00 179.01 179.76 3d4l h SER 333 N 0.77 -0.38 1.23 1.42 0.02 -1.96 -3.26 113.55 111.39 3d4l h SER 333 Ca 0.37 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3d4l h SER 333 Cb 0.41 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.04 3d4l h SER 333 CO -0.14 -0.11 -0.77 0.77 -1.14 0.00 0.00 176.83 175.44 3d4l h SER 334 N -0.65 0.00 -0.32 3.07 4.64 -1.96 -3.47 113.55 114.86 3d4l h SER 334 Ca -0.05 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.14 3d4l h SER 334 Cb 0.46 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.50 3d4l h SER 334 CO 0.08 0.00 -0.13 0.61 -0.87 0.00 0.00 176.83 176.52 3d4l n GLY 335 N 1.16 0.88 3.85 -0.77 0.00 0.36 -5.00 105.19 105.67 3d4l n GLY 335 Ca 0.01 -0.48 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 3d4l n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d4l s ARG 336 N -2.29 2.45 -0.17 1.61 1.81 -1.19 -4.87 118.95 116.30 3d4l s ARG 336 Ca 0.00 -1.63 -0.01 0.00 -1.72 0.00 0.00 55.73 52.37 3d4l s ARG 336 Cb 0.00 -2.28 -0.00 0.00 -0.45 0.00 0.00 34.95 32.21 3d4l s ARG 336 CO 0.00 -0.22 -0.13 -1.58 -0.68 0.00 0.00 175.30 172.69 3d4l s TRP 337 N -2.52 2.83 -0.09 -0.53 0.52 -1.26 -0.29 118.94 117.59 3d4l s TRP 337 Ca 0.46 -1.03 0.02 0.00 0.02 0.00 0.00 56.10 55.57 3d4l s TRP 337 Cb -0.02 -1.94 -0.02 0.00 -1.15 0.00 0.00 33.47 30.35 3d4l s TRP 337 CO 0.27 -0.49 -0.16 -0.80 0.02 0.00 0.00 176.95 175.78 3d4l s ASN 338 N 0.96 3.82 -0.41 2.95 -0.87 -0.59 -4.90 114.94 115.90 3d4l s ASN 338 Ca -0.02 -0.33 -0.03 0.00 -1.57 0.00 0.00 52.86 50.91 3d4l s ASN 338 Cb -0.15 -1.25 0.11 0.00 -0.02 0.00 0.00 41.25 39.94 3d4l s ASN 338 CO -0.02 0.23 0.20 0.00 -2.57 0.00 0.00 177.10 174.94 3d4l s LEU 340 N 1.15 4.36 0.43 0.00 1.43 -1.25 -4.90 118.68 119.89 3d4l s LEU 340 Ca 0.08 2.86 0.11 0.00 -1.03 0.00 0.00 54.13 56.14 3d4l s LEU 340 Cb -0.23 -3.63 0.95 0.00 0.03 0.00 0.00 46.19 43.31 3d4l s LEU 340 CO -0.04 -0.85 2.03 1.62 0.23 0.00 0.00 176.35 179.33 3d4l h VAL 341 N 3.47 1.10 0.00 -1.59 3.04 -1.98 -0.38 116.25 119.91 3d4l h VAL 341 Ca -0.46 -0.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.86 3d4l h VAL 341 Cb 1.22 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 31.43 3d4l h VAL 341 CO 0.80 0.13 0.00 0.00 -1.01 0.00 0.00 177.57 177.49 3d4l h ALA 342 N 1.78 1.00 -0.70 3.17 0.00 -1.96 -1.57 119.26 120.98 3d4l h ALA 342 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d4l h ALA 342 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3d4l h ALA 342 CO -0.00 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.79 3d4l n ARG 343 N -2.66 2.94 -2.80 0.00 1.74 -0.16 -4.46 116.66 111.26 3d4l n ARG 343 Ca -0.01 -2.68 -0.40 0.00 -0.77 0.00 0.00 57.85 53.99 3d4l n ARG 343 Cb 0.15 -1.62 -0.06 0.00 -1.02 0.00 0.00 32.46 29.91 3d4l n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3d4l s GLN 344 N -1.17 4.79 -0.10 5.56 -0.21 -0.59 -4.18 119.66 123.76 3d4l s GLN 344 Ca 0.48 1.42 0.00 0.00 0.02 0.00 0.00 55.36 57.28 3d4l s GLN 344 Cb 0.26 -3.25 0.02 0.00 1.00 0.00 0.00 33.01 31.04 3d4l s GLN 344 CO 0.31 0.52 -0.08 -1.01 -2.12 0.00 0.00 175.29 172.90 3d4l s HIS 345 N -1.20 1.44 -0.05 0.91 3.76 -0.52 -4.93 115.29 114.70 3d4l s HIS 345 Ca 0.40 -0.67 -0.11 0.00 -0.15 0.00 0.00 55.06 54.53 3d4l s HIS 345 Cb -0.25 -1.17 -0.05 0.00 1.11 0.00 0.00 32.58 32.22 3d4l s HIS 345 CO 0.30 -0.45 0.29 0.42 -0.85 0.00 0.00 174.74 174.45 3d4l s ILE 346 N 1.47 5.25 -0.09 0.60 1.01 -1.26 -0.23 121.20 127.95 3d4l s ILE 346 Ca 0.00 0.52 -0.00 0.00 0.00 0.00 0.00 60.65 61.17 3d4l s ILE 346 Cb -0.13 -3.57 0.02 0.00 0.01 0.00 0.00 42.46 38.79 3d4l s ILE 346 CO -0.05 0.58 -0.05 -0.70 0.00 0.00 0.00 174.94 174.71 3d4l s GLU 347 N -1.12 1.12 0.18 2.79 2.12 0.10 -5.00 118.70 118.89 3d4l s GLU 347 Ca 0.21 -0.12 0.00 0.00 0.36 0.00 0.00 54.97 55.42 3d4l s GLU 347 Cb -0.14 -1.26 -0.04 0.00 0.26 0.00 0.00 34.13 32.95 3d4l s GLU 347 CO 0.10 -0.23 0.07 0.00 -0.54 0.00 0.00 175.26 174.65 3d4l s MET 348 N 1.62 1.13 -0.01 4.30 0.23 -1.26 -0.20 119.30 125.10 3d4l s MET 348 Ca 0.01 -1.57 0.01 0.00 -1.03 0.00 0.00 55.69 53.11 3d4l s MET 348 Cb -0.13 0.04 0.00 0.00 -1.53 0.00 0.00 34.83 33.21 3d4l s MET 348 CO -0.05 -0.27 -0.03 0.45 -2.03 0.00 0.00 175.02 173.09 3d4l s SER 349 N -3.15 0.43 0.00 -1.18 0.15 -0.73 -5.00 113.70 104.22 3d4l s SER 349 Ca 0.30 -0.06 0.19 0.00 0.70 0.00 0.00 55.95 57.09 3d4l s SER 349 Cb 0.07 -0.09 -0.15 0.00 -1.71 0.00 0.00 66.02 64.14 3d4l s SER 349 CO 0.07 0.02 0.86 0.35 1.20 0.00 0.00 173.24 175.74 3d4l n THR 350 N 3.23 0.00 0.24 6.45 -2.24 -1.26 -4.47 114.28 116.22 3d4l n THR 350 Ca -0.16 -0.12 0.06 0.00 -2.27 0.00 0.00 64.05 61.56 3d4l n THR 350 Cb 0.57 1.07 -0.09 0.00 -2.10 0.00 0.00 70.33 69.78 3d4l n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3d4l n THR 351 N -1.03 0.00 0.00 4.28 -2.24 -1.26 -5.09 114.28 108.94 3d4l n THR 351 Ca 0.05 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 3d4l n THR 351 Cb 0.33 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 3d4l n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d4l n GLY 352 N 1.57 1.97 4.00 3.38 0.00 -1.26 -4.80 105.19 110.04 3d4l n GLY 352 Ca -0.00 0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 3d4l n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3d4l s TRP 353 N 0.71 1.93 -0.19 1.61 -2.14 -1.26 -4.54 118.94 115.05 3d4l s TRP 353 Ca 0.00 -0.31 -0.13 0.00 2.66 0.00 0.00 56.10 58.32 3d4l s TRP 353 Cb 0.00 -2.74 -0.05 0.00 -3.10 0.00 0.00 33.47 27.58 3d4l s TRP 353 CO 0.00 -1.32 0.27 0.08 -2.66 0.00 0.00 176.95 173.32 3d4l s VAL 354 N -2.91 5.31 0.00 -0.66 1.01 -0.29 -4.75 120.40 118.11 3d4l s VAL 354 Ca 0.63 0.46 0.00 0.00 0.00 0.00 0.00 61.98 63.07 3d4l s VAL 354 Cb -0.07 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.70 3d4l s VAL 354 CO 0.41 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.48 3d4l n GLY 355 N 3.70 -1.55 0.15 4.51 0.00 -1.26 -3.36 105.19 107.37 3d4l n GLY 355 Ca -0.12 -1.54 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 3d4l n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3d4l h ARG 356 N 0.00 -0.28 0.00 1.61 3.08 -1.94 -3.39 114.38 113.46 3d4l h ARG 356 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3d4l h ARG 356 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3d4l h ARG 356 CO 0.00 0.05 -0.40 1.19 -1.07 0.00 0.00 179.97 179.74 3d4l n PHE 357 N -5.06 0.00 -3.56 3.04 3.72 -1.26 -4.91 117.46 109.43 3d4l n PHE 357 Ca -0.09 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.25 3d4l n PHE 357 Cb 0.24 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.76 3d4l n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 3d4l s ARG 358 N -1.09 0.65 0.35 -1.08 1.70 -1.25 -4.99 118.95 113.24 3d4l s ARG 358 Ca 0.00 -0.26 -0.26 0.00 -0.47 0.00 0.00 55.73 54.74 3d4l s ARG 358 Cb 0.00 0.29 -0.12 0.00 -0.57 0.00 0.00 34.95 34.54 3d4l s ARG 358 CO 0.00 -0.29 1.03 -2.30 -1.08 0.00 0.00 175.30 172.66 3d4l n PRO 359 N -0.22 1.42 -1.46 3.89 -0.02 -1.21 -4.32 135.00 133.08 3d4l n PRO 359 Ca -0.05 0.50 -0.30 0.00 -2.02 0.00 0.00 63.50 61.63 3d4l n PRO 359 Cb 0.61 -1.97 0.08 0.00 -0.02 0.00 0.00 33.50 32.20 3d4l n PRO 359 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3d4l s SER 360 N -0.61 4.64 0.24 2.55 1.04 -1.26 -4.91 113.70 115.38 3d4l s SER 360 Ca 0.60 1.52 -0.21 0.00 0.48 0.00 0.00 55.95 58.34 3d4l s SER 360 Cb -0.63 -2.29 -0.09 0.00 0.10 0.00 0.00 66.02 63.12 3d4l s SER 360 CO 0.59 -1.91 0.77 -1.83 0.98 0.00 0.00 173.24 171.84 3d4l s GLU 361 N -5.04 4.33 0.43 4.02 1.03 -1.26 -4.95 118.70 117.25 3d4l s GLU 361 Ca 0.60 0.97 -0.12 0.00 0.03 0.00 0.00 54.97 56.45 3d4l s GLU 361 Cb -0.15 -2.89 -0.07 0.00 -0.80 0.00 0.00 34.13 30.22 3d4l s GLU 361 CO 0.55 0.39 0.82 -1.25 -1.33 0.00 0.00 175.26 174.44 3d4l s PRO 362 N -1.94 3.83 -0.33 -4.83 0.04 -1.26 -4.61 135.00 125.90 3d4l s PRO 362 Ca 0.44 0.60 0.03 0.00 0.04 0.00 0.00 61.00 62.11 3d4l s PRO 362 Cb -0.17 -2.33 0.10 0.00 0.04 0.00 0.00 34.50 32.14 3d4l s PRO 362 CO 0.22 -0.09 0.06 -1.01 0.04 0.00 0.00 177.00 176.22 3d4l s HIS 363 N -2.42 3.37 0.42 0.56 3.76 0.44 -4.94 115.29 116.49 3d4l s HIS 363 Ca 0.53 -2.77 -0.22 0.00 -0.15 0.00 0.00 55.06 52.45 3d4l s HIS 363 Cb -0.10 -2.70 -0.10 0.00 1.11 0.00 0.00 32.58 30.79 3d4l s HIS 363 CO 0.31 -0.94 1.00 -0.06 -0.85 0.00 0.00 174.74 174.20 3d4l s PHE 364 N 1.04 3.26 0.91 1.40 0.40 -1.26 -0.94 117.98 122.79 3d4l s PHE 364 Ca 0.11 1.63 -0.12 0.00 -0.60 0.00 0.00 56.93 57.95 3d4l s PHE 364 Cb -0.19 -3.00 0.14 0.00 0.51 0.00 0.00 43.02 40.49 3d4l s PHE 364 CO -0.11 -0.41 1.13 0.95 0.70 0.00 0.00 175.22 177.48 3d4l s THR 365 N -1.90 2.06 0.22 0.64 -4.23 -0.72 -4.88 115.64 106.83 3d4l s THR 365 Ca 0.61 0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 61.07 3d4l s THR 365 Cb -0.16 -2.75 0.18 0.00 1.34 0.00 0.00 72.50 71.11 3d4l s THR 365 CO 0.20 -0.03 1.75 0.25 -0.54 0.00 0.00 174.62 176.25 3d4l h LEU 366 N -1.51 0.30 -0.03 4.79 5.85 -1.92 -0.44 115.31 122.34 3d4l h LEU 366 Ca -0.51 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3d4l h LEU 366 Cb 1.33 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.41 3d4l h LEU 366 CO 0.61 0.15 -0.01 -0.90 -0.34 0.00 0.00 178.44 177.96 3d4l n ASP 367 N -4.97 0.07 -0.21 1.25 5.68 -1.26 -4.92 116.55 112.19 3d4l n ASP 367 Ca 0.11 -0.41 -0.03 0.00 -0.50 0.00 0.00 54.79 53.96 3d4l n ASP 367 Cb 0.32 -0.19 -0.01 0.00 -1.14 0.00 0.00 41.12 40.10 3d4l n ASP 367 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d4l n GLY 368 N 1.21 0.49 0.04 6.12 0.00 -0.17 -4.88 105.19 108.00 3d4l n GLY 368 Ca 0.17 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.18 3d4l n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d4l n ASN 369 N -0.33 0.60 -3.95 1.61 3.02 -1.26 -4.90 115.26 110.05 3d4l n ASN 369 Ca -0.03 0.07 -0.10 0.00 -0.03 0.00 0.00 54.58 54.50 3d4l n ASN 369 Cb 0.29 0.09 -0.07 0.00 -0.61 0.00 0.00 39.78 39.48 3d4l n ASN 369 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3d4l s SER 370 N -3.82 0.01 0.15 6.41 1.04 -1.26 -1.24 113.70 114.99 3d4l s SER 370 Ca 0.08 -0.84 -0.17 0.00 0.48 0.00 0.00 55.95 55.50 3d4l s SER 370 Cb 0.15 0.45 0.03 0.00 0.10 0.00 0.00 66.02 66.75 3d4l s SER 370 CO 0.69 -0.91 0.44 0.72 0.98 0.00 0.00 173.24 175.16 3d4l s PHE 371 N -3.96 -0.18 -0.04 5.02 -0.12 -0.25 -1.76 117.98 116.68 3d4l s PHE 371 Ca 0.17 -0.13 0.03 0.00 -0.05 0.00 0.00 56.93 56.95 3d4l s PHE 371 Cb 0.03 0.30 -0.03 0.00 -0.63 0.00 0.00 43.02 42.69 3d4l s PHE 371 CO 0.00 -0.76 -0.13 0.71 -0.05 0.00 0.00 175.22 174.99 3d4l s TYR 372 N -3.82 2.74 -0.16 3.49 1.51 -0.11 -0.25 117.35 120.75 3d4l s TYR 372 Ca 0.05 -0.13 -0.16 0.00 -1.01 0.00 0.00 57.07 55.82 3d4l s TYR 372 Cb 0.01 -1.63 0.04 0.00 -0.11 0.00 0.00 41.96 40.27 3d4l s TYR 372 CO -0.10 0.23 0.45 0.21 -1.11 0.00 0.00 175.55 175.24 3d4l s LYS 373 N -0.84 0.55 -0.15 -0.62 2.20 -0.50 -0.42 119.74 119.96 3d4l s LYS 373 Ca 0.12 0.59 -0.26 0.00 -0.36 0.00 0.00 55.97 56.06 3d4l s LYS 373 Cb -0.11 0.27 -0.02 0.00 -1.51 0.00 0.00 37.83 36.46 3d4l s LYS 373 CO 0.01 -0.07 0.84 0.42 -0.36 0.00 0.00 175.35 176.19 3d4l s ILE 374 N 0.14 4.88 0.06 5.43 1.01 -1.26 -0.43 121.20 131.03 3d4l s ILE 374 Ca -0.01 1.67 -0.04 0.00 0.00 0.00 0.00 60.65 62.27 3d4l s ILE 374 Cb -0.03 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 3d4l s ILE 374 CO 0.01 0.04 0.05 0.27 0.00 0.00 0.00 174.94 175.31 3d4l s ILE 375 N 2.02 0.19 0.03 2.92 -4.36 -0.46 -4.56 121.20 116.97 3d4l s ILE 375 Ca 0.40 -1.55 -0.30 0.00 -0.26 0.00 0.00 60.65 58.94 3d4l s ILE 375 Cb -0.17 -1.41 -0.06 0.00 1.25 0.00 0.00 42.46 42.08 3d4l s ILE 375 CO 0.14 -0.85 1.29 -0.55 0.24 0.00 0.00 174.94 175.20 3d4l s SER 376 N -2.84 6.96 0.90 4.36 0.15 -1.26 -1.72 113.70 120.25 3d4l s SER 376 Ca 0.05 2.06 -0.09 0.00 0.70 0.00 0.00 55.95 58.68 3d4l s SER 376 Cb 0.06 -2.57 0.14 0.00 -1.71 0.00 0.00 66.02 61.95 3d4l s SER 376 CO -0.10 -0.60 0.88 -0.46 1.20 0.00 0.00 173.24 174.17 3d4l n ASN 377 N 4.60 0.32 0.33 5.45 0.23 0.19 -4.85 115.26 121.53 3d4l n ASN 377 Ca 0.11 -1.47 0.22 0.00 -0.53 0.00 0.00 54.58 52.90 3d4l n ASN 377 Cb 0.45 -0.65 1.14 0.00 -2.08 0.00 0.00 39.78 38.64 3d4l n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3d4l h GLU 378 N 0.00 0.00 -0.01 -3.83 4.39 -1.95 0.85 114.58 114.03 3d4l h GLU 378 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3d4l h GLU 378 Cb 0.85 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.50 3d4l h GLU 378 CO 0.23 0.00 -0.24 0.39 -1.16 0.00 0.00 179.01 178.23 3d4l n GLU 379 N -3.16 0.85 -0.66 2.33 -0.58 -1.26 -4.93 120.64 113.23 3d4l n GLU 379 Ca -0.03 -0.49 0.00 0.00 -0.42 0.00 0.00 57.16 56.22 3d4l n GLU 379 Cb 0.10 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.48 3d4l n GLU 379 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3d4l n GLY 380 N 1.33 0.66 3.73 0.62 0.00 0.29 -4.76 105.19 107.06 3d4l n GLY 380 Ca 0.13 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3d4l n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d4l s TYR 381 N -2.00 3.31 -0.21 1.61 1.51 -1.26 0.02 117.35 120.34 3d4l s TYR 381 Ca 0.00 0.25 -0.29 0.00 -1.01 0.00 0.00 57.07 56.02 3d4l s TYR 381 Cb 0.00 -1.90 0.00 0.00 -0.11 0.00 0.00 41.96 39.95 3d4l s TYR 381 CO 0.00 0.47 1.05 1.03 -1.11 0.00 0.00 175.55 176.99 3d4l s ARG 382 N -0.62 4.28 0.26 -0.62 0.52 -1.26 -0.64 118.95 120.88 3d4l s ARG 382 Ca 0.11 1.39 0.02 0.00 -0.52 0.00 0.00 55.73 56.73 3d4l s ARG 382 Cb -0.12 -3.63 -0.04 0.00 0.52 0.00 0.00 34.95 31.68 3d4l s ARG 382 CO 0.02 -0.59 0.15 -1.01 0.02 0.00 0.00 175.30 173.89 3d4l s HIS 383 N 3.05 1.46 -0.15 -0.53 3.76 -0.70 -1.39 115.29 120.79 3d4l s HIS 383 Ca 0.45 -1.36 -0.24 0.00 -0.15 0.00 0.00 55.06 53.77 3d4l s HIS 383 Cb -0.16 -0.76 -0.02 0.00 1.11 0.00 0.00 32.58 32.75 3d4l s HIS 383 CO 0.08 -0.55 0.75 0.42 -0.85 0.00 0.00 174.74 174.60 3d4l s ILE 384 N -3.80 4.95 0.02 0.60 1.01 -1.26 -1.36 121.20 121.37 3d4l s ILE 384 Ca 0.38 1.48 0.04 0.00 0.00 0.00 0.00 60.65 62.55 3d4l s ILE 384 Cb 0.06 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.43 3d4l s ILE 384 CO 0.16 0.10 -0.09 0.00 0.00 0.00 0.00 174.94 175.10 3d4l s TYR 386 N -1.00 3.06 0.06 0.00 5.04 0.12 -1.41 117.35 123.22 3d4l s TYR 386 Ca 0.17 -0.50 0.05 0.00 -2.44 0.00 0.00 57.07 54.35 3d4l s TYR 386 Cb -0.11 -2.19 -0.04 0.00 0.35 0.00 0.00 41.96 39.97 3d4l s TYR 386 CO 0.08 -0.36 -0.05 -0.06 -1.34 0.00 0.00 175.55 173.82 3d4l s PHE 387 N 1.48 2.90 -0.14 4.97 0.08 0.65 -1.32 117.98 126.60 3d4l s PHE 387 Ca 0.06 -0.06 -0.08 0.00 0.12 0.00 0.00 56.93 56.97 3d4l s PHE 387 Cb -0.15 -1.54 -0.04 0.00 -0.57 0.00 0.00 43.02 40.72 3d4l s PHE 387 CO 0.02 0.43 0.12 -0.65 -0.10 0.00 0.00 175.22 175.04 3d4l s GLN 388 N -1.94 3.66 0.54 0.44 1.11 -1.26 -1.09 119.66 121.12 3d4l s GLN 388 Ca 0.21 -0.19 0.26 0.00 0.01 0.00 0.00 55.36 55.65 3d4l s GLN 388 Cb -0.11 -3.23 1.56 0.00 -1.01 0.00 0.00 33.01 30.22 3d4l s GLN 388 CO 0.13 0.60 2.15 -0.84 0.01 0.00 0.00 175.29 177.35 3d4l h ILE 389 N 4.25 0.65 -0.47 1.08 3.07 -1.52 -2.66 117.51 121.90 3d4l h ILE 389 Ca -0.50 -0.26 -0.31 0.00 1.55 0.00 0.00 64.86 65.35 3d4l h ILE 389 Cb 1.20 1.16 -0.20 0.00 -0.27 0.00 0.00 36.82 38.71 3d4l h ILE 389 CO 0.64 0.06 -0.29 -0.90 -1.05 0.00 0.00 178.15 176.61 3d4l n ASP 390 N -3.88 3.57 -3.94 2.16 5.75 -1.26 -4.33 116.55 114.61 3d4l n ASP 390 Ca -0.03 -3.81 -0.19 0.00 -0.01 0.00 0.00 54.79 50.76 3d4l n ASP 390 Cb 0.16 -0.56 -0.16 0.00 -1.03 0.00 0.00 41.12 39.52 3d4l n ASP 390 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3d4l s LYS 391 N -3.41 0.81 0.15 0.11 3.01 -1.00 -4.93 119.74 114.47 3d4l s LYS 391 Ca 0.47 -0.18 -0.10 0.00 -1.01 0.00 0.00 55.97 55.15 3d4l s LYS 391 Cb 0.41 -0.79 -0.03 0.00 -1.01 0.00 0.00 37.83 36.41 3d4l s LYS 391 CO -0.00 0.01 1.48 0.87 0.51 0.00 0.00 175.35 178.21 3d4l h LYS 392 N 6.76 0.93 -6.19 1.68 6.56 -1.89 -3.41 116.57 121.01 3d4l h LYS 392 Ca -0.35 -0.49 -0.56 0.00 -1.06 0.00 0.00 60.65 58.19 3d4l h LYS 392 Cb 1.16 0.02 -0.05 0.00 -0.57 0.00 0.00 32.23 32.79 3d4l h LYS 392 CO 0.48 1.15 0.05 -0.51 -2.06 0.00 0.00 179.45 178.56 3d4l s ASP 393 N -6.84 7.08 0.29 0.86 1.01 -1.26 -5.01 116.67 112.79 3d4l s ASP 393 Ca -0.11 1.29 0.08 0.00 0.71 0.00 0.00 52.55 54.52 3d4l s ASP 393 Cb 0.11 -2.41 -0.04 0.00 1.01 0.00 0.00 42.92 41.60 3d4l s ASP 393 CO 0.88 0.09 0.17 0.00 0.21 0.00 0.00 175.17 176.52 3d4l s THR 395 N -2.25 2.74 0.12 0.00 2.01 -0.43 -4.86 115.64 112.97 3d4l s THR 395 Ca 0.35 -0.75 -0.30 0.00 0.31 0.00 0.00 61.69 61.30 3d4l s THR 395 Cb -0.06 -2.16 -0.07 0.00 0.01 0.00 0.00 72.50 70.22 3d4l s THR 395 CO 0.24 0.51 1.22 -0.36 -0.69 0.00 0.00 174.62 175.54 3d4l s PHE 396 N 0.74 3.42 -0.85 4.92 0.08 -1.26 0.15 117.98 125.17 3d4l s PHE 396 Ca -0.06 1.32 0.17 0.00 0.12 0.00 0.00 56.93 58.48 3d4l s PHE 396 Cb -0.15 -3.45 -0.17 0.00 -0.57 0.00 0.00 43.02 38.67 3d4l s PHE 396 CO 0.01 -1.35 0.73 0.44 -0.10 0.00 0.00 175.22 174.96 3d4l n ILE 397 N 3.30 0.00 -4.21 0.64 -5.35 0.47 -4.93 119.36 109.28 3d4l n ILE 397 Ca 0.07 -0.11 -0.13 0.00 -0.27 0.00 0.00 62.75 62.31 3d4l n ILE 397 Cb 0.45 1.01 -0.10 0.00 -1.74 0.00 0.00 39.64 39.26 3d4l n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3d4l s THR 398 N -2.57 0.97 0.07 7.28 -4.23 -1.25 -4.90 115.64 111.01 3d4l s THR 398 Ca 0.07 -1.93 -0.27 0.00 -1.18 0.00 0.00 61.69 58.39 3d4l s THR 398 Cb 0.13 -1.68 0.08 0.00 1.34 0.00 0.00 72.50 72.37 3d4l s THR 398 CO 0.68 -0.74 0.84 -1.59 -0.54 0.00 0.00 174.62 173.26 3d4l s LYS 399 N -3.56 1.02 0.00 3.99 -2.85 -1.26 -4.54 119.74 112.54 3d4l s LYS 399 Ca 0.13 -0.43 0.00 0.00 -1.00 0.00 0.00 55.97 54.66 3d4l s LYS 399 Cb 0.02 0.44 0.00 0.00 -2.06 0.00 0.00 37.83 36.23 3d4l s LYS 399 CO -0.01 -0.45 0.00 0.41 0.10 0.00 0.00 175.35 175.39 3d4l n GLY 400 N -0.32 3.21 2.72 0.59 0.00 -1.26 -4.93 105.19 105.20 3d4l n GLY 400 Ca -0.10 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 3d4l n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d4l n THR 401 N -1.83 4.35 -3.84 2.61 -2.24 -1.26 -4.75 114.28 107.33 3d4l n THR 401 Ca 0.00 -3.97 -0.04 0.00 -2.27 0.00 0.00 64.05 57.77 3d4l n THR 401 Cb 0.00 -2.37 0.01 0.00 -2.10 0.00 0.00 70.33 65.87 3d4l n THR 401 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3d4l s TRP 402 N 0.75 0.03 0.05 4.78 1.48 -1.26 -5.04 118.94 119.73 3d4l s TRP 402 Ca 0.46 -0.44 0.02 0.00 -1.06 0.00 0.00 56.10 55.09 3d4l s TRP 402 Cb 0.13 0.70 -0.03 0.00 -1.16 0.00 0.00 33.47 33.11 3d4l s TRP 402 CO -0.04 -0.97 -0.07 -1.21 -4.06 0.00 0.00 176.95 170.60 3d4l s GLU 403 N -2.45 0.55 -0.10 3.25 2.02 -1.26 -4.54 118.70 116.17 3d4l s GLU 403 Ca 0.19 -0.82 -0.26 0.00 0.02 0.00 0.00 54.97 54.10 3d4l s GLU 403 Cb -0.03 -0.25 -0.02 0.00 0.10 0.00 0.00 34.13 33.93 3d4l s GLU 403 CO 0.05 0.03 0.82 0.08 0.02 0.00 0.00 175.26 176.27 3d4l s VAL 404 N -1.68 4.93 -0.07 2.63 1.01 -0.49 -2.50 120.40 124.23 3d4l s VAL 404 Ca -0.08 1.67 -0.24 0.00 0.00 0.00 0.00 61.98 63.34 3d4l s VAL 404 Cb -0.08 -4.15 -0.30 0.00 0.00 0.00 0.00 36.38 31.85 3d4l s VAL 404 CO -0.00 0.13 0.86 0.40 0.00 0.00 0.00 175.10 176.48 3d4l h ILE 405 N 4.97 1.60 -2.27 2.22 1.08 -1.06 -3.45 117.51 120.59 3d4l h ILE 405 Ca -0.36 -2.49 0.05 0.00 -0.39 0.00 0.00 64.86 61.67 3d4l h ILE 405 Cb 1.17 3.26 -0.17 0.00 -3.07 0.00 0.00 36.82 38.02 3d4l h ILE 405 CO 0.79 0.69 0.39 -0.83 -0.69 0.00 0.00 178.15 178.50 3d4l s GLY 406 N -4.37 -0.48 -0.16 5.37 0.00 -1.20 -5.01 107.32 101.46 3d4l s GLY 406 Ca -0.15 1.13 -0.17 0.00 0.00 0.00 0.00 44.72 45.53 3d4l s GLY 406 CO 0.79 0.53 0.44 -0.42 0.00 0.00 0.00 173.10 174.44 3d4l s ILE 407 N -2.57 5.19 -0.14 0.90 1.01 -1.26 -1.76 121.20 122.57 3d4l s ILE 407 Ca 0.00 0.84 0.14 0.00 0.00 0.00 0.00 60.65 61.62 3d4l s ILE 407 Cb -0.01 -3.77 -0.19 0.00 0.01 0.00 0.00 42.46 38.50 3d4l s ILE 407 CO -0.05 0.29 0.06 -0.62 0.00 0.00 0.00 174.94 174.62 3d4l n GLU 408 N 4.07 1.49 -3.50 2.79 -0.58 0.13 -4.98 120.64 120.06 3d4l n GLU 408 Ca -0.08 -0.01 -0.14 0.00 -0.42 0.00 0.00 57.16 56.51 3d4l n GLU 408 Cb 0.51 -1.39 -0.04 0.00 -0.57 0.00 0.00 31.44 29.95 3d4l n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3d4l s ALA 409 N -2.39 -1.76 -0.03 0.62 0.00 -1.10 -4.84 121.76 112.26 3d4l s ALA 409 Ca -0.07 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.01 3d4l s ALA 409 Cb 0.05 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.34 3d4l s ALA 409 CO 0.62 -0.49 0.01 -1.17 0.00 0.00 0.00 175.76 174.73 3d4l s LEU 410 N -1.70 1.03 0.47 0.00 2.96 -1.26 0.04 118.68 120.21 3d4l s LEU 410 Ca -0.05 -0.00 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 3d4l s LEU 410 Cb -0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 46.19 46.49 3d4l s LEU 410 CO 0.01 -0.12 0.07 0.42 -1.32 0.00 0.00 176.35 175.40 3d4l s THR 411 N 1.18 0.82 0.10 3.68 -4.23 0.62 -4.98 115.64 112.83 3d4l s THR 411 Ca -0.08 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.73 3d4l s THR 411 Cb -0.13 -2.18 0.33 0.00 1.34 0.00 0.00 72.50 71.86 3d4l s THR 411 CO -0.02 0.00 1.91 0.77 -0.54 0.00 0.00 174.62 176.74 3d4l h SER 412 N 1.51 0.00 0.00 3.99 4.64 -2.01 -3.28 113.55 118.40 3d4l h SER 412 Ca -0.39 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.64 3d4l h SER 412 Cb 1.30 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.34 3d4l h SER 412 CO 0.65 0.08 -2.18 0.47 -0.87 0.00 0.00 176.83 174.98 3d4l n ASP 413 N -3.21 0.59 -4.04 4.97 8.00 -1.26 -4.82 116.55 116.78 3d4l n ASP 413 Ca 0.01 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.42 3d4l n ASP 413 Cb 0.36 1.07 -0.11 0.00 -0.02 0.00 0.00 41.12 42.42 3d4l n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3d4l s TYR 414 N -2.55 0.45 -0.09 1.24 1.51 -1.24 -1.19 117.35 115.47 3d4l s TYR 414 Ca -0.09 -0.73 0.04 0.00 -1.01 0.00 0.00 57.07 55.29 3d4l s TYR 414 Cb 0.06 -0.31 -0.00 0.00 -0.11 0.00 0.00 41.96 41.60 3d4l s TYR 414 CO 0.74 -0.23 -0.24 -1.17 -1.11 0.00 0.00 175.55 173.54 3d4l s LEU 415 N -2.07 2.07 -0.14 -1.29 0.20 -0.98 -0.27 118.68 116.20 3d4l s LEU 415 Ca -0.06 -0.54 -0.05 0.00 0.69 0.00 0.00 54.13 54.17 3d4l s LEU 415 Cb -0.03 -1.38 -0.04 0.00 -0.43 0.00 0.00 46.19 44.31 3d4l s LEU 415 CO -0.04 0.17 0.03 -0.31 -0.29 0.00 0.00 176.35 175.91 3d4l s TYR 416 N 0.29 3.22 0.12 5.38 1.51 0.11 -1.24 117.35 126.74 3d4l s TYR 416 Ca -0.17 0.10 -0.10 0.00 -1.01 0.00 0.00 57.07 55.89 3d4l s TYR 416 Cb -0.17 -1.95 0.00 0.00 -0.11 0.00 0.00 41.96 39.73 3d4l s TYR 416 CO 0.08 0.28 0.26 1.52 -1.11 0.00 0.00 175.55 176.59 3d4l s TYR 417 N -0.17 0.13 -0.11 2.71 -0.85 0.04 0.17 117.35 119.27 3d4l s TYR 417 Ca 0.06 -0.52 -0.04 0.00 -0.52 0.00 0.00 57.07 56.05 3d4l s TYR 417 Cb -0.12 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.20 3d4l s TYR 417 CO 0.02 -0.63 0.05 0.42 -1.52 0.00 0.00 175.55 173.89 3d4l s ILE 418 N -3.87 4.75 0.18 -3.49 -1.09 -0.72 -0.24 121.20 116.71 3d4l s ILE 418 Ca 0.07 -0.07 -0.11 0.00 -2.23 0.00 0.00 60.65 58.31 3d4l s ILE 418 Cb 0.04 -3.04 0.00 0.00 -1.58 0.00 0.00 42.46 37.88 3d4l s ILE 418 CO -0.08 0.59 0.36 -0.94 -1.23 0.00 0.00 174.94 173.63 3d4l s SER 419 N -0.78 -0.04 -0.38 3.58 1.04 -0.52 -0.39 113.70 116.21 3d4l s SER 419 Ca 0.12 -0.77 0.06 0.00 0.48 0.00 0.00 55.95 55.85 3d4l s SER 419 Cb -0.12 0.48 0.62 0.00 0.10 0.00 0.00 66.02 67.10 3d4l s SER 419 CO 0.03 -0.95 1.75 -0.46 0.98 0.00 0.00 173.24 174.59 3d4l n ASN 420 N -0.26 3.42 -0.21 7.02 0.23 -1.04 -1.70 115.26 122.72 3d4l n ASN 420 Ca -0.08 -3.62 -0.08 0.00 -0.53 0.00 0.00 54.58 50.27 3d4l n ASN 420 Cb 0.63 -0.76 0.03 0.00 -2.08 0.00 0.00 39.78 37.59 3d4l n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3d4l h GLU 421 N 1.16 0.92 -6.24 -3.83 4.81 -1.84 -3.34 114.58 106.22 3d4l h GLU 421 Ca 0.45 -0.21 -0.69 0.00 -0.13 0.00 0.00 59.36 58.79 3d4l h GLU 421 Cb 2.40 -0.13 0.04 0.00 0.63 0.00 0.00 28.75 31.68 3d4l h GLU 421 CO 0.82 0.83 0.68 0.98 -0.73 0.00 0.00 179.01 181.59 3d4l n TYR 422 N -4.40 1.81 -1.32 0.92 9.36 -1.26 -1.35 117.16 120.93 3d4l n TYR 422 Ca 0.03 0.54 -0.12 0.00 3.32 0.00 0.00 57.90 61.66 3d4l n TYR 422 Cb 0.22 -2.41 -0.05 0.00 -0.63 0.00 0.00 39.34 36.46 3d4l n TYR 422 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3d4l n LYS 423 N 3.88 -1.38 -1.93 2.98 5.02 -1.26 -1.95 118.16 123.52 3d4l n LYS 423 Ca 0.21 0.76 -0.20 0.00 -2.02 0.00 0.00 58.31 57.07 3d4l n LYS 423 Cb 0.18 -4.97 -0.05 0.00 -0.02 0.00 0.00 35.03 30.17 3d4l n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d4l n GLY 424 N -0.16 0.85 3.43 0.72 0.00 -0.45 -4.96 105.19 104.63 3d4l n GLY 424 Ca -0.12 -0.06 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 3d4l n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3d4l s MET 425 N -4.25 3.08 0.62 1.61 -1.94 -0.82 -4.93 119.30 112.66 3d4l s MET 425 Ca 0.00 -1.01 0.41 0.00 -1.71 0.00 0.00 55.69 53.37 3d4l s MET 425 Cb 0.00 -4.09 2.06 0.00 2.01 0.00 0.00 34.83 34.81 3d4l s MET 425 CO 0.00 -1.12 2.23 -1.00 -0.01 0.00 0.00 175.02 175.12 3d4l h PRO 426 N 8.89 0.00 -0.44 2.03 0.13 -1.90 -1.67 132.00 139.04 3d4l h PRO 426 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3d4l h PRO 426 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3d4l h PRO 426 CO 0.92 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.10 3d4l n GLY 427 N -0.72 1.17 3.75 1.56 0.00 -1.26 -4.88 105.19 104.80 3d4l n GLY 427 Ca -0.02 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 3d4l n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d4l s GLY 428 N -1.09 1.59 -0.07 -0.02 0.00 -0.63 -2.41 107.32 104.70 3d4l s GLY 428 Ca 0.32 -1.58 -0.03 0.00 0.00 0.00 0.00 44.72 43.44 3d4l s GLY 428 CO 0.23 -1.60 0.16 0.50 0.00 0.00 0.00 173.10 172.38 3d4l s ARG 429 N -3.79 0.08 0.09 2.90 1.81 -0.08 -4.17 118.95 115.80 3d4l s ARG 429 Ca 0.33 0.43 0.02 0.00 -1.72 0.00 0.00 55.73 54.79 3d4l s ARG 429 Cb -0.06 -0.20 -0.04 0.00 -0.45 0.00 0.00 34.95 34.20 3d4l s ARG 429 CO 0.23 -0.20 -0.07 -0.80 -0.68 0.00 0.00 175.30 173.78 3d4l s ASN 430 N 1.46 1.12 -0.12 0.23 0.01 -0.69 -0.51 114.94 116.44 3d4l s ASN 430 Ca -0.06 -0.98 -0.14 0.00 -0.71 0.00 0.00 52.86 50.98 3d4l s ASN 430 Cb -0.12 0.09 -0.05 0.00 0.41 0.00 0.00 41.25 41.59 3d4l s ASN 430 CO -0.06 -0.45 0.31 -0.22 -1.51 0.00 0.00 177.10 175.17 3d4l s LEU 431 N -2.94 4.31 0.17 0.60 2.96 -1.26 -1.43 118.68 121.08 3d4l s LEU 431 Ca 0.10 0.62 0.04 0.00 -0.22 0.00 0.00 54.13 54.67 3d4l s LEU 431 Cb 0.04 -2.40 -0.05 0.00 0.50 0.00 0.00 46.19 44.28 3d4l s LEU 431 CO -0.04 0.17 -0.08 -0.31 -1.32 0.00 0.00 176.35 174.77 3d4l s TYR 432 N -0.00 1.37 0.01 5.38 1.51 0.66 -0.26 117.35 126.01 3d4l s TYR 432 Ca 0.18 -0.79 0.02 0.00 -1.01 0.00 0.00 57.07 55.47 3d4l s TYR 432 Cb -0.14 -0.72 -0.01 0.00 -0.11 0.00 0.00 41.96 40.98 3d4l s TYR 432 CO 0.06 0.06 -0.08 -1.59 -1.11 0.00 0.00 175.55 172.89 3d4l s LYS 433 N -3.77 0.61 -0.07 -0.62 -2.85 -0.78 -0.78 119.74 111.47 3d4l s LYS 433 Ca 0.20 -0.41 0.04 0.00 -1.00 0.00 0.00 55.97 54.80 3d4l s LYS 433 Cb 0.03 -0.55 0.00 0.00 -2.06 0.00 0.00 37.83 35.25 3d4l s LYS 433 CO 0.03 0.14 -0.19 -1.50 0.10 0.00 0.00 175.35 173.93 3d4l s ILE 434 N -0.48 1.65 -0.20 3.79 2.07 -0.37 -1.47 121.20 126.19 3d4l s ILE 434 Ca 0.00 -0.80 -0.29 0.00 -1.41 0.00 0.00 60.65 58.15 3d4l s ILE 434 Cb -0.05 -1.43 -0.02 0.00 0.13 0.00 0.00 42.46 41.09 3d4l s ILE 434 CO 0.00 0.47 1.47 -1.58 -1.91 0.00 0.00 174.94 173.39 3d4l s GLN 435 N 0.29 3.98 0.57 3.50 0.74 -0.78 -2.32 119.66 125.66 3d4l s GLN 435 Ca -0.12 1.65 0.31 0.00 0.05 0.00 0.00 55.36 57.25 3d4l s GLN 435 Cb -0.15 -3.93 1.75 0.00 1.10 0.00 0.00 33.01 31.78 3d4l s GLN 435 CO 0.05 -1.05 2.20 -0.07 -0.55 0.00 0.00 175.29 175.87 3d4l h LEU 436 N 10.83 0.00 0.00 3.68 3.38 -1.47 -1.82 115.31 129.91 3d4l h LEU 436 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3d4l h LEU 436 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3d4l h LEU 436 CO 0.99 0.04 -0.38 -1.54 0.09 0.00 0.00 178.44 177.65 3d4l n SER 437 N -3.66 0.45 -3.26 -0.43 3.41 -1.26 -4.64 113.62 104.22 3d4l n SER 437 Ca -0.02 0.08 -0.06 0.00 -0.26 0.00 0.00 58.87 58.60 3d4l n SER 437 Cb 0.14 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.03 3d4l n SER 437 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3d4l s ASP 438 N -3.40 -0.36 0.27 4.04 -1.08 -0.69 -5.02 116.67 110.43 3d4l s ASP 438 Ca 0.11 -0.78 0.18 0.00 -0.52 0.00 0.00 52.55 51.53 3d4l s ASP 438 Cb 0.16 1.39 0.95 0.00 -1.46 0.00 0.00 42.92 43.97 3d4l s ASP 438 CO 0.66 -0.25 1.53 -1.22 0.52 0.00 0.00 175.17 176.41 3d4l n TYR 439 N 4.72 0.60 1.21 -5.34 4.01 -1.20 -0.81 117.16 120.35 3d4l n TYR 439 Ca 0.08 0.31 0.14 0.00 -0.16 0.00 0.00 57.90 58.27 3d4l n TYR 439 Cb 0.52 -0.99 0.68 0.00 -0.31 0.00 0.00 39.34 39.24 3d4l n TYR 439 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3d4l n THR 440 N -2.12 0.03 -3.25 -0.72 -2.24 -1.26 -4.45 114.28 100.27 3d4l n THR 440 Ca -0.01 0.01 -0.46 0.00 -2.27 0.00 0.00 64.05 61.31 3d4l n THR 440 Cb 0.04 -0.52 -0.02 0.00 -2.10 0.00 0.00 70.33 67.73 3d4l n THR 440 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3d4l s LYS 441 N -2.77 3.66 -0.14 -0.78 -0.14 0.01 -5.01 119.74 114.57 3d4l s LYS 441 Ca 0.21 -2.40 -0.00 0.00 -1.36 0.00 0.00 55.97 52.43 3d4l s LYS 441 Cb 0.19 -4.55 -0.01 0.00 -1.68 0.00 0.00 37.83 31.79 3d4l s LYS 441 CO 0.48 -1.39 -0.14 0.08 -0.76 0.00 0.00 175.35 173.63 3d4l s VAL 442 N 0.55 2.88 -0.14 3.17 1.01 -1.26 -1.86 120.40 124.76 3d4l s VAL 442 Ca 0.22 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.52 3d4l s VAL 442 Cb -0.09 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.09 3d4l s VAL 442 CO -0.09 0.52 -0.21 -0.89 0.00 0.00 0.00 175.10 174.43 3d4l s THR 443 N 0.58 1.99 -0.05 3.92 2.01 -0.54 -4.98 115.64 118.56 3d4l s THR 443 Ca -0.08 -0.93 -0.29 0.00 0.31 0.00 0.00 61.69 60.70 3d4l s THR 443 Cb -0.16 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.56 3d4l s THR 443 CO 0.03 0.53 0.95 0.00 -0.69 0.00 0.00 174.62 175.45 3d4l n LEU 445 N 4.33 0.61 0.00 0.00 4.77 0.64 -4.60 117.00 122.75 3d4l n LEU 445 Ca 0.06 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 3d4l n LEU 445 Cb 0.50 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3d4l n LEU 445 CO 0.51 0.11 -0.34 -1.54 -1.33 0.00 0.00 177.39 174.80 3d4l n SER 446 N -1.84 3.40 -0.23 -1.43 3.41 -1.20 -4.80 113.62 110.92 3d4l n SER 446 Ca 0.02 -0.08 0.04 0.00 -0.26 0.00 0.00 58.87 58.59 3d4l n SER 446 Cb 0.42 0.83 0.15 0.00 -0.26 0.00 0.00 64.21 65.36 3d4l n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d4l n GLU 448 N -5.20 2.24 -0.20 0.00 4.71 -1.26 -4.11 120.64 116.83 3d4l n GLU 448 Ca 0.12 -1.84 -0.04 0.00 -0.01 0.00 0.00 57.16 55.40 3d4l n GLU 448 Cb 0.42 -1.47 0.06 0.00 -1.01 0.00 0.00 31.44 29.44 3d4l n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3d4l h LEU 449 N 4.01 0.50 -5.00 -4.62 3.38 -1.80 -3.39 115.31 108.39 3d4l h LEU 449 Ca 0.00 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 3d4l h LEU 449 Cb 0.87 -0.08 -0.14 0.00 0.09 0.00 0.00 40.66 41.39 3d4l h LEU 449 CO 0.00 0.34 -0.34 -3.20 0.09 0.00 0.00 178.44 175.32 3d4l n ASN 450 N -4.81 -2.49 -0.25 -0.43 2.85 -1.26 -5.05 115.26 103.82 3d4l n ASN 450 Ca 0.06 -2.58 0.30 0.00 -0.11 0.00 0.00 54.58 52.25 3d4l n ASN 450 Cb 0.12 1.43 0.71 0.00 1.24 0.00 0.00 39.78 43.29 3d4l n ASN 450 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3d4l h PRO 451 N 4.06 0.04 0.11 1.20 0.13 -1.76 0.32 132.00 136.09 3d4l h PRO 451 Ca -0.10 -0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.74 3d4l h PRO 451 Cb 1.10 -0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.25 3d4l h PRO 451 CO 0.09 0.03 -1.21 0.93 -0.23 0.00 0.00 178.00 177.61 3d4l h GLU 452 N 0.04 0.55 0.02 0.86 5.08 -1.96 -3.37 114.58 115.80 3d4l h GLU 452 Ca 0.49 -0.73 -0.32 0.00 -1.00 0.00 0.00 59.36 57.80 3d4l h GLU 452 Cb 1.89 0.24 -0.05 0.00 0.50 0.00 0.00 28.75 31.33 3d4l h GLU 452 CO -0.03 1.32 -1.88 -2.13 -1.00 0.00 0.00 179.01 175.29 3d4l n ARG 453 N -3.75 0.66 -4.02 2.33 0.63 -0.79 -4.56 116.66 107.17 3d4l n ARG 453 Ca -0.12 0.24 -0.31 0.00 -0.92 0.00 0.00 57.85 56.74 3d4l n ARG 453 Cb 0.97 -1.73 -0.15 0.00 0.45 0.00 0.00 32.46 32.00 3d4l n ARG 453 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3d4l n GLN 455 N 4.55 0.10 -3.59 0.00 6.02 0.70 -4.36 117.38 120.80 3d4l n GLN 455 Ca -0.14 -0.46 -0.28 0.00 -0.01 0.00 0.00 57.00 56.11 3d4l n GLN 455 Cb 0.44 -0.74 -0.16 0.00 1.02 0.00 0.00 30.24 30.80 3d4l n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3d4l s TYR 456 N -0.14 0.49 0.18 1.08 6.14 -1.04 -0.90 117.35 123.16 3d4l s TYR 456 Ca 0.00 -0.82 0.09 0.00 0.64 0.00 0.00 57.07 56.98 3d4l s TYR 456 Cb 0.00 -0.94 -0.04 0.00 0.42 0.00 0.00 41.96 41.39 3d4l s TYR 456 CO 0.00 -0.74 -0.13 0.71 0.64 0.00 0.00 175.55 176.04 3d4l s TYR 457 N 2.04 2.56 0.19 4.97 2.02 0.33 -0.60 117.35 128.86 3d4l s TYR 457 Ca 0.06 -0.25 0.02 0.00 -0.37 0.00 0.00 57.07 56.53 3d4l s TYR 457 Cb -0.16 -1.25 -0.05 0.00 -0.40 0.00 0.00 41.96 40.10 3d4l s TYR 457 CO -0.26 0.51 0.03 -1.54 -1.57 0.00 0.00 175.55 172.72 3d4l s SER 458 N -2.80 1.16 0.10 2.29 1.04 -0.83 -4.60 113.70 110.06 3d4l s SER 458 Ca 0.24 -1.23 -0.06 0.00 0.48 0.00 0.00 55.95 55.38 3d4l s SER 458 Cb -0.09 0.14 -0.02 0.00 0.10 0.00 0.00 66.02 66.16 3d4l s SER 458 CO 0.14 -0.62 0.14 0.54 0.98 0.00 0.00 173.24 174.42 3d4l s VAL 459 N -3.70 0.14 -0.19 5.02 0.11 -1.26 -1.76 120.40 118.76 3d4l s VAL 459 Ca 0.28 -1.44 -0.05 0.00 -2.93 0.00 0.00 61.98 57.84 3d4l s VAL 459 Cb 0.07 -1.55 0.07 0.00 -1.53 0.00 0.00 36.38 33.44 3d4l s VAL 459 CO 0.07 -0.65 0.12 -0.55 -3.33 0.00 0.00 175.10 170.76 3d4l s SER 460 N -2.91 2.29 0.29 3.54 0.15 -0.48 -4.97 113.70 111.60 3d4l s SER 460 Ca 0.10 -0.62 -0.12 0.00 0.70 0.00 0.00 55.95 56.00 3d4l s SER 460 Cb 0.06 -0.12 -0.08 0.00 -1.71 0.00 0.00 66.02 64.16 3d4l s SER 460 CO -0.07 -0.36 0.66 -0.36 1.20 0.00 0.00 173.24 174.30 3d4l s PHE 461 N 2.17 3.40 1.10 3.44 0.40 -1.26 -0.84 117.98 126.39 3d4l s PHE 461 Ca 0.04 1.06 -0.17 0.00 -0.60 0.00 0.00 56.93 57.25 3d4l s PHE 461 Cb -0.16 -2.41 0.24 0.00 0.51 0.00 0.00 43.02 41.21 3d4l s PHE 461 CO -0.13 0.16 1.16 -1.54 0.70 0.00 0.00 175.22 175.56 3d4l s SER 462 N -2.36 1.82 0.29 1.36 1.04 0.64 -4.86 113.70 111.63 3d4l s SER 462 Ca 0.51 0.64 0.03 0.00 0.48 0.00 0.00 55.95 57.61 3d4l s SER 462 Cb -0.11 -0.92 0.74 0.00 0.10 0.00 0.00 66.02 65.84 3d4l s SER 462 CO 0.20 -3.57 1.64 0.11 0.98 0.00 0.00 173.24 172.60 3d4l h LYS 463 N -2.20 0.20 -0.17 4.02 1.79 -1.73 -1.70 116.57 116.77 3d4l h LYS 463 Ca -0.46 -0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 57.95 3d4l h LYS 463 Cb 1.29 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.86 3d4l h LYS 463 CO 0.40 0.13 -0.09 0.39 -1.08 0.00 0.00 179.45 179.20 3d4l n GLU 464 N -5.22 1.98 -1.74 3.15 -0.58 -1.26 -4.95 120.64 112.01 3d4l n GLU 464 Ca 0.22 -2.93 -0.16 0.00 -0.42 0.00 0.00 57.16 53.87 3d4l n GLU 464 Cb 0.71 -1.71 -0.05 0.00 -0.57 0.00 0.00 31.44 29.82 3d4l n GLU 464 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3d4l n ALA 465 N -1.03 -0.32 0.09 0.62 0.00 -0.64 -4.89 120.51 114.34 3d4l n ALA 465 Ca 0.23 0.22 -0.05 0.00 0.00 0.00 0.00 53.44 53.83 3d4l n ALA 465 Cb 0.83 -1.75 0.11 0.00 0.00 0.00 0.00 19.45 18.65 3d4l n ALA 465 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3d4l h LYS 466 N 0.00 0.22 -4.72 0.00 3.64 -1.81 -3.41 116.57 110.49 3d4l h LYS 466 Ca -0.35 -0.16 -0.25 0.00 -1.27 0.00 0.00 60.65 58.62 3d4l h LYS 466 Cb 1.13 0.03 -0.16 0.00 -0.41 0.00 0.00 32.23 32.82 3d4l h LYS 466 CO 0.48 0.78 -0.71 0.71 -2.27 0.00 0.00 179.45 178.44 3d4l s TYR 467 N -3.69 0.92 -0.08 1.91 2.02 -1.26 -0.90 117.35 116.27 3d4l s TYR 467 Ca -0.04 -0.81 -0.09 0.00 -0.37 0.00 0.00 57.07 55.76 3d4l s TYR 467 Cb 0.12 -0.52 0.02 0.00 -0.40 0.00 0.00 41.96 41.18 3d4l s TYR 467 CO 0.80 -0.10 0.24 1.52 -1.57 0.00 0.00 175.55 176.44 3d4l s TYR 468 N -3.15 -0.23 -0.21 2.71 1.13 -0.43 -0.26 117.35 116.90 3d4l s TYR 468 Ca 0.09 0.55 -0.10 0.00 -1.41 0.00 0.00 57.07 56.20 3d4l s TYR 468 Cb 0.02 0.08 -0.05 0.00 -1.10 0.00 0.00 41.96 40.91 3d4l s TYR 468 CO -0.03 -0.17 0.13 -1.14 -2.51 0.00 0.00 175.55 171.83 3d4l s GLN 469 N -0.13 4.10 -0.13 -3.49 0.74 -0.02 -0.50 119.66 120.23 3d4l s GLN 469 Ca -0.02 -0.27 -0.07 0.00 0.05 0.00 0.00 55.36 55.05 3d4l s GLN 469 Cb -0.03 -3.42 -0.04 0.00 1.10 0.00 0.00 33.01 30.62 3d4l s GLN 469 CO 0.01 0.20 0.13 -0.51 -0.55 0.00 0.00 175.29 174.57 3d4l s LEU 470 N 0.63 4.30 -0.28 3.68 1.43 0.14 -1.39 118.68 127.20 3d4l s LEU 470 Ca 0.07 0.40 0.02 0.00 -1.03 0.00 0.00 54.13 53.59 3d4l s LEU 470 Cb -0.12 -2.06 0.08 0.00 0.03 0.00 0.00 46.19 44.12 3d4l s LEU 470 CO 0.01 0.36 -0.01 -0.60 0.23 0.00 0.00 176.35 176.34 3d4l s ARG 471 N -0.75 1.55 -0.16 1.70 3.52 -0.72 -1.35 118.95 122.74 3d4l s ARG 471 Ca 0.13 -1.28 -0.20 0.00 -0.13 0.00 0.00 55.73 54.26 3d4l s ARG 471 Cb -0.12 -2.70 -0.03 0.00 -1.56 0.00 0.00 34.95 30.54 3d4l s ARG 471 CO 0.03 -0.73 0.57 0.00 -0.81 0.00 0.00 175.30 174.35 3d4l n SER 473 N 4.41 2.72 0.00 0.00 3.41 0.23 -1.59 113.62 122.80 3d4l n SER 473 Ca -0.04 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.60 3d4l n SER 473 Cb 0.51 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 3d4l n SER 473 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d4l n GLY 474 N 0.34 1.38 0.08 5.00 0.00 -1.26 -1.06 105.19 109.66 3d4l n GLY 474 Ca 0.09 -1.09 0.11 0.00 0.00 0.00 0.00 46.02 45.13 3d4l n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d4l n PRO 475 N -0.85 0.15 -0.29 1.61 -0.04 -0.51 -0.21 135.00 134.86 3d4l n PRO 475 Ca 0.00 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 3d4l n PRO 475 Cb 0.00 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 3d4l n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d4l n GLY 476 N 0.51 0.06 3.77 0.55 0.00 0.27 -4.51 105.19 105.85 3d4l n GLY 476 Ca 0.04 -1.83 -0.38 0.00 0.00 0.00 0.00 46.02 43.85 3d4l n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d4l s LEU 477 N 0.00 4.16 0.19 0.99 1.43 -1.26 -4.58 118.68 119.61 3d4l s LEU 477 Ca 0.00 2.34 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 3d4l s LEU 477 Cb 0.00 -4.06 -0.16 0.00 0.03 0.00 0.00 46.19 42.01 3d4l s LEU 477 CO 0.00 -0.71 1.01 -2.65 0.23 0.00 0.00 176.35 174.23 3d4l n PRO 478 N -0.01 0.93 -4.19 1.29 -0.02 -1.26 -4.79 135.00 126.95 3d4l n PRO 478 Ca 0.05 0.33 -0.23 0.00 -2.02 0.00 0.00 63.50 61.63 3d4l n PRO 478 Cb 0.47 -1.71 -0.17 0.00 -0.02 0.00 0.00 33.50 32.07 3d4l n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3d4l s LEU 479 N 0.96 1.30 -0.17 2.45 2.96 -0.62 -4.21 118.68 121.36 3d4l s LEU 479 Ca 0.69 -0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 54.38 3d4l s LEU 479 Cb -0.86 -0.64 -0.01 0.00 0.50 0.00 0.00 46.19 45.19 3d4l s LEU 479 CO 0.55 -0.06 -0.10 -0.31 -1.32 0.00 0.00 176.35 175.11 3d4l s TYR 480 N 1.13 2.87 0.12 5.38 1.51 -0.05 -0.70 117.35 127.61 3d4l s TYR 480 Ca -0.07 -0.85 0.04 0.00 -1.01 0.00 0.00 57.07 55.17 3d4l s TYR 480 Cb -0.14 -1.95 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 3d4l s TYR 480 CO -0.01 -0.39 -0.09 0.95 -1.11 0.00 0.00 175.55 174.89 3d4l s THR 481 N 0.86 0.98 -0.05 -0.71 -4.23 -0.46 -0.31 115.64 111.74 3d4l s THR 481 Ca -0.03 -1.90 0.05 0.00 -1.18 0.00 0.00 61.69 58.63 3d4l s THR 481 Cb -0.15 -1.66 -0.02 0.00 1.34 0.00 0.00 72.50 72.01 3d4l s THR 481 CO 0.00 -0.72 -0.19 -0.22 -0.54 0.00 0.00 174.62 172.95 3d4l s LEU 482 N -2.92 2.44 0.10 4.79 2.96 -0.51 -0.68 118.68 124.87 3d4l s LEU 482 Ca 0.12 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 3d4l s LEU 482 Cb 0.02 -1.47 -0.04 0.00 0.50 0.00 0.00 46.19 45.20 3d4l s LEU 482 CO -0.01 0.31 -0.08 -1.00 -1.32 0.00 0.00 176.35 174.26 3d4l s HIS 483 N -0.56 0.97 -0.11 5.38 3.76 0.35 -1.00 115.29 124.07 3d4l s HIS 483 Ca 0.08 -0.85 -0.01 0.00 -0.15 0.00 0.00 55.06 54.14 3d4l s HIS 483 Cb -0.11 -0.54 -0.02 0.00 1.11 0.00 0.00 32.58 33.02 3d4l s HIS 483 CO 0.01 -0.09 -0.09 -1.54 -0.85 0.00 0.00 174.74 172.18 3d4l s SER 484 N -2.95 4.41 0.30 1.40 1.04 -0.70 -1.32 113.70 115.88 3d4l s SER 484 Ca 0.11 -0.18 0.12 0.00 0.48 0.00 0.00 55.95 56.49 3d4l s SER 484 Cb 0.03 -1.46 0.46 0.00 0.10 0.00 0.00 66.02 65.15 3d4l s SER 484 CO -0.03 0.24 1.66 0.28 0.98 0.00 0.00 173.24 176.36 3d4l h SER 485 N 6.18 0.00 -0.81 7.02 0.02 -1.26 -0.84 113.55 123.85 3d4l h SER 485 Ca -0.35 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.69 3d4l h SER 485 Cb 1.19 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.66 3d4l h SER 485 CO 0.56 0.54 0.47 1.62 -1.14 0.00 0.00 176.83 178.88 3d4l h VAL 486 N 0.00 0.91 0.00 2.27 3.04 -1.90 -3.16 116.25 117.42 3d4l h VAL 486 Ca -0.01 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 3d4l h VAL 486 Cb 1.01 0.06 0.00 0.00 -2.01 0.00 0.00 31.29 30.35 3d4l h VAL 486 CO 0.07 0.14 -0.30 0.59 -1.01 0.00 0.00 177.57 177.06 3d4l n ASN 487 N -4.74 0.80 -3.98 3.17 3.02 -1.25 -5.01 115.26 107.25 3d4l n ASN 487 Ca 0.13 -2.29 -0.27 0.00 -0.03 0.00 0.00 54.58 52.12 3d4l n ASN 487 Cb 0.27 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 39.17 3d4l n ASN 487 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3d4l n ASP 488 N -0.47 -1.10 -4.78 6.41 9.92 -0.36 -4.93 116.55 121.24 3d4l n ASP 488 Ca 0.05 -0.99 -0.37 0.00 -0.53 0.00 0.00 54.79 52.96 3d4l n ASP 488 Cb 0.66 -3.10 -0.05 0.00 -0.64 0.00 0.00 41.12 37.99 3d4l n ASP 488 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 3d4l s LYS 489 N -6.59 4.33 -0.69 -1.24 1.02 -0.95 -4.83 119.74 110.78 3d4l s LYS 489 Ca 0.16 1.47 -0.19 0.00 0.02 0.00 0.00 55.97 57.43 3d4l s LYS 489 Cb -0.09 -2.66 0.12 0.00 -0.52 0.00 0.00 37.83 34.68 3d4l s LYS 489 CO 0.89 0.02 0.84 0.20 -0.92 0.00 0.00 175.35 176.37 3d4l s GLY 490 N -1.55 1.83 0.02 -3.33 0.00 -1.26 -1.72 107.32 101.31 3d4l s GLY 490 Ca 0.55 -2.38 -0.27 0.00 0.00 0.00 0.00 44.72 42.61 3d4l s GLY 490 CO 0.27 1.71 1.19 1.41 0.00 0.00 0.00 173.10 177.68 3d4l h LEU 491 N 10.07 -0.82 -7.52 0.66 3.38 -1.42 -3.49 115.31 116.17 3d4l h LEU 491 Ca -0.16 0.03 0.05 0.00 0.09 0.00 0.00 57.88 57.88 3d4l h LEU 491 Cb 1.07 0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.94 3d4l h LEU 491 CO 1.08 -0.49 0.26 0.00 0.09 0.00 0.00 178.44 179.38 3d4l s ARG 492 N -4.79 1.48 -0.17 1.13 1.70 -1.16 -5.01 118.95 112.12 3d4l s ARG 492 Ca -0.14 -0.72 -0.18 0.00 -0.47 0.00 0.00 55.73 54.22 3d4l s ARG 492 Cb 0.01 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.93 3d4l s ARG 492 CO 0.42 -0.67 0.50 0.08 -1.08 0.00 0.00 175.30 174.56 3d4l s VAL 493 N -3.75 5.13 -0.11 4.99 1.01 -1.26 -1.43 120.40 124.98 3d4l s VAL 493 Ca 0.07 0.95 -0.04 0.00 0.00 0.00 0.00 61.98 62.96 3d4l s VAL 493 Cb -0.03 -3.83 -0.26 0.00 0.00 0.00 0.00 36.38 32.26 3d4l s VAL 493 CO -0.02 0.22 0.39 0.18 0.00 0.00 0.00 175.10 175.87 3d4l n LEU 494 N 4.44 2.44 -3.65 3.92 4.77 0.58 -4.94 117.00 124.57 3d4l n LEU 494 Ca -0.05 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.13 3d4l n LEU 494 Cb 0.51 -0.97 -0.05 0.00 -2.33 0.00 0.00 43.42 40.58 3d4l n LEU 494 CO 0.42 0.80 0.28 -0.70 -1.33 0.00 0.00 177.39 176.86 3d4l s GLU 495 N -2.56 0.60 0.00 3.23 2.56 -1.08 -5.01 118.70 116.44 3d4l s GLU 495 Ca -0.21 1.39 0.05 0.00 0.00 0.00 0.00 54.97 56.21 3d4l s GLU 495 Cb 0.07 0.68 0.13 0.00 2.00 0.00 0.00 34.13 37.00 3d4l s GLU 495 CO 0.77 -0.19 1.03 -0.40 -0.56 0.00 0.00 175.26 175.92 3d4l n ASP 496 N 5.16 2.25 -2.95 -1.70 5.68 -1.26 -0.87 116.55 122.87 3d4l n ASP 496 Ca -0.14 -1.85 -0.18 0.00 -0.50 0.00 0.00 54.79 52.12 3d4l n ASP 496 Cb 0.52 -0.09 -0.00 0.00 -1.14 0.00 0.00 41.12 40.40 3d4l n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3d4l n ASN 497 N 0.05 -4.01 0.24 -1.12 3.02 -1.26 -4.85 115.26 107.33 3d4l n ASN 497 Ca 0.05 -0.13 0.09 0.00 -0.03 0.00 0.00 54.58 54.56 3d4l n ASN 497 Cb 0.30 -3.35 0.61 0.00 -0.61 0.00 0.00 39.78 36.73 3d4l n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3d4l h SER 498 N -0.62 0.00 -0.08 6.41 4.64 -1.94 -2.00 113.55 119.96 3d4l h SER 498 Ca -0.38 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.93 3d4l h SER 498 Cb 1.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3d4l h SER 498 CO 0.45 0.17 0.02 0.00 -0.87 0.00 0.00 176.83 176.60 3d4l h ALA 499 N 1.83 0.11 -0.72 5.18 0.00 -2.00 -1.60 119.26 122.05 3d4l h ALA 499 Ca -0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3d4l h ALA 499 Cb 0.36 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3d4l h ALA 499 CO 0.02 -0.26 0.45 1.25 0.00 0.00 0.00 179.25 180.71 3d4l h LEU 500 N -0.09 0.86 -0.73 0.00 5.85 -1.79 -1.92 115.31 117.50 3d4l h LEU 500 Ca 0.03 -0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.78 3d4l h LEU 500 Cb 0.26 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 3d4l h LEU 500 CO 0.00 0.65 0.39 -0.78 -0.34 0.00 0.00 178.44 178.36 3d4l h ASP 501 N 0.99 0.54 -0.67 1.25 3.58 -1.20 0.21 116.42 121.12 3d4l h ASP 501 Ca 0.26 0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.72 3d4l h ASP 501 Cb -0.06 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 3d4l h ASP 501 CO -0.05 0.32 0.26 0.50 -2.88 0.00 0.00 179.24 177.39 3d4l h LYS 502 N 0.68 1.01 -0.38 0.28 3.64 -0.66 -2.52 116.57 118.63 3d4l h LYS 502 Ca 0.35 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.46 3d4l h LYS 502 Cb 0.31 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3d4l h LYS 502 CO -0.24 0.85 -0.04 0.52 -2.27 0.00 0.00 179.45 178.28 3d4l h MET 503 N 0.96 0.70 0.00 1.90 2.86 -0.46 -3.01 114.93 117.87 3d4l h MET 503 Ca 0.22 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3d4l h MET 503 Cb 0.23 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.84 3d4l h MET 503 CO -0.02 0.82 0.00 -0.07 1.06 0.00 0.00 176.91 178.70 3d4l h LEU 504 N 0.51 0.00 -2.05 1.22 3.38 -0.48 -2.64 115.31 115.25 3d4l h LEU 504 Ca 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3d4l h LEU 504 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3d4l h LEU 504 CO 0.03 0.00 -0.06 1.56 0.09 0.00 0.00 178.44 180.06 3d4l h GLN 505 N 0.00 0.00 -0.62 1.13 4.20 -1.31 -1.48 115.11 117.03 3d4l h GLN 505 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3d4l h GLN 505 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 3d4l h GLN 505 CO 0.00 0.06 0.00 0.09 -0.67 0.00 0.00 178.83 178.31 3d4l n ASN 506 N -4.17 3.55 -4.20 1.46 3.02 -0.99 -4.89 115.26 109.04 3d4l n ASN 506 Ca -0.03 -2.34 -0.25 0.00 -0.03 0.00 0.00 54.58 51.93 3d4l n ASN 506 Cb 0.14 -0.49 -0.15 0.00 -0.61 0.00 0.00 39.78 38.67 3d4l n ASN 506 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d4l s VAL 507 N -1.79 1.48 -1.12 2.41 1.01 -0.56 -3.74 120.40 118.09 3d4l s VAL 507 Ca 0.36 -0.92 -0.19 0.00 0.00 0.00 0.00 61.98 61.23 3d4l s VAL 507 Cb 0.24 -1.26 0.10 0.00 0.00 0.00 0.00 36.38 35.45 3d4l s VAL 507 CO 0.17 0.32 1.46 -1.10 0.00 0.00 0.00 175.10 175.95 3d4l s GLN 508 N -0.70 3.80 0.42 2.72 -0.21 0.31 -4.99 119.66 121.01 3d4l s GLN 508 Ca 0.07 -1.79 -0.19 0.00 0.02 0.00 0.00 55.36 53.47 3d4l s GLN 508 Cb -0.08 -5.26 -0.10 0.00 1.00 0.00 0.00 33.01 28.57 3d4l s GLN 508 CO 0.00 -2.05 0.90 -1.64 -2.12 0.00 0.00 175.29 170.39 3d4l s MET 509 N 3.62 4.12 0.77 2.91 -1.94 -1.26 -4.39 119.30 123.13 3d4l s MET 509 Ca 0.45 0.97 -0.12 0.00 -1.71 0.00 0.00 55.69 55.28 3d4l s MET 509 Cb -0.00 -2.24 0.05 0.00 2.01 0.00 0.00 34.83 34.65 3d4l s MET 509 CO -0.03 -0.02 1.12 -1.25 -0.01 0.00 0.00 175.02 174.83 3d4l s PRO 510 N -3.29 2.33 0.38 2.03 0.04 -1.26 -4.33 135.00 130.89 3d4l s PRO 510 Ca 0.59 0.39 0.08 0.00 0.04 0.00 0.00 61.00 62.10 3d4l s PRO 510 Cb -0.09 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.43 3d4l s PRO 510 CO 0.17 -1.39 0.12 -1.54 0.04 0.00 0.00 177.00 174.40 3d4l s SER 511 N -4.30 4.38 -0.06 6.66 1.04 -0.53 -4.92 113.70 115.96 3d4l s SER 511 Ca 0.60 -1.01 0.04 0.00 0.48 0.00 0.00 55.95 56.06 3d4l s SER 511 Cb -0.12 -0.54 0.00 0.00 0.10 0.00 0.00 66.02 65.47 3d4l s SER 511 CO 0.52 -0.41 -0.17 -0.75 0.98 0.00 0.00 173.24 173.41 3d4l s LYS 512 N -3.83 2.03 -0.15 4.02 2.20 -1.26 0.08 119.74 122.82 3d4l s LYS 512 Ca 0.38 -0.60 -0.00 0.00 -0.36 0.00 0.00 55.97 55.39 3d4l s LYS 512 Cb 0.02 -1.67 -0.01 0.00 -1.51 0.00 0.00 37.83 34.67 3d4l s LYS 512 CO 0.21 0.16 -0.14 0.21 -0.36 0.00 0.00 175.35 175.44 3d4l s LYS 513 N 0.31 3.28 -0.17 4.03 2.20 -0.19 -4.96 119.74 124.24 3d4l s LYS 513 Ca -0.11 -0.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.78 3d4l s LYS 513 Cb -0.14 -2.65 0.00 0.00 -1.51 0.00 0.00 37.83 33.53 3d4l s LYS 513 CO 0.04 0.07 -0.15 -1.17 -0.36 0.00 0.00 175.35 173.77 3d4l s LEU 514 N 0.71 2.43 0.00 5.43 2.96 -1.26 -0.59 118.68 128.35 3d4l s LEU 514 Ca -0.07 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.32 3d4l s LEU 514 Cb -0.15 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 44.99 3d4l s LEU 514 CO 0.02 0.06 0.14 -0.67 -1.32 0.00 0.00 176.35 174.58 3d4l n ASP 515 N 4.25 -0.42 -4.15 3.68 -0.08 -0.34 -5.01 116.55 114.48 3d4l n ASP 515 Ca -0.19 -1.33 -0.10 0.00 -1.51 0.00 0.00 54.79 51.66 3d4l n ASP 515 Cb 0.51 0.71 -0.10 0.00 2.34 0.00 0.00 41.12 44.58 3d4l n ASP 515 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 3d4l s PHE 516 N -6.95 0.81 0.19 -0.67 -0.71 -1.26 -0.21 117.98 109.18 3d4l s PHE 516 Ca 0.04 -1.02 0.08 0.00 -1.04 0.00 0.00 56.93 54.99 3d4l s PHE 516 Cb -0.01 -0.50 -0.04 0.00 -1.21 0.00 0.00 43.02 41.26 3d4l s PHE 516 CO 0.03 -0.28 -0.17 0.96 -1.34 0.00 0.00 175.22 174.42 3d4l s ILE 517 N -3.78 1.84 -0.15 -4.49 -4.36 -0.05 -4.93 121.20 105.27 3d4l s ILE 517 Ca 0.14 -2.09 -0.04 0.00 -0.26 0.00 0.00 60.65 58.40 3d4l s ILE 517 Cb 0.07 -1.97 -0.03 0.00 1.25 0.00 0.00 42.46 41.78 3d4l s ILE 517 CO -0.04 -0.44 -0.01 -0.63 0.24 0.00 0.00 174.94 174.05 3d4l s ILE 518 N -2.48 4.17 -0.17 8.37 1.01 -1.26 -0.71 121.20 130.13 3d4l s ILE 518 Ca 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 60.65 60.57 3d4l s ILE 518 Cb -0.04 -2.83 0.05 0.00 0.01 0.00 0.00 42.46 39.66 3d4l s ILE 518 CO 0.07 0.51 -0.01 -0.76 0.00 0.00 0.00 174.94 174.75 3d4l s LEU 519 N 0.15 1.31 -1.16 2.97 1.43 0.15 -4.86 118.68 118.67 3d4l s LEU 519 Ca 0.00 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.36 3d4l s LEU 519 Cb -0.13 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.35 3d4l s LEU 519 CO 0.02 -0.24 0.82 0.59 0.23 0.00 0.00 176.35 177.77 3d4l n ASN 520 N 4.98 -4.38 0.00 2.29 4.13 -1.26 -1.56 115.26 119.46 3d4l n ASN 520 Ca -0.10 -0.84 0.00 0.00 1.68 0.00 0.00 54.58 55.33 3d4l n ASN 520 Cb 0.48 -4.29 0.00 0.00 -1.54 0.00 0.00 39.78 34.43 3d4l n ASN 520 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3d4l n GLU 521 N -3.89 -1.64 -5.23 3.52 4.71 -1.26 -4.96 120.64 111.89 3d4l n GLU 521 Ca -0.16 0.41 -0.31 0.00 -0.01 0.00 0.00 57.16 57.09 3d4l n GLU 521 Cb 0.63 -4.68 -0.16 0.00 -1.01 0.00 0.00 31.44 26.21 3d4l n GLU 521 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 3d4l s THR 522 N -1.16 2.00 0.13 2.62 2.01 -0.60 -5.12 115.64 115.52 3d4l s THR 522 Ca 0.00 -1.04 -0.19 0.00 0.31 0.00 0.00 61.69 60.77 3d4l s THR 522 Cb 0.00 -1.70 -0.07 0.00 0.01 0.00 0.00 72.50 70.74 3d4l s THR 522 CO 0.00 0.56 0.63 -1.59 -0.69 0.00 0.00 174.62 173.52 3d4l s LYS 523 N -0.13 4.22 -0.04 4.92 -2.85 -1.26 0.32 119.74 124.92 3d4l s LYS 523 Ca -0.04 0.78 0.02 0.00 -1.00 0.00 0.00 55.97 55.72 3d4l s LYS 523 Cb -0.14 -3.11 0.02 0.00 -2.06 0.00 0.00 37.83 32.54 3d4l s LYS 523 CO 0.04 0.55 -0.07 -0.06 0.10 0.00 0.00 175.35 175.90 3d4l s PHE 524 N -1.27 0.95 0.28 1.78 0.40 0.11 -4.95 117.98 115.29 3d4l s PHE 524 Ca 0.34 -0.29 -0.10 0.00 -0.60 0.00 0.00 56.93 56.29 3d4l s PHE 524 Cb -0.19 -0.75 -0.07 0.00 0.51 0.00 0.00 43.02 42.52 3d4l s PHE 524 CO 0.20 -0.18 0.61 -1.58 0.70 0.00 0.00 175.22 174.97 3d4l s TRP 525 N 0.65 3.43 0.10 0.36 0.52 -1.26 -0.87 118.94 121.87 3d4l s TRP 525 Ca -0.10 0.92 -0.06 0.00 0.02 0.00 0.00 56.10 56.89 3d4l s TRP 525 Cb -0.13 -2.31 -0.02 0.00 -1.15 0.00 0.00 33.47 29.86 3d4l s TRP 525 CO 0.01 0.17 0.13 1.52 0.02 0.00 0.00 176.95 178.80 3d4l s TYR 526 N -1.96 0.39 0.09 -1.98 -0.85 0.71 -0.93 117.35 112.81 3d4l s TYR 526 Ca 0.49 -0.83 0.04 0.00 -0.52 0.00 0.00 57.07 56.24 3d4l s TYR 526 Cb -0.11 -0.21 -0.03 0.00 0.38 0.00 0.00 41.96 41.99 3d4l s TYR 526 CO 0.23 -0.53 -0.11 1.14 -1.52 0.00 0.00 175.55 174.77 3d4l s GLN 527 N -3.92 0.80 -0.05 -3.49 -2.07 -0.33 -1.20 119.66 109.41 3d4l s GLN 527 Ca 0.10 -1.07 0.01 0.00 -1.82 0.00 0.00 55.36 52.58 3d4l s GLN 527 Cb 0.06 -0.56 0.02 0.00 -1.09 0.00 0.00 33.01 31.44 3d4l s GLN 527 CO -0.07 0.10 -0.06 -1.64 -1.32 0.00 0.00 175.29 172.30 3d4l s MET 528 N -2.44 0.95 -0.38 9.60 -1.94 0.24 -1.44 119.30 123.89 3d4l s MET 528 Ca 0.02 -0.15 -0.19 0.00 -1.71 0.00 0.00 55.69 53.66 3d4l s MET 528 Cb -0.05 -0.92 0.01 0.00 2.01 0.00 0.00 34.83 35.88 3d4l s MET 528 CO 0.01 -0.06 0.57 0.42 -0.01 0.00 0.00 175.02 175.94 3d4l s ILE 529 N 0.86 4.94 -0.13 2.53 -1.09 0.60 -1.03 121.20 127.89 3d4l s ILE 529 Ca -0.12 0.26 -0.07 0.00 -2.23 0.00 0.00 60.65 58.49 3d4l s ILE 529 Cb -0.15 -4.06 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 3d4l s ILE 529 CO 0.01 -0.36 0.13 -0.76 -1.23 0.00 0.00 174.94 172.73 3d4l s LEU 530 N 2.55 4.34 0.87 2.97 1.43 0.11 -2.05 118.68 128.90 3d4l s LEU 530 Ca 0.20 0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 53.61 3d4l s LEU 530 Cb -0.15 -2.06 0.09 0.00 0.03 0.00 0.00 46.19 44.10 3d4l s LEU 530 CO 0.15 0.38 1.01 -2.65 0.23 0.00 0.00 176.35 175.48 3d4l n PRO 531 N 2.17 -0.12 -1.82 1.29 -0.02 -1.26 -1.46 135.00 133.77 3d4l n PRO 531 Ca -0.19 0.03 -0.40 0.00 -2.02 0.00 0.00 63.50 60.92 3d4l n PRO 531 Cb 0.55 -2.29 0.01 0.00 -0.02 0.00 0.00 33.50 31.75 3d4l n PRO 531 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3d4l s PRO 532 N -4.14 3.73 -1.45 0.52 0.02 -1.26 -2.50 135.00 129.91 3d4l s PRO 532 Ca 0.68 2.40 -0.06 0.00 0.02 0.00 0.00 61.00 64.04 3d4l s PRO 532 Cb -0.26 -2.68 0.01 0.00 0.02 0.00 0.00 34.50 31.59 3d4l s PRO 532 CO 0.56 -0.78 0.78 0.72 -0.33 0.00 0.00 177.00 177.96 3d4l n HIS 533 N -0.14 -2.22 -1.65 6.54 8.25 -1.26 -4.87 115.22 119.88 3d4l n HIS 533 Ca 0.05 0.67 -0.54 0.00 -0.26 0.00 0.00 57.72 57.64 3d4l n HIS 533 Cb 0.42 -4.59 -0.06 0.00 1.12 0.00 0.00 29.99 26.88 3d4l n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3d4l n PHE 534 N -4.64 1.78 -3.86 4.41 7.35 -1.04 -4.94 117.46 116.52 3d4l n PHE 534 Ca -0.07 0.57 -0.35 0.00 -0.76 0.00 0.00 57.45 56.84 3d4l n PHE 534 Cb 0.60 -2.40 -0.13 0.00 0.35 0.00 0.00 39.48 37.90 3d4l n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3d4l s ASP 535 N 1.89 5.07 0.00 -2.13 3.68 -1.26 -4.96 116.67 118.95 3d4l s ASP 535 Ca 0.90 -1.87 0.00 0.00 2.13 0.00 0.00 52.55 53.72 3d4l s ASP 535 Cb -0.99 -1.76 0.00 0.00 -1.45 0.00 0.00 42.92 38.72 3d4l s ASP 535 CO 0.55 -0.44 0.87 2.29 0.13 0.00 0.00 175.17 178.56 3d4l n LYS 536 N 4.53 0.00 0.00 4.34 2.85 -1.26 -0.51 118.16 128.11 3d4l n LYS 536 Ca -0.04 0.37 0.13 0.00 -1.05 0.00 0.00 58.31 57.73 3d4l n LYS 536 Cb 0.42 -1.58 0.29 0.00 -0.65 0.00 0.00 35.03 33.51 3d4l n LYS 536 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3d4l n SER 537 N -1.37 2.20 -4.70 -5.58 3.41 -1.26 -4.21 113.62 102.11 3d4l n SER 537 Ca 0.00 -1.70 -0.23 0.00 -0.26 0.00 0.00 58.87 56.68 3d4l n SER 537 Cb 0.08 0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 64.00 3d4l n SER 537 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3d4l s LYS 538 N -2.06 2.36 -0.25 4.33 1.02 0.33 -5.02 119.74 120.46 3d4l s LYS 538 Ca 0.31 -1.47 -0.09 0.00 0.02 0.00 0.00 55.97 54.74 3d4l s LYS 538 Cb 0.20 -2.18 -0.04 0.00 -0.52 0.00 0.00 37.83 35.29 3d4l s LYS 538 CO 0.34 0.23 0.14 0.15 -0.92 0.00 0.00 175.35 175.29 3d4l s LYS 539 N -3.77 3.90 0.05 1.68 -0.14 -1.26 -4.15 119.74 116.05 3d4l s LYS 539 Ca 0.35 -0.35 0.05 0.00 -1.36 0.00 0.00 55.97 54.65 3d4l s LYS 539 Cb -0.04 -3.49 -0.04 0.00 -1.68 0.00 0.00 37.83 32.58 3d4l s LYS 539 CO 0.22 -0.07 -0.08 0.71 -0.76 0.00 0.00 175.35 175.37 3d4l s TYR 540 N 1.38 2.83 0.73 3.18 2.02 0.23 -4.66 117.35 123.07 3d4l s TYR 540 Ca 0.06 -0.09 -0.11 0.00 -0.37 0.00 0.00 57.07 56.56 3d4l s TYR 540 Cb -0.15 -1.54 0.03 0.00 -0.40 0.00 0.00 41.96 39.91 3d4l s TYR 540 CO 0.06 0.39 1.08 -1.25 -1.57 0.00 0.00 175.55 174.27 3d4l s PRO 541 N -1.77 2.58 -0.03 -1.71 0.04 -1.26 -0.67 135.00 132.18 3d4l s PRO 541 Ca 0.19 1.12 0.02 0.00 0.04 0.00 0.00 61.00 62.38 3d4l s PRO 541 Cb -0.11 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.50 3d4l s PRO 541 CO 0.11 -1.39 -0.09 -1.17 0.04 0.00 0.00 177.00 174.50 3d4l s LEU 542 N -5.63 1.70 -0.22 -3.56 0.20 -0.29 -2.14 118.68 108.74 3d4l s LEU 542 Ca 0.61 -0.19 -0.03 0.00 0.69 0.00 0.00 54.13 55.20 3d4l s LEU 542 Cb -0.16 -0.57 -0.00 0.00 -0.43 0.00 0.00 46.19 45.02 3d4l s LEU 542 CO 0.53 0.04 -0.06 -0.22 -0.29 0.00 0.00 176.35 176.36 3d4l s LEU 543 N 0.36 2.87 -0.31 -0.68 2.96 0.23 -0.32 118.68 123.78 3d4l s LEU 543 Ca -0.06 -0.48 -0.23 0.00 -0.22 0.00 0.00 54.13 53.14 3d4l s LEU 543 Cb -0.10 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 44.88 3d4l s LEU 543 CO 0.01 -0.03 0.79 -0.22 -1.32 0.00 0.00 176.35 175.57 3d4l s LEU 544 N 1.45 4.09 -0.36 -0.68 2.96 0.62 -0.89 118.68 125.87 3d4l s LEU 544 Ca 0.05 0.62 -0.18 0.00 -0.22 0.00 0.00 54.13 54.40 3d4l s LEU 544 Cb -0.14 -3.07 0.00 0.00 0.50 0.00 0.00 46.19 43.47 3d4l s LEU 544 CO -0.04 -0.63 0.49 -0.62 -1.32 0.00 0.00 176.35 174.22 3d4l s ASP 545 N 1.65 6.28 0.08 3.68 -1.08 0.22 -0.85 116.67 126.66 3d4l s ASP 545 Ca 0.32 -0.16 0.08 0.00 -0.52 0.00 0.00 52.55 52.27 3d4l s ASP 545 Cb -0.14 -2.26 -0.03 0.00 -1.46 0.00 0.00 42.92 39.03 3d4l s ASP 545 CO 0.13 -0.49 -0.21 0.54 0.52 0.00 0.00 175.17 175.66 3d4l s VAL 546 N 2.34 1.70 0.00 1.11 0.11 -0.14 -4.35 120.40 121.17 3d4l s VAL 546 Ca 0.17 -1.42 0.00 0.00 -2.93 0.00 0.00 61.98 57.80 3d4l s VAL 546 Cb -0.16 -1.52 0.00 0.00 -1.53 0.00 0.00 36.38 33.17 3d4l s VAL 546 CO 0.13 0.03 0.00 0.00 -3.33 0.00 0.00 175.10 171.94 3d4l n TYR 547 N 1.35 0.00 -1.57 1.54 4.19 -1.26 -4.18 117.16 117.23 3d4l n TYR 547 Ca -0.19 0.00 -0.15 0.00 3.31 0.00 0.00 57.90 60.87 3d4l n TYR 547 Cb 0.53 0.13 -0.06 0.00 0.49 0.00 0.00 39.34 40.43 3d4l n TYR 547 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3d4l n ALA 548 N -2.01 -0.27 -1.33 2.98 0.00 -1.26 -3.27 120.51 115.36 3d4l n ALA 548 Ca 0.00 0.23 -0.29 0.00 0.00 0.00 0.00 53.44 53.39 3d4l n ALA 548 Cb 0.00 -1.67 0.16 0.00 0.00 0.00 0.00 19.45 17.94 3d4l n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d4l s GLY 549 N -2.76 1.57 0.23 0.00 0.00 -1.26 -4.85 107.32 100.24 3d4l s GLY 549 Ca 0.00 -0.46 -0.31 0.00 0.00 0.00 0.00 44.72 43.95 3d4l s GLY 549 CO 0.00 0.14 1.68 2.56 0.00 0.00 0.00 173.10 177.49 3d4l s PRO 550 N -5.11 4.12 -1.25 2.90 0.04 -1.26 -1.67 135.00 132.77 3d4l s PRO 550 Ca 0.65 2.60 0.00 0.00 0.04 0.00 0.00 61.00 64.29 3d4l s PRO 550 Cb -0.17 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.31 3d4l s PRO 550 CO 0.56 -0.72 0.00 0.00 0.04 0.00 0.00 177.00 176.88 3d4l s SER 552 N -2.77 5.51 -0.20 0.00 1.04 -0.67 -3.80 113.70 112.80 3d4l s SER 552 Ca 0.00 0.73 -0.04 0.00 0.48 0.00 0.00 55.95 57.11 3d4l s SER 552 Cb 0.00 -1.67 0.10 0.00 0.10 0.00 0.00 66.02 64.55 3d4l s SER 552 CO 0.00 -1.13 0.34 -1.58 0.98 0.00 0.00 173.24 171.84 3d4l s GLN 553 N -5.04 0.28 0.00 4.02 0.74 -1.26 -0.53 119.66 117.86 3d4l s GLN 553 Ca 0.55 0.64 0.09 0.00 0.05 0.00 0.00 55.36 56.68 3d4l s GLN 553 Cb -0.11 -0.33 0.00 0.00 1.10 0.00 0.00 33.01 33.68 3d4l s GLN 553 CO 0.46 -0.49 0.60 1.63 -0.55 0.00 0.00 175.29 176.94 3d4l n LYS 554 N 5.36 1.98 -3.85 1.67 4.76 -1.26 -4.87 118.16 121.95 3d4l n LYS 554 Ca -0.05 -0.60 -0.36 0.00 -2.87 0.00 0.00 58.31 54.42 3d4l n LYS 554 Cb 0.50 -1.05 -0.13 0.00 -1.84 0.00 0.00 35.03 32.51 3d4l n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3d4l s ALA 555 N -1.19 2.93 0.28 7.82 0.00 -1.26 -4.79 121.76 125.56 3d4l s ALA 555 Ca 0.07 -1.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.09 3d4l s ALA 555 Cb 0.07 -2.11 0.01 0.00 0.00 0.00 0.00 23.12 21.09 3d4l s ALA 555 CO 0.21 -1.40 0.40 -0.40 0.00 0.00 0.00 175.76 174.57 3d4l n ASP 556 N 4.65 -1.12 -1.73 0.00 5.68 -1.26 -4.44 116.55 118.33 3d4l n ASP 556 Ca -0.11 -2.50 0.08 0.00 -0.50 0.00 0.00 54.79 51.76 3d4l n ASP 556 Cb 0.43 2.07 0.38 0.00 -1.14 0.00 0.00 41.12 42.86 3d4l n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3d4l n THR 557 N -0.46 2.27 -2.57 2.12 -2.24 -1.01 -4.96 114.28 107.43 3d4l n THR 557 Ca 0.00 -1.27 -0.41 0.00 -2.27 0.00 0.00 64.05 60.11 3d4l n THR 557 Cb 0.47 -0.10 -0.04 0.00 -2.10 0.00 0.00 70.33 68.56 3d4l n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3d4l s VAL 558 N -2.31 3.98 -0.08 2.28 1.01 -1.26 -1.42 120.40 122.59 3d4l s VAL 558 Ca 0.52 1.73 -0.25 0.00 0.00 0.00 0.00 61.98 63.98 3d4l s VAL 558 Cb 0.37 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 3d4l s VAL 558 CO 0.20 0.31 0.80 0.12 0.00 0.00 0.00 175.10 176.53 3d4l s PHE 559 N -0.34 3.55 0.03 5.22 5.36 -0.23 -4.92 117.98 126.65 3d4l s PHE 559 Ca 0.48 1.35 0.02 0.00 -0.96 0.00 0.00 56.93 57.82 3d4l s PHE 559 Cb -0.28 -2.94 -0.02 0.00 -0.34 0.00 0.00 43.02 39.44 3d4l s PHE 559 CO 0.34 -0.03 -0.07 1.03 -1.46 0.00 0.00 175.22 175.03 3d4l s ARG 560 N 1.25 0.48 -0.32 10.12 0.52 -1.26 -4.91 118.95 124.82 3d4l s ARG 560 Ca 0.41 -0.63 0.03 0.00 -0.52 0.00 0.00 55.73 55.01 3d4l s ARG 560 Cb -0.18 -0.27 0.09 0.00 0.52 0.00 0.00 34.95 35.10 3d4l s ARG 560 CO 0.19 0.05 0.02 -0.51 0.02 0.00 0.00 175.30 175.07 3d4l s LEU 561 N -1.29 4.42 0.00 2.53 1.43 -1.26 -4.88 118.68 119.63 3d4l s LEU 561 Ca -0.08 -1.90 0.00 0.00 -1.03 0.00 0.00 54.13 51.12 3d4l s LEU 561 Cb -0.08 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.50 3d4l s LEU 561 CO 0.00 -0.34 0.00 -0.46 0.23 0.00 0.00 176.35 175.78 3d4l n ASN 562 N 4.35 0.00 -0.33 2.29 0.23 -1.26 -4.99 115.26 115.54 3d4l n ASN 562 Ca -0.02 -0.47 0.02 0.00 -0.53 0.00 0.00 54.58 53.58 3d4l n ASN 562 Cb 0.42 0.00 0.17 0.00 -2.08 0.00 0.00 39.78 38.29 3d4l n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 3d4l h TRP 563 N 0.47 1.06 -0.41 -2.53 7.01 -1.97 -1.10 115.95 118.47 3d4l h TRP 563 Ca 0.00 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 3d4l h TRP 563 Cb 0.00 -0.34 -0.02 0.00 -2.10 0.00 0.00 29.16 26.70 3d4l h TRP 563 CO 0.00 0.52 0.20 0.00 -2.79 0.00 0.00 178.44 176.36 3d4l h ALA 564 N 1.44 1.57 -0.47 2.65 0.00 -1.98 -0.80 119.26 121.67 3d4l h ALA 564 Ca 0.41 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.24 3d4l h ALA 564 Cb 0.23 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3d4l h ALA 564 CO -0.19 0.35 0.31 1.15 0.00 0.00 0.00 179.25 180.86 3d4l h THR 565 N 0.58 1.10 -0.34 0.00 2.02 -1.54 -0.72 112.91 114.00 3d4l h THR 565 Ca 0.15 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 3d4l h THR 565 Cb 0.07 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 3d4l h THR 565 CO -0.02 0.11 0.02 0.22 0.37 0.00 0.00 175.52 176.23 3d4l h TYR 566 N 0.62 0.63 -0.97 3.16 3.20 -1.19 0.11 116.97 122.53 3d4l h TYR 566 Ca 0.18 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 61.97 3d4l h TYR 566 Cb -0.05 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.00 3d4l h TYR 566 CO -0.05 0.68 0.64 -0.07 -1.64 0.00 0.00 178.16 177.72 3d4l h LEU 567 N 0.40 1.09 0.02 2.82 3.38 -0.81 0.83 115.31 123.04 3d4l h LEU 567 Ca 0.10 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3d4l h LEU 567 Cb 0.41 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3d4l h LEU 567 CO 0.01 0.77 -0.24 0.00 0.09 0.00 0.00 178.44 179.08 3d4l h ALA 568 N 1.37 0.00 -0.10 1.53 0.00 -1.06 -1.71 119.26 119.30 3d4l h ALA 568 Ca 0.37 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3d4l h ALA 568 Cb -0.10 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3d4l h ALA 568 CO -0.09 0.08 0.02 1.03 0.00 0.00 0.00 179.25 180.29 3d4l h SER 569 N -0.64 0.15 0.07 0.00 0.87 -0.65 -2.72 113.55 110.63 3d4l h SER 569 Ca -0.03 -0.24 -0.37 0.00 -1.23 0.00 0.00 61.79 59.92 3d4l h SER 569 Cb 1.07 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.95 3d4l h SER 569 CO 0.05 0.35 -2.10 0.41 -0.53 0.00 0.00 176.83 175.01 3d4l n THR 570 N -4.87 1.66 1.25 2.23 -1.04 0.27 -4.49 114.28 109.30 3d4l n THR 570 Ca -0.06 -0.55 0.13 0.00 -2.04 0.00 0.00 64.05 61.53 3d4l n THR 570 Cb 0.16 -1.68 0.32 0.00 -1.82 0.00 0.00 70.33 67.30 3d4l n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3d4l n GLU 571 N -3.56 1.61 -3.67 -2.82 -0.58 -0.90 -4.96 120.64 105.76 3d4l n GLU 571 Ca -0.37 -1.13 -0.25 0.00 -0.42 0.00 0.00 57.16 55.00 3d4l n GLU 571 Cb 0.99 -1.48 0.06 0.00 -0.57 0.00 0.00 31.44 30.44 3d4l n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3d4l n ASN 572 N 0.29 -4.97 -4.62 1.62 5.03 -0.84 -4.94 115.26 106.82 3d4l n ASN 572 Ca 0.15 -0.64 -0.34 0.00 0.87 0.00 0.00 54.58 54.62 3d4l n ASN 572 Cb 0.43 -4.65 -0.10 0.00 -1.02 0.00 0.00 39.78 34.44 3d4l n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3d4l s ILE 573 N -3.35 4.12 -0.12 2.41 1.01 -0.70 -4.48 121.20 120.09 3d4l s ILE 573 Ca 0.49 -0.31 -0.24 0.00 0.00 0.00 0.00 60.65 60.59 3d4l s ILE 573 Cb -0.23 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.47 3d4l s ILE 573 CO 0.76 0.57 0.75 -0.63 0.00 0.00 0.00 174.94 176.40 3d4l s ILE 574 N -0.55 4.97 -0.29 2.92 1.01 -0.91 -3.47 121.20 124.88 3d4l s ILE 574 Ca 0.09 1.50 -0.06 0.00 0.00 0.00 0.00 60.65 62.18 3d4l s ILE 574 Cb -0.12 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.29 3d4l s ILE 574 CO 0.02 0.14 0.06 -0.69 0.00 0.00 0.00 174.94 174.47 3d4l s VAL 575 N 1.47 3.76 0.18 2.92 1.01 -0.87 -0.60 120.40 128.26 3d4l s VAL 575 Ca 0.37 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.63 3d4l s VAL 575 Cb -0.17 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 3d4l s VAL 575 CO 0.15 0.07 0.01 0.00 0.00 0.00 0.00 175.10 175.34 3d4l s ALA 576 N 1.46 3.24 -0.01 5.51 0.00 -0.07 -0.29 121.76 131.60 3d4l s ALA 576 Ca 0.02 -1.38 -0.03 0.00 0.00 0.00 0.00 51.96 50.57 3d4l s ALA 576 Cb -0.17 -1.01 -0.00 0.00 0.00 0.00 0.00 23.12 21.93 3d4l s ALA 576 CO 0.01 0.46 0.06 -1.12 0.00 0.00 0.00 175.76 175.18 3d4l s SER 577 N -3.03 0.03 -0.01 0.00 0.01 -0.52 0.72 113.70 110.90 3d4l s SER 577 Ca 0.28 -0.10 0.02 0.00 1.31 0.00 0.00 55.95 57.45 3d4l s SER 577 Cb -0.09 0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.29 3d4l s SER 577 CO 0.19 -0.18 -0.05 0.12 0.41 0.00 0.00 173.24 173.73 3d4l s PHE 578 N -0.70 0.48 -0.47 2.43 5.36 -1.26 -1.19 117.98 122.63 3d4l s PHE 578 Ca -0.08 -0.09 -0.09 0.00 -0.96 0.00 0.00 56.93 55.71 3d4l s PHE 578 Cb -0.05 -0.32 0.12 0.00 -0.34 0.00 0.00 43.02 42.43 3d4l s PHE 578 CO 0.00 -0.02 0.34 -0.51 -1.46 0.00 0.00 175.22 173.58 3d4l s ASP 579 N -0.04 5.72 0.00 6.13 1.01 -0.11 -4.81 116.67 124.57 3d4l s ASP 579 Ca 0.01 -1.87 0.00 0.00 0.71 0.00 0.00 52.55 51.40 3d4l s ASP 579 Cb -0.03 -2.02 0.00 0.00 1.01 0.00 0.00 42.92 41.88 3d4l s ASP 579 CO -0.00 -0.69 0.00 0.61 0.21 0.00 0.00 175.17 175.30 3d4l n GLY 580 N 4.92 2.12 3.77 0.21 0.00 -1.26 -4.03 105.19 110.92 3d4l n GLY 580 Ca -0.08 -1.93 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 3d4l n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d4l s ARG 581 N 3.66 3.87 0.00 1.61 0.52 -1.26 -1.56 118.95 125.79 3d4l s ARG 581 Ca 0.00 2.37 0.00 0.00 -0.52 0.00 0.00 55.73 57.58 3d4l s ARG 581 Cb 0.00 -2.76 0.00 0.00 0.52 0.00 0.00 34.95 32.71 3d4l s ARG 581 CO 0.00 -0.65 0.00 0.41 0.02 0.00 0.00 175.30 175.08 3d4l n GLY 582 N 0.59 3.04 3.77 -3.53 0.00 0.47 -4.15 105.19 105.38 3d4l n GLY 582 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 3d4l n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d4l s SER 583 N -1.18 4.43 0.55 1.61 1.04 -0.60 -0.25 113.70 119.30 3d4l s SER 583 Ca 0.00 1.72 0.05 0.00 0.48 0.00 0.00 55.95 58.20 3d4l s SER 583 Cb 0.00 -2.44 0.09 0.00 0.10 0.00 0.00 66.02 63.78 3d4l s SER 583 CO 0.00 -2.06 0.72 0.61 0.98 0.00 0.00 173.24 173.48 3d4l n GLY 584 N -1.33 1.52 2.61 7.32 0.00 0.31 -3.69 105.19 111.92 3d4l n GLY 584 Ca 0.08 -2.15 -0.18 0.00 0.00 0.00 0.00 46.02 43.78 3d4l n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d4l n TYR 585 N -2.23 0.00 -1.33 1.61 4.01 -1.26 -4.81 117.16 113.14 3d4l n TYR 585 Ca 0.14 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.91 3d4l n TYR 585 Cb 0.49 -3.21 0.04 0.00 -0.31 0.00 0.00 39.34 36.35 3d4l n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3d4l n GLN 586 N -2.16 0.74 0.00 -0.72 6.02 -1.26 -4.42 117.38 115.58 3d4l n GLN 586 Ca -0.18 -1.49 0.00 0.00 -0.01 0.00 0.00 57.00 55.32 3d4l n GLN 586 Cb 0.64 -0.88 0.00 0.00 1.02 0.00 0.00 30.24 31.02 3d4l n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d4l n GLY 587 N -0.52 2.23 0.22 1.08 0.00 -1.26 -4.64 105.19 102.30 3d4l n GLY 587 Ca 0.05 -1.85 0.07 0.00 0.00 0.00 0.00 46.02 44.30 3d4l n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3d4l h ASP 588 N 0.00 0.00 -0.74 1.61 3.32 -0.70 -1.41 116.42 118.50 3d4l h ASP 588 Ca 0.00 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.13 3d4l h ASP 588 Cb 0.00 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 3d4l h ASP 588 CO 0.00 0.25 0.40 0.50 -1.72 0.00 0.00 179.24 178.67 3d4l h LYS 589 N 0.00 0.68 0.03 3.56 1.63 -1.87 0.34 116.57 120.93 3d4l h LYS 589 Ca -0.00 -0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 59.69 3d4l h LYS 589 Cb 0.53 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 32.00 3d4l h LYS 589 CO 0.03 0.45 -0.32 0.82 -3.45 0.00 0.00 179.45 176.98 3d4l h ILE 590 N 0.70 1.63 -0.55 2.00 2.04 -1.77 -3.27 117.51 118.28 3d4l h ILE 590 Ca 0.35 -2.36 -0.04 0.00 1.00 0.00 0.00 64.86 63.81 3d4l h ILE 590 Cb 0.30 3.21 -0.02 0.00 -0.74 0.00 0.00 36.82 39.57 3d4l h ILE 590 CO -0.23 0.59 0.19 -0.03 0.00 0.00 0.00 178.15 178.67 3d4l h MET 591 N -0.88 0.84 -0.06 2.37 4.05 -1.09 0.14 114.93 120.31 3d4l h MET 591 Ca -0.07 -0.17 0.00 0.00 -0.28 0.00 0.00 59.70 59.18 3d4l h MET 591 Cb 1.16 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.83 3d4l h MET 591 CO -0.00 0.75 0.00 0.72 0.23 0.00 0.00 176.91 178.61 3d4l n HIS 592 N -4.47 0.07 0.25 1.39 8.25 0.12 -3.96 115.22 116.86 3d4l n HIS 592 Ca 0.03 -0.03 0.14 0.00 -0.26 0.00 0.00 57.72 57.59 3d4l n HIS 592 Cb 0.18 0.00 0.80 0.00 1.12 0.00 0.00 29.99 32.09 3d4l n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3d4l h ALA 593 N 3.81 1.80 -0.64 -1.41 0.00 -1.56 -1.58 119.26 119.68 3d4l h ALA 593 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d4l h ALA 593 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3d4l h ALA 593 CO 0.00 -0.11 0.00 0.44 0.00 0.00 0.00 179.25 179.58 3d4l n ILE 594 N -4.09 1.67 -1.70 0.00 -5.35 -1.25 -4.91 119.36 103.73 3d4l n ILE 594 Ca -0.01 -1.11 -0.44 0.00 -0.27 0.00 0.00 62.75 60.92 3d4l n ILE 594 Cb 0.17 0.15 -0.03 0.00 -1.74 0.00 0.00 39.64 38.19 3d4l n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3d4l n ASN 595 N 1.16 3.48 -0.03 7.28 4.05 -0.60 -0.65 115.26 129.95 3d4l n ASN 595 Ca 0.25 1.10 -0.00 0.00 0.45 0.00 0.00 54.58 56.38 3d4l n ASN 595 Cb 0.84 -1.51 -0.00 0.00 1.23 0.00 0.00 39.78 40.33 3d4l n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3d4l n ARG 596 N 2.98 -1.97 -2.67 1.20 1.74 0.23 -4.83 116.66 113.36 3d4l n ARG 596 Ca 0.13 0.51 -0.09 0.00 -0.77 0.00 0.00 57.85 57.64 3d4l n ARG 596 Cb 0.33 -4.99 0.03 0.00 -1.02 0.00 0.00 32.46 26.81 3d4l n ARG 596 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3d4l n ARG 597 N 0.89 1.64 -1.75 5.56 3.00 0.17 -4.90 116.66 121.27 3d4l n ARG 597 Ca -0.00 -3.48 -0.36 0.00 -0.01 0.00 0.00 57.85 53.99 3d4l n ARG 597 Cb 0.50 -1.49 0.07 0.00 0.00 0.00 0.00 32.46 31.53 3d4l n ARG 597 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3d4l s LEU 598 N -3.39 3.55 -0.09 0.55 1.43 -1.22 -2.99 118.68 116.52 3d4l s LEU 598 Ca 0.30 2.53 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 3d4l s LEU 598 Cb 0.41 -4.61 0.00 0.00 0.03 0.00 0.00 46.19 42.02 3d4l s LEU 598 CO -0.00 -1.96 0.00 0.61 0.23 0.00 0.00 176.35 175.22 3d4l n GLY 599 N 0.73 0.45 0.00 -3.19 0.00 -1.26 -4.85 105.19 97.07 3d4l n GLY 599 Ca 0.15 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.16 3d4l n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d4l n THR 600 N -2.97 0.00 -0.32 2.61 -2.24 -1.16 -4.77 114.28 105.42 3d4l n THR 600 Ca -0.01 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 3d4l n THR 600 Cb 0.03 0.00 0.21 0.00 -2.10 0.00 0.00 70.33 68.47 3d4l n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3d4l h PHE 601 N 0.00 1.11 -0.22 4.78 0.04 -1.92 -0.93 116.94 119.79 3d4l h PHE 601 Ca 0.00 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.72 3d4l h PHE 601 Cb 0.00 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 37.77 3d4l h PHE 601 CO 0.00 0.60 -0.22 1.05 -0.60 0.00 0.00 178.31 179.14 3d4l h GLU 602 N 1.10 0.41 -0.07 1.51 9.09 -1.90 0.52 114.58 125.23 3d4l h GLU 602 Ca 0.39 -0.14 -0.07 0.00 0.05 0.00 0.00 59.36 59.60 3d4l h GLU 602 Cb 0.14 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.21 3d4l h GLU 602 CO -0.14 0.61 -0.23 0.28 0.05 0.00 0.00 179.01 179.57 3d4l h VAL 603 N 0.37 1.42 -0.87 -1.06 2.07 -1.62 -3.11 116.25 113.45 3d4l h VAL 603 Ca 0.06 -1.60 0.02 0.00 0.82 0.00 0.00 66.70 66.00 3d4l h VAL 603 Cb 0.59 2.26 -0.05 0.00 -1.52 0.00 0.00 31.29 32.58 3d4l h VAL 603 CO 0.04 0.45 0.57 -0.33 0.02 0.00 0.00 177.57 178.32 3d4l h GLU 604 N -0.20 1.09 -0.17 1.57 5.08 -1.03 -2.63 114.58 118.28 3d4l h GLU 604 Ca -0.01 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 3d4l h GLU 604 Cb 0.85 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3d4l h GLU 604 CO 0.05 0.72 -0.15 -0.44 -1.00 0.00 0.00 179.01 178.19 3d4l h ASP 605 N 1.12 0.26 -0.42 1.42 3.32 -0.95 -0.49 116.42 120.68 3d4l h ASP 605 Ca 0.34 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.22 3d4l h ASP 605 Cb -0.05 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 3d4l h ASP 605 CO -0.10 0.44 -0.14 1.56 -1.72 0.00 0.00 179.24 179.28 3d4l h GLN 606 N 0.26 0.84 -0.43 3.56 1.08 -1.40 -0.82 115.11 118.20 3d4l h GLN 606 Ca 0.05 -0.34 -0.02 0.00 -1.45 0.00 0.00 58.65 56.89 3d4l h GLN 606 Cb 0.43 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 3d4l h GLN 606 CO 0.03 0.97 0.21 0.82 -0.95 0.00 0.00 178.83 179.91 3d4l h ILE 607 N 0.66 1.18 -0.94 2.54 2.04 -1.15 -1.45 117.51 120.39 3d4l h ILE 607 Ca 0.10 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.45 3d4l h ILE 607 Cb 0.69 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 3d4l h ILE 607 CO 0.05 0.20 0.61 -0.08 0.00 0.00 0.00 178.15 178.92 3d4l h GLU 608 N 0.56 1.25 -0.27 2.37 4.57 -0.94 0.11 114.58 122.24 3d4l h GLU 608 Ca 0.15 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 3d4l h GLU 608 Cb 0.12 -0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 28.42 3d4l h GLU 608 CO -0.02 0.84 0.08 0.00 -1.18 0.00 0.00 179.01 178.73 3d4l h ALA 609 N 1.38 0.35 -0.76 2.92 0.00 -0.82 -0.81 119.26 121.53 3d4l h ALA 609 Ca 0.34 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3d4l h ALA 609 Cb -0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3d4l h ALA 609 CO -0.07 -0.01 0.36 0.00 0.00 0.00 0.00 179.25 179.53 3d4l h ALA 610 N 0.90 0.98 -0.66 0.00 0.00 -0.79 0.27 119.26 119.97 3d4l h ALA 610 Ca 0.08 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3d4l h ALA 610 Cb 0.26 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 3d4l h ALA 610 CO -0.00 0.55 0.40 -0.09 0.00 0.00 0.00 179.25 180.11 3d4l h ARG 611 N 1.08 0.75 -0.20 0.00 2.43 -0.55 0.22 114.38 118.11 3d4l h ARG 611 Ca 0.26 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.34 3d4l h ARG 611 Cb 0.13 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 3d4l h ARG 611 CO -0.03 0.50 -0.05 1.96 -1.51 0.00 0.00 179.97 180.83 3d4l h GLN 612 N 0.77 0.38 -0.58 0.20 4.20 -0.39 -2.80 115.11 116.88 3d4l h GLN 612 Ca 0.28 -0.15 0.03 0.00 0.06 0.00 0.00 58.65 58.87 3d4l h GLN 612 Cb 0.07 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 3d4l h GLN 612 CO -0.13 0.64 0.38 0.74 -0.67 0.00 0.00 178.83 179.79 3d4l h PHE 613 N 0.10 0.67 0.00 2.96 0.04 -0.03 -0.97 116.94 119.70 3d4l h PHE 613 Ca 0.05 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 3d4l h PHE 613 Cb 0.50 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 38.42 3d4l h PHE 613 CO 0.05 0.40 -0.04 0.66 -0.60 0.00 0.00 178.31 178.78 3d4l h SER 614 N 0.70 0.00 1.33 2.17 4.64 -0.32 -1.97 113.55 120.09 3d4l h SER 614 Ca 0.23 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.46 3d4l h SER 614 Cb 0.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 3d4l h SER 614 CO -0.06 0.04 -0.40 0.11 -0.87 0.00 0.00 176.83 175.64 3d4l h LYS 615 N 0.00 0.00 -6.98 4.77 1.79 -0.95 -3.42 116.57 111.77 3d4l h LYS 615 Ca -0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 3d4l h LYS 615 Cb 0.42 0.00 0.10 0.00 -1.58 0.00 0.00 32.23 31.17 3d4l h LYS 615 CO 0.00 0.40 0.60 -1.64 -1.08 0.00 0.00 179.45 177.74 3d4l s MET 616 N -3.19 3.72 0.56 3.15 -1.94 -0.74 -4.91 119.30 115.94 3d4l s MET 616 Ca 0.03 2.15 0.25 0.00 -1.71 0.00 0.00 55.69 56.41 3d4l s MET 616 Cb 0.08 -2.58 1.62 0.00 2.01 0.00 0.00 34.83 35.97 3d4l s MET 616 CO 0.71 -0.70 2.20 0.78 -0.01 0.00 0.00 175.02 178.01 3d4l h GLY 617 N 2.26 0.00 -2.23 -0.03 0.00 -1.88 -2.71 103.07 98.48 3d4l h GLY 617 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3d4l h GLY 617 CO 0.61 0.00 0.00 1.97 0.00 0.00 0.00 176.54 179.12 3d4l n PHE 618 N -4.02 0.92 -4.54 5.60 1.16 -1.26 -4.55 117.46 110.77 3d4l n PHE 618 Ca -0.03 -0.41 -0.33 0.00 -1.87 0.00 0.00 57.45 54.81 3d4l n PHE 618 Cb 0.10 -0.09 -0.15 0.00 -1.61 0.00 0.00 39.48 37.74 3d4l n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3d4l s VAL 619 N -1.48 2.84 -0.69 1.97 1.01 -1.02 -0.60 120.40 122.43 3d4l s VAL 619 Ca 0.38 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.38 3d4l s VAL 619 Cb 0.22 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.42 3d4l s VAL 619 CO 0.22 0.51 1.23 -0.62 0.00 0.00 0.00 175.10 176.45 3d4l s ASP 620 N 0.74 6.23 0.00 3.32 -1.08 0.15 -4.75 116.67 121.29 3d4l s ASP 620 Ca -0.06 -0.34 0.05 0.00 -0.52 0.00 0.00 52.55 51.68 3d4l s ASP 620 Cb -0.15 -2.55 0.28 0.00 -1.46 0.00 0.00 42.92 39.04 3d4l s ASP 620 CO 0.01 -1.72 0.97 -0.46 0.52 0.00 0.00 175.17 174.50 3d4l n ASN 621 N 9.01 0.00 -0.05 -0.34 0.23 -1.26 -0.77 115.26 122.08 3d4l n ASN 621 Ca 0.04 0.15 0.11 0.00 -0.53 0.00 0.00 54.58 54.35 3d4l n ASN 621 Cb 0.49 -0.24 0.13 0.00 -2.08 0.00 0.00 39.78 38.08 3d4l n ASN 621 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3d4l n LYS 622 N -1.24 0.15 -3.31 -3.83 5.02 -1.26 -4.52 118.16 109.17 3d4l n LYS 622 Ca 0.03 -0.10 -0.25 0.00 -2.02 0.00 0.00 58.31 55.96 3d4l n LYS 622 Cb 0.04 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.47 3d4l n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3d4l n ARG 623 N -1.34 1.50 -5.10 1.97 1.74 0.05 -4.82 116.66 110.66 3d4l n ARG 623 Ca 0.06 -3.87 -0.32 0.00 -0.77 0.00 0.00 57.85 52.95 3d4l n ARG 623 Cb 0.34 -1.70 -0.17 0.00 -1.02 0.00 0.00 32.46 29.91 3d4l n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3d4l s ILE 624 N -1.70 2.07 0.38 0.55 1.01 -1.26 -1.14 121.20 121.11 3d4l s ILE 624 Ca 0.37 -1.01 0.05 0.00 0.00 0.00 0.00 60.65 60.06 3d4l s ILE 624 Cb 0.15 -1.79 -0.06 0.00 0.01 0.00 0.00 42.46 40.77 3d4l s ILE 624 CO -0.07 0.56 0.04 0.00 0.00 0.00 0.00 174.94 175.47 3d4l s ALA 625 N 0.44 2.84 -0.04 9.38 0.00 0.56 -0.93 121.76 134.03 3d4l s ALA 625 Ca -0.16 -1.97 -0.07 0.00 0.00 0.00 0.00 51.96 49.75 3d4l s ALA 625 Cb -0.17 0.43 0.01 0.00 0.00 0.00 0.00 23.12 23.39 3d4l s ALA 625 CO 0.07 -0.22 0.17 -1.50 0.00 0.00 0.00 175.76 174.28 3d4l s ILE 626 N -3.03 0.03 0.05 0.00 2.07 -1.01 -0.27 121.20 119.05 3d4l s ILE 626 Ca 0.33 -0.29 -0.15 0.00 -1.41 0.00 0.00 60.65 59.13 3d4l s ILE 626 Cb 0.08 -0.35 0.03 0.00 0.13 0.00 0.00 42.46 42.35 3d4l s ILE 626 CO 0.15 -0.16 0.34 -1.66 -1.91 0.00 0.00 174.94 171.71 3d4l s TRP 627 N -0.54 -0.16 0.05 3.50 1.48 -0.03 -1.45 118.94 121.80 3d4l s TRP 627 Ca -0.06 0.03 -0.27 0.00 -1.06 0.00 0.00 56.10 54.73 3d4l s TRP 627 Cb -0.04 0.15 0.09 0.00 -1.16 0.00 0.00 33.47 32.51 3d4l s TRP 627 CO 0.01 -0.55 0.86 0.20 -4.06 0.00 0.00 176.95 173.42 3d4l s GLY 628 N -2.14 -0.43 0.03 3.67 0.00 -0.86 -0.96 107.32 106.63 3d4l s GLY 628 Ca -0.04 0.75 0.07 0.00 0.00 0.00 0.00 44.72 45.50 3d4l s GLY 628 CO -0.04 0.24 -0.20 0.86 0.00 0.00 0.00 173.10 173.96 3d4l s TRP 629 N -3.25 1.80 0.00 1.90 -0.11 -1.26 -1.69 118.94 116.34 3d4l s TRP 629 Ca 0.06 -0.37 0.00 0.00 1.22 0.00 0.00 56.10 57.01 3d4l s TRP 629 Cb -0.01 -1.10 0.00 0.00 -1.50 0.00 0.00 33.47 30.86 3d4l s TRP 629 CO -0.07 0.06 0.00 0.45 -4.62 0.00 0.00 176.95 172.77 3d4l n SER 630 N 2.04 0.00 -0.10 5.86 2.88 -0.01 -0.37 113.62 123.92 3d4l n SER 630 Ca -0.17 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.50 3d4l n SER 630 Cb 0.53 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 64.49 3d4l n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3d4l h TYR 631 N 0.00 0.44 0.00 0.66 5.03 -1.87 0.25 116.97 121.47 3d4l h TYR 631 Ca 0.00 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.28 3d4l h TYR 631 Cb 0.00 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.13 3d4l h TYR 631 CO 0.00 0.20 -0.19 0.78 -1.32 0.00 0.00 178.16 177.63 3d4l h GLY 632 N 0.41 0.00 1.35 1.82 0.00 -0.68 -1.63 103.07 104.34 3d4l h GLY 632 Ca 0.29 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.43 3d4l h GLY 632 CO -0.08 0.00 -0.69 -1.33 0.00 0.00 0.00 176.54 174.43 3d4l h GLY 633 N 0.90 0.72 0.89 4.60 0.00 -0.46 -0.95 103.07 108.77 3d4l h GLY 633 Ca -0.00 -0.96 -0.00 0.00 0.00 0.00 0.00 47.33 46.37 3d4l h GLY 633 CO 0.03 0.85 -0.04 -1.82 0.00 0.00 0.00 176.54 175.55 3d4l h TYR 634 N 0.46 -0.11 -0.49 5.60 3.20 -0.86 -1.20 116.97 123.57 3d4l h TYR 634 Ca -0.03 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 3d4l h TYR 634 Cb 1.29 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 39.58 3d4l h TYR 634 CO 0.07 0.03 0.24 0.28 -1.64 0.00 0.00 178.16 177.14 3d4l h VAL 635 N -0.23 1.18 -0.55 1.81 2.07 -1.31 0.10 116.25 119.32 3d4l h VAL 635 Ca -0.01 -0.50 0.07 0.00 0.82 0.00 0.00 66.70 67.08 3d4l h VAL 635 Cb 0.19 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 3d4l h VAL 635 CO 0.02 0.20 0.23 0.74 0.02 0.00 0.00 177.57 178.78 3d4l h THR 636 N 0.64 0.84 -0.42 2.57 2.02 -1.11 0.98 112.91 118.44 3d4l h THR 636 Ca 0.17 -0.15 -0.06 0.00 0.77 0.00 0.00 66.41 67.15 3d4l h THR 636 Cb 0.10 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 3d4l h THR 636 CO -0.02 0.08 0.04 0.28 0.37 0.00 0.00 175.52 176.27 3d4l h SER 637 N 0.43 0.68 -0.27 4.18 0.02 -0.66 0.01 113.55 117.95 3d4l h SER 637 Ca 0.27 -0.28 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 3d4l h SER 637 Cb 0.27 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3d4l h SER 637 CO -0.24 0.79 -0.01 0.24 -1.14 0.00 0.00 176.83 176.46 3d4l h MET 638 N 0.55 0.60 -0.06 3.45 2.86 -0.40 -1.17 114.93 120.76 3d4l h MET 638 Ca 0.12 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 3d4l h MET 638 Cb 0.41 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 3d4l h MET 638 CO 0.01 0.64 -0.03 0.28 1.06 0.00 0.00 176.91 178.87 3d4l h VAL 639 N 0.57 1.32 0.00 -2.22 2.07 -0.56 -2.31 116.25 115.12 3d4l h VAL 639 Ca 0.12 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 3d4l h VAL 639 Cb 0.39 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.01 3d4l h VAL 639 CO 0.02 0.28 -0.11 -0.07 0.02 0.00 0.00 177.57 177.70 3d4l h LEU 640 N -0.24 0.00 -2.18 2.57 3.38 -0.75 -1.52 115.31 116.57 3d4l h LEU 640 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3d4l h LEU 640 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3d4l h LEU 640 CO 0.01 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.26 3d4l n GLY 641 N -0.72 1.72 0.19 0.83 0.00 -0.46 -4.34 105.19 102.41 3d4l n GLY 641 Ca -0.02 -0.66 0.12 0.00 0.00 0.00 0.00 46.02 45.46 3d4l n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d4l h SER 642 N 3.67 0.00 -0.09 1.61 4.64 -0.69 -3.42 113.55 119.27 3d4l h SER 642 Ca 0.00 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3d4l h SER 642 Cb 0.83 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.90 3d4l h SER 642 CO 0.00 0.00 -0.04 0.61 -0.87 0.00 0.00 176.83 176.54 3d4l n GLY 643 N 1.14 0.55 0.24 -0.77 0.00 -1.26 -4.93 105.19 100.16 3d4l n GLY 643 Ca 0.04 -0.63 0.09 0.00 0.00 0.00 0.00 46.02 45.52 3d4l n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d4l h SER 644 N 0.00 0.00 0.00 1.61 4.64 -1.91 -3.46 113.55 114.43 3d4l h SER 644 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 3d4l h SER 644 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 3d4l h SER 644 CO 0.06 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 3d4l n GLY 645 N -0.63 1.10 0.13 -0.77 0.00 -1.26 -4.88 105.19 98.88 3d4l n GLY 645 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 3d4l n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3d4l h VAL 646 N 0.00 1.49 -3.19 1.61 2.07 -1.97 -3.45 116.25 112.82 3d4l h VAL 646 Ca 0.00 -2.56 -0.64 0.00 0.82 0.00 0.00 66.70 64.32 3d4l h VAL 646 Cb 0.00 2.41 -0.15 0.00 -1.52 0.00 0.00 31.29 32.04 3d4l h VAL 646 CO 0.00 0.74 -0.57 -0.36 0.02 0.00 0.00 177.57 177.40 3d4l s PHE 647 N -3.27 3.27 0.06 1.57 0.08 -1.26 -4.59 117.98 113.83 3d4l s PHE 647 Ca -0.03 0.15 -0.09 0.00 0.12 0.00 0.00 56.93 57.08 3d4l s PHE 647 Cb 0.11 -1.97 -0.32 0.00 -0.57 0.00 0.00 43.02 40.27 3d4l s PHE 647 CO 0.82 0.32 1.08 -0.22 -0.10 0.00 0.00 175.22 177.11 3d4l h LYS 648 N 6.01 0.39 -3.39 0.44 3.64 -1.35 -3.46 116.57 118.86 3d4l h LYS 648 Ca -0.43 -0.67 -0.04 0.00 -1.27 0.00 0.00 60.65 58.24 3d4l h LYS 648 Cb 1.18 0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 33.19 3d4l h LYS 648 CO 0.64 1.32 0.05 0.00 -2.27 0.00 0.00 179.45 179.19 3d4l s GLY 650 N -3.02 -0.41 -0.08 0.00 0.00 -0.37 -2.39 107.32 101.05 3d4l s GLY 650 Ca 0.19 1.25 0.02 0.00 0.00 0.00 0.00 44.72 46.17 3d4l s GLY 650 CO 0.10 0.45 -0.12 -0.42 0.00 0.00 0.00 173.10 173.12 3d4l s ILE 651 N -2.75 1.17 -0.17 0.90 1.01 -0.53 -1.90 121.20 118.93 3d4l s ILE 651 Ca 0.05 -0.48 -0.01 0.00 0.00 0.00 0.00 60.65 60.22 3d4l s ILE 651 Cb -0.01 -1.09 -0.00 0.00 0.01 0.00 0.00 42.46 41.37 3d4l s ILE 651 CO -0.07 0.37 -0.13 0.00 0.00 0.00 0.00 174.94 175.11 3d4l s ALA 652 N 0.84 2.57 -0.17 9.38 0.00 -0.57 -2.02 121.76 131.80 3d4l s ALA 652 Ca -0.11 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 50.75 3d4l s ALA 652 Cb -0.15 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.61 3d4l s ALA 652 CO 0.02 -0.16 -0.11 0.08 0.00 0.00 0.00 175.76 175.58 3d4l s VAL 653 N 1.03 3.00 -1.38 0.00 1.01 -0.68 -1.54 120.40 121.84 3d4l s VAL 653 Ca -0.01 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 3d4l s VAL 653 Cb -0.15 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.94 3d4l s VAL 653 CO -0.03 0.49 0.39 0.00 0.00 0.00 0.00 175.10 175.95 3d4l n ALA 654 N 4.14 -2.19 -1.82 5.51 0.00 0.43 -0.83 120.51 125.74 3d4l n ALA 654 Ca -0.19 -0.36 -0.33 0.00 0.00 0.00 0.00 53.44 52.56 3d4l n ALA 654 Cb 0.52 -1.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.08 3d4l n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3d4l s PRO 655 N -6.87 4.11 0.37 0.00 0.04 -1.26 -3.41 135.00 127.99 3d4l s PRO 655 Ca 0.15 1.10 -0.24 0.00 0.04 0.00 0.00 61.00 62.05 3d4l s PRO 655 Cb -0.07 -2.16 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 3d4l s PRO 655 CO 0.93 -0.14 0.99 0.08 0.04 0.00 0.00 177.00 178.90 3d4l s VAL 656 N -2.27 4.05 0.00 -0.36 1.01 -1.25 -4.46 120.40 117.12 3d4l s VAL 656 Ca 0.62 1.56 0.00 0.00 0.00 0.00 0.00 61.98 64.16 3d4l s VAL 656 Cb -0.10 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.48 3d4l s VAL 656 CO 0.18 0.00 0.00 -1.54 0.00 0.00 0.00 175.10 173.74 3d4l n SER 657 N 0.08 3.41 -3.66 3.32 3.41 -1.26 -4.14 113.62 114.78 3d4l n SER 657 Ca 0.04 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.58 3d4l n SER 657 Cb 0.51 0.65 -0.08 0.00 -0.26 0.00 0.00 64.21 65.02 3d4l n SER 657 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3d4l s ARG 658 N -1.39 0.43 0.58 4.33 3.52 -1.26 -0.90 118.95 124.25 3d4l s ARG 658 Ca 0.00 1.08 0.27 0.00 -0.13 0.00 0.00 55.73 56.95 3d4l s ARG 658 Cb 0.00 0.34 1.69 0.00 -1.56 0.00 0.00 34.95 35.42 3d4l s ARG 658 CO 0.00 -0.21 2.20 -1.49 -0.81 0.00 0.00 175.30 174.99 3d4l h TRP 659 N 7.79 0.00 0.00 5.12 4.06 -1.86 -0.55 115.95 130.51 3d4l h TRP 659 Ca -0.22 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.73 3d4l h TRP 659 Cb 1.14 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 3d4l h TRP 659 CO 0.23 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.50 3d4l n GLU 660 N -3.96 0.04 0.02 0.49 1.02 -1.26 -1.65 120.64 115.35 3d4l n GLU 660 Ca -0.02 0.39 0.11 0.00 -0.02 0.00 0.00 57.16 57.63 3d4l n GLU 660 Cb 0.14 -1.59 0.06 0.00 -0.02 0.00 0.00 31.44 30.03 3d4l n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3d4l n TYR 661 N -1.67 0.24 -2.53 -0.32 4.01 -0.21 -3.88 117.16 112.81 3d4l n TYR 661 Ca 0.02 0.07 -0.22 0.00 -0.16 0.00 0.00 57.90 57.61 3d4l n TYR 661 Cb 0.11 -0.41 0.05 0.00 -0.31 0.00 0.00 39.34 38.78 3d4l n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 3d4l s TYR 662 N -3.15 2.81 0.61 -0.72 5.04 -0.66 -4.82 117.35 116.45 3d4l s TYR 662 Ca 0.05 0.08 -0.17 0.00 -2.44 0.00 0.00 57.07 54.59 3d4l s TYR 662 Cb 0.15 -2.87 -0.03 0.00 0.35 0.00 0.00 41.96 39.56 3d4l s TYR 662 CO 0.78 -1.04 1.11 0.16 -1.34 0.00 0.00 175.55 175.21 3d4l s ASP 663 N -4.46 5.44 0.09 4.32 1.47 -1.26 -1.04 116.67 121.23 3d4l s ASP 663 Ca 0.58 2.03 -0.28 0.00 1.18 0.00 0.00 52.55 56.07 3d4l s ASP 663 Cb -0.10 -2.56 -0.14 0.00 -0.34 0.00 0.00 42.92 39.78 3d4l s ASP 663 CO 0.40 -1.40 1.66 0.77 0.68 0.00 0.00 175.17 177.28 3d4l h SER 664 N 0.52 -0.53 -0.27 2.11 4.64 -1.15 -1.79 113.55 117.09 3d4l h SER 664 Ca -0.48 0.04 0.05 0.00 -0.47 0.00 0.00 61.79 60.93 3d4l h SER 664 Cb 1.25 0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 63.46 3d4l h SER 664 CO 0.56 -0.32 -0.06 0.58 -0.87 0.00 0.00 176.83 176.72 3d4l h VAL 665 N -0.48 0.74 0.07 0.95 2.07 -1.94 0.69 116.25 118.35 3d4l h VAL 665 Ca -0.02 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 3d4l h VAL 665 Cb 0.42 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 3d4l h VAL 665 CO -0.00 0.00 -0.04 0.22 0.02 0.00 0.00 177.57 177.77 3d4l h TYR 666 N 0.01 -0.09 0.20 1.57 5.03 -1.93 -3.11 116.97 118.65 3d4l h TYR 666 Ca 0.13 -0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.43 3d4l h TYR 666 Cb 0.19 0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.49 3d4l h TYR 666 CO -0.26 0.45 -0.15 1.15 -1.32 0.00 0.00 178.16 178.03 3d4l h THR 667 N -0.72 0.67 0.00 1.81 2.02 -1.22 -2.66 112.91 112.80 3d4l h THR 667 Ca -0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 3d4l h THR 667 Cb 0.58 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3d4l h THR 667 CO 0.02 0.00 -0.10 -0.33 0.37 0.00 0.00 175.52 175.47 3d4l h GLU 668 N -0.36 0.00 -0.87 6.66 5.08 -1.02 0.18 114.58 124.26 3d4l h GLU 668 Ca -0.01 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 3d4l h GLU 668 Cb 0.32 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 3d4l h GLU 668 CO -0.01 0.10 0.56 -0.09 -1.00 0.00 0.00 179.01 178.58 3d4l h ARG 669 N 0.00 0.93 0.00 2.33 2.43 -1.40 0.39 114.38 119.07 3d4l h ARG 669 Ca -0.00 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.02 3d4l h ARG 669 Cb 0.25 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 3d4l h ARG 669 CO 0.01 0.62 -1.91 0.66 -1.51 0.00 0.00 179.97 177.84 3d4l n TYR 670 N -4.49 0.00 0.31 2.20 4.01 -0.79 -4.57 117.16 113.83 3d4l n TYR 670 Ca 0.13 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.90 3d4l n TYR 670 Cb 0.21 -0.53 -0.00 0.00 -0.31 0.00 0.00 39.34 38.71 3d4l n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3d4l n MET 671 N -2.26 2.38 0.00 -0.72 2.81 0.57 0.77 117.12 120.67 3d4l n MET 671 Ca -0.10 -0.48 0.00 0.00 -1.81 0.00 0.00 57.70 55.31 3d4l n MET 671 Cb 0.63 -0.98 0.00 0.00 -0.71 0.00 0.00 33.22 32.16 3d4l n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d4l n GLY 672 N 0.78 -0.41 3.86 3.03 0.00 0.12 -4.64 105.19 107.92 3d4l n GLY 672 Ca 0.03 -1.06 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 3d4l n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d4l s LEU 673 N 0.00 4.34 -1.49 0.99 1.43 -1.26 -4.28 118.68 118.40 3d4l s LEU 673 Ca 0.00 0.88 -0.08 0.00 -1.03 0.00 0.00 54.13 53.90 3d4l s LEU 673 Cb 0.00 -3.10 -0.02 0.00 0.03 0.00 0.00 46.19 43.10 3d4l s LEU 673 CO 0.00 0.14 2.78 -0.81 0.23 0.00 0.00 176.35 178.69 3d4l n PRO 674 N 0.83 3.98 -4.37 1.29 -0.04 -1.26 -1.39 135.00 134.03 3d4l n PRO 674 Ca -0.07 -2.62 -0.26 0.00 -0.04 0.00 0.00 63.50 60.52 3d4l n PRO 674 Cb 0.52 -2.72 -0.13 0.00 -0.04 0.00 0.00 33.50 31.13 3d4l n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3d4l s THR 675 N 0.97 1.87 0.48 0.52 -4.23 -1.26 -4.61 115.64 109.38 3d4l s THR 675 Ca 0.64 -1.56 0.20 0.00 -1.18 0.00 0.00 61.69 59.79 3d4l s THR 675 Cb 0.19 -1.68 0.36 0.00 1.34 0.00 0.00 72.50 72.71 3d4l s THR 675 CO -0.07 0.03 1.98 1.55 -0.54 0.00 0.00 174.62 177.56 3d4l h PRO 676 N 4.13 0.20 0.00 3.99 0.13 -1.96 0.15 132.00 138.64 3d4l h PRO 676 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3d4l h PRO 676 Cb 1.17 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3d4l h PRO 676 CO 0.40 0.13 0.00 0.93 -0.23 0.00 0.00 178.00 179.23 3d4l h GLU 677 N 0.21 0.00 0.00 0.86 3.07 -1.95 -3.43 114.58 113.33 3d4l h GLU 677 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 3d4l h GLU 677 Cb 0.81 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.72 3d4l h GLU 677 CO -0.05 0.00 0.00 -3.47 -1.40 0.00 0.00 179.01 174.09 3d4l n ASP 678 N -2.93 0.00 -0.19 1.42 -0.08 0.47 -5.02 116.55 110.21 3d4l n ASP 678 Ca 0.01 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.35 3d4l n ASP 678 Cb 0.32 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.87 3d4l n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 3d4l n ASN 679 N 0.00 1.54 -0.27 1.67 5.15 -0.49 -4.87 115.26 118.00 3d4l n ASN 679 Ca 0.00 -2.60 0.08 0.00 -0.60 0.00 0.00 54.58 51.46 3d4l n ASN 679 Cb 0.00 -0.31 0.21 0.00 -0.53 0.00 0.00 39.78 39.15 3d4l n ASN 679 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3d4l h LEU 680 N 0.00 -0.01 -0.81 1.20 5.85 -1.48 -1.64 115.31 118.42 3d4l h LEU 680 Ca 0.00 0.16 0.12 0.00 0.84 0.00 0.00 57.88 59.00 3d4l h LEU 680 Cb 1.08 0.23 -0.08 0.00 0.37 0.00 0.00 40.66 42.25 3d4l h LEU 680 CO 0.00 -0.08 0.43 0.44 -0.34 0.00 0.00 178.44 178.89 3d4l h ASP 681 N 0.25 0.56 0.89 1.25 3.32 -1.89 -0.97 116.42 119.83 3d4l h ASP 681 Ca 0.46 0.07 -0.11 0.00 0.02 0.00 0.00 57.03 57.47 3d4l h ASP 681 Cb 0.82 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.33 3d4l h ASP 681 CO -0.56 0.29 -0.51 -0.74 -1.72 0.00 0.00 179.24 176.00 3d4l h HIS 682 N 0.68 0.00 -0.84 4.55 2.76 -1.67 -1.37 115.15 119.25 3d4l h HIS 682 Ca 0.41 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.56 3d4l h HIS 682 Cb 0.49 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.41 3d4l h HIS 682 CO -0.09 0.51 0.42 1.88 -1.30 0.00 0.00 177.93 179.35 3d4l h TYR 683 N 0.00 1.20 0.00 5.26 0.05 -0.95 -2.08 116.97 120.45 3d4l h TYR 683 Ca -0.01 -0.05 -0.10 0.00 0.05 0.00 0.00 58.73 58.62 3d4l h TYR 683 Cb 1.09 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 38.44 3d4l h TYR 683 CO 0.00 0.86 -0.48 0.00 -1.05 0.00 0.00 178.16 177.48 3d4l h ARG 684 N 1.19 0.00 0.00 4.88 2.47 -0.93 -3.26 114.38 118.74 3d4l h ARG 684 Ca 0.29 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.01 3d4l h ARG 684 Cb 0.09 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.41 3d4l h ARG 684 CO -0.04 0.48 -0.55 0.09 0.56 0.00 0.00 179.97 180.52 3d4l n ASN 685 N -3.32 0.57 -2.05 7.04 3.02 -0.54 -4.19 115.26 115.79 3d4l n ASN 685 Ca 0.01 -0.02 -0.13 0.00 -0.03 0.00 0.00 54.58 54.41 3d4l n ASN 685 Cb 0.67 0.18 0.25 0.00 -0.61 0.00 0.00 39.78 40.26 3d4l n ASN 685 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3d4l n SER 686 N -1.81 4.29 -4.91 6.41 3.41 -0.80 -4.99 113.62 115.22 3d4l n SER 686 Ca 0.04 -3.41 -0.28 0.00 -0.26 0.00 0.00 58.87 54.97 3d4l n SER 686 Cb 0.39 -0.78 -0.03 0.00 -0.26 0.00 0.00 64.21 63.53 3d4l n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3d4l s THR 687 N -3.13 5.04 0.08 6.66 -4.23 -1.26 -4.77 115.64 114.03 3d4l s THR 687 Ca 0.55 -0.05 -0.14 0.00 -1.18 0.00 0.00 61.69 60.87 3d4l s THR 687 Cb 0.46 -3.76 -0.18 0.00 1.34 0.00 0.00 72.50 70.36 3d4l s THR 687 CO 0.12 -0.39 1.26 0.58 -0.54 0.00 0.00 174.62 175.65 3d4l h VAL 688 N 1.18 1.30 -0.91 2.29 2.07 -1.37 -3.31 116.25 117.51 3d4l h VAL 688 Ca -0.48 -1.97 0.19 0.00 0.82 0.00 0.00 66.70 65.25 3d4l h VAL 688 Cb 1.20 2.11 -0.11 0.00 -1.52 0.00 0.00 31.29 32.97 3d4l h VAL 688 CO 0.65 0.61 0.47 0.24 0.02 0.00 0.00 177.57 179.57 3d4l h MET 689 N 0.39 0.56 0.00 1.57 2.86 -1.91 -0.13 114.93 118.28 3d4l h MET 689 Ca -0.06 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 3d4l h MET 689 Cb 1.38 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.91 3d4l h MET 689 CO 0.15 0.37 0.00 0.66 1.06 0.00 0.00 176.91 179.15 3d4l h SER 690 N 0.58 0.00 -0.58 1.22 4.64 -1.94 -2.18 113.55 115.29 3d4l h SER 690 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3d4l h SER 690 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3d4l h SER 690 CO -0.43 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.07 3d4l n ARG 691 N -2.37 2.64 -0.26 4.77 1.74 -0.06 -4.69 116.66 118.43 3d4l n ARG 691 Ca -0.00 -2.51 0.02 0.00 -0.77 0.00 0.00 57.85 54.58 3d4l n ARG 691 Cb 0.13 -1.55 0.09 0.00 -1.02 0.00 0.00 32.46 30.11 3d4l n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3d4l h ALA 692 N 4.45 0.51 -1.01 7.54 0.00 -1.43 -1.24 119.26 128.09 3d4l h ALA 692 Ca 0.00 0.29 0.22 0.00 0.00 0.00 0.00 54.91 55.42 3d4l h ALA 692 Cb 1.00 0.56 -0.11 0.00 0.00 0.00 0.00 17.79 19.24 3d4l h ALA 692 CO 0.00 -0.41 0.61 1.49 0.00 0.00 0.00 179.25 180.94 3d4l h GLU 693 N 0.01 0.60 0.00 0.00 4.57 -1.86 -0.82 114.58 117.08 3d4l h GLU 693 Ca 0.36 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 3d4l h GLU 693 Cb 0.56 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 3d4l h GLU 693 CO -0.77 0.40 0.00 0.09 -1.18 0.00 0.00 179.01 177.55 3d4l n ASN 694 N -4.78 0.00 0.00 1.04 3.02 -0.47 -2.64 115.26 111.43 3d4l n ASN 694 Ca 0.25 0.30 0.15 0.00 -0.03 0.00 0.00 54.58 55.25 3d4l n ASN 694 Cb 0.69 -0.40 0.80 0.00 -0.61 0.00 0.00 39.78 40.26 3d4l n ASN 694 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3d4l n PHE 695 N -1.40 0.00 0.30 3.10 3.72 -0.31 -3.73 117.46 119.13 3d4l n PHE 695 Ca 0.05 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.61 3d4l n PHE 695 Cb 0.14 -0.22 0.91 0.00 -0.94 0.00 0.00 39.48 39.38 3d4l n PHE 695 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3d4l h LYS 696 N 0.00 0.00 -0.51 -1.08 1.57 -1.69 -2.67 116.57 112.20 3d4l h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3d4l h LYS 696 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3d4l h LYS 696 CO 0.00 0.03 0.00 1.04 -0.57 0.00 0.00 179.45 179.95 3d4l n GLN 697 N -3.66 3.71 -4.19 3.15 6.02 -1.24 -4.98 117.38 116.19 3d4l n GLN 697 Ca -0.03 -2.85 -0.11 0.00 -0.01 0.00 0.00 57.00 54.00 3d4l n GLN 697 Cb 0.12 -1.89 -0.10 0.00 1.02 0.00 0.00 30.24 29.39 3d4l n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3d4l s VAL 698 N -2.18 0.70 -0.23 5.09 -7.23 -1.01 -4.93 120.40 110.62 3d4l s VAL 698 Ca 0.47 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.58 3d4l s VAL 698 Cb 0.33 -1.80 -0.05 0.00 0.56 0.00 0.00 36.38 35.42 3d4l s VAL 698 CO 0.18 -0.76 0.17 -1.61 -0.31 0.00 0.00 175.10 172.77 3d4l s GLU 699 N -3.85 4.10 -0.04 4.82 2.02 -0.80 -5.00 118.70 119.96 3d4l s GLU 699 Ca 0.15 -0.23 0.04 0.00 0.02 0.00 0.00 54.97 54.96 3d4l s GLU 699 Cb 0.05 -3.51 -0.00 0.00 0.10 0.00 0.00 34.13 30.76 3d4l s GLU 699 CO -0.02 0.10 -0.16 -0.47 0.02 0.00 0.00 175.26 174.73 3d4l s TYR 700 N 0.93 1.62 -0.16 1.61 5.04 -1.26 -1.24 117.35 123.88 3d4l s TYR 700 Ca 0.08 -0.43 0.01 0.00 -2.44 0.00 0.00 57.07 54.29 3d4l s TYR 700 Cb -0.13 -1.08 0.02 0.00 0.35 0.00 0.00 41.96 41.12 3d4l s TYR 700 CO 0.03 -0.13 -0.17 -1.17 -1.34 0.00 0.00 175.55 172.77 3d4l s LEU 701 N -0.03 1.91 -0.16 6.97 2.96 -0.80 -0.09 118.68 129.44 3d4l s LEU 701 Ca -0.02 -0.56 -0.01 0.00 -0.22 0.00 0.00 54.13 53.32 3d4l s LEU 701 Cb -0.10 -1.32 -0.01 0.00 0.50 0.00 0.00 46.19 45.25 3d4l s LEU 701 CO 0.01 -0.02 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.71 3d4l s LEU 702 N 1.32 2.79 -0.00 -0.68 2.96 0.05 -1.52 118.68 123.60 3d4l s LEU 702 Ca 0.03 -0.34 0.04 0.00 -0.22 0.00 0.00 54.13 53.64 3d4l s LEU 702 Cb -0.13 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.89 3d4l s LEU 702 CO -0.10 0.11 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.29 3d4l s ILE 703 N 0.67 0.93 -0.27 6.68 1.01 -0.59 -1.25 121.20 128.38 3d4l s ILE 703 Ca -0.05 -0.58 -0.25 0.00 0.00 0.00 0.00 60.65 59.77 3d4l s ILE 703 Cb -0.15 -0.79 0.08 0.00 0.01 0.00 0.00 42.46 41.60 3d4l s ILE 703 CO 0.02 0.21 0.76 -2.28 0.00 0.00 0.00 174.94 173.65 3d4l s HIS 704 N -0.37 -0.76 0.06 3.97 2.46 -0.91 -0.43 115.29 119.31 3d4l s HIS 704 Ca 0.04 1.83 -0.27 0.00 0.47 0.00 0.00 55.06 57.13 3d4l s HIS 704 Cb -0.05 0.29 -0.05 0.00 -0.13 0.00 0.00 32.58 32.64 3d4l s HIS 704 CO -0.00 -0.36 0.84 0.20 -2.47 0.00 0.00 174.74 172.94 3d4l s GLY 705 N 0.39 2.86 0.53 1.59 0.00 -1.26 -1.14 107.32 110.30 3d4l s GLY 705 Ca 0.00 0.39 0.30 0.00 0.00 0.00 0.00 44.72 45.41 3d4l s GLY 705 CO -0.01 1.24 2.03 -0.91 0.00 0.00 0.00 173.10 175.46 3d4l h THR 706 N 4.13 0.39 -0.78 0.90 1.35 -1.24 -2.87 112.91 114.78 3d4l h THR 706 Ca -0.43 -0.61 -0.34 0.00 -0.55 0.00 0.00 66.41 64.47 3d4l h THR 706 Cb 1.21 1.44 -0.20 0.00 -1.73 0.00 0.00 68.15 68.86 3d4l h THR 706 CO 0.71 0.11 0.39 0.00 -0.25 0.00 0.00 175.52 176.48 3d4l n ALA 707 N -2.21 4.96 -2.18 6.62 0.00 -0.78 -4.71 120.51 122.21 3d4l n ALA 707 Ca -0.01 -2.72 -0.43 0.00 0.00 0.00 0.00 53.44 50.28 3d4l n ALA 707 Cb 0.28 -1.24 -0.02 0.00 0.00 0.00 0.00 19.45 18.46 3d4l n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3d4l s ASP 708 N -1.42 6.09 0.09 0.00 -1.08 -1.08 -4.30 116.67 114.96 3d4l s ASP 708 Ca 0.54 1.00 0.26 0.00 -0.52 0.00 0.00 52.55 53.83 3d4l s ASP 708 Cb 0.45 -2.53 0.72 0.00 -1.46 0.00 0.00 42.92 40.09 3d4l s ASP 708 CO 0.10 -1.61 1.61 -0.90 0.52 0.00 0.00 175.17 174.89 3d4l n ASP 709 N 9.66 0.52 -0.00 -0.34 5.75 -1.26 -3.86 116.55 127.01 3d4l n ASP 709 Ca 0.19 0.25 -0.00 0.00 -0.01 0.00 0.00 54.79 55.23 3d4l n ASP 709 Cb 0.48 -0.23 -0.00 0.00 -1.03 0.00 0.00 41.12 40.34 3d4l n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 3d4l n ASN 710 N -1.87 0.00 -4.30 -1.12 2.85 -1.26 -4.73 115.26 104.83 3d4l n ASN 710 Ca 0.05 0.16 -0.44 0.00 -0.11 0.00 0.00 54.58 54.24 3d4l n ASN 710 Cb 0.39 -0.50 -0.07 0.00 1.24 0.00 0.00 39.78 40.85 3d4l n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3d4l s VAL 711 N -1.00 4.91 0.52 3.44 1.01 -1.26 -4.82 120.40 123.20 3d4l s VAL 711 Ca -0.00 -1.49 -0.22 0.00 0.00 0.00 0.00 61.98 60.27 3d4l s VAL 711 Cb 0.00 -4.12 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 3d4l s VAL 711 CO 0.00 -0.78 1.24 1.41 0.00 0.00 0.00 175.10 176.97 3d4l n HIS 712 N 5.14 1.91 -0.31 5.22 8.25 -1.25 -4.71 115.22 129.45 3d4l n HIS 712 Ca -0.12 0.46 0.21 0.00 -0.26 0.00 0.00 57.72 58.01 3d4l n HIS 712 Cb 0.41 -2.31 0.49 0.00 1.12 0.00 0.00 29.99 29.69 3d4l n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3d4l h PHE 713 N 1.40 0.69 -0.84 4.41 3.57 -1.80 0.50 116.94 124.86 3d4l h PHE 713 Ca -0.49 0.02 0.27 0.00 3.53 0.00 0.00 57.97 61.30 3d4l h PHE 713 Cb 1.32 -0.20 -0.16 0.00 2.79 0.00 0.00 35.95 39.70 3d4l h PHE 713 CO 0.44 0.09 0.16 0.94 -2.23 0.00 0.00 178.31 177.71 3d4l n GLN 714 N -4.63 -0.06 -0.14 1.11 7.27 -1.26 -0.82 117.38 118.85 3d4l n GLN 714 Ca 0.24 1.23 -0.06 0.00 0.07 0.00 0.00 57.00 58.49 3d4l n GLN 714 Cb 0.82 -2.04 0.03 0.00 2.41 0.00 0.00 30.24 31.46 3d4l n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3d4l h GLN 715 N 0.00 0.47 -0.01 3.69 4.20 -1.20 -0.66 115.11 121.60 3d4l h GLN 715 Ca 0.58 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 59.10 3d4l h GLN 715 Cb 1.33 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.98 3d4l h GLN 715 CO -0.75 0.31 -0.72 0.77 -0.67 0.00 0.00 178.83 177.78 3d4l h SER 716 N 0.49 0.09 -0.32 1.46 0.02 -1.15 -2.87 113.55 111.27 3d4l h SER 716 Ca 0.18 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3d4l h SER 716 Cb 0.05 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 3d4l h SER 716 CO -0.11 0.77 0.13 0.00 -1.14 0.00 0.00 176.83 176.49 3d4l h ALA 717 N 1.22 1.54 0.01 3.77 0.00 -0.52 -0.18 119.26 125.10 3d4l h ALA 717 Ca -0.01 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.58 3d4l h ALA 717 Cb 1.27 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3d4l h ALA 717 CO 0.10 0.36 -0.94 1.96 0.00 0.00 0.00 179.25 180.73 3d4l h GLN 718 N 0.53 0.06 0.14 0.00 1.08 -1.05 -2.66 115.11 113.22 3d4l h GLN 718 Ca 0.13 -0.08 -0.01 0.00 -1.45 0.00 0.00 58.65 57.24 3d4l h GLN 718 Cb 0.14 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3d4l h GLN 718 CO -0.01 0.95 -0.07 0.82 -0.95 0.00 0.00 178.83 179.57 3d4l h ILE 719 N 0.03 1.00 -0.89 2.54 2.04 -1.11 -2.08 117.51 119.03 3d4l h ILE 719 Ca -0.03 -0.64 0.06 0.00 1.00 0.00 0.00 64.86 65.25 3d4l h ILE 719 Cb 1.63 1.39 -0.06 0.00 -0.74 0.00 0.00 36.82 39.03 3d4l h ILE 719 CO 0.13 0.15 0.56 0.77 0.00 0.00 0.00 178.15 179.76 3d4l h SER 720 N -0.50 0.89 -0.54 1.72 4.64 -1.13 -1.23 113.55 117.40 3d4l h SER 720 Ca -0.02 0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 3d4l h SER 720 Cb 0.39 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.28 3d4l h SER 720 CO 0.03 0.58 0.11 0.50 -0.87 0.00 0.00 176.83 177.18 3d4l h LYS 721 N 1.03 0.94 -0.60 4.77 3.64 -1.44 0.32 116.57 125.23 3d4l h LYS 721 Ca 0.38 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.48 3d4l h LYS 721 Cb 0.14 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 3d4l h LYS 721 CO -0.16 0.86 0.13 0.00 -2.27 0.00 0.00 179.45 178.00 3d4l h ALA 722 N 1.23 0.80 -0.46 5.00 0.00 -0.63 0.61 119.26 125.80 3d4l h ALA 722 Ca 0.18 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3d4l h ALA 722 Cb 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3d4l h ALA 722 CO 0.01 0.52 -0.22 -0.07 0.00 0.00 0.00 179.25 179.49 3d4l h LEU 723 N 0.89 0.98 -0.61 0.00 3.38 -0.88 -2.67 115.31 116.40 3d4l h LEU 723 Ca 0.19 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 3d4l h LEU 723 Cb 0.38 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3d4l h LEU 723 CO 0.01 1.15 0.16 0.58 0.09 0.00 0.00 178.44 180.43 3d4l h VAL 724 N 0.82 1.25 -0.01 1.22 2.07 -0.74 -0.84 116.25 120.02 3d4l h VAL 724 Ca 0.11 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 3d4l h VAL 724 Cb 0.79 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 3d4l h VAL 724 CO 0.07 0.33 -0.02 0.44 0.02 0.00 0.00 177.57 178.41 3d4l h ASP 725 N 0.88 0.01 -0.50 0.57 3.32 -0.63 -2.07 116.42 118.00 3d4l h ASP 725 Ca 0.19 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3d4l h ASP 725 Cb 0.33 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 3d4l h ASP 725 CO -0.00 0.03 0.00 1.33 -1.72 0.00 0.00 179.24 178.88 3d4l n VAL 726 N -4.51 0.70 -2.90 -1.35 0.24 -1.03 -4.98 118.33 104.50 3d4l n VAL 726 Ca -0.03 -0.85 -0.10 0.00 -2.04 0.00 0.00 64.34 61.32 3d4l n VAL 726 Cb 0.11 0.79 0.03 0.00 -1.47 0.00 0.00 33.84 33.30 3d4l n VAL 726 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d4l n GLY 727 N 1.45 0.27 3.58 7.63 0.00 -0.78 -4.98 105.19 112.37 3d4l n GLY 727 Ca 0.20 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 3d4l n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d4l s VAL 728 N -3.08 4.60 0.30 1.61 1.01 -0.38 -5.04 120.40 119.43 3d4l s VAL 728 Ca 0.23 -0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.93 3d4l s VAL 728 Cb -0.10 -3.08 -0.09 0.00 0.00 0.00 0.00 36.38 33.10 3d4l s VAL 728 CO 0.29 0.44 0.79 -0.62 0.00 0.00 0.00 175.10 175.99 3d4l s ASP 729 N 0.62 6.96 0.30 3.32 2.15 -1.26 -4.49 116.67 124.26 3d4l s ASP 729 Ca 0.03 1.45 -0.19 0.00 0.43 0.00 0.00 52.55 54.26 3d4l s ASP 729 Cb -0.13 -2.44 0.02 0.00 -0.30 0.00 0.00 42.92 40.08 3d4l s ASP 729 CO 0.02 -0.13 0.71 0.72 -0.17 0.00 0.00 175.17 176.32 3d4l s PHE 730 N -1.81 -0.09 0.00 -5.34 -0.12 -1.26 -4.75 117.98 104.62 3d4l s PHE 730 Ca 0.51 -0.40 0.00 0.00 -0.05 0.00 0.00 56.93 56.99 3d4l s PHE 730 Cb -0.13 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 3d4l s PHE 730 CO 0.19 -1.28 0.06 -0.65 -0.05 0.00 0.00 175.22 173.48 3d4l s GLN 731 N -3.63 2.97 0.05 1.99 -1.52 0.87 -5.02 119.66 115.37 3d4l s GLN 731 Ca 0.13 -0.54 -0.01 0.00 -1.95 0.00 0.00 55.36 52.98 3d4l s GLN 731 Cb -0.05 -2.79 -0.03 0.00 -0.22 0.00 0.00 33.01 29.91 3d4l s GLN 731 CO 0.08 0.63 -0.01 0.00 -0.25 0.00 0.00 175.29 175.74 3d4l s ALA 732 N -1.18 0.40 -0.25 6.09 0.00 -1.26 -0.77 121.76 124.79 3d4l s ALA 732 Ca 0.22 -1.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.01 3d4l s ALA 732 Cb -0.12 0.27 0.10 0.00 0.00 0.00 0.00 23.12 23.37 3d4l s ALA 732 CO 0.13 -0.35 0.55 1.41 0.00 0.00 0.00 175.76 177.50 3d4l s MET 733 N -3.55 0.49 0.13 0.00 1.75 -0.38 -4.92 119.30 112.82 3d4l s MET 733 Ca 0.03 1.20 0.03 0.00 -1.25 0.00 0.00 55.69 55.70 3d4l s MET 733 Cb 0.05 0.47 -0.04 0.00 2.84 0.00 0.00 34.83 38.15 3d4l s MET 733 CO -0.09 -0.20 0.20 1.67 -0.65 0.00 0.00 175.02 175.95 3d4l s TRP 734 N 2.42 3.33 -0.28 4.11 -2.14 -1.26 -2.14 118.94 122.99 3d4l s TRP 734 Ca -0.06 0.08 0.03 0.00 2.66 0.00 0.00 56.10 58.82 3d4l s TRP 734 Cb -0.10 -1.62 0.07 0.00 -3.10 0.00 0.00 33.47 28.72 3d4l s TRP 734 CO -0.16 0.53 -0.06 0.71 -2.66 0.00 0.00 176.95 175.31 3d4l s TYR 735 N -1.67 3.28 0.05 1.66 1.51 -0.29 -4.92 117.35 116.97 3d4l s TYR 735 Ca 0.33 -2.44 -0.33 0.00 -1.01 0.00 0.00 57.07 53.62 3d4l s TYR 735 Cb -0.11 -2.15 -0.12 0.00 -0.11 0.00 0.00 41.96 39.47 3d4l s TYR 735 CO 0.26 -0.89 1.79 2.41 -1.11 0.00 0.00 175.55 178.01 3d4l n THR 736 N 4.42 0.36 -0.99 -0.71 -1.04 -1.26 -1.39 114.28 113.67 3d4l n THR 736 Ca -0.09 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 3d4l n THR 736 Cb 0.42 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.07 3d4l n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3d4l n ASP 737 N 5.47 -5.18 -4.85 8.00 8.00 -1.26 -4.88 116.55 121.85 3d4l n ASP 737 Ca 0.20 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.36 3d4l n ASP 737 Cb 0.32 -2.75 -0.06 0.00 -0.02 0.00 0.00 41.12 38.61 3d4l n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3d4l s GLU 738 N -1.50 3.99 0.00 -1.24 0.41 -0.99 -4.62 118.70 114.76 3d4l s GLU 738 Ca 0.00 0.55 0.00 0.00 -0.41 0.00 0.00 54.97 55.11 3d4l s GLU 738 Cb 0.00 -2.73 0.00 0.00 -1.78 0.00 0.00 34.13 29.62 3d4l s GLU 738 CO 0.00 0.35 0.00 -0.40 -0.49 0.00 0.00 175.26 174.72 3d4l n ASP 739 N 0.28 0.00 0.30 -0.19 5.68 -1.26 -1.86 116.55 119.49 3d4l n ASP 739 Ca -0.01 0.00 0.17 0.00 -0.50 0.00 0.00 54.79 54.44 3d4l n ASP 739 Cb 0.52 0.00 0.94 0.00 -1.14 0.00 0.00 41.12 41.44 3d4l n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 3d4l h HIS 740 N 0.00 0.00 0.00 2.11 -0.00 -1.91 -2.49 115.15 112.86 3d4l h HIS 740 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 3d4l h HIS 740 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 3d4l h HIS 740 CO 0.00 0.03 -0.66 0.41 -0.00 0.00 0.00 177.93 177.71 3d4l n GLY 741 N -1.07 -1.38 3.96 5.26 0.00 -1.26 -4.93 105.19 105.78 3d4l n GLY 741 Ca -0.03 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 3d4l n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3d4l n ILE 742 N -2.04 -0.90 0.91 -0.61 5.41 -0.94 -4.82 119.36 116.37 3d4l n ILE 742 Ca 0.03 -0.41 0.10 0.00 1.00 0.00 0.00 62.75 63.48 3d4l n ILE 742 Cb 0.43 -0.88 0.04 0.00 -0.71 0.00 0.00 39.64 38.52 3d4l n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3d4l n ALA 743 N -3.91 2.97 -1.61 -1.39 0.00 -1.26 -3.73 120.51 111.58 3d4l n ALA 743 Ca -0.25 -0.64 -0.36 0.00 0.00 0.00 0.00 53.44 52.19 3d4l n ALA 743 Cb 0.55 -0.73 0.08 0.00 0.00 0.00 0.00 19.45 19.35 3d4l n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3d4l s SER 744 N -2.07 4.40 0.16 0.00 1.04 -1.26 -4.72 113.70 111.25 3d4l s SER 744 Ca 0.21 2.59 -0.18 0.00 0.48 0.00 0.00 55.95 59.05 3d4l s SER 744 Cb 0.17 -2.61 0.08 0.00 0.10 0.00 0.00 66.02 63.76 3d4l s SER 744 CO 0.40 -2.14 1.67 -1.28 0.98 0.00 0.00 173.24 172.87 3d4l h SER 745 N 0.27 -0.38 -0.25 7.02 0.87 -1.99 0.27 113.55 119.35 3d4l h SER 745 Ca -0.50 0.12 -0.10 0.00 -1.23 0.00 0.00 61.79 60.08 3d4l h SER 745 Cb 1.33 0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 63.53 3d4l h SER 745 CO 0.52 -0.14 -0.23 0.71 -0.53 0.00 0.00 176.83 177.17 3d4l h THR 746 N -0.01 1.31 -0.72 2.23 1.35 -1.98 -2.61 112.91 112.48 3d4l h THR 746 Ca 0.18 -1.38 -0.04 0.00 -0.55 0.00 0.00 66.41 64.62 3d4l h THR 746 Cb 0.29 1.65 -0.03 0.00 -1.73 0.00 0.00 68.15 68.33 3d4l h THR 746 CO -0.39 0.43 0.28 0.00 -0.25 0.00 0.00 175.52 175.59 3d4l h ALA 747 N 0.68 1.15 -0.20 6.62 0.00 -1.85 -0.81 119.26 124.86 3d4l h ALA 747 Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3d4l h ALA 747 Cb 0.78 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3d4l h ALA 747 CO 0.06 0.61 0.13 1.25 0.00 0.00 0.00 179.25 181.30 3d4l h HIS 748 N 1.04 0.25 -0.68 0.00 2.76 -0.90 0.15 115.15 117.77 3d4l h HIS 748 Ca 0.24 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.35 3d4l h HIS 748 Cb 0.20 -0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.05 3d4l h HIS 748 CO 0.02 0.17 0.17 1.96 -1.30 0.00 0.00 177.93 178.94 3d4l h GLN 749 N 0.26 1.08 -0.43 5.26 4.20 -1.26 -2.83 115.11 121.41 3d4l h GLN 749 Ca 0.07 -0.26 -0.07 0.00 0.06 0.00 0.00 58.65 58.46 3d4l h GLN 749 Cb -0.02 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 3d4l h GLN 749 CO -0.02 0.96 0.00 1.25 -0.67 0.00 0.00 178.83 180.36 3d4l h HIS 750 N 1.01 0.82 -0.55 2.96 2.76 -0.69 -1.93 115.15 119.52 3d4l h HIS 750 Ca 0.21 -0.14 -0.11 0.00 -2.20 0.00 0.00 60.37 58.13 3d4l h HIS 750 Cb 0.36 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.09 3d4l h HIS 750 CO 0.03 0.81 -0.09 0.97 -1.30 0.00 0.00 177.93 178.34 3d4l h ILE 751 N 0.59 1.27 0.00 6.26 2.10 -0.69 -0.53 117.51 126.51 3d4l h ILE 751 Ca 0.12 -1.25 -0.10 0.00 1.08 0.00 0.00 64.86 64.71 3d4l h ILE 751 Cb 0.48 0.95 -0.01 0.00 -1.09 0.00 0.00 36.82 37.14 3d4l h ILE 751 CO 0.02 0.44 -0.49 1.88 -1.08 0.00 0.00 178.15 178.93 3d4l h TYR 752 N 0.91 0.00 -0.21 2.19 0.05 -1.49 -0.22 116.97 118.20 3d4l h TYR 752 Ca 0.14 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.83 3d4l h TYR 752 Cb 0.66 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.40 3d4l h TYR 752 CO 0.05 0.49 -0.22 1.15 -1.05 0.00 0.00 178.16 178.57 3d4l h THR 753 N 0.00 1.33 -0.44 -2.88 2.02 -1.14 -1.48 112.91 110.31 3d4l h THR 753 Ca -0.00 -1.40 -0.07 0.00 0.77 0.00 0.00 66.41 65.71 3d4l h THR 753 Cb 0.98 1.76 -0.02 0.00 -1.74 0.00 0.00 68.15 69.13 3d4l h THR 753 CO 0.06 0.43 0.01 -0.74 0.37 0.00 0.00 175.52 175.65 3d4l h HIS 754 N 0.20 0.85 -0.31 3.16 -0.00 -0.80 -2.38 115.15 115.87 3d4l h HIS 754 Ca 0.03 -0.15 -0.09 0.00 -0.00 0.00 0.00 60.37 60.16 3d4l h HIS 754 Cb 0.78 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.95 3d4l h HIS 754 CO 0.08 0.83 -0.19 0.52 -0.00 0.00 0.00 177.93 179.17 3d4l h MET 755 N 0.63 0.56 -0.56 5.26 2.07 -1.06 -2.19 114.93 119.64 3d4l h MET 755 Ca 0.13 -0.20 -0.03 0.00 -2.07 0.00 0.00 59.70 57.53 3d4l h MET 755 Cb 0.49 -0.04 -0.03 0.00 -1.87 0.00 0.00 31.60 30.15 3d4l h MET 755 CO 0.02 0.73 0.24 0.77 1.07 0.00 0.00 176.91 179.74 3d4l h SER 756 N 0.51 0.76 -0.64 1.22 0.02 -1.04 -0.69 113.55 113.69 3d4l h SER 756 Ca 0.08 -0.16 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 3d4l h SER 756 Cb 0.62 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 3d4l h SER 756 CO 0.04 0.71 0.22 0.45 -1.14 0.00 0.00 176.83 177.12 3d4l h HIS 757 N 0.77 1.01 -0.23 3.45 3.86 -1.26 -1.26 115.15 121.48 3d4l h HIS 757 Ca 0.19 -0.09 -0.00 0.00 -1.16 0.00 0.00 60.37 59.30 3d4l h HIS 757 Cb 0.17 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 3d4l h HIS 757 CO 0.00 0.81 0.13 0.35 0.86 0.00 0.00 177.93 180.09 3d4l h PHE 758 N 0.92 0.32 -0.17 2.45 3.57 -0.98 -1.34 116.94 121.71 3d4l h PHE 758 Ca 0.21 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 3d4l h PHE 758 Cb 0.26 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3d4l h PHE 758 CO 0.02 0.28 0.01 0.82 -2.23 0.00 0.00 178.31 177.20 3d4l h ILE 759 N 0.27 1.24 -0.71 1.41 1.08 -1.04 -0.81 117.51 118.96 3d4l h ILE 759 Ca 0.08 -0.81 0.04 0.00 -0.39 0.00 0.00 64.86 63.78 3d4l h ILE 759 Cb 0.06 1.45 -0.05 0.00 -3.07 0.00 0.00 36.82 35.21 3d4l h ILE 759 CO -0.01 0.24 0.43 0.11 -0.69 0.00 0.00 178.15 178.23 3d4l h LYS 760 N 0.06 0.80 -0.34 2.37 1.57 -1.18 -0.74 116.57 119.10 3d4l h LYS 760 Ca 0.05 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3d4l h LYS 760 Cb 0.36 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 3d4l h LYS 760 CO 0.01 0.53 0.16 0.37 -0.57 0.00 0.00 179.45 179.95 3d4l h GLN 761 N 0.82 0.49 -0.51 3.15 -0.00 -1.16 0.13 115.11 118.03 3d4l h GLN 761 Ca 0.30 -0.07 0.01 0.00 -0.00 0.00 0.00 58.65 58.88 3d4l h GLN 761 Cb 0.09 -0.09 -0.03 0.00 0.00 0.00 0.00 27.48 27.45 3d4l h GLN 761 CO -0.14 0.45 0.34 0.00 0.00 0.00 0.00 178.83 179.48 3d4l n PHE 763 N -4.46 0.33 -3.65 0.00 3.72 -0.34 -4.96 117.46 108.10 3d4l n PHE 763 Ca 0.05 -0.16 -0.22 0.00 -0.05 0.00 0.00 57.45 57.06 3d4l n PHE 763 Cb 0.06 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.66 3d4l n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3d4l n SER 764 N 0.81 -3.13 -4.74 4.37 7.64 -0.29 -4.99 113.62 113.28 3d4l n SER 764 Ca 0.17 -0.70 -0.35 0.00 1.01 0.00 0.00 58.87 58.99 3d4l n SER 764 Cb 0.44 -4.51 -0.08 0.00 -1.01 0.00 0.00 64.21 59.05 3d4l n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3d4l s LEU 765 N -6.84 3.98 0.00 -3.43 1.43 0.31 -5.03 118.68 109.10 3d4l s LEU 765 Ca 0.25 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.59 3d4l s LEU 765 Cb -0.12 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.13 3d4l s LEU 765 CO 0.78 0.31 0.42 -2.65 0.23 0.00 0.00 176.35 175.43