#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d4l n ARG 40 N 0.00 1.10 -1.18 -2.82 1.74 -1.26 -4.99 116.66 109.25 3d4l n ARG 40 Ca 0.00 0.43 -0.29 0.00 -0.77 0.00 0.00 57.85 57.22 3d4l n ARG 40 Cb 0.00 -2.53 0.16 0.00 -1.02 0.00 0.00 32.46 29.07 3d4l n ARG 40 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 3d4l s LYS 41 N -3.38 0.70 0.49 5.56 -2.85 -1.23 -4.61 119.74 114.42 3d4l s LYS 41 Ca 0.83 0.62 0.07 0.00 -1.00 0.00 0.00 55.97 56.48 3d4l s LYS 41 Cb -0.38 -1.76 0.01 0.00 -2.06 0.00 0.00 37.83 33.64 3d4l s LYS 41 CO 0.40 -2.57 0.38 0.95 0.10 0.00 0.00 175.35 174.61 3d4l s THR 42 N -2.95 2.08 -0.52 3.79 -4.23 -1.26 -0.30 115.64 112.25 3d4l s THR 42 Ca 0.65 -1.45 -0.23 0.00 -1.18 0.00 0.00 61.69 59.47 3d4l s THR 42 Cb -0.18 -2.53 0.04 0.00 1.34 0.00 0.00 72.50 71.16 3d4l s THR 42 CO 0.57 0.00 0.87 -0.47 -0.54 0.00 0.00 174.62 175.06 3d4l s TYR 43 N -2.65 2.87 0.64 3.99 5.04 -1.26 -4.82 117.35 121.16 3d4l s TYR 43 Ca 0.41 0.00 0.00 0.00 -2.44 0.00 0.00 57.07 55.04 3d4l s TYR 43 Cb -0.02 -3.92 0.08 0.00 0.35 0.00 0.00 41.96 38.45 3d4l s TYR 43 CO 0.24 -1.22 0.90 0.95 -1.34 0.00 0.00 175.55 175.08 3d4l s THR 44 N 3.65 2.37 0.17 4.34 -4.23 -1.26 -3.85 115.64 116.82 3d4l s THR 44 Ca 0.29 -0.62 -0.13 0.00 -1.18 0.00 0.00 61.69 60.06 3d4l s THR 44 Cb -0.13 -2.75 0.06 0.00 1.34 0.00 0.00 72.50 71.02 3d4l s THR 44 CO 0.20 0.00 1.73 0.25 -0.54 0.00 0.00 174.62 176.25 3d4l h LEU 45 N -0.26 0.78 -1.13 4.79 5.85 -1.95 -2.52 115.31 120.86 3d4l h LEU 45 Ca -0.39 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 3d4l h LEU 45 Cb 1.28 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.07 3d4l h LEU 45 CO 0.46 0.73 0.45 0.74 -0.34 0.00 0.00 178.44 180.48 3d4l h THR 46 N 0.78 1.22 -0.41 1.05 2.02 -1.97 0.93 112.91 116.52 3d4l h THR 46 Ca 0.19 -0.50 0.02 0.00 0.77 0.00 0.00 66.41 66.89 3d4l h THR 46 Cb 0.19 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 66.71 3d4l h THR 46 CO -0.02 0.23 0.22 0.44 0.37 0.00 0.00 175.52 176.77 3d4l h ASP 47 N 1.07 0.35 0.19 4.18 3.45 -1.85 0.58 116.42 124.38 3d4l h ASP 47 Ca 0.28 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.74 3d4l h ASP 47 Cb -0.02 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 3d4l h ASP 47 CO -0.05 0.25 -0.09 0.22 -1.57 0.00 0.00 179.24 178.00 3d4l h TYR 48 N 0.45 -0.24 0.00 4.55 3.20 -0.99 0.11 116.97 124.06 3d4l h TYR 48 Ca 0.17 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 3d4l h TYR 48 Cb 0.04 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3d4l h TYR 48 CO -0.08 0.03 -0.28 -0.07 -1.64 0.00 0.00 178.16 176.11 3d4l h LEU 49 N -0.48 0.00 -1.47 2.82 3.38 -0.62 -2.74 115.31 116.19 3d4l h LEU 49 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3d4l h LEU 49 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3d4l h LEU 49 CO 0.04 0.28 -0.23 0.29 0.09 0.00 0.00 178.44 178.91 3d4l n LYS 50 N -4.09 1.78 -3.66 1.13 4.76 0.20 -4.99 118.16 113.29 3d4l n LYS 50 Ca -0.02 -1.47 -0.23 0.00 -2.87 0.00 0.00 58.31 53.73 3d4l n LYS 50 Cb 0.34 -1.46 0.05 0.00 -1.84 0.00 0.00 35.03 32.12 3d4l n LYS 50 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3d4l n ASN 51 N 0.68 -3.08 -0.21 4.39 4.05 0.33 -4.90 115.26 116.52 3d4l n ASN 51 Ca 0.12 -0.71 -0.05 0.00 0.45 0.00 0.00 54.58 54.39 3d4l n ASN 51 Cb 0.53 -4.47 0.12 0.00 1.23 0.00 0.00 39.78 37.19 3d4l n ASN 51 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 3d4l h THR 52 N -2.08 1.25 -3.18 -0.44 1.35 -1.67 -3.35 112.91 104.79 3d4l h THR 52 Ca -0.59 -0.87 -0.76 0.00 -0.55 0.00 0.00 66.41 63.64 3d4l h THR 52 Cb 1.36 0.53 -0.24 0.00 -1.73 0.00 0.00 68.15 68.07 3d4l h THR 52 CO 0.57 0.33 -0.17 -0.31 -0.25 0.00 0.00 175.52 175.69 3d4l s TYR 53 N -5.33 3.31 -0.11 4.73 2.02 -1.26 -5.04 117.35 115.66 3d4l s TYR 53 Ca -0.11 -1.38 -0.19 0.00 -0.37 0.00 0.00 57.07 55.02 3d4l s TYR 53 Cb 0.15 -3.81 -0.04 0.00 -0.40 0.00 0.00 41.96 37.87 3d4l s TYR 53 CO 0.82 -1.02 0.52 0.50 -1.57 0.00 0.00 175.55 174.81 3d4l s ARG 54 N 1.43 4.35 -0.06 -0.62 3.52 -1.26 -5.06 118.95 121.26 3d4l s ARG 54 Ca 0.05 0.53 -0.26 0.00 -0.13 0.00 0.00 55.73 55.92 3d4l s ARG 54 Cb -0.27 -3.45 -0.03 0.00 -1.56 0.00 0.00 34.95 29.64 3d4l s ARG 54 CO 0.01 0.12 0.84 -1.17 -0.81 0.00 0.00 175.30 174.29 3d4l s LEU 55 N 0.72 4.31 0.11 -0.88 2.96 -1.26 -4.76 118.68 119.88 3d4l s LEU 55 Ca 0.28 1.37 -0.04 0.00 -0.22 0.00 0.00 54.13 55.52 3d4l s LEU 55 Cb -0.16 -3.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.18 3d4l s LEU 55 CO 0.12 -0.23 0.33 -0.54 -1.32 0.00 0.00 176.35 174.71 3d4l s LYS 56 N 1.14 3.58 0.10 1.98 1.02 -1.26 -5.10 119.74 121.20 3d4l s LYS 56 Ca 0.43 -0.16 0.01 0.00 0.02 0.00 0.00 55.97 56.28 3d4l s LYS 56 Cb -0.19 -2.92 -0.00 0.00 -0.52 0.00 0.00 37.83 34.19 3d4l s LYS 56 CO 0.21 0.52 0.05 1.47 -0.92 0.00 0.00 175.35 176.68 3d4l n LEU 57 N 0.29 0.00 -3.36 3.17 -0.00 -1.26 -4.88 117.00 110.96 3d4l n LEU 57 Ca -0.04 -0.79 -0.19 0.00 -0.00 0.00 0.00 56.01 54.98 3d4l n LEU 57 Cb 0.52 0.31 -0.08 0.00 -0.00 0.00 0.00 43.42 44.16 3d4l n LEU 57 CO 0.48 -0.13 -0.19 -0.47 -0.00 0.00 0.00 177.39 177.09 3d4l s TYR 58 N -2.04 -0.04 -0.52 1.47 6.14 -1.26 -4.98 117.35 116.12 3d4l s TYR 58 Ca 0.07 -1.11 -0.21 0.00 0.64 0.00 0.00 57.07 56.46 3d4l s TYR 58 Cb 0.00 -0.51 0.05 0.00 0.42 0.00 0.00 41.96 41.92 3d4l s TYR 58 CO 0.05 -0.95 0.73 -1.12 0.64 0.00 0.00 175.55 174.90 3d4l s SER 59 N 1.20 6.25 0.32 4.32 0.01 -1.26 -5.04 113.70 119.51 3d4l s SER 59 Ca 0.19 -0.76 0.08 0.00 1.31 0.00 0.00 55.95 56.77 3d4l s SER 59 Cb -0.15 -2.34 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 3d4l s SER 59 CO -0.03 -1.01 0.20 -1.48 0.41 0.00 0.00 173.24 171.33 3d4l s LEU 60 N 3.05 3.44 -0.20 2.44 0.05 -1.26 -4.64 118.68 121.56 3d4l s LEU 60 Ca 0.20 -0.60 -0.00 0.00 0.05 0.00 0.00 54.13 53.77 3d4l s LEU 60 Cb -0.17 -1.99 0.05 0.00 -2.05 0.00 0.00 46.19 42.03 3d4l s LEU 60 CO 0.14 -0.27 -0.04 -0.13 -0.55 0.00 0.00 176.35 175.50 3d4l s ARG 61 N -3.89 1.36 0.13 1.48 0.52 -0.42 -4.92 118.95 113.21 3d4l s ARG 61 Ca 0.38 -0.68 -0.31 0.00 -0.52 0.00 0.00 55.73 54.60 3d4l s ARG 61 Cb -0.05 -2.26 -0.09 0.00 0.52 0.00 0.00 34.95 33.08 3d4l s ARG 61 CO 0.24 -0.54 1.43 -1.58 0.02 0.00 0.00 175.30 174.87 3d4l s TRP 62 N 1.58 3.20 -0.48 -0.53 0.52 -1.26 -0.05 118.94 121.92 3d4l s TRP 62 Ca -0.02 0.89 0.07 0.00 0.02 0.00 0.00 56.10 57.07 3d4l s TRP 62 Cb -0.17 -3.74 -0.05 0.00 -1.15 0.00 0.00 33.47 28.36 3d4l s TRP 62 CO -0.07 -2.60 0.40 0.44 0.02 0.00 0.00 176.95 175.13 3d4l n ILE 63 N 3.83 0.00 -2.21 2.03 -5.35 -0.05 -4.92 119.36 112.69 3d4l n ILE 63 Ca 0.12 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 3d4l n ILE 63 Cb 0.41 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 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 -0.82 0.00 -0.05 7.28 3.41 -1.16 -4.98 113.62 117.30 3d4l n SER 64 Ca 0.02 -0.16 0.13 0.00 -0.26 0.00 0.00 58.87 58.60 3d4l n SER 64 Cb 0.13 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.47 3d4l n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3d4l n ASP 65 N -0.15 0.47 0.00 4.04 2.03 -1.26 -2.05 116.55 119.64 3d4l n ASP 65 Ca 0.00 -0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.07 3d4l n ASP 65 Cb 0.00 0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 3d4l n ASP 65 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 3d4l n HIS 66 N -1.31 0.00 -4.11 -0.67 -0.00 -1.26 -4.41 115.22 103.46 3d4l n HIS 66 Ca 0.08 -0.02 -0.14 0.00 -0.00 0.00 0.00 57.72 57.64 3d4l n HIS 66 Cb 0.33 -0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 30.19 3d4l n HIS 66 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3d4l s GLU 67 N -0.03 0.47 0.07 -0.41 2.02 -1.26 -1.05 118.70 118.50 3d4l s GLU 67 Ca 0.00 -0.46 0.00 0.00 0.02 0.00 0.00 54.97 54.53 3d4l s GLU 67 Cb 0.00 -0.34 -0.04 0.00 0.10 0.00 0.00 34.13 33.85 3d4l s GLU 67 CO 0.00 0.08 -0.04 1.52 0.02 0.00 0.00 175.26 176.83 3d4l s TYR 68 N -0.74 0.66 0.03 1.61 -0.85 -0.93 -0.87 117.35 116.26 3d4l s TYR 68 Ca -0.04 -0.98 -0.00 0.00 -0.52 0.00 0.00 57.07 55.53 3d4l s TYR 68 Cb -0.06 -0.43 -0.04 0.00 0.38 0.00 0.00 41.96 41.81 3d4l s TYR 68 CO 0.00 -0.28 0.13 -0.51 -1.52 0.00 0.00 175.55 173.38 3d4l s LEU 69 N -2.90 4.09 -0.12 -3.49 1.43 0.93 -0.35 118.68 118.28 3d4l s LEU 69 Ca 0.08 0.19 -0.09 0.00 -1.03 0.00 0.00 54.13 53.28 3d4l s LEU 69 Cb 0.06 -2.55 0.04 0.00 0.03 0.00 0.00 46.19 43.77 3d4l s LEU 69 CO -0.07 0.23 0.30 -0.47 0.23 0.00 0.00 176.35 176.56 3d4l s TYR 70 N -1.33 -0.36 -0.18 0.29 5.04 -0.13 -1.31 117.35 119.37 3d4l s TYR 70 Ca 0.28 0.85 -0.17 0.00 -2.44 0.00 0.00 57.07 55.59 3d4l s TYR 70 Cb -0.12 0.11 -0.04 0.00 0.35 0.00 0.00 41.96 42.26 3d4l s TYR 70 CO 0.20 -0.20 0.45 0.15 -1.34 0.00 0.00 175.55 174.81 3d4l s LYS 71 N 0.60 4.23 -0.05 4.97 1.02 -1.26 -0.24 119.74 129.00 3d4l s LYS 71 Ca -0.04 0.33 -0.01 0.00 0.02 0.00 0.00 55.97 56.27 3d4l s LYS 71 Cb -0.05 -3.51 0.03 0.00 -0.52 0.00 0.00 37.83 33.77 3d4l s LYS 71 CO -0.04 -0.01 0.02 -1.14 -0.92 0.00 0.00 175.35 173.26 3d4l s GLN 72 N 1.20 0.35 -1.46 1.68 0.74 0.19 -4.83 119.66 117.53 3d4l s GLN 72 Ca 0.22 0.17 -0.10 0.00 0.05 0.00 0.00 55.36 55.71 3d4l s GLN 72 Cb -0.15 -0.73 0.05 0.00 1.10 0.00 0.00 33.01 33.28 3d4l s GLN 72 CO 0.09 -0.27 0.87 0.39 -0.55 0.00 0.00 175.29 175.82 3d4l n GLU 73 N 4.95 -5.60 -0.88 1.67 1.02 -1.26 -0.97 120.64 119.57 3d4l n GLU 73 Ca -0.10 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 57.74 3d4l n GLU 73 Cb 0.50 -5.60 0.00 0.00 -0.02 0.00 0.00 31.44 26.33 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 -2.72 -1.24 -4.87 1.62 5.03 -1.26 -4.92 115.26 106.91 3d4l n ASN 74 Ca -0.01 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.15 3d4l n ASN 74 Cb 0.56 -1.09 -0.05 0.00 -1.02 0.00 0.00 39.78 38.18 3d4l n ASN 74 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 3d4l s ASN 75 N -2.45 6.00 -0.32 6.41 -0.87 -0.14 -4.09 114.94 119.47 3d4l s ASN 75 Ca 0.00 0.11 -0.12 0.00 -1.57 0.00 0.00 52.86 51.29 3d4l s ASN 75 Cb 0.00 -1.74 -0.02 0.00 -0.02 0.00 0.00 41.25 39.47 3d4l s ASN 75 CO 0.00 0.13 0.21 -0.63 -2.57 0.00 0.00 177.10 174.24 3d4l s ILE 76 N -1.56 5.05 0.12 0.60 1.01 -0.91 -0.64 121.20 124.87 3d4l s ILE 76 Ca 0.33 -0.26 0.04 0.00 0.00 0.00 0.00 60.65 60.76 3d4l s ILE 76 Cb -0.12 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 3d4l s ILE 76 CO 0.26 0.04 0.11 -0.76 0.00 0.00 0.00 174.94 174.58 3d4l s LEU 77 N 1.69 3.80 -0.18 2.97 1.02 0.67 0.46 118.68 129.10 3d4l s LEU 77 Ca 0.06 -0.07 -0.02 0.00 0.02 0.00 0.00 54.13 54.12 3d4l s LEU 77 Cb -0.17 -2.45 -0.00 0.00 0.02 0.00 0.00 46.19 43.58 3d4l s LEU 77 CO 0.09 0.12 -0.10 0.54 0.02 0.00 0.00 176.35 177.02 3d4l s VAL 78 N -1.57 2.98 0.02 -1.59 0.11 -0.45 -0.96 120.40 118.95 3d4l s VAL 78 Ca 0.30 -0.64 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 3d4l s VAL 78 Cb -0.11 -2.31 -0.04 0.00 -1.53 0.00 0.00 36.38 32.39 3d4l s VAL 78 CO 0.23 0.48 0.07 -0.36 -3.33 0.00 0.00 175.10 172.19 3d4l s PHE 79 N 1.11 3.24 -0.41 1.54 0.08 0.53 -2.19 117.98 121.87 3d4l s PHE 79 Ca 0.01 0.16 -0.17 0.00 0.12 0.00 0.00 56.93 57.05 3d4l s PHE 79 Cb -0.14 -1.70 0.02 0.00 -0.57 0.00 0.00 43.02 40.62 3d4l s PHE 79 CO -0.03 0.53 0.42 1.21 -0.10 0.00 0.00 175.22 177.26 3d4l s ASN 80 N -1.89 6.19 0.17 1.36 3.84 -0.25 -2.18 114.94 122.18 3d4l s ASN 80 Ca 0.24 -0.64 -0.17 0.00 0.21 0.00 0.00 52.86 52.50 3d4l s ASN 80 Cb -0.12 -2.22 0.12 0.00 -0.55 0.00 0.00 41.25 38.48 3d4l s ASN 80 CO 0.16 -0.54 1.65 0.00 -2.79 0.00 0.00 177.10 175.57 3d4l h ALA 81 N 8.69 0.22 -0.59 1.71 0.00 -1.42 0.35 119.26 128.23 3d4l h ALA 81 Ca -0.27 0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.92 3d4l h ALA 81 Cb 1.11 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 19.21 3d4l h ALA 81 CO 0.78 -0.49 0.08 1.49 0.00 0.00 0.00 179.25 181.11 3d4l h GLU 82 N -0.05 0.20 0.00 0.00 4.57 -1.94 -3.29 114.58 114.07 3d4l h GLU 82 Ca 0.21 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 3d4l h GLU 82 Cb 0.37 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 3d4l h GLU 82 CO -0.47 0.13 -0.71 0.66 -1.18 0.00 0.00 179.01 177.44 3d4l n TYR 83 N -5.17 0.00 -0.46 0.92 4.02 -1.13 -5.01 117.16 110.33 3d4l n TYR 83 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.97 3d4l n TYR 83 Cb 0.32 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.58 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 1.47 1.60 3.84 2.72 0.00 0.12 -5.03 105.19 109.92 3d4l n GLY 84 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.29 5.59 0.34 1.61 4.22 -1.25 -4.73 114.94 117.42 3d4l s ASN 85 Ca 0.00 1.50 -0.08 0.00 -2.14 0.00 0.00 52.86 52.14 3d4l s ASN 85 Cb 0.00 -2.42 0.02 0.00 1.28 0.00 0.00 41.25 40.13 3d4l s ASN 85 CO 0.00 -1.29 0.56 -0.94 -2.04 0.00 0.00 177.10 173.39 3d4l s SER 86 N -3.96 0.49 0.25 3.54 1.04 -1.26 -1.09 113.70 112.71 3d4l s SER 86 Ca 0.57 -1.29 -0.07 0.00 0.48 0.00 0.00 55.95 55.65 3d4l s SER 86 Cb -0.13 0.70 -0.01 0.00 0.10 0.00 0.00 66.02 66.68 3d4l s SER 86 CO 0.54 -1.37 0.36 -0.44 0.98 0.00 0.00 173.24 173.31 3d4l s SER 87 N -3.15 0.23 -0.30 7.02 0.01 -0.93 -4.99 113.70 111.59 3d4l s SER 87 Ca 0.25 -1.20 -0.23 0.00 1.31 0.00 0.00 55.95 56.08 3d4l s SER 87 Cb -0.02 0.54 -0.00 0.00 0.21 0.00 0.00 66.02 66.75 3d4l s SER 87 CO 0.16 -1.08 0.76 -0.69 0.41 0.00 0.00 173.24 172.80 3d4l s VAL 88 N -3.86 4.83 -0.03 3.43 1.01 -1.26 -1.34 120.40 123.18 3d4l s VAL 88 Ca 0.30 1.17 -0.15 0.00 0.00 0.00 0.00 61.98 63.30 3d4l s VAL 88 Cb 0.02 -4.11 -0.32 0.00 0.00 0.00 0.00 36.38 31.97 3d4l s VAL 88 CO 0.13 -0.20 0.79 0.15 0.00 0.00 0.00 175.10 175.97 3d4l h PHE 89 N 8.07 0.75 -1.95 5.22 3.04 -0.29 -3.45 116.94 128.33 3d4l h PHE 89 Ca -0.25 -0.55 -0.18 0.00 3.98 0.00 0.00 57.97 60.98 3d4l h PHE 89 Cb 1.10 -0.03 -0.30 0.00 2.56 0.00 0.00 35.95 39.28 3d4l h PHE 89 CO 0.77 1.58 -0.50 -1.17 -2.02 0.00 0.00 178.31 176.96 3d4l s LEU 90 N -7.52 -0.58 0.26 0.59 2.96 -0.64 -5.01 118.68 108.74 3d4l s LEU 90 Ca -0.14 0.09 -0.30 0.00 -0.22 0.00 0.00 54.13 53.56 3d4l s LEU 90 Cb 0.04 1.02 -0.13 0.00 0.50 0.00 0.00 46.19 47.62 3d4l s LEU 90 CO 0.87 -0.31 1.35 1.21 -1.32 0.00 0.00 176.35 178.14 3d4l n GLU 91 N 5.36 1.98 0.32 1.98 4.07 -1.26 -2.13 120.64 130.95 3d4l n GLU 91 Ca -0.03 0.70 0.20 0.00 -0.06 0.00 0.00 57.16 57.97 3d4l n GLU 91 Cb 0.50 -2.32 1.06 0.00 -0.06 0.00 0.00 31.44 30.62 3d4l n GLU 91 CO 0.00 0.00 0.00 -2.95 -0.06 0.00 0.00 177.13 174.12 3d4l h ASN 92 N 3.65 0.00 -0.13 4.31 7.08 -1.92 0.50 115.58 129.07 3d4l h ASN 92 Ca -0.45 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.77 3d4l h ASN 92 Cb 1.28 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.52 3d4l h ASN 92 CO 0.71 0.00 0.00 -1.54 -2.08 0.00 0.00 177.43 174.52 3d4l n SER 93 N -3.22 1.37 -0.27 6.14 3.41 -1.26 -4.20 113.62 115.58 3d4l n SER 93 Ca -0.02 -1.64 -0.02 0.00 -0.26 0.00 0.00 58.87 56.92 3d4l n SER 93 Cb 0.17 -0.08 0.09 0.00 -0.26 0.00 0.00 64.21 64.13 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 1.84 1.10 -1.42 6.66 2.02 -1.24 -3.08 112.91 118.78 3d4l h THR 94 Ca 0.00 -0.32 -0.62 0.00 0.77 0.00 0.00 66.41 66.24 3d4l h THR 94 Cb 0.40 0.09 -0.39 0.00 -1.74 0.00 0.00 68.15 66.51 3d4l h THR 94 CO 0.00 0.17 -0.37 0.49 0.37 0.00 0.00 175.52 176.18 3d4l n PHE 95 N -4.63 3.21 0.19 3.16 3.72 -1.26 -4.71 117.46 117.14 3d4l n PHE 95 Ca 0.09 -2.81 0.07 0.00 -0.05 0.00 0.00 57.45 54.75 3d4l n PHE 95 Cb 0.10 -0.39 0.23 0.00 -0.94 0.00 0.00 39.48 38.48 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 2.54 0.00 -0.16 4.37 5.19 -1.79 -3.07 116.42 123.50 3d4l h ASP 96 Ca 0.37 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.78 3d4l h ASP 96 Cb 0.89 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.40 3d4l h ASP 96 CO 0.97 0.31 0.00 -0.62 -3.12 0.00 0.00 179.24 176.78 3d4l n GLU 97 N -3.28 2.30 0.26 3.56 4.71 -1.26 -4.61 120.64 122.32 3d4l n GLU 97 Ca 0.01 -2.72 0.11 0.00 -0.01 0.00 0.00 57.16 54.56 3d4l n GLU 97 Cb 0.58 -1.70 0.72 0.00 -1.01 0.00 0.00 31.44 30.03 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 1.10 0.00 0.00 -0.32 3.57 -1.87 -3.45 116.94 115.97 3d4l h PHE 98 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3d4l h PHE 98 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 3d4l h PHE 98 CO 0.30 0.07 0.00 0.41 -2.23 0.00 0.00 178.31 176.86 3d4l n GLY 99 N -1.13 0.83 3.16 2.40 0.00 -1.26 -5.01 105.19 104.17 3d4l n GLY 99 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.20 -0.14 -0.26 1.61 3.76 -1.26 -5.12 115.29 110.68 3d4l s HIS 100 Ca 0.00 0.26 -0.29 0.00 -0.15 0.00 0.00 55.06 54.88 3d4l s HIS 100 Cb 0.00 0.05 0.01 0.00 1.11 0.00 0.00 32.58 33.75 3d4l s HIS 100 CO 0.00 -0.27 1.06 0.45 -0.85 0.00 0.00 174.74 175.12 3d4l s SER 101 N -0.88 7.04 -0.17 1.40 0.15 -1.26 -4.99 113.70 114.99 3d4l s SER 101 Ca -0.10 1.26 -0.29 0.00 0.70 0.00 0.00 55.95 57.52 3d4l s SER 101 Cb -0.05 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.71 3d4l s SER 101 CO 0.02 -0.75 1.20 -0.63 1.20 0.00 0.00 173.24 174.28 3d4l s ILE 102 N 3.37 4.39 0.08 6.45 1.01 -1.26 -4.47 121.20 130.76 3d4l s ILE 102 Ca 0.45 1.68 -0.11 0.00 0.00 0.00 0.00 60.65 62.66 3d4l s ILE 102 Cb -0.14 -4.08 -0.26 0.00 0.01 0.00 0.00 42.46 37.99 3d4l s ILE 102 CO 0.10 -0.13 1.16 -1.13 0.00 0.00 0.00 174.94 174.93 3d4l h ASN 103 N 7.93 0.74 -5.12 3.58 -1.24 -0.39 -3.49 115.58 117.60 3d4l h ASN 103 Ca -0.25 -0.67 0.09 0.00 0.71 0.00 0.00 56.30 56.17 3d4l h ASN 103 Cb 1.10 -0.23 -0.05 0.00 0.73 0.00 0.00 38.32 39.87 3d4l h ASN 103 CO 0.96 1.49 0.33 -0.62 -1.29 0.00 0.00 177.43 178.30 3d4l s ASP 104 N -7.31 -0.18 0.11 1.15 -1.08 -1.08 -5.02 116.67 103.27 3d4l s ASP 104 Ca -0.08 -0.65 -0.04 0.00 -0.52 0.00 0.00 52.55 51.26 3d4l s ASP 104 Cb 0.07 0.67 -0.03 0.00 -1.46 0.00 0.00 42.92 42.17 3d4l s ASP 104 CO 0.91 -1.26 0.12 -0.72 0.52 0.00 0.00 175.17 174.74 3d4l s TYR 105 N -3.38 0.54 -0.20 -5.34 1.13 -1.26 -0.94 117.35 107.90 3d4l s TYR 105 Ca 0.13 -0.96 -0.06 0.00 -1.41 0.00 0.00 57.07 54.77 3d4l s TYR 105 Cb -0.04 -0.28 0.10 0.00 -1.10 0.00 0.00 41.96 40.64 3d4l s TYR 105 CO 0.06 -0.54 0.40 0.45 -2.51 0.00 0.00 175.55 173.41 3d4l s SER 106 N -2.97 -0.11 0.09 -0.18 0.15 0.25 -4.94 113.70 105.99 3d4l s SER 106 Ca 0.15 0.80 -0.20 0.00 0.70 0.00 0.00 55.95 57.39 3d4l s SER 106 Cb 0.06 1.26 -0.07 0.00 -1.71 0.00 0.00 66.02 65.56 3d4l s SER 106 CO -0.04 -0.25 0.61 -0.63 1.20 0.00 0.00 173.24 174.13 3d4l s ILE 107 N 2.59 4.67 0.68 6.45 1.09 -1.26 0.11 121.20 135.52 3d4l s ILE 107 Ca 0.02 1.30 -0.15 0.00 -1.10 0.00 0.00 60.65 60.71 3d4l s ILE 107 Cb -0.13 -3.94 0.01 0.00 -1.06 0.00 0.00 42.46 37.35 3d4l s ILE 107 CO -0.13 0.54 1.15 -0.94 -0.10 0.00 0.00 174.94 175.46 3d4l s SER 108 N -1.14 4.78 0.36 3.58 1.04 -0.05 -4.90 113.70 117.36 3d4l s SER 108 Ca 0.31 2.16 0.12 0.00 0.48 0.00 0.00 55.95 59.01 3d4l s SER 108 Cb -0.20 -2.57 0.90 0.00 0.10 0.00 0.00 66.02 64.25 3d4l s SER 108 CO 0.20 -1.86 1.81 -0.65 0.98 0.00 0.00 173.24 173.72 3d4l h PRO 109 N -0.02 0.58 -0.13 4.02 0.11 -1.80 -0.42 132.00 134.35 3d4l h PRO 109 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3d4l h PRO 109 Cb 1.27 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3d4l h PRO 109 CO 0.52 0.39 0.00 -0.40 -0.21 0.00 0.00 178.00 178.30 3d4l n ASP 110 N -4.64 0.87 -0.34 -2.05 3.85 -1.06 -4.83 116.55 108.35 3d4l n ASP 110 Ca 0.22 -1.78 -0.04 0.00 -0.71 0.00 0.00 54.79 52.47 3d4l n ASP 110 Cb 0.64 -0.08 -0.02 0.00 -1.35 0.00 0.00 41.12 40.31 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 0.54 0.13 6.12 0.00 -0.17 -4.89 105.19 107.79 3d4l n GLY 111 Ca 0.10 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.09 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 0.18 0.00 -4.24 1.61 4.20 -1.91 -3.47 115.11 111.49 3d4l h GLN 112 Ca -0.09 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.49 3d4l h GLN 112 Cb 0.82 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.45 3d4l h GLN 112 CO 0.13 0.25 -0.66 -0.06 -0.67 0.00 0.00 178.83 177.82 3d4l s PHE 113 N -3.07 0.55 -0.05 2.96 0.08 -1.26 -2.31 117.98 114.87 3d4l s PHE 113 Ca 0.01 -1.07 0.02 0.00 0.12 0.00 0.00 56.93 56.01 3d4l s PHE 113 Cb 0.08 -0.38 0.01 0.00 -0.57 0.00 0.00 43.02 42.16 3d4l s PHE 113 CO 0.77 -0.41 -0.10 -1.50 -0.10 0.00 0.00 175.22 173.88 3d4l s ILE 114 N -3.93 0.97 -0.19 0.64 2.07 -0.63 -0.87 121.20 119.25 3d4l s ILE 114 Ca 0.09 -0.40 -0.19 0.00 -1.41 0.00 0.00 60.65 58.74 3d4l s ILE 114 Cb 0.08 -0.89 -0.03 0.00 0.13 0.00 0.00 42.46 41.74 3d4l s ILE 114 CO -0.08 0.31 0.55 -0.22 -1.91 0.00 0.00 174.94 173.58 3d4l s LEU 115 N 0.58 4.15 -0.23 8.50 2.96 0.30 -1.17 118.68 133.77 3d4l s LEU 115 Ca -0.11 0.72 -0.07 0.00 -0.22 0.00 0.00 54.13 54.45 3d4l s LEU 115 Cb -0.14 -2.75 -0.03 0.00 0.50 0.00 0.00 46.19 43.77 3d4l s LEU 115 CO 0.02 -0.20 0.06 -0.76 -1.32 0.00 0.00 176.35 174.15 3d4l s LEU 116 N 1.66 3.47 -0.23 -0.68 1.43 0.59 -0.58 118.68 124.33 3d4l s LEU 116 Ca 0.25 -0.15 -0.08 0.00 -1.03 0.00 0.00 54.13 53.12 3d4l s LEU 116 Cb -0.16 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 3d4l s LEU 116 CO 0.10 0.02 0.09 -0.70 0.23 0.00 0.00 176.35 176.09 3d4l s GLU 117 N 1.27 3.81 0.28 1.70 2.12 -0.11 -1.61 118.70 126.17 3d4l s GLU 117 Ca 0.05 -0.40 0.02 0.00 0.36 0.00 0.00 54.97 54.99 3d4l s GLU 117 Cb -0.15 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 30.87 3d4l s GLU 117 CO 0.03 -0.04 0.26 1.52 -0.54 0.00 0.00 175.26 176.49 3d4l s TYR 118 N 1.23 1.40 -1.47 5.30 1.13 -0.36 0.43 117.35 125.03 3d4l s TYR 118 Ca 0.05 -1.48 -0.07 0.00 -1.41 0.00 0.00 57.07 54.16 3d4l s TYR 118 Cb -0.14 -0.55 0.01 0.00 -1.10 0.00 0.00 41.96 40.18 3d4l s TYR 118 CO 0.04 -0.83 0.88 0.09 -2.51 0.00 0.00 175.55 173.22 3d4l n ASN 119 N -1.03 -6.15 -4.69 -0.18 3.02 -1.26 0.32 115.26 105.30 3d4l n ASN 119 Ca 0.04 -0.42 -0.42 0.00 -0.03 0.00 0.00 54.58 53.75 3d4l n ASN 119 Cb 0.63 -4.91 -0.03 0.00 -0.61 0.00 0.00 39.78 34.87 3d4l n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3d4l s TYR 120 N -3.24 2.17 -0.24 3.10 5.04 -1.26 -4.18 117.35 118.73 3d4l s TYR 120 Ca 0.45 0.07 -0.00 0.00 -2.44 0.00 0.00 57.07 55.15 3d4l s TYR 120 Cb -0.20 -4.10 0.07 0.00 0.35 0.00 0.00 41.96 38.08 3d4l s TYR 120 CO 0.55 -4.53 0.00 0.08 -1.34 0.00 0.00 175.55 170.32 3d4l s VAL 121 N 2.88 1.18 0.44 3.14 1.01 0.99 -4.99 120.40 125.05 3d4l s VAL 121 Ca 0.79 -1.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.38 3d4l s VAL 121 Cb -0.43 -1.62 -0.08 0.00 0.00 0.00 0.00 36.38 34.25 3d4l s VAL 121 CO 0.35 -0.26 1.34 -0.75 0.00 0.00 0.00 175.10 175.77 3d4l s LYS 122 N 1.53 3.78 0.00 2.72 2.20 -1.26 -0.38 119.74 128.34 3d4l s LYS 122 Ca -0.01 2.21 0.00 0.00 -0.36 0.00 0.00 55.97 57.82 3d4l s LYS 122 Cb -0.18 -2.65 0.00 0.00 -1.51 0.00 0.00 37.83 33.49 3d4l s LYS 122 CO -0.10 -0.66 0.00 0.94 -0.36 0.00 0.00 175.35 175.17 3d4l n GLN 123 N -0.13 0.00 0.00 4.03 7.27 0.09 -4.87 117.38 123.77 3d4l n GLN 123 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.12 3d4l n GLN 123 Cb 0.43 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.08 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 -0.14 3.69 5.03 -1.16 -4.93 117.44 119.93 3d4l n TRP 124 Ca 0.00 0.00 -0.08 0.00 3.03 0.00 0.00 57.50 60.45 3d4l n TRP 124 Cb 0.00 0.00 0.07 0.00 -1.03 0.00 0.00 31.31 30.35 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 0.90 0.00 -0.99 2.43 -1.98 -3.37 114.38 111.37 3d4l h ARG 125 Ca 0.00 -0.32 -0.06 0.00 -0.81 0.00 0.00 59.98 58.80 3d4l h ARG 125 Cb 0.00 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 3d4l h ARG 125 CO 0.00 0.96 -1.21 0.72 -1.51 0.00 0.00 179.97 178.94 3d4l n HIS 126 N -4.15 0.00 -2.07 2.20 8.25 -1.26 -5.07 115.22 113.11 3d4l n HIS 126 Ca 0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.15 3d4l n HIS 126 Cb 0.38 -0.15 0.01 0.00 1.12 0.00 0.00 29.99 31.35 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 -3.54 5.87 -0.05 0.41 1.04 -1.26 -4.69 113.70 111.48 3d4l s SER 127 Ca -0.02 1.79 -0.31 0.00 0.48 0.00 0.00 55.95 57.88 3d4l s SER 127 Cb 0.01 -2.53 0.12 0.00 0.10 0.00 0.00 66.02 63.72 3d4l s SER 127 CO 0.12 -1.11 1.18 -0.72 0.98 0.00 0.00 173.24 173.69 3d4l s TYR 128 N -2.48 -0.11 0.25 5.02 -0.85 -1.26 -0.73 117.35 117.18 3d4l s TYR 128 Ca 0.63 -0.00 0.10 0.00 -0.52 0.00 0.00 57.07 57.28 3d4l s TYR 128 Cb -0.15 0.55 -0.05 0.00 0.38 0.00 0.00 41.96 42.69 3d4l s TYR 128 CO 0.37 -0.35 -0.18 0.95 -1.52 0.00 0.00 175.55 174.82 3d4l s THR 129 N -2.60 2.20 0.20 -3.49 -4.23 0.49 -4.71 115.64 103.49 3d4l s THR 129 Ca 0.11 -2.33 -0.23 0.00 -1.18 0.00 0.00 61.69 58.07 3d4l s THR 129 Cb 0.02 -2.20 0.07 0.00 1.34 0.00 0.00 72.50 71.72 3d4l s THR 129 CO -0.04 -0.47 0.96 0.00 -0.54 0.00 0.00 174.62 174.53 3d4l s ALA 130 N -2.67 -1.52 0.13 3.99 0.00 -1.04 -0.01 121.76 120.65 3d4l s ALA 130 Ca 0.27 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 52.12 3d4l s ALA 130 Cb -0.03 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 3d4l s ALA 130 CO 0.12 -1.05 0.12 -1.12 0.00 0.00 0.00 175.76 173.83 3d4l s SER 131 N -3.12 5.56 0.01 0.00 0.01 0.15 -2.67 113.70 113.63 3d4l s SER 131 Ca 0.16 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.35 3d4l s SER 131 Cb -0.02 -1.48 -0.01 0.00 0.21 0.00 0.00 66.02 64.72 3d4l s SER 131 CO 0.05 0.11 -0.02 -0.31 0.41 0.00 0.00 173.24 173.47 3d4l s TYR 132 N -1.62 0.19 0.08 2.43 1.51 -1.26 -1.22 117.35 117.46 3d4l s TYR 132 Ca 0.30 -0.22 0.06 0.00 -1.01 0.00 0.00 57.07 56.20 3d4l s TYR 132 Cb -0.11 -0.13 -0.03 0.00 -0.11 0.00 0.00 41.96 41.58 3d4l s TYR 132 CO 0.23 -0.07 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.94 3d4l s ASP 133 N -0.62 1.80 -0.10 2.29 1.01 -0.63 -4.36 116.67 116.05 3d4l s ASP 133 Ca -0.06 -0.62 0.01 0.00 0.71 0.00 0.00 52.55 52.59 3d4l s ASP 133 Cb -0.04 -0.06 -0.02 0.00 1.01 0.00 0.00 42.92 43.81 3d4l s ASP 133 CO -0.00 -0.06 -0.13 -0.63 0.21 0.00 0.00 175.17 174.56 3d4l s ILE 134 N -1.25 3.10 -0.16 0.77 1.01 -1.26 -0.30 121.20 123.10 3d4l s ILE 134 Ca -0.01 -0.67 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 3d4l s ILE 134 Cb -0.10 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 3d4l s ILE 134 CO 0.03 0.55 -0.09 -0.47 0.00 0.00 0.00 174.94 174.96 3d4l s TYR 135 N -0.01 2.90 -0.49 3.97 5.04 -0.32 -1.04 117.35 127.40 3d4l s TYR 135 Ca -0.03 -0.66 -0.27 0.00 -2.44 0.00 0.00 57.07 53.67 3d4l s TYR 135 Cb -0.14 -1.94 0.03 0.00 0.35 0.00 0.00 41.96 40.25 3d4l s TYR 135 CO 0.04 -0.27 1.04 0.34 -1.34 0.00 0.00 175.55 175.36 3d4l s ASP 136 N 0.68 6.52 0.06 4.32 -1.08 0.22 -1.61 116.67 125.78 3d4l s ASP 136 Ca -0.04 0.18 -0.30 0.00 -0.52 0.00 0.00 52.55 51.87 3d4l s ASP 136 Cb -0.15 -2.50 -0.18 0.00 -1.46 0.00 0.00 42.92 38.64 3d4l s ASP 136 CO 0.02 -1.20 1.53 -0.07 0.52 0.00 0.00 175.17 175.97 3d4l h LEU 137 N 11.03 -0.58 0.15 -1.34 3.38 -1.73 0.20 115.31 126.42 3d4l h LEU 137 Ca -0.24 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.72 3d4l h LEU 137 Cb 1.07 0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 3d4l h LEU 137 CO 1.09 -0.35 -0.45 0.78 0.09 0.00 0.00 178.44 179.60 3d4l h ASN 138 N -0.78 -1.34 0.33 -0.43 2.35 -1.90 -0.68 115.58 113.13 3d4l h ASN 138 Ca -0.07 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 3d4l h ASN 138 Cb 0.57 0.49 0.00 0.00 0.05 0.00 0.00 38.32 39.43 3d4l h ASN 138 CO 0.12 -0.49 0.00 0.29 -1.65 0.00 0.00 177.43 175.69 3d4l n LYS 139 N -5.03 0.17 -4.08 0.81 5.02 -1.24 -4.87 118.16 108.94 3d4l n LYS 139 Ca -0.08 0.16 -0.32 0.00 -2.02 0.00 0.00 58.31 56.06 3d4l n LYS 139 Cb 0.36 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.85 3d4l n LYS 139 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3d4l n ARG 140 N -1.33 -3.62 -4.15 1.97 1.74 0.62 -4.96 116.66 106.93 3d4l n ARG 140 Ca 0.06 0.42 -0.17 0.00 -0.77 0.00 0.00 57.85 57.40 3d4l n ARG 140 Cb 0.13 -4.99 -0.12 0.00 -1.02 0.00 0.00 32.46 26.47 3d4l n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3d4l s GLN 141 N -6.75 0.74 0.07 5.56 -0.21 -0.67 -4.97 119.66 113.42 3d4l s GLN 141 Ca 0.49 -0.87 -0.22 0.00 0.02 0.00 0.00 55.36 54.78 3d4l s GLN 141 Cb -0.26 -0.68 -0.06 0.00 1.00 0.00 0.00 33.01 33.01 3d4l s GLN 141 CO 0.90 0.15 0.65 -1.17 -2.12 0.00 0.00 175.29 173.69 3d4l s LEU 142 N -1.62 4.50 -0.08 2.90 2.96 -1.26 0.72 118.68 126.80 3d4l s LEU 142 Ca -0.04 1.35 -0.26 0.00 -0.22 0.00 0.00 54.13 54.96 3d4l s LEU 142 Cb -0.10 -3.04 -0.03 0.00 0.50 0.00 0.00 46.19 43.53 3d4l s LEU 142 CO 0.02 0.18 0.82 -0.63 -1.32 0.00 0.00 176.35 175.41 3d4l s ILE 143 N -0.74 4.95 -0.60 6.68 1.01 -0.21 -4.90 121.20 127.39 3d4l s ILE 143 Ca 0.32 1.67 0.06 0.00 0.00 0.00 0.00 60.65 62.70 3d4l s ILE 143 Cb -0.20 -4.14 0.09 0.00 0.01 0.00 0.00 42.46 38.22 3d4l s ILE 143 CO 0.21 0.15 0.88 0.35 0.00 0.00 0.00 174.94 176.53 3d4l n THR 144 N 4.12 0.45 -4.22 2.92 -2.24 -1.26 -4.60 114.28 109.44 3d4l n THR 144 Ca 0.03 -0.72 -0.34 0.00 -2.27 0.00 0.00 64.05 60.74 3d4l n THR 144 Cb 0.50 0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 69.49 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 -0.71 3.01 -1.40 -0.78 2.02 -1.26 -4.60 118.70 114.97 3d4l s GLU 145 Ca 0.09 -0.45 -0.01 0.00 0.02 0.00 0.00 54.97 54.62 3d4l s GLU 145 Cb 0.05 -2.82 0.00 0.00 0.10 0.00 0.00 34.13 31.46 3d4l s GLU 145 CO 0.07 0.68 0.40 0.39 0.02 0.00 0.00 175.26 176.82 3d4l n GLU 146 N 1.65 -3.09 -1.70 1.61 -0.58 -1.26 -4.69 120.64 112.59 3d4l n GLU 146 Ca -0.16 0.39 -0.33 0.00 -0.42 0.00 0.00 57.16 56.63 3d4l n GLU 146 Cb 0.53 -4.45 0.06 0.00 -0.57 0.00 0.00 31.44 27.01 3d4l n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3d4l s ARG 147 N -6.59 2.66 0.26 3.49 0.52 -1.26 -4.82 118.95 113.22 3d4l s ARG 147 Ca 0.02 1.48 -0.30 0.00 -0.52 0.00 0.00 55.73 56.41 3d4l s ARG 147 Cb -0.01 -1.93 -0.10 0.00 0.52 0.00 0.00 34.95 33.44 3d4l s ARG 147 CO 0.89 -1.37 1.43 0.42 0.02 0.00 0.00 175.30 176.69 3d4l s ILE 148 N -2.24 2.66 0.90 1.52 1.01 -1.26 -4.95 121.20 118.83 3d4l s ILE 148 Ca 0.69 0.56 -0.11 0.00 0.00 0.00 0.00 60.65 61.79 3d4l s ILE 148 Cb -0.22 -3.36 0.12 0.00 0.01 0.00 0.00 42.46 39.00 3d4l s ILE 148 CO 0.42 0.09 1.03 -2.65 0.00 0.00 0.00 174.94 173.83 3d4l n PRO 149 N 2.16 -0.30 -2.40 2.79 -0.02 -1.26 -4.65 135.00 131.31 3d4l n PRO 149 Ca 0.06 -0.02 -0.31 0.00 -2.02 0.00 0.00 63.50 61.21 3d4l n PRO 149 Cb 0.40 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.57 3d4l n PRO 149 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 3d4l s ASN 150 N -2.42 6.49 -0.86 2.55 0.01 -1.26 -3.75 114.94 115.70 3d4l s ASN 150 Ca 0.67 1.39 0.00 0.00 -0.71 0.00 0.00 52.86 54.20 3d4l s ASN 150 Cb -0.24 -2.44 0.00 0.00 0.41 0.00 0.00 41.25 38.98 3d4l s ASN 150 CO 0.58 -0.61 0.00 0.59 -1.51 0.00 0.00 177.10 176.16 3d4l n ASN 151 N -1.82 -3.37 -4.74 -1.22 3.02 -1.22 -4.98 115.26 100.92 3d4l n ASN 151 Ca 0.05 -0.01 -0.41 0.00 -0.03 0.00 0.00 54.58 54.18 3d4l n ASN 151 Cb 0.54 -2.62 -0.04 0.00 -0.61 0.00 0.00 39.78 37.05 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 -2.50 3.81 0.04 3.41 2.01 -1.09 -4.60 115.64 116.73 3d4l s THR 152 Ca 0.00 1.55 0.09 0.00 0.31 0.00 0.00 61.69 63.64 3d4l s THR 152 Cb 0.00 -3.99 -0.22 0.00 0.01 0.00 0.00 72.50 68.30 3d4l s THR 152 CO 0.00 0.26 0.97 1.56 -0.69 0.00 0.00 174.62 176.72 3d4l h GLN 153 N 5.17 0.02 -1.75 4.92 4.20 -0.95 -2.76 115.11 123.95 3d4l h GLN 153 Ca -0.44 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.26 3d4l h GLN 153 Cb 1.21 0.01 -0.23 0.00 0.30 0.00 0.00 27.48 28.78 3d4l h GLN 153 CO 0.73 0.78 0.36 -0.46 -0.67 0.00 0.00 178.83 179.57 3d4l s TRP 154 N -2.65 -0.55 -0.04 2.96 -0.11 -1.20 -4.67 118.94 112.68 3d4l s TRP 154 Ca -0.02 1.19 -0.08 0.00 1.22 0.00 0.00 56.10 58.41 3d4l s TRP 154 Cb 0.09 0.37 0.01 0.00 -1.50 0.00 0.00 33.47 32.44 3d4l s TRP 154 CO 0.82 -0.36 0.18 0.54 -4.62 0.00 0.00 176.95 173.51 3d4l s VAL 155 N -0.35 0.04 -0.17 5.86 0.11 -1.26 -0.58 120.40 124.05 3d4l s VAL 155 Ca -0.01 -0.31 -0.18 0.00 -2.93 0.00 0.00 61.98 58.55 3d4l s VAL 155 Cb -0.03 -0.36 0.05 0.00 -1.53 0.00 0.00 36.38 34.51 3d4l s VAL 155 CO 0.00 -0.17 0.50 0.28 -3.33 0.00 0.00 175.10 172.39 3d4l s THR 156 N -0.59 0.00 0.65 5.04 -1.32 -0.47 -5.01 115.64 113.95 3d4l s THR 156 Ca -0.07 -0.03 -0.13 0.00 -1.21 0.00 0.00 61.69 60.25 3d4l s THR 156 Cb -0.04 -0.72 -0.01 0.00 -1.51 0.00 0.00 72.50 70.22 3d4l s THR 156 CO 0.01 -0.02 1.06 0.26 -2.21 0.00 0.00 174.62 173.72 3d4l s TRP 157 N 0.08 3.10 0.78 9.09 0.52 -1.26 -1.52 118.94 129.73 3d4l s TRP 157 Ca -0.01 1.45 -0.11 0.00 0.02 0.00 0.00 56.10 57.45 3d4l s TRP 157 Cb -0.03 -2.91 0.06 0.00 -1.15 0.00 0.00 33.47 29.43 3d4l s TRP 157 CO 0.01 -1.15 1.09 -1.54 0.02 0.00 0.00 176.95 175.38 3d4l s SER 158 N -3.45 4.52 0.53 2.95 1.04 -0.12 -4.88 113.70 114.29 3d4l s SER 158 Ca 0.60 1.68 0.30 0.00 0.48 0.00 0.00 55.95 59.01 3d4l s SER 158 Cb -0.14 -2.42 1.49 0.00 0.10 0.00 0.00 66.02 65.05 3d4l s SER 158 CO 0.48 -2.00 2.06 1.55 0.98 0.00 0.00 173.24 176.31 3d4l h PRO 159 N -1.11 0.00 -5.44 4.02 0.13 -1.83 -3.42 132.00 124.35 3d4l h PRO 159 Ca -0.45 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.26 3d4l h PRO 159 Cb 1.24 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.16 3d4l h PRO 159 CO 0.54 0.10 -0.78 0.08 -0.23 0.00 0.00 178.00 177.71 3d4l s VAL 160 N -4.03 1.22 0.00 1.56 1.01 -1.26 -4.77 120.40 114.13 3d4l s VAL 160 Ca -0.02 -1.43 0.00 0.00 0.00 0.00 0.00 61.98 60.53 3d4l s VAL 160 Cb 0.12 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.27 3d4l s VAL 160 CO 0.56 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.01 3d4l n GLY 161 N 1.07 1.43 1.57 4.51 0.00 -1.26 -4.42 105.19 108.08 3d4l n GLY 161 Ca -0.20 -0.63 0.01 0.00 0.00 0.00 0.00 46.02 45.21 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 12.76 0.06 -1.51 1.61 1.44 -1.26 -2.57 115.22 125.75 3d4l n HIS 162 Ca 0.00 -0.70 -0.31 0.00 -2.01 0.00 0.00 57.72 54.70 3d4l n HIS 162 Cb 0.00 0.03 0.06 0.00 0.12 0.00 0.00 29.99 30.20 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 -0.38 2.75 0.03 -1.40 1.02 -1.26 -4.58 119.74 115.92 3d4l s LYS 163 Ca 0.25 1.05 0.02 0.00 0.02 0.00 0.00 55.97 57.32 3d4l s LYS 163 Cb 0.30 -1.96 -0.02 0.00 -0.52 0.00 0.00 37.83 35.63 3d4l s LYS 163 CO -0.12 -1.25 -0.07 -0.51 -0.92 0.00 0.00 175.35 172.48 3d4l s LEU 164 N -5.57 2.16 -0.04 3.17 1.43 -0.19 -0.95 118.68 118.69 3d4l s LEU 164 Ca 0.60 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 3d4l s LEU 164 Cb -0.15 -0.24 0.01 0.00 0.03 0.00 0.00 46.19 45.83 3d4l s LEU 164 CO 0.54 -0.09 -0.11 0.00 0.23 0.00 0.00 176.35 176.92 3d4l s ALA 165 N -0.88 1.06 0.06 4.21 0.00 -0.57 -0.60 121.76 125.04 3d4l s ALA 165 Ca -0.05 -0.40 -0.06 0.00 0.00 0.00 0.00 51.96 51.45 3d4l s ALA 165 Cb -0.07 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 3d4l s ALA 165 CO 0.00 0.15 0.12 1.52 0.00 0.00 0.00 175.76 177.55 3d4l s TYR 166 N 0.32 0.22 -0.14 0.00 1.13 0.25 -1.36 117.35 117.76 3d4l s TYR 166 Ca -0.06 -0.60 -0.00 0.00 -1.41 0.00 0.00 57.07 54.99 3d4l s TYR 166 Cb -0.11 -0.14 -0.01 0.00 -1.10 0.00 0.00 41.96 40.60 3d4l s TYR 166 CO 0.01 -0.44 -0.13 0.08 -2.51 0.00 0.00 175.55 172.56 3d4l s VAL 167 N -3.29 2.97 -0.04 -3.49 1.01 0.26 -0.39 120.40 117.42 3d4l s VAL 167 Ca 0.01 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 3d4l s VAL 167 Cb 0.03 -2.25 0.03 0.00 0.00 0.00 0.00 36.38 34.19 3d4l s VAL 167 CO -0.08 0.52 0.09 0.86 0.00 0.00 0.00 175.10 176.49 3d4l s TRP 168 N 0.54 -0.06 -1.48 5.22 -0.00 -0.55 -0.32 118.94 122.28 3d4l s TRP 168 Ca -0.09 0.32 -0.12 0.00 -0.00 0.00 0.00 56.10 56.22 3d4l s TRP 168 Cb -0.16 -0.19 0.06 0.00 -0.00 0.00 0.00 33.47 33.18 3d4l s TRP 168 CO 0.04 -0.14 0.92 0.09 -0.00 0.00 0.00 176.95 177.86 3d4l n ASN 169 N 4.35 -5.13 -0.21 5.86 5.03 -1.26 -2.13 115.26 121.77 3d4l n ASN 169 Ca -0.24 -0.64 -0.03 0.00 0.87 0.00 0.00 54.58 54.54 3d4l n ASN 169 Cb 0.51 -4.10 -0.01 0.00 -1.02 0.00 0.00 39.78 35.16 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 -2.77 -4.64 -4.40 6.41 4.13 -1.26 -4.38 115.26 108.35 3d4l n ASN 170 Ca 0.02 0.07 -0.27 0.00 1.68 0.00 0.00 54.58 56.07 3d4l n ASN 170 Cb 0.54 -2.38 -0.12 0.00 -1.54 0.00 0.00 39.78 36.28 3d4l n ASN 170 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3d4l s ASP 171 N -2.20 3.33 0.02 6.41 -0.00 -0.90 -2.07 116.67 121.25 3d4l s ASP 171 Ca 0.00 -0.82 -0.15 0.00 -0.00 0.00 0.00 52.55 51.57 3d4l s ASP 171 Cb 0.00 -0.23 -0.06 0.00 -0.00 0.00 0.00 42.92 42.63 3d4l s ASP 171 CO 0.00 0.13 0.44 -0.63 -0.00 0.00 0.00 175.17 175.11 3d4l s ILE 172 N -1.48 4.97 0.05 0.77 1.01 -1.26 -1.48 121.20 123.78 3d4l s ILE 172 Ca 0.18 0.89 0.04 0.00 0.00 0.00 0.00 60.65 61.76 3d4l s ILE 172 Cb -0.09 -3.74 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 3d4l s ILE 172 CO 0.08 0.55 -0.11 -0.31 0.00 0.00 0.00 174.94 175.15 3d4l s TYR 173 N -1.11 0.98 -0.04 3.97 1.51 0.48 -0.15 117.35 122.98 3d4l s TYR 173 Ca 0.25 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.91 3d4l s TYR 173 Cb -0.17 -0.57 0.00 0.00 -0.11 0.00 0.00 41.96 41.12 3d4l s TYR 173 CO 0.15 -0.00 -0.12 0.08 -1.11 0.00 0.00 175.55 174.55 3d4l s VAL 174 N -1.17 1.03 -0.16 0.71 1.01 -0.46 -0.59 120.40 120.77 3d4l s VAL 174 Ca -0.04 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.47 3d4l s VAL 174 Cb -0.09 -0.91 -0.00 0.00 0.00 0.00 0.00 36.38 35.37 3d4l s VAL 174 CO 0.01 0.32 -0.15 -0.54 0.00 0.00 0.00 175.10 174.74 3d4l s LYS 175 N 0.30 3.22 0.05 2.72 1.02 0.23 -0.64 119.74 126.65 3d4l s LYS 175 Ca -0.06 -0.74 -0.14 0.00 0.02 0.00 0.00 55.97 55.04 3d4l s LYS 175 Cb -0.11 -2.64 -0.30 0.00 -0.52 0.00 0.00 37.83 34.26 3d4l s LYS 175 CO 0.02 0.01 1.09 0.82 -0.92 0.00 0.00 175.35 176.37 3d4l h ILE 176 N 5.66 1.30 -4.20 2.17 1.08 -1.84 -0.49 117.51 121.19 3d4l h ILE 176 Ca -0.33 -2.55 -0.57 0.00 -0.39 0.00 0.00 64.86 61.02 3d4l h ILE 176 Cb 1.19 2.78 -0.30 0.00 -3.07 0.00 0.00 36.82 37.41 3d4l h ILE 176 CO 0.57 0.77 -0.84 -1.61 -0.69 0.00 0.00 178.15 176.35 3d4l s GLU 177 N -2.89 1.65 0.37 2.37 0.41 -1.26 -4.24 118.70 115.11 3d4l s GLU 177 Ca -0.09 -0.66 0.17 0.00 -0.41 0.00 0.00 54.97 53.98 3d4l s GLU 177 Cb 0.05 -1.52 1.08 0.00 -1.78 0.00 0.00 34.13 31.96 3d4l s GLU 177 CO 0.93 0.35 1.72 -1.35 -0.49 0.00 0.00 175.26 176.42 3d4l h PRO 178 N 5.88 0.38 -0.30 0.39 0.11 -1.86 -1.52 132.00 135.08 3d4l h PRO 178 Ca -0.36 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3d4l h PRO 178 Cb 1.16 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3d4l h PRO 178 CO 0.48 0.25 0.00 0.27 -0.21 0.00 0.00 178.00 178.79 3d4l n ASN 179 N -4.79 3.29 -4.98 -2.05 6.94 -1.26 -4.86 115.26 107.54 3d4l n ASN 179 Ca 0.28 -1.98 -0.20 0.00 -0.02 0.00 0.00 54.58 52.66 3d4l n ASN 179 Cb 0.93 -0.18 0.00 0.00 -2.36 0.00 0.00 39.78 38.16 3d4l n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3d4l s LEU 180 N -1.62 3.89 0.62 -4.53 1.43 -0.57 -4.53 118.68 113.37 3d4l s LEU 180 Ca 0.36 -0.09 -0.19 0.00 -1.03 0.00 0.00 54.13 53.19 3d4l s LEU 180 Cb 0.22 -2.84 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 3d4l s LEU 180 CO 0.31 -0.51 1.28 -2.84 0.23 0.00 0.00 176.35 174.83 3d4l s PRO 181 N -4.27 2.74 0.48 1.29 0.02 -1.26 -4.85 135.00 129.14 3d4l s PRO 181 Ca 0.46 2.02 -0.15 0.00 0.02 0.00 0.00 61.00 63.35 3d4l s PRO 181 Cb -0.10 -1.92 -0.08 0.00 0.02 0.00 0.00 34.50 32.43 3d4l s PRO 181 CO 0.33 -1.44 0.92 -1.12 -0.33 0.00 0.00 177.00 175.36 3d4l s SER 182 N -1.39 6.62 -0.20 2.53 0.01 -1.26 -4.69 113.70 115.32 3d4l s SER 182 Ca 0.80 1.46 -0.06 0.00 1.31 0.00 0.00 55.95 59.46 3d4l s SER 182 Cb -0.36 -2.46 -0.03 0.00 0.21 0.00 0.00 66.02 63.38 3d4l s SER 182 CO 0.39 -0.52 0.02 -0.31 0.41 0.00 0.00 173.24 173.24 3d4l s TYR 183 N -2.52 3.08 0.12 2.43 2.02 0.19 -4.92 117.35 117.76 3d4l s TYR 183 Ca 0.57 -0.35 -0.30 0.00 -0.37 0.00 0.00 57.07 56.62 3d4l s TYR 183 Cb -0.10 -2.11 -0.06 0.00 -0.40 0.00 0.00 41.96 39.29 3d4l s TYR 183 CO 0.30 -0.19 1.02 0.50 -1.57 0.00 0.00 175.55 175.61 3d4l s ARG 184 N 0.98 4.65 -0.21 -0.62 3.52 -1.26 -1.35 118.95 124.66 3d4l s ARG 184 Ca 0.02 1.55 0.11 0.00 -0.13 0.00 0.00 55.73 57.29 3d4l s ARG 184 Cb -0.14 -3.35 -0.20 0.00 -1.56 0.00 0.00 34.95 29.70 3d4l s ARG 184 CO 0.02 0.13 -0.04 -0.89 -0.81 0.00 0.00 175.30 173.72 3d4l n ILE 185 N 2.76 1.33 -4.19 4.11 2.08 0.79 -4.90 119.36 121.34 3d4l n ILE 185 Ca 0.03 -0.70 -0.18 0.00 0.56 0.00 0.00 62.75 62.46 3d4l n ILE 185 Cb 0.48 -0.82 -0.12 0.00 -0.75 0.00 0.00 39.64 38.43 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 -2.47 1.17 0.00 1.39 -4.23 -1.22 -4.92 115.64 105.36 3d4l s THR 186 Ca -0.18 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 3d4l s THR 186 Cb 0.07 -1.20 0.00 0.00 1.34 0.00 0.00 72.50 72.71 3d4l s THR 186 CO 0.69 -0.27 0.51 0.79 -0.54 0.00 0.00 174.62 175.81 3d4l n TRP 187 N 1.09 0.00 1.05 3.99 8.01 -1.26 -4.54 117.44 125.78 3d4l n TRP 187 Ca -0.20 -0.11 0.12 0.00 -1.31 0.00 0.00 57.50 56.00 3d4l n TRP 187 Cb 0.55 -0.01 0.19 0.00 -2.01 0.00 0.00 31.31 30.02 3d4l n TRP 187 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 3d4l n THR 188 N -0.11 0.00 -1.60 -0.99 -2.24 -1.26 -4.98 114.28 103.11 3d4l n THR 188 Ca 0.00 -0.04 -0.45 0.00 -2.27 0.00 0.00 64.05 61.29 3d4l n THR 188 Cb 0.14 0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 68.83 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 1.46 -0.16 3.59 3.38 0.00 -1.26 -4.67 105.19 107.54 3d4l n GLY 189 Ca 0.07 0.35 -0.02 0.00 0.00 0.00 0.00 46.02 46.41 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 -1.44 0.54 -0.07 1.61 2.20 -0.83 -4.91 119.74 116.84 3d4l s LYS 190 Ca 0.60 1.40 -0.41 0.00 -0.36 0.00 0.00 55.97 57.20 3d4l s LYS 190 Cb -0.70 0.80 -0.19 0.00 -1.51 0.00 0.00 37.83 36.22 3d4l s LYS 190 CO 0.59 -0.21 1.21 -1.91 -0.36 0.00 0.00 175.35 174.67 3d4l n GLU 191 N 5.44 0.19 -0.83 4.03 2.13 -1.26 -0.50 120.64 129.83 3d4l n GLU 191 Ca -0.11 0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.77 3d4l n GLU 191 Cb 0.49 -1.59 0.00 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 2.13 -3.63 0.07 4.31 8.00 -1.26 -4.70 116.55 121.47 3d4l n ASP 192 Ca 0.22 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.72 3d4l n ASP 192 Cb 0.08 -2.89 0.00 0.00 -0.02 0.00 0.00 41.12 38.29 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 -2.06 0.91 -4.40 0.53 2.08 0.34 -4.72 119.36 112.05 3d4l n ILE 193 Ca 0.00 0.30 -0.33 0.00 0.56 0.00 0.00 62.75 63.28 3d4l n ILE 193 Cb 0.29 -1.31 -0.16 0.00 -0.75 0.00 0.00 39.64 37.71 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 -1.98 2.35 -0.25 1.39 -1.09 -0.27 -0.37 121.20 120.97 3d4l s ILE 194 Ca 0.00 -0.87 -0.03 0.00 -2.23 0.00 0.00 60.65 57.53 3d4l s ILE 194 Cb 0.00 -1.98 0.02 0.00 -1.58 0.00 0.00 42.46 38.92 3d4l s ILE 194 CO 0.00 0.53 -0.04 -0.31 -1.23 0.00 0.00 174.94 173.89 3d4l s TYR 195 N 1.01 3.08 -0.23 3.97 1.51 -0.04 -1.96 117.35 124.67 3d4l s TYR 195 Ca -0.02 -1.43 -0.06 0.00 -1.01 0.00 0.00 57.07 54.55 3d4l s TYR 195 Cb -0.15 -2.09 -0.02 0.00 -0.11 0.00 0.00 41.96 39.59 3d4l s TYR 195 CO -0.05 -0.69 0.02 -0.80 -1.11 0.00 0.00 175.55 172.92 3d4l s ASN 196 N 1.36 4.80 0.00 2.29 0.01 -0.88 -0.82 114.94 121.71 3d4l s ASN 196 Ca 0.01 -0.27 0.00 0.00 -0.71 0.00 0.00 52.86 51.88 3d4l s ASN 196 Cb -0.17 -1.85 0.00 0.00 0.41 0.00 0.00 41.25 39.65 3d4l s ASN 196 CO -0.03 -0.02 0.00 0.61 -1.51 0.00 0.00 177.10 176.15 3d4l n GLY 197 N 4.82 1.63 3.13 0.66 0.00 -0.39 -4.40 105.19 110.64 3d4l n GLY 197 Ca -0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.63 0.70 0.54 -0.61 -4.36 -1.26 -0.35 121.20 112.22 3d4l s ILE 198 Ca 0.00 -1.51 -0.06 0.00 -0.26 0.00 0.00 60.65 58.82 3d4l s ILE 198 Cb 0.00 -1.17 -0.02 0.00 1.25 0.00 0.00 42.46 42.52 3d4l s ILE 198 CO 0.00 -0.59 0.86 0.42 0.24 0.00 0.00 174.94 175.87 3d4l s THR 199 N -2.40 4.36 0.23 8.37 -4.23 -0.05 -4.71 115.64 117.21 3d4l s THR 199 Ca 0.01 0.18 -0.01 0.00 -1.18 0.00 0.00 61.69 60.70 3d4l s THR 199 Cb -0.03 -3.69 0.05 0.00 1.34 0.00 0.00 72.50 70.17 3d4l s THR 199 CO -0.01 -0.72 0.32 -0.90 -0.54 0.00 0.00 174.62 172.77 3d4l n ASP 200 N -2.45 0.35 0.12 3.99 5.75 -1.26 -4.79 116.55 118.26 3d4l n ASP 200 Ca 0.03 -1.32 -0.13 0.00 -0.01 0.00 0.00 54.79 53.36 3d4l n ASP 200 Cb 0.56 -0.22 -0.06 0.00 -1.03 0.00 0.00 41.12 40.37 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 -0.57 -0.37 -0.34 2.11 7.01 -2.00 -1.98 115.95 119.81 3d4l h TRP 201 Ca -0.11 0.00 -0.12 0.00 2.11 0.00 0.00 58.89 60.78 3d4l h TRP 201 Cb 0.37 0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.57 3d4l h TRP 201 CO 0.00 -0.22 -0.28 -0.24 -2.79 0.00 0.00 178.44 174.91 3d4l h VAL 202 N -0.32 1.28 -0.36 2.65 3.04 -1.95 -2.16 116.25 118.43 3d4l h VAL 202 Ca 0.00 -1.40 -0.11 0.00 -1.01 0.00 0.00 66.70 64.18 3d4l h VAL 202 Cb 0.30 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 30.88 3d4l h VAL 202 CO -0.04 0.46 -0.24 1.88 -1.01 0.00 0.00 177.57 178.62 3d4l h TYR 203 N 0.61 0.81 0.03 3.17 -1.99 -1.93 -0.16 116.97 117.52 3d4l h TYR 203 Ca 0.08 -0.19 -0.00 0.00 2.00 0.00 0.00 58.73 60.62 3d4l h TYR 203 Cb 0.79 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 39.33 3d4l h TYR 203 CO 0.04 0.88 -0.01 1.49 -0.00 0.00 0.00 178.16 180.56 3d4l h GLU 204 N 0.62 -0.03 -0.04 4.88 4.81 -1.22 -0.07 114.58 123.53 3d4l h GLU 204 Ca 0.09 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 3d4l h GLU 204 Cb 0.73 0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.12 3d4l h GLU 204 CO 0.06 0.09 -0.35 1.49 -0.73 0.00 0.00 179.01 179.57 3d4l h GLU 205 N -0.15 0.31 0.00 1.92 4.57 -1.35 -1.29 114.58 118.58 3d4l h GLU 205 Ca -0.00 -0.28 0.00 0.00 -1.18 0.00 0.00 59.36 57.90 3d4l h GLU 205 Cb 0.14 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 3d4l h GLU 205 CO 0.01 0.94 -1.70 0.39 -1.18 0.00 0.00 179.01 177.48 3d4l n GLU 206 N -4.41 0.63 -0.03 1.92 -0.58 -0.08 -4.48 120.64 113.61 3d4l n GLU 206 Ca -0.09 -0.14 -0.06 0.00 -0.42 0.00 0.00 57.16 56.44 3d4l n GLU 206 Cb 0.53 -1.44 -0.02 0.00 -0.57 0.00 0.00 31.44 29.94 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 -2.03 1.24 0.53 2.62 0.31 -0.93 -4.84 118.33 115.23 3d4l n VAL 207 Ca -0.02 0.18 0.11 0.00 -0.01 0.00 0.00 64.34 64.60 3d4l n VAL 207 Cb 0.46 -1.91 -0.04 0.00 -0.91 0.00 0.00 33.84 31.44 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 -3.90 0.18 -4.03 3.52 3.72 -0.08 -4.97 117.46 111.89 3d4l n PHE 208 Ca -0.11 0.05 -0.32 0.00 -0.05 0.00 0.00 57.45 57.02 3d4l n PHE 208 Cb 0.34 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 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 -1.94 -3.72 -3.51 4.37 7.64 -0.50 -4.91 113.62 111.04 3d4l n SER 209 Ca 0.01 -0.89 -0.11 0.00 1.01 0.00 0.00 58.87 58.89 3d4l n SER 209 Cb 0.44 -3.38 -0.03 0.00 -1.01 0.00 0.00 64.21 60.23 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 -3.36 -1.80 -0.00 -0.43 0.00 -1.12 -4.97 121.76 110.08 3d4l s ALA 210 Ca 0.62 1.08 0.06 0.00 0.00 0.00 0.00 51.96 53.72 3d4l s ALA 210 Cb -0.32 0.21 -0.24 0.00 0.00 0.00 0.00 23.12 22.77 3d4l s ALA 210 CO 0.87 -0.58 0.82 -0.92 0.00 0.00 0.00 175.76 175.95 3d4l h TYR 211 N 2.25 0.14 -3.90 0.00 3.20 -1.87 -3.39 116.97 113.40 3d4l h TYR 211 Ca -0.24 -0.11 -0.50 0.00 3.14 0.00 0.00 58.73 61.02 3d4l h TYR 211 Cb 1.22 -0.01 0.03 0.00 1.54 0.00 0.00 36.73 39.52 3d4l h TYR 211 CO 0.28 1.15 0.47 -1.54 -1.64 0.00 0.00 178.16 176.88 3d4l s SER 212 N -6.51 6.83 -0.33 -2.11 1.04 -1.26 -0.87 113.70 110.49 3d4l s SER 212 Ca -0.06 2.25 0.16 0.00 0.48 0.00 0.00 55.95 58.78 3d4l s SER 212 Cb 0.08 -2.61 0.46 0.00 0.10 0.00 0.00 66.02 64.05 3d4l s SER 212 CO 0.83 -0.45 1.00 0.00 0.98 0.00 0.00 173.24 175.59 3d4l n ALA 213 N 0.40 3.66 -2.97 5.32 0.00 0.52 -4.66 120.51 122.78 3d4l n ALA 213 Ca 0.03 -3.32 -0.10 0.00 0.00 0.00 0.00 53.44 50.05 3d4l n ALA 213 Cb 0.47 -0.85 -0.12 0.00 0.00 0.00 0.00 19.45 18.95 3d4l n ALA 213 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 3d4l s LEU 214 N -3.28 2.04 -0.15 0.00 0.05 -1.25 -1.80 118.68 114.29 3d4l s LEU 214 Ca 0.31 -0.29 -0.04 0.00 0.05 0.00 0.00 54.13 54.17 3d4l s LEU 214 Cb 0.43 0.18 0.05 0.00 -2.05 0.00 0.00 46.19 44.81 3d4l s LEU 214 CO -0.01 -0.22 0.07 0.26 -0.55 0.00 0.00 176.35 175.90 3d4l s TRP 215 N -0.99 0.32 0.38 3.48 0.51 0.97 -4.98 118.94 118.62 3d4l s TRP 215 Ca -0.11 -0.29 -0.25 0.00 -2.12 0.00 0.00 56.10 53.32 3d4l s TRP 215 Cb -0.07 -0.71 -0.09 0.00 -0.81 0.00 0.00 33.47 31.79 3d4l s TRP 215 CO -0.00 -0.46 1.09 -1.58 -0.51 0.00 0.00 176.95 175.49 3d4l s TRP 216 N 2.09 3.26 0.85 -1.98 0.52 -1.26 -0.76 118.94 121.67 3d4l s TRP 216 Ca 0.02 1.63 -0.11 0.00 0.02 0.00 0.00 56.10 57.66 3d4l s TRP 216 Cb -0.15 -3.23 0.10 0.00 -1.15 0.00 0.00 33.47 29.03 3d4l s TRP 216 CO -0.08 -0.81 1.09 -1.54 0.02 0.00 0.00 176.95 175.63 3d4l s SER 217 N -1.32 3.93 0.27 2.95 1.04 0.01 -4.89 113.70 115.69 3d4l s SER 217 Ca 0.55 1.47 -0.03 0.00 0.48 0.00 0.00 55.95 58.43 3d4l s SER 217 Cb -0.26 -2.18 0.58 0.00 0.10 0.00 0.00 66.02 64.26 3d4l s SER 217 CO 0.33 -2.35 1.63 -0.65 0.98 0.00 0.00 173.24 173.18 3d4l h PRO 218 N -1.35 0.11 -0.62 4.02 0.11 -1.91 -1.16 132.00 131.21 3d4l h PRO 218 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3d4l h PRO 218 Cb 1.27 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3d4l h PRO 218 CO 0.56 0.07 0.00 0.27 -0.21 0.00 0.00 178.00 178.69 3d4l n ASN 219 N -5.34 3.78 0.00 -2.05 0.23 -1.26 -4.43 115.26 106.19 3d4l n ASN 219 Ca 0.18 -1.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.23 3d4l n ASN 219 Cb 0.59 -0.41 0.00 0.00 -2.08 0.00 0.00 39.78 37.88 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 1.57 0.82 0.11 4.83 0.00 -0.44 -4.66 105.19 107.42 3d4l n GLY 220 Ca 0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 0.98 -2.93 2.61 2.02 -1.93 -3.45 112.91 110.20 3d4l h THR 221 Ca 0.00 -0.49 -0.60 0.00 0.77 0.00 0.00 66.41 66.08 3d4l h THR 221 Cb 0.00 1.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 3d4l h THR 221 CO 0.00 0.12 -0.45 -0.36 0.37 0.00 0.00 175.52 175.20 3d4l s PHE 222 N -5.21 3.51 -0.19 3.16 0.08 -1.26 -0.72 117.98 117.35 3d4l s PHE 222 Ca -0.15 0.31 0.01 0.00 0.12 0.00 0.00 56.93 57.22 3d4l s PHE 222 Cb 0.03 -1.81 0.04 0.00 -0.57 0.00 0.00 43.02 40.72 3d4l s PHE 222 CO 0.63 0.54 -0.09 -1.17 -0.10 0.00 0.00 175.22 175.03 3d4l s LEU 223 N -2.63 2.17 0.10 -0.37 2.96 0.25 -0.81 118.68 120.35 3d4l s LEU 223 Ca 0.36 -0.85 -0.00 0.00 -0.22 0.00 0.00 54.13 53.42 3d4l s LEU 223 Cb -0.13 -1.18 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 3d4l s LEU 223 CO 0.27 -0.15 0.27 0.00 -1.32 0.00 0.00 176.35 175.42 3d4l s ALA 224 N 1.43 3.95 0.10 5.97 0.00 0.06 -1.16 121.76 132.12 3d4l s ALA 224 Ca -0.01 -0.82 -0.24 0.00 0.00 0.00 0.00 51.96 50.88 3d4l s ALA 224 Cb -0.16 -1.89 0.07 0.00 0.00 0.00 0.00 23.12 21.14 3d4l s ALA 224 CO -0.08 0.72 0.59 1.52 0.00 0.00 0.00 175.76 178.51 3d4l s TYR 225 N -1.60 -0.53 0.16 0.00 1.13 0.21 -0.02 117.35 116.69 3d4l s TYR 225 Ca 0.36 0.49 0.05 0.00 -1.41 0.00 0.00 57.07 56.56 3d4l s TYR 225 Cb -0.12 0.48 -0.04 0.00 -1.10 0.00 0.00 41.96 41.18 3d4l s TYR 225 CO 0.28 -0.76 0.15 0.00 -2.51 0.00 0.00 175.55 172.70 3d4l s ALA 226 N -3.03 3.61 -0.11 9.51 0.00 -0.75 -1.03 121.76 129.98 3d4l s ALA 226 Ca -0.02 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.76 3d4l s ALA 226 Cb -0.01 -1.41 0.02 0.00 0.00 0.00 0.00 23.12 21.72 3d4l s ALA 226 CO -0.06 0.52 -0.09 -1.14 0.00 0.00 0.00 175.76 174.98 3d4l s GLN 227 N -3.08 1.66 -0.11 0.00 0.74 0.43 -1.26 119.66 118.04 3d4l s GLN 227 Ca 0.31 -0.33 -0.03 0.00 0.05 0.00 0.00 55.36 55.37 3d4l s GLN 227 Cb -0.10 -1.61 -0.03 0.00 1.10 0.00 0.00 33.01 32.37 3d4l s GLN 227 CO 0.24 -0.19 -0.00 -0.06 -0.55 0.00 0.00 175.29 174.72 3d4l s PHE 228 N 1.44 3.13 -0.30 1.67 0.08 0.00 -1.29 117.98 122.71 3d4l s PHE 228 Ca 0.00 0.05 -0.00 0.00 0.12 0.00 0.00 56.93 57.10 3d4l s PHE 228 Cb -0.13 -1.87 0.06 0.00 -0.57 0.00 0.00 43.02 40.51 3d4l s PHE 228 CO -0.06 0.30 -0.01 1.21 -0.10 0.00 0.00 175.22 176.56 3d4l s ASN 229 N -0.41 4.79 -0.28 1.36 3.84 -0.27 -0.86 114.94 123.11 3d4l s ASN 229 Ca 0.08 -1.43 0.12 0.00 0.21 0.00 0.00 52.86 51.84 3d4l s ASN 229 Cb -0.12 -1.67 0.67 0.00 -0.55 0.00 0.00 41.25 39.58 3d4l s ASN 229 CO 0.02 -0.27 1.67 0.47 -2.79 0.00 0.00 177.10 176.20 3d4l n ASP 230 N 4.54 4.40 -0.27 -4.21 9.92 0.50 -1.76 116.55 129.67 3d4l n ASP 230 Ca -0.11 -3.22 0.09 0.00 -0.53 0.00 0.00 54.79 51.01 3d4l n ASP 230 Cb 0.43 -0.68 0.23 0.00 -0.64 0.00 0.00 41.12 40.46 3d4l n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 3d4l h THR 231 N 2.37 0.50 -0.43 -3.53 2.02 -1.85 -2.34 112.91 109.65 3d4l h THR 231 Ca 0.17 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.24 3d4l h THR 231 Cb 2.00 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 3d4l h THR 231 CO 0.55 0.06 0.00 -0.62 0.37 0.00 0.00 175.52 175.88 3d4l n GLU 232 N -5.11 3.09 -2.63 6.66 1.02 -1.26 -4.95 120.64 117.46 3d4l n GLU 232 Ca 0.17 -2.49 -0.42 0.00 -0.02 0.00 0.00 57.16 54.40 3d4l n GLU 232 Cb 0.53 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 30.35 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 -1.64 4.63 0.76 2.62 1.01 -0.88 -4.70 120.40 122.21 3d4l s VAL 233 Ca 0.36 1.90 -0.13 0.00 0.00 0.00 0.00 61.98 64.11 3d4l s VAL 233 Cb 0.23 -4.22 0.06 0.00 0.00 0.00 0.00 36.38 32.45 3d4l s VAL 233 CO 0.18 0.09 1.14 -2.84 0.00 0.00 0.00 175.10 173.67 3d4l s PRO 234 N 1.42 2.11 -0.09 2.72 0.02 -1.26 -4.71 135.00 135.21 3d4l s PRO 234 Ca 0.53 1.47 -0.02 0.00 0.02 0.00 0.00 61.00 63.00 3d4l s PRO 234 Cb -0.22 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.41 3d4l s PRO 234 CO 0.25 -1.80 -0.01 -0.51 -0.33 0.00 0.00 177.00 174.60 3d4l s LEU 235 N -5.58 3.48 0.12 -5.54 1.02 -1.26 -1.28 118.68 109.65 3d4l s LEU 235 Ca 0.67 0.09 -0.21 0.00 0.02 0.00 0.00 54.13 54.71 3d4l s LEU 235 Cb -0.22 -1.79 -0.07 0.00 0.02 0.00 0.00 46.19 44.12 3d4l s LEU 235 CO 0.50 0.36 0.64 -0.51 0.02 0.00 0.00 176.35 177.36 3d4l s ILE 236 N -0.75 4.61 -0.04 -0.59 1.10 -0.32 -4.86 121.20 120.35 3d4l s ILE 236 Ca 0.12 1.36 0.04 0.00 -0.51 0.00 0.00 60.65 61.65 3d4l s ILE 236 Cb -0.11 -3.97 0.00 0.00 0.15 0.00 0.00 42.46 38.53 3d4l s ILE 236 CO 0.02 0.51 -0.15 -1.61 -2.11 0.00 0.00 174.94 171.61 3d4l s GLU 237 N -1.22 1.61 0.08 3.50 2.02 -1.26 -1.61 118.70 121.82 3d4l s GLU 237 Ca 0.32 -0.51 -0.15 0.00 0.02 0.00 0.00 54.97 54.66 3d4l s GLU 237 Cb -0.20 -1.39 0.03 0.00 0.10 0.00 0.00 34.13 32.66 3d4l s GLU 237 CO 0.21 0.17 0.34 1.52 0.02 0.00 0.00 175.26 177.53 3d4l s TYR 238 N 0.19 -0.13 0.32 1.61 1.13 -0.88 -4.98 117.35 114.61 3d4l s TYR 238 Ca -0.06 -0.09 -0.17 0.00 -1.41 0.00 0.00 57.07 55.34 3d4l s TYR 238 Cb -0.12 0.15 -0.09 0.00 -1.10 0.00 0.00 41.96 40.81 3d4l s TYR 238 CO 0.02 -0.59 0.76 -1.12 -2.51 0.00 0.00 175.55 172.11 3d4l s SER 239 N -2.44 6.86 -0.12 -0.18 0.01 -1.26 -0.31 113.70 116.26 3d4l s SER 239 Ca -0.01 1.37 0.00 0.00 1.31 0.00 0.00 55.95 58.62 3d4l s SER 239 Cb 0.01 -2.41 0.02 0.00 0.21 0.00 0.00 66.02 63.86 3d4l s SER 239 CO -0.07 -0.17 -0.10 0.12 0.41 0.00 0.00 173.24 173.42 3d4l s PHE 240 N -1.91 1.71 0.03 2.43 5.36 0.11 -4.70 117.98 121.01 3d4l s PHE 240 Ca 0.53 -0.88 0.06 0.00 -0.96 0.00 0.00 56.93 55.68 3d4l s PHE 240 Cb -0.12 -1.34 -0.24 0.00 -0.34 0.00 0.00 43.02 40.99 3d4l s PHE 240 CO 0.18 -0.54 0.96 1.88 -1.46 0.00 0.00 175.22 176.23 3d4l h TYR 241 N 8.03 0.14 -1.04 10.12 -1.99 -1.96 -0.37 116.97 129.90 3d4l h TYR 241 Ca -0.32 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.30 3d4l h TYR 241 Cb 1.14 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.86 3d4l h TYR 241 CO 0.47 1.12 0.00 0.45 -0.00 0.00 0.00 178.16 180.20 3d4l n SER 242 N -3.29 -3.11 -4.71 3.88 2.88 -1.26 -4.75 113.62 103.26 3d4l n SER 242 Ca -0.10 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.10 3d4l n SER 242 Cb 1.01 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 64.58 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 3.88 0.60 -3.46 1.01 -1.26 -4.86 116.67 108.57 3d4l s ASP 243 Ca 0.00 2.37 0.30 0.00 0.71 0.00 0.00 52.55 55.93 3d4l s ASP 243 Cb 0.00 -2.59 1.73 0.00 1.01 0.00 0.00 42.92 43.07 3d4l s ASP 243 CO 0.00 -2.48 2.12 -0.08 0.21 0.00 0.00 175.17 174.94 3d4l h GLU 244 N -0.61 0.00 0.00 8.23 4.81 -2.05 -1.81 114.58 123.15 3d4l h GLU 244 Ca -0.47 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.72 3d4l h GLU 244 Cb 1.30 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 3d4l h GLU 244 CO 0.48 0.00 -0.21 0.66 -0.73 0.00 0.00 179.01 179.21 3d4l h SER 245 N 0.00 0.00 -2.74 1.04 4.64 -1.93 -3.42 113.55 111.14 3d4l h SER 245 Ca 0.07 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.82 3d4l h SER 245 Cb 0.43 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 3d4l h SER 245 CO -0.00 0.21 1.14 -0.22 -0.87 0.00 0.00 176.83 177.08 3d4l s LEU 246 N -7.36 3.90 0.10 5.97 2.96 -0.68 -4.91 118.68 118.66 3d4l s LEU 246 Ca -0.02 1.66 -0.15 0.00 -0.22 0.00 0.00 54.13 55.39 3d4l s LEU 246 Cb 0.13 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 43.22 3d4l s LEU 246 CO 0.63 -1.26 1.47 -0.61 -1.32 0.00 0.00 176.35 175.26 3d4l h GLN 247 N 10.80 0.66 -5.50 1.98 4.15 -1.89 -3.43 115.11 121.87 3d4l h GLN 247 Ca -0.34 -0.29 -0.66 0.00 0.77 0.00 0.00 58.65 58.14 3d4l h GLN 247 Cb 1.16 -0.02 -0.24 0.00 0.21 0.00 0.00 27.48 28.59 3d4l h GLN 247 CO 1.00 0.87 -0.73 0.71 -1.93 0.00 0.00 178.83 178.76 3d4l s TYR 248 N -4.61 2.89 0.66 3.99 2.02 -1.26 -5.10 117.35 115.93 3d4l s TYR 248 Ca -0.13 -0.41 -0.17 0.00 -0.37 0.00 0.00 57.07 55.99 3d4l s TYR 248 Cb 0.09 -1.84 -0.00 0.00 -0.40 0.00 0.00 41.96 39.80 3d4l s TYR 248 CO 0.80 -0.05 1.23 -2.14 -1.57 0.00 0.00 175.55 173.82 3d4l s PRO 249 N 0.11 2.56 0.07 -1.71 0.02 -1.26 -4.99 135.00 129.80 3d4l s PRO 249 Ca -0.04 1.86 -0.11 0.00 0.02 0.00 0.00 61.00 62.73 3d4l s PRO 249 Cb -0.14 -1.87 -0.06 0.00 0.02 0.00 0.00 34.50 32.45 3d4l s PRO 249 CO 0.04 -1.54 0.42 0.21 -0.33 0.00 0.00 177.00 175.80 3d4l s LYS 250 N -3.57 3.82 -0.34 5.54 2.20 -0.15 -4.90 119.74 122.33 3d4l s LYS 250 Ca 0.78 0.26 -0.12 0.00 -0.36 0.00 0.00 55.97 56.53 3d4l s LYS 250 Cb -0.32 -3.04 -0.01 0.00 -1.51 0.00 0.00 37.83 32.96 3d4l s LYS 250 CO 0.39 0.58 0.22 0.99 -0.36 0.00 0.00 175.35 177.17 3d4l s THR 251 N -1.33 5.01 0.04 3.43 2.01 -1.26 0.05 115.64 123.58 3d4l s THR 251 Ca 0.31 -0.40 -0.26 0.00 0.31 0.00 0.00 61.69 61.66 3d4l s THR 251 Cb -0.15 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.70 3d4l s THR 251 CO 0.17 -0.05 0.82 -0.69 -0.69 0.00 0.00 174.62 174.18 3d4l s VAL 252 N 1.67 4.74 -0.10 3.82 1.01 0.58 -4.91 120.40 127.20 3d4l s VAL 252 Ca 0.05 1.73 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3d4l s VAL 252 Cb -0.18 -4.16 0.02 0.00 0.00 0.00 0.00 36.38 32.06 3d4l s VAL 252 CO 0.09 0.32 -0.09 -0.13 0.00 0.00 0.00 175.10 175.29 3d4l s ARG 253 N 0.18 1.60 -0.07 2.72 0.52 -1.26 -2.07 118.95 120.58 3d4l s ARG 253 Ca 0.41 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 55.32 3d4l s ARG 253 Cb -0.21 -1.56 0.02 0.00 0.52 0.00 0.00 34.95 33.72 3d4l s ARG 253 CO 0.24 -0.19 -0.06 0.08 0.02 0.00 0.00 175.30 175.39 3d4l s VAL 254 N 1.44 0.75 -0.05 3.52 1.01 -0.64 -4.96 120.40 121.47 3d4l s VAL 254 Ca 0.00 -0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 3d4l s VAL 254 Cb -0.13 -0.77 -0.07 0.00 0.00 0.00 0.00 36.38 35.41 3d4l s VAL 254 CO -0.05 0.29 1.90 -2.84 0.00 0.00 0.00 175.10 174.40 3d4l s PRO 255 N 1.17 3.95 -0.19 2.72 0.02 -1.26 -1.17 135.00 140.23 3d4l s PRO 255 Ca -0.06 2.32 -0.04 0.00 0.02 0.00 0.00 61.00 63.24 3d4l s PRO 255 Cb -0.14 -4.15 0.09 0.00 0.02 0.00 0.00 34.50 30.33 3d4l s PRO 255 CO -0.01 -1.16 0.28 -0.47 -0.33 0.00 0.00 177.00 175.31 3d4l s TYR 256 N 5.08 -0.47 -0.35 6.54 6.14 -0.40 -4.45 117.35 129.44 3d4l s TYR 256 Ca 0.85 0.64 -0.24 0.00 0.64 0.00 0.00 57.07 58.96 3d4l s TYR 256 Cb -0.37 -0.15 0.01 0.00 0.42 0.00 0.00 41.96 41.87 3d4l s TYR 256 CO 0.37 -0.56 0.84 -1.25 0.64 0.00 0.00 175.55 175.60 3d4l s PRO 257 N 2.42 3.83 0.77 4.97 0.04 -1.26 -4.53 135.00 141.23 3d4l s PRO 257 Ca 0.06 0.48 -0.12 0.00 0.04 0.00 0.00 61.00 61.47 3d4l s PRO 257 Cb -0.14 -3.79 0.05 0.00 0.04 0.00 0.00 34.50 30.66 3d4l s PRO 257 CO -0.12 -0.86 1.14 0.15 0.04 0.00 0.00 177.00 177.36 3d4l s LYS 258 N 3.23 2.31 0.00 4.56 1.02 -1.26 -0.34 119.74 129.26 3d4l s LYS 258 Ca 0.34 0.23 -0.37 0.00 0.02 0.00 0.00 55.97 56.20 3d4l s LYS 258 Cb -0.13 -1.99 -0.16 0.00 -0.52 0.00 0.00 37.83 35.04 3d4l s LYS 258 CO 0.17 -1.37 1.51 0.00 -0.92 0.00 0.00 175.35 174.74 3d4l n ALA 259 N -3.18 -0.26 -0.19 5.17 0.00 0.09 -1.18 120.51 120.95 3d4l n ALA 259 Ca 0.08 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.97 3d4l n ALA 259 Cb 0.60 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.86 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 3.19 2.12 3.90 0.00 0.00 -1.26 -4.83 105.19 108.31 3d4l n GLY 260 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.02 2.24 -0.01 4.61 0.00 -0.33 -4.99 121.76 120.27 3d4l s ALA 261 Ca 0.00 -1.01 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 3d4l s ALA 261 Cb 0.00 -2.84 -0.06 0.00 0.00 0.00 0.00 23.12 20.22 3d4l s ALA 261 CO 0.00 -2.28 1.56 0.08 0.00 0.00 0.00 175.76 175.12 3d4l s VAL 262 N -3.73 3.50 0.45 0.00 1.01 -1.26 -4.91 120.40 115.46 3d4l s VAL 262 Ca 0.70 0.80 -0.04 0.00 0.00 0.00 0.00 61.98 63.44 3d4l s VAL 262 Cb -0.07 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 3d4l s VAL 262 CO 0.52 -0.03 0.73 0.20 0.00 0.00 0.00 175.10 176.52 3d4l s ASN 263 N 2.59 6.23 0.67 3.32 0.01 -1.26 -4.36 114.94 122.13 3d4l s ASN 263 Ca 0.70 0.79 -0.14 0.00 -0.71 0.00 0.00 52.86 53.49 3d4l s ASN 263 Cb -0.34 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.17 3d4l s ASN 263 CO 0.29 -0.53 1.10 -2.16 -1.51 0.00 0.00 177.10 174.28 3d4l s PRO 264 N -4.64 2.80 0.29 -0.60 0.04 -1.26 -4.79 135.00 126.84 3d4l s PRO 264 Ca 0.46 1.32 0.08 0.00 0.04 0.00 0.00 61.00 62.89 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 0.43 -1.24 0.21 0.95 0.04 0.00 0.00 177.00 177.39 3d4l s THR 265 N -2.46 3.92 0.03 1.26 -4.23 -0.72 -4.92 115.64 108.51 3d4l s THR 265 Ca 0.65 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 59.71 3d4l s THR 265 Cb -0.19 -3.24 -0.02 0.00 1.34 0.00 0.00 72.50 70.39 3d4l s THR 265 CO 0.43 -0.28 -0.04 0.54 -0.54 0.00 0.00 174.62 174.73 3d4l s VAL 266 N -2.24 0.23 0.06 2.29 0.11 -1.26 -1.12 120.40 118.48 3d4l s VAL 266 Ca 0.36 -0.94 0.02 0.00 -2.93 0.00 0.00 61.98 58.49 3d4l s VAL 266 Cb -0.07 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.40 3d4l s VAL 266 CO 0.25 -0.46 -0.07 -0.54 -3.33 0.00 0.00 175.10 170.95 3d4l s LYS 267 N -1.47 0.63 -0.03 1.54 1.02 -0.41 -4.98 119.74 116.04 3d4l s LYS 267 Ca -0.14 -0.98 0.05 0.00 0.02 0.00 0.00 55.97 54.92 3d4l s LYS 267 Cb -0.10 -0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 36.98 3d4l s LYS 267 CO -0.01 0.01 -0.17 0.12 -0.92 0.00 0.00 175.35 174.39 3d4l s PHE 268 N -2.30 1.65 0.08 3.18 5.36 -1.26 -0.43 117.98 124.27 3d4l s PHE 268 Ca -0.02 -0.42 0.01 0.00 -0.96 0.00 0.00 56.93 55.54 3d4l s PHE 268 Cb -0.04 -1.10 -0.04 0.00 -0.34 0.00 0.00 43.02 41.50 3d4l s PHE 268 CO -0.02 -0.12 -0.05 -0.06 -1.46 0.00 0.00 175.22 173.51 3d4l s PHE 269 N -0.10 0.75 -0.04 10.12 0.40 -0.20 -0.91 117.98 128.01 3d4l s PHE 269 Ca -0.01 -0.94 0.01 0.00 -0.60 0.00 0.00 56.93 55.40 3d4l s PHE 269 Cb -0.10 -0.46 0.02 0.00 0.51 0.00 0.00 43.02 42.98 3d4l s PHE 269 CO 0.01 -0.22 -0.05 0.08 0.70 0.00 0.00 175.22 175.74 3d4l s VAL 270 N -3.57 0.52 0.01 -0.44 1.01 0.00 -0.62 120.40 117.30 3d4l s VAL 270 Ca 0.09 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.00 3d4l s VAL 270 Cb 0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 3d4l s VAL 270 CO -0.06 0.21 -0.22 0.54 0.00 0.00 0.00 175.10 175.57 3d4l s VAL 271 N 0.73 1.74 -0.60 2.92 0.11 -0.31 -0.28 120.40 124.71 3d4l s VAL 271 Ca -0.10 -1.07 -0.23 0.00 -2.93 0.00 0.00 61.98 57.66 3d4l s VAL 271 Cb -0.13 -1.47 0.06 0.00 -1.53 0.00 0.00 36.38 33.31 3d4l s VAL 271 CO 0.00 0.37 0.91 0.21 -3.33 0.00 0.00 175.10 173.27 3d4l s ASN 272 N -0.82 6.24 0.48 3.54 3.04 -1.26 -0.58 114.94 125.58 3d4l s ASN 272 Ca 0.08 -0.74 0.31 0.00 0.04 0.00 0.00 52.86 52.56 3d4l s ASN 272 Cb -0.09 -2.41 1.26 0.00 -1.54 0.00 0.00 41.25 38.47 3d4l s ASN 272 CO 0.00 -1.29 1.91 0.71 -3.04 0.00 0.00 177.10 175.40 3d4l h THR 273 N 5.98 0.00 0.00 -5.21 1.35 -1.23 -2.72 112.91 111.08 3d4l h THR 273 Ca -0.28 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3d4l h THR 273 Cb 1.07 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 3d4l h THR 273 CO 1.12 0.00 0.00 0.44 -0.25 0.00 0.00 175.52 176.83 3d4l h ASP 274 N 0.00 0.00 0.33 5.36 3.32 -1.88 -2.81 116.42 120.75 3d4l h ASP 274 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3d4l h ASP 274 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3d4l h ASP 274 CO 0.00 0.00 -0.59 -1.54 -1.72 0.00 0.00 179.24 175.39 3d4l n SER 275 N -2.40 0.73 -0.31 6.45 3.41 -1.03 -4.50 113.62 115.97 3d4l n SER 275 Ca 0.03 -0.54 0.09 0.00 -0.26 0.00 0.00 58.87 58.19 3d4l n SER 275 Cb 0.29 0.43 0.26 0.00 -0.26 0.00 0.00 64.21 64.92 3d4l n SER 275 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3d4l h LEU 276 N 0.21 0.56 -0.49 1.04 3.38 -1.61 0.07 115.31 118.47 3d4l h LEU 276 Ca 0.00 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3d4l h LEU 276 Cb 0.51 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3d4l h LEU 276 CO 0.00 0.20 0.00 -1.54 0.09 0.00 0.00 178.44 177.19 3d4l n SER 277 N -4.87 0.75 -0.02 -0.43 3.41 -1.26 -3.79 113.62 107.41 3d4l n SER 277 Ca 0.19 -1.39 0.03 0.00 -0.26 0.00 0.00 58.87 57.45 3d4l n SER 277 Cb 0.50 -0.02 -0.10 0.00 -0.26 0.00 0.00 64.21 64.33 3d4l n SER 277 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3d4l n SER 278 N -0.36 2.08 -4.29 4.04 7.64 -0.03 -5.01 113.62 117.69 3d4l n SER 278 Ca 0.19 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.82 3d4l n SER 278 Cb 0.21 1.37 -0.12 0.00 -1.01 0.00 0.00 64.21 64.66 3d4l n SER 278 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3d4l s VAL 279 N -2.73 1.74 0.34 0.44 -7.23 -0.93 -5.05 120.40 106.99 3d4l s VAL 279 Ca -0.05 -1.56 0.06 0.00 -1.81 0.00 0.00 61.98 58.62 3d4l s VAL 279 Cb 0.07 -1.58 0.13 0.00 0.56 0.00 0.00 36.38 35.55 3d4l s VAL 279 CO 0.52 -0.06 1.84 0.71 -0.31 0.00 0.00 175.10 177.80 3d4l h THR 280 N 4.05 1.21 -1.94 5.32 1.35 -1.91 -3.40 112.91 117.60 3d4l h THR 280 Ca -0.46 -0.96 -0.37 0.00 -0.55 0.00 0.00 66.41 64.06 3d4l h THR 280 Cb 1.18 1.22 -0.31 0.00 -1.73 0.00 0.00 68.15 68.51 3d4l h THR 280 CO 0.40 0.30 -0.69 0.21 -0.25 0.00 0.00 175.52 175.49 3d4l s ASN 281 N -6.83 1.09 0.36 5.36 2.47 -1.26 -5.05 114.94 111.09 3d4l s ASN 281 Ca -0.06 -1.67 -0.28 0.00 0.42 0.00 0.00 52.86 51.27 3d4l s ASN 281 Cb 0.15 0.56 -0.12 0.00 -1.45 0.00 0.00 41.25 40.39 3d4l s ASN 281 CO 0.76 -0.25 1.34 0.00 -3.72 0.00 0.00 177.10 175.24 3d4l n ALA 282 N 4.12 1.61 -2.66 1.71 0.00 -1.26 -4.95 120.51 119.07 3d4l n ALA 282 Ca 0.12 0.34 -0.41 0.00 0.00 0.00 0.00 53.44 53.50 3d4l n ALA 282 Cb 0.45 -2.30 -0.04 0.00 0.00 0.00 0.00 19.45 17.56 3d4l n ALA 282 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3d4l s THR 283 N -1.12 4.92 -0.35 0.00 2.01 -1.26 -5.03 115.64 114.80 3d4l s THR 283 Ca 0.56 1.74 -0.20 0.00 0.31 0.00 0.00 61.69 64.10 3d4l s THR 283 Cb -0.53 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 67.80 3d4l s THR 283 CO 0.62 0.23 0.62 -0.44 -0.69 0.00 0.00 174.62 174.96 3d4l s SER 284 N 0.75 6.41 -0.15 3.53 0.01 -1.26 -4.49 113.70 118.50 3d4l s SER 284 Ca 0.44 0.13 -0.25 0.00 1.31 0.00 0.00 55.95 57.58 3d4l s SER 284 Cb -0.20 -2.32 -0.02 0.00 0.21 0.00 0.00 66.02 63.70 3d4l s SER 284 CO 0.23 -0.58 0.81 -0.63 0.41 0.00 0.00 173.24 173.48 3d4l s ILE 285 N 2.67 4.90 0.16 1.44 -1.09 0.62 -4.81 121.20 125.10 3d4l s ILE 285 Ca 0.24 1.61 -0.24 0.00 -2.23 0.00 0.00 60.65 60.02 3d4l s ILE 285 Cb -0.15 -4.12 -0.08 0.00 -1.58 0.00 0.00 42.46 36.53 3d4l s ILE 285 CO 0.15 0.06 0.75 -1.58 -1.23 0.00 0.00 174.94 173.08 3d4l s GLN 286 N 1.96 4.49 -0.32 2.79 0.74 -1.26 -0.82 119.66 127.24 3d4l s GLN 286 Ca 0.38 1.08 -0.04 0.00 0.05 0.00 0.00 55.36 56.83 3d4l s GLN 286 Cb -0.17 -3.22 0.04 0.00 1.10 0.00 0.00 33.01 30.77 3d4l s GLN 286 CO 0.13 0.56 0.05 0.42 -0.55 0.00 0.00 175.29 175.90 3d4l s ILE 287 N -1.18 3.36 0.47 -2.34 1.01 -0.09 -4.89 121.20 117.54 3d4l s ILE 287 Ca 0.36 -1.25 -0.20 0.00 0.00 0.00 0.00 60.65 59.56 3d4l s ILE 287 Cb -0.22 -2.91 -0.09 0.00 0.01 0.00 0.00 42.46 39.25 3d4l s ILE 287 CO 0.25 -0.13 0.99 0.42 0.00 0.00 0.00 174.94 176.47 3d4l s THR 288 N 1.33 4.17 0.66 2.92 -4.23 -1.26 -4.26 115.64 114.96 3d4l s THR 288 Ca -0.03 1.30 -0.15 0.00 -1.18 0.00 0.00 61.69 61.62 3d4l s THR 288 Cb -0.20 -3.55 -0.00 0.00 1.34 0.00 0.00 72.50 70.09 3d4l s THR 288 CO 0.01 -0.34 1.11 0.00 -0.54 0.00 0.00 174.62 174.85 3d4l s ALA 289 N -2.18 2.49 0.83 3.99 0.00 -1.26 -5.00 121.76 120.63 3d4l s ALA 289 Ca 0.64 0.54 -0.10 0.00 0.00 0.00 0.00 51.96 53.03 3d4l s ALA 289 Cb -0.12 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 19.78 3d4l s ALA 289 CO 0.19 -1.25 1.11 -1.25 0.00 0.00 0.00 175.76 174.55 3d4l s PRO 290 N -4.10 1.73 0.28 0.00 0.04 -1.26 -4.73 135.00 126.95 3d4l s PRO 290 Ca 0.67 1.29 0.00 0.00 0.04 0.00 0.00 61.00 63.00 3d4l s PRO 290 Cb -0.20 -1.83 0.52 0.00 0.04 0.00 0.00 34.50 33.03 3d4l s PRO 290 CO 0.41 -2.05 1.83 0.00 0.04 0.00 0.00 177.00 177.24 3d4l h ALA 291 N -1.44 1.46 -0.01 8.56 0.00 -1.99 -0.30 119.26 125.55 3d4l h ALA 291 Ca -0.44 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3d4l h ALA 291 Cb 1.25 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3d4l h ALA 291 CO 0.48 0.23 0.06 0.66 0.00 0.00 0.00 179.25 180.67 3d4l h SER 292 N 0.98 0.00 0.03 0.00 4.64 -2.03 -2.73 113.55 114.45 3d4l h SER 292 Ca 0.48 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.42 3d4l h SER 292 Cb 0.45 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.48 3d4l h SER 292 CO -0.26 0.00 -2.37 0.23 -0.87 0.00 0.00 176.83 173.56 3d4l n MET 293 N -3.21 0.67 0.31 4.77 2.00 -0.21 -4.45 117.12 117.00 3d4l n MET 293 Ca -0.03 0.18 0.21 0.00 0.00 0.00 0.00 57.70 58.06 3d4l n MET 293 Cb 0.13 -1.56 1.08 0.00 0.00 0.00 0.00 33.22 32.87 3d4l n MET 293 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 3d4l h LEU 294 N 0.00 0.00 -1.48 4.03 3.38 -1.01 -2.57 115.31 117.66 3d4l h LEU 294 Ca -0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.42 3d4l h LEU 294 Cb 1.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.68 3d4l h LEU 294 CO -0.05 0.00 0.00 0.16 0.09 0.00 0.00 178.44 178.64 3d4l h ILE 295 N 0.00 0.00 -2.08 1.22 3.07 -1.74 -3.46 117.51 114.52 3d4l h ILE 295 Ca 0.00 -0.24 -0.01 0.00 1.55 0.00 0.00 64.86 66.17 3d4l h ILE 295 Cb 0.06 1.05 -0.00 0.00 -0.27 0.00 0.00 36.82 37.66 3d4l h ILE 295 CO 0.00 0.00 0.02 0.61 -1.05 0.00 0.00 178.15 177.73 3d4l n GLY 296 N -0.41 2.10 3.76 0.16 0.00 -0.97 -5.13 105.19 104.69 3d4l n GLY 296 Ca 0.00 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.15 5.80 0.35 1.61 1.01 -1.26 -4.94 116.67 118.09 3d4l s ASP 297 Ca 0.01 2.73 -0.14 0.00 0.71 0.00 0.00 52.55 55.86 3d4l s ASP 297 Cb -0.00 -2.64 0.03 0.00 1.01 0.00 0.00 42.92 41.32 3d4l s ASP 297 CO 0.01 -1.20 0.69 -1.38 0.21 0.00 0.00 175.17 173.50 3d4l s HIS 298 N -1.30 0.26 0.07 4.23 -3.43 -1.26 -1.37 115.29 112.49 3d4l s HIS 298 Ca 0.64 -0.79 0.02 0.00 -0.80 0.00 0.00 55.06 54.13 3d4l s HIS 298 Cb -0.39 0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 31.32 3d4l s HIS 298 CO 0.49 -1.38 -0.08 0.71 -2.00 0.00 0.00 174.74 172.48 3d4l s TYR 299 N -2.88 0.80 -0.22 0.38 2.02 0.11 -4.83 117.35 112.73 3d4l s TYR 299 Ca 0.18 -0.66 -0.17 0.00 -0.37 0.00 0.00 57.07 56.05 3d4l s TYR 299 Cb -0.04 -0.47 -0.03 0.00 -0.40 0.00 0.00 41.96 41.02 3d4l s TYR 299 CO 0.12 -0.09 0.45 -1.17 -1.57 0.00 0.00 175.55 173.29 3d4l s LEU 300 N -2.17 4.12 0.00 -1.29 2.96 -1.26 -0.93 118.68 120.11 3d4l s LEU 300 Ca -0.01 0.54 0.02 0.00 -0.22 0.00 0.00 54.13 54.46 3d4l s LEU 300 Cb -0.04 -2.59 -0.00 0.00 0.50 0.00 0.00 46.19 44.05 3d4l s LEU 300 CO -0.01 -0.16 0.27 0.00 -1.32 0.00 0.00 176.35 175.13 3d4l s ASP 302 N -0.74 -0.62 -0.06 0.00 -1.08 -1.14 -4.89 116.67 108.15 3d4l s ASP 302 Ca 0.01 1.10 -0.01 0.00 -0.52 0.00 0.00 52.55 53.14 3d4l s ASP 302 Cb 0.01 1.09 0.03 0.00 -1.46 0.00 0.00 42.92 42.59 3d4l s ASP 302 CO 0.05 -0.27 0.00 -0.69 0.52 0.00 0.00 175.17 174.79 3d4l s VAL 303 N 0.04 0.30 -0.10 1.11 1.01 -1.26 -1.10 120.40 120.40 3d4l s VAL 303 Ca -0.00 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 3d4l s VAL 303 Cb -0.04 -0.45 0.05 0.00 0.00 0.00 0.00 36.38 35.95 3d4l s VAL 303 CO -0.00 0.23 0.21 -0.89 0.00 0.00 0.00 175.10 174.64 3d4l s THR 304 N 1.75 -0.32 0.27 3.92 2.01 -0.15 -5.02 115.64 118.10 3d4l s THR 304 Ca 0.01 0.31 -0.29 0.00 0.31 0.00 0.00 61.69 62.03 3d4l s THR 304 Cb -0.13 -0.36 -0.09 0.00 0.01 0.00 0.00 72.50 71.93 3d4l s THR 304 CO -0.04 0.13 1.14 0.26 -0.69 0.00 0.00 174.62 175.42 3d4l s TRP 305 N 2.28 3.49 -0.26 4.92 0.52 -1.26 -0.42 118.94 128.20 3d4l s TRP 305 Ca 0.02 1.62 -0.15 0.00 0.02 0.00 0.00 56.10 57.60 3d4l s TRP 305 Cb -0.12 -3.36 -0.12 0.00 -1.15 0.00 0.00 33.47 28.72 3d4l s TRP 305 CO -0.07 -0.83 -0.30 0.00 0.02 0.00 0.00 176.95 175.78 3d4l n ALA 306 N 1.38 1.12 -3.17 0.98 0.00 0.50 -4.88 120.51 116.43 3d4l n ALA 306 Ca -0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 53.44 52.39 3d4l n ALA 306 Cb 0.44 0.06 -0.01 0.00 0.00 0.00 0.00 19.45 19.94 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 -4.29 0.00 0.30 0.00 -2.24 -1.00 -4.57 114.28 102.48 3d4l n THR 307 Ca -0.49 -0.33 0.19 0.00 -2.27 0.00 0.00 64.05 61.15 3d4l n THR 307 Cb 0.83 0.17 0.95 0.00 -2.10 0.00 0.00 70.33 70.19 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 -1.97 -3.18 115.11 110.26 3d4l h GLN 308 Ca -0.03 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.13 3d4l h GLN 308 Cb 0.17 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.52 3d4l h GLN 308 CO 0.05 0.03 -0.51 0.39 -0.95 0.00 0.00 178.83 177.84 3d4l n GLU 309 N -3.26 0.44 -3.73 1.46 1.02 -1.26 -4.87 120.64 110.43 3d4l n GLU 309 Ca -0.02 -1.80 -0.15 0.00 -0.02 0.00 0.00 57.16 55.17 3d4l n GLU 309 Cb 0.17 -0.72 -0.15 0.00 -0.02 0.00 0.00 31.44 30.72 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 -0.96 0.05 0.04 3.49 3.52 -1.20 -1.25 118.95 122.63 3d4l s ARG 310 Ca 0.18 0.37 0.05 0.00 -0.13 0.00 0.00 55.73 56.21 3d4l s ARG 310 Cb 0.18 -0.23 -0.02 0.00 -1.56 0.00 0.00 34.95 33.33 3d4l s ARG 310 CO -0.04 -0.20 -0.16 -1.50 -0.81 0.00 0.00 175.30 172.60 3d4l s ILE 311 N 1.40 1.25 0.02 4.11 2.07 -0.12 -0.37 121.20 129.55 3d4l s ILE 311 Ca -0.06 -1.04 0.06 0.00 -1.41 0.00 0.00 60.65 58.20 3d4l s ILE 311 Cb -0.12 -1.11 -0.03 0.00 0.13 0.00 0.00 42.46 41.32 3d4l s ILE 311 CO -0.05 0.06 -0.16 -0.94 -1.91 0.00 0.00 174.94 171.94 3d4l s SER 312 N -1.13 3.96 0.01 4.50 1.04 0.44 -0.18 113.70 122.33 3d4l s SER 312 Ca 0.03 -0.34 0.01 0.00 0.48 0.00 0.00 55.95 56.14 3d4l s SER 312 Cb -0.08 -0.72 -0.01 0.00 0.10 0.00 0.00 66.02 65.31 3d4l s SER 312 CO 0.01 0.28 -0.05 -0.76 0.98 0.00 0.00 173.24 173.70 3d4l s LEU 313 N -1.29 2.06 -0.04 2.42 1.43 -0.59 -0.98 118.68 121.68 3d4l s LEU 313 Ca 0.14 -0.18 0.07 0.00 -1.03 0.00 0.00 54.13 53.13 3d4l s LEU 313 Cb -0.11 -0.21 -0.02 0.00 0.03 0.00 0.00 46.19 45.89 3d4l s LEU 313 CO 0.05 -0.00 -0.25 -1.10 0.23 0.00 0.00 176.35 175.27 3d4l s GLN 314 N -0.43 2.38 0.08 1.70 -0.21 -0.26 -0.92 119.66 122.00 3d4l s GLN 314 Ca -0.01 -0.91 0.10 0.00 0.02 0.00 0.00 55.36 54.56 3d4l s GLN 314 Cb -0.04 -2.12 -0.03 0.00 1.00 0.00 0.00 33.01 31.82 3d4l s GLN 314 CO -0.00 0.46 -0.25 -1.58 -2.12 0.00 0.00 175.29 171.80 3d4l s TRP 315 N -0.36 2.36 -0.05 0.91 0.52 0.26 -0.40 118.94 122.18 3d4l s TRP 315 Ca 0.02 -0.37 0.03 0.00 0.02 0.00 0.00 56.10 55.80 3d4l s TRP 315 Cb -0.12 -1.35 0.01 0.00 -1.15 0.00 0.00 33.47 30.86 3d4l s TRP 315 CO 0.02 0.23 -0.13 -1.17 0.02 0.00 0.00 176.95 175.92 3d4l s LEU 316 N -1.59 1.73 0.64 2.99 2.96 -0.11 -0.84 118.68 124.46 3d4l s LEU 316 Ca 0.13 -0.29 -0.15 0.00 -0.22 0.00 0.00 54.13 53.60 3d4l s LEU 316 Cb -0.10 -0.81 -0.01 0.00 0.50 0.00 0.00 46.19 45.77 3d4l s LEU 316 CO 0.04 0.07 1.11 -0.13 -1.32 0.00 0.00 176.35 176.12 3d4l s ARG 317 N 0.44 2.89 0.52 1.98 0.52 -0.88 0.04 118.95 124.47 3d4l s ARG 317 Ca -0.10 1.40 0.23 0.00 -0.52 0.00 0.00 55.73 56.74 3d4l s ARG 317 Cb -0.14 -1.96 1.34 0.00 0.52 0.00 0.00 34.95 34.71 3d4l s ARG 317 CO 0.03 -1.18 2.01 -0.09 0.02 0.00 0.00 175.30 176.09 3d4l h ARG 318 N 0.18 0.05 -5.23 3.54 2.43 -1.54 -3.00 114.38 110.80 3d4l h ARG 318 Ca -0.47 -0.00 -0.65 0.00 -0.81 0.00 0.00 59.98 58.05 3d4l h ARG 318 Cb 1.25 -0.01 -0.16 0.00 -0.42 0.00 0.00 29.97 30.63 3d4l h ARG 318 CO 0.55 0.03 0.40 0.42 -1.51 0.00 0.00 179.97 179.86 3d4l s ILE 319 N -5.06 4.49 0.00 1.20 -1.09 -1.26 -4.83 121.20 114.64 3d4l s ILE 319 Ca -0.05 -0.51 0.00 0.00 -2.23 0.00 0.00 60.65 57.86 3d4l s ILE 319 Cb 0.19 -4.61 0.00 0.00 -1.58 0.00 0.00 42.46 36.47 3d4l s ILE 319 CO 0.73 -1.32 0.72 0.00 -1.23 0.00 0.00 174.94 173.83 3d4l n GLN 320 N 7.25 0.44 -0.16 2.79 6.02 -1.13 -3.77 117.38 128.82 3d4l n GLN 320 Ca -0.05 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.00 3d4l n GLN 320 Cb 0.45 -1.28 0.14 0.00 1.02 0.00 0.00 30.24 30.56 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 1.41 2.71 -3.58 1.08 6.94 -1.26 -1.27 115.26 121.29 3d4l n ASN 321 Ca 0.00 -2.66 -0.17 0.00 -0.02 0.00 0.00 54.58 51.73 3d4l n ASN 321 Cb 0.22 -0.33 -0.14 0.00 -2.36 0.00 0.00 39.78 37.18 3d4l n ASN 321 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 3d4l s TYR 322 N -2.16 -0.28 0.12 -2.53 6.14 -1.25 -1.50 117.35 115.89 3d4l s TYR 322 Ca 0.26 0.50 0.07 0.00 0.64 0.00 0.00 57.07 58.54 3d4l s TYR 322 Cb 0.21 -0.26 -0.04 0.00 0.42 0.00 0.00 41.96 42.29 3d4l s TYR 322 CO 0.05 -0.45 -0.17 -1.54 0.64 0.00 0.00 175.55 174.07 3d4l s SER 323 N 2.34 2.34 -0.04 4.32 1.04 0.03 -2.07 113.70 121.67 3d4l s SER 323 Ca 0.04 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 55.73 3d4l s SER 323 Cb -0.14 -0.12 0.01 0.00 0.10 0.00 0.00 66.02 65.88 3d4l s SER 323 CO -0.10 -0.04 -0.07 -0.69 0.98 0.00 0.00 173.24 173.32 3d4l s VAL 324 N -1.71 0.69 -0.17 5.02 1.01 -0.02 -0.89 120.40 124.34 3d4l s VAL 324 Ca 0.09 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 3d4l s VAL 324 Cb -0.07 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 3d4l s VAL 324 CO 0.04 0.24 -0.03 -0.32 0.00 0.00 0.00 175.10 175.04 3d4l s MET 325 N 0.54 3.66 0.04 2.72 1.75 0.12 -0.57 119.30 127.56 3d4l s MET 325 Ca -0.08 -0.52 0.03 0.00 -1.25 0.00 0.00 55.69 53.87 3d4l s MET 325 Cb -0.12 -2.96 -0.04 0.00 2.84 0.00 0.00 34.83 34.56 3d4l s MET 325 CO 0.01 0.19 -0.01 -0.51 -0.65 0.00 0.00 175.02 174.04 3d4l s ASP 326 N 0.52 4.99 -0.19 1.11 1.01 -0.10 -0.76 116.67 123.25 3d4l s ASP 326 Ca -0.03 -0.10 0.01 0.00 0.71 0.00 0.00 52.55 53.14 3d4l s ASP 326 Cb -0.14 -1.23 0.04 0.00 1.01 0.00 0.00 42.92 42.59 3d4l s ASP 326 CO 0.03 0.24 -0.14 -0.63 0.21 0.00 0.00 175.17 174.88 3d4l s ILE 327 N -1.17 1.82 -0.10 0.77 1.01 -1.26 -1.54 121.20 120.74 3d4l s ILE 327 Ca 0.22 -1.02 0.02 0.00 0.00 0.00 0.00 60.65 59.86 3d4l s ILE 327 Cb -0.12 -1.80 -0.02 0.00 0.01 0.00 0.00 42.46 40.54 3d4l s ILE 327 CO 0.13 0.29 -0.15 0.00 0.00 0.00 0.00 174.94 175.21 3d4l s ASP 329 N -0.04 4.98 0.07 0.00 1.11 -0.12 -0.95 116.67 121.71 3d4l s ASP 329 Ca -0.04 -0.04 -0.30 0.00 0.18 0.00 0.00 52.55 52.36 3d4l s ASP 329 Cb -0.14 -1.27 -0.05 0.00 1.07 0.00 0.00 42.92 42.52 3d4l s ASP 329 CO 0.04 0.29 1.14 -0.47 1.18 0.00 0.00 175.17 177.35 3d4l s TYR 330 N -1.04 3.50 -0.53 4.23 5.04 -0.38 -1.25 117.35 126.92 3d4l s TYR 330 Ca 0.18 1.42 -0.11 0.00 -2.44 0.00 0.00 57.07 56.12 3d4l s TYR 330 Cb -0.11 -3.34 0.13 0.00 0.35 0.00 0.00 41.96 38.99 3d4l s TYR 330 CO 0.09 -0.94 0.43 0.34 -1.34 0.00 0.00 175.55 174.13 3d4l s ASP 331 N 0.88 5.90 0.61 4.32 2.15 0.14 -4.95 116.67 125.72 3d4l s ASP 331 Ca 0.56 -2.01 0.30 0.00 0.43 0.00 0.00 52.55 51.83 3d4l s ASP 331 Cb -0.28 -2.07 1.67 0.00 -0.30 0.00 0.00 42.92 41.94 3d4l s ASP 331 CO 0.30 -0.71 2.05 -0.08 -0.17 0.00 0.00 175.17 176.56 3d4l h GLU 332 N 8.42 0.00 0.00 4.34 4.81 -1.94 0.49 114.58 130.70 3d4l h GLU 332 Ca -0.19 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 58.87 3d4l h GLU 332 Cb 1.07 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 3d4l h GLU 332 CO 0.89 0.00 -1.03 0.66 -0.73 0.00 0.00 179.01 178.80 3d4l h SER 333 N 0.00 0.00 -0.01 1.04 4.64 -1.95 -3.35 113.55 113.92 3d4l h SER 333 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3d4l h SER 333 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3d4l h SER 333 CO -0.00 0.68 -0.16 -1.54 -0.87 0.00 0.00 176.83 174.93 3d4l n SER 334 N -3.12 1.19 -1.35 4.97 3.41 -0.62 -4.98 113.62 113.12 3d4l n SER 334 Ca -0.04 -1.10 -0.18 0.00 -0.26 0.00 0.00 58.87 57.30 3d4l n SER 334 Cb 0.84 0.42 -0.08 0.00 -0.26 0.00 0.00 64.21 65.14 3d4l n SER 334 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d4l n GLY 335 N 0.81 1.71 3.79 5.00 0.00 0.16 -4.96 105.19 111.70 3d4l n GLY 335 Ca 0.04 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.48 2.38 -0.17 1.61 1.81 -1.17 -4.90 118.95 115.02 3d4l s ARG 336 Ca 0.00 -1.67 -0.01 0.00 -1.72 0.00 0.00 55.73 52.33 3d4l s ARG 336 Cb 0.00 -2.17 -0.00 0.00 -0.45 0.00 0.00 34.95 32.32 3d4l s ARG 336 CO 0.00 -0.11 -0.12 -1.58 -0.68 0.00 0.00 175.30 172.80 3d4l s TRP 337 N -2.52 2.84 -0.04 -0.53 0.52 -1.26 0.26 118.94 118.21 3d4l s TRP 337 Ca 0.43 -1.03 0.07 0.00 0.02 0.00 0.00 56.10 55.59 3d4l s TRP 337 Cb 0.00 -1.95 -0.02 0.00 -1.15 0.00 0.00 33.47 30.36 3d4l s TRP 337 CO 0.25 -0.49 -0.23 -0.80 0.02 0.00 0.00 176.95 175.69 3d4l s ASN 338 N 0.98 3.27 -0.38 2.95 -0.87 -0.38 -4.90 114.94 115.61 3d4l s ASN 338 Ca -0.02 -0.42 -0.02 0.00 -1.57 0.00 0.00 52.86 50.84 3d4l s ASN 338 Cb -0.15 -0.58 0.10 0.00 -0.02 0.00 0.00 41.25 40.60 3d4l s ASN 338 CO -0.02 0.30 0.15 0.00 -2.57 0.00 0.00 177.10 174.97 3d4l s LEU 340 N 1.11 4.37 0.51 0.00 1.43 -1.25 -4.89 118.68 119.96 3d4l s LEU 340 Ca 0.07 2.62 0.15 0.00 -1.03 0.00 0.00 54.13 55.95 3d4l s LEU 340 Cb -0.22 -3.59 1.23 0.00 0.03 0.00 0.00 46.19 43.64 3d4l s LEU 340 CO -0.05 -0.83 2.14 1.62 0.23 0.00 0.00 176.35 179.46 3d4l h VAL 341 N 4.05 1.00 0.00 -1.59 3.04 -1.97 0.10 116.25 120.89 3d4l h VAL 341 Ca -0.43 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 3d4l h VAL 341 Cb 1.20 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.43 3d4l h VAL 341 CO 0.92 0.01 0.00 0.00 -1.01 0.00 0.00 177.57 177.49 3d4l n ALA 342 N -2.54 1.32 -0.20 3.17 0.00 -1.26 -1.25 120.51 119.76 3d4l n ALA 342 Ca -0.02 0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.57 3d4l n ALA 342 Cb 0.10 -1.25 0.19 0.00 0.00 0.00 0.00 19.45 18.49 3d4l n ALA 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d4l n ARG 343 N -1.94 2.78 -3.18 0.00 1.74 0.34 -4.27 116.66 112.13 3d4l n ARG 343 Ca 0.01 -2.18 -0.39 0.00 -0.77 0.00 0.00 57.85 54.52 3d4l n ARG 343 Cb 0.11 -1.34 -0.05 0.00 -1.02 0.00 0.00 32.46 30.15 3d4l n ARG 343 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3d4l s GLN 344 N -1.01 4.35 -0.10 5.56 0.74 -0.38 -4.04 119.66 124.79 3d4l s GLN 344 Ca 0.29 0.73 0.04 0.00 0.05 0.00 0.00 55.36 56.47 3d4l s GLN 344 Cb 0.15 -3.38 0.00 0.00 1.10 0.00 0.00 33.01 30.88 3d4l s GLN 344 CO 0.20 0.26 -0.23 -1.01 -0.55 0.00 0.00 175.29 173.97 3d4l s HIS 345 N 0.18 2.45 -0.12 1.67 3.76 0.06 -4.94 115.29 118.36 3d4l s HIS 345 Ca 0.32 -1.02 -0.08 0.00 -0.15 0.00 0.00 55.06 54.13 3d4l s HIS 345 Cb -0.18 -1.65 -0.04 0.00 1.11 0.00 0.00 32.58 31.82 3d4l s HIS 345 CO 0.16 -0.42 0.17 0.42 -0.85 0.00 0.00 174.74 174.22 3d4l s ILE 346 N 0.42 5.45 -0.13 0.60 1.01 -1.26 0.11 121.20 127.39 3d4l s ILE 346 Ca -0.17 0.28 -0.03 0.00 0.00 0.00 0.00 60.65 60.73 3d4l s ILE 346 Cb -0.18 -3.44 0.05 0.00 0.01 0.00 0.00 42.46 38.90 3d4l s ILE 346 CO 0.07 0.60 0.03 -0.70 0.00 0.00 0.00 174.94 174.94 3d4l s GLU 347 N -0.89 0.50 0.30 2.79 2.12 -0.07 -5.01 118.70 118.43 3d4l s GLU 347 Ca 0.15 -0.12 0.03 0.00 0.36 0.00 0.00 54.97 55.39 3d4l s GLU 347 Cb -0.12 -1.54 -0.05 0.00 0.26 0.00 0.00 34.13 32.68 3d4l s GLU 347 CO 0.04 -0.50 0.09 0.00 -0.54 0.00 0.00 175.26 174.35 3d4l s MET 348 N 1.97 1.56 -0.02 4.30 0.23 -1.26 -0.79 119.30 125.29 3d4l s MET 348 Ca 0.02 -1.86 0.00 0.00 -1.03 0.00 0.00 55.69 52.82 3d4l s MET 348 Cb -0.15 -0.53 0.02 0.00 -1.53 0.00 0.00 34.83 32.64 3d4l s MET 348 CO -0.07 -0.27 0.00 0.45 -2.03 0.00 0.00 175.02 173.10 3d4l s SER 349 N -3.41 0.23 0.10 -1.18 0.15 -0.56 -4.99 113.70 104.04 3d4l s SER 349 Ca 0.36 -0.01 0.21 0.00 0.70 0.00 0.00 55.95 57.22 3d4l s SER 349 Cb 0.08 -0.11 -0.13 0.00 -1.71 0.00 0.00 66.02 64.15 3d4l s SER 349 CO 0.15 -0.07 0.81 0.35 1.20 0.00 0.00 173.24 175.68 3d4l n THR 350 N 3.79 0.58 -0.02 6.45 -2.24 -1.26 -4.37 114.28 117.21 3d4l n THR 350 Ca -0.22 -0.57 0.07 0.00 -2.27 0.00 0.00 64.05 61.05 3d4l n THR 350 Cb 0.53 -0.32 -0.15 0.00 -2.10 0.00 0.00 70.33 68.29 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 -2.60 0.22 0.00 4.28 -2.24 -1.26 -5.07 114.28 107.61 3d4l n THR 351 Ca -0.04 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 3d4l n THR 351 Cb 0.63 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 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 1.47 3.87 4.02 3.38 0.00 -1.26 -4.84 105.19 111.83 3d4l n GLY 352 Ca -0.08 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 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 0.25 1.74 -0.19 1.61 -2.14 -1.26 -4.55 118.94 114.40 3d4l s TRP 353 Ca 0.00 -0.50 -0.11 0.00 2.66 0.00 0.00 56.10 58.15 3d4l s TRP 353 Cb 0.00 -2.49 -0.05 0.00 -3.10 0.00 0.00 33.47 27.83 3d4l s TRP 353 CO 0.00 -1.20 0.17 0.08 -2.66 0.00 0.00 176.95 173.34 3d4l s VAL 354 N -2.77 5.38 0.00 -0.66 1.01 -0.40 -4.76 120.40 118.21 3d4l s VAL 354 Ca 0.62 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.88 3d4l s VAL 354 Cb -0.06 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.80 3d4l s VAL 354 CO 0.40 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.53 3d4l n GLY 355 N 3.50 -1.04 0.08 4.51 0.00 -1.26 -3.47 105.19 107.50 3d4l n GLY 355 Ca -0.15 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.06 0.00 1.61 3.08 -1.95 -3.40 114.38 113.66 3d4l h ARG 356 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d4l h ARG 356 Cb 0.00 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.06 3d4l h ARG 356 CO 0.00 0.49 -0.12 1.19 -1.07 0.00 0.00 179.97 180.46 3d4l n PHE 357 N -4.84 0.00 -3.60 3.04 3.72 -1.26 -4.90 117.46 109.61 3d4l n PHE 357 Ca -0.09 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.28 3d4l n PHE 357 Cb 0.29 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.81 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 -0.76 0.25 0.33 -1.08 1.70 -1.25 -4.98 118.95 113.16 3d4l s ARG 358 Ca 0.00 -0.09 -0.28 0.00 -0.47 0.00 0.00 55.73 54.89 3d4l s ARG 358 Cb 0.00 0.12 -0.13 0.00 -0.57 0.00 0.00 34.95 34.37 3d4l s ARG 358 CO 0.00 -0.11 1.16 -2.30 -1.08 0.00 0.00 175.30 172.97 3d4l n PRO 359 N -0.08 1.76 -1.29 3.89 -0.02 -1.23 -4.33 135.00 133.70 3d4l n PRO 359 Ca 0.01 0.62 -0.31 0.00 -2.02 0.00 0.00 63.50 61.80 3d4l n PRO 359 Cb 0.58 -2.11 0.09 0.00 -0.02 0.00 0.00 33.50 32.04 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 -0.44 4.56 0.24 2.55 1.04 -1.26 -4.93 113.70 115.45 3d4l s SER 360 Ca 0.57 1.78 -0.14 0.00 0.48 0.00 0.00 55.95 58.65 3d4l s SER 360 Cb -0.62 -2.50 -0.08 0.00 0.10 0.00 0.00 66.02 62.92 3d4l s SER 360 CO 0.61 -2.00 0.63 -1.83 0.98 0.00 0.00 173.24 171.63 3d4l s GLU 361 N -4.92 3.97 0.34 4.02 1.03 -1.26 -4.94 118.70 116.94 3d4l s GLU 361 Ca 0.61 0.53 -0.13 0.00 0.03 0.00 0.00 54.97 56.01 3d4l s GLU 361 Cb -0.17 -2.69 -0.08 0.00 -0.80 0.00 0.00 34.13 30.39 3d4l s GLU 361 CO 0.56 0.32 0.73 -1.25 -1.33 0.00 0.00 175.26 174.29 3d4l s PRO 362 N -2.53 3.92 -0.27 -4.83 0.04 -1.26 -4.61 135.00 125.46 3d4l s PRO 362 Ca 0.46 0.58 0.02 0.00 0.04 0.00 0.00 61.00 62.11 3d4l s PRO 362 Cb -0.13 -2.43 0.07 0.00 0.04 0.00 0.00 34.50 32.05 3d4l s PRO 362 CO 0.20 0.11 -0.05 -1.01 0.04 0.00 0.00 177.00 176.29 3d4l s HIS 363 N -2.09 3.06 0.27 0.56 3.76 -0.10 -4.94 115.29 115.81 3d4l s HIS 363 Ca 0.53 -2.30 -0.20 0.00 -0.15 0.00 0.00 55.06 52.94 3d4l s HIS 363 Cb -0.10 -2.05 -0.09 0.00 1.11 0.00 0.00 32.58 31.44 3d4l s HIS 363 CO 0.22 -0.87 0.79 -0.06 -0.85 0.00 0.00 174.74 173.97 3d4l s PHE 364 N 1.16 3.59 0.84 1.40 0.40 -1.26 -0.84 117.98 123.28 3d4l s PHE 364 Ca -0.02 1.46 -0.11 0.00 -0.60 0.00 0.00 56.93 57.66 3d4l s PHE 364 Cb -0.19 -2.69 0.10 0.00 0.51 0.00 0.00 43.02 40.75 3d4l s PHE 364 CO -0.07 0.24 1.09 0.95 0.70 0.00 0.00 175.22 178.13 3d4l s THR 365 N -1.66 2.92 0.25 0.64 -4.23 -0.44 -4.88 115.64 108.24 3d4l s THR 365 Ca 0.48 0.30 -0.04 0.00 -1.18 0.00 0.00 61.69 61.25 3d4l s THR 365 Cb -0.16 -2.86 0.24 0.00 1.34 0.00 0.00 72.50 71.06 3d4l s THR 365 CO 0.20 -0.39 1.70 0.25 -0.54 0.00 0.00 174.62 175.84 3d4l h LEU 366 N -1.33 0.10 0.00 4.79 5.85 -1.92 -0.36 115.31 122.44 3d4l h LEU 366 Ca -0.48 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.38 3d4l h LEU 366 Cb 1.27 0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.46 3d4l h LEU 366 CO 0.55 -0.00 0.00 -0.90 -0.34 0.00 0.00 178.44 177.75 3d4l n ASP 367 N -5.11 0.00 -0.10 1.25 5.68 -1.26 -4.89 116.55 112.12 3d4l n ASP 367 Ca 0.15 -0.87 -0.01 0.00 -0.50 0.00 0.00 54.79 53.56 3d4l n ASP 367 Cb 0.47 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.44 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 0.65 0.27 0.34 6.12 0.00 -0.15 -4.87 105.19 107.55 3d4l n GLY 368 Ca 0.19 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.66 1.40 -3.71 1.61 3.02 -1.26 -4.89 115.26 110.76 3d4l n ASN 369 Ca -0.01 -1.13 -0.10 0.00 -0.03 0.00 0.00 54.58 53.31 3d4l n ASN 369 Cb 0.36 0.26 -0.05 0.00 -0.61 0.00 0.00 39.78 39.74 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 -2.48 -0.17 0.14 6.41 1.04 -1.26 -1.26 113.70 116.12 3d4l s SER 370 Ca 0.23 -0.43 -0.16 0.00 0.48 0.00 0.00 55.95 56.06 3d4l s SER 370 Cb 0.19 0.47 0.03 0.00 0.10 0.00 0.00 66.02 66.81 3d4l s SER 370 CO 0.53 -0.88 0.41 0.72 0.98 0.00 0.00 173.24 175.01 3d4l s PHE 371 N -3.84 -0.12 -0.01 5.02 -0.12 -0.11 -1.33 117.98 117.48 3d4l s PHE 371 Ca 0.06 -0.21 0.05 0.00 -0.05 0.00 0.00 56.93 56.78 3d4l s PHE 371 Cb 0.02 0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.64 3d4l s PHE 371 CO -0.09 -0.75 -0.17 0.71 -0.05 0.00 0.00 175.22 174.87 3d4l s TYR 372 N -3.84 2.62 -0.15 3.49 1.51 -0.02 -0.42 117.35 120.54 3d4l s TYR 372 Ca 0.06 -0.22 -0.14 0.00 -1.01 0.00 0.00 57.07 55.76 3d4l s TYR 372 Cb 0.01 -1.55 0.04 0.00 -0.11 0.00 0.00 41.96 40.36 3d4l s TYR 372 CO -0.09 0.20 0.40 0.21 -1.11 0.00 0.00 175.55 175.16 3d4l s LYS 373 N -1.04 0.46 -0.09 -0.62 2.20 -0.48 -0.92 119.74 119.24 3d4l s LYS 373 Ca 0.13 0.58 -0.29 0.00 -0.36 0.00 0.00 55.97 56.03 3d4l s LYS 373 Cb -0.11 0.20 -0.02 0.00 -1.51 0.00 0.00 37.83 36.40 3d4l s LYS 373 CO 0.03 -0.07 0.96 0.42 -0.36 0.00 0.00 175.35 176.33 3d4l s ILE 374 N 0.33 4.83 0.06 5.43 1.01 -1.26 -0.89 121.20 130.71 3d4l s ILE 374 Ca -0.01 1.95 -0.08 0.00 0.00 0.00 0.00 60.65 62.52 3d4l s ILE 374 Cb -0.03 -4.27 -0.01 0.00 0.01 0.00 0.00 42.46 38.16 3d4l s ILE 374 CO -0.01 0.05 0.15 0.27 0.00 0.00 0.00 174.94 175.41 3d4l s ILE 375 N 1.78 0.14 0.19 2.92 -4.36 -0.41 -4.60 121.20 116.85 3d4l s ILE 375 Ca 0.47 -1.14 -0.30 0.00 -0.26 0.00 0.00 60.65 59.42 3d4l s ILE 375 Cb -0.18 -1.15 -0.08 0.00 1.25 0.00 0.00 42.46 42.29 3d4l s ILE 375 CO 0.19 -0.63 0.95 -0.94 0.24 0.00 0.00 174.94 174.75 3d4l s SER 376 N -2.51 7.59 0.79 4.36 1.04 -1.26 -1.33 113.70 122.38 3d4l s SER 376 Ca 0.00 1.89 -0.04 0.00 0.48 0.00 0.00 55.95 58.29 3d4l s SER 376 Cb 0.02 -2.60 0.09 0.00 0.10 0.00 0.00 66.02 63.63 3d4l s SER 376 CO -0.08 0.07 0.58 -0.46 0.98 0.00 0.00 173.24 174.33 3d4l n ASN 377 N 1.98 0.33 0.04 7.02 0.23 0.44 -4.86 115.26 120.44 3d4l n ASN 377 Ca -0.00 -1.39 0.17 0.00 -0.53 0.00 0.00 54.58 52.83 3d4l n ASN 377 Cb 0.48 -0.41 0.66 0.00 -2.08 0.00 0.00 39.78 38.42 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 0.04 -0.00 -3.83 5.08 -1.96 -0.05 114.58 113.86 3d4l h GLU 378 Ca -0.19 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 3d4l h GLU 378 Cb 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3d4l h GLU 378 CO 0.16 0.03 -0.12 0.39 -1.00 0.00 0.00 179.01 178.47 3d4l n GLU 379 N -4.42 0.61 -0.36 2.33 1.02 -1.26 -4.92 120.64 113.63 3d4l n GLU 379 Ca 0.07 -0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 3d4l n GLU 379 Cb 0.48 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 3d4l n GLU 379 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d4l n GLY 380 N 1.30 0.82 3.63 0.62 0.00 -0.03 -4.77 105.19 106.76 3d4l n GLY 380 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.02 3.12 -0.22 1.61 1.51 -1.26 0.21 117.35 120.30 3d4l s TYR 381 Ca 0.00 0.07 -0.29 0.00 -1.01 0.00 0.00 57.07 55.84 3d4l s TYR 381 Cb 0.00 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 40.01 3d4l s TYR 381 CO 0.00 0.33 1.13 1.03 -1.11 0.00 0.00 175.55 176.94 3d4l s ARG 382 N -0.53 4.21 0.22 -0.62 0.52 -1.26 -0.42 118.95 121.06 3d4l s ARG 382 Ca 0.09 1.42 0.00 0.00 -0.52 0.00 0.00 55.73 56.72 3d4l s ARG 382 Cb -0.12 -3.71 -0.05 0.00 0.52 0.00 0.00 34.95 31.60 3d4l s ARG 382 CO 0.02 -0.71 0.09 -1.01 0.02 0.00 0.00 175.30 173.71 3d4l s HIS 383 N 3.42 1.32 -0.12 -0.53 3.76 -0.44 -1.18 115.29 121.51 3d4l s HIS 383 Ca 0.48 -1.24 -0.25 0.00 -0.15 0.00 0.00 55.06 53.91 3d4l s HIS 383 Cb -0.17 -0.73 -0.02 0.00 1.11 0.00 0.00 32.58 32.77 3d4l s HIS 383 CO 0.11 -0.44 0.80 0.42 -0.85 0.00 0.00 174.74 174.77 3d4l s ILE 384 N -3.91 4.94 -0.06 0.60 1.01 -1.26 -1.29 121.20 121.23 3d4l s ILE 384 Ca 0.36 1.60 0.02 0.00 0.00 0.00 0.00 60.65 62.63 3d4l s ILE 384 Cb 0.07 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.40 3d4l s ILE 384 CO 0.11 0.12 -0.11 0.00 0.00 0.00 0.00 174.94 175.06 3d4l s TYR 386 N -0.77 3.19 0.02 0.00 5.04 0.11 -1.39 117.35 123.56 3d4l s TYR 386 Ca 0.12 -0.09 0.07 0.00 -2.44 0.00 0.00 57.07 54.73 3d4l s TYR 386 Cb -0.11 -2.18 -0.03 0.00 0.35 0.00 0.00 41.96 40.00 3d4l s TYR 386 CO 0.01 -0.07 -0.21 -0.06 -1.34 0.00 0.00 175.55 173.88 3d4l s PHE 387 N 1.00 2.47 -0.05 4.97 0.08 0.44 -0.98 117.98 125.91 3d4l s PHE 387 Ca 0.05 -0.32 -0.13 0.00 0.12 0.00 0.00 56.93 56.65 3d4l s PHE 387 Cb -0.14 -1.47 -0.05 0.00 -0.57 0.00 0.00 43.02 40.79 3d4l s PHE 387 CO 0.03 0.17 0.33 -1.14 -0.10 0.00 0.00 175.22 174.51 3d4l s GLN 388 N -1.18 3.86 0.57 0.44 2.00 -1.26 -0.93 119.66 123.16 3d4l s GLN 388 Ca 0.13 0.25 0.27 0.00 -2.00 0.00 0.00 55.36 54.00 3d4l s GLN 388 Cb -0.10 -3.25 1.68 0.00 0.80 0.00 0.00 33.01 32.14 3d4l s GLN 388 CO 0.03 0.64 2.22 -0.84 -0.50 0.00 0.00 175.29 176.84 3d4l h ILE 389 N 3.92 0.63 -0.36 -2.34 3.07 -1.52 -2.71 117.51 118.19 3d4l h ILE 389 Ca -0.51 -0.06 -0.19 0.00 1.55 0.00 0.00 64.86 65.65 3d4l h ILE 389 Cb 1.21 1.04 -0.11 0.00 -0.27 0.00 0.00 36.82 38.69 3d4l h ILE 389 CO 0.63 0.01 -0.08 -0.90 -1.05 0.00 0.00 178.15 176.76 3d4l n ASP 390 N -3.96 2.45 -3.98 2.16 5.75 -1.26 -4.28 116.55 113.44 3d4l n ASP 390 Ca -0.03 -3.80 -0.21 0.00 -0.01 0.00 0.00 54.79 50.74 3d4l n ASP 390 Cb 0.10 -0.64 -0.16 0.00 -1.03 0.00 0.00 41.12 39.39 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 -3.26 1.05 0.17 0.11 1.02 -1.02 -4.85 119.74 112.95 3d4l s LYS 391 Ca 0.45 -0.27 0.09 0.00 0.02 0.00 0.00 55.97 56.26 3d4l s LYS 391 Cb 0.41 -0.96 -0.07 0.00 -0.52 0.00 0.00 37.83 36.68 3d4l s LYS 391 CO -0.00 0.05 1.36 0.87 -0.92 0.00 0.00 175.35 176.70 3d4l h LYS 392 N 6.69 0.00 -5.77 1.68 1.79 -1.88 -3.40 116.57 115.68 3d4l h LYS 392 Ca -0.34 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.55 3d4l h LYS 392 Cb 1.17 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.74 3d4l h LYS 392 CO 0.48 0.86 -0.09 -0.51 -1.08 0.00 0.00 179.45 179.11 3d4l s ASP 393 N -6.68 6.72 0.47 0.86 1.01 -1.26 -5.00 116.67 112.80 3d4l s ASP 393 Ca 0.01 0.87 0.08 0.00 0.71 0.00 0.00 52.55 54.22 3d4l s ASP 393 Cb 0.10 -2.31 0.03 0.00 1.01 0.00 0.00 42.92 41.75 3d4l s ASP 393 CO 0.80 -0.04 0.58 0.00 0.21 0.00 0.00 175.17 176.72 3d4l s THR 395 N -2.49 2.02 0.10 0.00 2.01 -0.15 -4.89 115.64 112.23 3d4l s THR 395 Ca 0.54 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 61.29 3d4l s THR 395 Cb -0.07 -1.80 -0.06 0.00 0.01 0.00 0.00 72.50 70.58 3d4l s THR 395 CO 0.33 0.54 1.20 -0.36 -0.69 0.00 0.00 174.62 175.64 3d4l s PHE 396 N 0.92 3.44 -1.11 4.92 0.08 -1.26 0.09 117.98 125.05 3d4l s PHE 396 Ca -0.05 1.33 0.16 0.00 0.12 0.00 0.00 56.93 58.49 3d4l s PHE 396 Cb -0.15 -3.43 -0.09 0.00 -0.57 0.00 0.00 43.02 38.78 3d4l s PHE 396 CO -0.04 -1.28 0.76 0.44 -0.10 0.00 0.00 175.22 175.00 3d4l n ILE 397 N 3.51 0.00 -4.14 0.64 -5.35 0.62 -4.93 119.36 109.71 3d4l n ILE 397 Ca 0.08 -0.23 -0.12 0.00 -0.27 0.00 0.00 62.75 62.21 3d4l n ILE 397 Cb 0.46 1.09 -0.11 0.00 -1.74 0.00 0.00 39.64 39.35 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 -2.20 0.70 0.20 7.28 -4.23 -1.25 -4.98 115.64 111.17 3d4l s THR 398 Ca 0.10 -1.62 -0.23 0.00 -1.18 0.00 0.00 61.69 58.75 3d4l s THR 398 Cb 0.12 -1.30 0.05 0.00 1.34 0.00 0.00 72.50 72.71 3d4l s THR 398 CO 0.53 -0.66 0.77 -1.59 -0.54 0.00 0.00 174.62 173.12 3d4l s LYS 399 N -2.95 1.46 0.00 3.99 -2.85 -1.26 -4.54 119.74 113.59 3d4l s LYS 399 Ca 0.04 -0.75 0.00 0.00 -1.00 0.00 0.00 55.97 54.27 3d4l s LYS 399 Cb -0.01 0.54 0.00 0.00 -2.06 0.00 0.00 37.83 36.30 3d4l s LYS 399 CO -0.02 -0.66 0.00 0.41 0.10 0.00 0.00 175.35 175.18 3d4l n GLY 400 N -0.43 2.28 2.75 0.59 0.00 -1.26 -4.92 105.19 104.20 3d4l n GLY 400 Ca -0.08 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 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 -1.78 5.00 -3.82 2.61 -2.24 -1.26 -4.80 114.28 108.00 3d4l n THR 401 Ca 0.00 -4.84 -0.04 0.00 -2.27 0.00 0.00 64.05 56.90 3d4l n THR 401 Cb 0.00 -2.13 0.00 0.00 -2.10 0.00 0.00 70.33 66.11 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 -1.20 -0.01 0.10 4.78 1.48 -1.26 -5.04 118.94 117.79 3d4l s TRP 402 Ca 0.42 -0.39 0.03 0.00 -1.06 0.00 0.00 56.10 55.10 3d4l s TRP 402 Cb 0.13 0.70 -0.04 0.00 -1.16 0.00 0.00 33.47 33.10 3d4l s TRP 402 CO -0.02 -1.00 -0.09 -1.21 -4.06 0.00 0.00 176.95 170.57 3d4l s GLU 403 N -2.72 0.85 -0.06 3.25 2.02 -1.26 -4.57 118.70 116.22 3d4l s GLU 403 Ca 0.17 -1.22 -0.23 0.00 0.02 0.00 0.00 54.97 53.71 3d4l s GLU 403 Cb -0.03 -0.44 -0.04 0.00 0.10 0.00 0.00 34.13 33.72 3d4l s GLU 403 CO 0.05 0.05 0.67 0.08 0.02 0.00 0.00 175.26 176.13 3d4l s VAL 404 N -2.81 5.04 -0.13 2.63 1.01 -0.33 -2.57 120.40 123.24 3d4l s VAL 404 Ca 0.08 1.38 -0.19 0.00 0.00 0.00 0.00 61.98 63.24 3d4l s VAL 404 Cb -0.00 -4.01 -0.25 0.00 0.00 0.00 0.00 36.38 32.12 3d4l s VAL 404 CO -0.01 0.28 0.51 0.40 0.00 0.00 0.00 175.10 176.28 3d4l h ILE 405 N 4.68 1.12 -2.25 2.22 1.08 -0.80 -3.46 117.51 120.10 3d4l h ILE 405 Ca -0.41 -2.34 0.06 0.00 -0.39 0.00 0.00 64.86 61.77 3d4l h ILE 405 Cb 1.20 2.70 -0.17 0.00 -3.07 0.00 0.00 36.82 37.48 3d4l h ILE 405 CO 0.75 0.60 0.41 -0.83 -0.69 0.00 0.00 178.15 178.39 3d4l s GLY 406 N -4.83 -0.47 -0.17 5.37 0.00 -1.15 -5.00 107.32 101.07 3d4l s GLY 406 Ca -0.22 1.14 -0.15 0.00 0.00 0.00 0.00 44.72 45.49 3d4l s GLY 406 CO 0.71 0.51 0.37 -0.42 0.00 0.00 0.00 173.10 174.28 3d4l s ILE 407 N -2.62 5.24 -0.17 0.90 1.01 -1.26 -1.21 121.20 123.10 3d4l s ILE 407 Ca 0.01 0.69 0.17 0.00 0.00 0.00 0.00 60.65 61.52 3d4l s ILE 407 Cb -0.01 -3.71 -0.24 0.00 0.01 0.00 0.00 42.46 38.52 3d4l s ILE 407 CO -0.05 0.32 0.10 -0.62 0.00 0.00 0.00 174.94 174.69 3d4l n GLU 408 N 3.93 0.94 -3.53 2.79 -0.58 0.12 -4.97 120.64 119.35 3d4l n GLU 408 Ca -0.10 -0.03 -0.12 0.00 -0.42 0.00 0.00 57.16 56.50 3d4l n GLU 408 Cb 0.51 -1.48 -0.04 0.00 -0.57 0.00 0.00 31.44 29.87 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 -2.54 -1.83 -0.04 0.62 0.00 -1.14 -4.90 121.76 111.92 3d4l s ALA 409 Ca -0.09 1.27 -0.01 0.00 0.00 0.00 0.00 51.96 53.13 3d4l s ALA 409 Cb 0.06 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.12 3d4l s ALA 409 CO 0.77 -0.46 0.03 -1.17 0.00 0.00 0.00 175.76 174.92 3d4l s LEU 410 N -1.63 0.55 0.50 0.00 2.96 -1.26 -0.74 118.68 119.06 3d4l s LEU 410 Ca -0.02 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 53.94 3d4l s LEU 410 Cb -0.01 -0.23 -0.01 0.00 0.50 0.00 0.00 46.19 46.45 3d4l s LEU 410 CO -0.00 -0.19 0.14 0.42 -1.32 0.00 0.00 176.35 175.40 3d4l s THR 411 N 1.78 1.49 0.47 3.68 -4.23 0.39 -5.01 115.64 114.22 3d4l s THR 411 Ca 0.01 -1.81 0.31 0.00 -1.18 0.00 0.00 61.69 59.01 3d4l s THR 411 Cb -0.12 -2.31 0.34 0.00 1.34 0.00 0.00 72.50 71.74 3d4l s THR 411 CO -0.03 0.00 2.15 0.77 -0.54 0.00 0.00 174.62 176.97 3d4l h SER 412 N 1.21 0.00 0.00 3.99 4.64 -2.01 -3.25 113.55 118.12 3d4l h SER 412 Ca -0.42 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3d4l h SER 412 Cb 1.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3d4l h SER 412 CO 0.69 0.07 -1.35 0.47 -0.87 0.00 0.00 176.83 175.84 3d4l n ASP 413 N -3.57 3.27 -3.99 4.97 8.00 -1.26 -4.91 116.55 119.06 3d4l n ASP 413 Ca -0.02 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.37 3d4l n ASP 413 Cb 0.18 1.32 -0.12 0.00 -0.02 0.00 0.00 41.12 42.49 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 -2.51 0.36 -0.10 1.24 1.51 -1.23 -1.07 117.35 115.54 3d4l s TYR 414 Ca -0.03 -0.45 0.02 0.00 -1.01 0.00 0.00 57.07 55.60 3d4l s TYR 414 Cb 0.05 -0.23 -0.02 0.00 -0.11 0.00 0.00 41.96 41.65 3d4l s TYR 414 CO 0.31 -0.13 -0.16 -1.17 -1.11 0.00 0.00 175.55 173.29 3d4l s LEU 415 N -1.28 2.59 -0.12 -1.29 0.20 -0.79 -0.46 118.68 117.53 3d4l s LEU 415 Ca -0.12 -0.34 -0.02 0.00 0.69 0.00 0.00 54.13 54.34 3d4l s LEU 415 Cb -0.09 -1.56 -0.03 0.00 -0.43 0.00 0.00 46.19 44.09 3d4l s LEU 415 CO -0.00 0.21 -0.05 -0.31 -0.29 0.00 0.00 176.35 175.91 3d4l s TYR 416 N 0.08 3.00 0.11 5.38 1.51 0.08 -1.06 117.35 126.44 3d4l s TYR 416 Ca -0.07 -0.16 -0.07 0.00 -1.01 0.00 0.00 57.07 55.77 3d4l s TYR 416 Cb -0.15 -1.85 -0.01 0.00 -0.11 0.00 0.00 41.96 39.83 3d4l s TYR 416 CO 0.05 0.13 0.17 1.52 -1.11 0.00 0.00 175.55 176.31 3d4l s TYR 417 N -0.16 0.35 -0.08 2.71 -0.85 -0.40 0.16 117.35 119.08 3d4l s TYR 417 Ca 0.03 -0.78 0.00 0.00 -0.52 0.00 0.00 57.07 55.80 3d4l s TYR 417 Cb -0.13 -0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.03 3d4l s TYR 417 CO 0.03 -0.56 -0.06 0.42 -1.52 0.00 0.00 175.55 173.85 3d4l s ILE 418 N -3.92 3.72 0.25 -3.49 -1.09 -0.35 -0.40 121.20 115.93 3d4l s ILE 418 Ca 0.11 -0.46 -0.09 0.00 -2.23 0.00 0.00 60.65 57.97 3d4l s ILE 418 Cb 0.05 -2.54 -0.01 0.00 -1.58 0.00 0.00 42.46 38.38 3d4l s ILE 418 CO -0.07 0.58 0.41 -0.94 -1.23 0.00 0.00 174.94 173.69 3d4l s SER 419 N -0.59 0.06 -0.38 3.58 1.04 -0.71 -0.05 113.70 116.65 3d4l s SER 419 Ca 0.09 -1.09 0.06 0.00 0.48 0.00 0.00 55.95 55.49 3d4l s SER 419 Cb -0.12 0.55 0.54 0.00 0.10 0.00 0.00 66.02 67.09 3d4l s SER 419 CO 0.02 -1.10 1.62 -0.46 0.98 0.00 0.00 173.24 174.30 3d4l n ASN 420 N -0.47 3.60 -0.15 7.02 0.23 -1.06 -1.49 115.26 122.95 3d4l n ASN 420 Ca -0.01 -3.75 -0.12 0.00 -0.53 0.00 0.00 54.58 50.18 3d4l n ASN 420 Cb 0.63 -0.70 -0.01 0.00 -2.08 0.00 0.00 39.78 37.61 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 1.22 0.90 -6.22 -3.83 4.81 -1.85 -3.34 114.58 106.28 3d4l h GLU 421 Ca 0.39 -0.39 -0.70 0.00 -0.13 0.00 0.00 59.36 58.53 3d4l h GLU 421 Cb 1.86 -0.03 0.04 0.00 0.63 0.00 0.00 28.75 31.24 3d4l h GLU 421 CO 0.74 1.04 0.65 0.98 -0.73 0.00 0.00 179.01 181.70 3d4l n TYR 422 N -4.19 1.76 -1.39 0.92 9.36 -1.26 -1.14 117.16 121.22 3d4l n TYR 422 Ca -0.01 0.58 -0.14 0.00 3.32 0.00 0.00 57.90 61.65 3d4l n TYR 422 Cb 0.44 -2.39 -0.06 0.00 -0.63 0.00 0.00 39.34 36.69 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 3.77 -1.33 -2.17 2.98 5.02 -1.26 -2.34 118.16 122.82 3d4l n LYS 423 Ca 0.22 0.82 -0.19 0.00 -2.02 0.00 0.00 58.31 57.13 3d4l n LYS 423 Cb 0.17 -5.07 -0.03 0.00 -0.02 0.00 0.00 35.03 30.08 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 -0.23 0.16 3.37 0.72 0.00 -0.29 -4.95 105.19 103.97 3d4l n GLY 424 Ca -0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.43 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 -4.66 3.02 0.60 1.61 -1.94 -0.99 -4.94 119.30 112.00 3d4l s MET 425 Ca 0.00 -1.38 0.40 0.00 -1.71 0.00 0.00 55.69 53.00 3d4l s MET 425 Cb 0.00 -4.20 2.13 0.00 2.01 0.00 0.00 34.83 34.77 3d4l s MET 425 CO 0.00 -1.23 2.22 -1.00 -0.01 0.00 0.00 175.02 175.00 3d4l h PRO 426 N 8.90 0.00 -0.46 2.03 0.13 -1.89 -1.73 132.00 138.99 3d4l h PRO 426 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 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 0.98 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.16 3d4l n GLY 427 N -1.00 1.34 3.80 1.56 0.00 -1.26 -4.88 105.19 104.76 3d4l n GLY 427 Ca -0.02 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.16 1.53 -0.03 -0.02 0.00 -0.65 -2.56 107.32 104.43 3d4l s GLY 428 Ca 0.36 -1.51 -0.01 0.00 0.00 0.00 0.00 44.72 43.56 3d4l s GLY 428 CO 0.26 -1.53 0.06 0.50 0.00 0.00 0.00 173.10 172.38 3d4l s ARG 429 N -3.84 -0.02 0.07 2.90 1.81 0.16 -4.14 118.95 115.88 3d4l s ARG 429 Ca 0.34 0.26 0.01 0.00 -1.72 0.00 0.00 55.73 54.62 3d4l s ARG 429 Cb -0.07 -0.27 -0.04 0.00 -0.45 0.00 0.00 34.95 34.12 3d4l s ARG 429 CO 0.24 -0.19 -0.06 -0.80 -0.68 0.00 0.00 175.30 173.81 3d4l s ASN 430 N 1.28 0.89 -0.14 0.23 0.01 -0.55 -1.06 114.94 115.59 3d4l s ASN 430 Ca -0.07 -0.91 -0.14 0.00 -0.71 0.00 0.00 52.86 51.03 3d4l s ASN 430 Cb -0.13 0.11 -0.05 0.00 0.41 0.00 0.00 41.25 41.60 3d4l s ASN 430 CO -0.04 -0.45 0.31 -0.22 -1.51 0.00 0.00 177.10 175.19 3d4l s LEU 431 N -2.71 4.28 0.18 0.60 2.96 -1.26 -1.74 118.68 120.98 3d4l s LEU 431 Ca 0.06 0.57 0.08 0.00 -0.22 0.00 0.00 54.13 54.62 3d4l s LEU 431 Cb 0.03 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.27 3d4l s LEU 431 CO -0.05 0.13 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.64 3d4l s TYR 432 N 0.25 1.72 -0.10 5.38 1.51 0.46 -0.29 117.35 126.28 3d4l s TYR 432 Ca 0.18 -0.52 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 3d4l s TYR 432 Cb -0.13 -0.84 0.02 0.00 -0.11 0.00 0.00 41.96 40.90 3d4l s TYR 432 CO 0.05 0.32 -0.13 0.21 -1.11 0.00 0.00 175.55 174.89 3d4l s LYS 433 N -3.13 1.95 -0.07 -0.62 2.20 -0.02 -1.27 119.74 118.78 3d4l s LYS 433 Ca 0.18 -0.47 0.05 0.00 -0.36 0.00 0.00 55.97 55.37 3d4l s LYS 433 Cb -0.04 -1.70 -0.01 0.00 -1.51 0.00 0.00 37.83 34.57 3d4l s LYS 433 CO 0.06 -0.08 -0.23 -1.50 -0.36 0.00 0.00 175.35 173.25 3d4l s ILE 434 N 1.03 2.26 -0.18 5.43 2.07 -0.23 -1.05 121.20 130.53 3d4l s ILE 434 Ca -0.07 -0.98 -0.29 0.00 -1.41 0.00 0.00 60.65 57.90 3d4l s ILE 434 Cb -0.15 -1.85 -0.01 0.00 0.13 0.00 0.00 42.46 40.58 3d4l s ILE 434 CO -0.01 0.56 1.27 -1.58 -1.91 0.00 0.00 174.94 173.27 3d4l s GLN 435 N -0.06 4.20 0.50 3.50 0.74 -0.68 -1.89 119.66 125.97 3d4l s GLN 435 Ca -0.06 1.63 0.23 0.00 0.05 0.00 0.00 55.36 57.21 3d4l s GLN 435 Cb -0.15 -3.78 1.32 0.00 1.10 0.00 0.00 33.01 31.50 3d4l s GLN 435 CO 0.05 -0.75 2.05 -0.07 -0.55 0.00 0.00 175.29 176.02 3d4l h LEU 436 N 9.85 0.00 -0.36 3.68 3.38 -1.45 -1.94 115.31 128.46 3d4l h LEU 436 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3d4l h LEU 436 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3d4l h LEU 436 CO 0.98 0.14 -0.23 -1.54 0.09 0.00 0.00 178.44 177.88 3d4l n SER 437 N -3.84 0.79 -3.23 -0.43 3.41 -1.26 -4.64 113.62 104.41 3d4l n SER 437 Ca -0.02 -0.70 -0.02 0.00 -0.26 0.00 0.00 58.87 57.87 3d4l n SER 437 Cb 0.24 0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.24 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 -2.55 -1.07 0.67 4.04 -1.08 -0.74 -5.02 116.67 110.91 3d4l s ASP 438 Ca 0.24 -0.94 0.36 0.00 -0.52 0.00 0.00 52.55 51.68 3d4l s ASP 438 Cb 0.19 1.72 1.94 0.00 -1.46 0.00 0.00 42.92 45.32 3d4l s ASP 438 CO 0.52 -0.18 2.10 1.88 0.52 0.00 0.00 175.17 180.01 3d4l h TYR 439 N 6.97 0.00 0.00 -5.34 0.05 -1.81 0.79 116.97 117.64 3d4l h TYR 439 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 3d4l h TYR 439 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3d4l h TYR 439 CO 0.18 0.00 0.00 0.25 -1.05 0.00 0.00 178.16 177.54 3d4l n THR 440 N -2.99 0.24 -3.30 -2.88 -2.24 -1.26 -4.41 114.28 97.43 3d4l n THR 440 Ca -0.02 0.06 -0.46 0.00 -2.27 0.00 0.00 64.05 61.35 3d4l n THR 440 Cb 0.26 -0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 67.82 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 -2.76 3.38 -0.13 -0.78 -0.14 0.27 -5.01 119.74 114.58 3d4l s LYS 441 Ca 0.19 -2.15 0.02 0.00 -1.36 0.00 0.00 55.97 52.67 3d4l s LYS 441 Cb 0.17 -4.40 0.01 0.00 -1.68 0.00 0.00 37.83 31.93 3d4l s LYS 441 CO 0.41 -1.33 -0.19 0.08 -0.76 0.00 0.00 175.35 173.57 3d4l s VAL 442 N 0.82 1.81 -0.12 3.17 1.01 -1.26 -1.69 120.40 124.14 3d4l s VAL 442 Ca 0.13 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.29 3d4l s VAL 442 Cb -0.17 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 3d4l s VAL 442 CO -0.04 0.50 -0.15 -0.89 0.00 0.00 0.00 175.10 174.52 3d4l s THR 443 N 0.91 2.89 -0.24 3.92 2.01 -0.21 -4.96 115.64 119.95 3d4l s THR 443 Ca -0.06 -0.73 -0.22 0.00 0.31 0.00 0.00 61.69 60.99 3d4l s THR 443 Cb -0.15 -2.19 -0.01 0.00 0.01 0.00 0.00 72.50 70.15 3d4l s THR 443 CO -0.02 0.53 0.72 0.00 -0.69 0.00 0.00 174.62 175.17 3d4l h LEU 445 N 8.95 0.00 0.00 0.00 3.38 -1.00 -3.40 115.31 123.24 3d4l h LEU 445 Ca -0.26 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3d4l h LEU 445 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3d4l h LEU 445 CO 0.82 0.04 -0.49 -1.54 0.09 0.00 0.00 178.44 177.36 3d4l n SER 446 N -2.46 2.44 -0.22 -0.43 3.41 -1.22 -4.81 113.62 110.33 3d4l n SER 446 Ca 0.03 -0.14 0.02 0.00 -0.26 0.00 0.00 58.87 58.52 3d4l n SER 446 Cb 0.48 0.78 0.11 0.00 -0.26 0.00 0.00 64.21 65.31 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 -5.30 2.83 -0.09 0.00 -0.58 -1.26 -4.12 120.64 112.11 3d4l n GLU 448 Ca 0.10 -2.67 -0.09 0.00 -0.42 0.00 0.00 57.16 54.07 3d4l n GLU 448 Cb 0.37 -1.61 -0.02 0.00 -0.57 0.00 0.00 31.44 29.61 3d4l n GLU 448 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3d4l h LEU 449 N 4.28 0.36 -5.00 -4.62 3.38 -1.80 -3.39 115.31 108.52 3d4l h LEU 449 Ca 0.00 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 3d4l h LEU 449 Cb 1.04 -0.09 -0.15 0.00 0.09 0.00 0.00 40.66 41.55 3d4l h LEU 449 CO 0.03 0.30 -0.43 -3.20 0.09 0.00 0.00 178.44 175.24 3d4l n ASN 450 N -4.84 -2.98 -0.17 -0.43 2.85 -1.26 -5.04 115.26 103.38 3d4l n ASN 450 Ca -0.02 -2.74 0.24 0.00 -0.11 0.00 0.00 54.58 51.96 3d4l n ASN 450 Cb 0.05 1.61 0.65 0.00 1.24 0.00 0.00 39.78 43.33 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 4.55 0.14 0.21 1.20 0.13 -1.76 0.50 132.00 136.96 3d4l h PRO 451 Ca -0.02 -0.01 -0.30 0.00 -0.87 0.00 0.00 66.00 64.80 3d4l h PRO 451 Cb 1.10 -0.03 0.03 0.00 0.13 0.00 0.00 31.00 32.23 3d4l h PRO 451 CO 0.07 0.09 -1.30 0.93 -0.23 0.00 0.00 178.00 177.57 3d4l h GLU 452 N 0.14 0.51 0.00 0.86 5.08 -1.96 -3.37 114.58 115.84 3d4l h GLU 452 Ca 0.41 -0.83 -0.25 0.00 -1.00 0.00 0.00 59.36 57.70 3d4l h GLU 452 Cb 1.41 0.30 -0.04 0.00 0.50 0.00 0.00 28.75 30.92 3d4l h GLU 452 CO -0.07 1.39 -1.56 -0.09 -1.00 0.00 0.00 179.01 177.68 3d4l h ARG 453 N 0.06 0.00 -4.29 2.33 2.43 -1.81 -3.42 114.38 109.68 3d4l h ARG 453 Ca -0.22 0.00 -0.60 0.00 -0.81 0.00 0.00 59.98 58.35 3d4l h ARG 453 Cb 2.01 0.00 -0.38 0.00 -0.42 0.00 0.00 29.97 31.18 3d4l h ARG 453 CO 0.24 0.45 -0.79 0.00 -1.51 0.00 0.00 179.97 178.37 3d4l n GLN 455 N 4.72 0.68 -3.58 0.00 6.02 0.27 -4.38 117.38 121.12 3d4l n GLN 455 Ca -0.12 -0.69 -0.29 0.00 -0.01 0.00 0.00 57.00 55.89 3d4l n GLN 455 Cb 0.45 -0.64 -0.15 0.00 1.02 0.00 0.00 30.24 30.92 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 -0.24 0.74 0.13 1.08 6.14 -1.11 -0.67 117.35 123.42 3d4l s TYR 456 Ca 0.00 -1.23 0.07 0.00 0.64 0.00 0.00 57.07 56.56 3d4l s TYR 456 Cb 0.00 -1.12 -0.04 0.00 0.42 0.00 0.00 41.96 41.22 3d4l s TYR 456 CO 0.00 -0.84 -0.07 0.71 0.64 0.00 0.00 175.55 176.00 3d4l s TYR 457 N 1.79 2.77 0.16 4.97 2.02 -0.23 -0.64 117.35 128.20 3d4l s TYR 457 Ca 0.11 -0.15 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 3d4l s TYR 457 Cb -0.18 -1.41 -0.05 0.00 -0.40 0.00 0.00 41.96 39.93 3d4l s TYR 457 CO -0.28 0.47 -0.04 -1.54 -1.57 0.00 0.00 175.55 172.59 3d4l s SER 458 N -2.49 1.50 0.05 2.29 1.04 -0.58 -4.61 113.70 110.91 3d4l s SER 458 Ca 0.24 -1.10 0.00 0.00 0.48 0.00 0.00 55.95 55.57 3d4l s SER 458 Cb -0.10 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.04 3d4l s SER 458 CO 0.16 -0.46 -0.04 0.54 0.98 0.00 0.00 173.24 174.41 3d4l s VAL 459 N -3.50 0.32 -0.21 5.02 0.11 -1.26 -1.08 120.40 119.81 3d4l s VAL 459 Ca 0.20 -1.56 -0.04 0.00 -2.93 0.00 0.00 61.98 57.65 3d4l s VAL 459 Cb 0.05 -1.18 0.07 0.00 -1.53 0.00 0.00 36.38 33.79 3d4l s VAL 459 CO 0.02 -0.80 0.09 -0.55 -3.33 0.00 0.00 175.10 170.53 3d4l s SER 460 N -2.48 2.78 0.30 3.54 0.15 -0.23 -4.97 113.70 112.78 3d4l s SER 460 Ca 0.01 -0.84 -0.11 0.00 0.70 0.00 0.00 55.95 55.71 3d4l s SER 460 Cb 0.02 -0.36 -0.08 0.00 -1.71 0.00 0.00 66.02 63.89 3d4l s SER 460 CO -0.06 -0.36 0.66 -0.36 1.20 0.00 0.00 173.24 174.31 3d4l s PHE 461 N 2.06 3.42 1.14 3.44 0.40 -1.26 -0.40 117.98 126.76 3d4l s PHE 461 Ca 0.03 1.01 -0.19 0.00 -0.60 0.00 0.00 56.93 57.19 3d4l s PHE 461 Cb -0.16 -2.38 0.27 0.00 0.51 0.00 0.00 43.02 41.25 3d4l s PHE 461 CO -0.15 0.13 1.19 -1.54 0.70 0.00 0.00 175.22 175.55 3d4l s SER 462 N -2.52 1.54 0.24 1.36 1.04 -0.04 -4.86 113.70 110.45 3d4l s SER 462 Ca 0.50 0.44 -0.07 0.00 0.48 0.00 0.00 55.95 57.30 3d4l s SER 462 Cb -0.11 -0.56 0.41 0.00 0.10 0.00 0.00 66.02 65.86 3d4l s SER 462 CO 0.22 -3.72 1.67 0.11 0.98 0.00 0.00 173.24 172.50 3d4l h LYS 463 N -2.31 0.19 -0.31 4.02 1.79 -1.68 -2.00 116.57 116.26 3d4l h LYS 463 Ca -0.44 -0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 57.95 3d4l h LYS 463 Cb 1.27 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.83 3d4l h LYS 463 CO 0.33 0.12 0.00 0.39 -1.08 0.00 0.00 179.45 179.21 3d4l n GLU 464 N -5.23 2.58 -1.92 3.15 -0.58 -1.26 -4.95 120.64 112.42 3d4l n GLU 464 Ca 0.13 -2.95 -0.16 0.00 -0.42 0.00 0.00 57.16 53.76 3d4l n GLU 464 Cb 0.44 -1.85 -0.03 0.00 -0.57 0.00 0.00 31.44 29.42 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 -0.72 -0.37 0.16 0.62 0.00 -0.75 -4.90 120.51 114.55 3d4l n ALA 465 Ca 0.26 0.19 0.01 0.00 0.00 0.00 0.00 53.44 53.89 3d4l n ALA 465 Cb 0.96 -1.74 0.25 0.00 0.00 0.00 0.00 19.45 18.92 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 0.00 -4.56 0.00 3.64 -1.80 -3.42 116.57 110.43 3d4l h LYS 466 Ca -0.35 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 58.81 3d4l h LYS 466 Cb 1.17 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.84 3d4l h LYS 466 CO 0.46 0.51 -0.67 0.71 -2.27 0.00 0.00 179.45 178.19 3d4l s TYR 467 N -3.82 0.90 -0.08 1.91 2.02 -1.26 -0.90 117.35 116.12 3d4l s TYR 467 Ca -0.02 -1.04 -0.12 0.00 -0.37 0.00 0.00 57.07 55.52 3d4l s TYR 467 Cb 0.13 -0.53 0.03 0.00 -0.40 0.00 0.00 41.96 41.18 3d4l s TYR 467 CO 0.74 -0.29 0.30 1.52 -1.57 0.00 0.00 175.55 176.25 3d4l s TYR 468 N -3.78 -0.27 -0.21 2.71 1.13 -0.52 -0.86 117.35 115.54 3d4l s TYR 468 Ca 0.17 0.60 -0.09 0.00 -1.41 0.00 0.00 57.07 56.33 3d4l s TYR 468 Cb 0.07 0.10 -0.05 0.00 -1.10 0.00 0.00 41.96 40.98 3d4l s TYR 468 CO -0.02 -0.24 0.12 -1.14 -2.51 0.00 0.00 175.55 171.76 3d4l s GLN 469 N -0.38 4.04 -0.11 -3.49 0.74 0.46 -0.51 119.66 120.41 3d4l s GLN 469 Ca -0.05 -0.29 -0.09 0.00 0.05 0.00 0.00 55.36 54.98 3d4l s GLN 469 Cb -0.03 -3.40 -0.04 0.00 1.10 0.00 0.00 33.01 30.63 3d4l s GLN 469 CO 0.02 0.16 0.20 -0.51 -0.55 0.00 0.00 175.29 174.60 3d4l s LEU 470 N 0.73 4.38 -0.29 3.68 1.43 0.50 -1.06 118.68 128.06 3d4l s LEU 470 Ca 0.06 0.54 0.02 0.00 -1.03 0.00 0.00 54.13 53.72 3d4l s LEU 470 Cb -0.13 -2.18 0.08 0.00 0.03 0.00 0.00 46.19 43.99 3d4l s LEU 470 CO 0.02 0.36 0.00 -0.13 0.23 0.00 0.00 176.35 176.83 3d4l s ARG 471 N -0.85 1.50 -0.15 1.70 0.52 -0.24 -1.73 118.95 119.70 3d4l s ARG 471 Ca 0.16 -1.36 -0.20 0.00 -0.52 0.00 0.00 55.73 53.81 3d4l s ARG 471 Cb -0.13 -2.74 -0.03 0.00 0.52 0.00 0.00 34.95 32.57 3d4l s ARG 471 CO 0.05 -0.78 0.57 0.00 0.02 0.00 0.00 175.30 175.17 3d4l n SER 473 N 4.37 2.38 0.00 0.00 3.41 0.19 -1.80 113.62 122.17 3d4l n SER 473 Ca -0.04 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.55 3d4l n SER 473 Cb 0.51 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.11 1.15 0.12 5.00 0.00 -1.26 -1.06 105.19 109.03 3d4l n GLY 474 Ca 0.05 -1.09 0.12 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.79 0.22 -0.38 1.61 -0.04 -0.49 -0.56 135.00 134.56 3d4l n PRO 475 Ca 0.00 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 3d4l n PRO 475 Cb 0.00 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 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 0.48 0.23 3.77 0.55 0.00 -0.25 -4.49 105.19 105.48 3d4l n GLY 476 Ca 0.03 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 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 4.31 0.35 0.99 1.43 -1.26 -4.60 118.68 119.89 3d4l s LEU 477 Ca 0.00 2.78 -0.27 0.00 -1.03 0.00 0.00 54.13 55.61 3d4l s LEU 477 Cb 0.00 -3.76 -0.12 0.00 0.03 0.00 0.00 46.19 42.34 3d4l s LEU 477 CO 0.00 -0.77 1.11 -2.65 0.23 0.00 0.00 176.35 174.27 3d4l n PRO 478 N 0.41 1.62 -4.09 1.29 -0.02 -1.26 -4.77 135.00 128.18 3d4l n PRO 478 Ca 0.02 0.57 -0.21 0.00 -2.02 0.00 0.00 63.50 61.86 3d4l n PRO 478 Cb 0.42 -2.07 -0.17 0.00 -0.02 0.00 0.00 33.50 31.66 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 -0.35 1.19 -0.17 2.45 2.96 -0.74 -4.31 118.68 119.71 3d4l s LEU 479 Ca 0.59 -0.15 -0.02 0.00 -0.22 0.00 0.00 54.13 54.33 3d4l s LEU 479 Cb -0.61 -0.50 -0.01 0.00 0.50 0.00 0.00 46.19 45.56 3d4l s LEU 479 CO 0.60 -0.08 -0.08 -0.31 -1.32 0.00 0.00 176.35 175.16 3d4l s TYR 480 N 1.17 2.91 0.09 5.38 1.51 0.11 -1.38 117.35 127.15 3d4l s TYR 480 Ca -0.07 -0.69 0.04 0.00 -1.01 0.00 0.00 57.07 55.34 3d4l s TYR 480 Cb -0.14 -1.97 -0.03 0.00 -0.11 0.00 0.00 41.96 39.71 3d4l s TYR 480 CO -0.01 -0.31 -0.11 0.95 -1.11 0.00 0.00 175.55 174.97 3d4l s THR 481 N 0.78 0.96 -0.06 -0.71 -4.23 -0.71 0.43 115.64 112.10 3d4l s THR 481 Ca -0.03 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 58.91 3d4l s THR 481 Cb -0.15 -1.31 -0.03 0.00 1.34 0.00 0.00 72.50 72.35 3d4l s THR 481 CO 0.01 -0.51 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.28 3d4l s LEU 482 N -2.34 3.06 0.06 4.79 2.96 -0.23 -0.37 118.68 126.61 3d4l s LEU 482 Ca 0.04 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.90 3d4l s LEU 482 Cb -0.04 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 3d4l s LEU 482 CO 0.00 0.36 -0.07 -1.00 -1.32 0.00 0.00 176.35 174.32 3d4l s HIS 483 N -0.77 0.69 -0.19 5.38 3.76 0.33 0.10 115.29 124.58 3d4l s HIS 483 Ca 0.12 -0.67 -0.08 0.00 -0.15 0.00 0.00 55.06 54.28 3d4l s HIS 483 Cb -0.11 -0.41 -0.04 0.00 1.11 0.00 0.00 32.58 33.13 3d4l s HIS 483 CO 0.01 -0.13 0.07 -1.54 -0.85 0.00 0.00 174.74 172.30 3d4l s SER 484 N -2.10 5.66 0.40 1.40 1.04 -0.76 -1.44 113.70 117.90 3d4l s SER 484 Ca -0.03 0.07 0.20 0.00 0.48 0.00 0.00 55.95 56.67 3d4l s SER 484 Cb -0.04 -1.98 0.81 0.00 0.10 0.00 0.00 66.02 64.91 3d4l s SER 484 CO -0.02 0.15 1.80 0.28 0.98 0.00 0.00 173.24 176.43 3d4l h SER 485 N 6.85 0.00 -0.54 7.02 0.02 -1.27 0.48 113.55 126.12 3d4l h SER 485 Ca -0.37 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.63 3d4l h SER 485 Cb 1.17 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.68 3d4l h SER 485 CO 0.70 0.33 0.36 1.62 -1.14 0.00 0.00 176.83 178.69 3d4l h VAL 486 N 0.00 1.02 0.00 2.27 3.04 -1.90 -3.24 116.25 117.44 3d4l h VAL 486 Ca -0.00 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.50 3d4l h VAL 486 Cb 0.78 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 3d4l h VAL 486 CO 0.04 0.10 0.00 -0.46 -1.01 0.00 0.00 177.57 176.24 3d4l n ASN 487 N -4.47 0.35 -3.55 3.17 2.04 -1.23 -5.02 115.26 106.54 3d4l n ASN 487 Ca 0.07 -1.16 -0.26 0.00 -0.44 0.00 0.00 54.58 52.79 3d4l n ASN 487 Cb 0.20 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.44 3d4l n ASN 487 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 3d4l n ASP 488 N -0.08 -3.72 -4.90 0.53 10.43 0.15 -4.96 116.55 114.01 3d4l n ASP 488 Ca 0.00 -0.53 -0.32 0.00 2.57 0.00 0.00 54.79 56.51 3d4l n ASP 488 Cb 0.42 -3.06 -0.05 0.00 1.84 0.00 0.00 41.12 40.27 3d4l n ASP 488 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 3d4l s LYS 489 N -6.22 3.55 0.08 -1.24 -0.14 -1.19 -4.88 119.74 109.71 3d4l s LYS 489 Ca 0.48 -0.19 -0.30 0.00 -1.36 0.00 0.00 55.97 54.59 3d4l s LYS 489 Cb -0.25 -2.97 -0.05 0.00 -1.68 0.00 0.00 37.83 32.87 3d4l s LYS 489 CO 0.59 0.56 1.11 0.20 -0.76 0.00 0.00 175.35 177.05 3d4l s GLY 490 N -2.25 2.67 -0.16 -3.33 0.00 -1.26 -1.84 107.32 101.15 3d4l s GLY 490 Ca 0.35 0.74 -0.11 0.00 0.00 0.00 0.00 44.72 45.71 3d4l s GLY 490 CO 0.23 1.83 0.24 1.04 0.00 0.00 0.00 173.10 176.44 3d4l n LEU 491 N 3.49 2.41 -3.60 0.66 4.77 0.12 -4.94 117.00 119.91 3d4l n LEU 491 Ca 0.06 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 3d4l n LEU 491 Cb 0.48 -1.05 -0.01 0.00 -2.33 0.00 0.00 43.42 40.51 3d4l n LEU 491 CO 0.54 0.69 1.12 0.00 -1.33 0.00 0.00 177.39 178.41 3d4l s ARG 492 N -2.50 0.20 -0.10 3.23 1.70 -1.16 -5.01 118.95 115.31 3d4l s ARG 492 Ca -0.26 -0.10 -0.18 0.00 -0.47 0.00 0.00 55.73 54.72 3d4l s ARG 492 Cb 0.07 0.07 -0.04 0.00 -0.57 0.00 0.00 34.95 34.48 3d4l s ARG 492 CO 0.69 -0.09 0.48 0.08 -1.08 0.00 0.00 175.30 175.39 3d4l s VAL 493 N -2.23 5.15 -0.16 4.99 1.01 -1.26 -1.06 120.40 126.83 3d4l s VAL 493 Ca 0.13 0.98 0.01 0.00 0.00 0.00 0.00 61.98 63.09 3d4l s VAL 493 Cb 0.03 -3.82 -0.23 0.00 0.00 0.00 0.00 36.38 32.36 3d4l s VAL 493 CO -0.04 0.35 0.20 0.18 0.00 0.00 0.00 175.10 175.79 3d4l n LEU 494 N 3.44 2.27 -3.63 3.92 4.77 0.17 -4.94 117.00 122.99 3d4l n LEU 494 Ca -0.08 0.11 -0.03 0.00 -0.03 0.00 0.00 56.01 55.98 3d4l n LEU 494 Cb 0.52 -0.74 -0.05 0.00 -2.33 0.00 0.00 43.42 40.82 3d4l n LEU 494 CO 0.43 0.79 0.32 -0.70 -1.33 0.00 0.00 177.39 176.90 3d4l s GLU 495 N -2.55 0.61 0.00 3.23 2.56 -1.04 -4.99 118.70 116.52 3d4l s GLU 495 Ca -0.23 1.31 0.07 0.00 0.00 0.00 0.00 54.97 56.12 3d4l s GLU 495 Cb 0.07 0.56 0.05 0.00 2.00 0.00 0.00 34.13 36.81 3d4l s GLU 495 CO 0.73 -0.17 0.70 -0.40 -0.56 0.00 0.00 175.26 175.55 3d4l n ASP 496 N 4.96 1.51 -2.98 -1.70 5.68 -1.26 -0.71 116.55 122.04 3d4l n ASP 496 Ca -0.15 -1.26 -0.22 0.00 -0.50 0.00 0.00 54.79 52.66 3d4l n ASP 496 Cb 0.53 0.05 0.04 0.00 -1.14 0.00 0.00 41.12 40.60 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 0.31 -6.08 0.08 -1.12 3.02 -1.26 -4.82 115.26 105.39 3d4l n ASN 497 Ca 0.04 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.29 3d4l n ASN 497 Cb 0.17 -4.89 0.32 0.00 -0.61 0.00 0.00 39.78 34.77 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 -1.45 0.31 0.06 6.41 4.64 -1.94 -1.42 113.55 120.16 3d4l h SER 498 Ca -0.52 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 60.71 3d4l h SER 498 Cb 1.36 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3d4l h SER 498 CO 0.56 0.51 -0.03 0.00 -0.87 0.00 0.00 176.83 177.00 3d4l h ALA 499 N 1.52 -0.09 -0.56 5.18 0.00 -1.99 -0.88 119.26 122.45 3d4l h ALA 499 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3d4l h ALA 499 Cb 0.49 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3d4l h ALA 499 CO 0.03 -0.55 0.24 1.25 0.00 0.00 0.00 179.25 180.23 3d4l h LEU 500 N -0.09 0.75 -1.14 0.00 5.85 -1.80 -2.31 115.31 116.58 3d4l h LEU 500 Ca -0.01 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.64 3d4l h LEU 500 Cb 0.07 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 3d4l h LEU 500 CO 0.01 0.69 0.59 -0.78 -0.34 0.00 0.00 178.44 178.62 3d4l h ASP 501 N 0.75 0.89 -0.40 1.25 3.58 -0.98 0.57 116.42 122.08 3d4l h ASP 501 Ca 0.19 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.63 3d4l h ASP 501 Cb 0.16 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 3d4l h ASP 501 CO -0.02 0.54 0.17 0.50 -2.88 0.00 0.00 179.24 177.55 3d4l h LYS 502 N 0.99 0.60 -0.37 0.28 3.11 -0.69 -2.58 116.57 117.91 3d4l h LYS 502 Ca 0.41 -0.10 -0.03 0.00 -2.81 0.00 0.00 60.65 58.12 3d4l h LYS 502 Cb 0.29 -0.10 -0.02 0.00 -1.00 0.00 0.00 32.23 31.41 3d4l h LYS 502 CO -0.17 0.55 0.13 0.52 -2.81 0.00 0.00 179.45 177.68 3d4l h MET 503 N 0.51 0.57 0.00 1.90 2.86 -0.71 -2.81 114.93 117.25 3d4l h MET 503 Ca 0.14 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3d4l h MET 503 Cb 0.17 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.75 3d4l h MET 503 CO -0.01 0.57 0.00 -0.07 1.06 0.00 0.00 176.91 178.45 3d4l h LEU 504 N 0.45 0.00 -1.46 1.22 3.38 -0.80 -2.79 115.31 115.31 3d4l h LEU 504 Ca 0.12 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.11 3d4l h LEU 504 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3d4l h LEU 504 CO -0.01 0.00 0.38 1.56 0.09 0.00 0.00 178.44 180.46 3d4l h GLN 505 N 0.00 0.71 -0.80 1.13 1.08 -1.18 -1.93 115.11 114.12 3d4l h GLN 505 Ca 0.00 -0.04 -0.11 0.00 -1.45 0.00 0.00 58.65 57.05 3d4l h GLN 505 Cb 0.22 -0.16 -0.07 0.00 -0.05 0.00 0.00 27.48 27.43 3d4l h GLN 505 CO 0.00 0.47 0.14 0.09 -0.95 0.00 0.00 178.83 178.58 3d4l n ASN 506 N -4.46 4.09 -4.15 1.46 3.02 -1.05 -4.88 115.26 109.29 3d4l n ASN 506 Ca 0.06 -2.80 -0.24 0.00 -0.03 0.00 0.00 54.58 51.58 3d4l n ASN 506 Cb 0.08 -0.66 -0.15 0.00 -0.61 0.00 0.00 39.78 38.44 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 -2.26 1.29 -1.03 2.41 1.01 -0.73 -3.47 120.40 117.63 3d4l s VAL 507 Ca 0.39 -0.71 -0.21 0.00 0.00 0.00 0.00 61.98 61.45 3d4l s VAL 507 Cb 0.31 -1.08 0.08 0.00 0.00 0.00 0.00 36.38 35.68 3d4l s VAL 507 CO 0.10 0.36 1.40 -1.10 0.00 0.00 0.00 175.10 175.86 3d4l s GLN 508 N -0.40 3.65 0.38 2.72 -0.21 0.59 -4.97 119.66 121.42 3d4l s GLN 508 Ca 0.06 -1.40 -0.16 0.00 0.02 0.00 0.00 55.36 53.88 3d4l s GLN 508 Cb -0.06 -5.26 -0.09 0.00 1.00 0.00 0.00 33.01 28.59 3d4l s GLN 508 CO -0.01 -2.10 0.83 -1.64 -2.12 0.00 0.00 175.29 170.26 3d4l s MET 509 N 4.25 4.04 0.79 2.91 -1.94 -1.26 -4.25 119.30 123.85 3d4l s MET 509 Ca 0.43 0.81 -0.12 0.00 -1.71 0.00 0.00 55.69 55.11 3d4l s MET 509 Cb -0.01 -2.32 0.07 0.00 2.01 0.00 0.00 34.83 34.58 3d4l s MET 509 CO -0.08 0.04 1.16 -1.25 -0.01 0.00 0.00 175.02 174.88 3d4l s PRO 510 N -3.23 2.10 0.34 2.03 0.04 -1.26 -4.32 135.00 130.69 3d4l s PRO 510 Ca 0.57 0.15 0.09 0.00 0.04 0.00 0.00 61.00 61.84 3d4l s PRO 510 Cb -0.10 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 3d4l s PRO 510 CO 0.19 -1.51 0.05 -1.54 0.04 0.00 0.00 177.00 174.23 3d4l s SER 511 N -4.55 4.34 -0.06 6.66 1.04 -0.40 -4.92 113.70 115.82 3d4l s SER 511 Ca 0.61 -0.92 0.04 0.00 0.48 0.00 0.00 55.95 56.16 3d4l s SER 511 Cb -0.11 -0.60 0.00 0.00 0.10 0.00 0.00 66.02 65.41 3d4l s SER 511 CO 0.49 -0.25 -0.18 -0.75 0.98 0.00 0.00 173.24 173.53 3d4l s LYS 512 N -3.76 2.11 -0.12 4.02 2.20 -1.26 -0.11 119.74 122.83 3d4l s LYS 512 Ca 0.36 -0.65 0.01 0.00 -0.36 0.00 0.00 55.97 55.32 3d4l s LYS 512 Cb -0.01 -1.74 -0.01 0.00 -1.51 0.00 0.00 37.83 34.56 3d4l s LYS 512 CO 0.20 0.19 -0.14 0.21 -0.36 0.00 0.00 175.35 175.45 3d4l s LYS 513 N 0.24 3.29 -0.17 4.03 2.20 -0.19 -4.95 119.74 124.19 3d4l s LYS 513 Ca -0.10 -0.70 0.01 0.00 -0.36 0.00 0.00 55.97 54.81 3d4l s LYS 513 Cb -0.14 -2.58 0.02 0.00 -1.51 0.00 0.00 37.83 33.62 3d4l s LYS 513 CO 0.04 0.24 -0.16 -1.17 -0.36 0.00 0.00 175.35 173.94 3d4l s LEU 514 N 0.27 1.95 0.00 5.43 2.96 -1.26 -0.59 118.68 127.44 3d4l s LEU 514 Ca -0.10 -0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 53.19 3d4l s LEU 514 Cb -0.16 -1.31 0.01 0.00 0.50 0.00 0.00 46.19 45.23 3d4l s LEU 514 CO 0.06 -0.04 0.11 -0.67 -1.32 0.00 0.00 176.35 174.49 3d4l n ASP 515 N 4.70 -0.33 -4.14 3.68 4.64 -0.68 -5.02 116.55 119.40 3d4l n ASP 515 Ca -0.18 -1.28 -0.10 0.00 -1.38 0.00 0.00 54.79 51.85 3d4l n ASP 515 Cb 0.50 0.56 -0.10 0.00 -1.04 0.00 0.00 41.12 41.04 3d4l n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 3d4l s PHE 516 N -6.91 0.88 0.09 -0.67 -0.71 -1.26 -0.64 117.98 108.76 3d4l s PHE 516 Ca 0.03 -1.22 0.06 0.00 -1.04 0.00 0.00 56.93 54.76 3d4l s PHE 516 Cb -0.01 -0.46 -0.03 0.00 -1.21 0.00 0.00 43.02 41.31 3d4l s PHE 516 CO 0.02 -0.56 -0.15 0.96 -1.34 0.00 0.00 175.22 174.15 3d4l s ILE 517 N -4.06 1.24 -0.23 -4.49 -4.36 -0.53 -4.94 121.20 103.83 3d4l s ILE 517 Ca 0.27 -1.48 -0.09 0.00 -0.26 0.00 0.00 60.65 59.09 3d4l s ILE 517 Cb 0.07 -1.29 -0.04 0.00 1.25 0.00 0.00 42.46 42.45 3d4l s ILE 517 CO 0.04 -0.28 0.11 -0.63 0.24 0.00 0.00 174.94 174.42 3d4l s ILE 518 N -1.59 4.88 -0.09 8.37 1.01 -1.26 -1.23 121.20 131.29 3d4l s ILE 518 Ca 0.03 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.70 3d4l s ILE 518 Cb -0.08 -3.27 0.02 0.00 0.01 0.00 0.00 42.46 39.14 3d4l s ILE 518 CO 0.03 0.36 -0.10 -0.76 0.00 0.00 0.00 174.94 174.47 3d4l s LEU 519 N 1.17 1.39 -1.45 2.97 1.43 -0.23 -4.77 118.68 119.20 3d4l s LEU 519 Ca 0.06 -0.30 -0.08 0.00 -1.03 0.00 0.00 54.13 52.78 3d4l s LEU 519 Cb -0.14 -0.83 0.04 0.00 0.03 0.00 0.00 46.19 45.29 3d4l s LEU 519 CO 0.04 -0.05 0.66 0.59 0.23 0.00 0.00 176.35 177.83 3d4l n ASN 520 N 4.43 -5.17 -0.19 2.29 4.13 -1.26 -1.15 115.26 118.34 3d4l n ASN 520 Ca -0.17 -0.40 -0.02 0.00 1.68 0.00 0.00 54.58 55.66 3d4l n ASN 520 Cb 0.51 -4.19 -0.01 0.00 -1.54 0.00 0.00 39.78 34.55 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 -4.09 -0.62 -5.16 3.52 -0.58 -1.26 -5.01 120.64 107.44 3d4l n GLU 521 Ca -0.05 0.37 -0.30 0.00 -0.42 0.00 0.00 57.16 56.77 3d4l n GLU 521 Cb 0.58 -3.98 -0.16 0.00 -0.57 0.00 0.00 31.44 27.30 3d4l n GLU 521 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3d4l s THR 522 N -1.87 1.87 0.05 2.62 2.01 -0.30 -5.12 115.64 114.90 3d4l s THR 522 Ca 0.00 -0.99 -0.28 0.00 0.31 0.00 0.00 61.69 60.73 3d4l s THR 522 Cb 0.00 -1.57 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 3d4l s THR 522 CO 0.00 0.53 0.89 -0.54 -0.69 0.00 0.00 174.62 174.80 3d4l s LYS 523 N -0.35 4.59 -0.11 4.92 1.02 -1.26 -1.07 119.74 127.48 3d4l s LYS 523 Ca 0.03 1.29 0.01 0.00 0.02 0.00 0.00 55.97 57.32 3d4l s LYS 523 Cb -0.11 -3.40 0.02 0.00 -0.52 0.00 0.00 37.83 33.82 3d4l s LYS 523 CO 0.01 0.16 -0.12 -0.06 -0.92 0.00 0.00 175.35 174.42 3d4l s PHE 524 N 0.28 1.80 0.33 3.18 0.40 -0.36 -4.97 117.98 118.64 3d4l s PHE 524 Ca 0.45 -0.88 -0.13 0.00 -0.60 0.00 0.00 56.93 55.76 3d4l s PHE 524 Cb -0.22 -1.36 -0.08 0.00 0.51 0.00 0.00 43.02 41.88 3d4l s PHE 524 CO 0.26 -0.50 0.72 -1.58 0.70 0.00 0.00 175.22 174.82 3d4l s TRP 525 N 1.25 3.40 0.13 0.36 0.52 -1.26 -1.45 118.94 121.89 3d4l s TRP 525 Ca -0.02 1.14 -0.08 0.00 0.02 0.00 0.00 56.10 57.16 3d4l s TRP 525 Cb -0.14 -2.48 -0.01 0.00 -1.15 0.00 0.00 33.47 29.69 3d4l s TRP 525 CO -0.05 0.08 0.22 1.52 0.02 0.00 0.00 176.95 178.74 3d4l s TYR 526 N -2.04 0.33 0.10 -1.98 -0.85 0.18 -1.35 117.35 111.75 3d4l s TYR 526 Ca 0.53 -0.73 0.03 0.00 -0.52 0.00 0.00 57.07 56.38 3d4l s TYR 526 Cb -0.10 -0.09 -0.04 0.00 0.38 0.00 0.00 41.96 42.11 3d4l s TYR 526 CO 0.20 -0.63 -0.09 1.14 -1.52 0.00 0.00 175.55 174.65 3d4l s GLN 527 N -3.93 0.86 -0.02 -3.49 -2.07 -0.57 -1.69 119.66 108.75 3d4l s GLN 527 Ca 0.12 -1.21 0.00 0.00 -1.82 0.00 0.00 55.36 52.46 3d4l s GLN 527 Cb 0.04 -0.48 0.03 0.00 -1.09 0.00 0.00 33.01 31.50 3d4l s GLN 527 CO -0.05 0.06 0.01 -1.64 -1.32 0.00 0.00 175.29 172.35 3d4l s MET 528 N -3.03 0.21 -0.34 9.60 -1.94 0.24 -1.77 119.30 122.27 3d4l s MET 528 Ca 0.07 0.09 -0.17 0.00 -1.71 0.00 0.00 55.69 53.97 3d4l s MET 528 Cb -0.01 -0.40 -0.01 0.00 2.01 0.00 0.00 34.83 36.42 3d4l s MET 528 CO -0.01 -0.13 0.46 0.42 -0.01 0.00 0.00 175.02 175.75 3d4l s ILE 529 N 0.93 5.08 -0.12 2.53 -1.09 0.40 -1.02 121.20 127.90 3d4l s ILE 529 Ca -0.09 0.27 -0.05 0.00 -2.23 0.00 0.00 60.65 58.56 3d4l s ILE 529 Cb -0.12 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.82 3d4l s ILE 529 CO -0.02 -0.15 0.05 -0.76 -1.23 0.00 0.00 174.94 172.83 3d4l s LEU 530 N 2.25 3.82 0.82 2.97 1.43 0.84 -1.93 118.68 128.89 3d4l s LEU 530 Ca 0.16 0.20 -0.13 0.00 -1.03 0.00 0.00 54.13 53.33 3d4l s LEU 530 Cb -0.16 -1.91 0.07 0.00 0.03 0.00 0.00 46.19 44.22 3d4l s LEU 530 CO 0.12 0.33 1.05 -2.65 0.23 0.00 0.00 176.35 175.44 3d4l n PRO 531 N 2.50 0.12 -1.55 1.29 -0.02 -1.26 -1.27 135.00 134.81 3d4l n PRO 531 Ca -0.18 0.11 -0.36 0.00 -2.02 0.00 0.00 63.50 61.04 3d4l n PRO 531 Cb 0.54 -2.31 0.08 0.00 -0.02 0.00 0.00 33.50 31.78 3d4l n PRO 531 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3d4l n PRO 532 N -2.90 0.82 -3.73 0.52 -0.02 -1.26 -2.50 135.00 125.92 3d4l n PRO 532 Ca 0.12 0.34 -0.28 0.00 -2.02 0.00 0.00 63.50 61.66 3d4l n PRO 532 Cb 0.51 -2.39 0.03 0.00 -0.02 0.00 0.00 33.50 31.62 3d4l n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3d4l n HIS 533 N -2.21 -2.27 -1.64 6.00 8.25 -1.26 -4.85 115.22 117.23 3d4l n HIS 533 Ca 0.15 0.83 -0.46 0.00 -0.26 0.00 0.00 57.72 57.98 3d4l n HIS 533 Cb 0.49 -4.00 -0.03 0.00 1.12 0.00 0.00 29.99 27.56 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 -4.62 1.90 -3.89 4.41 7.35 -1.04 -4.97 117.46 116.61 3d4l n PHE 534 Ca 0.02 0.50 -0.30 0.00 -0.76 0.00 0.00 57.45 56.92 3d4l n PHE 534 Cb 0.54 -2.41 -0.16 0.00 0.35 0.00 0.00 39.48 37.81 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 0.21 3.85 0.00 -2.13 3.68 -1.26 -4.99 116.67 116.03 3d4l s ASP 535 Ca 0.70 -1.29 0.02 0.00 2.13 0.00 0.00 52.55 54.11 3d4l s ASP 535 Cb -0.71 -1.11 0.10 0.00 -1.45 0.00 0.00 42.92 39.75 3d4l s ASP 535 CO 0.50 -0.28 0.96 2.29 0.13 0.00 0.00 175.17 178.77 3d4l n LYS 536 N 4.70 0.02 0.01 4.34 2.85 -1.26 -0.87 118.16 127.95 3d4l n LYS 536 Ca -0.09 0.35 0.13 0.00 -1.05 0.00 0.00 58.31 57.65 3d4l n LYS 536 Cb 0.44 -1.50 0.39 0.00 -0.65 0.00 0.00 35.03 33.70 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 -1.38 0.36 -4.98 -5.58 3.41 -1.26 -4.37 113.62 99.83 3d4l n SER 537 Ca 0.01 0.12 -0.20 0.00 -0.26 0.00 0.00 58.87 58.54 3d4l n SER 537 Cb 0.02 -0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 63.86 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 -3.03 3.20 -0.28 4.33 1.02 -0.05 -5.03 119.74 119.90 3d4l s LYS 538 Ca 0.12 -0.94 -0.06 0.00 0.02 0.00 0.00 55.97 55.10 3d4l s LYS 538 Cb 0.17 -2.83 0.01 0.00 -0.52 0.00 0.00 37.83 34.66 3d4l s LYS 538 CO 0.63 0.19 0.05 0.15 -0.92 0.00 0.00 175.35 175.45 3d4l s LYS 539 N -4.10 3.11 0.08 1.68 -0.14 -1.26 -4.31 119.74 114.81 3d4l s LYS 539 Ca 0.41 -0.83 0.03 0.00 -1.36 0.00 0.00 55.97 54.22 3d4l s LYS 539 Cb -0.09 -3.29 -0.04 0.00 -1.68 0.00 0.00 37.83 32.73 3d4l s LYS 539 CO 0.30 -0.40 0.09 0.71 -0.76 0.00 0.00 175.35 175.29 3d4l s TYR 540 N 1.48 3.21 0.62 3.18 2.02 -0.40 -4.55 117.35 122.91 3d4l s TYR 540 Ca 0.03 0.08 -0.15 0.00 -0.37 0.00 0.00 57.07 56.66 3d4l s TYR 540 Cb -0.17 -1.62 -0.02 0.00 -0.40 0.00 0.00 41.96 39.75 3d4l s TYR 540 CO 0.01 0.53 1.07 -1.25 -1.57 0.00 0.00 175.55 174.34 3d4l s PRO 541 N -2.43 3.12 -0.05 -1.71 0.04 -1.26 -0.91 135.00 131.80 3d4l s PRO 541 Ca 0.30 1.23 0.03 0.00 0.04 0.00 0.00 61.00 62.60 3d4l s PRO 541 Cb -0.12 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.42 3d4l s PRO 541 CO 0.22 -0.97 -0.14 -1.17 0.04 0.00 0.00 177.00 174.98 3d4l s LEU 542 N -4.72 1.81 -0.21 -3.56 0.20 -0.26 -1.95 118.68 110.00 3d4l s LEU 542 Ca 0.64 -0.31 -0.03 0.00 0.69 0.00 0.00 54.13 55.12 3d4l s LEU 542 Cb -0.17 -0.85 -0.01 0.00 -0.43 0.00 0.00 46.19 44.73 3d4l s LEU 542 CO 0.40 0.10 -0.07 -0.22 -0.29 0.00 0.00 176.35 176.27 3d4l s LEU 543 N 0.28 2.81 -0.36 -0.68 2.96 0.30 -0.58 118.68 123.40 3d4l s LEU 543 Ca -0.08 -0.40 -0.21 0.00 -0.22 0.00 0.00 54.13 53.22 3d4l s LEU 543 Cb -0.12 -1.70 0.00 0.00 0.50 0.00 0.00 46.19 44.87 3d4l s LEU 543 CO 0.03 0.00 0.64 -0.22 -1.32 0.00 0.00 176.35 175.48 3d4l s LEU 544 N 1.33 4.27 -0.37 -0.68 2.96 -0.14 -0.78 118.68 125.26 3d4l s LEU 544 Ca 0.04 0.11 -0.21 0.00 -0.22 0.00 0.00 54.13 53.84 3d4l s LEU 544 Cb -0.14 -2.79 0.01 0.00 0.50 0.00 0.00 46.19 43.77 3d4l s LEU 544 CO -0.03 -0.62 0.67 -0.62 -1.32 0.00 0.00 176.35 174.43 3d4l s ASP 545 N 1.82 6.44 0.06 3.68 -1.08 0.13 -1.03 116.67 126.68 3d4l s ASP 545 Ca 0.24 0.12 0.08 0.00 -0.52 0.00 0.00 52.55 52.48 3d4l s ASP 545 Cb -0.14 -2.34 -0.03 0.00 -1.46 0.00 0.00 42.92 38.95 3d4l s ASP 545 CO 0.15 -0.66 -0.21 0.54 0.52 0.00 0.00 175.17 175.51 3d4l s VAL 546 N 2.83 1.71 0.00 1.11 0.11 -0.12 -4.32 120.40 121.72 3d4l s VAL 546 Ca 0.26 -1.30 0.00 0.00 -2.93 0.00 0.00 61.98 58.01 3d4l s VAL 546 Cb -0.14 -1.50 0.00 0.00 -1.53 0.00 0.00 36.38 33.20 3d4l s VAL 546 CO 0.16 0.15 0.00 0.00 -3.33 0.00 0.00 175.10 172.08 3d4l n TYR 547 N 1.64 0.00 -1.57 1.54 4.19 -1.26 -4.15 117.16 117.54 3d4l n TYR 547 Ca -0.18 0.00 -0.16 0.00 3.31 0.00 0.00 57.90 60.87 3d4l n TYR 547 Cb 0.53 0.14 -0.06 0.00 0.49 0.00 0.00 39.34 40.45 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 -2.00 -0.27 -1.40 2.98 0.00 -1.26 -3.33 120.51 115.23 3d4l n ALA 548 Ca 0.00 0.24 -0.29 0.00 0.00 0.00 0.00 53.44 53.39 3d4l n ALA 548 Cb 0.00 -1.69 0.16 0.00 0.00 0.00 0.00 19.45 17.91 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 1.58 0.20 0.00 0.00 -1.26 -4.86 107.32 100.22 3d4l s GLY 549 Ca 0.00 -0.54 -0.32 0.00 0.00 0.00 0.00 44.72 43.86 3d4l s GLY 549 CO 0.00 0.07 1.65 2.56 0.00 0.00 0.00 173.10 177.38 3d4l s PRO 550 N -5.22 4.16 -1.24 2.90 0.04 -1.26 -1.65 135.00 132.73 3d4l s PRO 550 Ca 0.65 2.51 0.00 0.00 0.04 0.00 0.00 61.00 64.20 3d4l s PRO 550 Cb -0.15 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.29 3d4l s PRO 550 CO 0.55 -0.68 0.00 0.00 0.04 0.00 0.00 177.00 176.91 3d4l s SER 552 N -2.86 5.25 -0.25 0.00 1.04 -0.66 -3.79 113.70 112.43 3d4l s SER 552 Ca 0.00 0.81 -0.03 0.00 0.48 0.00 0.00 55.95 57.21 3d4l s SER 552 Cb 0.00 -1.61 0.14 0.00 0.10 0.00 0.00 66.02 64.65 3d4l s SER 552 CO 0.00 -1.37 0.40 -1.58 0.98 0.00 0.00 173.24 171.67 3d4l s GLN 553 N -5.24 0.36 0.00 4.02 0.74 -1.26 -1.02 119.66 117.26 3d4l s GLN 553 Ca 0.58 0.59 0.14 0.00 0.05 0.00 0.00 55.36 56.72 3d4l s GLN 553 Cb -0.11 -0.36 0.08 0.00 1.10 0.00 0.00 33.01 33.72 3d4l s GLN 553 CO 0.48 -0.62 0.90 1.63 -0.55 0.00 0.00 175.29 177.12 3d4l n LYS 554 N 5.37 1.22 -3.81 1.67 4.76 -1.26 -4.85 118.16 121.25 3d4l n LYS 554 Ca -0.04 -1.17 -0.36 0.00 -2.87 0.00 0.00 58.31 53.87 3d4l n LYS 554 Cb 0.50 -1.25 -0.12 0.00 -1.84 0.00 0.00 35.03 32.32 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 -1.31 3.02 0.23 7.82 0.00 -1.26 -4.79 121.76 125.47 3d4l s ALA 555 Ca 0.15 -2.10 -0.01 0.00 0.00 0.00 0.00 51.96 50.01 3d4l s ALA 555 Cb 0.12 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 21.01 3d4l s ALA 555 CO 0.22 -1.52 0.32 -0.40 0.00 0.00 0.00 175.76 174.38 3d4l n ASP 556 N 4.66 -0.88 -1.75 0.00 5.68 -1.26 -4.44 116.55 118.56 3d4l n ASP 556 Ca -0.08 -2.28 0.08 0.00 -0.50 0.00 0.00 54.79 52.00 3d4l n ASP 556 Cb 0.43 1.66 0.38 0.00 -1.14 0.00 0.00 41.12 42.45 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 -0.39 2.35 -2.78 2.12 -2.24 -1.06 -4.96 114.28 107.33 3d4l n THR 557 Ca 0.01 -1.28 -0.40 0.00 -2.27 0.00 0.00 64.05 60.11 3d4l n THR 557 Cb 0.39 -0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 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 -2.39 4.15 -0.21 2.28 1.01 -1.26 -1.40 120.40 122.57 3d4l s VAL 558 Ca 0.52 2.04 -0.22 0.00 0.00 0.00 0.00 61.98 64.31 3d4l s VAL 558 Cb 0.37 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 3d4l s VAL 558 CO 0.19 0.49 0.71 0.12 0.00 0.00 0.00 175.10 176.60 3d4l s PHE 559 N -1.07 3.35 0.06 5.22 5.36 -0.22 -4.91 117.98 125.77 3d4l s PHE 559 Ca 0.41 1.00 0.05 0.00 -0.96 0.00 0.00 56.93 57.43 3d4l s PHE 559 Cb -0.25 -2.90 -0.03 0.00 -0.34 0.00 0.00 43.02 39.50 3d4l s PHE 559 CO 0.31 -0.27 -0.13 1.03 -1.46 0.00 0.00 175.22 174.70 3d4l s ARG 560 N 2.27 0.80 -0.33 10.12 0.52 -1.26 -4.90 118.95 126.16 3d4l s ARG 560 Ca 0.31 -0.90 0.02 0.00 -0.52 0.00 0.00 55.73 54.65 3d4l s ARG 560 Cb -0.16 -0.79 0.09 0.00 0.52 0.00 0.00 34.95 34.62 3d4l s ARG 560 CO 0.10 0.18 0.04 -0.51 0.02 0.00 0.00 175.30 175.12 3d4l s LEU 561 N -1.62 4.55 0.00 2.53 1.43 -1.26 -4.89 118.68 119.42 3d4l s LEU 561 Ca -0.02 -1.94 0.00 0.00 -1.03 0.00 0.00 54.13 51.14 3d4l s LEU 561 Cb -0.10 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.47 3d4l s LEU 561 CO 0.02 -0.36 0.00 -0.46 0.23 0.00 0.00 176.35 175.78 3d4l n ASN 562 N 4.36 0.00 -0.30 2.29 0.23 -1.26 -4.99 115.26 115.59 3d4l n ASN 562 Ca -0.01 -0.19 -0.01 0.00 -0.53 0.00 0.00 54.58 53.84 3d4l n ASN 562 Cb 0.42 0.00 0.12 0.00 -2.08 0.00 0.00 39.78 38.24 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 0.19 0.97 -0.30 -2.53 7.01 -1.98 -1.06 115.95 118.26 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 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 26.73 3d4l h TRP 563 CO 0.00 0.52 0.16 0.00 -2.79 0.00 0.00 178.44 176.33 3d4l h ALA 564 N 1.38 1.72 -0.52 2.65 0.00 -1.98 -1.06 119.26 121.45 3d4l h ALA 564 Ca 0.35 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.21 3d4l h ALA 564 Cb 0.10 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3d4l h ALA 564 CO -0.15 0.24 0.34 1.15 0.00 0.00 0.00 179.25 180.83 3d4l h THR 565 N 0.41 1.13 -0.28 0.00 2.02 -1.54 -0.94 112.91 113.72 3d4l h THR 565 Ca 0.11 -0.24 -0.07 0.00 0.77 0.00 0.00 66.41 66.98 3d4l h THR 565 Cb 0.02 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3d4l h THR 565 CO -0.02 0.13 -0.09 0.22 0.37 0.00 0.00 175.52 176.13 3d4l h TYR 566 N 0.70 0.63 -0.57 3.16 3.20 -1.22 -0.63 116.97 122.25 3d4l h TYR 566 Ca 0.19 -0.14 0.05 0.00 3.14 0.00 0.00 58.73 61.96 3d4l h TYR 566 Cb -0.08 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.00 3d4l h TYR 566 CO -0.04 0.77 0.31 -0.07 -1.64 0.00 0.00 178.16 177.48 3d4l h LEU 567 N 0.30 0.45 -0.03 2.82 3.38 -0.84 0.12 115.31 121.51 3d4l h LEU 567 Ca 0.07 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 3d4l h LEU 567 Cb 0.58 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3d4l h LEU 567 CO 0.03 0.31 -0.27 0.00 0.09 0.00 0.00 178.44 178.60 3d4l h ALA 568 N 1.29 0.08 0.19 1.53 0.00 -1.18 -1.60 119.26 119.56 3d4l h ALA 568 Ca 0.25 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3d4l h ALA 568 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3d4l h ALA 568 CO -0.15 0.11 -0.09 1.03 0.00 0.00 0.00 179.25 180.14 3d4l h SER 569 N -0.34 -0.22 0.10 0.00 0.87 -0.96 -2.48 113.55 110.52 3d4l h SER 569 Ca -0.02 -0.18 -0.35 0.00 -1.23 0.00 0.00 61.79 60.01 3d4l h SER 569 Cb 0.96 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.95 3d4l h SER 569 CO 0.05 0.06 -1.93 0.41 -0.53 0.00 0.00 176.83 174.90 3d4l n THR 570 N -5.09 1.73 1.33 2.23 -1.04 0.41 -4.42 114.28 109.43 3d4l n THR 570 Ca -0.09 -0.56 0.13 0.00 -2.04 0.00 0.00 64.05 61.49 3d4l n THR 570 Cb 0.21 -1.77 0.38 0.00 -1.82 0.00 0.00 70.33 67.33 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 -3.62 1.81 -3.82 -2.82 -0.58 -0.89 -4.97 120.64 105.76 3d4l n GLU 571 Ca -0.33 -1.23 -0.27 0.00 -0.42 0.00 0.00 57.16 54.92 3d4l n GLU 571 Cb 0.99 -1.47 0.03 0.00 -0.57 0.00 0.00 31.44 30.42 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 0.47 -3.54 -4.61 1.62 5.03 -0.76 -4.92 115.26 108.56 3d4l n ASN 572 Ca 0.17 -0.78 -0.34 0.00 0.87 0.00 0.00 54.58 54.50 3d4l n ASN 572 Cb 0.43 -4.01 -0.11 0.00 -1.02 0.00 0.00 39.78 35.07 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 -3.44 4.03 -0.07 2.41 1.01 -0.68 -4.46 121.20 120.00 3d4l s ILE 573 Ca 0.41 -0.34 -0.25 0.00 0.00 0.00 0.00 60.65 60.47 3d4l s ILE 573 Cb -0.20 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 3d4l s ILE 573 CO 0.82 0.58 0.77 -0.63 0.00 0.00 0.00 174.94 176.47 3d4l s ILE 574 N -0.55 4.99 -0.26 2.92 1.01 -0.82 -3.35 121.20 125.14 3d4l s ILE 574 Ca 0.09 1.58 -0.03 0.00 0.00 0.00 0.00 60.65 62.29 3d4l s ILE 574 Cb -0.12 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.27 3d4l s ILE 574 CO 0.02 0.21 -0.02 -0.69 0.00 0.00 0.00 174.94 174.46 3d4l s VAL 575 N 1.00 3.21 0.17 2.92 1.01 -0.81 -0.54 120.40 127.36 3d4l s VAL 575 Ca 0.40 -0.89 0.09 0.00 0.00 0.00 0.00 61.98 61.58 3d4l s VAL 575 Cb -0.18 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 3d4l s VAL 575 CO 0.19 0.18 -0.13 0.00 0.00 0.00 0.00 175.10 175.35 3d4l s ALA 576 N 1.38 2.85 0.02 5.51 0.00 0.04 -0.46 121.76 131.11 3d4l s ALA 576 Ca 0.01 -1.46 0.01 0.00 0.00 0.00 0.00 51.96 50.52 3d4l s ALA 576 Cb -0.17 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.26 3d4l s ALA 576 CO -0.02 0.49 -0.05 -1.12 0.00 0.00 0.00 175.76 175.05 3d4l s SER 577 N -2.66 0.57 -0.02 0.00 0.01 -0.73 0.17 113.70 111.05 3d4l s SER 577 Ca 0.23 -0.35 0.02 0.00 1.31 0.00 0.00 55.95 57.16 3d4l s SER 577 Cb -0.09 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.16 3d4l s SER 577 CO 0.14 -0.12 -0.06 0.12 0.41 0.00 0.00 173.24 173.72 3d4l s PHE 578 N -0.89 0.67 -0.50 2.43 5.36 -1.26 -1.51 117.98 122.27 3d4l s PHE 578 Ca -0.07 -0.14 -0.10 0.00 -0.96 0.00 0.00 56.93 55.66 3d4l s PHE 578 Cb -0.07 -0.49 0.13 0.00 -0.34 0.00 0.00 43.02 42.25 3d4l s PHE 578 CO -0.00 -0.07 0.39 -0.51 -1.46 0.00 0.00 175.22 173.57 3d4l s ASP 579 N 0.19 5.77 0.00 6.13 1.01 -0.45 -4.84 116.67 124.48 3d4l s ASP 579 Ca -0.02 -2.00 0.00 0.00 0.71 0.00 0.00 52.55 51.23 3d4l s ASP 579 Cb -0.07 -2.03 0.00 0.00 1.01 0.00 0.00 42.92 41.83 3d4l s ASP 579 CO -0.00 -0.68 0.00 0.61 0.21 0.00 0.00 175.17 175.31 3d4l n GLY 580 N 4.80 2.13 3.73 0.21 0.00 -1.26 -4.03 105.19 110.78 3d4l n GLY 580 Ca -0.06 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 3d4l n GLY 580 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d4l n ARG 581 N 0.00 2.35 0.00 1.61 1.74 -1.26 -1.89 116.66 119.21 3d4l n ARG 581 Ca 0.00 0.82 0.00 0.00 -0.77 0.00 0.00 57.85 57.90 3d4l n ARG 581 Cb 0.00 -2.47 0.00 0.00 -1.02 0.00 0.00 32.46 28.97 3d4l n ARG 581 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d4l n GLY 582 N 0.65 3.43 3.78 -0.13 0.00 0.08 -4.11 105.19 108.88 3d4l n GLY 582 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.84 4.65 0.59 1.61 1.04 -0.79 -0.53 113.70 119.43 3d4l s SER 583 Ca 0.00 1.78 0.09 0.00 0.48 0.00 0.00 55.95 58.29 3d4l s SER 583 Cb 0.00 -2.51 0.09 0.00 0.10 0.00 0.00 66.02 63.70 3d4l s SER 583 CO 0.00 -1.93 0.73 -0.83 0.98 0.00 0.00 173.24 172.19 3d4l s GLY 584 N -3.47 1.86 -1.19 7.32 0.00 -0.19 -3.52 107.32 108.12 3d4l s GLY 584 Ca 0.61 -1.97 0.00 0.00 0.00 0.00 0.00 44.72 43.36 3d4l s GLY 584 CO 0.56 -1.77 0.00 -1.72 0.00 0.00 0.00 173.10 170.16 3d4l n TYR 585 N -2.19 0.00 -1.28 1.90 4.01 -1.26 -4.83 117.16 113.51 3d4l n TYR 585 Ca 0.12 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.89 3d4l n TYR 585 Cb 0.63 -2.24 0.04 0.00 -0.31 0.00 0.00 39.34 37.46 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 -2.22 0.75 0.00 -0.72 6.02 -1.26 -4.47 117.38 115.48 3d4l n GLN 586 Ca -0.11 -1.40 0.00 0.00 -0.01 0.00 0.00 57.00 55.48 3d4l n GLN 586 Cb 0.42 -0.84 0.00 0.00 1.02 0.00 0.00 30.24 30.85 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 -0.46 2.25 0.20 1.08 0.00 -1.26 -4.65 105.19 102.35 3d4l n GLY 587 Ca 0.04 -1.84 0.02 0.00 0.00 0.00 0.00 46.02 44.24 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 0.10 -0.87 1.61 3.32 -0.54 -2.01 116.42 118.03 3d4l h ASP 588 Ca 0.00 -0.03 0.14 0.00 0.02 0.00 0.00 57.03 57.16 3d4l h ASP 588 Cb 0.00 -0.03 -0.09 0.00 0.22 0.00 0.00 39.33 39.43 3d4l h ASP 588 CO 0.00 0.41 0.48 0.50 -1.72 0.00 0.00 179.24 178.91 3d4l h LYS 589 N 0.09 0.68 0.04 3.56 1.63 -1.87 0.41 116.57 121.11 3d4l h LYS 589 Ca 0.01 -0.04 -0.12 0.00 -0.85 0.00 0.00 60.65 59.65 3d4l h LYS 589 Cb 0.60 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.07 3d4l h LYS 589 CO 0.04 0.45 -0.62 0.82 -3.45 0.00 0.00 179.45 176.69 3d4l h ILE 590 N 0.70 1.44 -0.43 2.00 2.04 -1.78 -3.29 117.51 118.18 3d4l h ILE 590 Ca 0.46 -2.35 -0.02 0.00 1.00 0.00 0.00 64.86 63.96 3d4l h ILE 590 Cb 0.61 2.99 -0.02 0.00 -0.74 0.00 0.00 36.82 39.66 3d4l h ILE 590 CO -0.34 0.57 0.20 -0.03 0.00 0.00 0.00 178.15 178.55 3d4l h MET 591 N -0.80 0.62 -0.08 2.37 4.05 -1.05 0.32 114.93 120.36 3d4l h MET 591 Ca -0.15 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.18 3d4l h MET 591 Cb 1.28 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 3d4l h MET 591 CO -0.02 0.55 0.00 0.72 0.23 0.00 0.00 176.91 178.39 3d4l n HIS 592 N -4.66 0.10 0.25 1.39 8.25 0.14 -4.00 115.22 116.70 3d4l n HIS 592 Ca 0.00 -0.05 0.09 0.00 -0.26 0.00 0.00 57.72 57.50 3d4l n HIS 592 Cb 0.12 0.00 0.64 0.00 1.12 0.00 0.00 29.99 31.87 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 3.36 1.59 -0.62 -1.41 0.00 -1.56 -2.43 119.26 118.19 3d4l h ALA 593 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3d4l h ALA 593 Cb 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3d4l h ALA 593 CO 0.00 0.15 0.00 0.44 0.00 0.00 0.00 179.25 179.84 3d4l n ILE 594 N -4.09 0.83 -1.60 0.00 -5.35 -1.26 -4.92 119.36 102.97 3d4l n ILE 594 Ca -0.02 -0.84 -0.50 0.00 -0.27 0.00 0.00 62.75 61.12 3d4l n ILE 594 Cb 0.20 0.43 -0.05 0.00 -1.74 0.00 0.00 39.64 38.48 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 1.34 1.83 0.00 7.28 4.05 -0.92 -0.34 115.26 128.50 3d4l n ASN 595 Ca 0.21 1.12 0.00 0.00 0.45 0.00 0.00 54.58 56.36 3d4l n ASN 595 Cb 0.53 -1.25 0.00 0.00 1.23 0.00 0.00 39.78 40.29 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 2.35 -2.00 -2.79 1.20 1.74 0.44 -4.82 116.66 112.78 3d4l n ARG 596 Ca 0.16 0.41 -0.14 0.00 -0.77 0.00 0.00 57.85 57.51 3d4l n ARG 596 Cb 0.23 -4.53 0.01 0.00 -1.02 0.00 0.00 32.46 27.15 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 0.81 1.43 -2.07 5.56 3.00 0.53 -4.89 116.66 121.03 3d4l n ARG 597 Ca 0.00 -3.49 -0.36 0.00 -0.01 0.00 0.00 57.85 54.00 3d4l n ARG 597 Cb 0.41 -1.51 0.03 0.00 0.00 0.00 0.00 32.46 31.38 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 -3.01 3.68 -0.06 0.55 1.43 -1.23 -3.27 118.68 116.77 3d4l s LEU 598 Ca 0.33 2.32 0.00 0.00 -1.03 0.00 0.00 54.13 55.75 3d4l s LEU 598 Cb 0.42 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 42.05 3d4l s LEU 598 CO -0.02 -1.49 0.00 0.61 0.23 0.00 0.00 176.35 175.68 3d4l n GLY 599 N 0.38 0.40 0.00 -3.19 0.00 -1.26 -4.87 105.19 96.65 3d4l n GLY 599 Ca 0.13 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 -3.29 0.00 -0.29 2.61 -2.24 -1.20 -4.80 114.28 105.05 3d4l n THR 600 Ca -0.01 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 3d4l n THR 600 Cb 0.17 0.00 0.26 0.00 -2.10 0.00 0.00 70.33 68.66 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 1.00 0.00 4.78 0.04 -1.93 0.64 116.94 121.47 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 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 37.81 3d4l h PHE 601 CO 0.00 0.50 -0.38 1.05 -0.60 0.00 0.00 178.31 178.88 3d4l h GLU 602 N 0.97 0.00 0.01 1.51 9.09 -1.90 0.53 114.58 124.78 3d4l h GLU 602 Ca 0.40 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.77 3d4l h GLU 602 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 3d4l h GLU 602 CO -0.16 0.38 -0.16 0.28 0.05 0.00 0.00 179.01 179.40 3d4l h VAL 603 N 0.00 1.63 -1.01 -1.06 2.07 -1.49 -3.18 116.25 113.21 3d4l h VAL 603 Ca -0.00 -2.07 0.03 0.00 0.82 0.00 0.00 66.70 65.48 3d4l h VAL 603 Cb 0.73 2.99 -0.06 0.00 -1.52 0.00 0.00 31.29 33.44 3d4l h VAL 603 CO 0.05 0.55 0.66 -0.33 0.02 0.00 0.00 177.57 178.52 3d4l h GLU 604 N -0.69 1.25 0.00 1.57 5.08 -0.80 -2.20 114.58 118.79 3d4l h GLU 604 Ca -0.02 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3d4l h GLU 604 Cb 1.00 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3d4l h GLU 604 CO 0.03 0.83 -0.24 -0.44 -1.00 0.00 0.00 179.01 178.19 3d4l h ASP 605 N 1.29 0.00 -0.07 1.42 3.32 -0.97 -1.12 116.42 120.28 3d4l h ASP 605 Ca 0.40 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.27 3d4l h ASP 605 Cb -0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 3d4l h ASP 605 CO -0.12 0.24 -0.57 1.56 -1.72 0.00 0.00 179.24 178.63 3d4l h GLN 606 N 0.00 0.66 -0.23 3.56 1.08 -1.38 -0.61 115.11 118.20 3d4l h GLN 606 Ca -0.00 -0.43 -0.02 0.00 -1.45 0.00 0.00 58.65 56.74 3d4l h GLN 606 Cb 0.49 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 3d4l h GLN 606 CO 0.03 1.05 0.05 0.82 -0.95 0.00 0.00 178.83 179.83 3d4l h ILE 607 N 0.50 1.21 -0.83 2.54 2.04 -1.23 -2.19 117.51 119.56 3d4l h ILE 607 Ca 0.00 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 3d4l h ILE 607 Cb 1.15 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 38.43 3d4l h ILE 607 CO 0.11 0.22 0.46 -0.08 0.00 0.00 0.00 178.15 178.86 3d4l h GLU 608 N 0.19 1.15 -0.90 2.37 4.57 -1.17 -1.76 114.58 119.03 3d4l h GLU 608 Ca 0.07 -0.13 0.02 0.00 -1.18 0.00 0.00 59.36 58.14 3d4l h GLU 608 Cb 0.29 -0.23 -0.05 0.00 -0.16 0.00 0.00 28.75 28.60 3d4l h GLU 608 CO 0.00 0.84 0.59 0.00 -1.18 0.00 0.00 179.01 179.26 3d4l h ALA 609 N 1.34 1.16 -0.53 2.92 0.00 -0.87 0.10 119.26 123.37 3d4l h ALA 609 Ca 0.29 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 3d4l h ALA 609 Cb 0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3d4l h ALA 609 CO -0.05 0.50 0.08 0.00 0.00 0.00 0.00 179.25 179.79 3d4l h ALA 610 N 1.34 1.14 -0.43 0.00 0.00 -0.71 0.04 119.26 120.65 3d4l h ALA 610 Ca 0.34 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3d4l h ALA 610 Cb -0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3d4l h ALA 610 CO -0.09 0.57 0.11 0.00 0.00 0.00 0.00 179.25 179.84 3d4l h ARG 611 N 0.81 0.69 -0.55 0.00 3.08 -0.44 -1.66 114.38 116.30 3d4l h ARG 611 Ca 0.17 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 3d4l h ARG 611 Cb 0.36 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 3d4l h ARG 611 CO 0.01 0.70 0.13 1.96 -1.07 0.00 0.00 179.97 181.69 3d4l h GLN 612 N 0.56 0.85 -0.30 0.04 1.08 -0.63 -1.69 115.11 115.02 3d4l h GLN 612 Ca 0.14 -0.18 -0.11 0.00 -1.45 0.00 0.00 58.65 57.05 3d4l h GLN 612 Cb 0.31 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 3d4l h GLN 612 CO 0.00 0.77 -0.22 0.74 -0.95 0.00 0.00 178.83 179.17 3d4l h PHE 613 N 0.82 0.81 -0.28 2.96 0.04 -0.77 -2.88 116.94 117.63 3d4l h PHE 613 Ca 0.18 -0.22 -0.04 0.00 2.80 0.00 0.00 57.97 60.69 3d4l h PHE 613 Cb 0.31 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 3d4l h PHE 613 CO 0.02 0.95 0.00 0.66 -0.60 0.00 0.00 178.31 179.34 3d4l h SER 614 N 0.44 0.40 0.00 2.17 4.64 -1.07 -0.14 113.55 119.98 3d4l h SER 614 Ca 0.06 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3d4l h SER 614 Cb 0.78 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3d4l h SER 614 CO 0.06 0.46 0.00 0.29 -0.87 0.00 0.00 176.83 176.77 3d4l n LYS 615 N -4.32 0.61 0.00 4.77 5.02 -0.66 -2.36 118.16 121.22 3d4l n LYS 615 Ca 0.01 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.43 3d4l n LYS 615 Cb 0.22 -1.36 0.38 0.00 -0.02 0.00 0.00 35.03 34.26 3d4l n LYS 615 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3d4l n MET 616 N -0.86 0.17 0.00 1.97 2.81 -0.06 -4.97 117.12 116.18 3d4l n MET 616 Ca 0.10 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 3d4l n MET 616 Cb 0.05 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 3d4l n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d4l n GLY 617 N 1.46 2.91 1.13 3.03 0.00 -1.00 -4.88 105.19 107.85 3d4l n GLY 617 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.11 3d4l n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3d4l n PHE 618 N -2.00 1.20 -5.14 1.61 1.16 -1.26 -4.76 117.46 108.28 3d4l n PHE 618 Ca 0.00 -1.23 -0.31 0.00 -1.87 0.00 0.00 57.45 54.04 3d4l n PHE 618 Cb 0.00 -0.44 -0.17 0.00 -1.61 0.00 0.00 39.48 37.26 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 -3.03 1.91 -0.66 1.97 1.01 -1.26 -1.28 120.40 119.06 3d4l s VAL 619 Ca 0.45 -0.95 -0.28 0.00 0.00 0.00 0.00 61.98 61.20 3d4l s VAL 619 Cb 0.38 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 35.15 3d4l s VAL 619 CO 0.06 0.53 1.25 -0.62 0.00 0.00 0.00 175.10 176.32 3d4l s ASP 620 N 0.18 6.28 0.62 3.32 -1.08 -0.09 -4.75 116.67 121.15 3d4l s ASP 620 Ca -0.12 -0.16 0.28 0.00 -0.52 0.00 0.00 52.55 52.03 3d4l s ASP 620 Cb -0.16 -2.56 1.50 0.00 -1.46 0.00 0.00 42.92 40.24 3d4l s ASP 620 CO 0.06 -1.68 1.88 0.78 0.52 0.00 0.00 175.17 176.73 3d4l h ASN 621 N 9.92 0.00 0.77 -0.34 2.35 -1.94 0.20 115.58 126.54 3d4l h ASN 621 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 3d4l h ASN 621 Cb 1.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.43 3d4l h ASN 621 CO 1.23 0.00 -0.18 0.29 -1.65 0.00 0.00 177.43 177.12 3d4l n LYS 622 N -3.36 0.07 -3.25 0.81 5.02 -1.26 -4.33 118.16 111.85 3d4l n LYS 622 Ca 0.04 -0.02 -0.25 0.00 -2.02 0.00 0.00 58.31 56.06 3d4l n LYS 622 Cb 0.56 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.01 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 -1.45 1.59 -4.20 1.97 1.74 0.71 -4.82 116.66 112.20 3d4l n ARG 623 Ca 0.07 -3.89 -0.33 0.00 -0.77 0.00 0.00 57.85 52.93 3d4l n ARG 623 Cb 0.33 -1.72 -0.15 0.00 -1.02 0.00 0.00 32.46 29.90 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 -2.05 2.44 0.45 0.55 1.01 -1.26 -1.10 121.20 121.25 3d4l s ILE 624 Ca 0.38 -0.82 0.05 0.00 0.00 0.00 0.00 60.65 60.27 3d4l s ILE 624 Cb 0.19 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 3d4l s ILE 624 CO -0.07 0.51 0.05 0.00 0.00 0.00 0.00 174.94 175.43 3d4l s ALA 625 N 1.20 3.58 -0.12 9.38 0.00 0.25 -0.53 121.76 135.52 3d4l s ALA 625 Ca 0.02 -1.66 -0.14 0.00 0.00 0.00 0.00 51.96 50.19 3d4l s ALA 625 Cb -0.14 -0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.01 3d4l s ALA 625 CO -0.08 -0.11 0.37 -1.50 0.00 0.00 0.00 175.76 174.44 3d4l s ILE 626 N -2.75 0.01 0.08 0.00 2.07 -0.95 -0.97 121.20 118.70 3d4l s ILE 626 Ca 0.27 -0.09 -0.14 0.00 -1.41 0.00 0.00 60.65 59.28 3d4l s ILE 626 Cb 0.06 -0.56 0.02 0.00 0.13 0.00 0.00 42.46 42.12 3d4l s ILE 626 CO 0.14 -0.05 0.34 -1.66 -1.91 0.00 0.00 174.94 171.80 3d4l s TRP 627 N -0.12 -0.12 -0.02 3.50 1.48 -0.20 -1.39 118.94 122.07 3d4l s TRP 627 Ca -0.03 -0.12 -0.29 0.00 -1.06 0.00 0.00 56.10 54.60 3d4l s TRP 627 Cb -0.03 0.15 0.11 0.00 -1.16 0.00 0.00 33.47 32.54 3d4l s TRP 627 CO 0.01 -0.60 0.92 0.20 -4.06 0.00 0.00 176.95 173.42 3d4l s GLY 628 N -2.48 -0.45 0.02 3.67 0.00 -0.87 -0.94 107.32 106.27 3d4l s GLY 628 Ca -0.00 1.07 0.08 0.00 0.00 0.00 0.00 44.72 45.88 3d4l s GLY 628 CO -0.08 0.36 -0.25 0.86 0.00 0.00 0.00 173.10 173.99 3d4l s TRP 629 N -3.05 2.20 0.00 1.90 -0.11 -1.26 -1.36 118.94 117.27 3d4l s TRP 629 Ca 0.05 -0.41 0.00 0.00 1.22 0.00 0.00 56.10 56.97 3d4l s TRP 629 Cb -0.01 -1.35 0.00 0.00 -1.50 0.00 0.00 33.47 30.61 3d4l s TRP 629 CO -0.09 0.06 0.00 0.45 -4.62 0.00 0.00 176.95 172.76 3d4l n SER 630 N 2.04 0.00 0.04 5.86 2.88 -0.25 -0.57 113.62 123.62 3d4l n SER 630 Ca -0.17 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.47 3d4l n SER 630 Cb 0.52 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 64.51 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 0.30 -0.27 0.66 5.03 -1.87 0.87 116.97 121.68 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 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.17 3d4l h TYR 631 CO 0.00 0.17 -0.00 0.78 -1.32 0.00 0.00 178.16 177.79 3d4l h GLY 632 N 0.30 0.44 1.31 1.82 0.00 -0.83 -1.03 103.07 105.08 3d4l h GLY 632 Ca 0.16 -0.24 -0.14 0.00 0.00 0.00 0.00 47.33 47.11 3d4l h GLY 632 CO -0.03 0.23 -0.34 -1.33 0.00 0.00 0.00 176.54 175.06 3d4l h GLY 633 N 0.72 0.84 0.86 4.60 0.00 -0.78 -0.08 103.07 109.23 3d4l h GLY 633 Ca 0.09 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 46.61 3d4l h GLY 633 CO 0.01 0.73 -0.06 -1.82 0.00 0.00 0.00 176.54 175.40 3d4l h TYR 634 N 0.65 -0.14 -0.65 5.60 3.20 -0.87 -1.07 116.97 123.67 3d4l h TYR 634 Ca 0.07 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 3d4l h TYR 634 Cb 0.88 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.16 3d4l h TYR 634 CO 0.05 0.03 0.37 0.28 -1.64 0.00 0.00 178.16 177.24 3d4l h VAL 635 N -0.29 1.20 -0.55 1.81 2.07 -1.14 0.08 116.25 119.42 3d4l h VAL 635 Ca -0.02 -0.49 0.05 0.00 0.82 0.00 0.00 66.70 67.07 3d4l h VAL 635 Cb 0.24 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 3d4l h VAL 635 CO 0.03 0.22 0.28 0.74 0.02 0.00 0.00 177.57 178.85 3d4l h THR 636 N 0.89 0.94 -0.47 2.57 2.02 -0.93 0.56 112.91 118.48 3d4l h THR 636 Ca 0.23 -0.18 -0.09 0.00 0.77 0.00 0.00 66.41 67.14 3d4l h THR 636 Cb 0.02 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 3d4l h THR 636 CO -0.04 0.10 -0.06 0.28 0.37 0.00 0.00 175.52 176.17 3d4l h SER 637 N 0.53 0.87 -0.77 4.18 0.02 -0.67 0.36 113.55 118.07 3d4l h SER 637 Ca 0.25 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 3d4l h SER 637 Cb 0.17 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 3d4l h SER 637 CO -0.18 1.00 0.31 0.24 -1.14 0.00 0.00 176.83 177.06 3d4l h MET 638 N 0.72 1.15 -0.23 3.45 2.86 -0.63 -0.77 114.93 121.48 3d4l h MET 638 Ca 0.13 -0.21 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 3d4l h MET 638 Cb 0.59 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 3d4l h MET 638 CO 0.04 0.94 0.01 0.28 1.06 0.00 0.00 176.91 179.23 3d4l h VAL 639 N 1.12 1.25 0.00 -2.22 2.07 -0.67 -2.12 116.25 115.68 3d4l h VAL 639 Ca 0.26 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 3d4l h VAL 639 Cb 0.21 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3d4l h VAL 639 CO -0.02 0.27 -0.13 -0.07 0.02 0.00 0.00 177.57 177.63 3d4l h LEU 640 N 0.17 0.00 -2.01 2.57 3.38 -0.69 -2.40 115.31 116.34 3d4l h LEU 640 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3d4l h LEU 640 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3d4l h LEU 640 CO 0.01 0.13 0.00 0.61 0.09 0.00 0.00 178.44 179.28 3d4l n GLY 641 N -0.79 1.46 0.15 0.83 0.00 -0.32 -4.33 105.19 102.18 3d4l n GLY 641 Ca -0.02 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.50 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 3.55 0.00 -0.19 1.61 4.64 -0.84 -3.43 113.55 118.89 3d4l h SER 642 Ca 0.00 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 3d4l h SER 642 Cb 0.79 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.86 3d4l h SER 642 CO 0.00 0.00 -0.07 0.61 -0.87 0.00 0.00 176.83 176.50 3d4l n GLY 643 N 1.23 0.66 0.23 -0.77 0.00 -1.26 -4.92 105.19 100.35 3d4l n GLY 643 Ca 0.05 -0.90 0.09 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.90 -3.46 113.55 114.44 3d4l h SER 644 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3d4l h SER 644 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3d4l h SER 644 CO 0.11 0.22 0.00 0.61 -0.87 0.00 0.00 176.83 176.91 3d4l n GLY 645 N -0.36 0.69 0.07 -0.77 0.00 -1.26 -4.88 105.19 98.69 3d4l n GLY 645 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 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 1.67 -3.40 1.61 2.07 -1.96 -3.46 116.25 112.77 3d4l h VAL 646 Ca 0.00 -3.23 -0.67 0.00 0.82 0.00 0.00 66.70 63.62 3d4l h VAL 646 Cb 0.03 2.77 -0.18 0.00 -1.52 0.00 0.00 31.29 32.39 3d4l h VAL 646 CO 0.00 0.93 -0.65 -0.36 0.02 0.00 0.00 177.57 177.51 3d4l s PHE 647 N -2.82 3.07 0.02 1.57 0.08 -1.26 -4.64 117.98 114.00 3d4l s PHE 647 Ca 0.00 0.01 -0.15 0.00 0.12 0.00 0.00 56.93 56.91 3d4l s PHE 647 Cb 0.10 -1.83 -0.35 0.00 -0.57 0.00 0.00 43.02 40.37 3d4l s PHE 647 CO 0.82 0.28 0.97 -0.22 -0.10 0.00 0.00 175.22 176.96 3d4l h LYS 648 N 5.69 0.53 -3.58 0.44 3.64 -1.13 -3.46 116.57 118.70 3d4l h LYS 648 Ca -0.44 -0.90 -0.05 0.00 -1.27 0.00 0.00 60.65 57.99 3d4l h LYS 648 Cb 1.19 0.34 -0.10 0.00 -0.41 0.00 0.00 32.23 33.24 3d4l h LYS 648 CO 0.57 1.43 -0.11 0.00 -2.27 0.00 0.00 179.45 179.08 3d4l s GLY 650 N -2.96 -0.60 -0.11 0.00 0.00 -0.01 -2.24 107.32 101.39 3d4l s GLY 650 Ca 0.17 0.79 0.01 0.00 0.00 0.00 0.00 44.72 45.69 3d4l s GLY 650 CO 0.04 0.44 -0.12 -0.42 0.00 0.00 0.00 173.10 173.04 3d4l s ILE 651 N -2.84 1.32 -0.19 0.90 1.01 -0.49 -1.85 121.20 119.07 3d4l s ILE 651 Ca -0.03 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.08 3d4l s ILE 651 Cb -0.01 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.20 3d4l s ILE 651 CO -0.05 0.41 -0.07 0.00 0.00 0.00 0.00 174.94 175.24 3d4l s ALA 652 N 1.26 2.79 -0.18 9.38 0.00 -0.63 -2.05 121.76 132.33 3d4l s ALA 652 Ca -0.02 -1.04 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 3d4l s ALA 652 Cb -0.14 -1.55 -0.01 0.00 0.00 0.00 0.00 23.12 21.41 3d4l s ALA 652 CO -0.05 -0.15 -0.07 0.08 0.00 0.00 0.00 175.76 175.57 3d4l s VAL 653 N 1.01 3.40 -1.31 0.00 1.01 -0.46 -1.57 120.40 122.49 3d4l s VAL 653 Ca -0.00 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.31 3d4l s VAL 653 Cb -0.15 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.75 3d4l s VAL 653 CO -0.00 0.47 0.52 0.00 0.00 0.00 0.00 175.10 176.08 3d4l n ALA 654 N 4.10 -2.33 -1.81 5.51 0.00 0.13 -1.09 120.51 125.01 3d4l n ALA 654 Ca -0.18 -0.39 -0.33 0.00 0.00 0.00 0.00 53.44 52.54 3d4l n ALA 654 Cb 0.52 -2.38 -0.06 0.00 0.00 0.00 0.00 19.45 17.53 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 -6.84 4.10 0.38 0.00 0.04 -1.26 -3.24 135.00 128.18 3d4l s PRO 655 Ca 0.27 1.19 -0.24 0.00 0.04 0.00 0.00 61.00 62.26 3d4l s PRO 655 Cb -0.13 -2.15 -0.10 0.00 0.04 0.00 0.00 34.50 32.16 3d4l s PRO 655 CO 0.93 -0.15 0.99 0.08 0.04 0.00 0.00 177.00 178.89 3d4l s VAL 656 N -2.12 4.05 0.00 -0.36 1.01 -1.25 -4.51 120.40 117.22 3d4l s VAL 656 Ca 0.64 1.53 0.00 0.00 0.00 0.00 0.00 61.98 64.14 3d4l s VAL 656 Cb -0.11 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.50 3d4l s VAL 656 CO 0.15 -0.03 0.00 -1.54 0.00 0.00 0.00 175.10 173.68 3d4l n SER 657 N -0.03 4.25 -3.66 3.32 3.41 -1.26 -4.16 113.62 115.49 3d4l n SER 657 Ca 0.05 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.58 3d4l n SER 657 Cb 0.51 0.69 -0.08 0.00 -0.26 0.00 0.00 64.21 65.07 3d4l n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d4l s ARG 658 N -1.76 0.55 0.55 4.33 1.70 -1.26 -1.01 118.95 122.05 3d4l s ARG 658 Ca 0.00 1.11 0.23 0.00 -0.47 0.00 0.00 55.73 56.60 3d4l s ARG 658 Cb 0.00 0.22 1.47 0.00 -0.57 0.00 0.00 34.95 36.07 3d4l s ARG 658 CO 0.00 -0.17 2.11 -1.49 -1.08 0.00 0.00 175.30 174.66 3d4l h TRP 659 N 7.32 0.00 0.00 5.89 4.06 -1.87 -0.69 115.95 130.67 3d4l h TRP 659 Ca -0.29 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.66 3d4l h TRP 659 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 3d4l h TRP 659 CO 0.15 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.42 3d4l n GLU 660 N -4.22 0.06 0.09 0.49 1.02 -1.26 -2.03 120.64 114.78 3d4l n GLU 660 Ca 0.02 0.38 0.12 0.00 -0.02 0.00 0.00 57.16 57.66 3d4l n GLU 660 Cb 0.29 -1.63 0.10 0.00 -0.02 0.00 0.00 31.44 30.18 3d4l n GLU 660 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3d4l h TYR 661 N 0.00 0.00 -3.11 -0.32 0.05 -1.49 -3.29 116.97 108.80 3d4l h TYR 661 Ca 0.00 0.00 -0.45 0.00 0.05 0.00 0.00 58.73 58.33 3d4l h TYR 661 Cb 0.20 0.00 0.07 0.00 1.01 0.00 0.00 36.73 38.00 3d4l h TYR 661 CO 0.00 0.00 0.10 -0.47 -1.05 0.00 0.00 178.16 176.74 3d4l s TYR 662 N -3.25 2.81 0.63 4.88 5.04 -0.86 -4.82 117.35 121.78 3d4l s TYR 662 Ca 0.04 0.20 -0.16 0.00 -2.44 0.00 0.00 57.07 54.70 3d4l s TYR 662 Cb 0.11 -3.00 -0.01 0.00 0.35 0.00 0.00 41.96 39.41 3d4l s TYR 662 CO 0.75 -1.19 1.12 0.16 -1.34 0.00 0.00 175.55 175.04 3d4l s ASP 663 N -4.49 5.24 0.09 4.32 1.47 -1.26 -0.73 116.67 121.31 3d4l s ASP 663 Ca 0.59 2.06 -0.24 0.00 1.18 0.00 0.00 52.55 56.14 3d4l s ASP 663 Cb -0.10 -2.56 -0.13 0.00 -0.34 0.00 0.00 42.92 39.79 3d4l s ASP 663 CO 0.42 -1.54 1.72 0.77 0.68 0.00 0.00 175.17 177.21 3d4l h SER 664 N 0.32 -0.15 -0.28 2.11 4.64 -0.83 -2.07 113.55 117.29 3d4l h SER 664 Ca -0.48 0.02 0.04 0.00 -0.47 0.00 0.00 61.79 60.90 3d4l h SER 664 Cb 1.25 0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.36 3d4l h SER 664 CO 0.55 -0.09 0.06 0.58 -0.87 0.00 0.00 176.83 177.06 3d4l h VAL 665 N -0.13 0.88 0.15 0.95 2.07 -1.94 0.86 116.25 119.10 3d4l h VAL 665 Ca 0.01 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 3d4l h VAL 665 Cb 0.13 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3d4l h VAL 665 CO -0.02 0.03 -0.07 0.22 0.02 0.00 0.00 177.57 177.75 3d4l h TYR 666 N 0.17 -0.18 -0.03 1.57 5.03 -1.93 -3.10 116.97 118.51 3d4l h TYR 666 Ca 0.13 -0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.45 3d4l h TYR 666 Cb 0.12 0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.44 3d4l h TYR 666 CO -0.16 0.26 -0.10 1.15 -1.32 0.00 0.00 178.16 178.00 3d4l h THR 667 N -0.87 0.75 0.00 1.81 2.02 -1.34 -2.69 112.91 112.59 3d4l h THR 667 Ca -0.02 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 3d4l h THR 667 Cb 0.53 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 3d4l h THR 667 CO 0.03 0.00 -0.13 -0.33 0.37 0.00 0.00 175.52 175.47 3d4l h GLU 668 N -0.15 0.00 -0.99 6.66 5.08 -0.97 0.77 114.58 124.98 3d4l h GLU 668 Ca 0.05 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.48 3d4l h GLU 668 Cb 0.22 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 3d4l h GLU 668 CO -0.12 0.13 0.64 -0.09 -1.00 0.00 0.00 179.01 178.56 3d4l h ARG 669 N 0.00 1.11 0.00 2.33 2.43 -1.39 0.13 114.38 118.99 3d4l h ARG 669 Ca -0.00 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 58.98 3d4l h ARG 669 Cb 0.27 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 3d4l h ARG 669 CO 0.02 0.73 -2.05 0.66 -1.51 0.00 0.00 179.97 177.82 3d4l n TYR 670 N -4.53 0.00 0.40 2.20 4.01 -0.99 -4.60 117.16 113.66 3d4l n TYR 670 Ca 0.15 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.94 3d4l n TYR 670 Cb 0.20 -0.63 -0.00 0.00 -0.31 0.00 0.00 39.34 38.60 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 -2.38 2.29 0.00 -0.72 2.81 0.23 0.17 117.12 119.52 3d4l n MET 671 Ca -0.13 -0.53 0.00 0.00 -1.81 0.00 0.00 57.70 55.23 3d4l n MET 671 Cb 0.74 -1.04 0.00 0.00 -0.71 0.00 0.00 33.22 32.21 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 0.87 -0.15 3.88 3.03 0.00 0.03 -4.65 105.19 108.19 3d4l n GLY 672 Ca 0.04 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.68 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 4.38 -1.57 0.99 1.43 -1.26 -4.29 118.68 118.35 3d4l s LEU 673 Ca 0.00 0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 53.59 3d4l s LEU 673 Cb 0.00 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.54 3d4l s LEU 673 CO 0.00 0.27 2.72 -0.81 0.23 0.00 0.00 176.35 178.76 3d4l n PRO 674 N 1.23 3.48 -4.26 1.29 -0.04 -1.26 -1.82 135.00 133.62 3d4l n PRO 674 Ca -0.12 -2.36 -0.18 0.00 -0.04 0.00 0.00 63.50 60.80 3d4l n PRO 674 Cb 0.53 -2.94 -0.11 0.00 -0.04 0.00 0.00 33.50 30.94 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 2.37 1.38 0.48 0.52 -4.23 -1.26 -4.65 115.64 110.26 3d4l s THR 675 Ca 0.62 -1.78 0.16 0.00 -1.18 0.00 0.00 61.69 59.51 3d4l s THR 675 Cb 0.17 -1.61 0.31 0.00 1.34 0.00 0.00 72.50 72.71 3d4l s THR 675 CO -0.07 -0.44 2.06 1.55 -0.54 0.00 0.00 174.62 177.18 3d4l h PRO 676 N 3.40 0.19 0.00 3.99 0.13 -1.95 -0.17 132.00 137.58 3d4l h PRO 676 Ca -0.40 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 3d4l h PRO 676 Cb 1.20 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3d4l h PRO 676 CO 0.52 0.13 0.00 0.93 -0.23 0.00 0.00 178.00 179.35 3d4l h GLU 677 N 0.20 0.00 0.00 0.86 3.07 -1.96 -3.43 114.58 113.32 3d4l h GLU 677 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 3d4l h GLU 677 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 3d4l h GLU 677 CO -0.03 0.00 0.00 -3.47 -1.40 0.00 0.00 179.01 174.11 3d4l n ASP 678 N -2.36 0.00 -0.43 1.42 -0.08 -0.18 -5.03 116.55 109.89 3d4l n ASP 678 Ca 0.04 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.37 3d4l n ASP 678 Cb 0.35 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.89 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 1.25 -0.34 1.67 5.15 -0.76 -4.86 115.26 117.38 3d4l n ASN 679 Ca 0.00 -2.65 0.14 0.00 -0.60 0.00 0.00 54.58 51.46 3d4l n ASN 679 Cb 0.00 -0.34 0.34 0.00 -0.53 0.00 0.00 39.78 39.25 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 0.20 0.75 -0.71 1.20 5.85 -1.34 -1.80 115.31 119.46 3d4l h LEU 680 Ca -0.02 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.82 3d4l h LEU 680 Cb 1.24 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.18 3d4l h LEU 680 CO 0.01 0.27 0.44 0.44 -0.34 0.00 0.00 178.44 179.26 3d4l h ASP 681 N 0.73 0.71 0.51 1.25 3.32 -1.89 -0.96 116.42 120.09 3d4l h ASP 681 Ca 0.57 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.48 3d4l h ASP 681 Cb 0.93 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 3d4l h ASP 681 CO -0.35 0.49 -0.64 -0.74 -1.72 0.00 0.00 179.24 176.27 3d4l h HIS 682 N 0.85 0.16 -0.64 4.55 2.76 -1.71 -1.21 115.15 119.91 3d4l h HIS 682 Ca 0.29 -0.07 0.02 0.00 -2.20 0.00 0.00 60.37 58.42 3d4l h HIS 682 Cb 0.05 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 28.94 3d4l h HIS 682 CO -0.04 0.73 0.40 1.88 -1.30 0.00 0.00 177.93 179.60 3d4l h TYR 683 N 0.09 0.76 0.00 5.26 0.05 -0.99 -1.68 116.97 120.46 3d4l h TYR 683 Ca -0.01 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 3d4l h TYR 683 Cb 1.15 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.63 3d4l h TYR 683 CO 0.01 0.45 -0.36 0.00 -1.05 0.00 0.00 178.16 177.21 3d4l h ARG 684 N 0.81 0.00 0.00 4.88 2.47 -1.02 -3.23 114.38 118.29 3d4l h ARG 684 Ca 0.25 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 3d4l h ARG 684 Cb -0.02 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 3d4l h ARG 684 CO -0.08 0.36 -0.39 -1.71 0.56 0.00 0.00 179.97 178.70 3d4l n ASN 685 N -3.28 0.42 -1.44 7.04 4.05 -0.47 -4.21 115.26 117.37 3d4l n ASN 685 Ca 0.02 -0.01 -0.07 0.00 0.45 0.00 0.00 54.58 54.96 3d4l n ASN 685 Cb 0.61 0.05 0.21 0.00 1.23 0.00 0.00 39.78 41.88 3d4l n ASN 685 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 3d4l n SER 686 N -1.60 3.17 -4.90 1.20 3.41 -0.67 -5.01 113.62 109.22 3d4l n SER 686 Ca 0.06 -3.58 -0.29 0.00 -0.26 0.00 0.00 58.87 54.79 3d4l n SER 686 Cb 0.35 -0.68 -0.03 0.00 -0.26 0.00 0.00 64.21 63.59 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 -3.18 5.02 0.15 6.66 -4.23 -1.26 -4.79 115.64 114.01 3d4l s THR 687 Ca 0.48 0.08 -0.08 0.00 -1.18 0.00 0.00 61.69 60.99 3d4l s THR 687 Cb 0.42 -3.72 -0.08 0.00 1.34 0.00 0.00 72.50 70.45 3d4l s THR 687 CO 0.05 -0.31 1.43 0.58 -0.54 0.00 0.00 174.62 175.84 3d4l h VAL 688 N 1.39 1.30 -0.91 2.29 2.07 -1.43 -3.28 116.25 117.68 3d4l h VAL 688 Ca -0.48 -1.80 0.14 0.00 0.82 0.00 0.00 66.70 65.38 3d4l h VAL 688 Cb 1.19 1.74 -0.07 0.00 -1.52 0.00 0.00 31.29 32.62 3d4l h VAL 688 CO 0.66 0.57 0.58 0.24 0.02 0.00 0.00 177.57 179.65 3d4l h MET 689 N 0.55 0.73 0.00 1.57 2.86 -1.92 -0.95 114.93 117.77 3d4l h MET 689 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3d4l h MET 689 Cb 1.17 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.66 3d4l h MET 689 CO 0.12 0.48 0.00 -1.13 1.06 0.00 0.00 176.91 177.44 3d4l n SER 690 N -4.58 0.37 -1.17 1.22 3.41 -1.23 -1.95 113.62 109.69 3d4l n SER 690 Ca 0.18 0.61 0.10 0.00 -0.26 0.00 0.00 58.87 59.49 3d4l n SER 690 Cb 0.45 -0.68 0.28 0.00 -0.26 0.00 0.00 64.21 64.00 3d4l n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3d4l n ARG 691 N -1.93 2.90 -0.25 4.33 1.74 -0.36 -4.73 116.66 118.36 3d4l n ARG 691 Ca 0.02 -2.53 0.04 0.00 -0.77 0.00 0.00 57.85 54.61 3d4l n ARG 691 Cb 0.16 -1.53 0.13 0.00 -1.02 0.00 0.00 32.46 30.20 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 3.57 0.70 -0.85 7.54 0.00 -1.45 -1.38 119.26 127.39 3d4l h ALA 692 Ca 0.00 0.24 0.14 0.00 0.00 0.00 0.00 54.91 55.29 3d4l h ALA 692 Cb 0.99 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 3d4l h ALA 692 CO 0.03 -0.42 0.55 1.49 0.00 0.00 0.00 179.25 180.91 3d4l h GLU 693 N 0.09 0.62 0.00 0.00 4.57 -1.86 -0.89 114.58 117.11 3d4l h GLU 693 Ca 0.39 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 3d4l h GLU 693 Cb 0.66 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 3d4l h GLU 693 CO -0.65 0.41 0.00 0.09 -1.18 0.00 0.00 179.01 177.67 3d4l n ASN 694 N -4.54 0.62 0.00 1.04 3.02 -0.52 -2.59 115.26 112.29 3d4l n ASN 694 Ca 0.16 0.66 0.10 0.00 -0.03 0.00 0.00 54.58 55.47 3d4l n ASN 694 Cb 0.47 -0.79 0.49 0.00 -0.61 0.00 0.00 39.78 39.35 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 -2.19 0.00 0.32 3.10 3.72 -0.34 -2.25 117.46 119.82 3d4l n PHE 695 Ca 0.02 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.58 3d4l n PHE 695 Cb 0.21 -0.29 0.68 0.00 -0.94 0.00 0.00 39.48 39.14 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 -0.01 -1.08 1.57 -1.68 -2.79 116.57 112.58 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 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3d4l h LYS 696 CO 0.00 0.00 -0.15 1.04 -0.57 0.00 0.00 179.45 179.77 3d4l n GLN 697 N -2.75 0.98 -4.22 3.15 6.02 -0.95 -4.96 117.38 114.64 3d4l n GLN 697 Ca 0.01 -0.51 -0.13 0.00 -0.01 0.00 0.00 57.00 56.36 3d4l n GLN 697 Cb 0.24 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.91 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 -2.37 0.10 -0.25 5.09 -7.23 -1.05 -4.94 120.40 109.74 3d4l s VAL 698 Ca 0.29 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.36 3d4l s VAL 698 Cb 0.20 -2.52 -0.05 0.00 0.56 0.00 0.00 36.38 34.57 3d4l s VAL 698 CO 0.46 0.00 0.14 -1.61 -0.31 0.00 0.00 175.10 173.79 3d4l s GLU 699 N -4.13 3.97 -0.03 4.82 2.02 -0.88 -4.99 118.70 119.48 3d4l s GLU 699 Ca 0.39 -0.32 0.05 0.00 0.02 0.00 0.00 54.97 55.11 3d4l s GLU 699 Cb 0.07 -3.50 -0.01 0.00 0.10 0.00 0.00 34.13 30.79 3d4l s GLU 699 CO 0.13 -0.02 -0.19 -0.47 0.02 0.00 0.00 175.26 174.73 3d4l s TYR 700 N 1.25 1.79 -0.15 1.61 5.04 -1.26 -0.83 117.35 124.80 3d4l s TYR 700 Ca 0.07 -0.45 0.01 0.00 -2.44 0.00 0.00 57.07 54.26 3d4l s TYR 700 Cb -0.14 -1.18 0.02 0.00 0.35 0.00 0.00 41.96 41.00 3d4l s TYR 700 CO 0.06 -0.12 -0.19 -1.17 -1.34 0.00 0.00 175.55 172.79 3d4l s LEU 701 N -0.17 1.97 -0.15 6.97 2.96 -0.77 -0.40 118.68 129.08 3d4l s LEU 701 Ca 0.01 -0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 53.34 3d4l s LEU 701 Cb -0.10 -1.35 -0.01 0.00 0.50 0.00 0.00 46.19 45.23 3d4l s LEU 701 CO 0.01 0.01 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.72 3d4l s LEU 702 N 1.15 2.74 -0.01 -0.68 2.96 -0.36 -1.61 118.68 122.86 3d4l s LEU 702 Ca -0.00 -0.35 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 3d4l s LEU 702 Cb -0.14 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 3d4l s LEU 702 CO -0.08 0.12 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.34 3d4l s ILE 703 N 0.64 0.82 -0.20 6.68 1.01 -0.61 -1.48 121.20 128.07 3d4l s ILE 703 Ca -0.06 -0.43 -0.22 0.00 0.00 0.00 0.00 60.65 59.94 3d4l s ILE 703 Cb -0.15 -0.69 0.06 0.00 0.01 0.00 0.00 42.46 41.68 3d4l s ILE 703 CO 0.03 0.24 0.61 -2.28 0.00 0.00 0.00 174.94 173.53 3d4l s HIS 704 N -0.16 -0.65 0.10 3.97 2.46 -0.94 0.19 115.29 120.26 3d4l s HIS 704 Ca 0.03 1.52 -0.23 0.00 0.47 0.00 0.00 55.06 56.85 3d4l s HIS 704 Cb -0.05 0.24 -0.07 0.00 -0.13 0.00 0.00 32.58 32.58 3d4l s HIS 704 CO -0.00 -0.36 0.69 0.20 -2.47 0.00 0.00 174.74 172.80 3d4l s GLY 705 N 0.07 2.79 0.53 1.59 0.00 -1.26 -1.25 107.32 109.79 3d4l s GLY 705 Ca -0.02 0.21 0.31 0.00 0.00 0.00 0.00 44.72 45.23 3d4l s GLY 705 CO 0.02 0.76 1.97 -0.91 0.00 0.00 0.00 173.10 174.94 3d4l h THR 706 N 3.59 0.19 -0.73 0.90 1.35 -1.26 -3.06 112.91 113.90 3d4l h THR 706 Ca -0.47 -0.65 -0.42 0.00 -0.55 0.00 0.00 66.41 64.32 3d4l h THR 706 Cb 1.21 1.54 -0.24 0.00 -1.73 0.00 0.00 68.15 68.92 3d4l h THR 706 CO 0.66 0.07 0.27 0.00 -0.25 0.00 0.00 175.52 176.27 3d4l n ALA 707 N -2.14 5.21 -2.42 6.62 0.00 -0.56 -4.72 120.51 122.49 3d4l n ALA 707 Ca 0.00 -3.20 -0.43 0.00 0.00 0.00 0.00 53.44 49.81 3d4l n ALA 707 Cb 0.32 -1.13 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 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 -2.10 6.41 0.04 0.00 -1.08 -1.15 -4.26 116.67 114.53 3d4l s ASP 708 Ca 0.53 0.70 0.27 0.00 -0.52 0.00 0.00 52.55 53.53 3d4l s ASP 708 Cb 0.45 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 40.25 3d4l s ASP 708 CO 0.04 -1.40 1.70 -0.90 0.52 0.00 0.00 175.17 175.13 3d4l n ASP 709 N 8.58 0.33 -0.01 -0.34 5.75 -1.26 -4.01 116.55 125.58 3d4l n ASP 709 Ca 0.15 0.26 -0.01 0.00 -0.01 0.00 0.00 54.79 55.18 3d4l n ASP 709 Cb 0.48 -0.26 -0.00 0.00 -1.03 0.00 0.00 41.12 40.31 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 -1.67 0.25 -4.32 -1.12 2.85 -1.26 -4.77 115.26 105.22 3d4l n ASN 710 Ca 0.06 0.15 -0.43 0.00 -0.11 0.00 0.00 54.58 54.25 3d4l n ASN 710 Cb 0.36 -0.54 -0.08 0.00 1.24 0.00 0.00 39.78 40.76 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 -1.21 4.75 0.47 3.44 1.01 -1.26 -4.81 120.40 122.78 3d4l s VAL 711 Ca -0.03 -1.31 -0.25 0.00 0.00 0.00 0.00 61.98 60.39 3d4l s VAL 711 Cb 0.00 -3.92 -0.08 0.00 0.00 0.00 0.00 36.38 32.39 3d4l s VAL 711 CO 0.04 -0.61 1.41 1.41 0.00 0.00 0.00 175.10 177.36 3d4l n HIS 712 N 5.07 2.59 -0.33 5.22 8.25 -1.26 -4.70 115.22 130.06 3d4l n HIS 712 Ca -0.11 0.44 0.25 0.00 -0.26 0.00 0.00 57.72 58.04 3d4l n HIS 712 Cb 0.43 -2.44 0.54 0.00 1.12 0.00 0.00 29.99 29.64 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 2.12 0.59 -1.00 4.41 3.57 -1.80 0.27 116.94 125.10 3d4l h PHE 713 Ca -0.51 0.02 0.39 0.00 3.53 0.00 0.00 57.97 61.41 3d4l h PHE 713 Cb 1.28 -0.17 -0.18 0.00 2.79 0.00 0.00 35.95 39.67 3d4l h PHE 713 CO 0.49 0.03 0.49 0.37 -2.23 0.00 0.00 178.31 177.46 3d4l h GLN 714 N 0.34 0.04 -0.57 1.11 4.15 -1.94 0.60 115.11 118.83 3d4l h GLN 714 Ca 0.61 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 60.02 3d4l h GLN 714 Cb 1.64 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 29.29 3d4l h GLN 714 CO -0.28 0.02 0.34 1.96 -1.93 0.00 0.00 178.83 178.94 3d4l h GLN 715 N 0.04 0.78 0.00 1.69 4.20 -0.78 -1.07 115.11 119.97 3d4l h GLN 715 Ca 0.81 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 59.32 3d4l h GLN 715 Cb 2.08 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 29.68 3d4l h GLN 715 CO -0.77 0.56 -0.61 0.77 -0.67 0.00 0.00 178.83 178.12 3d4l h SER 716 N 0.77 0.00 -0.61 1.46 0.02 -1.10 -3.00 113.55 111.08 3d4l h SER 716 Ca 0.20 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 3d4l h SER 716 Cb -0.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 3d4l h SER 716 CO -0.04 0.61 0.36 0.00 -1.14 0.00 0.00 176.83 176.62 3d4l h ALA 717 N 1.39 1.44 0.01 3.77 0.00 -0.62 -0.50 119.26 124.76 3d4l h ALA 717 Ca -0.01 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 3d4l h ALA 717 Cb 1.42 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 3d4l h ALA 717 CO 0.08 0.47 -0.93 1.96 0.00 0.00 0.00 179.25 180.83 3d4l h GLN 718 N 0.87 0.08 -0.17 0.00 1.08 -1.19 -2.43 115.11 113.35 3d4l h GLN 718 Ca 0.22 -0.10 -0.03 0.00 -1.45 0.00 0.00 58.65 57.29 3d4l h GLN 718 Cb 0.00 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 3d4l h GLN 718 CO -0.04 0.95 -0.01 0.82 -0.95 0.00 0.00 178.83 179.60 3d4l h ILE 719 N 0.03 1.27 -0.82 2.54 2.04 -1.28 -1.89 117.51 119.41 3d4l h ILE 719 Ca -0.03 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 64.89 3d4l h ILE 719 Cb 1.61 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 39.19 3d4l h ILE 719 CO 0.13 0.27 0.36 0.77 0.00 0.00 0.00 178.15 179.68 3d4l h SER 720 N 0.04 1.10 -0.51 1.72 4.64 -1.14 -1.26 113.55 118.14 3d4l h SER 720 Ca 0.05 -0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.14 3d4l h SER 720 Cb 0.41 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3d4l h SER 720 CO 0.01 0.94 0.07 0.50 -0.87 0.00 0.00 176.83 177.48 3d4l h LYS 721 N 1.17 0.90 -0.35 4.77 3.64 -1.38 -0.21 116.57 125.12 3d4l h LYS 721 Ca 0.28 -0.23 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 3d4l h LYS 721 Cb 0.16 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3d4l h LYS 721 CO -0.03 0.86 -0.24 0.00 -2.27 0.00 0.00 179.45 177.77 3d4l h ALA 722 N 1.22 0.93 -0.30 5.00 0.00 -0.90 -0.55 119.26 124.65 3d4l h ALA 722 Ca 0.17 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 3d4l h ALA 722 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3d4l h ALA 722 CO 0.01 0.61 -0.28 -0.07 0.00 0.00 0.00 179.25 179.52 3d4l h LEU 723 N 0.61 0.78 -0.75 0.00 3.38 -0.80 -2.91 115.31 115.62 3d4l h LEU 723 Ca 0.08 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 3d4l h LEU 723 Cb 0.73 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 3d4l h LEU 723 CO 0.06 1.08 0.42 0.58 0.09 0.00 0.00 178.44 180.67 3d4l h VAL 724 N 0.48 1.22 0.00 1.22 2.07 -0.91 -1.03 116.25 119.32 3d4l h VAL 724 Ca 0.05 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 3d4l h VAL 724 Cb 0.85 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3d4l h VAL 724 CO 0.07 0.25 -0.06 0.44 0.02 0.00 0.00 177.57 178.29 3d4l h ASP 725 N 1.03 0.00 -0.46 0.57 3.32 -0.97 -1.74 116.42 118.17 3d4l h ASP 725 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3d4l h ASP 725 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3d4l h ASP 725 CO -0.04 0.06 0.00 1.33 -1.72 0.00 0.00 179.24 178.86 3d4l n VAL 726 N -3.74 0.87 -2.91 -1.35 0.24 -1.03 -4.99 118.33 105.43 3d4l n VAL 726 Ca -0.02 -0.94 -0.12 0.00 -2.04 0.00 0.00 64.34 61.22 3d4l n VAL 726 Cb 0.15 0.61 0.03 0.00 -1.47 0.00 0.00 33.84 33.17 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 1.02 0.17 3.66 7.63 0.00 -0.66 -4.99 105.19 112.02 3d4l n GLY 727 Ca 0.16 -0.25 -0.36 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 -3.06 5.24 0.27 1.61 1.01 -0.44 -5.03 120.40 120.01 3d4l s VAL 728 Ca 0.25 0.14 -0.19 0.00 0.00 0.00 0.00 61.98 62.17 3d4l s VAL 728 Cb -0.11 -3.42 -0.09 0.00 0.00 0.00 0.00 36.38 32.76 3d4l s VAL 728 CO 0.30 0.38 0.76 -0.62 0.00 0.00 0.00 175.10 175.92 3d4l s ASP 729 N 0.83 6.99 0.30 3.32 2.15 -1.26 -4.49 116.67 124.51 3d4l s ASP 729 Ca 0.07 1.42 -0.19 0.00 0.43 0.00 0.00 52.55 54.28 3d4l s ASP 729 Cb -0.13 -2.42 0.03 0.00 -0.30 0.00 0.00 42.92 40.10 3d4l s ASP 729 CO 0.02 -0.06 0.73 0.72 -0.17 0.00 0.00 175.17 176.41 3d4l s PHE 730 N -1.69 -0.10 0.03 -5.34 -0.71 -1.26 -4.77 117.98 104.14 3d4l s PHE 730 Ca 0.48 -0.41 0.00 0.00 -1.04 0.00 0.00 56.93 55.96 3d4l s PHE 730 Cb -0.15 0.72 -0.04 0.00 -1.21 0.00 0.00 43.02 42.35 3d4l s PHE 730 CO 0.20 -1.31 0.11 -0.65 -1.34 0.00 0.00 175.22 172.23 3d4l s GLN 731 N -3.54 3.11 0.06 1.99 -1.52 0.47 -5.03 119.66 115.20 3d4l s GLN 731 Ca 0.12 -0.52 -0.03 0.00 -1.95 0.00 0.00 55.36 52.98 3d4l s GLN 731 Cb -0.06 -2.87 -0.03 0.00 -0.22 0.00 0.00 33.01 29.83 3d4l s GLN 731 CO 0.08 0.62 0.04 0.00 -0.25 0.00 0.00 175.29 175.78 3d4l s ALA 732 N -1.31 0.27 -0.28 6.09 0.00 -1.26 -1.23 121.76 124.03 3d4l s ALA 732 Ca 0.27 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 51.11 3d4l s ALA 732 Cb -0.12 0.33 0.11 0.00 0.00 0.00 0.00 23.12 23.44 3d4l s ALA 732 CO 0.19 -0.41 0.65 1.41 0.00 0.00 0.00 175.76 177.60 3d4l s MET 733 N -3.83 0.61 0.13 0.00 1.75 -0.55 -4.93 119.30 112.49 3d4l s MET 733 Ca 0.06 1.34 0.04 0.00 -1.25 0.00 0.00 55.69 55.88 3d4l s MET 733 Cb 0.07 0.56 -0.04 0.00 2.84 0.00 0.00 34.83 38.26 3d4l s MET 733 CO -0.10 -0.18 0.14 1.67 -0.65 0.00 0.00 175.02 175.90 3d4l s TRP 734 N 2.39 3.22 -0.28 4.11 -2.14 -1.26 -2.23 118.94 122.76 3d4l s TRP 734 Ca -0.07 0.04 0.03 0.00 2.66 0.00 0.00 56.10 58.76 3d4l s TRP 734 Cb -0.09 -1.58 0.07 0.00 -3.10 0.00 0.00 33.47 28.77 3d4l s TRP 734 CO -0.19 0.52 -0.06 0.71 -2.66 0.00 0.00 176.95 175.28 3d4l s TYR 735 N -1.62 3.29 0.01 1.66 2.02 -0.38 -4.93 117.35 117.39 3d4l s TYR 735 Ca 0.31 -2.45 -0.34 0.00 -0.37 0.00 0.00 57.07 54.22 3d4l s TYR 735 Cb -0.11 -2.16 -0.13 0.00 -0.40 0.00 0.00 41.96 39.16 3d4l s TYR 735 CO 0.24 -0.89 1.74 2.41 -1.57 0.00 0.00 175.55 177.48 3d4l n THR 736 N 4.41 0.32 -1.23 -0.71 -1.04 -1.26 -1.44 114.28 113.34 3d4l n THR 736 Ca -0.09 -0.06 -0.08 0.00 -2.04 0.00 0.00 64.05 61.79 3d4l n THR 736 Cb 0.42 -1.68 -0.03 0.00 -1.82 0.00 0.00 70.33 67.22 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 5.17 -5.46 -4.88 8.00 8.00 -1.26 -4.88 116.55 121.25 3d4l n ASP 737 Ca 0.20 0.19 -0.32 0.00 0.71 0.00 0.00 54.79 55.57 3d4l n ASP 737 Cb 0.28 -3.64 -0.05 0.00 -0.02 0.00 0.00 41.12 37.69 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 -2.52 3.75 0.00 -1.24 0.41 -0.98 -4.65 118.70 113.46 3d4l s GLU 738 Ca 0.00 0.16 0.00 0.00 -0.41 0.00 0.00 54.97 54.72 3d4l s GLU 738 Cb 0.00 -2.77 0.00 0.00 -1.78 0.00 0.00 34.13 29.58 3d4l s GLU 738 CO 0.00 0.40 0.00 -0.40 -0.49 0.00 0.00 175.26 174.77 3d4l n ASP 739 N 0.12 0.17 0.33 -0.19 5.68 -1.26 -1.50 116.55 119.90 3d4l n ASP 739 Ca -0.02 0.00 0.22 0.00 -0.50 0.00 0.00 54.79 54.49 3d4l n ASP 739 Cb 0.52 0.00 1.17 0.00 -1.14 0.00 0.00 41.12 41.68 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 -2.12 115.15 113.24 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 0.00 -0.79 0.41 -0.00 0.00 0.00 177.93 177.55 3d4l n GLY 741 N -1.05 -1.22 3.85 5.26 0.00 -1.26 -4.95 105.19 105.82 3d4l n GLY 741 Ca -0.03 -0.39 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.75 -1.08 0.19 -0.61 5.41 -0.80 -4.82 119.36 115.91 3d4l n ILE 742 Ca 0.04 -0.37 0.08 0.00 1.00 0.00 0.00 62.75 63.49 3d4l n ILE 742 Cb 0.39 -0.99 0.14 0.00 -0.71 0.00 0.00 39.64 38.47 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 -3.65 2.36 -1.75 -1.39 0.00 -1.26 -3.89 120.51 110.93 3d4l n ALA 743 Ca -0.18 -0.92 -0.36 0.00 0.00 0.00 0.00 53.44 51.98 3d4l n ALA 743 Cb 0.46 -0.57 0.04 0.00 0.00 0.00 0.00 19.45 19.38 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 -1.15 5.08 0.18 0.00 1.04 -1.26 -4.73 113.70 112.85 3d4l s SER 744 Ca 0.25 2.46 -0.18 0.00 0.48 0.00 0.00 55.95 58.96 3d4l s SER 744 Cb 0.15 -2.61 0.12 0.00 0.10 0.00 0.00 66.02 63.78 3d4l s SER 744 CO 0.21 -1.67 1.64 -1.28 0.98 0.00 0.00 173.24 173.11 3d4l h SER 745 N 0.86 -0.64 -0.43 7.02 0.87 -1.99 0.90 113.55 120.14 3d4l h SER 745 Ca -0.51 0.16 -0.15 0.00 -1.23 0.00 0.00 61.79 60.06 3d4l h SER 745 Cb 1.31 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 63.62 3d4l h SER 745 CO 0.55 -0.22 -0.32 0.71 -0.53 0.00 0.00 176.83 177.02 3d4l h THR 746 N -0.10 1.27 -0.27 2.23 1.35 -1.99 -2.47 112.91 112.94 3d4l h THR 746 Ca 0.21 -1.49 -0.12 0.00 -0.55 0.00 0.00 66.41 64.46 3d4l h THR 746 Cb 0.42 1.27 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 3d4l h THR 746 CO -0.50 0.51 -0.33 0.00 -0.25 0.00 0.00 175.52 174.94 3d4l h ALA 747 N 0.81 0.91 -0.26 6.62 0.00 -1.83 -1.00 119.26 124.51 3d4l h ALA 747 Ca 0.08 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 3d4l h ALA 747 Cb 0.91 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3d4l h ALA 747 CO 0.09 0.62 0.15 1.25 0.00 0.00 0.00 179.25 181.36 3d4l h HIS 748 N 0.49 0.36 -0.59 0.00 2.76 -0.76 -0.16 115.15 117.25 3d4l h HIS 748 Ca 0.06 -0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.14 3d4l h HIS 748 Cb 0.82 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.64 3d4l h HIS 748 CO 0.03 0.29 0.04 1.96 -1.30 0.00 0.00 177.93 178.95 3d4l h GLN 749 N 0.32 1.00 -0.40 5.26 4.20 -1.24 -2.96 115.11 121.28 3d4l h GLN 749 Ca 0.09 -0.28 -0.06 0.00 0.06 0.00 0.00 58.65 58.46 3d4l h GLN 749 Cb 0.04 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3d4l h GLN 749 CO -0.02 0.95 0.02 1.25 -0.67 0.00 0.00 178.83 180.36 3d4l h HIS 750 N 0.92 0.76 -0.43 2.96 2.76 -0.86 -2.24 115.15 119.03 3d4l h HIS 750 Ca 0.18 -0.13 -0.13 0.00 -2.20 0.00 0.00 60.37 58.09 3d4l h HIS 750 Cb 0.48 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 3d4l h HIS 750 CO 0.03 0.76 -0.25 0.97 -1.30 0.00 0.00 177.93 178.15 3d4l h ILE 751 N 0.53 1.27 -0.02 6.26 2.10 -1.00 -0.40 117.51 126.25 3d4l h ILE 751 Ca 0.12 -1.40 -0.14 0.00 1.08 0.00 0.00 64.86 64.51 3d4l h ILE 751 Cb 0.45 1.21 -0.02 0.00 -1.09 0.00 0.00 36.82 37.37 3d4l h ILE 751 CO 0.02 0.48 -0.65 1.88 -1.08 0.00 0.00 178.15 178.80 3d4l h TYR 752 N 0.77 0.13 -0.20 2.19 0.05 -1.53 -0.56 116.97 117.80 3d4l h TYR 752 Ca 0.10 -0.05 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 3d4l h TYR 752 Cb 0.81 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.52 3d4l h TYR 752 CO 0.05 0.71 -0.02 1.15 -1.05 0.00 0.00 178.16 179.00 3d4l h THR 753 N 0.07 1.27 -0.46 -2.88 2.02 -1.21 -0.44 112.91 111.27 3d4l h THR 753 Ca -0.01 -0.94 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 3d4l h THR 753 Cb 1.16 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 69.03 3d4l h THR 753 CO 0.09 0.29 0.26 -0.74 0.37 0.00 0.00 175.52 175.79 3d4l h HIS 754 N 0.12 0.62 -0.39 3.16 -0.00 -0.86 -2.31 115.15 115.48 3d4l h HIS 754 Ca 0.06 -0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.33 3d4l h HIS 754 Cb 0.44 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 3d4l h HIS 754 CO 0.04 0.45 -0.11 0.52 -0.00 0.00 0.00 177.93 178.84 3d4l h MET 755 N 0.60 0.69 -0.39 5.26 2.07 -1.06 -2.47 114.93 119.62 3d4l h MET 755 Ca 0.16 -0.22 0.00 0.00 -2.07 0.00 0.00 59.70 57.58 3d4l h MET 755 Cb 0.03 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 29.68 3d4l h MET 755 CO -0.03 0.78 0.26 0.77 1.07 0.00 0.00 176.91 179.76 3d4l h SER 756 N 0.63 0.46 -0.73 1.22 0.02 -0.69 -0.84 113.55 113.62 3d4l h SER 756 Ca 0.11 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 3d4l h SER 756 Cb 0.55 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 3d4l h SER 756 CO 0.03 0.34 0.41 0.45 -1.14 0.00 0.00 176.83 176.92 3d4l h HIS 757 N 0.53 0.99 -0.38 3.45 3.86 -1.25 -0.92 115.15 121.43 3d4l h HIS 757 Ca 0.14 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.32 3d4l h HIS 757 Cb -0.05 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.08 3d4l h HIS 757 CO -0.05 0.69 0.18 0.35 0.86 0.00 0.00 177.93 179.96 3d4l h PHE 758 N 1.00 0.56 -0.34 2.45 3.57 -1.04 -0.65 116.94 122.49 3d4l h PHE 758 Ca 0.26 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.67 3d4l h PHE 758 Cb 0.02 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 3d4l h PHE 758 CO -0.00 0.48 -0.01 0.82 -2.23 0.00 0.00 178.31 177.36 3d4l h ILE 759 N 0.48 1.26 -0.57 1.41 1.08 -1.01 -1.66 117.51 118.51 3d4l h ILE 759 Ca 0.13 -1.00 -0.04 0.00 -0.39 0.00 0.00 64.86 63.56 3d4l h ILE 759 Cb 0.14 1.23 -0.03 0.00 -3.07 0.00 0.00 36.82 35.09 3d4l h ILE 759 CO -0.02 0.33 0.21 0.11 -0.69 0.00 0.00 178.15 178.09 3d4l h LYS 760 N 0.42 0.83 -0.15 2.37 1.57 -1.05 -1.14 116.57 119.42 3d4l h LYS 760 Ca 0.10 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 3d4l h LYS 760 Cb 0.48 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3d4l h LYS 760 CO 0.02 0.69 -0.11 0.37 -0.57 0.00 0.00 179.45 179.85 3d4l h GLN 761 N 0.82 0.34 -0.63 3.15 -0.00 -1.02 0.41 115.11 118.18 3d4l h GLN 761 Ca 0.19 -0.17 0.02 0.00 -0.00 0.00 0.00 58.65 58.69 3d4l h GLN 761 Cb 0.19 -0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.63 3d4l h GLN 761 CO -0.02 0.70 0.41 0.00 0.00 0.00 0.00 178.83 179.93 3d4l n PHE 763 N -4.45 0.27 -3.54 0.00 3.72 -0.46 -4.95 117.46 108.05 3d4l n PHE 763 Ca 0.07 -0.14 -0.19 0.00 -0.05 0.00 0.00 57.45 57.14 3d4l n PHE 763 Cb 0.07 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.68 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 0.61 -2.34 -4.63 4.37 7.64 -0.67 -4.99 113.62 113.60 3d4l n SER 764 Ca 0.17 -0.67 -0.35 0.00 1.01 0.00 0.00 58.87 59.03 3d4l n SER 764 Cb 0.40 -4.77 -0.10 0.00 -1.01 0.00 0.00 64.21 58.73 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 -6.58 3.72 0.00 -3.43 1.43 0.14 -5.03 118.68 108.93 3d4l s LEU 765 Ca 0.09 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 3d4l s LEU 765 Cb -0.04 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.26 3d4l s LEU 765 CO 0.76 0.22 0.33 -2.65 0.23 0.00 0.00 176.35 175.24