#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d4z s GLN 32 N -2.35 3.84 -0.27 0.00 -0.21 -1.26 -5.00 119.66 114.41 3d4z s GLN 32 Ca 0.59 2.00 -0.29 0.00 0.02 0.00 0.00 55.36 57.68 3d4z s GLN 32 Cb -0.41 -2.59 -0.00 0.00 1.00 0.00 0.00 33.01 31.00 3d4z s GLN 32 CO 0.53 -0.55 1.27 0.34 -2.12 0.00 0.00 175.29 174.75 3d4z s ASP 33 N -1.00 6.77 0.00 5.90 -1.08 -1.26 -4.87 116.67 121.13 3d4z s ASP 33 Ca 0.60 1.32 0.23 0.00 -0.52 0.00 0.00 52.55 54.18 3d4z s ASP 33 Cb -0.34 -2.54 0.53 0.00 -1.46 0.00 0.00 42.92 39.10 3d4z s ASP 33 CO 0.43 -0.98 1.45 1.33 0.52 0.00 0.00 175.17 177.92 3d4z n VAL 34 N 5.96 0.32 -0.07 1.11 0.24 -1.26 -4.41 118.33 120.23 3d4z n VAL 34 Ca 0.14 -0.57 -0.12 0.00 -2.04 0.00 0.00 64.34 61.75 3d4z n VAL 34 Cb 0.46 0.83 -0.06 0.00 -1.47 0.00 0.00 33.84 33.60 3d4z n VAL 34 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 3d4z n VAL 35 N 1.05 0.80 0.97 3.34 0.31 -1.26 -4.85 118.33 118.68 3d4z n VAL 35 Ca 0.18 -0.26 0.10 0.00 -0.01 0.00 0.00 64.34 64.34 3d4z n VAL 35 Cb 0.51 -1.29 -0.11 0.00 -0.91 0.00 0.00 33.84 32.03 3d4z n VAL 35 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3d4z n GLN 36 N -3.23 0.27 -3.71 5.55 6.02 -1.26 -4.20 117.38 116.81 3d4z n GLN 36 Ca -0.26 -0.06 -0.38 0.00 -0.01 0.00 0.00 57.00 56.28 3d4z n GLN 36 Cb 0.74 -1.47 -0.12 0.00 1.02 0.00 0.00 30.24 30.41 3d4z n GLN 36 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3d4z s ASP 37 N -2.91 5.41 -0.29 1.08 1.01 -1.26 -4.89 116.67 114.81 3d4z s ASP 37 Ca 0.08 -1.07 -0.29 0.00 0.71 0.00 0.00 52.55 51.98 3d4z s ASP 37 Cb 0.16 -1.91 0.01 0.00 1.01 0.00 0.00 42.92 42.19 3d4z s ASP 37 CO 0.83 -0.33 1.17 -0.69 0.21 0.00 0.00 175.17 176.35 3d4z s VAL 38 N 1.45 4.37 0.44 -1.27 1.01 -1.26 -4.76 120.40 120.37 3d4z s VAL 38 Ca -0.00 1.58 -0.26 0.00 0.00 0.00 0.00 61.98 63.30 3d4z s VAL 38 Cb -0.19 -4.28 -0.09 0.00 0.00 0.00 0.00 36.38 31.82 3d4z s VAL 38 CO 0.04 -0.43 1.46 -2.65 0.00 0.00 0.00 175.10 173.52 3d4z n PRO 39 N 6.96 2.37 -3.19 2.72 -0.02 -1.26 -4.95 135.00 137.63 3d4z n PRO 39 Ca 0.13 0.84 -0.42 0.00 -2.02 0.00 0.00 63.50 62.03 3d4z n PRO 39 Cb 0.47 -2.66 -0.07 0.00 -0.02 0.00 0.00 33.50 31.21 3d4z n PRO 39 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3d4z s ASN 40 N -0.39 6.31 0.16 2.55 2.47 -1.26 -5.05 114.94 119.73 3d4z s ASN 40 Ca 0.59 -0.24 0.06 0.00 0.42 0.00 0.00 52.86 53.69 3d4z s ASN 40 Cb -0.45 -2.29 -0.04 0.00 -1.45 0.00 0.00 41.25 37.02 3d4z s ASN 40 CO 0.59 -0.62 -0.12 0.68 -3.72 0.00 0.00 177.10 173.90 3d4z s VAL 41 N 2.54 1.38 0.17 -5.21 -7.23 -1.26 -5.05 120.40 105.74 3d4z s VAL 41 Ca 0.20 -2.02 -0.05 0.00 -1.81 0.00 0.00 61.98 58.29 3d4z s VAL 41 Cb -0.15 -1.83 -0.08 0.00 0.56 0.00 0.00 36.38 34.88 3d4z s VAL 41 CO 0.16 -0.62 1.45 0.44 -0.31 0.00 0.00 175.10 176.22 3d4z h ASP 42 N 2.90 0.67 -3.16 4.85 3.32 -1.71 -3.42 116.42 119.86 3d4z h ASP 42 Ca -0.38 -0.39 -0.56 0.00 0.02 0.00 0.00 57.03 55.72 3d4z h ASP 42 Cb 1.20 -0.20 -0.36 0.00 0.22 0.00 0.00 39.33 40.19 3d4z h ASP 42 CO 0.60 1.13 -0.82 -0.69 -1.72 0.00 0.00 179.24 177.74 3d4z s VAL 43 N -3.89 1.25 -0.21 -1.35 1.01 -0.36 -5.00 120.40 111.86 3d4z s VAL 43 Ca -0.08 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3d4z s VAL 43 Cb 0.11 -1.22 0.03 0.00 0.00 0.00 0.00 36.38 35.29 3d4z s VAL 43 CO 0.86 0.41 -0.16 -1.58 0.00 0.00 0.00 175.10 174.62 3d4z s GLN 44 N 1.58 2.79 0.43 2.72 -0.44 -1.26 -0.94 119.66 124.53 3d4z s GLN 44 Ca 0.04 -0.97 0.13 0.00 -2.50 0.00 0.00 55.36 52.06 3d4z s GLN 44 Cb -0.13 -2.71 0.93 0.00 -1.64 0.00 0.00 33.01 29.46 3d4z s GLN 44 CO -0.09 -0.32 1.96 0.52 0.50 0.00 0.00 175.29 177.86 3d4z h MET 45 N 7.91 0.05 -0.50 1.67 2.86 -1.40 0.36 114.93 125.88 3d4z h MET 45 Ca -0.37 -0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.14 3d4z h MET 45 Cb 1.11 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 3d4z h MET 45 CO 0.58 0.24 -0.11 1.25 1.06 0.00 0.00 176.91 179.94 3d4z h LEU 46 N 0.05 0.97 -0.55 1.22 5.85 -1.93 -0.75 115.31 120.18 3d4z h LEU 46 Ca 0.01 -0.36 -0.12 0.00 0.84 0.00 0.00 57.88 58.26 3d4z h LEU 46 Cb 0.36 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3d4z h LEU 46 CO 0.03 1.10 -0.11 -0.08 -0.34 0.00 0.00 178.44 179.03 3d4z h GLU 47 N 0.83 1.04 -0.36 1.25 4.22 -1.61 -1.92 114.58 118.02 3d4z h GLU 47 Ca 0.13 -0.39 0.01 0.00 0.08 0.00 0.00 59.36 59.19 3d4z h GLU 47 Cb 0.67 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 3d4z h GLU 47 CO 0.05 1.08 0.23 1.25 -2.18 0.00 0.00 179.01 179.44 3d4z h LEU 48 N 0.92 0.39 -1.18 1.64 5.85 -0.91 -2.42 115.31 119.61 3d4z h LEU 48 Ca 0.14 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.91 3d4z h LEU 48 Cb 0.69 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 3d4z h LEU 48 CO 0.05 0.28 0.57 1.88 -0.34 0.00 0.00 178.44 180.88 3d4z h TYR 49 N 0.47 1.02 -0.20 1.25 -1.99 -0.94 0.94 116.97 117.52 3d4z h TYR 49 Ca 0.14 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.80 3d4z h TYR 49 Cb -0.03 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.35 3d4z h TYR 49 CO -0.06 0.55 -0.27 0.22 -0.00 0.00 0.00 178.16 178.60 3d4z h ASP 50 N 1.02 0.39 0.56 3.88 3.58 -0.88 -3.22 116.42 121.75 3d4z h ASP 50 Ca 0.36 -0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.66 3d4z h ASP 50 Cb 0.14 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.08 3d4z h ASP 50 CO -0.13 0.66 -1.46 -2.11 -2.88 0.00 0.00 179.24 173.32 3d4z n ARG 51 N -4.12 0.63 -2.21 0.28 1.85 -0.81 -4.98 116.66 107.30 3d4z n ARG 51 Ca -0.01 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.48 3d4z n ARG 51 Cb 0.40 -1.70 0.00 0.00 -1.05 0.00 0.00 32.46 30.12 3d4z n ARG 51 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 3d4z s MET 52 N -3.37 3.48 -0.00 2.89 -1.94 0.26 -5.01 119.30 115.62 3d4z s MET 52 Ca -0.04 1.73 0.07 0.00 -1.71 0.00 0.00 55.69 55.74 3d4z s MET 52 Cb 0.11 -2.18 -0.24 0.00 2.01 0.00 0.00 34.83 34.53 3d4z s MET 52 CO 0.84 -0.77 0.81 1.03 -0.01 0.00 0.00 175.02 176.92 3d4z h SER 53 N 1.55 0.10 -0.15 3.03 0.87 -1.90 -3.48 113.55 113.57 3d4z h SER 53 Ca -0.50 -0.18 -0.06 0.00 -1.23 0.00 0.00 61.79 59.82 3d4z h SER 53 Cb 1.26 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.16 3d4z h SER 53 CO 0.58 1.15 -0.06 0.49 -0.53 0.00 0.00 176.83 178.46 3d4z n PHE 54 N -3.22 0.00 -2.03 2.24 3.72 -1.26 -4.96 117.46 111.95 3d4z n PHE 54 Ca -0.14 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.85 3d4z n PHE 54 Cb 1.03 -1.74 -0.02 0.00 -0.94 0.00 0.00 39.48 37.81 3d4z n PHE 54 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3d4z s LYS 55 N -1.86 4.29 -0.97 -1.08 -0.14 -1.26 -4.92 119.74 113.79 3d4z s LYS 55 Ca 0.00 2.30 -0.10 0.00 -1.36 0.00 0.00 55.97 56.81 3d4z s LYS 55 Cb 0.00 -3.07 0.25 0.00 -1.68 0.00 0.00 37.83 33.33 3d4z s LYS 55 CO 0.00 -0.32 0.94 0.34 -0.76 0.00 0.00 175.35 175.55 3d4z s ASP 56 N -0.16 6.97 0.12 2.83 2.15 -1.26 -5.02 116.67 122.30 3d4z s ASP 56 Ca 0.53 -3.22 0.05 0.00 0.43 0.00 0.00 52.55 50.34 3d4z s ASP 56 Cb -0.42 -2.18 -0.04 0.00 -0.30 0.00 0.00 42.92 39.98 3d4z s ASP 56 CO 0.52 -0.40 0.04 0.27 -0.17 0.00 0.00 175.17 175.43 3d4z s ILE 57 N -0.67 4.14 -0.31 4.11 -4.36 -1.26 -5.04 121.20 117.81 3d4z s ILE 57 Ca 0.25 -1.07 -0.29 0.00 -0.26 0.00 0.00 60.65 59.28 3d4z s ILE 57 Cb -0.10 -3.03 -0.00 0.00 1.25 0.00 0.00 42.46 40.57 3d4z s ILE 57 CO -0.08 0.02 1.44 -0.62 0.24 0.00 0.00 174.94 175.94 3d4z s ASP 58 N -2.64 6.45 0.00 4.36 -1.08 -1.26 -4.62 116.67 117.88 3d4z s ASP 58 Ca 0.28 1.21 0.25 0.00 -0.52 0.00 0.00 52.55 53.77 3d4z s ASP 58 Cb -0.11 -2.54 0.73 0.00 -1.46 0.00 0.00 42.92 39.55 3d4z s ASP 58 CO 0.20 -1.26 1.56 0.61 0.52 0.00 0.00 175.17 176.79 3d4z n GLY 59 N 4.69 0.47 0.00 2.66 0.00 0.26 -5.02 105.19 108.24 3d4z n GLY 59 Ca 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3d4z n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d4z n GLY 60 N 1.23 0.48 0.33 -0.02 0.00 -1.26 -3.74 105.19 102.22 3d4z n GLY 60 Ca 0.17 -1.76 0.03 0.00 0.00 0.00 0.00 46.02 44.47 3d4z n GLY 60 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3d4z h VAL 61 N 0.00 1.12 -2.28 1.61 -1.51 -1.93 -2.93 116.25 110.33 3d4z h VAL 61 Ca 0.00 -0.27 -0.63 0.00 -1.23 0.00 0.00 66.70 64.57 3d4z h VAL 61 Cb 0.00 0.28 -0.14 0.00 -2.13 0.00 0.00 31.29 29.30 3d4z h VAL 61 CO 0.00 0.14 0.86 0.86 -1.23 0.00 0.00 177.57 178.20 3d4z s TRP 62 N -5.67 2.72 0.44 5.19 -0.00 -1.21 -4.48 118.94 115.93 3d4z s TRP 62 Ca -0.10 -0.77 0.11 0.00 -0.00 0.00 0.00 56.10 55.34 3d4z s TRP 62 Cb 0.18 -4.41 0.97 0.00 -0.00 0.00 0.00 33.47 30.21 3d4z s TRP 62 CO 0.76 -1.71 2.04 0.87 -0.00 0.00 0.00 176.95 178.91 3d4z h LYS 63 N 9.46 0.25 -0.42 5.86 1.79 -1.80 -1.38 116.57 130.33 3d4z h LYS 63 Ca -0.08 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 3d4z h LYS 63 Cb 1.04 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 3d4z h LYS 63 CO 1.22 0.24 0.00 1.04 -1.08 0.00 0.00 179.45 180.87 3d4z n GLN 64 N -4.43 3.18 0.00 3.15 6.02 -1.26 -0.58 117.38 123.47 3d4z n GLN 64 Ca -0.00 -2.58 0.00 0.00 -0.01 0.00 0.00 57.00 54.41 3d4z n GLN 64 Cb 0.14 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.74 3d4z n GLN 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d4z n GLY 65 N 0.39 2.89 3.64 1.08 0.00 -0.52 -4.66 105.19 108.01 3d4z n GLY 65 Ca 0.19 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 3d4z n GLY 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3d4z s TRP 66 N 3.46 0.35 -0.64 1.61 -2.14 -1.25 -4.21 118.94 116.13 3d4z s TRP 66 Ca 0.00 -0.75 -0.27 0.00 2.66 0.00 0.00 56.10 57.74 3d4z s TRP 66 Cb 0.00 0.31 0.02 0.00 -3.10 0.00 0.00 33.47 30.69 3d4z s TRP 66 CO 0.00 -1.12 1.38 -0.80 -2.66 0.00 0.00 176.95 173.75 3d4z s ASN 67 N -3.04 6.08 0.22 -2.66 0.01 -1.25 -4.68 114.94 109.62 3d4z s ASN 67 Ca 0.21 -0.02 -0.30 0.00 -0.71 0.00 0.00 52.86 52.04 3d4z s ASN 67 Cb -0.02 -2.55 -0.09 0.00 0.41 0.00 0.00 41.25 39.00 3d4z s ASN 67 CO 0.11 -1.81 1.20 -0.63 -1.51 0.00 0.00 177.10 174.46 3d4z s ILE 68 N 6.14 3.43 0.05 0.60 1.01 -1.26 -5.03 121.20 126.15 3d4z s ILE 68 Ca 0.46 1.26 0.08 0.00 0.00 0.00 0.00 60.65 62.45 3d4z s ILE 68 Cb -0.09 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.54 3d4z s ILE 68 CO 0.21 0.23 -0.21 -0.54 0.00 0.00 0.00 174.94 174.62 3d4z s LYS 69 N -0.57 1.91 0.07 2.79 1.02 -1.26 -4.97 119.74 118.73 3d4z s LYS 69 Ca 0.51 -1.06 0.01 0.00 0.02 0.00 0.00 55.97 55.45 3d4z s LYS 69 Cb -0.34 -2.10 -0.04 0.00 -0.52 0.00 0.00 37.83 34.84 3d4z s LYS 69 CO 0.39 0.52 -0.05 1.52 -0.92 0.00 0.00 175.35 176.81 3d4z s TYR 70 N -0.92 0.67 -0.32 3.18 1.13 -1.26 -4.98 117.35 114.86 3d4z s TYR 70 Ca 0.14 -0.91 -0.20 0.00 -1.41 0.00 0.00 57.07 54.69 3d4z s TYR 70 Cb -0.10 -0.43 -0.01 0.00 -1.10 0.00 0.00 41.96 40.32 3d4z s TYR 70 CO 0.05 -0.24 0.61 0.34 -2.51 0.00 0.00 175.55 173.79 3d4z s ASP 71 N -2.74 6.46 0.57 -0.18 -1.08 -1.26 -4.93 116.67 113.51 3d4z s ASP 71 Ca 0.06 0.33 0.27 0.00 -0.52 0.00 0.00 52.55 52.69 3d4z s ASP 71 Cb 0.04 -2.32 1.53 0.00 -1.46 0.00 0.00 42.92 40.71 3d4z s ASP 71 CO -0.06 -0.48 2.05 1.55 0.52 0.00 0.00 175.17 178.75 3d4z h PRO 72 N 8.25 0.00 -0.00 4.34 0.13 -1.99 0.02 132.00 142.75 3d4z h PRO 72 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3d4z h PRO 72 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3d4z h PRO 72 CO 0.80 0.00 -0.00 1.28 -0.23 0.00 0.00 178.00 179.85 3d4z n LEU 73 N -4.01 0.07 -0.29 1.56 4.77 -1.26 -3.79 117.00 114.05 3d4z n LEU 73 Ca 0.04 -0.02 -0.06 0.00 -0.03 0.00 0.00 56.01 55.95 3d4z n LEU 73 Cb 0.43 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.57 3d4z n LEU 73 CO 0.31 0.01 1.08 0.50 -1.33 0.00 0.00 177.39 177.96 3d4z h LYS 74 N 0.11 1.15 -5.79 3.23 3.64 -1.39 -3.41 116.57 114.12 3d4z h LYS 74 Ca 0.00 -0.18 -0.67 0.00 -1.27 0.00 0.00 60.65 58.53 3d4z h LYS 74 Cb 0.03 -0.20 -0.09 0.00 -0.41 0.00 0.00 32.23 31.56 3d4z h LYS 74 CO 0.00 0.90 -0.53 0.71 -2.27 0.00 0.00 179.45 178.27 3d4z s TYR 75 N -5.66 3.45 0.38 1.91 2.02 -1.25 -4.92 117.35 113.29 3d4z s TYR 75 Ca -0.13 0.38 -0.12 0.00 -0.37 0.00 0.00 57.07 56.84 3d4z s TYR 75 Cb 0.15 -1.86 0.05 0.00 -0.40 0.00 0.00 41.96 39.90 3d4z s TYR 75 CO 0.83 0.64 0.72 0.27 -1.57 0.00 0.00 175.55 176.44 3d4z n ASN 76 N 1.76 -2.09 -0.32 2.29 0.23 0.39 -4.90 115.26 112.61 3d4z n ASN 76 Ca -0.17 -2.65 0.16 0.00 -0.53 0.00 0.00 54.58 51.39 3d4z n ASN 76 Cb 0.54 3.54 0.40 0.00 -2.08 0.00 0.00 39.78 42.19 3d4z n ASN 76 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3d4z h ALA 77 N 2.01 1.90 -0.62 -2.53 0.00 -1.95 0.12 119.26 118.19 3d4z h ALA 77 Ca -0.32 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3d4z h ALA 77 Cb 1.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3d4z h ALA 77 CO 0.41 -0.27 0.00 0.72 0.00 0.00 0.00 179.25 180.11 3d4z n HIS 78 N -4.70 1.39 -2.95 0.00 8.25 -1.26 -4.63 115.22 111.32 3d4z n HIS 78 Ca 0.23 -0.56 -0.01 0.00 -0.26 0.00 0.00 57.72 57.12 3d4z n HIS 78 Cb 0.67 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.56 3d4z n HIS 78 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3d4z s HIS 79 N -1.79 -1.40 0.21 4.41 5.04 0.42 -5.15 115.29 117.03 3d4z s HIS 79 Ca 0.48 -0.08 0.00 0.00 -1.54 0.00 0.00 55.06 53.92 3d4z s HIS 79 Cb 0.31 0.26 -0.04 0.00 0.04 0.00 0.00 32.58 33.15 3d4z s HIS 79 CO 0.24 -1.01 0.38 0.15 -2.34 0.00 0.00 174.74 172.16 3d4z s LYS 80 N 1.45 3.50 -0.27 2.88 1.02 -1.19 -0.46 119.74 126.66 3d4z s LYS 80 Ca 0.21 -0.41 -0.23 0.00 0.02 0.00 0.00 55.97 55.56 3d4z s LYS 80 Cb -0.00 -2.85 -0.00 0.00 -0.52 0.00 0.00 37.83 34.46 3d4z s LYS 80 CO -0.08 0.40 0.78 -1.17 -0.92 0.00 0.00 175.35 174.36 3d4z s LEU 81 N -3.43 4.08 -0.25 3.17 2.96 0.17 -4.87 118.68 120.51 3d4z s LEU 81 Ca 0.38 0.81 -0.16 0.00 -0.22 0.00 0.00 54.13 54.94 3d4z s LEU 81 Cb -0.11 -3.08 -0.04 0.00 0.50 0.00 0.00 46.19 43.46 3d4z s LEU 81 CO 0.29 -0.54 0.41 -0.54 -1.32 0.00 0.00 176.35 174.66 3d4z s LYS 82 N 2.85 4.08 -0.17 1.98 1.02 0.23 -1.30 119.74 128.42 3d4z s LYS 82 Ca 0.32 0.15 -0.01 0.00 0.02 0.00 0.00 55.97 56.46 3d4z s LYS 82 Cb -0.15 -3.62 -0.00 0.00 -0.52 0.00 0.00 37.83 33.54 3d4z s LYS 82 CO 0.10 -0.21 -0.13 0.08 -0.92 0.00 0.00 175.35 174.26 3d4z s VAL 83 N 1.87 2.82 -0.31 3.17 1.01 0.10 -0.26 120.40 128.80 3d4z s VAL 83 Ca 0.18 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 3d4z s VAL 83 Cb -0.15 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.04 3d4z s VAL 83 CO 0.09 0.50 0.08 -0.36 0.00 0.00 0.00 175.10 175.41 3d4z s PHE 84 N 0.94 3.20 -0.29 5.22 0.08 -0.16 -1.14 117.98 125.83 3d4z s PHE 84 Ca -0.02 -1.25 -0.18 0.00 0.12 0.00 0.00 56.93 55.59 3d4z s PHE 84 Cb -0.15 -2.25 -0.02 0.00 -0.57 0.00 0.00 43.02 40.03 3d4z s PHE 84 CO -0.01 -0.67 0.53 0.08 -0.10 0.00 0.00 175.22 175.05 3d4z s VAL 85 N 1.44 5.04 -0.42 -0.44 1.01 -0.01 -0.82 120.40 126.20 3d4z s VAL 85 Ca 0.00 0.76 -0.03 0.00 0.00 0.00 0.00 61.98 62.72 3d4z s VAL 85 Cb -0.18 -3.88 0.11 0.00 0.00 0.00 0.00 36.38 32.43 3d4z s VAL 85 CO 0.02 -0.01 0.21 -0.69 0.00 0.00 0.00 175.10 174.63 3d4z s VAL 86 N 2.37 3.27 0.28 2.92 1.01 0.18 -0.61 120.40 129.82 3d4z s VAL 86 Ca 0.21 -2.13 -0.29 0.00 0.00 0.00 0.00 61.98 59.77 3d4z s VAL 86 Cb -0.15 -3.24 -0.10 0.00 0.00 0.00 0.00 36.38 32.88 3d4z s VAL 86 CO 0.10 -0.70 1.37 -2.84 0.00 0.00 0.00 175.10 173.03 3d4z s PRO 87 N 1.06 4.32 0.23 2.72 0.02 -1.26 -0.62 135.00 141.46 3d4z s PRO 87 Ca 0.09 2.24 -0.13 0.00 0.02 0.00 0.00 61.00 63.22 3d4z s PRO 87 Cb -0.23 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.20 3d4z s PRO 87 CO -0.04 -0.30 0.47 -3.38 -0.33 0.00 0.00 177.00 173.41 3d4z s HIS 88 N -0.51 0.27 -0.20 6.54 -3.43 -0.57 -1.56 115.29 115.83 3d4z s HIS 88 Ca 0.54 -0.64 -0.04 0.00 -0.80 0.00 0.00 55.06 54.13 3d4z s HIS 88 Cb -0.40 0.20 0.10 0.00 -1.43 0.00 0.00 32.58 31.05 3d4z s HIS 88 CO 0.47 -0.95 0.28 0.45 -2.00 0.00 0.00 174.74 172.99 3d4z s SER 89 N -2.99 0.78 -0.34 7.38 0.15 -1.26 -3.83 113.70 113.59 3d4z s SER 89 Ca 0.19 0.13 -0.28 0.00 0.70 0.00 0.00 55.95 56.69 3d4z s SER 89 Cb -0.00 0.68 0.02 0.00 -1.71 0.00 0.00 66.02 65.00 3d4z s SER 89 CO 0.06 -0.30 1.05 -2.28 1.20 0.00 0.00 173.24 172.98 3d4z s HIS 90 N 2.41 3.11 -0.38 3.44 2.46 -0.25 -4.74 115.29 121.35 3d4z s HIS 90 Ca 0.07 1.08 -0.00 0.00 0.47 0.00 0.00 55.06 56.67 3d4z s HIS 90 Cb -0.15 -3.75 0.11 0.00 -0.13 0.00 0.00 32.58 28.66 3d4z s HIS 90 CO -0.12 -0.82 0.14 -0.80 -2.47 0.00 0.00 174.74 170.67 3d4z s ASN 91 N 1.77 5.05 -0.11 9.88 0.01 -1.26 -0.34 114.94 129.94 3d4z s ASN 91 Ca 0.44 -2.07 -0.29 0.00 -0.71 0.00 0.00 52.86 50.23 3d4z s ASN 91 Cb -0.12 -1.75 -0.04 0.00 0.41 0.00 0.00 41.25 39.76 3d4z s ASN 91 CO 0.17 -0.47 1.54 -1.81 -1.51 0.00 0.00 177.10 175.02 3d4z s ASP 92 N 1.44 6.70 -1.15 -1.22 1.01 -1.26 -4.90 116.67 117.29 3d4z s ASP 92 Ca 0.09 1.98 -0.14 0.00 0.71 0.00 0.00 52.55 55.19 3d4z s ASP 92 Cb -0.21 -2.53 -0.07 0.00 1.01 0.00 0.00 42.92 41.12 3d4z s ASP 92 CO -0.06 -0.94 2.23 -2.65 0.21 0.00 0.00 175.17 173.97 3d4z n PRO 93 N 7.08 2.39 0.00 8.23 -0.02 -1.26 -4.59 135.00 146.83 3d4z n PRO 93 Ca 0.17 -2.04 0.00 0.00 -2.02 0.00 0.00 63.50 59.61 3d4z n PRO 93 Cb 0.44 -2.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.01 3d4z n PRO 93 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d4z n GLY 94 N 4.08 2.16 0.00 -1.23 0.00 -1.26 -4.52 105.19 104.41 3d4z n GLY 94 Ca 0.54 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 45.06 3d4z n GLY 94 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3d4z n TRP 95 N 2.12 0.00 1.07 1.61 -0.00 -1.26 -4.67 117.44 116.30 3d4z n TRP 95 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.50 57.62 3d4z n TRP 95 Cb 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 31.31 31.41 3d4z n TRP 95 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 177.69 178.13 3d4z n ILE 96 N -0.25 0.00 -4.27 5.87 -5.35 -1.26 -0.93 119.36 113.16 3d4z n ILE 96 Ca 0.00 -0.27 -0.16 0.00 -0.27 0.00 0.00 62.75 62.05 3d4z n ILE 96 Cb 0.00 1.10 -0.10 0.00 -1.74 0.00 0.00 39.64 38.90 3d4z n ILE 96 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3d4z s GLN 97 N -2.40 1.13 0.91 6.28 -0.21 -1.26 -4.83 119.66 119.28 3d4z s GLN 97 Ca 0.22 -1.46 -0.12 0.00 0.02 0.00 0.00 55.36 54.02 3d4z s GLN 97 Cb 0.19 -0.80 0.14 0.00 1.00 0.00 0.00 33.01 33.54 3d4z s GLN 97 CO 0.51 0.12 1.09 0.95 -2.12 0.00 0.00 175.29 175.85 3d4z s THR 98 N -3.05 2.53 0.18 -0.19 -4.23 -1.26 -4.20 115.64 105.42 3d4z s THR 98 Ca 0.17 0.17 -0.20 0.00 -1.18 0.00 0.00 61.69 60.66 3d4z s THR 98 Cb 0.01 -2.69 0.12 0.00 1.34 0.00 0.00 72.50 71.27 3d4z s THR 98 CO 0.03 -0.23 1.61 0.15 -0.54 0.00 0.00 174.62 175.64 3d4z h PHE 99 N -1.59 -0.69 -0.26 3.99 3.57 -1.90 0.08 116.94 120.14 3d4z h PHE 99 Ca -0.50 0.06 -0.13 0.00 3.53 0.00 0.00 57.97 60.92 3d4z h PHE 99 Cb 1.29 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 40.40 3d4z h PHE 99 CO 0.39 -0.34 -0.37 1.49 -2.23 0.00 0.00 178.31 177.25 3d4z h GLU 100 N -0.16 0.60 -0.22 1.11 4.57 -1.96 0.66 114.58 119.17 3d4z h GLU 100 Ca 0.22 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3d4z h GLU 100 Cb 0.50 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 3d4z h GLU 100 CO -0.57 0.88 0.14 0.93 -1.18 0.00 0.00 179.01 179.20 3d4z h GLU 101 N 0.50 0.30 -0.44 1.92 5.08 -1.80 -0.96 114.58 119.18 3d4z h GLU 101 Ca 0.05 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 3d4z h GLU 101 Cb 0.87 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 3d4z h GLU 101 CO 0.08 0.24 -0.02 1.88 -1.00 0.00 0.00 179.01 180.18 3d4z h TYR 102 N 0.28 0.78 -0.59 4.33 0.05 -0.80 0.83 116.97 121.85 3d4z h TYR 102 Ca 0.08 -0.11 0.00 0.00 0.05 0.00 0.00 58.73 58.75 3d4z h TYR 102 Cb 0.01 -0.21 -0.03 0.00 1.01 0.00 0.00 36.73 37.51 3d4z h TYR 102 CO -0.05 0.75 0.37 -0.92 -1.05 0.00 0.00 178.16 177.26 3d4z h TYR 103 N 0.69 0.76 -0.13 4.88 3.20 -0.51 0.16 116.97 126.02 3d4z h TYR 103 Ca 0.13 0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.80 3d4z h TYR 103 Cb 0.46 -0.25 0.01 0.00 1.54 0.00 0.00 36.73 38.48 3d4z h TYR 103 CO 0.02 0.50 -0.77 1.96 -1.64 0.00 0.00 178.16 178.23 3d4z h GLN 104 N 0.79 0.68 0.00 1.82 1.08 -0.89 -0.23 115.11 118.36 3d4z h GLN 104 Ca 0.21 -0.56 -0.23 0.00 -1.45 0.00 0.00 58.65 56.62 3d4z h GLN 104 Cb -0.05 0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.46 3d4z h GLN 104 CO -0.04 1.17 -1.23 0.45 -0.95 0.00 0.00 178.83 178.23 3d4z h HIS 105 N 0.46 0.00 0.00 2.96 3.86 -0.71 -3.45 115.15 118.27 3d4z h HIS 105 Ca -0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3d4z h HIS 105 Cb 1.38 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.85 3d4z h HIS 105 CO 0.07 0.98 0.00 -0.25 0.86 0.00 0.00 177.93 179.59 3d4z n ASP 106 N -3.24 0.27 -0.03 2.45 8.00 0.40 -4.89 116.55 119.51 3d4z n ASP 106 Ca -0.06 0.20 -0.03 0.00 0.71 0.00 0.00 54.79 55.61 3d4z n ASP 106 Cb 0.97 0.03 0.21 0.00 -0.02 0.00 0.00 41.12 42.31 3d4z n ASP 106 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3d4z h THR 107 N 0.00 1.24 -0.08 -3.53 2.02 -1.07 -0.94 112.91 110.55 3d4z h THR 107 Ca 0.00 -1.07 -0.06 0.00 0.77 0.00 0.00 66.41 66.05 3d4z h THR 107 Cb 0.00 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 3d4z h THR 107 CO 0.00 0.36 -0.23 0.07 0.37 0.00 0.00 175.52 176.08 3d4z h LYS 108 N 0.55 0.14 -0.11 6.66 2.10 -1.26 -0.26 116.57 124.39 3d4z h LYS 108 Ca 0.10 -0.04 -0.23 0.00 -2.00 0.00 0.00 60.65 58.48 3d4z h LYS 108 Cb 0.52 -0.01 0.01 0.00 -0.90 0.00 0.00 32.23 31.85 3d4z h LYS 108 CO 0.03 0.37 -0.84 0.45 -2.00 0.00 0.00 179.45 177.46 3d4z h HIS 109 N 0.13 0.99 -0.33 0.07 3.86 -1.50 -1.41 115.15 116.95 3d4z h HIS 109 Ca 0.02 -0.46 0.01 0.00 -1.16 0.00 0.00 60.37 58.78 3d4z h HIS 109 Cb 0.49 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.80 3d4z h HIS 109 CO 0.00 1.29 0.21 0.82 0.86 0.00 0.00 177.93 181.11 3d4z h ILE 110 N 0.47 1.07 -0.08 2.45 2.04 -0.66 0.10 117.51 122.89 3d4z h ILE 110 Ca -0.07 -0.15 -0.20 0.00 1.00 0.00 0.00 64.86 65.45 3d4z h ILE 110 Cb 1.46 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 3d4z h ILE 110 CO 0.17 0.08 -0.78 -0.07 0.00 0.00 0.00 178.15 177.54 3d4z h LEU 111 N 0.42 0.57 -0.56 1.44 3.38 -1.07 0.13 115.31 119.62 3d4z h LEU 111 Ca 0.12 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3d4z h LEU 111 Cb -0.03 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3d4z h LEU 111 CO -0.04 1.15 0.25 -1.28 0.09 0.00 0.00 178.44 178.62 3d4z h SER 112 N 0.31 0.76 0.85 -0.43 0.87 -1.16 -1.43 113.55 113.31 3d4z h SER 112 Ca -0.04 -0.15 -0.16 0.00 -1.23 0.00 0.00 61.79 60.21 3d4z h SER 112 Cb 1.38 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 3d4z h SER 112 CO 0.14 0.70 -0.74 0.78 -0.53 0.00 0.00 176.83 177.17 3d4z h ASN 113 N 0.77 0.00 -0.50 6.23 2.35 -0.86 -2.55 115.58 121.02 3d4z h ASN 113 Ca 0.19 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.90 3d4z h ASN 113 Cb 0.16 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 3d4z h ASN 113 CO -0.02 0.74 0.17 0.00 -1.65 0.00 0.00 177.43 176.67 3d4z h ALA 114 N 1.26 0.65 -0.44 -0.83 0.00 -0.50 0.66 119.26 120.06 3d4z h ALA 114 Ca -0.01 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.77 3d4z h ALA 114 Cb 1.37 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 3d4z h ALA 114 CO 0.10 0.29 0.19 1.25 0.00 0.00 0.00 179.25 181.08 3d4z h LEU 115 N 0.67 0.25 -0.04 0.00 5.85 -1.11 0.22 115.31 121.17 3d4z h LEU 115 Ca 0.16 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 3d4z h LEU 115 Cb 0.25 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 3d4z h LEU 115 CO -0.01 0.18 0.00 -0.09 -0.34 0.00 0.00 178.44 178.19 3d4z h ARG 116 N 0.39 0.06 -0.27 1.25 2.43 -1.24 -1.55 114.38 115.46 3d4z h ARG 116 Ca 0.20 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.20 3d4z h ARG 116 Cb 0.15 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3d4z h ARG 116 CO -0.17 0.35 -0.45 0.45 -1.51 0.00 0.00 179.97 178.64 3d4z h HIS 117 N -0.24 0.83 -0.30 2.20 3.86 -0.69 -0.54 115.15 120.27 3d4z h HIS 117 Ca 0.01 -0.26 -0.05 0.00 -1.16 0.00 0.00 60.37 58.91 3d4z h HIS 117 Cb 0.32 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3d4z h HIS 117 CO 0.03 1.01 -0.00 -0.07 0.86 0.00 0.00 177.93 179.76 3d4z h LEU 118 N 0.55 0.52 -0.63 2.43 3.38 -1.01 -1.37 115.31 119.18 3d4z h LEU 118 Ca 0.03 -0.31 0.10 0.00 0.09 0.00 0.00 57.88 57.80 3d4z h LEU 118 Cb 1.00 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.53 3d4z h LEU 118 CO 0.09 0.70 0.23 -0.74 0.09 0.00 0.00 178.44 178.82 3d4z h HIS 119 N 0.32 0.40 -0.00 1.13 2.76 -1.08 -2.57 115.15 116.11 3d4z h HIS 119 Ca 0.09 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 3d4z h HIS 119 Cb 0.44 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.31 3d4z h HIS 119 CO 0.04 0.09 -0.16 -0.25 -1.30 0.00 0.00 177.93 176.34 3d4z n ASP 120 N -5.01 0.17 -3.59 3.26 8.00 -0.23 -4.47 116.55 114.68 3d4z n ASP 120 Ca 0.09 0.25 -0.29 0.00 0.71 0.00 0.00 54.79 55.56 3d4z n ASP 120 Cb 0.29 -0.25 -0.12 0.00 -0.02 0.00 0.00 41.12 41.02 3d4z n ASP 120 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3d4z s ASN 121 N -3.00 3.04 0.66 -2.24 0.01 -0.53 -5.01 114.94 107.87 3d4z s ASN 121 Ca 0.13 -2.82 0.43 0.00 -0.71 0.00 0.00 52.86 49.89 3d4z s ASN 121 Cb 0.19 -0.81 2.34 0.00 0.41 0.00 0.00 41.25 43.37 3d4z s ASN 121 CO 0.59 -0.22 2.32 -0.65 -1.51 0.00 0.00 177.10 177.62 3d4z h PRO 122 N 6.31 0.00 -0.00 -0.60 0.11 -1.78 -1.23 132.00 134.80 3d4z h PRO 122 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3d4z h PRO 122 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3d4z h PRO 122 CO 0.44 0.00 -0.60 0.39 -0.21 0.00 0.00 178.00 178.02 3d4z n GLU 123 N -3.04 0.43 -2.63 1.05 -0.58 -1.26 -4.90 120.64 109.71 3d4z n GLU 123 Ca -0.03 -0.32 -0.34 0.00 -0.42 0.00 0.00 57.16 56.06 3d4z n GLU 123 Cb 0.10 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.44 3d4z n GLU 123 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 3d4z s MET 124 N -2.78 3.94 0.13 3.49 1.75 -0.46 -4.65 119.30 120.71 3d4z s MET 124 Ca 0.14 1.29 0.01 0.00 -1.25 0.00 0.00 55.69 55.88 3d4z s MET 124 Cb 0.18 -2.12 -0.04 0.00 2.84 0.00 0.00 34.83 35.68 3d4z s MET 124 CO 0.69 -0.31 -0.01 0.15 -0.65 0.00 0.00 175.02 174.89 3d4z s LYS 125 N -3.21 0.95 -0.27 4.11 -0.14 -1.26 -4.80 119.74 115.12 3d4z s LYS 125 Ca 0.66 -1.43 -0.25 0.00 -1.36 0.00 0.00 55.97 53.59 3d4z s LYS 125 Cb -0.14 -0.12 0.09 0.00 -1.68 0.00 0.00 37.83 35.98 3d4z s LYS 125 CO 0.18 -0.12 0.85 0.12 -0.76 0.00 0.00 175.35 175.62 3d4z s PHE 126 N -3.74 -0.66 0.12 3.18 5.36 -0.23 -4.38 117.98 117.64 3d4z s PHE 126 Ca 0.19 1.61 0.08 0.00 -0.96 0.00 0.00 56.93 57.85 3d4z s PHE 126 Cb 0.06 0.31 -0.04 0.00 -0.34 0.00 0.00 43.02 43.01 3d4z s PHE 126 CO -0.00 -0.32 -0.14 0.96 -1.46 0.00 0.00 175.22 174.26 3d4z s ILE 127 N 0.31 3.10 -0.03 3.12 -4.36 -0.60 -1.28 121.20 121.46 3d4z s ILE 127 Ca 0.01 -1.43 0.01 0.00 -0.26 0.00 0.00 60.65 58.98 3d4z s ILE 127 Cb -0.05 -2.45 0.02 0.00 1.25 0.00 0.00 42.46 41.23 3d4z s ILE 127 CO -0.02 0.08 -0.03 0.86 0.24 0.00 0.00 174.94 176.06 3d4z s TRP 128 N -1.25 0.60 -0.15 1.37 -0.11 -0.29 -4.34 118.94 114.76 3d4z s TRP 128 Ca 0.20 -0.13 0.03 0.00 1.22 0.00 0.00 56.10 57.42 3d4z s TRP 128 Cb -0.11 -0.55 -0.12 0.00 -1.50 0.00 0.00 33.47 31.20 3d4z s TRP 128 CO 0.12 -0.15 -0.10 0.00 -4.62 0.00 0.00 176.95 172.20 3d4z n ALA 129 N 3.92 1.66 -3.12 5.86 0.00 -1.26 -0.91 120.51 126.65 3d4z n ALA 129 Ca -0.25 -0.73 -0.45 0.00 0.00 0.00 0.00 53.44 52.02 3d4z n ALA 129 Cb 0.51 0.09 -0.05 0.00 0.00 0.00 0.00 19.45 20.01 3d4z n ALA 129 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3d4z s GLU 130 N -2.32 3.04 0.43 0.00 8.01 -1.26 -3.93 118.70 122.66 3d4z s GLU 130 Ca -0.18 -1.36 0.24 0.00 0.01 0.00 0.00 54.97 53.67 3d4z s GLU 130 Cb 0.05 -4.26 0.70 0.00 -4.31 0.00 0.00 34.13 26.31 3d4z s GLU 130 CO 0.41 -1.50 1.73 0.82 0.01 0.00 0.00 175.26 176.73 3d4z h ILE 131 N 5.92 0.41 -0.57 -1.63 1.08 -0.99 -2.70 117.51 119.03 3d4z h ILE 131 Ca -0.29 -1.22 0.11 0.00 -0.39 0.00 0.00 64.86 63.06 3d4z h ILE 131 Cb 1.09 1.91 -0.09 0.00 -3.07 0.00 0.00 36.82 36.66 3d4z h ILE 131 CO 1.09 0.20 0.06 0.77 -0.69 0.00 0.00 178.15 179.58 3d4z h SER 132 N 0.00 -0.11 -0.07 1.72 4.64 -1.36 0.24 113.55 118.60 3d4z h SER 132 Ca -0.00 0.12 -0.18 0.00 -0.47 0.00 0.00 61.79 61.26 3d4z h SER 132 Cb 0.89 0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3d4z h SER 132 CO 0.03 -0.04 -0.61 1.88 -0.87 0.00 0.00 176.83 177.22 3d4z h TYR 133 N 0.19 0.87 -0.56 4.77 0.05 -1.74 -2.12 116.97 118.43 3d4z h TYR 133 Ca 0.30 -0.33 -0.06 0.00 0.05 0.00 0.00 58.73 58.68 3d4z h TYR 133 Cb 0.45 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 3d4z h TYR 133 CO -0.29 1.11 0.11 0.35 -1.05 0.00 0.00 178.16 178.40 3d4z h PHE 134 N 0.51 0.96 -0.47 4.88 3.57 -1.06 -0.67 116.94 124.66 3d4z h PHE 134 Ca -0.00 -0.12 -0.09 0.00 3.53 0.00 0.00 57.97 61.28 3d4z h PHE 134 Cb 1.19 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 3d4z h PHE 134 CO 0.06 0.84 -0.07 0.00 -2.23 0.00 0.00 178.31 176.91 3d4z h ALA 135 N 1.01 1.00 -0.87 2.41 0.00 -0.54 0.16 119.26 122.42 3d4z h ALA 135 Ca 0.17 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.79 3d4z h ALA 135 Cb 0.38 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3d4z h ALA 135 CO 0.01 0.61 0.57 -0.09 0.00 0.00 0.00 179.25 180.34 3d4z h ARG 136 N 0.75 1.15 -0.00 0.00 9.65 -0.98 -2.55 114.38 122.40 3d4z h ARG 136 Ca 0.13 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 58.94 3d4z h ARG 136 Cb 0.55 -0.26 0.00 0.00 -1.39 0.00 0.00 29.97 28.88 3d4z h ARG 136 CO 0.03 0.77 -0.00 0.35 2.80 0.00 0.00 179.97 183.92 3d4z h PHE 137 N 1.18 0.00 -0.58 2.20 3.57 -0.73 -3.33 116.94 119.25 3d4z h PHE 137 Ca 0.32 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.91 3d4z h PHE 137 Cb -0.13 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.54 3d4z h PHE 137 CO 0.00 0.67 0.19 -0.92 -2.23 0.00 0.00 178.31 176.02 3d4z h TYR 138 N -0.67 0.32 0.00 0.41 3.20 -0.60 -0.84 116.97 118.79 3d4z h TYR 138 Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3d4z h TYR 138 Cb 0.67 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.89 3d4z h TYR 138 CO 0.16 0.06 0.00 0.72 -1.64 0.00 0.00 178.16 177.46 3d4z n HIS 139 N -5.04 0.14 1.29 -3.82 8.25 -0.97 -0.92 115.22 114.15 3d4z n HIS 139 Ca 0.08 0.04 0.13 0.00 -0.26 0.00 0.00 57.72 57.72 3d4z n HIS 139 Cb 0.27 -0.57 0.47 0.00 1.12 0.00 0.00 29.99 31.27 3d4z n HIS 139 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3d4z n ASP 140 N -1.62 0.78 -4.76 0.41 9.92 -0.33 -4.92 116.55 116.03 3d4z n ASP 140 Ca 0.05 -0.72 -0.39 0.00 -0.53 0.00 0.00 54.79 53.20 3d4z n ASP 140 Cb 0.28 0.05 -0.06 0.00 -0.64 0.00 0.00 41.12 40.75 3d4z n ASP 140 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3d4z s LEU 141 N -2.52 4.56 0.74 0.64 1.43 -0.10 -5.05 118.68 118.38 3d4z s LEU 141 Ca 0.25 1.88 -0.14 0.00 -1.03 0.00 0.00 54.13 55.10 3d4z s LEU 141 Cb 0.19 -3.69 0.04 0.00 0.03 0.00 0.00 46.19 42.77 3d4z s LEU 141 CO 0.51 0.10 1.16 -0.83 0.23 0.00 0.00 176.35 177.52 3d4z s GLY 142 N -1.30 2.15 0.28 -3.19 0.00 -1.26 -4.78 107.32 99.22 3d4z s GLY 142 Ca 0.43 0.70 -0.02 0.00 0.00 0.00 0.00 44.72 45.83 3d4z s GLY 142 CO 0.29 1.08 1.91 -2.09 0.00 0.00 0.00 173.10 174.29 3d4z h GLU 143 N -0.49 1.11 -0.47 2.90 4.57 -1.97 -0.13 114.58 120.11 3d4z h GLU 143 Ca -0.46 -0.07 0.09 0.00 -1.18 0.00 0.00 59.36 57.74 3d4z h GLU 143 Cb 1.27 -0.25 -0.10 0.00 -0.16 0.00 0.00 28.75 29.51 3d4z h GLU 143 CO 0.50 0.74 -0.31 -2.95 -1.18 0.00 0.00 179.01 175.80 3d4z h ASN 144 N 1.15 -1.06 0.19 1.04 7.08 -2.00 -0.25 115.58 121.73 3d4z h ASN 144 Ca 0.40 0.20 -0.15 0.00 -3.08 0.00 0.00 56.30 53.67 3d4z h ASN 144 Cb 0.12 0.52 -0.01 0.00 -2.08 0.00 0.00 38.32 36.86 3d4z h ASN 144 CO -0.14 -0.31 -0.57 0.11 -2.08 0.00 0.00 177.43 174.44 3d4z h LYS 145 N -0.21 0.40 -0.69 4.14 1.79 -1.72 -1.89 116.57 118.40 3d4z h LYS 145 Ca 0.20 -0.26 0.02 0.00 -2.18 0.00 0.00 60.65 58.43 3d4z h LYS 145 Cb 0.53 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.18 3d4z h LYS 145 CO -0.58 0.86 0.44 0.87 -1.08 0.00 0.00 179.45 179.96 3d4z h LYS 146 N 0.30 0.86 -0.65 3.15 1.57 -0.54 0.67 116.57 121.93 3d4z h LYS 146 Ca 0.00 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3d4z h LYS 146 Cb 1.09 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.18 3d4z h LYS 146 CO 0.10 0.57 0.27 -0.07 -0.57 0.00 0.00 179.45 179.74 3d4z h LEU 147 N 0.88 0.89 -0.91 2.94 3.38 -0.78 0.12 115.31 121.84 3d4z h LEU 147 Ca 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3d4z h LEU 147 Cb -0.04 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 3d4z h LEU 147 CO -0.08 0.82 0.54 1.56 0.09 0.00 0.00 178.44 181.36 3d4z h GLN 148 N 0.92 1.24 -0.22 1.13 4.20 -0.90 -1.26 115.11 120.21 3d4z h GLN 148 Ca 0.22 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 3d4z h GLN 148 Cb 0.20 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 3d4z h GLN 148 CO -0.02 0.87 -0.00 1.98 -0.67 0.00 0.00 178.83 180.99 3d4z h MET 149 N 1.25 0.38 -0.45 1.46 4.05 -0.42 -2.17 114.93 119.04 3d4z h MET 149 Ca 0.32 -0.12 -0.00 0.00 -0.28 0.00 0.00 59.70 59.62 3d4z h MET 149 Cb -0.04 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 3d4z h MET 149 CO -0.06 0.58 0.28 0.87 0.23 0.00 0.00 176.91 178.81 3d4z h LYS 150 N 0.15 0.60 -0.28 0.39 1.57 -0.65 -2.16 116.57 116.19 3d4z h LYS 150 Ca 0.06 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 3d4z h LYS 150 Cb 0.41 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3d4z h LYS 150 CO 0.01 0.42 0.11 1.03 -0.57 0.00 0.00 179.45 180.45 3d4z h SER 151 N 0.61 0.39 1.42 0.86 0.87 -0.85 0.20 113.55 117.05 3d4z h SER 151 Ca 0.16 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 3d4z h SER 151 Cb -0.03 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 3d4z h SER 151 CO -0.03 0.45 0.00 0.16 -0.53 0.00 0.00 176.83 176.88 3d4z h ILE 152 N 0.30 0.00 0.00 2.23 3.07 -0.90 -1.31 117.51 120.89 3d4z h ILE 152 Ca 0.09 -0.69 -0.05 0.00 1.55 0.00 0.00 64.86 65.76 3d4z h ILE 152 Cb 0.19 1.68 0.00 0.00 -0.27 0.00 0.00 36.82 38.42 3d4z h ILE 152 CO -0.01 0.00 -0.19 0.58 -1.05 0.00 0.00 178.15 177.48 3d4z h VAL 153 N 0.00 1.58 -0.66 0.16 2.07 -1.20 -0.41 116.25 117.79 3d4z h VAL 153 Ca 0.00 -1.95 0.01 0.00 0.82 0.00 0.00 66.70 65.58 3d4z h VAL 153 Cb 0.71 2.83 -0.03 0.00 -1.52 0.00 0.00 31.29 33.28 3d4z h VAL 153 CO 0.00 0.53 0.44 0.50 0.02 0.00 0.00 177.57 179.05 3d4z h LYS 154 N -0.59 0.84 -0.03 1.57 3.64 -0.26 -1.64 116.57 120.09 3d4z h LYS 154 Ca -0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3d4z h LYS 154 Cb 0.97 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3d4z h LYS 154 CO 0.04 0.55 0.00 0.27 -2.27 0.00 0.00 179.45 178.04 3d4z n ASN 155 N -4.44 0.87 0.00 4.20 0.23 -0.53 -4.93 115.26 110.66 3d4z n ASN 155 Ca 0.07 -1.37 0.00 0.00 -0.53 0.00 0.00 54.58 52.75 3d4z n ASN 155 Cb 0.06 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.75 3d4z n ASN 155 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3d4z n GLY 156 N 1.06 0.75 0.17 4.83 0.00 -0.62 -4.94 105.19 106.45 3d4z n GLY 156 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 3d4z n GLY 156 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3d4z h GLN 157 N 3.40 0.59 -4.91 1.61 4.20 -1.34 -3.41 115.11 115.24 3d4z h GLN 157 Ca 0.00 -0.73 -0.65 0.00 0.06 0.00 0.00 58.65 57.33 3d4z h GLN 157 Cb 0.00 0.23 -0.22 0.00 0.30 0.00 0.00 27.48 27.79 3d4z h GLN 157 CO 0.00 1.32 -0.60 -1.17 -0.67 0.00 0.00 178.83 177.70 3d4z s LEU 158 N -8.01 3.62 -0.11 1.46 2.96 -0.64 -1.07 118.68 116.89 3d4z s LEU 158 Ca -0.10 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 3d4z s LEU 158 Cb 0.05 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.79 3d4z s LEU 158 CO 0.91 -0.07 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.94 3d4z s GLU 159 N 1.63 2.94 0.10 1.98 2.12 -0.40 -4.29 118.70 122.78 3d4z s GLU 159 Ca 0.06 -0.84 -0.28 0.00 0.36 0.00 0.00 54.97 54.27 3d4z s GLU 159 Cb -0.16 -2.27 -0.06 0.00 0.26 0.00 0.00 34.13 31.90 3d4z s GLU 159 CO 0.05 0.12 0.90 -0.06 -0.54 0.00 0.00 175.26 175.72 3d4z s PHE 160 N 0.50 3.81 -0.08 5.30 0.08 -1.26 -1.14 117.98 125.18 3d4z s PHE 160 Ca -0.15 1.71 0.03 0.00 0.12 0.00 0.00 56.93 58.64 3d4z s PHE 160 Cb -0.17 -2.97 -0.01 0.00 -0.57 0.00 0.00 43.02 39.29 3d4z s PHE 160 CO 0.06 0.26 -0.19 0.14 -0.10 0.00 0.00 175.22 175.38 3d4z s VAL 161 N -0.15 2.58 0.00 -0.44 -7.23 -0.09 -4.69 120.40 110.38 3d4z s VAL 161 Ca 0.44 -0.86 0.00 0.00 -1.81 0.00 0.00 61.98 59.75 3d4z s VAL 161 Cb -0.23 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.70 3d4z s VAL 161 CO 0.28 0.56 0.00 0.41 -0.31 0.00 0.00 175.10 176.04 3d4z n THR 162 N 3.08 0.00 -1.04 5.32 -1.04 0.08 -4.22 114.28 116.46 3d4z n THR 162 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 3d4z n THR 162 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 3d4z n THR 162 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d4z n GLY 163 N 0.00 0.47 3.85 3.41 0.00 -1.25 -4.63 105.19 107.03 3d4z n GLY 163 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 3d4z n GLY 163 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d4z s GLY 164 N -2.89 1.63 0.30 -0.02 0.00 -1.25 -1.94 107.32 103.14 3d4z s GLY 164 Ca 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 44.72 44.48 3d4z s GLY 164 CO 0.00 0.13 1.85 -0.25 0.00 0.00 0.00 173.10 174.83 3d4z h TRP 165 N -0.83 1.09 -4.68 1.90 2.91 -1.57 -0.87 115.95 113.89 3d4z h TRP 165 Ca -0.46 0.03 -0.47 0.00 1.13 0.00 0.00 58.89 59.12 3d4z h TRP 165 Cb 1.26 -0.35 -0.12 0.00 -0.51 0.00 0.00 29.16 29.45 3d4z h TRP 165 CO 0.49 0.44 -0.43 1.33 -1.03 0.00 0.00 178.44 179.24 3d4z n VAL 166 N -4.59 0.00 -3.50 2.65 0.24 -1.26 -1.21 118.33 110.65 3d4z n VAL 166 Ca 0.18 -2.22 -0.42 0.00 -2.04 0.00 0.00 64.34 59.84 3d4z n VAL 166 Cb 0.36 0.97 -0.07 0.00 -1.47 0.00 0.00 33.84 33.63 3d4z n VAL 166 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 3d4z s MET 167 N -3.33 2.83 0.53 7.34 -2.45 -1.26 -4.87 119.30 118.09 3d4z s MET 167 Ca 0.29 -2.07 -0.18 0.00 -1.25 0.00 0.00 55.69 52.48 3d4z s MET 167 Cb 0.01 -4.06 -0.07 0.00 1.25 0.00 0.00 34.83 31.97 3d4z s MET 167 CO 0.20 -1.23 1.04 -1.25 1.05 0.00 0.00 175.02 174.83 3d4z s PRO 168 N 0.83 3.63 0.36 4.11 0.04 -1.26 -3.18 135.00 139.54 3d4z s PRO 168 Ca 0.10 1.24 -0.25 0.00 0.04 0.00 0.00 61.00 62.14 3d4z s PRO 168 Cb -0.22 -2.08 -0.13 0.00 0.04 0.00 0.00 34.50 32.11 3d4z s PRO 168 CO -0.03 -0.56 0.68 -3.47 0.04 0.00 0.00 177.00 173.67 3d4z n ASP 169 N -1.46 -0.29 -0.25 6.66 2.03 0.03 -4.65 116.55 118.62 3d4z n ASP 169 Ca 0.09 1.01 0.05 0.00 0.52 0.00 0.00 54.79 56.46 3d4z n ASP 169 Cb 0.53 -1.14 0.01 0.00 -0.72 0.00 0.00 41.12 39.79 3d4z n ASP 169 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3d4z n GLU 170 N 0.67 1.77 -0.10 -0.67 1.02 -1.26 -4.39 120.64 117.68 3d4z n GLU 170 Ca 0.12 -0.69 -0.18 0.00 -0.02 0.00 0.00 57.16 56.39 3d4z n GLU 170 Cb 0.36 -1.09 -0.09 0.00 -0.02 0.00 0.00 31.44 30.60 3d4z n GLU 170 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d4z n ALA 171 N -0.10 0.75 0.16 0.62 0.00 -1.26 -4.57 120.51 116.10 3d4z n ALA 171 Ca 0.04 -0.54 0.11 0.00 0.00 0.00 0.00 53.44 53.06 3d4z n ALA 171 Cb 0.21 -0.35 -0.05 0.00 0.00 0.00 0.00 19.45 19.27 3d4z n ALA 171 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d4z n ASN 172 N -4.46 0.55 -4.77 0.00 3.02 -1.26 -4.55 115.26 103.79 3d4z n ASN 172 Ca -0.28 0.13 -0.40 0.00 -0.03 0.00 0.00 54.58 54.00 3d4z n ASN 172 Cb 0.60 0.98 -0.03 0.00 -0.61 0.00 0.00 39.78 40.72 3d4z n ASN 172 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3d4z s SER 173 N -4.83 6.85 0.29 6.41 1.04 -1.26 -4.75 113.70 117.45 3d4z s SER 173 Ca -0.02 2.51 -0.28 0.00 0.48 0.00 0.00 55.95 58.64 3d4z s SER 173 Cb 0.12 -2.64 -0.10 0.00 0.10 0.00 0.00 66.02 63.51 3d4z s SER 173 CO 0.83 -0.46 0.94 -2.28 0.98 0.00 0.00 173.24 173.25 3d4z s HIS 174 N -1.20 3.82 0.46 5.02 2.46 -1.26 -4.20 115.29 120.39 3d4z s HIS 174 Ca 0.49 1.84 0.19 0.00 0.47 0.00 0.00 55.06 58.05 3d4z s HIS 174 Cb -0.36 -2.95 1.16 0.00 -0.13 0.00 0.00 32.58 30.30 3d4z s HIS 174 CO 0.47 0.32 1.94 0.11 -2.47 0.00 0.00 174.74 175.11 3d4z h TRP 175 N 3.58 0.34 -0.37 3.88 5.08 -0.94 0.72 115.95 128.24 3d4z h TRP 175 Ca -0.46 0.01 -0.03 0.00 1.08 0.00 0.00 58.89 59.49 3d4z h TRP 175 Cb 1.19 -0.11 -0.02 0.00 -3.00 0.00 0.00 29.16 27.23 3d4z h TRP 175 CO 0.61 0.13 0.09 0.00 -1.28 0.00 0.00 178.44 177.99 3d4z h ARG 176 N 0.29 0.55 0.00 0.12 3.08 -1.92 -0.27 114.38 116.23 3d4z h ARG 176 Ca 0.34 -0.09 -0.18 0.00 0.07 0.00 0.00 59.98 60.11 3d4z h ARG 176 Cb 0.90 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.83 3d4z h ARG 176 CO -0.08 0.51 -1.08 -0.91 -1.07 0.00 0.00 179.97 177.34 3d4z h ASN 177 N 0.54 0.00 -0.37 7.04 2.35 -1.30 -0.68 115.58 123.16 3d4z h ASN 177 Ca 0.13 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 3d4z h ASN 177 Cb 0.21 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 3d4z h ASN 177 CO -0.00 0.75 0.23 0.58 -1.65 0.00 0.00 177.43 177.33 3d4z h VAL 178 N 0.00 1.12 -0.70 2.81 2.07 -0.78 -1.27 116.25 119.50 3d4z h VAL 178 Ca -0.09 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 3d4z h VAL 178 Cb 1.66 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 3d4z h VAL 178 CO 0.08 0.12 0.25 0.25 0.02 0.00 0.00 177.57 178.29 3d4z h LEU 179 N 0.48 0.98 -0.13 2.57 5.85 -0.99 -1.67 115.31 122.40 3d4z h LEU 179 Ca 0.13 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3d4z h LEU 179 Cb -0.01 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 3d4z h LEU 179 CO -0.03 0.91 -0.05 0.25 -0.34 0.00 0.00 178.44 179.18 3d4z h LEU 180 N 1.00 -0.16 -0.66 2.25 5.85 -0.82 0.11 115.31 122.88 3d4z h LEU 180 Ca 0.23 0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.85 3d4z h LEU 180 Cb 0.25 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 3d4z h LEU 180 CO -0.01 -0.06 -0.50 0.06 -0.34 0.00 0.00 178.44 177.58 3d4z h GLN 181 N -0.02 0.43 -0.41 1.25 -0.00 -1.15 0.50 115.11 115.70 3d4z h GLN 181 Ca 0.07 -0.25 -0.01 0.00 -0.00 0.00 0.00 58.65 58.46 3d4z h GLN 181 Cb 0.13 0.02 -0.02 0.00 -0.00 0.00 0.00 27.48 27.61 3d4z h GLN 181 CO -0.15 0.83 0.24 1.25 -0.00 0.00 0.00 178.83 181.00 3d4z h LEU 182 N 0.34 0.51 -0.90 0.06 5.85 -0.99 -1.51 115.31 118.67 3d4z h LEU 182 Ca 0.01 -0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.58 3d4z h LEU 182 Cb 1.00 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.89 3d4z h LEU 182 CO 0.09 0.43 -0.06 0.74 -0.34 0.00 0.00 178.44 179.30 3d4z h THR 183 N 0.54 1.25 -0.24 1.05 2.02 -0.44 0.41 112.91 117.50 3d4z h THR 183 Ca 0.15 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.25 3d4z h THR 183 Cb 0.03 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3d4z h THR 183 CO -0.03 0.37 0.11 -0.08 0.37 0.00 0.00 175.52 176.26 3d4z h GLU 184 N 0.69 0.34 -0.26 6.66 4.57 -0.53 0.15 114.58 126.21 3d4z h GLU 184 Ca 0.13 -0.05 -0.09 0.00 -1.18 0.00 0.00 59.36 58.16 3d4z h GLU 184 Cb 0.51 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.04 3d4z h GLU 184 CO 0.03 0.36 -0.20 0.78 -1.18 0.00 0.00 179.01 178.79 3d4z h GLY 185 N 0.24 0.64 2.00 1.92 0.00 -1.22 -2.70 103.07 103.96 3d4z h GLY 185 Ca 0.08 -0.63 -0.13 0.00 0.00 0.00 0.00 47.33 46.65 3d4z h GLY 185 CO -0.01 0.57 -0.61 1.46 0.00 0.00 0.00 176.54 177.95 3d4z h GLN 186 N 0.31 0.00 -0.41 4.80 4.20 -0.23 -0.79 115.11 122.99 3d4z h GLN 186 Ca 0.05 -0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 3d4z h GLN 186 Cb 0.75 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 3d4z h GLN 186 CO 0.05 0.62 -0.04 1.15 -0.67 0.00 0.00 178.83 179.94 3d4z h THR 187 N 0.00 1.27 -0.23 -0.54 2.02 -0.71 0.56 112.91 115.28 3d4z h THR 187 Ca -0.01 -1.10 0.03 0.00 0.77 0.00 0.00 66.41 66.11 3d4z h THR 187 Cb 1.09 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.61 3d4z h THR 187 CO 0.08 0.37 0.03 -0.25 0.37 0.00 0.00 175.52 176.12 3d4z h TRP 188 N 0.58 0.05 -0.75 3.16 7.01 -1.20 -1.70 115.95 123.11 3d4z h TRP 188 Ca 0.11 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 3d4z h TRP 188 Cb 0.54 0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 27.58 3d4z h TRP 188 CO 0.04 0.00 0.43 -0.07 -2.79 0.00 0.00 178.44 176.06 3d4z h LEU 189 N 0.12 0.92 -0.58 0.65 3.38 -0.84 0.09 115.31 119.05 3d4z h LEU 189 Ca 0.11 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 3d4z h LEU 189 Cb 0.12 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3d4z h LEU 189 CO -0.15 0.73 0.08 0.50 0.09 0.00 0.00 178.44 179.68 3d4z h LYS 190 N 1.03 0.97 -0.29 1.13 3.64 -0.66 0.16 116.57 122.55 3d4z h LYS 190 Ca 0.27 -0.27 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 3d4z h LYS 190 Cb -0.01 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3d4z h LYS 190 CO -0.05 0.93 -0.16 0.37 -2.27 0.00 0.00 179.45 178.27 3d4z h GLN 191 N 0.86 0.61 0.00 1.90 4.15 -0.88 -2.62 115.11 119.13 3d4z h GLN 191 Ca 0.17 -0.28 -0.25 0.00 0.77 0.00 0.00 58.65 59.07 3d4z h GLN 191 Cb 0.44 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.07 3d4z h GLN 191 CO 0.01 0.86 -2.19 1.19 -1.93 0.00 0.00 178.83 176.77 3d4z n PHE 192 N -4.40 0.00 0.13 3.99 3.72 -0.02 -4.58 117.46 116.30 3d4z n PHE 192 Ca -0.03 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.38 3d4z n PHE 192 Cb 0.38 -0.80 0.00 0.00 -0.94 0.00 0.00 39.48 38.12 3d4z n PHE 192 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3d4z n MET 193 N -2.56 1.73 -3.73 -1.08 2.81 0.38 -5.00 117.12 109.68 3d4z n MET 193 Ca -0.23 -0.45 -0.26 0.00 -1.81 0.00 0.00 57.70 54.95 3d4z n MET 193 Cb 0.95 -0.91 0.06 0.00 -0.71 0.00 0.00 33.22 32.61 3d4z n MET 193 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3d4z n ASN 194 N -0.26 -5.67 -4.03 7.83 5.15 -0.09 -4.89 115.26 113.30 3d4z n ASN 194 Ca 0.01 -0.64 -0.11 0.00 -0.60 0.00 0.00 54.58 53.24 3d4z n ASN 194 Cb 0.06 -4.56 -0.11 0.00 -0.53 0.00 0.00 39.78 34.64 3d4z n ASN 194 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3d4z s VAL 195 N -3.31 0.34 -0.24 3.44 -7.23 -1.18 -4.98 120.40 107.23 3d4z s VAL 195 Ca 0.61 -1.08 -0.01 0.00 -1.81 0.00 0.00 61.98 59.69 3d4z s VAL 195 Cb -0.29 -0.55 0.07 0.00 0.56 0.00 0.00 36.38 36.18 3d4z s VAL 195 CO 0.77 -0.49 0.01 -0.89 -0.31 0.00 0.00 175.10 174.19 3d4z s THR 196 N -1.65 1.09 0.46 5.32 2.01 -1.26 -3.31 115.64 118.30 3d4z s THR 196 Ca -0.11 -1.08 -0.24 0.00 0.31 0.00 0.00 61.69 60.57 3d4z s THR 196 Cb -0.08 -1.55 -0.08 0.00 0.01 0.00 0.00 72.50 70.80 3d4z s THR 196 CO -0.01 -0.27 1.29 -2.65 -0.69 0.00 0.00 174.62 172.29 3d4z n PRO 197 N 4.82 1.86 0.00 4.92 -0.02 -1.26 -4.92 135.00 140.40 3d4z n PRO 197 Ca -0.08 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3d4z n PRO 197 Cb 0.45 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3d4z n PRO 197 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3d4z n THR 198 N -0.49 0.34 -5.11 3.45 -2.24 -1.26 -4.76 114.28 104.22 3d4z n THR 198 Ca 0.08 -0.62 -0.32 0.00 -2.27 0.00 0.00 64.05 60.92 3d4z n THR 198 Cb 0.41 0.89 -0.16 0.00 -2.10 0.00 0.00 70.33 69.38 3d4z n THR 198 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d4z s ALA 199 N -0.34 2.31 0.04 6.98 0.00 -1.26 -0.50 121.76 128.99 3d4z s ALA 199 Ca 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 51.00 3d4z s ALA 199 Cb 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 3d4z s ALA 199 CO 0.00 0.34 0.05 0.45 0.00 0.00 0.00 175.76 176.60 3d4z s SER 200 N 0.11 5.43 -0.22 0.00 0.15 -0.26 -0.74 113.70 118.17 3d4z s SER 200 Ca -0.10 0.02 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 3d4z s SER 200 Cb -0.16 -1.47 0.06 0.00 -1.71 0.00 0.00 66.02 62.75 3d4z s SER 200 CO 0.06 0.23 -0.01 0.86 1.20 0.00 0.00 173.24 175.58 3d4z s TRP 201 N -1.25 1.83 -0.56 3.44 -0.11 -1.26 -0.74 118.94 120.29 3d4z s TRP 201 Ca 0.25 -1.40 0.04 0.00 1.22 0.00 0.00 56.10 56.21 3d4z s TRP 201 Cb -0.12 -1.37 0.17 0.00 -1.50 0.00 0.00 33.47 30.65 3d4z s TRP 201 CO 0.16 -0.71 0.41 0.00 -4.62 0.00 0.00 176.95 172.19 3d4z s ALA 202 N 1.59 2.64 -0.76 5.86 0.00 -0.56 -4.85 121.76 125.68 3d4z s ALA 202 Ca -0.03 -3.15 0.25 0.00 0.00 0.00 0.00 51.96 49.03 3d4z s ALA 202 Cb -0.18 -1.89 0.43 0.00 0.00 0.00 0.00 23.12 21.48 3d4z s ALA 202 CO -0.07 -2.04 1.37 0.44 0.00 0.00 0.00 175.76 175.46 3d4z n ILE 203 N 2.45 0.23 0.00 0.00 -5.35 -1.26 -3.14 119.36 112.30 3d4z n ILE 203 Ca 0.24 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 3d4z n ILE 203 Cb 0.41 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.28 3d4z n ILE 203 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 3d4z n ASP 204 N -1.90 1.80 -4.68 7.28 2.03 -1.26 -4.38 116.55 115.44 3d4z n ASP 204 Ca 0.04 -0.22 -0.38 0.00 0.52 0.00 0.00 54.79 54.76 3d4z n ASP 204 Cb 0.40 0.79 0.06 0.00 -0.72 0.00 0.00 41.12 41.65 3d4z n ASP 204 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3d4z n PRO 205 N -0.97 1.11 -2.64 -0.67 -0.02 -1.26 -4.81 135.00 125.73 3d4z n PRO 205 Ca 0.00 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 3d4z n PRO 205 Cb 0.00 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.12 3d4z n PRO 205 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3d4z n PHE 206 N -1.65 3.63 0.00 6.00 3.72 -1.26 -4.36 117.46 123.53 3d4z n PHE 206 Ca 0.14 -3.00 0.00 0.00 -0.05 0.00 0.00 57.45 54.54 3d4z n PHE 206 Cb 0.47 -1.95 0.00 0.00 -0.94 0.00 0.00 39.48 37.06 3d4z n PHE 206 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d4z n GLY 207 N 3.05 2.42 3.10 1.37 0.00 -1.07 -4.56 105.19 109.51 3d4z n GLY 207 Ca 0.37 -1.88 -0.19 0.00 0.00 0.00 0.00 46.02 44.32 3d4z n GLY 207 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3d4z s HIS 208 N -2.82 1.04 -0.03 1.61 3.76 -1.09 -4.59 115.29 113.17 3d4z s HIS 208 Ca 0.00 -0.32 0.04 0.00 -0.15 0.00 0.00 55.06 54.63 3d4z s HIS 208 Cb 0.00 -0.63 -0.03 0.00 1.11 0.00 0.00 32.58 33.04 3d4z s HIS 208 CO 0.00 0.01 -0.14 0.45 -0.85 0.00 0.00 174.74 174.20 3d4z s SER 209 N -0.96 4.03 0.00 1.40 0.15 -1.26 -1.02 113.70 116.05 3d4z s SER 209 Ca 0.00 -0.23 0.16 0.00 0.70 0.00 0.00 55.95 56.58 3d4z s SER 209 Cb -0.07 -0.82 0.76 0.00 -1.71 0.00 0.00 66.02 64.18 3d4z s SER 209 CO 0.01 0.32 1.45 -0.81 1.20 0.00 0.00 173.24 175.41 3d4z n PRO 210 N 2.11 0.18 0.27 5.44 -0.04 -1.26 -1.81 135.00 139.88 3d4z n PRO 210 Ca -0.17 0.16 0.10 0.00 -0.04 0.00 0.00 63.50 63.55 3d4z n PRO 210 Cb 0.52 -1.50 0.71 0.00 -0.04 0.00 0.00 33.50 33.20 3d4z n PRO 210 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 3d4z h THR 211 N 0.00 0.81 0.40 0.52 2.02 -1.94 -2.12 112.91 112.60 3d4z h THR 211 Ca 0.00 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.95 3d4z h THR 211 Cb 0.17 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3d4z h THR 211 CO 0.00 0.06 -0.19 0.24 0.37 0.00 0.00 175.52 175.99 3d4z h MET 212 N 0.00 -0.52 -0.17 6.66 2.86 -1.77 -1.19 114.93 120.79 3d4z h MET 212 Ca -0.00 0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3d4z h MET 212 Cb 0.12 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 3d4z h MET 212 CO 0.01 -0.21 0.12 -1.00 1.06 0.00 0.00 176.91 176.89 3d4z h PRO 213 N -0.90 0.08 0.10 -0.22 0.13 -1.73 0.17 132.00 129.63 3d4z h PRO 213 Ca -0.06 -0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.08 3d4z h PRO 213 Cb 0.55 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.65 3d4z h PRO 213 CO 0.09 0.05 -0.15 -0.92 -0.23 0.00 0.00 178.00 176.84 3d4z h TYR 214 N 0.08 -0.39 -0.29 1.56 3.20 -1.13 0.19 116.97 120.20 3d4z h TYR 214 Ca 0.08 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.83 3d4z h TYR 214 Cb 0.21 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 3d4z h TYR 214 CO -0.00 -0.22 -0.29 0.82 -1.64 0.00 0.00 178.16 176.83 3d4z h ILE 215 N -0.30 1.30 -0.46 1.81 2.04 -0.70 -3.06 117.51 118.13 3d4z h ILE 215 Ca 0.02 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 3d4z h ILE 215 Cb 0.31 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 3d4z h ILE 215 CO -0.07 0.47 0.23 -0.07 0.00 0.00 0.00 178.15 178.71 3d4z h LEU 216 N 0.45 0.60 -1.52 1.44 3.38 -0.55 -2.17 115.31 116.94 3d4z h LEU 216 Ca 0.05 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3d4z h LEU 216 Cb 0.86 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3d4z h LEU 216 CO 0.07 0.54 -0.25 -0.61 0.09 0.00 0.00 178.44 178.29 3d4z h GLN 217 N 0.61 0.00 -0.06 1.13 -0.00 -0.65 0.37 115.11 116.51 3d4z h GLN 217 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.81 3d4z h GLN 217 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.57 3d4z h GLN 217 CO -0.02 0.25 0.00 1.63 0.00 0.00 0.00 178.83 180.69 3d4z n LYS 218 N -4.13 1.33 -0.16 1.69 5.02 -0.99 -3.58 118.16 117.34 3d4z n LYS 218 Ca -0.02 -0.49 0.09 0.00 -2.02 0.00 0.00 58.31 55.86 3d4z n LYS 218 Cb 0.31 -1.38 0.14 0.00 -0.02 0.00 0.00 35.03 34.08 3d4z n LYS 218 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3d4z n SER 219 N -0.32 2.14 0.00 4.39 7.64 -0.01 -1.72 113.62 125.74 3d4z n SER 219 Ca 0.17 -3.10 0.00 0.00 1.01 0.00 0.00 58.87 56.95 3d4z n SER 219 Cb 0.20 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 3d4z n SER 219 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d4z n GLY 220 N -1.31 0.88 3.79 0.23 0.00 -1.09 -4.89 105.19 102.80 3d4z n GLY 220 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 3d4z n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d4z s PHE 221 N -2.60 2.87 0.00 1.61 0.40 -0.46 -4.80 117.98 114.99 3d4z s PHE 221 Ca 0.00 1.53 0.00 0.00 -0.60 0.00 0.00 56.93 57.86 3d4z s PHE 221 Cb 0.00 -3.07 0.00 0.00 0.51 0.00 0.00 43.02 40.46 3d4z s PHE 221 CO 0.00 -1.30 0.00 1.63 0.70 0.00 0.00 175.22 176.25 3d4z n LYS 222 N -2.06 1.94 -3.71 0.44 4.76 0.35 -4.59 118.16 115.29 3d4z n LYS 222 Ca 0.09 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.39 3d4z n LYS 222 Cb 0.52 -0.84 -0.08 0.00 -1.84 0.00 0.00 35.03 32.79 3d4z n LYS 222 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3d4z s ASN 223 N -1.64 -0.27 0.06 4.39 0.01 -1.03 -3.81 114.94 112.64 3d4z s ASN 223 Ca 0.00 0.16 -0.10 0.00 -0.71 0.00 0.00 52.86 52.21 3d4z s ASN 223 Cb 0.00 0.36 0.01 0.00 0.41 0.00 0.00 41.25 42.03 3d4z s ASN 223 CO 0.00 -0.51 0.22 0.00 -1.51 0.00 0.00 177.10 175.30 3d4z s MET 224 N -1.51 0.78 -0.02 -0.60 0.23 -0.12 -1.10 119.30 116.97 3d4z s MET 224 Ca -0.12 -0.71 0.04 0.00 -1.03 0.00 0.00 55.69 53.87 3d4z s MET 224 Cb -0.04 0.32 -0.01 0.00 -1.53 0.00 0.00 34.83 33.58 3d4z s MET 224 CO 0.04 -0.24 -0.14 -1.17 -2.03 0.00 0.00 175.02 171.48 3d4z s LEU 225 N -2.35 1.96 0.19 0.18 0.20 0.08 -0.54 118.68 118.40 3d4z s LEU 225 Ca -0.02 -0.26 0.03 0.00 0.69 0.00 0.00 54.13 54.58 3d4z s LEU 225 Cb 0.01 -0.74 -0.05 0.00 -0.43 0.00 0.00 46.19 44.98 3d4z s LEU 225 CO -0.06 0.15 -0.04 0.27 -0.29 0.00 0.00 176.35 176.38 3d4z s ILE 226 N -0.16 1.00 0.03 6.68 -4.36 -0.32 -1.50 121.20 122.58 3d4z s ILE 226 Ca 0.02 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.38 3d4z s ILE 226 Cb -0.07 -2.13 0.00 0.00 1.25 0.00 0.00 42.46 41.51 3d4z s ILE 226 CO 0.00 -0.50 0.00 1.67 0.24 0.00 0.00 174.94 176.35 3d4z n GLN 227 N -0.31 0.00 -2.82 0.37 -0.06 -1.19 -1.27 117.38 112.10 3d4z n GLN 227 Ca -0.07 0.00 -0.43 0.00 -2.00 0.00 0.00 57.00 54.50 3d4z n GLN 227 Cb 0.63 -0.06 -0.02 0.00 -4.06 0.00 0.00 30.24 26.73 3d4z n GLN 227 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 3d4z s ARG 228 N -2.00 3.77 0.19 3.69 0.52 -1.26 -4.76 118.95 119.10 3d4z s ARG 228 Ca 0.00 -1.87 0.11 0.00 -0.52 0.00 0.00 55.73 53.44 3d4z s ARG 228 Cb 0.00 -5.11 -0.04 0.00 0.52 0.00 0.00 34.95 30.32 3d4z s ARG 228 CO 0.00 -1.91 -0.22 0.95 0.02 0.00 0.00 175.30 174.14 3d4z s THR 229 N 3.02 2.21 0.18 0.02 -4.23 -1.26 -2.58 115.64 113.00 3d4z s THR 229 Ca 0.40 -2.02 -0.33 0.00 -1.18 0.00 0.00 61.69 58.57 3d4z s THR 229 Cb -0.02 -2.05 -0.15 0.00 1.34 0.00 0.00 72.50 71.61 3d4z s THR 229 CO -0.05 -0.19 1.22 1.57 -0.54 0.00 0.00 174.62 176.63 3d4z n HIS 230 N 0.22 1.49 0.05 3.99 -0.00 -1.26 -4.73 115.22 114.98 3d4z n HIS 230 Ca -0.12 0.62 0.16 0.00 0.46 0.00 0.00 57.72 58.84 3d4z n HIS 230 Cb 0.56 -2.32 0.66 0.00 -0.12 0.00 0.00 29.99 28.77 3d4z n HIS 230 CO 0.00 0.00 0.00 0.10 0.46 0.00 0.00 176.34 176.90 3d4z h TYR 231 N 3.59 0.05 -0.16 1.57 -0.00 -1.81 -0.13 116.97 120.08 3d4z h TYR 231 Ca -0.44 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.17 3d4z h TYR 231 Cb 1.33 -0.02 -0.01 0.00 0.00 0.00 0.00 36.73 38.03 3d4z h TYR 231 CO 0.55 0.02 -0.45 0.77 -0.00 0.00 0.00 178.16 179.05 3d4z h SER 232 N 0.05 0.43 -0.35 0.10 0.02 -1.88 -2.24 113.55 109.68 3d4z h SER 232 Ca 0.20 -0.20 -0.09 0.00 -0.84 0.00 0.00 61.79 60.85 3d4z h SER 232 Cb 0.72 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 3d4z h SER 232 CO -0.01 0.83 -0.14 0.58 -1.14 0.00 0.00 176.83 176.95 3d4z h VAL 233 N 0.33 1.28 -0.87 2.27 2.07 -1.41 -1.39 116.25 118.54 3d4z h VAL 233 Ca 0.02 -1.25 0.07 0.00 0.82 0.00 0.00 66.70 66.37 3d4z h VAL 233 Cb 0.93 1.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.98 3d4z h VAL 233 CO 0.08 0.41 0.53 0.11 0.02 0.00 0.00 177.57 178.72 3d4z h LYS 234 N 0.51 0.92 -0.36 1.57 1.57 -1.16 0.46 116.57 120.08 3d4z h LYS 234 Ca 0.08 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 3d4z h LYS 234 Cb 0.67 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 3d4z h LYS 234 CO 0.05 0.61 0.01 -0.22 -0.57 0.00 0.00 179.45 179.33 3d4z h LYS 235 N 0.95 0.63 -0.34 3.15 3.64 -1.25 0.18 116.57 123.53 3d4z h LYS 235 Ca 0.39 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 3d4z h LYS 235 Cb 0.23 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3d4z h LYS 235 CO -0.19 0.73 0.06 1.49 -2.27 0.00 0.00 179.45 179.26 3d4z h GLU 236 N 0.45 0.56 -0.23 1.90 4.57 -0.84 -1.49 114.58 119.49 3d4z h GLU 236 Ca 0.10 -0.15 -0.16 0.00 -1.18 0.00 0.00 59.36 57.98 3d4z h GLU 236 Cb 0.44 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 3d4z h GLU 236 CO 0.02 0.64 -0.50 -0.07 -1.18 0.00 0.00 179.01 177.92 3d4z h LEU 237 N 0.39 0.71 -1.21 1.64 3.38 -0.87 -2.92 115.31 116.44 3d4z h LEU 237 Ca 0.10 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 3d4z h LEU 237 Cb 0.35 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3d4z h LEU 237 CO 0.01 1.08 0.40 0.00 0.09 0.00 0.00 178.44 180.02 3d4z h ALA 238 N 0.94 1.40 0.00 1.53 0.00 -0.39 0.55 119.26 123.28 3d4z h ALA 238 Ca 0.02 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3d4z h ALA 238 Cb 1.05 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3d4z h ALA 238 CO 0.10 0.50 -0.13 1.96 0.00 0.00 0.00 179.25 181.69 3d4z h GLN 239 N 0.95 0.00 -0.37 0.00 4.20 -1.08 -1.71 115.11 117.10 3d4z h GLN 239 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 3d4z h GLN 239 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 3d4z h GLN 239 CO -0.04 0.13 0.00 1.04 -0.67 0.00 0.00 178.83 179.29 3d4z n GLN 240 N -4.31 2.42 -3.84 1.46 1.13 -0.75 -4.95 117.38 108.53 3d4z n GLN 240 Ca -0.03 -2.22 -0.25 0.00 -1.94 0.00 0.00 57.00 52.56 3d4z n GLN 240 Cb 0.20 -1.48 0.01 0.00 0.11 0.00 0.00 30.24 29.08 3d4z n GLN 240 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3d4z n ARG 241 N 1.39 -4.41 -0.72 -1.09 1.74 -0.44 -4.89 116.66 108.23 3d4z n ARG 241 Ca 0.18 0.54 -0.02 0.00 -0.77 0.00 0.00 57.85 57.78 3d4z n ARG 241 Cb 0.58 -5.02 0.21 0.00 -1.02 0.00 0.00 32.46 27.20 3d4z n ARG 241 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3d4z n GLN 242 N -4.39 2.00 0.13 5.56 6.02 0.05 -4.61 117.38 122.15 3d4z n GLN 242 Ca -0.23 -3.11 0.13 0.00 -0.01 0.00 0.00 57.00 53.78 3d4z n GLN 242 Cb 0.65 -1.81 0.33 0.00 1.02 0.00 0.00 30.24 30.42 3d4z n GLN 242 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3d4z h LEU 243 N 1.10 0.00 -8.61 1.08 3.38 -1.82 -3.42 115.31 107.03 3d4z h LEU 243 Ca 0.18 -0.02 -0.66 0.00 0.09 0.00 0.00 57.88 57.47 3d4z h LEU 243 Cb 1.60 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 42.08 3d4z h LEU 243 CO 0.35 0.01 -0.77 -1.61 0.09 0.00 0.00 178.44 176.50 3d4z s GLU 244 N -3.14 3.35 0.13 1.13 2.02 -1.26 -0.18 118.70 120.76 3d4z s GLU 244 Ca 0.09 -0.70 -0.16 0.00 0.02 0.00 0.00 54.97 54.23 3d4z s GLU 244 Cb 0.11 -2.61 0.03 0.00 0.10 0.00 0.00 34.13 31.76 3d4z s GLU 244 CO 0.63 0.22 0.40 -0.59 0.02 0.00 0.00 175.26 175.94 3d4z s PHE 245 N 0.32 -0.16 -0.53 1.61 -0.12 -0.33 -4.21 117.98 114.56 3d4z s PHE 245 Ca -0.11 -0.16 -0.21 0.00 -0.05 0.00 0.00 56.93 56.39 3d4z s PHE 245 Cb -0.16 0.25 0.05 0.00 -0.63 0.00 0.00 43.02 42.54 3d4z s PHE 245 CO 0.06 -0.72 0.77 -0.51 -0.05 0.00 0.00 175.22 174.76 3d4z s LEU 246 N -2.82 4.60 -0.47 -1.99 1.43 0.26 -0.42 118.68 119.26 3d4z s LEU 246 Ca 0.04 -0.69 -0.23 0.00 -1.03 0.00 0.00 54.13 52.23 3d4z s LEU 246 Cb 0.02 -2.60 0.03 0.00 0.03 0.00 0.00 46.19 43.66 3d4z s LEU 246 CO -0.11 -1.05 0.81 0.86 0.23 0.00 0.00 176.35 177.10 3d4z s TRP 247 N 3.21 2.96 0.30 0.29 -0.11 -0.38 -1.37 118.94 123.84 3d4z s TRP 247 Ca 0.22 0.11 0.08 0.00 1.22 0.00 0.00 56.10 57.73 3d4z s TRP 247 Cb -0.16 -3.73 -0.04 0.00 -1.50 0.00 0.00 33.47 28.04 3d4z s TRP 247 CO 0.15 -1.05 0.18 -0.98 -4.62 0.00 0.00 176.95 170.63 3d4z s ARG 248 N 3.38 2.64 0.64 5.86 1.70 -0.22 -1.37 118.95 131.58 3d4z s ARG 248 Ca 0.30 -1.30 -0.16 0.00 -0.47 0.00 0.00 55.73 54.10 3d4z s ARG 248 Cb -0.12 -2.39 -0.01 0.00 -0.57 0.00 0.00 34.95 31.86 3d4z s ARG 248 CO 0.22 0.24 1.15 -0.65 -1.08 0.00 0.00 175.30 175.17 3d4z s GLN 249 N -3.86 2.79 0.54 3.89 -1.52 -1.26 -4.37 119.66 115.87 3d4z s GLN 249 Ca 0.36 1.56 0.29 0.00 -1.95 0.00 0.00 55.36 55.62 3d4z s GLN 249 Cb -0.06 -1.93 1.54 0.00 -0.22 0.00 0.00 33.01 32.34 3d4z s GLN 249 CO 0.24 -1.29 2.10 -0.84 -0.25 0.00 0.00 175.29 175.26 3d4z h ILE 250 N 0.29 0.49 -0.06 1.08 3.07 -1.94 -1.43 117.51 119.01 3d4z h ILE 250 Ca -0.48 -0.45 0.00 0.00 1.55 0.00 0.00 64.86 65.48 3d4z h ILE 250 Cb 1.27 1.31 0.00 0.00 -0.27 0.00 0.00 36.82 39.12 3d4z h ILE 250 CO 0.54 0.09 0.00 -2.67 -1.05 0.00 0.00 178.15 175.06 3d4z n TRP 251 N -3.58 0.05 -2.93 0.16 2.14 -1.26 -4.63 117.44 107.38 3d4z n TRP 251 Ca -0.02 -0.02 -0.43 0.00 2.07 0.00 0.00 57.50 59.10 3d4z n TRP 251 Cb 0.22 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.68 3d4z n TRP 251 CO 0.00 0.00 0.00 0.34 2.07 0.00 0.00 177.69 180.10 3d4z s ASP 252 N -1.94 6.21 0.19 -0.67 2.15 -0.54 -4.71 116.67 117.36 3d4z s ASP 252 Ca 0.32 -0.93 -0.02 0.00 0.43 0.00 0.00 52.55 52.36 3d4z s ASP 252 Cb 0.20 -2.39 0.10 0.00 -0.30 0.00 0.00 42.92 40.54 3d4z s ASP 252 CO 0.31 -1.29 1.47 -1.13 -0.17 0.00 0.00 175.17 174.37 3d4z h ASN 253 N 9.39 0.52 0.65 -0.34 -1.24 -1.88 -3.32 115.58 119.37 3d4z h ASN 253 Ca -0.28 -0.31 -0.27 0.00 0.71 0.00 0.00 56.30 56.15 3d4z h ASN 253 Cb 1.08 -0.15 -0.04 0.00 0.73 0.00 0.00 38.32 39.93 3d4z h ASN 253 CO 1.13 1.03 -1.49 0.50 -1.29 0.00 0.00 177.43 177.31 3d4z h LYS 254 N 0.33 0.00 0.00 6.67 3.64 -1.98 -3.43 116.57 121.79 3d4z h LYS 254 Ca -0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3d4z h LYS 254 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3d4z h LYS 254 CO 0.11 0.66 0.00 0.41 -2.27 0.00 0.00 179.45 178.36 3d4z n GLY 255 N 1.49 0.97 0.08 5.01 0.00 -1.25 -4.98 105.19 106.51 3d4z n GLY 255 Ca -0.12 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.00 3d4z n GLY 255 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d4z n ASP 256 N 0.04 0.49 -0.05 1.61 8.00 -1.26 -1.34 116.55 124.04 3d4z n ASP 256 Ca 0.00 0.59 0.14 0.00 0.71 0.00 0.00 54.79 56.24 3d4z n ASP 256 Cb 0.00 -0.71 0.66 0.00 -0.02 0.00 0.00 41.12 41.05 3d4z n ASP 256 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3d4z n THR 257 N -2.01 0.00 -1.99 -3.53 -2.24 -1.26 -4.97 114.28 98.28 3d4z n THR 257 Ca 0.04 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.41 3d4z n THR 257 Cb 0.28 -0.29 0.01 0.00 -2.10 0.00 0.00 70.33 68.23 3d4z n THR 257 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d4z s ALA 258 N -2.59 3.01 -0.04 6.98 0.00 -0.45 -4.69 121.76 123.98 3d4z s ALA 258 Ca 0.26 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.43 3d4z s ALA 258 Cb 0.20 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.85 3d4z s ALA 258 CO 0.49 -1.01 -0.02 -1.17 0.00 0.00 0.00 175.76 174.05 3d4z s LEU 259 N -3.03 1.15 0.16 0.00 2.96 -0.47 -4.88 118.68 114.57 3d4z s LEU 259 Ca 0.65 -0.08 -0.31 0.00 -0.22 0.00 0.00 54.13 54.16 3d4z s LEU 259 Cb -0.37 -0.35 -0.11 0.00 0.50 0.00 0.00 46.19 45.86 3d4z s LEU 259 CO 0.45 -0.09 1.73 0.12 -1.32 0.00 0.00 176.35 177.24 3d4z s PHE 260 N 1.11 2.62 -0.04 5.38 5.36 -1.25 -1.25 117.98 129.92 3d4z s PHE 260 Ca -0.08 0.25 0.04 0.00 -0.96 0.00 0.00 56.93 56.18 3d4z s PHE 260 Cb -0.14 -4.11 -0.00 0.00 -0.34 0.00 0.00 43.02 38.43 3d4z s PHE 260 CO -0.01 -4.35 -0.16 0.99 -1.46 0.00 0.00 175.22 170.23 3d4z s THR 261 N 1.84 1.35 -0.24 0.12 2.01 0.44 -0.94 115.64 120.22 3d4z s THR 261 Ca 0.76 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 62.03 3d4z s THR 261 Cb -0.47 -1.16 -0.02 0.00 0.01 0.00 0.00 72.50 70.86 3d4z s THR 261 CO 0.33 0.39 0.02 -2.28 -0.69 0.00 0.00 174.62 172.39 3d4z s HIS 262 N 0.03 3.03 -0.22 4.92 2.46 0.30 -1.19 115.29 124.62 3d4z s HIS 262 Ca -0.03 -0.69 -0.14 0.00 0.47 0.00 0.00 55.06 54.67 3d4z s HIS 262 Cb -0.11 -2.18 -0.04 0.00 -0.13 0.00 0.00 32.58 30.12 3d4z s HIS 262 CO 0.02 -0.46 0.34 1.41 -2.47 0.00 0.00 174.74 173.58 3d4z s MET 263 N 1.55 4.12 0.47 2.88 1.75 0.75 -1.17 119.30 129.64 3d4z s MET 263 Ca 0.06 0.06 -0.22 0.00 -1.25 0.00 0.00 55.69 54.34 3d4z s MET 263 Cb -0.15 -3.56 -0.07 0.00 2.84 0.00 0.00 34.83 33.89 3d4z s MET 263 CO 0.00 -0.07 1.12 -1.64 -0.65 0.00 0.00 175.02 173.79 3d4z s MET 264 N 1.41 3.74 0.12 4.11 -1.94 -0.40 -4.78 119.30 121.56 3d4z s MET 264 Ca 0.15 1.63 0.24 0.00 -1.71 0.00 0.00 55.69 56.01 3d4z s MET 264 Cb -0.15 -2.29 0.28 0.00 2.01 0.00 0.00 34.83 34.68 3d4z s MET 264 CO 0.08 -0.53 1.26 -1.00 -0.01 0.00 0.00 175.02 174.81 3d4z h PRO 265 N 1.86 0.00 0.00 2.03 0.13 -1.92 -3.46 132.00 130.65 3d4z h PRO 265 Ca -0.49 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.37 3d4z h PRO 265 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 3d4z h PRO 265 CO 0.60 0.00 -0.16 1.19 -0.23 0.00 0.00 178.00 179.40 3d4z n PHE 266 N -2.15 -0.42 0.20 1.56 3.72 -1.26 -4.82 117.46 114.29 3d4z n PHE 266 Ca 0.03 -1.04 0.08 0.00 -0.05 0.00 0.00 57.45 56.47 3d4z n PHE 266 Cb 0.45 -0.17 0.33 0.00 -0.94 0.00 0.00 39.48 39.15 3d4z n PHE 266 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 3d4z h TYR 267 N 0.80 0.00 -4.04 1.38 3.20 -1.95 -3.46 116.97 112.91 3d4z h TYR 267 Ca -0.16 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.58 3d4z h TYR 267 Cb 0.55 0.00 -0.13 0.00 1.54 0.00 0.00 36.73 38.68 3d4z h TYR 267 CO 0.00 0.29 -0.43 0.45 -1.64 0.00 0.00 178.16 176.82 3d4z s SER 268 N -6.27 0.15 0.00 -2.11 0.15 -1.26 -5.01 113.70 99.34 3d4z s SER 268 Ca 0.02 -0.94 0.26 0.00 0.70 0.00 0.00 55.95 55.99 3d4z s SER 268 Cb 0.09 0.37 1.11 0.00 -1.71 0.00 0.00 66.02 65.89 3d4z s SER 268 CO 0.67 -0.81 1.77 0.00 1.20 0.00 0.00 173.24 176.06 3d4z n TYR 269 N -0.14 0.06 -1.70 3.44 0.18 -1.26 -4.49 117.16 113.24 3d4z n TYR 269 Ca -0.08 -0.03 -0.29 0.00 1.88 0.00 0.00 57.90 59.38 3d4z n TYR 269 Cb 0.63 0.00 0.12 0.00 -0.38 0.00 0.00 39.34 39.71 3d4z n TYR 269 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 3d4z s ASP 270 N -1.85 3.88 0.17 9.48 1.47 -1.26 -4.61 116.67 123.95 3d4z s ASP 270 Ca 0.37 0.85 -0.11 0.00 1.18 0.00 0.00 52.55 54.84 3d4z s ASP 270 Cb 0.20 -1.36 0.07 0.00 -0.34 0.00 0.00 42.92 41.48 3d4z s ASP 270 CO 0.31 -2.31 1.70 0.40 0.68 0.00 0.00 175.17 175.96 3d4z h ILE 271 N -1.33 1.24 -0.16 2.11 2.04 -1.88 -1.42 117.51 118.12 3d4z h ILE 271 Ca -0.48 -0.83 0.05 0.00 1.00 0.00 0.00 64.86 64.59 3d4z h ILE 271 Cb 1.33 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 3d4z h ILE 271 CO 0.62 0.31 0.25 -0.65 0.00 0.00 0.00 178.15 178.69 3d4z h PRO 272 N 0.85 0.00 -0.20 2.37 0.11 -1.88 -1.97 132.00 131.28 3d4z h PRO 272 Ca 0.19 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.27 3d4z h PRO 272 Cb 0.29 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 3d4z h PRO 272 CO -0.01 0.00 -0.04 0.72 -0.21 0.00 0.00 178.00 178.46 3d4z n HIS 273 N -3.50 0.68 -0.12 0.65 8.25 -0.58 -3.91 115.22 116.69 3d4z n HIS 273 Ca 0.01 -1.09 0.00 0.00 -0.26 0.00 0.00 57.72 56.39 3d4z n HIS 273 Cb 0.36 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 31.16 3d4z n HIS 273 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3d4z n THR 274 N -0.91 0.00 0.14 1.59 -2.24 -0.74 -4.55 114.28 107.56 3d4z n THR 274 Ca 0.22 -0.29 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 3d4z n THR 274 Cb 0.85 1.12 0.05 0.00 -2.10 0.00 0.00 70.33 70.24 3d4z n THR 274 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d4z n GLY 276 N 1.16 -2.56 0.20 0.00 0.00 -1.26 -3.47 105.19 99.26 3d4z n GLY 276 Ca 0.01 -1.27 0.14 0.00 0.00 0.00 0.00 46.02 44.91 3d4z n GLY 276 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d4z h PRO 277 N 0.00 0.00 -4.39 1.61 0.13 -1.93 -3.42 132.00 124.01 3d4z h PRO 277 Ca 0.00 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.41 3d4z h PRO 277 Cb 0.00 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 30.87 3d4z h PRO 277 CO 0.00 0.00 -0.41 0.34 -0.23 0.00 0.00 178.00 177.70 3d4z s ASP 278 N -5.21 5.81 0.47 1.44 -1.08 -1.26 -3.36 116.67 113.48 3d4z s ASP 278 Ca 0.04 -1.49 0.25 0.00 -0.52 0.00 0.00 52.55 50.83 3d4z s ASP 278 Cb 0.09 -2.05 1.15 0.00 -1.46 0.00 0.00 42.92 40.64 3d4z s ASP 278 CO 0.53 -0.59 1.94 1.55 0.52 0.00 0.00 175.17 179.11 3d4z h PRO 279 N 8.53 0.00 -0.25 4.34 0.13 -1.78 -0.23 132.00 142.73 3d4z h PRO 279 Ca -0.25 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.87 3d4z h PRO 279 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3d4z h PRO 279 CO 0.81 0.20 0.08 -0.22 -0.23 0.00 0.00 178.00 178.63 3d4z h LYS 280 N 0.00 0.36 0.03 0.86 3.64 -1.92 0.11 116.57 119.65 3d4z h LYS 280 Ca -0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 3d4z h LYS 280 Cb 0.56 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 3d4z h LYS 280 CO 0.03 0.32 -0.33 0.28 -2.27 0.00 0.00 179.45 177.48 3d4z h VAL 281 N 0.36 1.63 -0.14 2.00 2.07 -1.62 -3.37 116.25 117.18 3d4z h VAL 281 Ca 0.09 -2.36 -0.02 0.00 0.82 0.00 0.00 66.70 65.23 3d4z h VAL 281 Cb 0.12 3.21 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 3d4z h VAL 281 CO -0.01 0.60 0.01 0.00 0.02 0.00 0.00 177.57 178.20 3d4z n GLN 284 N -4.19 0.16 -0.22 0.00 6.02 -0.61 -2.15 117.38 116.40 3d4z n GLN 284 Ca -0.03 0.18 0.08 0.00 -0.01 0.00 0.00 57.00 57.22 3d4z n GLN 284 Cb 0.18 -1.50 0.18 0.00 1.02 0.00 0.00 30.24 30.12 3d4z n GLN 284 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3d4z n PHE 285 N -1.28 0.41 -3.49 1.08 3.72 -0.00 -4.11 117.46 113.79 3d4z n PHE 285 Ca 0.05 -0.87 -0.42 0.00 -0.05 0.00 0.00 57.45 56.16 3d4z n PHE 285 Cb 0.09 -0.20 -0.06 0.00 -0.94 0.00 0.00 39.48 38.37 3d4z n PHE 285 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3d4z s ASP 286 N -2.19 6.05 0.00 4.37 -1.08 -0.91 -4.95 116.67 117.96 3d4z s ASP 286 Ca 0.32 -2.55 0.23 0.00 -0.52 0.00 0.00 52.55 50.04 3d4z s ASP 286 Cb 0.27 -2.06 1.36 0.00 -1.46 0.00 0.00 42.92 41.02 3d4z s ASP 286 CO 0.06 -0.55 1.76 0.49 0.52 0.00 0.00 175.17 177.45 3d4z n PHE 287 N 4.06 0.00 1.51 -5.34 3.72 -1.26 -1.59 117.46 118.56 3d4z n PHE 287 Ca 0.06 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.61 3d4z n PHE 287 Cb 0.42 -0.04 0.76 0.00 -0.94 0.00 0.00 39.48 39.68 3d4z n PHE 287 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3d4z n LYS 288 N -1.04 0.56 -1.03 -1.08 4.81 -1.26 -4.11 118.16 115.01 3d4z n LYS 288 Ca 0.17 -0.05 -0.19 0.00 -0.87 0.00 0.00 58.31 57.37 3d4z n LYS 288 Cb 0.10 -1.50 0.16 0.00 0.02 0.00 0.00 35.03 33.81 3d4z n LYS 288 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 3d4z n ARG 289 N -1.18 2.20 0.00 1.64 1.74 -0.62 -4.46 116.66 115.99 3d4z n ARG 289 Ca 0.16 -2.57 0.12 0.00 -0.77 0.00 0.00 57.85 54.78 3d4z n ARG 289 Cb 0.23 -2.01 0.11 0.00 -1.02 0.00 0.00 32.46 29.77 3d4z n ARG 289 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3d4z n MET 290 N -0.82 1.01 0.00 5.56 2.81 -1.26 -4.34 117.12 120.08 3d4z n MET 290 Ca 0.49 -0.77 0.00 0.00 -1.81 0.00 0.00 57.70 55.61 3d4z n MET 290 Cb 1.48 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 32.50 3d4z n MET 290 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d4z n GLY 291 N 1.40 4.12 0.19 3.03 0.00 -1.24 -4.98 105.19 107.72 3d4z n GLY 291 Ca 0.10 -0.77 0.14 0.00 0.00 0.00 0.00 46.02 45.48 3d4z n GLY 291 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d4z h SER 292 N 0.91 0.00 -0.47 1.61 4.64 -1.89 -1.90 113.55 116.44 3d4z h SER 292 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d4z h SER 292 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3d4z h SER 292 CO 0.00 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.45 3d4z n PHE 293 N -2.50 0.61 -2.19 4.77 3.72 -1.26 -4.95 117.46 115.67 3d4z n PHE 293 Ca 0.00 -0.31 -0.15 0.00 -0.05 0.00 0.00 57.45 56.95 3d4z n PHE 293 Cb 0.16 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.68 3d4z n PHE 293 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d4z n GLY 294 N 1.56 -0.05 3.37 1.37 0.00 -0.72 -5.01 105.19 105.71 3d4z n GLY 294 Ca 0.21 -0.28 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 3d4z n GLY 294 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d4z s LEU 295 N -4.10 2.48 0.32 0.99 1.43 -1.26 -5.07 118.68 113.47 3d4z s LEU 295 Ca 0.00 -0.92 -0.07 0.00 -1.03 0.00 0.00 54.13 52.12 3d4z s LEU 295 Cb 0.00 -0.89 0.01 0.00 0.03 0.00 0.00 46.19 45.34 3d4z s LEU 295 CO 0.00 -0.03 0.50 -0.94 0.23 0.00 0.00 176.35 176.11 3d4z s SER 296 N -2.91 0.54 -0.31 2.29 1.04 -1.26 -3.66 113.70 109.43 3d4z s SER 296 Ca 0.20 -1.31 -0.12 0.00 0.48 0.00 0.00 55.95 55.20 3d4z s SER 296 Cb -0.05 0.66 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 3d4z s SER 296 CO 0.08 -1.29 0.21 0.00 0.98 0.00 0.00 173.24 173.22 3d4z h PRO 298 N 8.43 0.00 -0.00 0.00 0.13 -1.98 -1.23 132.00 137.35 3d4z h PRO 298 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3d4z h PRO 298 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3d4z h PRO 298 CO 0.60 0.00 0.00 0.91 -0.23 0.00 0.00 178.00 179.28 3d4z n TRP 299 N -2.96 0.00 -1.03 1.56 8.01 -1.26 -4.91 117.44 116.85 3d4z n TRP 299 Ca -0.01 -0.00 -0.01 0.00 -1.31 0.00 0.00 57.50 56.17 3d4z n TRP 299 Cb 0.16 0.00 -0.00 0.00 -2.01 0.00 0.00 31.31 29.46 3d4z n TRP 299 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 3d4z n LYS 300 N -0.88 -0.50 -3.98 -0.99 5.02 -0.46 -5.00 118.16 111.37 3d4z n LYS 300 Ca 0.22 0.23 -0.34 0.00 -2.02 0.00 0.00 58.31 56.39 3d4z n LYS 300 Cb 0.12 -3.68 -0.14 0.00 -0.02 0.00 0.00 35.03 31.30 3d4z n LYS 300 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3d4z s VAL 301 N -1.82 2.70 0.63 -0.18 1.01 -1.26 -5.06 120.40 116.42 3d4z s VAL 301 Ca 0.00 -1.19 -0.11 0.00 0.00 0.00 0.00 61.98 60.68 3d4z s VAL 301 Cb 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 3d4z s VAL 301 CO 0.00 0.13 1.03 -2.16 0.00 0.00 0.00 175.10 174.10 3d4z s PRO 302 N 1.27 3.45 0.63 2.72 0.04 -1.26 -4.47 135.00 137.38 3d4z s PRO 302 Ca -0.02 0.67 -0.18 0.00 0.04 0.00 0.00 61.00 61.51 3d4z s PRO 302 Cb -0.17 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 3d4z s PRO 302 CO -0.05 -0.65 1.22 -1.25 0.04 0.00 0.00 177.00 176.32 3d4z s PRO 303 N -5.20 2.72 -0.06 0.56 0.05 -1.26 -4.76 135.00 127.05 3d4z s PRO 303 Ca 0.55 1.85 0.05 0.00 0.05 0.00 0.00 61.00 63.51 3d4z s PRO 303 Cb -0.11 -1.89 -0.01 0.00 0.05 0.00 0.00 34.50 32.54 3d4z s PRO 303 CO 0.53 -1.41 -0.23 1.03 0.05 0.00 0.00 177.00 176.97 3d4z s ARG 304 N -3.48 2.49 0.19 4.56 0.52 -1.26 -4.86 118.95 117.12 3d4z s ARG 304 Ca 0.78 -0.85 -0.33 0.00 -0.52 0.00 0.00 55.73 54.81 3d4z s ARG 304 Cb -0.31 -2.07 -0.14 0.00 0.52 0.00 0.00 34.95 32.94 3d4z s ARG 304 CO 0.37 0.33 1.42 2.41 0.02 0.00 0.00 175.30 179.85 3d4z n THR 305 N 3.07 0.57 -2.53 0.02 -1.04 -1.26 -4.92 114.28 108.19 3d4z n THR 305 Ca -0.18 -0.14 -0.41 0.00 -2.04 0.00 0.00 64.05 61.28 3d4z n THR 305 Cb 0.52 -1.34 -0.04 0.00 -1.82 0.00 0.00 70.33 67.65 3d4z n THR 305 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3d4z s ILE 306 N 0.26 4.09 0.30 12.58 -1.09 -1.26 -4.97 121.20 131.11 3d4z s ILE 306 Ca 0.74 1.67 0.03 0.00 -2.23 0.00 0.00 60.65 60.86 3d4z s ILE 306 Cb -0.72 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.06 3d4z s ILE 306 CO 0.46 0.22 0.18 -0.94 -1.23 0.00 0.00 174.94 173.63 3d4z s SER 307 N 0.35 1.46 0.46 3.58 1.04 -1.26 -4.99 113.70 114.35 3d4z s SER 307 Ca 0.52 -1.58 0.11 0.00 0.48 0.00 0.00 55.95 55.48 3d4z s SER 307 Cb -0.28 0.42 1.05 0.00 0.10 0.00 0.00 66.02 67.31 3d4z s SER 307 CO 0.32 -0.92 2.10 0.44 0.98 0.00 0.00 173.24 176.16 3d4z h ASP 308 N 2.23 0.25 1.34 7.02 3.32 -2.00 -0.83 116.42 127.74 3d4z h ASP 308 Ca -0.32 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.66 3d4z h ASP 308 Cb 1.25 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 3d4z h ASP 308 CO 0.49 0.18 -0.30 1.56 -1.72 0.00 0.00 179.24 179.45 3d4z h GLN 309 N 0.29 0.00 -0.00 3.56 7.50 -1.99 -3.31 115.11 121.16 3d4z h GLN 309 Ca 0.08 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.23 3d4z h GLN 309 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.50 3d4z h GLN 309 CO -0.02 0.30 -0.02 0.27 -1.50 0.00 0.00 178.83 177.87 3d4z n ASN 310 N -3.27 1.11 0.17 1.46 0.23 -1.07 -4.76 115.26 109.12 3d4z n ASN 310 Ca 0.02 -1.06 0.01 0.00 -0.53 0.00 0.00 54.58 53.02 3d4z n ASN 310 Cb 0.57 0.13 0.29 0.00 -2.08 0.00 0.00 39.78 38.70 3d4z n ASN 310 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 3d4z h VAL 311 N 0.53 1.32 -0.33 3.53 3.04 -1.24 0.18 116.25 123.29 3d4z h VAL 311 Ca 0.00 -1.54 -0.05 0.00 -1.01 0.00 0.00 66.70 64.10 3d4z h VAL 311 Cb 0.12 1.82 -0.01 0.00 -2.01 0.00 0.00 31.29 31.21 3d4z h VAL 311 CO 0.00 0.44 0.01 0.00 -1.01 0.00 0.00 177.57 177.01 3d4z h ALA 312 N 1.54 0.44 -0.15 3.17 0.00 -1.85 -0.40 119.26 122.01 3d4z h ALA 312 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3d4z h ALA 312 Cb 0.80 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3d4z h ALA 312 CO 0.06 0.18 0.06 0.00 0.00 0.00 0.00 179.25 179.55 3d4z h ALA 313 N 0.86 0.20 -0.60 0.00 0.00 -1.75 -0.75 119.26 117.22 3d4z h ALA 313 Ca 0.09 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3d4z h ALA 313 Cb 0.42 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3d4z h ALA 313 CO 0.01 -0.21 0.11 0.00 0.00 0.00 0.00 179.25 179.17 3d4z h ARG 314 N 0.09 0.95 -0.40 0.00 2.47 -0.95 -2.19 114.38 114.36 3d4z h ARG 314 Ca 0.05 -0.23 -0.02 0.00 -1.26 0.00 0.00 59.98 58.52 3d4z h ARG 314 Cb 0.17 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.35 3d4z h ARG 314 CO -0.00 0.87 0.17 0.77 0.56 0.00 0.00 179.97 182.34 3d4z h SER 315 N 0.91 0.55 -0.71 7.04 0.02 -0.92 -0.70 113.55 119.73 3d4z h SER 315 Ca 0.19 -0.16 0.09 0.00 -0.84 0.00 0.00 61.79 61.07 3d4z h SER 315 Cb 0.37 -0.14 -0.07 0.00 0.14 0.00 0.00 62.40 62.70 3d4z h SER 315 CO 0.01 0.55 0.36 -0.78 -1.14 0.00 0.00 176.83 175.82 3d4z h ASP 316 N 0.51 0.47 -0.35 3.07 3.58 -0.86 0.16 116.42 122.98 3d4z h ASP 316 Ca 0.14 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.63 3d4z h ASP 316 Cb 0.17 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 3d4z h ASP 316 CO -0.01 0.27 0.16 -0.07 -2.88 0.00 0.00 179.24 176.71 3d4z h LEU 317 N 0.61 0.47 -0.13 2.28 3.38 -0.92 -2.34 115.31 118.66 3d4z h LEU 317 Ca 0.35 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 3d4z h LEU 317 Cb 0.36 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3d4z h LEU 317 CO -0.26 0.48 -0.37 0.25 0.09 0.00 0.00 178.44 178.63 3d4z h LEU 318 N 0.43 0.56 -1.31 1.67 5.85 -0.80 -2.54 115.31 119.17 3d4z h LEU 318 Ca 0.12 -0.59 -0.03 0.00 0.84 0.00 0.00 57.88 58.22 3d4z h LEU 318 Cb 0.14 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3d4z h LEU 318 CO -0.01 1.05 0.09 0.58 -0.34 0.00 0.00 178.44 179.81 3d4z h VAL 319 N 0.10 1.18 -0.83 1.05 2.07 -0.71 -0.51 116.25 118.60 3d4z h VAL 319 Ca -0.01 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 3d4z h VAL 319 Cb 0.99 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 3d4z h VAL 319 CO 0.08 0.23 0.37 -0.78 0.02 0.00 0.00 177.57 177.49 3d4z h ASP 320 N 0.55 1.10 -0.30 0.57 3.58 -1.34 0.25 116.42 120.83 3d4z h ASP 320 Ca 0.13 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.41 3d4z h ASP 320 Cb 0.21 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 3d4z h ASP 320 CO -0.00 0.94 0.13 1.56 -2.88 0.00 0.00 179.24 178.99 3d4z h GLN 321 N 1.18 0.45 -0.33 0.28 1.08 -0.85 -1.87 115.11 115.05 3d4z h GLN 321 Ca 0.28 -0.08 0.04 0.00 -1.45 0.00 0.00 58.65 57.44 3d4z h GLN 321 Cb 0.15 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.47 3d4z h GLN 321 CO -0.03 0.45 0.11 -1.49 -0.95 0.00 0.00 178.83 176.92 3d4z h TRP 322 N 0.35 0.20 0.00 2.96 6.55 -0.74 -0.49 115.95 124.77 3d4z h TRP 322 Ca 0.10 0.02 -0.08 0.00 0.95 0.00 0.00 58.89 59.88 3d4z h TRP 322 Cb 0.16 -0.04 -0.01 0.00 -0.86 0.00 0.00 29.16 28.41 3d4z h TRP 322 CO -0.01 0.08 -0.36 0.87 -1.05 0.00 0.00 178.44 177.97 3d4z h LYS 323 N 0.25 0.00 -0.21 0.49 1.57 -0.39 0.54 116.57 118.82 3d4z h LYS 323 Ca 0.15 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.88 3d4z h LYS 323 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 3d4z h LYS 323 CO -0.16 0.36 -0.07 0.87 -0.57 0.00 0.00 179.45 179.89 3d4z h LYS 324 N 0.00 0.42 -0.94 3.15 1.57 -0.86 -2.64 116.57 117.27 3d4z h LYS 324 Ca -0.00 -0.17 0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3d4z h LYS 324 Cb 0.67 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.90 3d4z h LYS 324 CO 0.05 0.68 0.61 -0.22 -0.57 0.00 0.00 179.45 179.99 3d4z h LYS 325 N 0.14 1.10 0.00 3.15 3.64 -0.60 -1.77 116.57 122.23 3d4z h LYS 325 Ca 0.05 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3d4z h LYS 325 Cb 0.53 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3d4z h LYS 325 CO 0.02 0.73 -0.06 0.00 -2.27 0.00 0.00 179.45 177.87 3d4z h ALA 326 N 1.41 1.49 0.00 5.00 0.00 -0.75 -1.76 119.26 124.66 3d4z h ALA 326 Ca 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3d4z h ALA 326 Cb 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3d4z h ALA 326 CO -0.15 0.07 0.00 0.93 0.00 0.00 0.00 179.25 180.10 3d4z h GLU 327 N 0.00 0.00 -0.01 0.00 4.39 -0.95 -2.33 114.58 115.68 3d4z h GLU 327 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3d4z h GLU 327 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3d4z h GLU 327 CO 0.01 0.00 -0.22 1.28 -1.16 0.00 0.00 179.01 178.91 3d4z n LEU 328 N -2.66 0.91 -4.40 1.33 4.77 -0.66 -4.91 117.00 111.38 3d4z n LEU 328 Ca -0.01 -0.21 -0.20 0.00 -0.03 0.00 0.00 56.01 55.56 3d4z n LEU 328 Cb 0.12 -0.14 -0.10 0.00 -2.33 0.00 0.00 43.42 40.97 3d4z n LEU 328 CO 0.17 0.17 -0.40 -0.31 -1.33 0.00 0.00 177.39 175.70 3d4z s TYR 329 N -2.49 1.89 -0.47 -1.77 2.02 -0.88 -4.41 117.35 111.23 3d4z s TYR 329 Ca 0.25 -0.64 0.23 0.00 -0.37 0.00 0.00 57.07 56.54 3d4z s TYR 329 Cb 0.19 -1.00 -0.04 0.00 -0.40 0.00 0.00 41.96 40.71 3d4z s TYR 329 CO 0.51 0.33 0.93 0.54 -1.57 0.00 0.00 175.55 176.28 3d4z n ARG 330 N -0.52 0.39 -3.57 -0.62 1.74 -1.26 -4.96 116.66 107.85 3d4z n ARG 330 Ca -0.06 -0.02 -0.24 0.00 -0.77 0.00 0.00 57.85 56.76 3d4z n ARG 330 Cb 0.62 -1.61 0.02 0.00 -1.02 0.00 0.00 32.46 30.47 3d4z n ARG 330 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3d4z s THR 331 N -3.27 1.84 -0.38 0.55 -4.23 -1.26 -4.71 115.64 104.18 3d4z s THR 331 Ca 0.01 -1.31 0.06 0.00 -1.18 0.00 0.00 61.69 59.28 3d4z s THR 331 Cb 0.14 -2.15 0.57 0.00 1.34 0.00 0.00 72.50 72.40 3d4z s THR 331 CO 0.82 0.00 1.60 -0.46 -0.54 0.00 0.00 174.62 176.04 3d4z n ASN 332 N -1.94 4.06 -4.21 3.99 6.94 -1.26 -4.84 115.26 117.99 3d4z n ASN 332 Ca 0.05 -3.01 -0.33 0.00 -0.02 0.00 0.00 54.58 51.27 3d4z n ASN 332 Cb 0.63 -0.71 -0.15 0.00 -2.36 0.00 0.00 39.78 37.19 3d4z n ASN 332 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3d4z s VAL 333 N -2.46 2.51 -0.10 3.53 1.01 -1.26 -0.60 120.40 123.03 3d4z s VAL 333 Ca 0.43 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.63 3d4z s VAL 333 Cb 0.35 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 3d4z s VAL 333 CO 0.10 0.51 -0.19 -0.22 0.00 0.00 0.00 175.10 175.30 3d4z s LEU 334 N 1.07 2.37 -0.23 3.92 2.96 0.64 -4.96 118.68 124.45 3d4z s LEU 334 Ca -0.01 -0.44 -0.16 0.00 -0.22 0.00 0.00 54.13 53.31 3d4z s LEU 334 Cb -0.14 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.02 3d4z s LEU 334 CO -0.05 0.19 0.39 -0.22 -1.32 0.00 0.00 176.35 175.34 3d4z s LEU 335 N 0.20 4.10 -0.46 -0.68 2.96 -1.26 -0.99 118.68 122.55 3d4z s LEU 335 Ca -0.12 0.42 0.03 0.00 -0.22 0.00 0.00 54.13 54.25 3d4z s LEU 335 Cb -0.16 -2.48 0.13 0.00 0.50 0.00 0.00 46.19 44.17 3d4z s LEU 335 CO 0.06 -0.13 0.22 -0.63 -1.32 0.00 0.00 176.35 174.55 3d4z s ILE 336 N 1.66 2.13 0.52 6.68 -1.09 0.00 -4.97 121.20 126.13 3d4z s ILE 336 Ca 0.17 -2.89 -0.23 0.00 -2.23 0.00 0.00 60.65 55.48 3d4z s ILE 336 Cb -0.15 -2.50 -0.06 0.00 -1.58 0.00 0.00 42.46 38.18 3d4z s ILE 336 CO 0.09 -0.80 1.37 -2.84 -1.23 0.00 0.00 174.94 171.53 3d4z s PRO 337 N 0.13 3.28 -0.41 2.79 0.02 -1.26 -0.65 135.00 138.90 3d4z s PRO 337 Ca 0.16 2.27 0.01 0.00 0.02 0.00 0.00 61.00 63.46 3d4z s PRO 337 Cb -0.24 -2.35 0.13 0.00 0.02 0.00 0.00 34.50 32.06 3d4z s PRO 337 CO -0.02 -1.09 0.22 -1.17 -0.33 0.00 0.00 177.00 174.61 3d4z s LEU 338 N -3.33 2.23 0.00 -5.54 2.96 0.21 -4.75 118.68 110.46 3d4z s LEU 338 Ca 0.69 -2.47 0.00 0.00 -0.22 0.00 0.00 54.13 52.13 3d4z s LEU 338 Cb -0.41 -0.86 0.00 0.00 0.50 0.00 0.00 46.19 45.42 3d4z s LEU 338 CO 0.49 -0.28 0.00 0.61 -1.32 0.00 0.00 176.35 175.85 3d4z n GLY 339 N 3.73 -1.23 1.19 7.98 0.00 -1.26 -1.52 105.19 114.08 3d4z n GLY 339 Ca 0.09 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.17 3d4z n GLY 339 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3d4z n ASP 340 N 0.21 -0.44 -4.71 1.61 -0.08 -1.25 -3.18 116.55 108.71 3d4z n ASP 340 Ca 0.00 -1.17 -0.42 0.00 -1.51 0.00 0.00 54.79 51.69 3d4z n ASP 340 Cb 0.00 0.70 -0.03 0.00 2.34 0.00 0.00 41.12 44.13 3d4z n ASP 340 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 3d4z s ASP 341 N -1.81 6.49 -1.67 1.67 1.11 -1.26 -1.09 116.67 120.12 3d4z s ASP 341 Ca 0.08 2.71 -0.17 0.00 0.18 0.00 0.00 52.55 55.35 3d4z s ASP 341 Cb -0.01 -2.59 0.14 0.00 1.07 0.00 0.00 42.92 41.54 3d4z s ASP 341 CO 0.01 -0.91 0.82 0.49 1.18 0.00 0.00 175.17 176.76 3d4z n PHE 342 N 4.41 -1.85 -2.13 4.23 3.72 0.54 -4.79 117.46 121.58 3d4z n PHE 342 Ca 0.15 0.82 -0.27 0.00 -0.05 0.00 0.00 57.45 58.10 3d4z n PHE 342 Cb 0.37 -3.17 0.11 0.00 -0.94 0.00 0.00 39.48 35.85 3d4z n PHE 342 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3d4z s ARG 343 N -6.86 1.71 -1.23 -1.08 1.81 -1.16 -4.35 118.95 107.78 3d4z s ARG 343 Ca 0.71 -0.34 -0.04 0.00 -1.72 0.00 0.00 55.73 54.34 3d4z s ARG 343 Cb -0.38 -2.07 0.00 0.00 -0.45 0.00 0.00 34.95 32.05 3d4z s ARG 343 CO 0.91 -1.62 1.06 1.19 -0.68 0.00 0.00 175.30 176.16 3d4z n PHE 344 N -3.19 -2.45 -0.02 -0.53 3.72 -1.26 -4.75 117.46 108.98 3d4z n PHE 344 Ca 0.11 0.95 -0.02 0.00 -0.05 0.00 0.00 57.45 58.44 3d4z n PHE 344 Cb 0.60 -4.95 -0.01 0.00 -0.94 0.00 0.00 39.48 34.19 3d4z n PHE 344 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3d4z n LYS 345 N -4.44 0.15 -2.37 -1.08 4.81 -1.26 -4.37 118.16 109.60 3d4z n LYS 345 Ca -0.14 0.30 -0.38 0.00 -0.87 0.00 0.00 58.31 57.22 3d4z n LYS 345 Cb 0.61 -1.01 -0.03 0.00 0.02 0.00 0.00 35.03 34.63 3d4z n LYS 345 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 3d4z s GLN 346 N -1.42 4.07 0.28 1.64 1.11 -1.26 -4.40 119.66 119.69 3d4z s GLN 346 Ca -0.05 1.73 0.01 0.00 0.01 0.00 0.00 55.36 57.06 3d4z s GLN 346 Cb 0.01 -2.63 0.53 0.00 -1.01 0.00 0.00 33.01 29.91 3d4z s GLN 346 CO 0.08 -0.27 1.85 -0.91 0.01 0.00 0.00 175.29 176.04 3d4z h ASN 347 N 2.58 0.95 0.43 5.90 2.35 -1.95 -0.77 115.58 125.06 3d4z h ASN 347 Ca -0.49 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.26 3d4z h ASN 347 Cb 1.23 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 3d4z h ASN 347 CO 0.62 0.53 -0.21 0.71 -1.65 0.00 0.00 177.43 177.43 3d4z h THR 348 N 1.03 0.82 -0.15 2.81 1.35 -2.00 -1.70 112.91 115.08 3d4z h THR 348 Ca 0.48 -0.84 -0.11 0.00 -0.55 0.00 0.00 66.41 65.40 3d4z h THR 348 Cb 0.42 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 3d4z h THR 348 CO -0.24 0.21 -0.32 -0.08 -0.25 0.00 0.00 175.52 174.84 3d4z h GLU 349 N 0.00 0.48 -0.49 4.72 4.81 -1.53 -0.45 114.58 122.12 3d4z h GLU 349 Ca -0.00 -0.32 0.07 0.00 -0.13 0.00 0.00 59.36 58.98 3d4z h GLU 349 Cb 0.49 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.85 3d4z h GLU 349 CO 0.03 0.92 0.17 -1.49 -0.73 0.00 0.00 179.01 177.91 3d4z h TRP 350 N 0.11 0.30 -0.40 0.92 4.06 -1.01 -1.41 115.95 118.52 3d4z h TRP 350 Ca 0.00 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.95 3d4z h TRP 350 Cb 0.92 -0.06 -0.02 0.00 -1.00 0.00 0.00 29.16 29.00 3d4z h TRP 350 CO 0.10 0.10 0.14 -0.44 -3.56 0.00 0.00 178.44 174.77 3d4z h ASP 351 N 0.35 0.57 0.08 -3.49 3.32 -1.23 -0.80 116.42 115.22 3d4z h ASP 351 Ca 0.23 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 56.98 3d4z h ASP 351 Cb 0.25 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3d4z h ASP 351 CO -0.24 0.61 -0.38 1.62 -1.72 0.00 0.00 179.24 179.12 3d4z h VAL 352 N 0.49 1.30 -0.03 -1.35 3.04 -0.64 0.73 116.25 119.80 3d4z h VAL 352 Ca 0.13 -1.50 -0.04 0.00 -1.01 0.00 0.00 66.70 64.27 3d4z h VAL 352 Cb 0.23 1.58 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 3d4z h VAL 352 CO -0.01 0.46 -0.16 1.56 -1.01 0.00 0.00 177.57 178.42 3d4z h GLN 353 N 0.34 0.15 -0.26 4.17 1.08 -1.21 -3.10 115.11 116.27 3d4z h GLN 353 Ca 0.03 -0.13 -0.02 0.00 -1.45 0.00 0.00 58.65 57.09 3d4z h GLN 353 Cb 0.83 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.28 3d4z h GLN 353 CO 0.07 0.80 0.10 -0.09 -0.95 0.00 0.00 178.83 178.75 3d4z h ARG 354 N -0.45 0.40 -0.45 1.46 2.43 -0.91 -1.83 114.38 115.02 3d4z h ARG 354 Ca -0.01 -0.08 -0.13 0.00 -0.81 0.00 0.00 59.98 58.95 3d4z h ARG 354 Cb 0.83 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 3d4z h ARG 354 CO 0.03 0.44 -0.22 0.28 -1.51 0.00 0.00 179.97 179.00 3d4z h VAL 355 N 0.27 1.27 -0.41 0.20 2.07 -0.99 0.13 116.25 118.79 3d4z h VAL 355 Ca 0.09 -1.38 -0.07 0.00 0.82 0.00 0.00 66.70 66.16 3d4z h VAL 355 Cb 0.20 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3d4z h VAL 355 CO -0.01 0.47 -0.03 0.78 0.02 0.00 0.00 177.57 178.81 3d4z h ASN 356 N 0.79 0.73 -0.61 0.57 2.35 -1.50 -1.32 115.58 116.60 3d4z h ASN 356 Ca 0.10 -0.32 -0.08 0.00 -0.55 0.00 0.00 56.30 55.44 3d4z h ASN 356 Cb 0.79 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.94 3d4z h ASN 356 CO 0.07 0.88 0.06 1.88 -1.65 0.00 0.00 177.43 178.67 3d4z h TYR 357 N 0.56 1.13 -0.82 1.19 0.05 -1.17 -2.05 116.97 115.86 3d4z h TYR 357 Ca 0.11 -0.17 0.06 0.00 0.05 0.00 0.00 58.73 58.78 3d4z h TYR 357 Cb 0.52 -0.30 -0.06 0.00 1.01 0.00 0.00 36.73 37.90 3d4z h TYR 357 CO 0.04 0.97 0.50 0.93 -1.05 0.00 0.00 178.16 179.55 3d4z h GLU 358 N 0.98 0.91 -0.74 4.88 5.08 -0.51 0.18 114.58 125.34 3d4z h GLU 358 Ca 0.19 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3d4z h GLU 358 Cb 0.48 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 3d4z h GLU 358 CO 0.02 0.60 0.30 0.00 -1.00 0.00 0.00 179.01 178.93 3d4z h ARG 359 N 0.93 1.11 -0.02 2.33 3.08 -0.84 -0.92 114.38 120.06 3d4z h ARG 359 Ca 0.35 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 3d4z h ARG 359 Cb 0.14 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3d4z h ARG 359 CO -0.16 0.91 0.01 -0.07 -1.07 0.00 0.00 179.97 179.59 3d4z h LEU 360 N 1.07 0.02 -0.76 3.04 3.38 -0.66 -2.60 115.31 118.80 3d4z h LEU 360 Ca 0.25 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.11 3d4z h LEU 360 Cb 0.21 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 3d4z h LEU 360 CO -0.02 0.16 0.47 -0.26 0.09 0.00 0.00 178.44 178.88 3d4z h PHE 361 N -0.12 0.88 -0.54 1.13 0.04 -0.47 0.14 116.94 117.99 3d4z h PHE 361 Ca 0.01 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 3d4z h PHE 361 Cb 0.15 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 3d4z h PHE 361 CO -0.03 0.48 0.26 1.49 -0.60 0.00 0.00 178.31 179.92 3d4z h GLU 362 N 0.90 0.79 0.15 1.51 4.81 -1.07 0.13 114.58 121.79 3d4z h GLU 362 Ca 0.31 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 3d4z h GLU 362 Cb 0.07 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.31 3d4z h GLU 362 CO -0.13 0.65 -0.07 1.25 -0.73 0.00 0.00 179.01 179.98 3d4z h HIS 363 N 0.73 -0.18 -0.41 0.92 2.76 -1.05 -2.94 115.15 114.98 3d4z h HIS 363 Ca 0.19 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.38 3d4z h HIS 363 Cb 0.12 0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.11 3d4z h HIS 363 CO -0.00 0.19 0.22 0.82 -1.30 0.00 0.00 177.93 177.85 3d4z h ILE 364 N -0.58 0.99 0.00 6.26 2.04 -0.60 -2.27 117.51 123.35 3d4z h ILE 364 Ca -0.02 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3d4z h ILE 364 Cb 0.45 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3d4z h ILE 364 CO 0.03 0.08 0.00 0.78 0.00 0.00 0.00 178.15 179.04 3d4z h ASN 365 N 0.44 0.00 -0.02 1.72 2.35 -0.79 -2.61 115.58 116.67 3d4z h ASN 365 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3d4z h ASN 365 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 3d4z h ASN 365 CO -0.11 0.00 -0.37 -1.54 -1.65 0.00 0.00 177.43 173.76 3d4z n SER 366 N -2.67 2.24 -4.22 5.81 3.41 -0.90 -4.77 113.62 112.52 3d4z n SER 366 Ca 0.02 -1.62 -0.41 0.00 -0.26 0.00 0.00 58.87 56.59 3d4z n SER 366 Cb 0.28 0.37 -0.08 0.00 -0.26 0.00 0.00 64.21 64.52 3d4z n SER 366 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3d4z s GLN 367 N -2.37 2.61 0.50 4.33 -1.52 -0.96 -4.95 119.66 117.29 3d4z s GLN 367 Ca 0.21 -1.87 0.21 0.00 -1.95 0.00 0.00 55.36 51.95 3d4z s GLN 367 Cb 0.19 -3.98 1.27 0.00 -0.22 0.00 0.00 33.01 30.26 3d4z s GLN 367 CO 0.51 -1.21 1.99 0.00 -0.25 0.00 0.00 175.29 176.33 3d4z h ALA 368 N 8.33 2.33 0.00 6.09 0.00 -1.86 -1.34 119.26 132.81 3d4z h ALA 368 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3d4z h ALA 368 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3d4z h ALA 368 CO 0.86 -0.48 0.00 1.12 0.00 0.00 0.00 179.25 180.75 3d4z h HIS 369 N 0.14 0.00 0.00 0.00 2.07 -1.93 -0.35 115.15 115.08 3d4z h HIS 369 Ca 0.26 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.68 3d4z h HIS 369 Cb 0.85 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.82 3d4z h HIS 369 CO -0.00 0.00 -0.59 0.74 -3.07 0.00 0.00 177.93 175.01 3d4z h PHE 370 N 0.00 0.00 -6.23 6.12 0.04 -1.54 -3.48 116.94 111.85 3d4z h PHE 370 Ca 0.00 0.00 -0.46 0.00 2.80 0.00 0.00 57.97 60.31 3d4z h PHE 370 Cb 0.05 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.20 3d4z h PHE 370 CO 0.00 0.49 -0.78 0.09 -0.60 0.00 0.00 178.31 177.50 3d4z n ASN 371 N -3.18 -3.50 -4.23 2.17 3.02 -0.14 -4.86 115.26 104.54 3d4z n ASN 371 Ca 0.01 -0.80 -0.27 0.00 -0.03 0.00 0.00 54.58 53.49 3d4z n ASN 371 Cb 0.74 -3.93 -0.15 0.00 -0.61 0.00 0.00 39.78 35.82 3d4z n ASN 371 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d4z s VAL 372 N -3.44 1.66 -0.25 2.41 1.01 -1.26 -0.66 120.40 119.86 3d4z s VAL 372 Ca 0.43 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.45 3d4z s VAL 372 Cb -0.21 -1.39 0.06 0.00 0.00 0.00 0.00 36.38 34.83 3d4z s VAL 372 CO 0.82 0.40 -0.09 -1.58 0.00 0.00 0.00 175.10 174.65 3d4z s GLN 373 N -0.68 2.01 -0.02 2.72 2.00 -0.42 -4.36 119.66 120.91 3d4z s GLN 373 Ca 0.08 -1.19 0.05 0.00 -2.00 0.00 0.00 55.36 52.30 3d4z s GLN 373 Cb -0.08 -2.76 -0.03 0.00 0.80 0.00 0.00 33.01 30.94 3d4z s GLN 373 CO -0.00 -0.57 -0.15 0.00 -0.50 0.00 0.00 175.29 174.06 3d4z s ALA 374 N 1.22 2.64 0.12 1.58 0.00 -1.26 -0.72 121.76 125.35 3d4z s ALA 374 Ca -0.07 -1.05 -0.24 0.00 0.00 0.00 0.00 51.96 50.59 3d4z s ALA 374 Cb -0.19 -0.89 0.07 0.00 0.00 0.00 0.00 23.12 22.11 3d4z s ALA 374 CO -0.06 0.56 0.61 1.14 0.00 0.00 0.00 175.76 178.02 3d4z s GLN 375 N -0.99 1.24 0.43 0.00 0.00 -0.29 -4.88 119.66 115.17 3d4z s GLN 375 Ca 0.13 -0.35 -0.25 0.00 -0.00 0.00 0.00 55.36 54.89 3d4z s GLN 375 Cb -0.11 0.57 -0.08 0.00 0.00 0.00 0.00 33.01 33.40 3d4z s GLN 375 CO 0.02 -0.52 1.31 -0.06 0.00 0.00 0.00 175.29 176.04 3d4z s PHE 376 N -3.31 2.73 0.31 9.60 0.08 -1.26 -0.82 117.98 125.31 3d4z s PHE 376 Ca -0.01 1.40 -0.04 0.00 0.12 0.00 0.00 56.93 58.40 3d4z s PHE 376 Cb -0.01 -3.68 -0.00 0.00 -0.57 0.00 0.00 43.02 38.76 3d4z s PHE 376 CO -0.09 -2.20 0.45 0.20 -0.10 0.00 0.00 175.22 173.48 3d4z s GLY 377 N -0.79 1.31 0.44 4.36 0.00 0.22 -4.77 107.32 108.08 3d4z s GLY 377 Ca 0.59 -1.41 0.07 0.00 0.00 0.00 0.00 44.72 43.97 3d4z s GLY 377 CO 0.48 -0.96 0.34 -0.51 0.00 0.00 0.00 173.10 172.45 3d4z s THR 378 N -3.32 2.42 0.14 0.90 -4.23 -1.26 -4.17 115.64 106.12 3d4z s THR 378 Ca 0.30 -1.44 -0.14 0.00 -1.18 0.00 0.00 61.69 59.22 3d4z s THR 378 Cb 0.00 -2.87 0.01 0.00 1.34 0.00 0.00 72.50 70.99 3d4z s THR 378 CO 0.17 0.00 1.67 0.25 -0.54 0.00 0.00 174.62 176.17 3d4z h LEU 379 N 1.07 0.66 -1.24 4.79 5.85 -1.96 -2.17 115.31 122.31 3d4z h LEU 379 Ca -0.41 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.08 3d4z h LEU 379 Cb 1.27 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3d4z h LEU 379 CO 0.60 0.69 0.18 -0.61 -0.34 0.00 0.00 178.44 178.96 3d4z h GLN 380 N 0.60 0.71 -0.74 1.25 5.75 -1.96 -1.60 115.11 119.13 3d4z h GLN 380 Ca 0.15 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 3d4z h GLN 380 Cb 0.26 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 3d4z h GLN 380 CO -0.01 0.60 0.43 0.93 -2.65 0.00 0.00 178.83 178.13 3d4z h GLU 381 N 0.71 1.02 0.40 1.69 5.08 -1.88 0.10 114.58 121.69 3d4z h GLU 381 Ca 0.17 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 3d4z h GLU 381 Cb 0.16 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3d4z h GLU 381 CO -0.01 0.74 -0.26 -0.92 -1.00 0.00 0.00 179.01 177.55 3d4z h TYR 382 N 1.01 -0.68 -0.60 4.33 3.20 -0.75 -1.78 116.97 121.70 3d4z h TYR 382 Ca 0.26 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.07 3d4z h TYR 382 Cb -0.00 0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 3d4z h TYR 382 CO -0.01 -0.40 0.14 0.74 -1.64 0.00 0.00 178.16 176.99 3d4z h PHE 383 N -0.64 0.98 -0.77 -3.82 0.04 -1.05 -0.72 116.94 110.96 3d4z h PHE 383 Ca -0.04 -0.11 0.02 0.00 2.80 0.00 0.00 57.97 60.64 3d4z h PHE 383 Cb 0.53 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 38.36 3d4z h PHE 383 CO -0.11 0.82 0.50 -0.44 -0.60 0.00 0.00 178.31 178.49 3d4z h ASP 384 N 0.90 0.85 -0.11 2.17 3.32 -0.68 -0.63 116.42 122.24 3d4z h ASP 384 Ca 0.19 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.09 3d4z h ASP 384 Cb 0.34 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3d4z h ASP 384 CO 0.00 0.60 -0.40 0.00 -1.72 0.00 0.00 179.24 177.72 3d4z h ALA 385 N 1.30 0.79 -0.22 3.45 0.00 -0.61 -0.86 119.26 123.11 3d4z h ALA 385 Ca 0.29 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.77 3d4z h ALA 385 Cb -0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3d4z h ALA 385 CO -0.08 0.65 0.12 0.28 0.00 0.00 0.00 179.25 180.22 3d4z h VAL 386 N 0.53 1.00 0.00 0.00 2.07 -0.69 -0.80 116.25 118.36 3d4z h VAL 386 Ca 0.04 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 3d4z h VAL 386 Cb 0.93 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3d4z h VAL 386 CO 0.08 0.04 -0.30 0.45 0.02 0.00 0.00 177.57 177.86 3d4z h HIS 387 N 0.25 0.00 -0.74 1.57 -0.00 -0.83 0.01 115.15 115.40 3d4z h HIS 387 Ca 0.09 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.40 3d4z h HIS 387 Cb 0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.39 3d4z h HIS 387 CO -0.09 0.30 0.23 1.96 -0.00 0.00 0.00 177.93 180.34 3d4z h GLN 388 N 0.00 1.15 -0.56 2.45 4.20 -0.74 0.46 115.11 122.07 3d4z h GLN 388 Ca -0.00 -0.24 -0.10 0.00 0.06 0.00 0.00 58.65 58.37 3d4z h GLN 388 Cb 0.78 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 3d4z h GLN 388 CO 0.04 0.97 -0.03 0.00 -0.67 0.00 0.00 178.83 179.14 3d4z h ALA 389 N 1.15 0.76 -0.49 3.87 0.00 -0.15 -1.31 119.26 123.08 3d4z h ALA 389 Ca 0.24 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3d4z h ALA 389 Cb 0.30 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3d4z h ALA 389 CO -0.01 0.62 0.30 1.49 0.00 0.00 0.00 179.25 181.65 3d4z h GLU 390 N 0.90 0.66 0.00 0.00 4.81 -0.82 -0.49 114.58 119.63 3d4z h GLU 390 Ca 0.16 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 3d4z h GLU 390 Cb 0.59 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 3d4z h GLU 390 CO 0.03 0.48 -0.29 0.00 -0.73 0.00 0.00 179.01 178.50 3d4z h ARG 391 N 0.66 0.00 -0.04 1.92 3.08 -0.66 -0.73 114.38 118.60 3d4z h ARG 391 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3d4z h ARG 391 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3d4z h ARG 391 CO -0.03 0.29 0.00 0.00 -1.07 0.00 0.00 179.97 179.15 3d4z n ALA 392 N -2.38 2.56 -0.84 0.04 0.00 -0.52 -4.85 120.51 114.53 3d4z n ALA 392 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3d4z n ALA 392 Cb 0.37 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3d4z n ALA 392 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d4z n GLY 393 N 0.77 0.52 0.23 0.00 0.00 -0.28 -4.94 105.19 101.48 3d4z n GLY 393 Ca 0.10 -0.58 0.12 0.00 0.00 0.00 0.00 46.02 45.67 3d4z n GLY 393 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3d4z h GLN 394 N 0.55 0.00 -2.11 1.61 4.15 -1.23 -3.47 115.11 114.62 3d4z h GLN 394 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 3d4z h GLN 394 Cb 0.00 0.00 -0.19 0.00 0.21 0.00 0.00 27.48 27.50 3d4z h GLN 394 CO 0.00 0.03 0.15 0.00 -1.93 0.00 0.00 178.83 177.08 3d4z s ALA 395 N -3.29 -1.67 0.06 3.38 0.00 -1.26 -4.87 121.76 114.11 3d4z s ALA 395 Ca 0.06 1.22 0.08 0.00 0.00 0.00 0.00 51.96 53.31 3d4z s ALA 395 Cb 0.06 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 3d4z s ALA 395 CO 0.65 -0.36 -0.21 -1.83 0.00 0.00 0.00 175.76 174.00 3d4z s GLU 396 N -1.24 1.36 0.10 0.00 -1.05 -1.26 -4.64 118.70 111.97 3d4z s GLU 396 Ca -0.11 -1.02 0.05 0.00 -0.15 0.00 0.00 54.97 53.74 3d4z s GLU 396 Cb -0.00 -1.53 -0.04 0.00 -0.44 0.00 0.00 34.13 32.12 3d4z s GLU 396 CO 0.09 0.38 0.01 -0.06 0.95 0.00 0.00 175.26 176.64 3d4z s PHE 397 N -0.89 3.01 0.68 4.83 0.08 -1.26 -5.06 117.98 119.36 3d4z s PHE 397 Ca 0.08 -0.02 -0.12 0.00 0.12 0.00 0.00 56.93 56.98 3d4z s PHE 397 Cb -0.09 -1.53 0.00 0.00 -0.57 0.00 0.00 43.02 40.83 3d4z s PHE 397 CO 0.02 0.49 1.06 -1.25 -0.10 0.00 0.00 175.22 175.45 3d4z s PRO 398 N -2.40 2.95 0.04 0.24 0.04 -1.26 -4.78 135.00 129.82 3d4z s PRO 398 Ca 0.26 1.06 -0.04 0.00 0.04 0.00 0.00 61.00 62.33 3d4z s PRO 398 Cb -0.11 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 3d4z s PRO 398 CO 0.19 -1.10 0.25 0.95 0.04 0.00 0.00 177.00 177.34 3d4z s THR 399 N -2.84 5.33 -0.04 1.26 -4.23 -1.26 -0.58 115.64 113.27 3d4z s THR 399 Ca 0.60 -0.07 -0.06 0.00 -1.18 0.00 0.00 61.69 60.98 3d4z s THR 399 Cb -0.15 -3.59 0.01 0.00 1.34 0.00 0.00 72.50 70.11 3d4z s THR 399 CO 0.50 0.24 0.15 -0.22 -0.54 0.00 0.00 174.62 174.75 3d4z s LEU 400 N -2.16 1.45 0.14 4.79 0.20 -0.47 -1.22 118.68 121.40 3d4z s LEU 400 Ca 0.32 0.19 0.02 0.00 0.69 0.00 0.00 54.13 55.35 3d4z s LEU 400 Cb -0.13 0.57 -0.04 0.00 -0.43 0.00 0.00 46.19 46.15 3d4z s LEU 400 CO 0.21 -0.13 -0.05 -0.94 -0.29 0.00 0.00 176.35 175.16 3d4z s SER 401 N -0.27 1.32 0.00 3.68 1.04 -0.12 -1.05 113.70 118.30 3d4z s SER 401 Ca -0.04 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.32 3d4z s SER 401 Cb -0.03 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.17 3d4z s SER 401 CO 0.01 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.36 3d4z n GLY 402 N -0.16 0.42 3.47 7.32 0.00 -1.26 -0.97 105.19 114.01 3d4z n GLY 402 Ca -0.09 -2.22 -0.28 0.00 0.00 0.00 0.00 46.02 43.42 3d4z n GLY 402 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d4z n ASP 403 N 0.51 1.85 -2.54 1.61 5.75 -1.26 -4.36 116.55 118.10 3d4z n ASP 403 Ca 0.00 -3.21 -0.20 0.00 -0.01 0.00 0.00 54.79 51.37 3d4z n ASP 403 Cb 0.00 0.85 0.01 0.00 -1.03 0.00 0.00 41.12 40.96 3d4z n ASP 403 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3d4z n PHE 404 N -1.03 2.55 -4.39 2.11 3.72 -0.19 -4.90 117.46 115.34 3d4z n PHE 404 Ca -0.10 -2.97 -0.28 0.00 -0.05 0.00 0.00 57.45 54.05 3d4z n PHE 404 Cb 0.63 -0.20 -0.12 0.00 -0.94 0.00 0.00 39.48 38.85 3d4z n PHE 404 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3d4z s PHE 405 N -3.39 2.36 -0.10 1.38 0.08 -1.26 -2.69 117.98 114.36 3d4z s PHE 405 Ca 0.40 -0.34 -0.16 0.00 0.12 0.00 0.00 56.93 56.95 3d4z s PHE 405 Cb 0.42 -1.22 -0.05 0.00 -0.57 0.00 0.00 43.02 41.61 3d4z s PHE 405 CO -0.10 0.43 0.39 0.99 -0.10 0.00 0.00 175.22 176.83 3d4z s THR 406 N -1.38 5.19 0.35 0.64 2.01 -1.26 -5.09 115.64 116.09 3d4z s THR 406 Ca 0.18 0.78 -0.27 0.00 0.31 0.00 0.00 61.69 62.68 3d4z s THR 406 Cb -0.09 -3.72 -0.09 0.00 0.01 0.00 0.00 72.50 68.61 3d4z s THR 406 CO 0.09 0.43 1.24 -0.47 -0.69 0.00 0.00 174.62 175.21 3d4z s TYR 407 N 0.03 3.10 -0.05 4.92 5.04 -1.26 -4.78 117.35 124.34 3d4z s TYR 407 Ca 0.22 1.50 0.02 0.00 -2.44 0.00 0.00 57.07 56.37 3d4z s TYR 407 Cb -0.15 -3.54 0.01 0.00 0.35 0.00 0.00 41.96 38.63 3d4z s TYR 407 CO 0.09 -1.55 -0.10 0.00 -1.34 0.00 0.00 175.55 172.65 3d4z s ALA 408 N -1.24 1.05 -0.25 3.97 0.00 -1.26 -0.31 121.76 123.72 3d4z s ALA 408 Ca 0.52 -0.33 0.23 0.00 0.00 0.00 0.00 51.96 52.37 3d4z s ALA 408 Cb -0.36 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.29 3d4z s ALA 408 CO 0.46 0.11 1.01 -0.40 0.00 0.00 0.00 175.76 176.95 3d4z n ASP 409 N 3.67 0.77 -3.54 0.00 5.75 -1.22 -2.67 116.55 119.32 3d4z n ASP 409 Ca -0.22 0.27 -0.11 0.00 -0.01 0.00 0.00 54.79 54.72 3d4z n ASP 409 Cb 0.52 0.57 -0.04 0.00 -1.03 0.00 0.00 41.12 41.14 3d4z n ASP 409 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d4z s ARG 410 N -3.36 0.78 1.13 0.11 1.70 -1.26 -4.78 118.95 113.26 3d4z s ARG 410 Ca -0.01 -0.01 0.00 0.00 -0.47 0.00 0.00 55.73 55.24 3d4z s ARG 410 Cb 0.10 0.36 0.00 0.00 -0.57 0.00 0.00 34.95 34.85 3d4z s ARG 410 CO 0.80 -0.28 0.00 -1.13 -1.08 0.00 0.00 175.30 173.60 3d4z n SER 411 N 0.38 0.00 -1.70 -2.89 3.41 -1.26 -0.90 113.62 110.66 3d4z n SER 411 Ca -0.11 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.48 3d4z n SER 411 Cb 0.59 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.84 3d4z n SER 411 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3d4z n ASP 412 N 2.01 4.54 -4.47 4.04 5.75 -1.26 -4.86 116.55 122.30 3d4z n ASP 412 Ca 0.00 -3.21 -0.44 0.00 -0.01 0.00 0.00 54.79 51.13 3d4z n ASP 412 Cb 0.00 -0.69 -0.01 0.00 -1.03 0.00 0.00 41.12 39.39 3d4z n ASP 412 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 3d4z s ASN 413 N -1.33 6.90 -0.02 -1.12 0.02 -0.07 -4.97 114.94 114.34 3d4z s ASN 413 Ca 0.52 -2.60 -0.21 0.00 -1.02 0.00 0.00 52.86 49.55 3d4z s ASN 413 Cb 0.42 -2.42 -0.05 0.00 0.02 0.00 0.00 41.25 39.22 3d4z s ASN 413 CO 0.12 -0.90 0.59 -0.31 0.02 0.00 0.00 177.10 176.61 3d4z s TYR 414 N 2.25 3.65 -1.02 2.20 1.51 -1.26 -3.39 117.35 121.29 3d4z s TYR 414 Ca 0.41 1.17 -0.05 0.00 -1.01 0.00 0.00 57.07 57.58 3d4z s TYR 414 Cb -0.03 -2.62 0.07 0.00 -0.11 0.00 0.00 41.96 39.27 3d4z s TYR 414 CO -0.03 0.30 2.61 0.91 -1.11 0.00 0.00 175.55 178.23 3d4z n TRP 415 N 2.95 2.15 1.06 2.71 7.02 0.58 -2.87 117.44 131.04 3d4z n TRP 415 Ca -0.06 -2.51 0.11 0.00 -1.02 0.00 0.00 57.50 54.02 3d4z n TRP 415 Cb 0.51 -1.73 0.09 0.00 -2.42 0.00 0.00 31.31 27.76 3d4z n TRP 415 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 3d4z n SER 416 N 1.64 1.28 -0.30 -0.99 3.41 -1.22 -4.31 113.62 113.13 3d4z n SER 416 Ca 0.59 -1.03 -0.05 0.00 -0.26 0.00 0.00 58.87 58.12 3d4z n SER 416 Cb 0.37 0.51 0.07 0.00 -0.26 0.00 0.00 64.21 64.90 3d4z n SER 416 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3d4z h GLY 417 N 4.93 1.19 1.56 5.00 0.00 -1.20 -2.72 103.07 111.83 3d4z h GLY 417 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.80 3d4z h GLY 417 CO 0.00 0.51 0.00 1.58 0.00 0.00 0.00 176.54 178.63 3d4z n TYR 418 N -4.43 0.00 0.33 5.60 4.11 -1.05 -1.33 117.16 120.39 3d4z n TYR 418 Ca 0.08 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 58.09 3d4z n TYR 418 Cb 0.08 -0.28 0.49 0.00 -0.00 0.00 0.00 39.34 39.64 3d4z n TYR 418 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 3d4z n TYR 419 N -1.28 0.73 0.00 -3.48 4.01 -1.03 -3.89 117.16 112.23 3d4z n TYR 419 Ca 0.10 0.31 0.00 0.00 -0.16 0.00 0.00 57.90 58.15 3d4z n TYR 419 Cb 0.16 -1.00 0.00 0.00 -0.31 0.00 0.00 39.34 38.19 3d4z n TYR 419 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 3d4z n THR 420 N -2.19 0.00 -1.62 -0.72 -1.04 -0.45 -2.31 114.28 105.96 3d4z n THR 420 Ca 0.01 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.57 3d4z n THR 420 Cb 0.17 -0.14 -0.02 0.00 -1.82 0.00 0.00 70.33 68.51 3d4z n THR 420 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 3d4z n SER 421 N -1.23 1.87 -3.49 8.00 7.64 -0.91 -2.67 113.62 122.83 3d4z n SER 421 Ca 0.00 1.17 -0.23 0.00 1.01 0.00 0.00 58.87 60.81 3d4z n SER 421 Cb 0.16 -1.33 0.05 0.00 -1.01 0.00 0.00 64.21 62.08 3d4z n SER 421 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3d4z n ARG 422 N 1.27 -1.59 0.25 1.43 3.00 -1.26 -4.03 116.66 115.74 3d4z n ARG 422 Ca 0.11 0.69 0.13 0.00 -0.01 0.00 0.00 57.85 58.77 3d4z n ARG 422 Cb 0.31 -4.78 0.63 0.00 0.00 0.00 0.00 32.46 28.62 3d4z n ARG 422 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 3d4z h PRO 423 N -1.38 0.00 -0.57 5.56 0.13 -1.83 -2.55 132.00 131.37 3d4z h PRO 423 Ca -0.59 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.59 3d4z h PRO 423 Cb 1.32 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.40 3d4z h PRO 423 CO 0.45 0.13 0.30 -0.92 -0.23 0.00 0.00 178.00 177.73 3d4z h TYR 424 N 0.00 0.54 0.00 1.56 3.20 -1.90 -1.19 116.97 119.19 3d4z h TYR 424 Ca -0.00 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.73 3d4z h TYR 424 Cb 0.53 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 3d4z h TYR 424 CO 0.00 0.26 -0.76 0.45 -1.64 0.00 0.00 178.16 176.47 3d4z h HIS 425 N 0.56 0.00 -0.70 -3.82 3.86 -1.83 -0.09 115.15 113.13 3d4z h HIS 425 Ca 0.25 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.47 3d4z h HIS 425 Cb 0.16 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.59 3d4z h HIS 425 CO -0.10 0.76 0.46 0.87 0.86 0.00 0.00 177.93 180.79 3d4z h LYS 426 N 0.00 0.90 -0.35 2.45 1.57 -1.20 0.33 116.57 120.27 3d4z h LYS 426 Ca -0.01 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 3d4z h LYS 426 Cb 1.41 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 3d4z h LYS 426 CO 0.10 0.60 -0.21 -0.09 -0.57 0.00 0.00 179.45 179.28 3d4z h ARG 427 N 0.93 0.75 -0.60 3.15 9.65 -0.98 -3.00 114.38 124.28 3d4z h ARG 427 Ca 0.26 -0.35 0.05 0.00 -1.10 0.00 0.00 59.98 58.84 3d4z h ARG 427 Cb -0.09 -0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 3d4z h ARG 427 CO -0.06 0.96 0.40 1.98 2.80 0.00 0.00 179.97 186.05 3d4z h MET 428 N 0.53 0.63 -0.67 0.20 4.05 -0.66 -1.26 114.93 117.75 3d4z h MET 428 Ca 0.07 -0.04 0.10 0.00 -0.28 0.00 0.00 59.70 59.56 3d4z h MET 428 Cb 0.76 -0.14 -0.08 0.00 -0.80 0.00 0.00 31.60 31.34 3d4z h MET 428 CO 0.06 0.42 0.27 0.22 0.23 0.00 0.00 176.91 178.11 3d4z h ASP 429 N 0.65 0.29 0.32 1.39 3.58 -0.79 0.28 116.42 122.13 3d4z h ASP 429 Ca 0.25 0.08 -0.16 0.00 0.42 0.00 0.00 57.03 57.62 3d4z h ASP 429 Cb 0.18 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 3d4z h ASP 429 CO -0.07 0.16 -0.66 0.03 -2.88 0.00 0.00 179.24 175.81 3d4z h ARG 430 N 0.46 0.32 -0.02 0.28 2.47 -1.25 0.75 114.38 117.39 3d4z h ARG 430 Ca 0.34 -0.24 -0.00 0.00 -1.26 0.00 0.00 59.98 58.82 3d4z h ARG 430 Cb 0.43 0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.80 3d4z h ARG 430 CO -0.32 0.87 0.01 0.28 0.56 0.00 0.00 179.97 181.36 3d4z h VAL 431 N 0.22 1.15 -0.46 2.04 2.07 -0.77 -2.60 116.25 117.90 3d4z h VAL 431 Ca -0.02 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 66.99 3d4z h VAL 431 Cb 1.20 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 3d4z h VAL 431 CO 0.11 0.12 0.00 0.25 0.02 0.00 0.00 177.57 178.07 3d4z h LEU 432 N -0.15 0.73 -0.56 2.57 5.85 -0.88 -1.08 115.31 121.79 3d4z h LEU 432 Ca 0.01 -0.17 0.11 0.00 0.84 0.00 0.00 57.88 58.67 3d4z h LEU 432 Cb 0.19 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 40.92 3d4z h LEU 432 CO -0.00 0.79 -0.07 -0.03 -0.34 0.00 0.00 178.44 178.80 3d4z h MET 433 N 0.71 0.06 -0.20 1.25 4.05 -0.73 0.11 114.93 120.19 3d4z h MET 433 Ca 0.14 -0.00 -0.20 0.00 -0.28 0.00 0.00 59.70 59.35 3d4z h MET 433 Cb 0.43 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.23 3d4z h MET 433 CO 0.02 0.04 -0.68 1.25 0.23 0.00 0.00 176.91 177.77 3d4z h HIS 434 N 0.06 1.02 0.00 1.39 -0.00 -1.00 -2.36 115.15 114.26 3d4z h HIS 434 Ca 0.28 -0.41 -0.09 0.00 -0.00 0.00 0.00 60.37 60.14 3d4z h HIS 434 Cb 0.44 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.66 3d4z h HIS 434 CO -0.40 1.24 -0.45 1.88 -0.00 0.00 0.00 177.93 180.20 3d4z h TYR 435 N 0.56 0.00 -0.21 5.26 0.05 -0.69 0.39 116.97 122.33 3d4z h TYR 435 Ca -0.02 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.73 3d4z h TYR 435 Cb 1.29 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.02 3d4z h TYR 435 CO 0.08 0.45 0.05 0.28 -1.05 0.00 0.00 178.16 177.96 3d4z h VAL 436 N 0.00 1.21 -0.42 -2.88 2.07 -0.74 0.62 116.25 116.11 3d4z h VAL 436 Ca -0.00 -0.69 0.03 0.00 0.82 0.00 0.00 66.70 66.85 3d4z h VAL 436 Cb 0.80 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 3d4z h VAL 436 CO 0.06 0.22 0.22 -0.09 0.02 0.00 0.00 177.57 177.99 3d4z h ARG 437 N 0.15 0.43 -0.60 1.57 2.43 -0.97 -0.66 114.38 116.73 3d4z h ARG 437 Ca 0.06 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 3d4z h ARG 437 Cb 0.29 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 3d4z h ARG 437 CO 0.00 0.28 0.02 0.00 -1.51 0.00 0.00 179.97 178.77 3d4z h ALA 438 N 1.22 0.91 -0.46 2.80 0.00 -0.75 -0.43 119.26 122.55 3d4z h ALA 438 Ca 0.18 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3d4z h ALA 438 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3d4z h ALA 438 CO -0.12 0.65 -0.15 0.00 0.00 0.00 0.00 179.25 179.63 3d4z h ALA 439 N 1.07 0.64 -0.55 0.00 0.00 -0.64 0.12 119.26 119.90 3d4z h ALA 439 Ca 0.17 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 3d4z h ALA 439 Cb 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3d4z h ALA 439 CO 0.02 0.57 0.10 0.93 0.00 0.00 0.00 179.25 180.87 3d4z h GLU 440 N 0.75 0.90 0.11 0.00 5.08 -0.96 -2.25 114.58 118.21 3d4z h GLU 440 Ca 0.11 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3d4z h GLU 440 Cb 0.71 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3d4z h GLU 440 CO 0.05 0.86 -0.05 1.98 -1.00 0.00 0.00 179.01 180.85 3d4z h MET 441 N 0.79 -0.15 -0.78 2.33 4.05 -0.95 -1.69 114.93 118.53 3d4z h MET 441 Ca 0.17 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.62 3d4z h MET 441 Cb 0.39 0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 31.18 3d4z h MET 441 CO 0.01 0.22 0.51 -0.07 0.23 0.00 0.00 176.91 177.81 3d4z h LEU 442 N -0.54 0.85 0.00 3.39 3.38 -0.78 -1.81 115.31 119.79 3d4z h LEU 442 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3d4z h LEU 442 Cb 0.44 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3d4z h LEU 442 CO 0.03 0.59 -0.34 -1.54 0.09 0.00 0.00 178.44 177.27 3d4z n SER 443 N -4.44 0.73 0.24 -0.43 3.41 -0.85 -3.77 113.62 108.51 3d4z n SER 443 Ca 0.10 0.31 0.11 0.00 -0.26 0.00 0.00 58.87 59.13 3d4z n SER 443 Cb 0.09 -0.26 0.58 0.00 -0.26 0.00 0.00 64.21 64.36 3d4z n SER 443 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d4z h ALA 444 N 2.54 1.14 0.00 7.33 0.00 -0.39 -3.14 119.26 126.74 3d4z h ALA 444 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3d4z h ALA 444 Cb 0.73 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 3d4z h ALA 444 CO 0.00 0.23 -0.08 -1.49 0.00 0.00 0.00 179.25 177.91 3d4z h TRP 445 N 0.00 0.00 -2.68 0.00 4.06 -1.65 -3.43 115.95 112.25 3d4z h TRP 445 Ca -0.00 0.00 -0.54 0.00 2.06 0.00 0.00 58.89 60.41 3d4z h TRP 445 Cb 0.56 0.00 -0.15 0.00 -1.00 0.00 0.00 29.16 28.57 3d4z h TRP 445 CO 0.00 0.08 -0.76 -1.01 -3.56 0.00 0.00 178.44 173.20 3d4z s HIS 446 N -4.42 2.01 0.21 0.49 3.76 -1.19 -5.07 115.29 111.07 3d4z s HIS 446 Ca -0.04 -0.44 -0.27 0.00 -0.15 0.00 0.00 55.06 54.16 3d4z s HIS 446 Cb 0.14 -0.91 -0.08 0.00 1.11 0.00 0.00 32.58 32.83 3d4z s HIS 446 CO 0.59 0.52 0.85 -1.12 -0.85 0.00 0.00 174.74 174.72 3d4z s SER 447 N -3.27 7.48 -0.05 1.40 0.01 -1.26 -4.99 113.70 113.01 3d4z s SER 447 Ca 0.25 1.77 0.06 0.00 1.31 0.00 0.00 55.95 59.33 3d4z s SER 447 Cb -0.04 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 3d4z s SER 447 CO 0.10 0.17 -0.22 0.26 0.41 0.00 0.00 173.24 173.96 3d4z s TRP 448 N -1.20 2.50 0.53 2.43 0.52 -1.26 -5.04 118.94 117.42 3d4z s TRP 448 Ca 0.39 -0.50 -0.22 0.00 0.02 0.00 0.00 56.10 55.79 3d4z s TRP 448 Cb -0.24 -1.60 -0.06 0.00 -1.15 0.00 0.00 33.47 30.42 3d4z s TRP 448 CO 0.28 -0.07 1.19 -3.47 0.02 0.00 0.00 176.95 174.90 3d4z n ASP 449 N 2.69 1.92 0.16 2.95 2.03 -1.26 -4.37 116.55 120.68 3d4z n ASP 449 Ca -0.17 0.95 0.18 0.00 0.52 0.00 0.00 54.79 56.27 3d4z n ASP 449 Cb 0.52 -1.48 0.79 0.00 -0.72 0.00 0.00 41.12 40.22 3d4z n ASP 449 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 3d4z h GLY 450 N 1.25 0.00 2.00 0.27 0.00 -2.01 -0.54 103.07 104.04 3d4z h GLY 450 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3d4z h GLY 450 CO 0.56 0.00 0.00 -0.33 0.00 0.00 0.00 176.54 176.77 3d4z h MET 451 N 0.00 0.00 0.00 4.80 2.86 -2.04 -1.96 114.93 118.59 3d4z h MET 451 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3d4z h MET 451 Cb 0.70 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.36 3d4z h MET 451 CO -0.00 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.97 3d4z h ALA 452 N 2.19 1.00 -2.75 6.32 0.00 -1.44 -3.47 119.26 121.12 3d4z h ALA 452 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.53 3d4z h ALA 452 Cb 0.40 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 3d4z h ALA 452 CO 0.00 0.00 -0.45 0.54 0.00 0.00 0.00 179.25 179.34 3d4z n ARG 453 N -2.37 -1.73 0.08 0.00 1.74 -0.74 -4.89 116.66 108.76 3d4z n ARG 453 Ca 0.03 0.96 -0.13 0.00 -0.77 0.00 0.00 57.85 57.94 3d4z n ARG 453 Cb 0.33 -5.54 -0.08 0.00 -1.02 0.00 0.00 32.46 26.14 3d4z n ARG 453 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3d4z h ILE 454 N 0.00 0.98 -0.96 0.55 1.08 -1.85 -2.00 117.51 115.31 3d4z h ILE 454 Ca -0.43 -0.44 0.04 0.00 -0.39 0.00 0.00 64.86 63.64 3d4z h ILE 454 Cb 1.31 1.25 -0.06 0.00 -3.07 0.00 0.00 36.82 36.26 3d4z h ILE 454 CO 0.54 0.11 0.63 -0.33 -0.69 0.00 0.00 178.15 178.40 3d4z h GLU 455 N -0.38 1.16 -0.13 2.37 3.07 -1.94 -0.15 114.58 118.58 3d4z h GLU 455 Ca -0.02 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 3d4z h GLU 455 Cb 0.31 -0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 3d4z h GLU 455 CO 0.03 0.77 0.04 1.49 -1.40 0.00 0.00 179.01 179.94 3d4z h GLU 456 N 1.20 0.20 -0.65 2.33 4.81 -1.93 -0.01 114.58 120.53 3d4z h GLU 456 Ca 0.39 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.51 3d4z h GLU 456 Cb 0.03 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 3d4z h GLU 456 CO -0.12 0.33 0.17 0.00 -0.73 0.00 0.00 179.01 178.65 3d4z h ARG 457 N 0.03 1.04 -0.46 1.92 -0.00 -0.97 -1.47 114.38 114.46 3d4z h ARG 457 Ca 0.04 -0.25 -0.12 0.00 -0.50 0.00 0.00 59.98 59.16 3d4z h ARG 457 Cb 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 29.97 30.03 3d4z h ARG 457 CO -0.00 0.93 -0.18 -0.07 0.00 0.00 0.00 179.97 180.65 3d4z h LEU 458 N 0.96 0.91 -0.58 3.04 3.38 -0.92 -1.44 115.31 120.68 3d4z h LEU 458 Ca 0.21 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 3d4z h LEU 458 Cb 0.35 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3d4z h LEU 458 CO 0.00 1.07 0.26 -0.08 0.09 0.00 0.00 178.44 179.78 3d4z h GLU 459 N 0.79 0.84 -0.53 1.13 4.81 -0.78 0.52 114.58 121.36 3d4z h GLU 459 Ca 0.11 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 3d4z h GLU 459 Cb 0.72 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 3d4z h GLU 459 CO 0.06 0.70 0.31 0.37 -0.73 0.00 0.00 179.01 179.71 3d4z h GLN 460 N 0.79 0.73 -0.44 1.92 4.15 -1.03 -0.62 115.11 120.60 3d4z h GLN 460 Ca 0.20 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 3d4z h GLN 460 Cb 0.14 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 3d4z h GLN 460 CO -0.02 0.54 0.21 0.00 -1.93 0.00 0.00 178.83 177.63 3d4z h ALA 461 N 1.15 0.57 -0.69 3.38 0.00 -0.90 -0.83 119.26 121.94 3d4z h ALA 461 Ca 0.19 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3d4z h ALA 461 Cb 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3d4z h ALA 461 CO -0.03 0.13 0.22 0.00 0.00 0.00 0.00 179.25 179.56 3d4z h ARG 462 N 0.57 1.06 -0.09 0.00 3.08 -0.73 -2.09 114.38 116.18 3d4z h ARG 462 Ca 0.15 -0.22 -0.18 0.00 0.07 0.00 0.00 59.98 59.81 3d4z h ARG 462 Cb 0.12 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 3d4z h ARG 462 CO -0.02 0.90 -0.70 0.00 -1.07 0.00 0.00 179.97 179.09 3d4z h ARG 463 N 1.02 0.43 -0.24 0.04 3.08 -0.67 0.89 114.38 118.93 3d4z h ARG 463 Ca 0.22 -0.33 -0.17 0.00 0.07 0.00 0.00 59.98 59.77 3d4z h ARG 463 Cb 0.29 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 3d4z h ARG 463 CO -0.01 0.96 -0.55 0.93 -1.07 0.00 0.00 179.97 180.24 3d4z h GLU 464 N 0.30 0.72 -0.54 0.04 4.39 -1.03 0.67 114.58 119.13 3d4z h GLU 464 Ca -0.02 -0.46 -0.09 0.00 0.34 0.00 0.00 59.36 59.12 3d4z h GLU 464 Cb 1.27 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.95 3d4z h GLU 464 CO 0.12 1.08 -0.02 1.25 -1.16 0.00 0.00 179.01 180.29 3d4z h LEU 465 N 0.56 0.96 -0.62 1.33 5.85 -1.34 -2.50 115.31 119.53 3d4z h LEU 465 Ca 0.01 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 3d4z h LEU 465 Cb 1.13 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 3d4z h LEU 465 CO 0.11 1.04 0.37 0.28 -0.34 0.00 0.00 178.44 179.91 3d4z h SER 466 N 0.85 0.75 -0.98 1.25 0.02 -0.64 -2.44 113.55 112.36 3d4z h SER 466 Ca 0.15 -0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.10 3d4z h SER 466 Cb 0.56 -0.19 -0.06 0.00 0.14 0.00 0.00 62.40 62.85 3d4z h SER 466 CO 0.03 0.59 0.64 0.25 -1.14 0.00 0.00 176.83 177.20 3d4z h LEU 467 N 0.84 1.04 -1.88 5.07 5.85 -0.71 -1.69 115.31 123.83 3d4z h LEU 467 Ca 0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3d4z h LEU 467 Cb -0.02 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.79 3d4z h LEU 467 CO -0.04 0.68 0.00 0.15 -0.34 0.00 0.00 178.44 178.89 3d4z h PHE 468 N 1.19 0.00 0.00 1.25 3.57 -0.99 -1.60 116.94 120.35 3d4z h PHE 468 Ca 0.41 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.91 3d4z h PHE 468 Cb 0.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.84 3d4z h PHE 468 CO -0.01 0.00 0.00 1.04 -2.23 0.00 0.00 178.31 177.11 3d4z n GLN 469 N -2.94 0.03 -1.44 1.11 1.13 -0.64 -0.85 117.38 113.79 3d4z n GLN 469 Ca -0.01 0.23 -0.38 0.00 -1.94 0.00 0.00 57.00 54.91 3d4z n GLN 469 Cb 0.20 -1.50 0.04 0.00 0.11 0.00 0.00 30.24 29.10 3d4z n GLN 469 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 3d4z n HIS 470 N -1.47 -0.68 1.51 1.08 -0.00 -0.61 -0.79 115.22 114.26 3d4z n HIS 470 Ca 0.04 0.42 0.05 0.00 -0.00 0.00 0.00 57.72 58.23 3d4z n HIS 470 Cb 0.17 -1.95 0.29 0.00 -0.00 0.00 0.00 29.99 28.50 3d4z n HIS 470 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 3d4z n HIS 471 N -1.82 0.00 -0.04 1.57 1.44 -1.19 -0.54 115.22 114.65 3d4z n HIS 471 Ca 0.11 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.84 3d4z n HIS 471 Cb 0.48 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.62 3d4z n HIS 471 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 3d4z n ASP 472 N -0.70 2.18 0.00 4.39 8.00 -1.26 -4.65 116.55 124.51 3d4z n ASP 472 Ca 0.07 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.61 3d4z n ASP 472 Cb 0.03 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 3d4z n ASP 472 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d4z n GLY 473 N -0.24 0.12 0.35 0.44 0.00 0.30 -3.38 105.19 102.77 3d4z n GLY 473 Ca 0.03 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.22 3d4z n GLY 473 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3d4z h ILE 474 N 0.00 0.50 0.00 -0.61 2.10 -0.98 -0.24 117.51 118.28 3d4z h ILE 474 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 3d4z h ILE 474 Cb 0.00 0.80 0.00 0.00 -1.09 0.00 0.00 36.82 36.53 3d4z h ILE 474 CO 0.00 0.00 0.00 0.71 -1.08 0.00 0.00 178.15 177.78 3d4z h THR 475 N 0.00 0.00 -0.85 2.19 1.35 -1.82 -3.43 112.91 110.36 3d4z h THR 475 Ca 0.12 -0.23 -0.15 0.00 -0.55 0.00 0.00 66.41 65.60 3d4z h THR 475 Cb 0.64 1.06 -0.02 0.00 -1.73 0.00 0.00 68.15 68.09 3d4z h THR 475 CO -0.00 0.00 -0.18 0.61 -0.25 0.00 0.00 175.52 175.70 3d4z n GLY 476 N -0.43 0.34 0.97 5.82 0.00 -0.10 -4.39 105.19 107.39 3d4z n GLY 476 Ca -0.00 -0.62 0.07 0.00 0.00 0.00 0.00 46.02 45.47 3d4z n GLY 476 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d4z n THR 477 N -3.63 2.35 -3.42 2.61 -2.24 -1.25 -4.57 114.28 104.13 3d4z n THR 477 Ca -0.08 -1.95 -0.19 0.00 -2.27 0.00 0.00 64.05 59.55 3d4z n THR 477 Cb 0.47 -0.27 -0.00 0.00 -2.10 0.00 0.00 70.33 68.43 3d4z n THR 477 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d4z s ALA 478 N -2.88 4.17 0.76 6.98 0.00 -1.22 -4.90 121.76 124.68 3d4z s ALA 478 Ca 0.43 -1.40 -0.14 0.00 0.00 0.00 0.00 51.96 50.85 3d4z s ALA 478 Cb 0.35 -1.74 0.06 0.00 0.00 0.00 0.00 23.12 21.79 3d4z s ALA 478 CO 0.08 -0.07 1.17 0.15 0.00 0.00 0.00 175.76 177.10 3d4z s LYS 479 N -4.22 2.01 0.24 0.00 1.02 -0.11 -4.70 119.74 113.98 3d4z s LYS 479 Ca 0.45 1.61 -0.06 0.00 0.02 0.00 0.00 55.97 57.99 3d4z s LYS 479 Cb -0.10 -1.83 0.42 0.00 -0.52 0.00 0.00 37.83 35.80 3d4z s LYS 479 CO 0.32 -1.90 1.69 1.15 -0.92 0.00 0.00 175.35 175.69 3d4z h THR 480 N -0.65 0.53 0.00 2.17 2.02 -1.94 0.94 112.91 115.98 3d4z h THR 480 Ca -0.46 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.62 3d4z h THR 480 Cb 1.28 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.94 3d4z h THR 480 CO 0.49 0.05 -0.07 1.12 0.37 0.00 0.00 175.52 177.48 3d4z h HIS 481 N 0.25 0.00 0.13 3.16 2.07 -1.96 -1.48 115.15 117.33 3d4z h HIS 481 Ca 0.39 0.00 -0.30 0.00 -2.85 0.00 0.00 60.37 57.61 3d4z h HIS 481 Cb 0.65 0.00 0.03 0.00 2.57 0.00 0.00 27.41 30.66 3d4z h HIS 481 CO -0.27 0.07 -1.27 0.28 -3.07 0.00 0.00 177.93 173.67 3d4z h VAL 482 N 0.00 1.29 -0.97 6.12 2.07 -1.20 -2.28 116.25 121.27 3d4z h VAL 482 Ca -0.00 -2.49 0.04 0.00 0.82 0.00 0.00 66.70 65.06 3d4z h VAL 482 Cb 0.60 2.72 -0.06 0.00 -1.52 0.00 0.00 31.29 33.03 3d4z h VAL 482 CO 0.01 0.76 0.63 0.58 0.02 0.00 0.00 177.57 179.57 3d4z h VAL 483 N 0.27 1.17 -0.66 2.57 2.07 -0.60 -0.76 116.25 120.30 3d4z h VAL 483 Ca -0.19 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 3d4z h VAL 483 Cb 1.94 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 3d4z h VAL 483 CO 0.24 0.22 0.37 0.58 0.02 0.00 0.00 177.57 179.00 3d4z h VAL 484 N 1.22 1.21 -0.60 2.57 2.07 -1.24 -0.09 116.25 121.38 3d4z h VAL 484 Ca 0.38 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.40 3d4z h VAL 484 Cb 0.00 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 3d4z h VAL 484 CO -0.12 0.22 0.40 -0.78 0.02 0.00 0.00 177.57 177.32 3d4z h ASP 485 N 0.91 0.69 -0.83 0.57 3.58 -0.71 -0.24 116.42 120.39 3d4z h ASP 485 Ca 0.23 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.63 3d4z h ASP 485 Cb 0.03 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 3d4z h ASP 485 CO -0.04 0.50 0.36 1.88 -2.88 0.00 0.00 179.24 179.06 3d4z h TYR 486 N 0.81 1.23 -0.46 0.28 0.05 -0.62 -1.14 116.97 117.12 3d4z h TYR 486 Ca 0.22 -0.08 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 3d4z h TYR 486 Cb -0.09 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.26 3d4z h TYR 486 CO -0.03 0.91 0.08 1.49 -1.05 0.00 0.00 178.16 179.56 3d4z h GLU 487 N 1.19 0.76 -0.63 4.88 4.81 -0.63 -0.31 114.58 124.65 3d4z h GLU 487 Ca 0.28 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3d4z h GLU 487 Cb 0.17 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 3d4z h GLU 487 CO -0.03 0.77 0.33 1.96 -0.73 0.00 0.00 179.01 181.31 3d4z h GLN 488 N 0.63 0.89 -0.47 1.92 4.20 -0.79 0.79 115.11 122.29 3d4z h GLN 488 Ca 0.14 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 3d4z h GLN 488 Cb 0.37 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 3d4z h GLN 488 CO 0.01 0.69 0.24 0.00 -0.67 0.00 0.00 178.83 179.09 3d4z h ARG 489 N 0.87 0.67 -0.05 1.46 3.08 -1.04 -1.40 114.38 117.95 3d4z h ARG 489 Ca 0.22 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 60.09 3d4z h ARG 489 Cb 0.07 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3d4z h ARG 489 CO -0.03 0.55 -0.38 0.52 -1.07 0.00 0.00 179.97 179.55 3d4z h MET 490 N 0.61 0.11 -0.67 0.04 2.86 -0.59 -1.07 114.93 116.23 3d4z h MET 490 Ca 0.16 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.67 3d4z h MET 490 Cb 0.10 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 3d4z h MET 490 CO -0.02 0.48 0.09 0.37 1.06 0.00 0.00 176.91 178.89 3d4z h GLN 491 N 0.10 1.12 -0.50 1.72 5.75 -0.43 0.49 115.11 123.35 3d4z h GLN 491 Ca 0.01 -0.31 -0.09 0.00 -0.15 0.00 0.00 58.65 58.10 3d4z h GLN 491 Cb 0.73 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.13 3d4z h GLN 491 CO 0.05 1.03 -0.07 0.93 -2.65 0.00 0.00 178.83 178.13 3d4z h GLU 492 N 1.04 0.88 -0.66 1.69 4.39 -0.88 -1.90 114.58 119.15 3d4z h GLU 492 Ca 0.20 -0.28 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 3d4z h GLU 492 Cb 0.47 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.01 3d4z h GLU 492 CO 0.02 0.92 0.33 0.00 -1.16 0.00 0.00 179.01 179.12 3d4z h ALA 493 N 1.12 0.85 -0.69 3.43 0.00 -0.72 -0.42 119.26 122.82 3d4z h ALA 493 Ca 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d4z h ALA 493 Cb 0.57 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3d4z h ALA 493 CO 0.03 0.40 0.42 -0.07 0.00 0.00 0.00 179.25 180.03 3d4z h LEU 494 N 0.91 0.83 -0.97 0.00 3.38 -0.55 0.29 115.31 119.19 3d4z h LEU 494 Ca 0.23 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3d4z h LEU 494 Cb 0.09 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 3d4z h LEU 494 CO -0.03 0.65 0.57 0.11 0.09 0.00 0.00 178.44 179.83 3d4z h LYS 495 N 0.95 1.28 -0.50 1.13 1.57 -0.98 0.09 116.57 120.10 3d4z h LYS 495 Ca 0.25 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3d4z h LYS 495 Cb -0.04 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 31.98 3d4z h LYS 495 CO -0.05 0.89 0.20 0.00 -0.57 0.00 0.00 179.45 179.93 3d4z h ALA 496 N 1.33 0.64 -0.37 3.86 0.00 -0.62 -1.05 119.26 123.06 3d4z h ALA 496 Ca 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3d4z h ALA 496 Cb -0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3d4z h ALA 496 CO -0.06 0.25 0.17 0.00 0.00 0.00 0.00 179.25 179.61 3d4z h GLN 498 N 0.46 0.78 -0.32 0.00 4.15 -0.76 0.11 115.11 119.53 3d4z h GLN 498 Ca 0.13 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 3d4z h GLN 498 Cb 0.13 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 3d4z h GLN 498 CO -0.02 0.52 0.20 1.98 -1.93 0.00 0.00 178.83 179.58 3d4z h MET 499 N 0.80 0.43 -0.33 1.69 4.05 -0.80 0.12 114.93 120.89 3d4z h MET 499 Ca 0.30 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.65 3d4z h MET 499 Cb 0.10 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 3d4z h MET 499 CO -0.14 0.31 0.08 0.28 0.23 0.00 0.00 176.91 177.67 3d4z h VAL 500 N 0.42 1.22 -0.43 -5.77 2.07 -0.95 -1.98 116.25 110.82 3d4z h VAL 500 Ca 0.12 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.90 3d4z h VAL 500 Cb -0.01 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3d4z h VAL 500 CO -0.02 0.25 0.28 0.24 0.02 0.00 0.00 177.57 178.34 3d4z h MET 501 N 0.37 0.56 -0.10 1.57 2.07 -0.50 -1.16 114.93 117.73 3d4z h MET 501 Ca 0.10 -0.03 -0.19 0.00 -2.07 0.00 0.00 59.70 57.51 3d4z h MET 501 Cb 0.30 -0.13 -0.00 0.00 -1.87 0.00 0.00 31.60 29.90 3d4z h MET 501 CO 0.00 0.37 -0.73 -0.56 1.07 0.00 0.00 176.91 177.06 3d4z h GLN 502 N 0.57 0.51 -0.69 1.72 -0.00 -0.66 0.06 115.11 116.62 3d4z h GLN 502 Ca 0.16 -0.41 -0.02 0.00 -0.00 0.00 0.00 58.65 58.38 3d4z h GLN 502 Cb -0.05 0.08 -0.03 0.00 -0.00 0.00 0.00 27.48 27.48 3d4z h GLN 502 CO -0.04 1.04 0.34 1.96 -0.00 0.00 0.00 178.83 182.13 3d4z h GLN 503 N 0.35 0.97 -0.47 0.06 1.08 -1.24 -1.78 115.11 114.08 3d4z h GLN 503 Ca -0.03 -0.12 -0.12 0.00 -1.45 0.00 0.00 58.65 56.93 3d4z h GLN 503 Cb 1.31 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.54 3d4z h GLN 503 CO 0.13 0.74 -0.16 0.77 -0.95 0.00 0.00 178.83 179.36 3d4z h SER 504 N 0.97 0.96 -0.58 1.46 0.02 -0.72 -1.78 113.55 113.87 3d4z h SER 504 Ca 0.24 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 3d4z h SER 504 Cb 0.08 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 3d4z h SER 504 CO -0.03 1.12 0.32 0.58 -1.14 0.00 0.00 176.83 177.68 3d4z h VAL 505 N 0.79 1.19 -0.96 2.27 2.07 -0.81 -0.17 116.25 120.63 3d4z h VAL 505 Ca 0.11 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 3d4z h VAL 505 Cb 0.73 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3d4z h VAL 505 CO 0.06 0.20 0.58 0.22 0.02 0.00 0.00 177.57 178.65 3d4z h TYR 506 N 0.78 1.26 -0.22 1.57 3.20 -1.14 -1.29 116.97 121.13 3d4z h TYR 506 Ca 0.20 -0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.89 3d4z h TYR 506 Cb 0.04 -0.41 -0.00 0.00 1.54 0.00 0.00 36.73 37.89 3d4z h TYR 506 CO -0.01 0.83 -0.59 -0.09 -1.64 0.00 0.00 178.16 176.66 3d4z h ARG 507 N 1.32 0.73 0.00 1.82 2.43 -0.96 -2.82 114.38 116.90 3d4z h ARG 507 Ca 0.34 -0.49 -0.05 0.00 -0.81 0.00 0.00 59.98 58.98 3d4z h ARG 507 Cb -0.06 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 3d4z h ARG 507 CO -0.07 1.11 -0.24 -0.07 -1.51 0.00 0.00 179.97 179.19 3d4z h LEU 508 N 0.55 0.00 -3.05 3.80 3.38 -0.66 -3.27 115.31 116.06 3d4z h LEU 508 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3d4z h LEU 508 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 3d4z h LEU 508 CO 0.12 0.24 -0.13 0.18 0.09 0.00 0.00 178.44 178.95 3d4z n LEU 509 N -3.36 2.69 -4.24 1.67 4.77 -0.52 -4.84 117.00 113.18 3d4z n LEU 509 Ca 0.00 -3.32 -0.31 0.00 -0.03 0.00 0.00 56.01 52.36 3d4z n LEU 509 Cb 0.46 -0.48 -0.16 0.00 -2.33 0.00 0.00 43.42 40.91 3d4z n LEU 509 CO 0.34 0.91 -0.55 -0.89 -1.33 0.00 0.00 177.39 175.87 3d4z s THR 510 N -2.98 1.95 0.00 -5.08 2.01 -1.07 -0.36 115.64 110.10 3d4z s THR 510 Ca 0.35 -1.00 -0.37 0.00 0.31 0.00 0.00 61.69 60.98 3d4z s THR 510 Cb 0.32 -1.66 -0.16 0.00 0.01 0.00 0.00 72.50 71.01 3d4z s THR 510 CO 0.01 0.54 1.48 1.17 -0.69 0.00 0.00 174.62 177.13 3d4z n LYS 511 N 3.07 1.28 -0.35 4.92 4.81 0.14 -4.69 118.16 127.35 3d4z n LYS 511 Ca -0.18 0.46 0.09 0.00 -0.87 0.00 0.00 58.31 57.82 3d4z n LYS 511 Cb 0.52 -2.14 0.28 0.00 0.02 0.00 0.00 35.03 33.72 3d4z n LYS 511 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 3d4z h PRO 512 N 5.50 0.87 -0.02 1.64 0.11 -1.92 0.37 132.00 138.55 3d4z h PRO 512 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3d4z h PRO 512 Cb 1.32 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3d4z h PRO 512 CO 0.84 0.58 0.00 -1.13 -0.21 0.00 0.00 178.00 178.07 3d4z n SER 513 N -4.64 0.24 -0.03 -2.05 3.41 -1.26 -3.07 113.62 106.21 3d4z n SER 513 Ca 0.20 -1.42 -0.01 0.00 -0.26 0.00 0.00 58.87 57.38 3d4z n SER 513 Cb 0.42 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 64.28 3d4z n SER 513 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3d4z n ILE 514 N -0.65 0.42 -1.70 -1.33 5.41 -0.02 -5.02 119.36 116.48 3d4z n ILE 514 Ca 0.15 -0.36 -0.55 0.00 1.00 0.00 0.00 62.75 62.99 3d4z n ILE 514 Cb 0.11 -0.35 -0.07 0.00 -0.71 0.00 0.00 39.64 38.63 3d4z n ILE 514 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3d4z n TYR 515 N -2.18 2.13 -3.24 1.39 9.36 -0.40 -4.90 117.16 119.32 3d4z n TYR 515 Ca -0.11 0.38 -0.25 0.00 3.32 0.00 0.00 57.90 61.24 3d4z n TYR 515 Cb 0.62 -2.52 -0.08 0.00 -0.63 0.00 0.00 39.34 36.73 3d4z n TYR 515 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3d4z n SER 516 N 5.85 0.07 -4.78 2.98 2.88 -1.26 -5.04 113.62 114.32 3d4z n SER 516 Ca 0.26 -2.63 -0.37 0.00 -1.33 0.00 0.00 58.87 54.79 3d4z n SER 516 Cb 0.18 -0.62 -0.04 0.00 -0.75 0.00 0.00 64.21 62.97 3d4z n SER 516 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3d4z s PRO 517 N -0.93 4.27 -0.27 -1.46 0.04 -1.26 -5.03 135.00 130.36 3d4z s PRO 517 Ca 0.35 1.57 -0.06 0.00 0.04 0.00 0.00 61.00 62.90 3d4z s PRO 517 Cb 0.14 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 32.00 3d4z s PRO 517 CO -0.13 -0.06 0.04 0.34 0.04 0.00 0.00 177.00 177.23 3d4z s ASP 518 N -1.42 4.89 0.00 6.66 -1.08 -1.26 -5.02 116.67 119.45 3d4z s ASP 518 Ca 0.55 -0.61 0.21 0.00 -0.52 0.00 0.00 52.55 52.18 3d4z s ASP 518 Cb -0.24 -1.84 1.14 0.00 -1.46 0.00 0.00 42.92 40.52 3d4z s ASP 518 CO 0.30 -0.13 1.65 0.49 0.52 0.00 0.00 175.17 178.00 3d4z n PHE 519 N 4.84 0.00 0.85 -5.34 3.72 -1.26 -1.29 117.46 118.98 3d4z n PHE 519 Ca -0.16 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.35 3d4z n PHE 519 Cb 0.49 -0.16 -0.09 0.00 -0.94 0.00 0.00 39.48 38.77 3d4z n PHE 519 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3d4z n SER 520 N -1.16 0.82 -4.83 4.37 3.41 -1.26 -4.97 113.62 110.00 3d4z n SER 520 Ca 0.12 -0.78 -0.32 0.00 -0.26 0.00 0.00 58.87 57.63 3d4z n SER 520 Cb 0.12 1.06 -0.03 0.00 -0.26 0.00 0.00 64.21 65.10 3d4z n SER 520 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3d4z s PHE 521 N -3.08 3.36 -0.57 7.33 5.36 -0.41 -5.03 117.98 124.94 3d4z s PHE 521 Ca 0.06 1.50 -0.17 0.00 -0.96 0.00 0.00 56.93 57.36 3d4z s PHE 521 Cb 0.16 -2.84 0.13 0.00 -0.34 0.00 0.00 43.02 40.13 3d4z s PHE 521 CO 0.86 -0.44 0.58 0.45 -1.46 0.00 0.00 175.22 175.21 3d4z s SER 522 N -2.88 6.22 0.05 6.13 0.15 -1.26 -4.90 113.70 117.22 3d4z s SER 522 Ca 0.60 -1.74 0.02 0.00 0.70 0.00 0.00 55.95 55.53 3d4z s SER 522 Cb -0.11 -2.24 -0.25 0.00 -1.71 0.00 0.00 66.02 61.71 3d4z s SER 522 CO 0.29 -0.92 1.04 1.88 1.20 0.00 0.00 173.24 176.73 3d4z h TYR 523 N 8.92 0.25 -3.87 3.44 0.05 -1.95 -3.43 116.97 120.38 3d4z h TYR 523 Ca -0.27 -0.19 -0.28 0.00 0.05 0.00 0.00 58.73 58.04 3d4z h TYR 523 Cb 1.09 -0.01 -0.19 0.00 1.01 0.00 0.00 36.73 38.63 3d4z h TYR 523 CO 0.78 1.18 -0.73 -0.06 -1.05 0.00 0.00 178.16 178.29 3d4z s PHE 524 N -2.65 0.85 0.09 4.88 0.40 -1.26 -0.30 117.98 119.99 3d4z s PHE 524 Ca -0.04 -0.64 0.08 0.00 -0.60 0.00 0.00 56.93 55.73 3d4z s PHE 524 Cb 0.08 -0.49 -0.04 0.00 0.51 0.00 0.00 43.02 43.08 3d4z s PHE 524 CO 0.85 -0.07 -0.16 0.95 0.70 0.00 0.00 175.22 177.48 3d4z s THR 525 N -2.21 2.98 0.33 0.64 -4.23 -0.69 -4.86 115.64 107.60 3d4z s THR 525 Ca -0.00 -1.36 -0.27 0.00 -1.18 0.00 0.00 61.69 58.88 3d4z s THR 525 Cb -0.04 -2.35 -0.09 0.00 1.34 0.00 0.00 72.50 71.35 3d4z s THR 525 CO -0.01 0.16 1.07 -0.76 -0.54 0.00 0.00 174.62 174.54 3d4z s LEU 526 N -1.99 4.39 -0.17 4.79 1.43 -1.26 -0.83 118.68 125.04 3d4z s LEU 526 Ca 0.18 2.16 0.01 0.00 -1.03 0.00 0.00 54.13 55.45 3d4z s LEU 526 Cb -0.11 -3.85 0.01 0.00 0.03 0.00 0.00 46.19 42.27 3d4z s LEU 526 CO 0.10 -0.27 -0.18 -0.62 0.23 0.00 0.00 176.35 175.61 3d4z s ASP 527 N -1.18 3.32 -0.17 2.29 2.15 0.08 -4.92 116.67 118.25 3d4z s ASP 527 Ca 0.50 -0.59 0.00 0.00 0.43 0.00 0.00 52.55 52.89 3d4z s ASP 527 Cb -0.28 -1.51 0.04 0.00 -0.30 0.00 0.00 42.92 40.87 3d4z s ASP 527 CO 0.35 0.03 -0.10 -0.62 -0.17 0.00 0.00 175.17 174.66 3d4z s ASP 528 N 1.12 3.03 0.28 -0.34 -1.08 -1.26 -4.11 116.67 114.32 3d4z s ASP 528 Ca 0.01 -0.71 0.26 0.00 -0.52 0.00 0.00 52.55 51.58 3d4z s ASP 528 Cb -0.14 -1.12 0.85 0.00 -1.46 0.00 0.00 42.92 41.05 3d4z s ASP 528 CO -0.07 -0.13 1.76 0.28 0.52 0.00 0.00 175.17 177.52 3d4z h SER 529 N 8.04 0.00 0.00 -0.34 0.02 -1.99 -3.33 113.55 115.95 3d4z h SER 529 Ca -0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 3d4z h SER 529 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 3d4z h SER 529 CO 0.47 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.70 3d4z n ARG 530 N -2.44 0.99 -3.74 3.45 1.74 -1.26 -4.49 116.66 110.91 3d4z n ARG 530 Ca 0.04 -0.91 -0.14 0.00 -0.77 0.00 0.00 57.85 56.08 3d4z n ARG 530 Cb 0.37 -0.90 -0.14 0.00 -1.02 0.00 0.00 32.46 30.77 3d4z n ARG 530 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 3d4z s TRP 531 N -0.45 -0.20 -0.41 -1.55 -0.11 -1.25 -3.99 118.94 110.97 3d4z s TRP 531 Ca 0.00 0.55 0.24 0.00 1.22 0.00 0.00 56.10 58.11 3d4z s TRP 531 Cb 0.00 -0.08 1.03 0.00 -1.50 0.00 0.00 33.47 32.92 3d4z s TRP 531 CO 0.00 -0.19 1.71 -2.30 -4.62 0.00 0.00 176.95 171.55 3d4z n PRO 532 N 4.34 0.19 0.00 5.86 -0.02 -1.26 -4.70 135.00 139.41 3d4z n PRO 532 Ca -0.24 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 3d4z n PRO 532 Cb 0.52 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 3d4z n PRO 532 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d4z n GLY 533 N -0.21 2.12 3.61 -1.23 0.00 -1.26 -4.28 105.19 103.95 3d4z n GLY 533 Ca 0.01 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 3d4z n GLY 533 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d4z s SER 534 N -0.08 5.91 0.00 1.61 0.15 -1.26 -0.93 113.70 119.09 3d4z s SER 534 Ca 0.00 1.79 0.00 0.00 0.70 0.00 0.00 55.95 58.44 3d4z s SER 534 Cb 0.00 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 3d4z s SER 534 CO 0.00 -1.62 0.00 0.61 1.20 0.00 0.00 173.24 173.43 3d4z n GLY 535 N 5.27 0.73 0.12 9.45 0.00 -1.26 -4.88 105.19 114.62 3d4z n GLY 535 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 3d4z n GLY 535 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3d4z n VAL 536 N -2.12 1.52 -3.74 1.61 0.31 -0.11 -4.96 118.33 110.84 3d4z n VAL 536 Ca 0.00 -0.18 -0.14 0.00 -0.01 0.00 0.00 64.34 64.01 3d4z n VAL 536 Cb 0.00 -2.04 -0.09 0.00 -0.91 0.00 0.00 33.84 30.80 3d4z n VAL 536 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 3d4z s GLU 537 N -2.58 0.63 -1.23 5.55 2.12 -1.00 -4.99 118.70 117.21 3d4z s GLU 537 Ca -0.34 0.03 -0.12 0.00 0.36 0.00 0.00 54.97 54.91 3d4z s GLU 537 Cb 0.10 0.29 0.18 0.00 0.26 0.00 0.00 34.13 34.96 3d4z s GLU 537 CO 0.47 -0.16 1.59 -3.47 -0.54 0.00 0.00 175.26 173.16 3d4z n ASP 538 N 1.69 5.22 -0.89 -1.70 -0.08 -1.26 -4.61 116.55 114.92 3d4z n ASP 538 Ca -0.19 -3.04 0.07 0.00 -1.51 0.00 0.00 54.79 50.11 3d4z n ASP 538 Cb 0.56 -1.52 0.24 0.00 2.34 0.00 0.00 41.12 42.75 3d4z n ASP 538 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3d4z n SER 539 N 4.74 3.59 -4.69 1.67 3.41 -1.26 -4.97 113.62 116.10 3d4z n SER 539 Ca 0.37 -3.14 -0.35 0.00 -0.26 0.00 0.00 58.87 55.49 3d4z n SER 539 Cb 0.40 -0.55 -0.09 0.00 -0.26 0.00 0.00 64.21 63.70 3d4z n SER 539 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3d4z s ARG 540 N -2.90 3.62 0.15 4.33 0.52 -1.26 -4.91 118.95 118.50 3d4z s ARG 540 Ca 0.42 -0.32 -0.30 0.00 -0.52 0.00 0.00 55.73 55.01 3d4z s ARG 540 Cb 0.35 -3.10 -0.07 0.00 0.52 0.00 0.00 34.95 32.65 3d4z s ARG 540 CO 0.07 0.48 1.12 0.99 0.02 0.00 0.00 175.30 177.99 3d4z s THR 541 N -0.23 3.91 -0.13 0.02 2.01 -1.26 -5.04 115.64 114.92 3d4z s THR 541 Ca 0.08 1.58 -0.17 0.00 0.31 0.00 0.00 61.69 63.48 3d4z s THR 541 Cb -0.12 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 3d4z s THR 541 CO 0.01 0.24 0.45 -0.89 -0.69 0.00 0.00 174.62 173.74 3d4z s THR 542 N 0.05 5.20 -0.23 -0.82 2.01 -1.26 -4.41 115.64 116.19 3d4z s THR 542 Ca 0.51 0.88 -0.29 0.00 0.31 0.00 0.00 61.69 63.11 3d4z s THR 542 Cb -0.29 -3.79 -0.01 0.00 0.01 0.00 0.00 72.50 68.42 3d4z s THR 542 CO 0.34 0.32 1.36 -0.63 -0.69 0.00 0.00 174.62 175.32 3d4z s ILE 543 N 0.68 4.09 -0.33 1.82 1.01 0.48 -4.92 121.20 124.04 3d4z s ILE 543 Ca 0.24 1.27 -0.12 0.00 0.00 0.00 0.00 60.65 62.03 3d4z s ILE 543 Cb -0.15 -3.99 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 3d4z s ILE 543 CO 0.09 -0.30 0.23 -0.63 0.00 0.00 0.00 174.94 174.33 3d4z s ILE 544 N 4.18 5.29 0.17 2.92 -1.09 -1.26 -1.35 121.20 130.06 3d4z s ILE 544 Ca 0.59 -0.14 0.10 0.00 -2.23 0.00 0.00 60.65 58.97 3d4z s ILE 544 Cb -0.21 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 3d4z s ILE 544 CO 0.21 0.04 -0.21 -0.76 -1.23 0.00 0.00 174.94 172.99 3d4z s LEU 545 N 1.73 2.42 -0.28 2.97 1.43 -1.26 -4.76 118.68 120.94 3d4z s LEU 545 Ca 0.06 -0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 52.02 3d4z s LEU 545 Cb -0.17 -1.01 0.19 0.00 0.03 0.00 0.00 46.19 45.23 3d4z s LEU 545 CO 0.11 0.05 1.35 -0.83 0.23 0.00 0.00 176.35 177.26 3d4z s GLY 546 N -2.61 0.09 0.45 -3.19 0.00 -0.10 -4.79 107.32 97.18 3d4z s GLY 546 Ca 0.18 2.85 0.13 0.00 0.00 0.00 0.00 44.72 47.88 3d4z s GLY 546 CO 0.08 1.16 2.03 -2.09 0.00 0.00 0.00 173.10 174.29 3d4z h GLU 547 N 2.15 0.34 -0.53 2.90 4.81 -1.96 -1.14 114.58 121.16 3d4z h GLU 547 Ca -0.10 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 3d4z h GLU 547 Cb 1.19 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.49 3d4z h GLU 547 CO 0.22 0.23 0.00 -0.25 -0.73 0.00 0.00 179.01 178.48 3d4z n ASP 548 N -4.48 3.05 0.01 1.04 8.00 -1.26 -4.65 116.55 118.26 3d4z n ASP 548 Ca 0.06 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.58 3d4z n ASP 548 Cb 0.25 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 3d4z n ASP 548 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d4z n ILE 549 N 1.18 0.00 -3.27 0.53 3.06 -0.67 -5.10 119.36 115.08 3d4z n ILE 549 Ca 0.19 0.00 0.03 0.00 -2.50 0.00 0.00 62.75 60.47 3d4z n ILE 549 Cb 0.49 -0.58 -0.02 0.00 0.54 0.00 0.00 39.64 40.08 3d4z n ILE 549 CO 0.00 0.00 0.00 -0.22 -2.50 0.00 0.00 176.55 173.83 3d4z s LEU 550 N -5.16 -1.18 0.29 9.51 2.96 -0.52 -4.93 118.68 119.65 3d4z s LEU 550 Ca 0.00 0.95 0.13 0.00 -0.22 0.00 0.00 54.13 54.99 3d4z s LEU 550 Cb 0.00 2.07 0.41 0.00 0.50 0.00 0.00 46.19 49.17 3d4z s LEU 550 CO 0.00 -0.22 1.62 -0.65 -1.32 0.00 0.00 176.35 175.78 3d4z h PRO 551 N 7.97 0.00 -3.47 0.98 0.11 -1.89 -0.22 132.00 135.48 3d4z h PRO 551 Ca -0.20 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.87 3d4z h PRO 551 Cb 1.15 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.15 3d4z h PRO 551 CO 0.17 0.57 -0.06 -1.54 -0.21 0.00 0.00 178.00 176.93 3d4z s SER 552 N -6.70 -0.17 -0.05 -2.05 1.04 -1.26 -1.31 113.70 103.20 3d4z s SER 552 Ca -0.01 -0.63 -0.02 0.00 0.48 0.00 0.00 55.95 55.77 3d4z s SER 552 Cb 0.12 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.82 3d4z s SER 552 CO 0.74 -1.04 0.11 -0.75 0.98 0.00 0.00 173.24 173.28 3d4z s LYS 553 N -3.92 0.07 0.15 4.02 2.47 0.20 -4.97 119.74 117.77 3d4z s LYS 553 Ca 0.13 0.27 -0.25 0.00 -1.56 0.00 0.00 55.97 54.56 3d4z s LYS 553 Cb -0.00 -0.13 -0.08 0.00 -1.46 0.00 0.00 37.83 36.16 3d4z s LYS 553 CO -0.00 -0.13 0.78 -1.01 0.16 0.00 0.00 175.35 175.15 3d4z s HIS 554 N 0.87 3.89 0.10 4.03 3.76 -1.26 -0.69 115.29 125.99 3d4z s HIS 554 Ca -0.07 1.62 0.07 0.00 -0.15 0.00 0.00 55.06 56.53 3d4z s HIS 554 Cb -0.09 -2.78 -0.03 0.00 1.11 0.00 0.00 32.58 30.79 3d4z s HIS 554 CO -0.04 0.49 -0.16 0.14 -0.85 0.00 0.00 174.74 174.32 3d4z s VAL 555 N -1.02 1.41 -0.03 -0.90 -7.23 -0.06 -1.61 120.40 110.96 3d4z s VAL 555 Ca 0.36 -1.55 0.02 0.00 -1.81 0.00 0.00 61.98 59.01 3d4z s VAL 555 Cb -0.23 -1.41 0.01 0.00 0.56 0.00 0.00 36.38 35.31 3d4z s VAL 555 CO 0.26 -0.24 -0.08 -0.69 -0.31 0.00 0.00 175.10 174.04 3d4z s VAL 556 N -1.55 0.73 -0.07 1.32 1.01 0.06 -0.26 120.40 121.63 3d4z s VAL 556 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.72 3d4z s VAL 556 Cb -0.08 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3d4z s VAL 556 CO 0.03 0.24 -0.06 -0.04 0.00 0.00 0.00 175.10 175.27 3d4z s MET 557 N 0.31 2.78 -0.05 2.72 -1.94 -0.11 -0.36 119.30 122.65 3d4z s MET 557 Ca -0.05 -0.53 0.02 0.00 -1.71 0.00 0.00 55.69 53.42 3d4z s MET 557 Cb -0.09 -2.62 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 3d4z s MET 557 CO 0.01 0.66 -0.08 -1.58 -0.01 0.00 0.00 175.02 174.02 3d4z s HIS 558 N -0.80 2.90 -0.33 -0.03 5.04 -0.03 -1.02 115.29 121.02 3d4z s HIS 558 Ca 0.12 -0.01 0.03 0.00 -1.54 0.00 0.00 55.06 53.66 3d4z s HIS 558 Cb -0.11 -1.68 0.10 0.00 0.04 0.00 0.00 32.58 30.93 3d4z s HIS 558 CO 0.02 0.33 0.05 1.21 -2.34 0.00 0.00 174.74 174.00 3d4z s ASN 559 N -0.95 4.67 0.19 9.88 2.47 -0.33 -1.03 114.94 129.83 3d4z s ASN 559 Ca 0.13 -2.06 0.22 0.00 0.42 0.00 0.00 52.86 51.57 3d4z s ASN 559 Cb -0.11 -1.54 0.90 0.00 -1.45 0.00 0.00 41.25 39.05 3d4z s ASN 559 CO 0.03 -0.37 1.68 1.07 -3.72 0.00 0.00 177.10 175.78 3d4z n THR 560 N 4.33 0.80 -2.79 -5.21 5.66 -1.26 -1.73 114.28 114.07 3d4z n THR 560 Ca 0.02 0.16 -0.37 0.00 -3.05 0.00 0.00 64.05 60.81 3d4z n THR 560 Cb 0.42 -1.03 -0.06 0.00 -1.55 0.00 0.00 70.33 68.11 3d4z n THR 560 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3d4z s LEU 561 N -4.13 4.36 -0.06 1.09 1.43 -1.26 -4.49 118.68 115.62 3d4z s LEU 561 Ca 0.06 1.83 -0.01 0.00 -1.03 0.00 0.00 54.13 54.98 3d4z s LEU 561 Cb 0.10 -3.98 0.02 0.00 0.03 0.00 0.00 46.19 42.36 3d4z s LEU 561 CO 0.40 -0.05 2.14 -0.81 0.23 0.00 0.00 176.35 178.26 3d4z n PRO 562 N 0.61 1.23 -3.84 1.29 -0.04 -1.26 -0.92 135.00 132.07 3d4z n PRO 562 Ca 0.02 -0.37 -0.10 0.00 -0.04 0.00 0.00 63.50 63.00 3d4z n PRO 562 Cb 0.50 -1.20 -0.08 0.00 -0.04 0.00 0.00 33.50 32.68 3d4z n PRO 562 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 3d4z s HIS 563 N -0.25 0.07 0.35 0.54 -3.43 -1.26 -0.34 115.29 110.97 3d4z s HIS 563 Ca 0.11 -0.35 -0.28 0.00 -0.80 0.00 0.00 55.06 53.74 3d4z s HIS 563 Cb 0.07 -0.03 -0.12 0.00 -1.43 0.00 0.00 32.58 31.07 3d4z s HIS 563 CO -0.00 -0.47 1.32 0.91 -2.00 0.00 0.00 174.74 174.50 3d4z n TRP 564 N 0.47 2.38 -3.82 0.38 7.02 -1.26 -3.95 117.44 118.66 3d4z n TRP 564 Ca -0.18 0.54 -0.13 0.00 -1.02 0.00 0.00 57.50 56.71 3d4z n TRP 564 Cb 0.60 -2.43 -0.15 0.00 -2.42 0.00 0.00 31.31 26.91 3d4z n TRP 564 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 3d4z s ARG 565 N -1.92 0.00 -0.08 -0.99 3.52 -0.49 -4.95 118.95 114.05 3d4z s ARG 565 Ca 0.55 0.12 -0.02 0.00 -0.13 0.00 0.00 55.73 56.25 3d4z s ARG 565 Cb -0.55 -0.11 -0.03 0.00 -1.56 0.00 0.00 34.95 32.69 3d4z s ARG 565 CO 0.62 -0.08 0.03 -1.21 -0.81 0.00 0.00 175.30 173.85 3d4z s GLU 566 N 0.54 3.04 -0.25 5.12 2.02 -1.26 -0.62 118.70 127.29 3d4z s GLU 566 Ca -0.04 -0.39 -0.19 0.00 0.02 0.00 0.00 54.97 54.37 3d4z s GLU 566 Cb -0.06 -2.85 0.07 0.00 0.10 0.00 0.00 34.13 31.39 3d4z s GLU 566 CO -0.02 0.70 0.64 -1.14 0.02 0.00 0.00 175.26 175.47 3d4z s GLN 567 N -1.03 0.71 0.33 1.61 0.74 -0.66 -4.99 119.66 116.38 3d4z s GLN 567 Ca 0.15 1.01 -0.28 0.00 0.05 0.00 0.00 55.36 56.28 3d4z s GLN 567 Cb -0.11 0.26 -0.10 0.00 1.10 0.00 0.00 33.01 34.15 3d4z s GLN 567 CO 0.04 -0.12 1.28 -0.51 -0.55 0.00 0.00 175.29 175.43 3d4z s LEU 568 N 0.89 4.41 0.07 3.68 1.43 -1.26 -1.16 118.68 126.74 3d4z s LEU 568 Ca -0.04 2.63 0.07 0.00 -1.03 0.00 0.00 54.13 55.75 3d4z s LEU 568 Cb -0.05 -3.68 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 3d4z s LEU 568 CO -0.08 -0.52 -0.18 0.68 0.23 0.00 0.00 176.35 176.48 3d4z s VAL 569 N -1.16 1.48 0.10 -1.59 -7.23 0.08 -4.91 120.40 107.16 3d4z s VAL 569 Ca 0.49 -1.28 0.06 0.00 -1.81 0.00 0.00 61.98 59.45 3d4z s VAL 569 Cb -0.38 -1.33 -0.03 0.00 0.56 0.00 0.00 36.38 35.19 3d4z s VAL 569 CO 0.51 0.01 -0.16 1.51 -0.31 0.00 0.00 175.10 176.66 3d4z s ASP 570 N -1.48 2.04 0.05 4.85 -4.77 -1.26 -1.47 116.67 114.64 3d4z s ASP 570 Ca 0.04 -0.72 0.02 0.00 -3.30 0.00 0.00 52.55 48.60 3d4z s ASP 570 Cb -0.09 -0.08 -0.03 0.00 -1.09 0.00 0.00 42.92 41.63 3d4z s ASP 570 CO 0.02 -0.07 -0.08 -0.36 0.70 0.00 0.00 175.17 175.38 3d4z s PHE 571 N -1.62 0.75 0.00 2.11 0.40 -0.24 -4.91 117.98 114.47 3d4z s PHE 571 Ca 0.05 -0.56 -0.22 0.00 -0.60 0.00 0.00 56.93 55.59 3d4z s PHE 571 Cb -0.08 -0.44 -0.05 0.00 0.51 0.00 0.00 43.02 42.96 3d4z s PHE 571 CO 0.03 -0.08 0.66 0.71 0.70 0.00 0.00 175.22 177.24 3d4z s TYR 572 N -1.74 3.69 0.07 0.36 1.51 -1.26 -0.79 117.35 119.19 3d4z s TYR 572 Ca -0.06 1.29 0.03 0.00 -1.01 0.00 0.00 57.07 57.32 3d4z s TYR 572 Cb -0.08 -2.70 -0.03 0.00 -0.11 0.00 0.00 41.96 39.05 3d4z s TYR 572 CO -0.00 0.30 -0.09 0.14 -1.11 0.00 0.00 175.55 174.79 3d4z s VAL 573 N -0.04 0.73 -2.18 0.71 -7.23 0.61 -0.38 120.40 112.62 3d4z s VAL 573 Ca 0.34 -1.45 0.20 0.00 -1.81 0.00 0.00 61.98 59.26 3d4z s VAL 573 Cb -0.19 -1.10 0.49 0.00 0.56 0.00 0.00 36.38 36.14 3d4z s VAL 573 CO 0.19 -0.53 1.62 -1.54 -0.31 0.00 0.00 175.10 174.53 3d4z n SER 574 N 0.85 1.06 -3.92 4.85 3.41 -0.46 -0.31 113.62 119.11 3d4z n SER 574 Ca -0.18 -1.59 -0.10 0.00 -0.26 0.00 0.00 58.87 56.73 3d4z n SER 574 Cb 0.57 -0.06 -0.11 0.00 -0.26 0.00 0.00 64.21 64.34 3d4z n SER 574 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3d4z s SER 575 N -1.59 0.12 0.00 4.04 0.15 -1.26 -4.76 113.70 110.40 3d4z s SER 575 Ca 0.31 -0.29 0.27 0.00 0.70 0.00 0.00 55.95 56.94 3d4z s SER 575 Cb 0.16 0.13 1.15 0.00 -1.71 0.00 0.00 66.02 65.76 3d4z s SER 575 CO 0.25 -0.26 1.87 -0.81 1.20 0.00 0.00 173.24 175.48 3d4z n PRO 576 N 1.85 0.00 -3.09 5.44 -0.04 -1.26 -4.42 135.00 133.48 3d4z n PRO 576 Ca -0.21 0.04 -0.44 0.00 -0.04 0.00 0.00 63.50 62.85 3d4z n PRO 576 Cb 0.56 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.52 3d4z n PRO 576 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3d4z n PHE 577 N -1.51 3.42 -4.83 0.54 3.72 -1.26 -4.93 117.46 112.60 3d4z n PHE 577 Ca 0.07 -3.08 -0.25 0.00 -0.05 0.00 0.00 57.45 54.14 3d4z n PHE 577 Cb 0.32 -1.47 -0.15 0.00 -0.94 0.00 0.00 39.48 37.24 3d4z n PHE 577 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3d4z s VAL 578 N -2.03 1.37 0.20 -4.37 1.01 -1.26 -0.84 120.40 114.48 3d4z s VAL 578 Ca 0.32 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.66 3d4z s VAL 578 Cb -0.00 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 3d4z s VAL 578 CO 0.03 0.39 -0.18 -0.94 0.00 0.00 0.00 175.10 174.40 3d4z s SER 579 N -0.32 2.93 -0.05 3.32 1.04 0.23 -4.78 113.70 116.06 3d4z s SER 579 Ca 0.05 -0.93 0.05 0.00 0.48 0.00 0.00 55.95 55.59 3d4z s SER 579 Cb -0.08 -0.19 -0.02 0.00 0.10 0.00 0.00 66.02 65.83 3d4z s SER 579 CO -0.00 -0.03 -0.19 -0.69 0.98 0.00 0.00 173.24 173.31 3d4z s VAL 580 N -2.31 2.67 0.12 5.02 1.01 -1.26 -0.75 120.40 124.90 3d4z s VAL 580 Ca 0.21 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.37 3d4z s VAL 580 Cb -0.05 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 3d4z s VAL 580 CO 0.09 0.58 -0.12 0.42 0.00 0.00 0.00 175.10 176.07 3d4z s THR 581 N -0.54 1.14 0.46 3.92 -4.23 -0.50 -0.79 115.64 115.10 3d4z s THR 581 Ca 0.07 -1.75 -0.04 0.00 -1.18 0.00 0.00 61.69 58.80 3d4z s THR 581 Cb -0.11 -1.51 0.10 0.00 1.34 0.00 0.00 72.50 72.31 3d4z s THR 581 CO 0.01 -0.53 0.63 -0.90 -0.54 0.00 0.00 174.62 173.28 3d4z n ASP 582 N 0.41 0.49 -1.47 3.99 5.68 -0.52 -0.55 116.55 124.57 3d4z n ASP 582 Ca -0.15 -1.49 -0.03 0.00 -0.50 0.00 0.00 54.79 52.62 3d4z n ASP 582 Cb 0.58 -0.44 0.19 0.00 -1.14 0.00 0.00 41.12 40.31 3d4z n ASP 582 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 3d4z n LEU 583 N 0.00 4.33 -0.67 -2.12 0.00 -1.21 -1.09 117.00 116.24 3d4z n LEU 583 Ca 0.09 -2.23 0.07 0.00 0.00 0.00 0.00 56.01 53.94 3d4z n LEU 583 Cb 0.33 -0.64 0.20 0.00 0.00 0.00 0.00 43.42 43.30 3d4z n LEU 583 CO 0.23 0.60 0.66 0.00 0.00 0.00 0.00 177.39 178.87 3d4z n ALA 584 N 0.06 2.61 -1.65 1.96 0.00 -1.26 -4.85 120.51 117.38 3d4z n ALA 584 Ca 0.23 -1.90 -0.15 0.00 0.00 0.00 0.00 53.44 51.62 3d4z n ALA 584 Cb 0.95 -0.55 -0.05 0.00 0.00 0.00 0.00 19.45 19.81 3d4z n ALA 584 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3d4z n ASN 585 N -0.30 -4.77 -4.72 0.00 5.15 -0.25 -4.98 115.26 105.40 3d4z n ASN 585 Ca 0.16 0.28 -0.42 0.00 -0.60 0.00 0.00 54.58 54.00 3d4z n ASN 585 Cb 0.68 -3.68 -0.03 0.00 -0.53 0.00 0.00 39.78 36.22 3d4z n ASN 585 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3d4z s ASN 586 N -2.71 7.32 0.50 1.20 0.01 -1.26 -4.80 114.94 115.20 3d4z s ASN 586 Ca 0.00 1.80 -0.23 0.00 -0.71 0.00 0.00 52.86 53.71 3d4z s ASN 586 Cb 0.00 -2.58 -0.06 0.00 0.41 0.00 0.00 41.25 39.02 3d4z s ASN 586 CO 0.00 -0.27 1.38 -2.84 -1.51 0.00 0.00 177.10 173.86 3d4z s PRO 587 N 0.75 3.40 -0.11 -0.60 0.02 -1.26 -1.44 135.00 135.75 3d4z s PRO 587 Ca 0.52 2.29 0.03 0.00 0.02 0.00 0.00 61.00 63.87 3d4z s PRO 587 Cb -0.24 -2.43 0.01 0.00 0.02 0.00 0.00 34.50 31.85 3d4z s PRO 587 CO 0.29 -1.00 -0.21 0.08 -0.33 0.00 0.00 177.00 175.83 3d4z s VAL 588 N -1.27 1.89 0.31 3.83 1.01 0.03 -4.83 120.40 121.37 3d4z s VAL 588 Ca 0.67 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 3d4z s VAL 588 Cb -0.41 -1.66 -0.11 0.00 0.00 0.00 0.00 36.38 34.19 3d4z s VAL 588 CO 0.51 0.52 1.55 -0.70 0.00 0.00 0.00 175.10 176.98 3d4z s GLU 589 N 0.62 4.14 0.08 2.72 2.12 -1.26 -4.24 118.70 122.88 3d4z s GLU 589 Ca -0.13 2.54 -0.00 0.00 0.36 0.00 0.00 54.97 57.74 3d4z s GLU 589 Cb -0.17 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.16 3d4z s GLU 589 CO 0.03 -0.58 -0.03 0.00 -0.54 0.00 0.00 175.26 174.15 3d4z s ALA 590 N -0.28 0.75 -0.03 6.30 0.00 -0.18 -4.24 121.76 124.07 3d4z s ALA 590 Ca 0.60 -1.31 0.03 0.00 0.00 0.00 0.00 51.96 51.28 3d4z s ALA 590 Cb -0.47 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.00 3d4z s ALA 590 CO 0.51 -0.35 -0.12 -1.14 0.00 0.00 0.00 175.76 174.66 3d4z s GLN 591 N -3.91 1.29 -0.10 0.00 0.74 -0.07 -0.94 119.66 116.67 3d4z s GLN 591 Ca 0.12 -0.43 -0.01 0.00 0.05 0.00 0.00 55.36 55.09 3d4z s GLN 591 Cb 0.07 -1.17 -0.03 0.00 1.10 0.00 0.00 33.01 32.99 3d4z s GLN 591 CO -0.06 0.17 -0.06 0.08 -0.55 0.00 0.00 175.29 174.87 3d4z s VAL 592 N 0.13 3.78 0.16 1.34 1.01 0.45 -0.04 120.40 127.23 3d4z s VAL 592 Ca -0.03 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.57 3d4z s VAL 592 Cb -0.10 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3d4z s VAL 592 CO 0.01 0.56 -0.12 -0.44 0.00 0.00 0.00 175.10 175.11 3d4z s SER 593 N -0.36 2.09 0.92 3.32 0.01 -0.06 -1.56 113.70 118.06 3d4z s SER 593 Ca 0.05 -0.99 -0.12 0.00 1.31 0.00 0.00 55.95 56.20 3d4z s SER 593 Cb -0.12 -0.06 0.14 0.00 0.21 0.00 0.00 66.02 66.19 3d4z s SER 593 CO 0.02 -0.26 1.09 -2.84 0.41 0.00 0.00 173.24 171.67 3d4z s PRO 594 N -3.60 1.04 -0.44 12.44 0.02 -1.26 -0.77 135.00 142.43 3d4z s PRO 594 Ca 0.18 0.74 -0.16 0.00 0.02 0.00 0.00 61.00 61.77 3d4z s PRO 594 Cb 0.01 -1.79 0.04 0.00 0.02 0.00 0.00 34.50 32.77 3d4z s PRO 594 CO 0.03 -2.37 0.41 0.08 -0.33 0.00 0.00 177.00 174.81 3d4z s VAL 595 N -2.94 5.15 -0.17 3.83 1.01 -1.26 -4.49 120.40 121.53 3d4z s VAL 595 Ca 0.64 -0.64 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 3d4z s VAL 595 Cb -0.18 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 3d4z s VAL 595 CO 0.57 -0.47 0.10 0.26 0.00 0.00 0.00 175.10 175.56 3d4z s TRP 596 N 1.93 3.38 0.08 5.22 0.52 -1.26 -0.77 118.94 128.04 3d4z s TRP 596 Ca 0.08 0.28 0.06 0.00 0.02 0.00 0.00 56.10 56.54 3d4z s TRP 596 Cb -0.20 -2.07 -0.03 0.00 -1.15 0.00 0.00 33.47 30.03 3d4z s TRP 596 CO 0.11 0.35 -0.16 -1.54 0.02 0.00 0.00 176.95 175.73 3d4z s SER 597 N 0.00 1.91 -0.09 2.95 1.04 -0.24 -4.95 113.70 114.34 3d4z s SER 597 Ca 0.08 -0.63 -0.05 0.00 0.48 0.00 0.00 55.95 55.83 3d4z s SER 597 Cb -0.12 -0.08 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 3d4z s SER 597 CO 0.00 -0.03 0.12 0.26 0.98 0.00 0.00 173.24 174.56 3d4z s TRP 598 N -1.22 3.48 -0.02 5.02 0.52 -1.26 0.34 118.94 125.81 3d4z s TRP 598 Ca 0.00 0.41 0.02 0.00 0.02 0.00 0.00 56.10 56.56 3d4z s TRP 598 Cb -0.10 -1.88 0.00 0.00 -1.15 0.00 0.00 33.47 30.35 3d4z s TRP 598 CO 0.03 0.66 -0.06 -1.01 0.02 0.00 0.00 176.95 176.58 3d4z s HIS 599 N -1.06 0.67 -0.45 -1.98 3.76 -0.22 -4.96 115.29 111.05 3d4z s HIS 599 Ca 0.17 -0.15 -0.24 0.00 -0.15 0.00 0.00 55.06 54.70 3d4z s HIS 599 Cb -0.12 -0.49 0.03 0.00 1.11 0.00 0.00 32.58 33.10 3d4z s HIS 599 CO 0.07 -0.07 0.84 -1.58 -0.85 0.00 0.00 174.74 173.15 3d4z s HIS 600 N 0.18 2.97 -0.73 1.40 2.46 -1.26 -1.62 115.29 118.68 3d4z s HIS 600 Ca -0.02 0.24 -0.22 0.00 0.47 0.00 0.00 55.06 55.53 3d4z s HIS 600 Cb -0.07 -3.78 0.07 0.00 -0.13 0.00 0.00 32.58 28.68 3d4z s HIS 600 CO -0.00 -1.03 1.05 0.34 -2.47 0.00 0.00 174.74 172.63 3d4z s ASP 601 N 2.18 6.26 0.00 9.88 -1.08 -0.05 -4.86 116.67 129.01 3d4z s ASP 601 Ca 0.32 -1.13 0.11 0.00 -0.52 0.00 0.00 52.55 51.33 3d4z s ASP 601 Cb -0.11 -2.44 0.52 0.00 -1.46 0.00 0.00 42.92 39.43 3d4z s ASP 601 CO 0.24 -1.43 1.27 0.35 0.52 0.00 0.00 175.17 176.12 3d4z n THR 602 N 5.96 0.88 -0.07 1.71 -2.24 -1.26 0.15 114.28 119.40 3d4z n THR 602 Ca 0.03 0.22 -0.07 0.00 -2.27 0.00 0.00 64.05 61.96 3d4z n THR 602 Cb 0.47 -1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 67.62 3d4z n THR 602 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3d4z h LEU 603 N 0.00 0.00 0.00 3.22 4.07 -1.94 -3.39 115.31 117.27 3d4z h LEU 603 Ca 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.79 3d4z h LEU 603 Cb 0.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.86 3d4z h LEU 603 CO 0.00 0.83 -0.01 0.35 -1.08 0.00 0.00 178.44 178.52 3d4z n THR 604 N -4.63 0.36 -3.23 0.22 -2.24 -1.12 -4.92 114.28 98.72 3d4z n THR 604 Ca -0.09 -0.17 -0.20 0.00 -2.27 0.00 0.00 64.05 61.31 3d4z n THR 604 Cb 0.28 -0.54 0.05 0.00 -2.10 0.00 0.00 70.33 68.02 3d4z n THR 604 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3d4z n LYS 605 N -1.96 -5.82 -4.28 -0.78 4.76 0.12 -5.01 118.16 105.19 3d4z n LYS 605 Ca 0.06 0.74 -0.19 0.00 -2.87 0.00 0.00 58.31 56.06 3d4z n LYS 605 Cb 0.40 -5.41 -0.11 0.00 -1.84 0.00 0.00 35.03 28.07 3d4z n LYS 605 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3d4z s THR 606 N -3.20 1.51 -0.34 -0.18 -4.23 -1.18 -4.99 115.64 103.03 3d4z s THR 606 Ca 0.41 -1.84 -0.12 0.00 -1.18 0.00 0.00 61.69 58.96 3d4z s THR 606 Cb -0.18 -1.69 -0.01 0.00 1.34 0.00 0.00 72.50 71.96 3d4z s THR 606 CO 0.50 -0.42 0.21 -0.63 -0.54 0.00 0.00 174.62 173.75 3d4z s ILE 607 N -2.25 4.97 0.07 2.99 1.01 -1.26 -0.87 121.20 125.86 3d4z s ILE 607 Ca 0.13 -0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.28 3d4z s ILE 607 Cb -0.04 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.84 3d4z s ILE 607 CO 0.04 -0.04 0.20 -1.38 0.00 0.00 0.00 174.94 173.77 3d4z s HIS 608 N 1.66 0.09 0.17 3.97 -3.43 -0.64 -4.35 115.29 112.77 3d4z s HIS 608 Ca 0.05 -0.43 -0.10 0.00 -0.80 0.00 0.00 55.06 53.78 3d4z s HIS 608 Cb -0.18 -0.03 -0.07 0.00 -1.43 0.00 0.00 32.58 30.88 3d4z s HIS 608 CO 0.09 -0.51 0.50 -1.25 -2.00 0.00 0.00 174.74 171.57 3d4z s PRO 609 N -3.33 3.81 0.03 -0.38 0.04 -1.26 -1.05 135.00 132.86 3d4z s PRO 609 Ca 0.01 0.26 0.08 0.00 0.04 0.00 0.00 61.00 61.39 3d4z s PRO 609 Cb 0.02 -2.80 -0.02 0.00 0.04 0.00 0.00 34.50 31.74 3d4z s PRO 609 CO -0.08 0.42 -0.22 -0.65 0.04 0.00 0.00 177.00 176.50 3d4z s GLN 610 N -2.43 1.56 -0.13 4.56 -1.52 0.15 -4.94 119.66 116.91 3d4z s GLN 610 Ca 0.42 -0.95 -0.06 0.00 -1.95 0.00 0.00 55.36 52.82 3d4z s GLN 610 Cb -0.13 -1.65 -0.04 0.00 -0.22 0.00 0.00 33.01 30.97 3d4z s GLN 610 CO 0.21 0.43 0.09 0.20 -0.25 0.00 0.00 175.29 175.97 3d4z s GLY 611 N -1.06 2.03 0.46 3.09 0.00 -1.26 -1.07 107.32 109.51 3d4z s GLY 611 Ca 0.09 -0.70 -0.24 0.00 0.00 0.00 0.00 44.72 43.87 3d4z s GLY 611 CO 0.01 -0.33 1.25 -0.45 0.00 0.00 0.00 173.10 173.59 3d4z s SER 612 N -0.69 5.99 0.00 1.64 0.15 0.05 -4.89 113.70 115.96 3d4z s SER 612 Ca 0.12 2.53 0.14 0.00 0.70 0.00 0.00 55.95 59.44 3d4z s SER 612 Cb -0.12 -2.62 0.24 0.00 -1.71 0.00 0.00 66.02 61.81 3d4z s SER 612 CO 0.03 -1.06 1.12 0.35 1.20 0.00 0.00 173.24 174.88 3d4z n THR 613 N -0.43 0.46 0.00 6.45 -2.24 -1.26 -4.43 114.28 112.83 3d4z n THR 613 Ca 0.07 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 3d4z n THR 613 Cb 0.46 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 3d4z n THR 613 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3d4z n THR 614 N 0.80 0.00 -3.80 4.28 -2.24 -1.26 -4.36 114.28 107.71 3d4z n THR 614 Ca 0.11 -0.37 -0.11 0.00 -2.27 0.00 0.00 64.05 61.41 3d4z n THR 614 Cb 0.41 0.89 -0.08 0.00 -2.10 0.00 0.00 70.33 69.46 3d4z n THR 614 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3d4z s LYS 615 N -1.09 0.75 0.15 -0.78 -2.85 -1.26 -4.65 119.74 110.00 3d4z s LYS 615 Ca 0.00 -0.55 0.01 0.00 -1.00 0.00 0.00 55.97 54.42 3d4z s LYS 615 Cb 0.00 0.32 -0.04 0.00 -2.06 0.00 0.00 37.83 36.05 3d4z s LYS 615 CO 0.00 -0.23 0.00 0.71 0.10 0.00 0.00 175.35 175.93 3d4z s TYR 616 N -2.53 1.04 -0.16 1.78 2.02 0.58 -4.16 117.35 115.93 3d4z s TYR 616 Ca -0.05 -1.06 -0.04 0.00 -0.37 0.00 0.00 57.07 55.56 3d4z s TYR 616 Cb -0.01 -0.60 -0.03 0.00 -0.40 0.00 0.00 41.96 40.92 3d4z s TYR 616 CO -0.03 -0.28 -0.04 1.03 -1.57 0.00 0.00 175.55 174.65 3d4z s ARG 617 N -3.93 3.65 -0.10 -0.62 0.52 0.05 -0.28 118.95 118.24 3d4z s ARG 617 Ca 0.21 -0.53 0.00 0.00 -0.52 0.00 0.00 55.73 54.89 3d4z s ARG 617 Cb 0.06 -2.90 -0.03 0.00 0.52 0.00 0.00 34.95 32.60 3d4z s ARG 617 CO 0.01 0.23 -0.08 -1.50 0.02 0.00 0.00 175.30 173.98 3d4z s ILE 618 N 0.39 3.53 -0.03 1.52 2.07 0.03 -0.88 121.20 127.83 3d4z s ILE 618 Ca -0.04 -0.52 0.05 0.00 -1.41 0.00 0.00 60.65 58.73 3d4z s ILE 618 Cb -0.14 -2.47 -0.01 0.00 0.13 0.00 0.00 42.46 39.97 3d4z s ILE 618 CO 0.03 0.56 -0.19 -0.63 -1.91 0.00 0.00 174.94 172.80 3d4z s ILE 619 N -0.31 1.57 0.19 2.00 1.01 0.95 -1.07 121.20 125.53 3d4z s ILE 619 Ca 0.04 -0.82 -0.17 0.00 0.00 0.00 0.00 60.65 59.70 3d4z s ILE 619 Cb -0.13 -1.33 0.03 0.00 0.01 0.00 0.00 42.46 41.04 3d4z s ILE 619 CO 0.02 0.45 0.50 0.72 0.00 0.00 0.00 174.94 176.63 3d4z s PHE 620 N -0.18 -0.11 -0.29 3.97 -0.71 -0.54 -0.89 117.98 119.24 3d4z s PHE 620 Ca 0.01 -0.23 -0.24 0.00 -1.04 0.00 0.00 56.93 55.43 3d4z s PHE 620 Cb -0.10 0.36 -0.00 0.00 -1.21 0.00 0.00 43.02 42.06 3d4z s PHE 620 CO 0.01 -0.88 0.80 0.21 -1.34 0.00 0.00 175.22 174.02 3d4z s LYS 621 N -3.87 4.04 0.02 1.99 2.20 -1.26 -0.74 119.74 122.11 3d4z s LYS 621 Ca 0.09 0.70 -0.16 0.00 -0.36 0.00 0.00 55.97 56.24 3d4z s LYS 621 Cb -0.00 -3.70 -0.06 0.00 -1.51 0.00 0.00 37.83 32.56 3d4z s LYS 621 CO -0.04 -0.63 0.45 0.00 -0.36 0.00 0.00 175.35 174.78 3d4z s ALA 622 N 2.93 3.67 -0.18 3.13 0.00 -0.31 -4.92 121.76 126.08 3d4z s ALA 622 Ca 0.33 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.15 3d4z s ALA 622 Cb -0.14 -2.46 0.02 0.00 0.00 0.00 0.00 23.12 20.54 3d4z s ALA 622 CO 0.11 0.45 -0.20 0.50 0.00 0.00 0.00 175.76 176.62 3d4z s ARG 623 N -1.05 2.98 -0.03 0.00 3.52 -1.26 -1.66 118.95 121.45 3d4z s ARG 623 Ca 0.25 -0.84 0.03 0.00 -0.13 0.00 0.00 55.73 55.05 3d4z s ARG 623 Cb -0.17 -2.58 -0.00 0.00 -1.56 0.00 0.00 34.95 30.63 3d4z s ARG 623 CO 0.15 -0.22 -0.12 0.08 -0.81 0.00 0.00 175.30 174.38 3d4z s VAL 624 N 1.29 1.03 1.04 7.11 1.01 0.21 -4.80 120.40 127.28 3d4z s VAL 624 Ca 0.05 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.40 3d4z s VAL 624 Cb -0.13 -0.89 0.21 0.00 0.00 0.00 0.00 36.38 35.57 3d4z s VAL 624 CO -0.13 0.30 1.08 -2.84 0.00 0.00 0.00 175.10 173.52 3d4z s PRO 625 N 0.01 0.08 0.23 2.72 0.02 -1.26 -1.39 135.00 135.40 3d4z s PRO 625 Ca -0.01 1.15 -0.32 0.00 0.02 0.00 0.00 61.00 61.84 3d4z s PRO 625 Cb -0.08 -1.65 -0.12 0.00 0.02 0.00 0.00 34.50 32.67 3d4z s PRO 625 CO 0.01 -3.14 1.68 -2.30 -0.33 0.00 0.00 177.00 172.92 3d4z n PRO 626 N -4.55 2.71 -4.11 5.54 -0.02 -1.25 -1.81 135.00 131.51 3d4z n PRO 626 Ca 0.07 0.97 -0.34 0.00 -2.02 0.00 0.00 63.50 62.18 3d4z n PRO 626 Cb 0.53 -2.80 -0.01 0.00 -0.02 0.00 0.00 33.50 31.20 3d4z n PRO 626 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3d4z n MET 627 N 3.46 -3.72 -2.04 -0.52 2.81 -0.09 -4.74 117.12 112.27 3d4z n MET 627 Ca 0.14 0.43 -0.00 0.00 -1.81 0.00 0.00 57.70 56.45 3d4z n MET 627 Cb 0.35 -5.20 -0.00 0.00 -0.71 0.00 0.00 33.22 27.65 3d4z n MET 627 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d4z n GLY 628 N -1.44 4.06 3.06 3.03 0.00 -0.75 -4.83 105.19 108.32 3d4z n GLY 628 Ca 0.07 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.11 3d4z n GLY 628 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d4z s LEU 629 N 0.00 2.19 -0.03 0.99 1.43 -0.04 -1.19 118.68 122.03 3d4z s LEU 629 Ca 0.00 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.65 3d4z s LEU 629 Cb 0.00 -0.28 0.02 0.00 0.03 0.00 0.00 46.19 45.96 3d4z s LEU 629 CO 0.00 -0.10 0.06 0.00 0.23 0.00 0.00 176.35 176.54 3d4z s ALA 630 N -1.02 -0.07 -0.12 4.21 0.00 -0.19 -1.36 121.76 123.21 3d4z s ALA 630 Ca -0.05 0.30 -0.05 0.00 0.00 0.00 0.00 51.96 52.17 3d4z s ALA 630 Cb -0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3d4z s ALA 630 CO 0.01 -0.08 0.06 0.99 0.00 0.00 0.00 175.76 176.73 3d4z s THR 631 N 0.65 4.78 0.22 0.00 2.01 -0.32 -0.94 115.64 122.05 3d4z s THR 631 Ca -0.05 -0.06 0.04 0.00 0.31 0.00 0.00 61.69 61.93 3d4z s THR 631 Cb -0.07 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 3d4z s THR 631 CO -0.02 0.57 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.13 3d4z s TYR 632 N -0.58 1.55 -0.06 4.92 1.51 0.64 -3.30 117.35 122.03 3d4z s TYR 632 Ca 0.11 -0.84 0.03 0.00 -1.01 0.00 0.00 57.07 55.36 3d4z s TYR 632 Cb -0.12 -0.87 0.00 0.00 -0.11 0.00 0.00 41.96 40.87 3d4z s TYR 632 CO 0.02 0.04 -0.17 0.08 -1.11 0.00 0.00 175.55 174.42 3d4z s VAL 633 N -3.33 1.45 -0.22 0.71 1.01 0.28 -0.88 120.40 119.42 3d4z s VAL 633 Ca 0.26 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 3d4z s VAL 633 Cb 0.04 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 3d4z s VAL 633 CO 0.07 0.42 0.10 -0.76 0.00 0.00 0.00 175.10 174.94 3d4z s LEU 634 N 0.34 3.82 -0.04 3.92 1.43 0.13 -1.42 118.68 126.87 3d4z s LEU 634 Ca -0.11 0.01 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 3d4z s LEU 634 Cb -0.15 -2.01 -0.00 0.00 0.03 0.00 0.00 46.19 44.07 3d4z s LEU 634 CO 0.04 0.07 -0.15 -0.89 0.23 0.00 0.00 176.35 175.65 3d4z s THR 635 N 0.99 1.30 0.46 5.49 2.01 0.07 -0.63 115.64 125.34 3d4z s THR 635 Ca 0.05 -0.64 -0.12 0.00 0.31 0.00 0.00 61.69 61.29 3d4z s THR 635 Cb -0.14 -1.13 -0.06 0.00 0.01 0.00 0.00 72.50 71.18 3d4z s THR 635 CO 0.03 0.38 0.85 -0.51 -0.69 0.00 0.00 174.62 174.69 3d4z s ILE 636 N 0.08 4.72 0.27 1.82 2.07 -0.42 -0.60 121.20 129.14 3d4z s ILE 636 Ca -0.04 0.76 -0.01 0.00 -1.41 0.00 0.00 60.65 59.96 3d4z s ILE 636 Cb -0.11 -3.76 -0.02 0.00 0.13 0.00 0.00 42.46 38.70 3d4z s ILE 636 CO 0.02 -0.66 0.28 -0.94 -1.91 0.00 0.00 174.94 171.74 3d4z s SER 637 N -3.32 0.70 0.00 4.50 1.04 -0.02 -4.92 113.70 111.67 3d4z s SER 637 Ca 0.53 -1.45 0.26 0.00 0.48 0.00 0.00 55.95 55.77 3d4z s SER 637 Cb -0.10 0.51 0.62 0.00 0.10 0.00 0.00 66.02 67.15 3d4z s SER 637 CO 0.35 -1.03 1.48 -0.90 0.98 0.00 0.00 173.24 174.12 3d4z n ASP 638 N -0.87 0.82 -1.75 7.02 5.68 -1.26 -4.75 116.55 121.44 3d4z n ASP 638 Ca 0.03 -0.63 -0.05 0.00 -0.50 0.00 0.00 54.79 53.64 3d4z n ASP 638 Cb 0.64 0.21 -0.00 0.00 -1.14 0.00 0.00 41.12 40.82 3d4z n ASP 638 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3d4z n SER 639 N -1.02 -0.66 -4.68 -1.12 3.41 -1.26 -5.07 113.62 103.23 3d4z n SER 639 Ca 0.09 -1.70 -0.42 0.00 -0.26 0.00 0.00 58.87 56.58 3d4z n SER 639 Cb 0.34 1.17 -0.03 0.00 -0.26 0.00 0.00 64.21 65.44 3d4z n SER 639 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3d4z s LYS 640 N -2.21 4.13 0.54 4.33 1.02 -1.26 -4.84 119.74 121.45 3d4z s LYS 640 Ca 0.10 2.63 -0.19 0.00 0.02 0.00 0.00 55.97 58.52 3d4z s LYS 640 Cb -0.01 -3.87 -0.06 0.00 -0.52 0.00 0.00 37.83 33.37 3d4z s LYS 640 CO 0.07 -0.91 1.08 -2.14 -0.92 0.00 0.00 175.35 172.54 3d4z s PRO 641 N 3.59 3.47 0.28 -1.68 0.02 -1.26 -4.95 135.00 134.47 3d4z s PRO 641 Ca 0.85 1.45 0.02 0.00 0.02 0.00 0.00 61.00 63.34 3d4z s PRO 641 Cb -0.45 -2.04 0.60 0.00 0.02 0.00 0.00 34.50 32.64 3d4z s PRO 641 CO 0.39 -0.72 1.81 1.49 -0.33 0.00 0.00 177.00 179.64 3d4z h GLU 642 N 1.14 0.85 -0.40 5.54 4.81 -1.97 -3.08 114.58 121.46 3d4z h GLU 642 Ca -0.49 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3d4z h GLU 642 Cb 1.24 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3d4z h GLU 642 CO 0.58 0.56 0.00 0.72 -0.73 0.00 0.00 179.01 180.13 3d4z n HIS 643 N -4.70 1.01 -4.54 0.92 8.25 -1.26 -4.89 115.22 110.01 3d4z n HIS 643 Ca 0.20 -0.69 -0.33 0.00 -0.26 0.00 0.00 57.72 56.64 3d4z n HIS 643 Cb 0.43 -0.22 -0.16 0.00 1.12 0.00 0.00 29.99 31.16 3d4z n HIS 643 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3d4z s THR 644 N -2.03 2.45 0.40 1.59 2.01 -1.17 -1.01 115.64 117.88 3d4z s THR 644 Ca 0.40 -0.84 0.08 0.00 0.31 0.00 0.00 61.69 61.63 3d4z s THR 644 Cb 0.28 -2.02 -0.02 0.00 0.01 0.00 0.00 72.50 70.75 3d4z s THR 644 CO 0.15 0.53 0.36 -0.94 -0.69 0.00 0.00 174.62 174.03 3d4z s SER 645 N 0.86 5.10 -0.08 3.53 1.04 -0.11 -4.66 113.70 119.38 3d4z s SER 645 Ca -0.05 -0.69 0.04 0.00 0.48 0.00 0.00 55.95 55.73 3d4z s SER 645 Cb -0.15 -0.66 -0.00 0.00 0.10 0.00 0.00 66.02 65.31 3d4z s SER 645 CO -0.01 -0.58 -0.21 -0.31 0.98 0.00 0.00 173.24 173.10 3d4z s TYR 646 N -2.43 2.19 0.53 5.02 1.51 -1.26 -0.41 117.35 122.49 3d4z s TYR 646 Ca 0.46 -0.80 -0.20 0.00 -1.01 0.00 0.00 57.07 55.53 3d4z s TYR 646 Cb -0.04 -1.48 -0.07 0.00 -0.11 0.00 0.00 41.96 40.27 3d4z s TYR 646 CO 0.28 -0.31 1.10 0.00 -1.11 0.00 0.00 175.55 175.51 3d4z s ALA 647 N 0.25 2.75 0.40 3.71 0.00 -0.60 -4.91 121.76 123.36 3d4z s ALA 647 Ca -0.13 0.76 -0.06 0.00 0.00 0.00 0.00 51.96 52.54 3d4z s ALA 647 Cb -0.16 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.59 3d4z s ALA 647 CO 0.06 -0.64 0.70 -1.54 0.00 0.00 0.00 175.76 174.34 3d4z s SER 648 N -1.84 6.37 -0.02 0.00 1.04 0.12 -4.85 113.70 114.53 3d4z s SER 648 Ca 0.71 0.87 0.01 0.00 0.48 0.00 0.00 55.95 58.02 3d4z s SER 648 Cb -0.22 -2.21 0.01 0.00 0.10 0.00 0.00 66.02 63.70 3d4z s SER 648 CO 0.25 -0.41 -0.04 0.20 0.98 0.00 0.00 173.24 174.23 3d4z s ASN 649 N -3.64 0.64 -0.10 7.02 0.01 -1.26 -1.10 114.94 116.50 3d4z s ASN 649 Ca 0.47 -0.08 -0.01 0.00 -0.71 0.00 0.00 52.86 52.53 3d4z s ASN 649 Cb -0.10 -0.22 0.03 0.00 0.41 0.00 0.00 41.25 41.37 3d4z s ASN 649 CO 0.37 -0.01 -0.06 -0.22 -1.51 0.00 0.00 177.10 175.67 3d4z s LEU 650 N 0.47 1.05 -0.32 0.60 2.96 0.37 -0.75 118.68 123.06 3d4z s LEU 650 Ca -0.05 -0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 53.50 3d4z s LEU 650 Cb -0.09 -0.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.85 3d4z s LEU 650 CO -0.00 -0.13 0.21 -0.22 -1.32 0.00 0.00 176.35 174.88 3d4z s LEU 651 N 1.73 4.32 -0.36 -0.68 2.96 0.43 -0.40 118.68 126.67 3d4z s LEU 651 Ca 0.04 -0.38 -0.12 0.00 -0.22 0.00 0.00 54.13 53.45 3d4z s LEU 651 Cb -0.13 -2.10 0.01 0.00 0.50 0.00 0.00 46.19 44.48 3d4z s LEU 651 CO -0.07 -0.19 0.23 -0.76 -1.32 0.00 0.00 176.35 174.24 3d4z s LEU 652 N 1.70 4.67 -0.13 -0.68 1.43 0.11 -1.86 118.68 123.93 3d4z s LEU 652 Ca 0.06 -0.76 -0.30 0.00 -1.03 0.00 0.00 54.13 52.10 3d4z s LEU 652 Cb -0.17 -2.08 0.13 0.00 0.03 0.00 0.00 46.19 44.10 3d4z s LEU 652 CO 0.09 -0.34 1.02 0.00 0.23 0.00 0.00 176.35 177.36 3d4z s ARG 653 N 1.64 0.58 0.61 1.70 1.70 -0.18 -1.68 118.95 123.30 3d4z s ARG 653 Ca 0.04 -0.03 -0.13 0.00 -0.47 0.00 0.00 55.73 55.14 3d4z s ARG 653 Cb -0.18 0.27 -0.04 0.00 -0.57 0.00 0.00 34.95 34.43 3d4z s ARG 653 CO 0.08 -0.22 1.03 0.15 -1.08 0.00 0.00 175.30 175.27 3d4z s LYS 654 N -1.88 3.49 -1.19 3.89 1.02 -1.26 -4.27 119.74 119.54 3d4z s LYS 654 Ca 0.03 0.92 -0.02 0.00 0.02 0.00 0.00 55.97 56.91 3d4z s LYS 654 Cb -0.01 -2.07 -0.01 0.00 -0.52 0.00 0.00 37.83 35.22 3d4z s LYS 654 CO -0.03 -0.66 0.89 -1.71 -0.92 0.00 0.00 175.35 172.93 3d4z n ASN 655 N -2.43 -2.93 -4.83 2.83 5.15 -1.26 -4.93 115.26 106.85 3d4z n ASN 655 Ca 0.07 -0.71 -0.31 0.00 -0.60 0.00 0.00 54.58 53.03 3d4z n ASN 655 Cb 0.54 -4.77 0.05 0.00 -0.53 0.00 0.00 39.78 35.07 3d4z n ASN 655 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3d4z s PRO 656 N -5.36 2.90 0.27 1.20 0.04 -1.26 -5.07 135.00 127.72 3d4z s PRO 656 Ca 0.12 0.82 0.05 0.00 0.04 0.00 0.00 61.00 62.04 3d4z s PRO 656 Cb -0.02 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.47 3d4z s PRO 656 CO 0.76 -1.09 -0.02 0.95 0.04 0.00 0.00 177.00 177.64 3d4z s THR 657 N -3.11 1.38 0.84 1.26 -4.23 -1.26 -5.14 115.64 105.38 3d4z s THR 657 Ca 0.58 -2.07 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 3d4z s THR 657 Cb -0.13 -2.47 0.10 0.00 1.34 0.00 0.00 72.50 71.34 3d4z s THR 657 CO 0.54 -0.26 1.16 -0.94 -0.54 0.00 0.00 174.62 174.58 3d4z s SER 658 N -3.41 3.47 -0.41 3.99 1.04 -1.26 -5.01 113.70 112.12 3d4z s SER 658 Ca 0.30 2.19 0.04 0.00 0.48 0.00 0.00 55.95 58.96 3d4z s SER 658 Cb 0.05 -2.57 0.17 0.00 0.10 0.00 0.00 66.02 63.77 3d4z s SER 658 CO 0.11 -2.74 0.33 -0.76 0.98 0.00 0.00 173.24 171.16 3d4z s LEU 659 N -6.12 1.34 0.64 2.42 1.43 -1.26 -5.11 118.68 112.02 3d4z s LEU 659 Ca 0.68 -2.98 -0.16 0.00 -1.03 0.00 0.00 54.13 50.64 3d4z s LEU 659 Cb -0.24 -0.41 -0.01 0.00 0.03 0.00 0.00 46.19 45.56 3d4z s LEU 659 CO 0.54 -0.18 1.12 -2.16 0.23 0.00 0.00 176.35 175.90 3d4z s PRO 660 N 0.15 2.90 -0.28 1.29 0.04 -1.26 -4.60 135.00 133.25 3d4z s PRO 660 Ca 0.32 1.44 0.17 0.00 0.04 0.00 0.00 61.00 62.97 3d4z s PRO 660 Cb 0.02 -1.96 0.49 0.00 0.04 0.00 0.00 34.50 33.09 3d4z s PRO 660 CO -0.18 -1.18 1.13 1.28 0.04 0.00 0.00 177.00 178.10 3d4z n LEU 661 N -2.19 2.84 0.00 -3.56 4.77 -1.26 -4.74 117.00 112.86 3d4z n LEU 661 Ca 0.11 -3.70 0.00 0.00 -0.03 0.00 0.00 56.01 52.38 3d4z n LEU 661 Cb 0.52 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 3d4z n LEU 661 CO 0.47 1.46 0.00 0.61 -1.33 0.00 0.00 177.39 178.59 3d4z n GLY 662 N -0.62 3.40 0.01 -0.72 0.00 -1.26 -1.48 105.19 104.51 3d4z n GLY 662 Ca 0.21 0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.43 3d4z n GLY 662 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3d4z n GLN 663 N 14.00 0.44 -1.67 1.61 6.02 -1.26 -4.90 117.38 131.61 3d4z n GLN 663 Ca 0.00 -0.01 -0.54 0.00 -0.01 0.00 0.00 57.00 56.44 3d4z n GLN 663 Cb 0.00 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.70 3d4z n GLN 663 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 3d4z n TYR 664 N -1.27 1.97 1.46 1.08 9.36 -0.55 -4.84 117.16 124.37 3d4z n TYR 664 Ca 0.14 0.46 0.13 0.00 3.32 0.00 0.00 57.90 61.95 3d4z n TYR 664 Cb 0.24 -2.46 0.73 0.00 -0.63 0.00 0.00 39.34 37.22 3d4z n TYR 664 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3d4z n PRO 665 N 4.65 0.61 -5.00 2.98 -0.04 -1.26 -4.75 135.00 132.19 3d4z n PRO 665 Ca 0.23 0.02 -0.32 0.00 -0.04 0.00 0.00 63.50 63.39 3d4z n PRO 665 Cb 0.18 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 31.98 3d4z n PRO 665 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3d4z s GLU 666 N -2.29 3.07 0.32 0.54 2.56 -1.26 -5.10 118.70 116.54 3d4z s GLU 666 Ca 0.33 -0.85 -0.27 0.00 0.00 0.00 0.00 54.97 54.17 3d4z s GLU 666 Cb 0.18 -2.37 -0.09 0.00 2.00 0.00 0.00 34.13 33.84 3d4z s GLU 666 CO 0.36 0.12 1.04 -0.51 -0.56 0.00 0.00 175.26 175.70 3d4z s ASP 667 N 0.50 7.16 0.32 -1.70 1.01 -1.26 -4.93 116.67 117.78 3d4z s ASP 667 Ca -0.14 2.09 -0.29 0.00 0.71 0.00 0.00 52.55 54.92 3d4z s ASP 667 Cb -0.17 -2.61 -0.11 0.00 1.01 0.00 0.00 42.92 41.05 3d4z s ASP 667 CO 0.05 -0.20 1.43 -0.69 0.21 0.00 0.00 175.17 175.97 3d4z s VAL 668 N -1.38 2.40 0.16 -1.27 1.01 -1.26 -4.69 120.40 115.37 3d4z s VAL 668 Ca 0.49 0.38 0.05 0.00 0.00 0.00 0.00 61.98 62.89 3d4z s VAL 668 Cb -0.26 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 3d4z s VAL 668 CO 0.33 0.08 0.16 -0.54 0.00 0.00 0.00 175.10 175.13 3d4z s LYS 669 N -1.39 2.99 0.16 2.72 -0.14 0.07 -4.98 119.74 119.18 3d4z s LYS 669 Ca 0.54 -0.82 0.07 0.00 -1.36 0.00 0.00 55.97 54.40 3d4z s LYS 669 Cb -0.43 -2.70 -0.04 0.00 -1.68 0.00 0.00 37.83 32.97 3d4z s LYS 669 CO 0.53 0.49 -0.15 -0.06 -0.76 0.00 0.00 175.35 175.40 3d4z s PHE 670 N -1.75 1.62 0.06 3.18 0.40 -1.26 -0.43 117.98 119.80 3d4z s PHE 670 Ca 0.32 -0.54 -0.27 0.00 -0.60 0.00 0.00 56.93 55.83 3d4z s PHE 670 Cb -0.10 -0.80 0.09 0.00 0.51 0.00 0.00 43.02 42.71 3d4z s PHE 670 CO 0.24 0.26 0.93 0.20 0.70 0.00 0.00 175.22 177.55 3d4z s GLY 671 N -2.78 -0.37 0.65 4.36 0.00 -0.78 -4.91 107.32 103.49 3d4z s GLY 671 Ca 0.15 0.65 -0.15 0.00 0.00 0.00 0.00 44.72 45.37 3d4z s GLY 671 CO 0.05 0.20 1.11 0.99 0.00 0.00 0.00 173.10 175.45 3d4z s ASP 672 N -2.68 5.16 0.31 1.64 1.01 -1.26 -1.01 116.67 119.84 3d4z s ASP 672 Ca 0.08 2.02 -0.28 0.00 0.71 0.00 0.00 52.55 55.08 3d4z s ASP 672 Cb -0.01 -2.55 -0.13 0.00 1.01 0.00 0.00 42.92 41.23 3d4z s ASP 672 CO -0.04 -1.60 1.14 -2.65 0.21 0.00 0.00 175.17 172.23 3d4z n PRO 673 N -2.31 1.71 -3.45 8.23 -0.02 -1.26 -4.65 135.00 133.24 3d4z n PRO 673 Ca 0.11 0.60 -0.11 0.00 -2.02 0.00 0.00 63.50 62.07 3d4z n PRO 673 Cb 0.52 -2.07 -0.02 0.00 -0.02 0.00 0.00 33.50 31.90 3d4z n PRO 673 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3d4z s ARG 674 N -1.68 1.12 0.47 -0.52 1.70 -1.26 -4.99 118.95 113.80 3d4z s ARG 674 Ca 0.57 -0.35 -0.23 0.00 -0.47 0.00 0.00 55.73 55.25 3d4z s ARG 674 Cb -0.64 0.52 -0.07 0.00 -0.57 0.00 0.00 34.95 34.19 3d4z s ARG 674 CO 0.61 -0.48 1.21 -1.21 -1.08 0.00 0.00 175.30 174.35 3d4z s GLU 675 N -3.32 3.66 0.05 3.89 2.02 -1.26 -4.08 118.70 119.67 3d4z s GLU 675 Ca 0.01 1.90 -0.03 0.00 0.02 0.00 0.00 54.97 56.87 3d4z s GLU 675 Cb -0.01 -2.42 -0.03 0.00 0.10 0.00 0.00 34.13 31.78 3d4z s GLU 675 CO -0.10 -0.66 0.03 0.96 0.02 0.00 0.00 175.26 175.51 3d4z s ILE 676 N -1.47 0.18 0.04 -1.63 -4.36 -0.93 -4.97 121.20 108.06 3d4z s ILE 676 Ca 0.64 -1.45 0.03 0.00 -0.26 0.00 0.00 60.65 59.61 3d4z s ILE 676 Cb -0.32 -1.22 -0.02 0.00 1.25 0.00 0.00 42.46 42.15 3d4z s ILE 676 CO 0.38 -0.80 -0.10 -0.55 0.24 0.00 0.00 174.94 174.11 3d4z s SER 677 N -2.58 1.15 0.02 4.36 0.15 -1.26 -0.44 113.70 115.10 3d4z s SER 677 Ca 0.02 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.21 3d4z s SER 677 Cb 0.04 -0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.30 3d4z s SER 677 CO -0.08 -0.07 -0.03 -0.76 1.20 0.00 0.00 173.24 173.50 3d4z s LEU 678 N -1.22 2.18 -0.07 3.45 1.43 -0.21 -4.99 118.68 119.26 3d4z s LEU 678 Ca -0.04 -0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 52.66 3d4z s LEU 678 Cb -0.08 0.06 0.04 0.00 0.03 0.00 0.00 46.19 46.24 3d4z s LEU 678 CO 0.01 -0.22 0.14 -0.60 0.23 0.00 0.00 176.35 175.90 3d4z s ARG 679 N -1.10 0.03 -0.16 1.70 3.52 -1.26 -0.87 118.95 120.80 3d4z s ARG 679 Ca -0.12 0.47 -0.07 0.00 -0.13 0.00 0.00 55.73 55.88 3d4z s ARG 679 Cb -0.08 -0.28 -0.04 0.00 -1.56 0.00 0.00 34.95 32.99 3d4z s ARG 679 CO -0.01 -0.27 0.10 0.08 -0.81 0.00 0.00 175.30 174.39 3d4z s VAL 680 N 1.92 5.11 0.00 7.11 1.01 -1.26 -5.01 120.40 129.29 3d4z s VAL 680 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.05 3d4z s VAL 680 Cb -0.12 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 32.98 3d4z s VAL 680 CO -0.05 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.17 3d4z n GLY 681 N 2.94 3.07 1.55 4.51 0.00 -1.26 -1.78 105.19 114.21 3d4z n GLY 681 Ca -0.18 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.62 3d4z n GLY 681 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d4z n ASN 682 N 1.61 4.90 -2.20 1.61 3.02 -1.26 -4.99 115.26 117.96 3d4z n ASN 682 Ca 0.00 -2.68 0.00 0.00 -0.03 0.00 0.00 54.58 51.87 3d4z n ASN 682 Cb 0.00 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 3d4z n ASN 682 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d4z n GLY 683 N 0.67 -0.70 3.75 7.41 0.00 -0.73 -4.96 105.19 110.63 3d4z n GLY 683 Ca 0.25 -1.71 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 3d4z n GLY 683 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3d4z s PRO 684 N -1.96 2.17 -0.26 1.61 0.04 -1.26 -4.76 135.00 130.58 3d4z s PRO 684 Ca 0.00 1.29 -0.12 0.00 0.04 0.00 0.00 61.00 62.21 3d4z s PRO 684 Cb 0.00 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 3d4z s PRO 684 CO 0.00 -1.73 0.22 0.99 0.04 0.00 0.00 177.00 176.52 3d4z s THR 685 N -2.73 5.31 -0.11 1.26 2.01 -0.40 -4.22 115.64 116.76 3d4z s THR 685 Ca 0.63 0.26 -0.01 0.00 0.31 0.00 0.00 61.69 62.89 3d4z s THR 685 Cb -0.19 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 3d4z s THR 685 CO 0.53 0.28 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.91 3d4z s LEU 686 N 1.47 3.08 -0.02 4.42 1.43 -0.05 -0.71 118.68 128.29 3d4z s LEU 686 Ca 0.09 -0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.10 3d4z s LEU 686 Cb -0.15 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 3d4z s LEU 686 CO 0.08 0.26 -0.10 0.00 0.23 0.00 0.00 176.35 176.82 3d4z s ALA 687 N -0.20 2.87 0.03 4.21 0.00 -0.37 -1.04 121.76 127.27 3d4z s ALA 687 Ca 0.02 -0.99 0.07 0.00 0.00 0.00 0.00 51.96 51.06 3d4z s ALA 687 Cb -0.13 -1.07 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 3d4z s ALA 687 CO 0.03 0.58 -0.21 -0.06 0.00 0.00 0.00 175.76 176.10 3d4z s PHE 688 N -0.87 1.86 0.98 0.00 0.40 0.42 -0.54 117.98 120.22 3d4z s PHE 688 Ca 0.14 -0.37 -0.13 0.00 -0.60 0.00 0.00 56.93 55.97 3d4z s PHE 688 Cb -0.11 -1.12 0.18 0.00 0.51 0.00 0.00 43.02 42.48 3d4z s PHE 688 CO 0.04 0.07 1.12 -1.54 0.70 0.00 0.00 175.22 175.61 3d4z s SER 689 N -1.07 2.86 0.08 1.36 1.04 0.42 -2.18 113.70 116.21 3d4z s SER 689 Ca 0.08 1.04 0.13 0.00 0.48 0.00 0.00 55.95 57.68 3d4z s SER 689 Cb -0.09 -1.64 0.57 0.00 0.10 0.00 0.00 66.02 64.97 3d4z s SER 689 CO 0.01 -2.97 1.40 -1.84 0.98 0.00 0.00 173.24 170.83 3d4z n GLU 690 N -4.05 0.05 -0.50 4.02 0.28 -1.26 -1.04 120.64 118.14 3d4z n GLU 690 Ca 0.06 0.39 0.08 0.00 -0.16 0.00 0.00 57.16 57.52 3d4z n GLU 690 Cb 0.58 -1.61 0.30 0.00 1.43 0.00 0.00 31.44 32.14 3d4z n GLU 690 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3d4z n GLN 691 N -1.71 3.21 -0.90 3.44 3.00 -1.26 -4.40 117.38 118.76 3d4z n GLN 691 Ca 0.02 -2.35 0.00 0.00 -0.01 0.00 0.00 57.00 54.66 3d4z n GLN 691 Cb 0.12 -1.77 0.00 0.00 0.00 0.00 0.00 30.24 28.60 3d4z n GLN 691 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3d4z n GLY 692 N 1.03 0.49 3.62 1.08 0.00 -0.20 -4.89 105.19 106.31 3d4z n GLY 692 Ca 0.21 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 3d4z n GLY 692 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d4z s LEU 693 N 0.00 3.30 0.27 0.99 1.43 -1.26 -4.74 118.68 118.67 3d4z s LEU 693 Ca 0.00 -0.01 -0.29 0.00 -1.03 0.00 0.00 54.13 52.80 3d4z s LEU 693 Cb 0.00 -1.79 -0.14 0.00 0.03 0.00 0.00 46.19 44.29 3d4z s LEU 693 CO 0.00 0.34 1.12 -0.11 0.23 0.00 0.00 176.35 177.93 3d4z n LEU 694 N 1.96 2.12 0.00 1.79 7.94 -1.26 -0.44 117.00 129.11 3d4z n LEU 694 Ca -0.17 1.17 0.00 0.00 -1.11 0.00 0.00 56.01 55.90 3d4z n LEU 694 Cb 0.53 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 43.16 3d4z n LEU 694 CO 0.29 -1.15 -0.44 0.29 -1.11 0.00 0.00 177.39 175.26 3d4z n LYS 695 N 1.08 3.17 -3.45 1.96 5.02 0.30 -1.89 118.16 124.34 3d4z n LYS 695 Ca 0.10 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.27 3d4z n LYS 695 Cb 0.31 -0.94 -0.03 0.00 -0.02 0.00 0.00 35.03 34.35 3d4z n LYS 695 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3d4z s SER 696 N -2.64 -0.55 -0.08 4.39 1.04 -1.07 -1.30 113.70 113.50 3d4z s SER 696 Ca 0.00 0.06 0.02 0.00 0.48 0.00 0.00 55.95 56.51 3d4z s SER 696 Cb 0.00 0.58 0.01 0.00 0.10 0.00 0.00 66.02 66.71 3d4z s SER 696 CO 0.00 -0.91 -0.14 -0.63 0.98 0.00 0.00 173.24 172.54 3d4z s ILE 697 N -3.42 1.34 -0.30 -1.02 1.01 -0.61 -1.23 121.20 116.95 3d4z s ILE 697 Ca -0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 3d4z s ILE 697 Cb -0.01 -1.22 0.04 0.00 0.01 0.00 0.00 42.46 41.28 3d4z s ILE 697 CO -0.10 0.40 0.04 -1.58 0.00 0.00 0.00 174.94 173.70 3d4z s GLN 698 N 0.78 2.66 0.20 2.79 0.74 0.11 -0.44 119.66 126.51 3d4z s GLN 698 Ca -0.12 -1.13 -0.06 0.00 0.05 0.00 0.00 55.36 54.10 3d4z s GLN 698 Cb -0.16 -3.27 0.14 0.00 1.10 0.00 0.00 33.01 30.82 3d4z s GLN 698 CO 0.02 -0.57 1.63 -0.07 -0.55 0.00 0.00 175.29 175.75 3d4z h LEU 699 N 8.11 0.90 -8.40 3.68 3.38 -1.86 -1.05 115.31 120.07 3d4z h LEU 699 Ca -0.25 -0.30 -0.18 0.00 0.09 0.00 0.00 57.88 57.24 3d4z h LEU 699 Cb 1.09 -0.24 -0.15 0.00 0.09 0.00 0.00 40.66 41.44 3d4z h LEU 699 CO 0.57 1.04 -0.67 0.42 0.09 0.00 0.00 178.44 179.90 3d4z s THR 700 N -4.76 0.27 0.33 0.22 -4.23 -1.26 -4.18 115.64 102.04 3d4z s THR 700 Ca -0.10 -1.89 0.13 0.00 -1.18 0.00 0.00 61.69 58.64 3d4z s THR 700 Cb 0.13 -1.84 0.33 0.00 1.34 0.00 0.00 72.50 72.45 3d4z s THR 700 CO 0.85 -0.68 1.66 -0.61 -0.54 0.00 0.00 174.62 175.29 3d4z h GLN 701 N 2.95 0.30 0.00 3.99 5.75 -1.93 -1.34 115.11 124.83 3d4z h GLN 701 Ca -0.35 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.13 3d4z h GLN 701 Cb 1.18 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.66 3d4z h GLN 701 CO 0.62 0.20 -0.67 -0.40 -2.65 0.00 0.00 178.83 175.93 3d4z n ASP 702 N -5.08 0.62 -4.95 -0.69 5.75 -1.26 -4.97 116.55 105.98 3d4z n ASP 702 Ca 0.30 -0.06 -0.24 0.00 -0.01 0.00 0.00 54.79 54.79 3d4z n ASP 702 Cb 0.94 0.31 0.03 0.00 -1.03 0.00 0.00 41.12 41.37 3d4z n ASP 702 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3d4z s SER 703 N -3.79 5.59 0.52 -1.12 1.04 -0.51 -5.08 113.70 110.35 3d4z s SER 703 Ca 0.07 0.35 -0.19 0.00 0.48 0.00 0.00 55.95 56.66 3d4z s SER 703 Cb 0.15 -1.42 -0.07 0.00 0.10 0.00 0.00 66.02 64.78 3d4z s SER 703 CO 0.73 -0.94 1.07 -2.84 0.98 0.00 0.00 173.24 172.24 3d4z s PRO 704 N -4.75 3.60 -0.57 4.02 0.02 -1.26 -4.78 135.00 131.27 3d4z s PRO 704 Ca 0.52 1.42 -0.28 0.00 0.02 0.00 0.00 61.00 62.68 3d4z s PRO 704 Cb -0.10 -2.06 0.03 0.00 0.02 0.00 0.00 34.50 32.39 3d4z s PRO 704 CO 0.40 -0.61 1.22 -1.01 -0.33 0.00 0.00 177.00 176.67 3d4z s HIS 705 N -1.97 2.58 -0.16 6.54 3.76 -1.26 -4.31 115.29 120.46 3d4z s HIS 705 Ca 0.69 0.43 -0.27 0.00 -0.15 0.00 0.00 55.06 55.76 3d4z s HIS 705 Cb -0.19 -4.50 -0.01 0.00 1.11 0.00 0.00 32.58 28.99 3d4z s HIS 705 CO 0.24 -1.63 0.92 0.08 -0.85 0.00 0.00 174.74 173.51 3d4z s VAL 706 N 5.06 4.81 0.12 -0.90 1.01 0.42 -4.80 120.40 126.12 3d4z s VAL 706 Ca 0.44 1.83 -0.31 0.00 0.00 0.00 0.00 61.98 63.94 3d4z s VAL 706 Cb -0.08 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 3d4z s VAL 706 CO 0.26 -0.02 1.68 -2.84 0.00 0.00 0.00 175.10 174.17 3d4z s PRO 707 N 2.31 4.18 -0.28 2.72 0.02 -1.26 -1.58 135.00 141.11 3d4z s PRO 707 Ca 0.42 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.88 3d4z s PRO 707 Cb -0.17 -3.41 0.14 0.00 0.02 0.00 0.00 34.50 31.08 3d4z s PRO 707 CO 0.13 -0.72 0.33 0.08 -0.33 0.00 0.00 177.00 176.49 3d4z s VAL 708 N 2.07 -0.48 -0.22 3.83 1.01 -0.42 -4.17 120.40 122.02 3d4z s VAL 708 Ca 0.74 -0.39 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 3d4z s VAL 708 Cb -0.43 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 3d4z s VAL 708 CO 0.33 -0.38 -0.04 -1.00 0.00 0.00 0.00 175.10 174.01 3d4z s HIS 709 N 2.43 2.96 0.15 5.22 3.76 -0.18 -2.89 115.29 126.74 3d4z s HIS 709 Ca 0.10 -0.89 -0.25 0.00 -0.15 0.00 0.00 55.06 53.86 3d4z s HIS 709 Cb -0.14 -2.10 -0.08 0.00 1.11 0.00 0.00 32.58 31.38 3d4z s HIS 709 CO -0.30 -0.52 0.78 -0.06 -0.85 0.00 0.00 174.74 173.79 3d4z s PHE 710 N 1.41 3.89 -0.04 1.40 0.08 -0.79 -0.66 117.98 123.27 3d4z s PHE 710 Ca 0.05 1.62 -0.06 0.00 0.12 0.00 0.00 56.93 58.66 3d4z s PHE 710 Cb -0.14 -2.78 0.01 0.00 -0.57 0.00 0.00 43.02 39.54 3d4z s PHE 710 CO -0.03 0.49 0.15 0.21 -0.10 0.00 0.00 175.22 175.94 3d4z s LYS 711 N -1.02 0.30 -0.13 0.44 2.20 0.06 -4.75 119.74 116.84 3d4z s LYS 711 Ca 0.36 -0.01 -0.02 0.00 -0.36 0.00 0.00 55.97 55.94 3d4z s LYS 711 Cb -0.23 0.13 -0.03 0.00 -1.51 0.00 0.00 37.83 36.20 3d4z s LYS 711 CO 0.26 -0.06 -0.04 -0.06 -0.36 0.00 0.00 175.35 175.09 3d4z s PHE 712 N -0.47 3.01 0.31 4.03 0.40 -1.26 -0.38 117.98 123.61 3d4z s PHE 712 Ca -0.06 -0.20 0.03 0.00 -0.60 0.00 0.00 56.93 56.10 3d4z s PHE 712 Cb -0.04 -1.89 -0.05 0.00 0.51 0.00 0.00 43.02 41.56 3d4z s PHE 712 CO 0.01 0.08 0.10 -0.51 0.70 0.00 0.00 175.22 175.60 3d4z s LEU 713 N 0.00 1.85 -0.02 -0.37 1.02 -0.39 -1.44 118.68 119.33 3d4z s LEU 713 Ca 0.01 -1.45 0.03 0.00 0.02 0.00 0.00 54.13 52.73 3d4z s LEU 713 Cb -0.13 -0.09 -0.00 0.00 0.02 0.00 0.00 46.19 45.99 3d4z s LEU 713 CO 0.03 -0.75 -0.10 -1.59 0.02 0.00 0.00 176.35 173.96 3d4z s LYS 714 N -3.91 0.89 0.04 1.70 -2.85 0.36 -0.62 119.74 115.35 3d4z s LYS 714 Ca 0.35 -0.33 -0.01 0.00 -1.00 0.00 0.00 55.97 54.98 3d4z s LYS 714 Cb 0.07 -0.84 -0.04 0.00 -2.06 0.00 0.00 37.83 34.95 3d4z s LYS 714 CO 0.15 0.17 0.21 0.71 0.10 0.00 0.00 175.35 176.69 3d4z s TYR 715 N -0.03 3.53 0.00 1.78 2.02 0.10 -0.65 117.35 124.10 3d4z s TYR 715 Ca 0.00 0.30 0.00 0.00 -0.37 0.00 0.00 57.07 57.01 3d4z s TYR 715 Cb -0.06 -1.79 0.00 0.00 -0.40 0.00 0.00 41.96 39.70 3d4z s TYR 715 CO 0.00 0.60 0.00 0.41 -1.57 0.00 0.00 175.55 174.99 3d4z n GLY 716 N 0.50 4.35 3.26 0.71 0.00 -1.26 -1.13 105.19 111.61 3d4z n GLY 716 Ca -0.07 -2.10 -0.24 0.00 0.00 0.00 0.00 46.02 43.62 3d4z n GLY 716 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d4z s VAL 717 N 0.75 1.61 0.29 1.61 1.01 -1.25 -3.21 120.40 121.21 3d4z s VAL 717 Ca 0.00 -1.37 -0.29 0.00 0.00 0.00 0.00 61.98 60.32 3d4z s VAL 717 Cb 0.00 -1.45 -0.10 0.00 0.00 0.00 0.00 36.38 34.83 3d4z s VAL 717 CO 0.00 0.03 1.30 -0.13 0.00 0.00 0.00 175.10 176.30 3d4z s ARG 718 N -1.58 4.38 0.10 2.72 0.52 -1.25 -4.62 118.95 119.21 3d4z s ARG 718 Ca 0.06 2.16 0.16 0.00 -0.52 0.00 0.00 55.73 57.58 3d4z s ARG 718 Cb -0.09 -3.11 -0.11 0.00 0.52 0.00 0.00 34.95 32.16 3d4z s ARG 718 CO 0.03 -0.18 0.95 0.66 0.02 0.00 0.00 175.30 176.77 3d4z h SER 719 N 3.96 0.00 -3.51 0.23 4.64 -1.97 -3.45 113.55 113.44 3d4z h SER 719 Ca -0.48 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.17 3d4z h SER 719 Cb 1.22 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.03 3d4z h SER 719 CO 0.69 0.60 -0.80 -1.38 -0.87 0.00 0.00 176.83 175.07 3d4z s HIS 720 N -2.91 2.71 0.00 4.77 0.00 -1.26 -5.03 115.29 113.57 3d4z s HIS 720 Ca -0.02 -0.64 0.00 0.00 -3.00 0.00 0.00 55.06 51.41 3d4z s HIS 720 Cb 0.08 -1.76 0.00 0.00 -4.00 0.00 0.00 32.58 26.90 3d4z s HIS 720 CO 0.80 -0.18 0.00 0.41 -1.00 0.00 0.00 174.74 174.77 3d4z n GLY 721 N 3.26 -0.07 3.82 -1.38 0.00 -1.26 -4.95 105.19 104.61 3d4z n GLY 721 Ca -0.18 -1.59 -0.37 0.00 0.00 0.00 0.00 46.02 43.89 3d4z n GLY 721 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d4z s ASP 722 N -4.00 7.05 -0.14 1.61 1.01 -1.26 -4.99 116.67 115.94 3d4z s ASP 722 Ca 0.00 1.36 -0.08 0.00 0.71 0.00 0.00 52.55 54.53 3d4z s ASP 722 Cb 0.00 -2.40 -0.04 0.00 1.01 0.00 0.00 42.92 41.49 3d4z s ASP 722 CO 0.00 0.10 0.15 -0.13 0.21 0.00 0.00 175.17 175.49 3d4z s ARG 723 N -1.77 3.72 0.56 8.23 3.00 -1.26 -4.53 118.95 126.90 3d4z s ARG 723 Ca 0.39 -0.14 -0.21 0.00 0.00 0.00 0.00 55.73 55.78 3d4z s ARG 723 Cb -0.17 -3.27 -0.05 0.00 0.00 0.00 0.00 34.95 31.45 3d4z s ARG 723 CO 0.21 0.61 1.25 0.43 0.00 0.00 0.00 175.30 177.79 3d4z n SER 724 N 2.52 2.15 0.00 0.23 7.64 -1.26 -4.53 113.62 120.37 3d4z n SER 724 Ca -0.18 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.63 3d4z n SER 724 Cb 0.54 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 3d4z n SER 724 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d4z n GLY 725 N 0.91 3.74 0.25 0.23 0.00 -0.70 -4.54 105.19 105.08 3d4z n GLY 725 Ca 0.11 -0.89 0.06 0.00 0.00 0.00 0.00 46.02 45.31 3d4z n GLY 725 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d4z h ALA 726 N 1.70 1.82 0.01 4.61 0.00 -1.85 -3.19 119.26 122.36 3d4z h ALA 726 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.52 3d4z h ALA 726 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3d4z h ALA 726 CO 0.00 0.14 -1.71 0.66 0.00 0.00 0.00 179.25 178.34 3d4z n TYR 727 N -4.43 0.76 -3.63 0.00 4.02 -1.26 -2.76 117.16 109.85 3d4z n TYR 727 Ca -0.02 0.30 -0.36 0.00 -0.01 0.00 0.00 57.90 57.80 3d4z n TYR 727 Cb 0.16 -1.08 -0.06 0.00 -0.02 0.00 0.00 39.34 38.34 3d4z n TYR 727 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3d4z s LEU 728 N -7.64 4.41 -0.34 7.72 1.43 -1.21 -0.83 118.68 122.22 3d4z s LEU 728 Ca -0.31 0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 53.49 3d4z s LEU 728 Cb 0.08 -2.63 0.04 0.00 0.03 0.00 0.00 46.19 43.71 3d4z s LEU 728 CO 0.59 0.28 0.12 0.12 0.23 0.00 0.00 176.35 177.69 3d4z s PHE 729 N -1.20 3.26 -0.51 0.29 5.36 -1.14 -1.72 117.98 122.31 3d4z s PHE 729 Ca 0.26 -1.41 0.06 0.00 -0.96 0.00 0.00 56.93 54.88 3d4z s PHE 729 Cb -0.15 -2.32 0.22 0.00 -0.34 0.00 0.00 43.02 40.44 3d4z s PHE 729 CO 0.14 -0.73 0.56 1.28 -1.46 0.00 0.00 175.22 175.00 3d4z n LEU 730 N 4.82 1.55 -4.76 6.12 4.77 -1.26 -4.68 117.00 123.57 3d4z n LEU 730 Ca -0.12 -4.94 -0.34 0.00 -0.03 0.00 0.00 56.01 50.58 3d4z n LEU 730 Cb 0.45 0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.61 3d4z n LEU 730 CO 0.32 1.99 0.78 -2.16 -1.33 0.00 0.00 177.39 176.99 3d4z s PRO 731 N -1.40 2.86 -1.09 3.23 0.04 -1.26 -3.92 135.00 133.46 3d4z s PRO 731 Ca 0.35 1.61 -0.05 0.00 0.04 0.00 0.00 61.00 62.95 3d4z s PRO 731 Cb 0.11 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.82 3d4z s PRO 731 CO -0.10 -1.24 2.47 0.27 0.04 0.00 0.00 177.00 178.44 3d4z n ASN 732 N -2.00 7.63 0.00 6.66 6.94 -1.20 -4.77 115.26 128.53 3d4z n ASN 732 Ca 0.12 -3.17 0.00 0.00 -0.02 0.00 0.00 54.58 51.51 3d4z n ASN 732 Cb 0.51 -1.32 0.00 0.00 -2.36 0.00 0.00 39.78 36.61 3d4z n ASN 732 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3d4z n GLY 733 N 1.46 0.74 3.61 4.83 0.00 -1.26 -4.85 105.19 109.72 3d4z n GLY 733 Ca 0.59 -2.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 3d4z n GLY 733 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3d4z n PRO 734 N 0.79 -0.06 -1.96 1.61 -0.02 -1.26 -4.80 135.00 129.31 3d4z n PRO 734 Ca 0.00 0.05 -0.35 0.00 -2.02 0.00 0.00 63.50 61.18 3d4z n PRO 734 Cb 0.00 -2.26 0.04 0.00 -0.02 0.00 0.00 33.50 31.26 3d4z n PRO 734 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d4z s ALA 735 N -2.28 2.51 -0.06 3.55 0.00 -1.26 -4.91 121.76 119.31 3d4z s ALA 735 Ca 0.68 0.93 -0.01 0.00 0.00 0.00 0.00 51.96 53.56 3d4z s ALA 735 Cb -0.27 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.39 3d4z s ALA 735 CO 0.56 -1.21 0.00 -1.12 0.00 0.00 0.00 175.76 174.00 3d4z s SER 736 N -1.76 5.18 0.35 0.00 0.01 0.18 -4.84 113.70 112.82 3d4z s SER 736 Ca 0.76 0.09 -0.29 0.00 1.31 0.00 0.00 55.95 57.82 3d4z s SER 736 Cb -0.29 -1.42 -0.11 0.00 0.21 0.00 0.00 66.02 64.42 3d4z s SER 736 CO 0.34 0.34 1.46 -2.84 0.41 0.00 0.00 173.24 172.96 3d4z s PRO 737 N -1.12 4.17 0.14 12.44 0.02 -1.26 -0.49 135.00 148.90 3d4z s PRO 737 Ca 0.16 2.49 -0.31 0.00 0.02 0.00 0.00 61.00 63.35 3d4z s PRO 737 Cb -0.11 -3.00 -0.10 0.00 0.02 0.00 0.00 34.50 31.30 3d4z s PRO 737 CO 0.05 -0.47 1.69 0.08 -0.33 0.00 0.00 177.00 178.02 3d4z s VAL 738 N -0.89 2.55 -0.27 3.83 1.01 -0.52 -4.78 120.40 121.32 3d4z s VAL 738 Ca 0.54 0.25 -0.29 0.00 0.00 0.00 0.00 61.98 62.48 3d4z s VAL 738 Cb -0.45 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 3d4z s VAL 738 CO 0.58 0.01 1.65 -1.61 0.00 0.00 0.00 175.10 175.72 3d4z s GLU 739 N 1.90 3.64 0.02 2.72 2.02 -1.26 -4.89 118.70 122.84 3d4z s GLU 739 Ca 0.75 1.51 0.23 0.00 0.02 0.00 0.00 54.97 57.48 3d4z s GLU 739 Cb -0.45 -4.08 0.16 0.00 0.10 0.00 0.00 34.13 29.86 3d4z s GLU 739 CO 0.33 -1.49 1.14 1.28 0.02 0.00 0.00 175.26 176.54 3d4z n LEU 740 N 9.02 0.66 0.00 1.80 4.77 -1.26 -4.79 117.00 127.20 3d4z n LEU 740 Ca 0.20 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 3d4z n LEU 740 Cb 0.46 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 3d4z n LEU 740 CO 0.66 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 3d4z n GLY 741 N 1.44 3.20 2.88 -0.72 0.00 -1.26 -3.69 105.19 107.03 3d4z n GLY 741 Ca 0.04 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 3d4z n GLY 741 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3d4z s GLN 742 N 0.00 2.24 0.64 1.61 0.74 -1.26 -5.09 119.66 118.55 3d4z s GLN 742 Ca 0.00 -3.09 -0.15 0.00 0.05 0.00 0.00 55.36 52.17 3d4z s GLN 742 Cb 0.00 -3.26 -0.01 0.00 1.10 0.00 0.00 33.01 30.84 3d4z s GLN 742 CO 0.00 -1.25 1.08 -1.25 -0.55 0.00 0.00 175.29 173.32 3d4z s PRO 743 N -1.08 3.02 -0.11 1.67 0.04 -1.24 -4.94 135.00 132.36 3d4z s PRO 743 Ca 0.23 1.24 -0.28 0.00 0.04 0.00 0.00 61.00 62.24 3d4z s PRO 743 Cb -0.09 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 3d4z s PRO 743 CO -0.13 -1.06 0.93 0.08 0.04 0.00 0.00 177.00 176.86 3d4z s VAL 744 N -2.50 4.85 -0.10 -0.36 1.01 -1.26 -4.82 120.40 117.21 3d4z s VAL 744 Ca 0.64 1.88 0.01 0.00 0.00 0.00 0.00 61.98 64.51 3d4z s VAL 744 Cb -0.17 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.95 3d4z s VAL 744 CO 0.42 0.05 -0.13 -0.69 0.00 0.00 0.00 175.10 174.75 3d4z s VAL 745 N 1.81 3.09 -0.19 2.92 1.01 -0.68 -2.52 120.40 125.85 3d4z s VAL 745 Ca 0.45 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 3d4z s VAL 745 Cb -0.18 -2.27 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 3d4z s VAL 745 CO 0.18 0.55 -0.12 -0.22 0.00 0.00 0.00 175.10 175.49 3d4z s LEU 746 N -0.01 2.59 -0.21 3.92 2.96 0.54 0.09 118.68 128.56 3d4z s LEU 746 Ca -0.03 -0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 53.37 3d4z s LEU 746 Cb -0.14 -1.62 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 3d4z s LEU 746 CO 0.04 0.03 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.38 3d4z s VAL 747 N 1.16 3.56 -0.16 1.68 1.01 0.46 -0.76 120.40 127.35 3d4z s VAL 747 Ca 0.01 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 3d4z s VAL 747 Cb -0.14 -2.61 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 3d4z s VAL 747 CO -0.04 0.43 -0.13 -0.89 0.00 0.00 0.00 175.10 174.47 3d4z s THR 748 N 1.26 2.87 -0.19 3.92 2.01 0.19 -0.48 115.64 125.22 3d4z s THR 748 Ca 0.03 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.34 3d4z s THR 748 Cb -0.14 -2.22 0.03 0.00 0.01 0.00 0.00 72.50 70.17 3d4z s THR 748 CO -0.01 0.51 -0.17 -0.75 -0.69 0.00 0.00 174.62 173.51 3d4z s LYS 749 N 0.76 2.65 0.21 4.92 2.20 -0.26 -0.03 119.74 130.19 3d4z s LYS 749 Ca -0.05 -0.85 0.02 0.00 -0.36 0.00 0.00 55.97 54.72 3d4z s LYS 749 Cb -0.15 -2.51 -0.05 0.00 -1.51 0.00 0.00 37.83 33.61 3d4z s LYS 749 CO 0.01 -0.29 0.04 0.20 -0.36 0.00 0.00 175.35 174.95 3d4z s GLY 750 N 1.31 1.43 0.22 5.54 0.00 -0.94 -0.70 107.32 114.19 3d4z s GLY 750 Ca 0.02 -1.70 -0.03 0.00 0.00 0.00 0.00 44.72 43.01 3d4z s GLY 750 CO -0.11 -1.56 1.63 1.70 0.00 0.00 0.00 173.10 174.76 3d4z h LYS 751 N 2.57 0.67 0.00 2.90 3.64 -1.97 -3.31 116.57 121.07 3d4z h LYS 751 Ca -0.37 -0.29 -0.29 0.00 -1.27 0.00 0.00 60.65 58.43 3d4z h LYS 751 Cb 1.22 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.97 3d4z h LYS 751 CO 0.62 0.88 -2.14 1.28 -2.27 0.00 0.00 179.45 177.82 3d4z n LEU 752 N -4.09 0.20 -3.68 5.20 4.77 -1.26 -4.49 117.00 113.65 3d4z n LEU 752 Ca -0.01 0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 3d4z n LEU 752 Cb 0.46 0.34 -0.10 0.00 -2.33 0.00 0.00 43.42 41.79 3d4z n LEU 752 CO 0.44 0.38 0.13 -0.70 -1.33 0.00 0.00 177.39 176.31 3d4z s GLU 753 N -2.70 0.47 0.24 3.23 2.12 -1.25 -4.48 118.70 116.33 3d4z s GLU 753 Ca -0.08 0.90 0.07 0.00 0.36 0.00 0.00 54.97 56.22 3d4z s GLU 753 Cb 0.08 0.02 -0.05 0.00 0.26 0.00 0.00 34.13 34.43 3d4z s GLU 753 CO 0.84 -0.16 -0.11 -1.12 -0.54 0.00 0.00 175.26 174.18 3d4z s SER 754 N 1.47 2.66 0.09 -1.70 0.01 -0.40 -2.21 113.70 113.62 3d4z s SER 754 Ca -0.10 -1.10 -0.25 0.00 1.31 0.00 0.00 55.95 55.82 3d4z s SER 754 Cb -0.08 -0.15 0.07 0.00 0.21 0.00 0.00 66.02 66.07 3d4z s SER 754 CO -0.15 -0.24 0.61 -0.94 0.41 0.00 0.00 173.24 172.93 3d4z s SER 755 N -3.37 -0.58 -0.14 2.44 1.04 0.95 -0.59 113.70 113.45 3d4z s SER 755 Ca 0.26 0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.90 3d4z s SER 755 Cb 0.01 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.72 3d4z s SER 755 CO 0.09 -0.85 -0.18 -0.69 0.98 0.00 0.00 173.24 172.59 3d4z s VAL 756 N -2.96 1.81 -0.01 5.02 1.01 -0.22 -0.64 120.40 124.40 3d4z s VAL 756 Ca -0.03 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.22 3d4z s VAL 756 Cb -0.01 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 3d4z s VAL 756 CO -0.06 0.50 -0.23 -0.44 0.00 0.00 0.00 175.10 174.87 3d4z s SER 757 N 1.12 2.72 -0.00 3.32 0.01 0.06 -0.65 113.70 120.28 3d4z s SER 757 Ca -0.01 -0.43 0.01 0.00 1.31 0.00 0.00 55.95 56.82 3d4z s SER 757 Cb -0.14 -0.30 0.00 0.00 0.21 0.00 0.00 66.02 65.79 3d4z s SER 757 CO -0.06 0.28 -0.02 0.54 0.41 0.00 0.00 173.24 174.39 3d4z s VAL 758 N -0.57 0.14 -0.83 3.43 0.11 0.30 -0.34 120.40 122.65 3d4z s VAL 758 Ca 0.09 -0.06 -0.20 0.00 -2.93 0.00 0.00 61.98 58.88 3d4z s VAL 758 Cb -0.09 -0.14 0.11 0.00 -1.53 0.00 0.00 36.38 34.73 3d4z s VAL 758 CO -0.01 0.05 1.06 -0.83 -3.33 0.00 0.00 175.10 172.04 3d4z s GLY 759 N 0.07 1.73 0.44 6.54 0.00 -1.05 -1.06 107.32 114.00 3d4z s GLY 759 Ca -0.00 -2.43 -0.00 0.00 0.00 0.00 0.00 44.72 42.28 3d4z s GLY 759 CO -0.00 2.02 0.67 1.08 0.00 0.00 0.00 173.10 176.86 3d4z s LEU 760 N 3.18 3.67 0.13 0.66 1.43 0.26 -4.41 118.68 123.60 3d4z s LEU 760 Ca 0.28 0.34 -0.31 0.00 -1.03 0.00 0.00 54.13 53.41 3d4z s LEU 760 Cb -0.10 -3.22 -0.10 0.00 0.03 0.00 0.00 46.19 42.80 3d4z s LEU 760 CO -0.02 -0.66 1.79 -2.84 0.23 0.00 0.00 176.35 174.85 3d4z s PRO 761 N -4.55 4.14 0.00 1.29 0.02 -1.26 -1.89 135.00 132.75 3d4z s PRO 761 Ca 0.48 2.57 0.00 0.00 0.02 0.00 0.00 61.00 64.07 3d4z s PRO 761 Cb -0.10 -3.50 0.00 0.00 0.02 0.00 0.00 34.50 30.92 3d4z s PRO 761 CO 0.38 -0.81 0.00 0.43 -0.33 0.00 0.00 177.00 176.67 3d4z n SER 762 N 5.36 0.00 -3.68 2.53 7.64 -1.26 -4.96 113.62 119.26 3d4z n SER 762 Ca 0.17 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.88 3d4z n SER 762 Cb 0.38 -1.00 -0.16 0.00 -1.01 0.00 0.00 64.21 62.41 3d4z n SER 762 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3d4z s VAL 763 N -2.17 -0.21 -0.40 0.44 1.01 -0.79 -0.53 120.40 117.75 3d4z s VAL 763 Ca 0.00 0.35 -0.21 0.00 0.00 0.00 0.00 61.98 62.12 3d4z s VAL 763 Cb 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 36.38 36.13 3d4z s VAL 763 CO 0.00 0.15 0.67 -0.69 0.00 0.00 0.00 175.10 175.23 3d4z s VAL 764 N 2.14 4.82 -0.18 2.92 1.01 -0.10 -0.58 120.40 130.42 3d4z s VAL 764 Ca 0.02 0.44 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 3d4z s VAL 764 Cb -0.12 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 3d4z s VAL 764 CO -0.05 -0.48 0.06 -2.28 0.00 0.00 0.00 175.10 172.35 3d4z s HIS 765 N 2.87 3.23 -0.04 5.22 5.04 -0.22 -0.61 115.29 130.78 3d4z s HIS 765 Ca 0.25 0.03 0.02 0.00 -1.54 0.00 0.00 55.06 53.83 3d4z s HIS 765 Cb -0.14 -2.08 0.01 0.00 0.04 0.00 0.00 32.58 30.42 3d4z s HIS 765 CO 0.18 0.13 -0.08 -0.65 -2.34 0.00 0.00 174.74 171.98 3d4z s GLN 766 N 0.41 0.98 -0.21 2.88 -0.21 0.43 -0.54 119.66 123.40 3d4z s GLN 766 Ca 0.03 -0.24 -0.03 0.00 0.02 0.00 0.00 55.36 55.14 3d4z s GLN 766 Cb -0.13 -0.91 -0.01 0.00 1.00 0.00 0.00 33.01 32.96 3d4z s GLN 766 CO 0.00 0.03 -0.06 0.99 -2.12 0.00 0.00 175.29 174.13 3d4z s THR 767 N 0.50 3.23 -0.09 -0.19 2.01 0.17 -0.85 115.64 120.42 3d4z s THR 767 Ca -0.08 -0.54 0.03 0.00 0.31 0.00 0.00 61.69 61.40 3d4z s THR 767 Cb -0.11 -2.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.92 3d4z s THR 767 CO 0.01 0.44 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.58 3d4z s ILE 768 N 1.39 2.77 -0.14 1.82 1.01 0.19 -1.06 121.20 127.18 3d4z s ILE 768 Ca 0.05 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.93 3d4z s ILE 768 Cb -0.14 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.24 3d4z s ILE 768 CO -0.04 0.56 -0.21 -0.04 0.00 0.00 0.00 174.94 175.21 3d4z s MET 769 N -0.08 2.96 -0.03 2.79 -1.94 0.25 -0.53 119.30 122.72 3d4z s MET 769 Ca -0.03 -0.83 0.04 0.00 -1.71 0.00 0.00 55.69 53.15 3d4z s MET 769 Cb -0.14 -2.42 0.06 0.00 2.01 0.00 0.00 34.83 34.33 3d4z s MET 769 CO 0.04 -0.05 0.95 0.54 -0.01 0.00 0.00 175.02 176.49 3d4z n ARG 770 N 4.18 2.00 0.00 2.03 1.74 -1.26 -1.28 116.66 124.07 3d4z n ARG 770 Ca -0.20 -1.53 0.00 0.00 -0.77 0.00 0.00 57.85 55.35 3d4z n ARG 770 Cb 0.51 -0.99 0.00 0.00 -1.02 0.00 0.00 32.46 30.96 3d4z n ARG 770 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d4z n GLY 771 N -0.58 1.42 0.00 -0.13 0.00 -1.26 -4.89 105.19 99.75 3d4z n GLY 771 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3d4z n GLY 771 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d4z n GLY 772 N -0.41 5.41 3.74 -0.02 0.00 -1.26 -3.61 105.19 109.03 3d4z n GLY 772 Ca 0.00 -1.07 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 3d4z n GLY 772 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d4z n ALA 773 N -3.00 2.39 -1.02 4.61 0.00 -1.26 -4.56 120.51 117.67 3d4z n ALA 773 Ca 0.00 0.37 -0.31 0.00 0.00 0.00 0.00 53.44 53.50 3d4z n ALA 773 Cb 0.00 -2.44 0.12 0.00 0.00 0.00 0.00 19.45 17.13 3d4z n ALA 773 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3d4z s PRO 774 N -0.64 1.70 -0.12 0.00 0.04 -1.24 -4.76 135.00 129.99 3d4z s PRO 774 Ca 0.63 1.40 -0.03 0.00 0.04 0.00 0.00 61.00 63.04 3d4z s PRO 774 Cb -0.51 -1.82 -0.03 0.00 0.04 0.00 0.00 34.50 32.18 3d4z s PRO 774 CO 0.50 -2.10 0.01 -2.00 0.04 0.00 0.00 177.00 173.45 3d4z s GLU 775 N -4.67 3.33 -0.12 4.56 2.12 0.31 -1.61 118.70 122.62 3d4z s GLU 775 Ca 0.65 -0.40 -0.01 0.00 0.36 0.00 0.00 54.97 55.56 3d4z s GLU 775 Cb -0.21 -2.91 -0.02 0.00 0.26 0.00 0.00 34.13 31.24 3d4z s GLU 775 CO 0.55 0.54 -0.08 0.42 -0.54 0.00 0.00 175.26 176.15 3d4z s ILE 776 N -0.41 3.53 -0.08 -3.70 -1.09 -0.36 0.56 121.20 119.66 3d4z s ILE 776 Ca 0.08 -0.50 0.03 0.00 -2.23 0.00 0.00 60.65 58.02 3d4z s ILE 776 Cb -0.12 -2.50 0.01 0.00 -1.58 0.00 0.00 42.46 38.27 3d4z s ILE 776 CO 0.02 0.53 -0.15 -0.13 -1.23 0.00 0.00 174.94 173.98 3d4z s ARG 777 N 0.07 2.06 -0.18 2.79 0.52 -0.03 -0.58 118.95 123.59 3d4z s ARG 777 Ca -0.03 -0.53 -0.00 0.00 -0.52 0.00 0.00 55.73 54.65 3d4z s ARG 777 Cb -0.14 -1.66 0.01 0.00 0.52 0.00 0.00 34.95 33.68 3d4z s ARG 777 CO 0.03 0.05 -0.14 -0.80 0.02 0.00 0.00 175.30 174.46 3d4z s ASN 778 N 0.64 3.59 -0.54 0.23 0.01 0.03 -0.43 114.94 118.47 3d4z s ASN 778 Ca -0.15 -0.53 -0.20 0.00 -0.71 0.00 0.00 52.86 51.27 3d4z s ASN 778 Cb -0.16 -1.57 0.06 0.00 0.41 0.00 0.00 41.25 39.99 3d4z s ASN 778 CO 0.04 0.02 0.72 -0.22 -1.51 0.00 0.00 177.10 176.15 3d4z s LEU 779 N 1.20 4.85 -0.28 0.60 2.96 0.22 -0.71 118.68 127.51 3d4z s LEU 779 Ca 0.02 -0.91 -0.09 0.00 -0.22 0.00 0.00 54.13 52.93 3d4z s LEU 779 Cb -0.14 -2.48 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 3d4z s LEU 779 CO -0.06 -1.03 0.13 -0.69 -1.32 0.00 0.00 176.35 173.38 3d4z s VAL 780 N 2.97 4.68 -0.38 1.68 1.01 0.68 -0.93 120.40 130.11 3d4z s VAL 780 Ca 0.18 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.98 3d4z s VAL 780 Cb -0.19 -3.28 0.12 0.00 0.00 0.00 0.00 36.38 33.04 3d4z s VAL 780 CO 0.12 0.21 0.18 -0.62 0.00 0.00 0.00 175.10 174.98 3d4z s ASP 781 N 1.65 3.81 0.00 3.32 2.15 0.31 -1.84 116.67 126.07 3d4z s ASP 781 Ca 0.06 -2.23 0.20 0.00 0.43 0.00 0.00 52.55 51.01 3d4z s ASP 781 Cb -0.16 -0.97 0.99 0.00 -0.30 0.00 0.00 42.92 42.48 3d4z s ASP 781 CO 0.06 -0.33 1.64 0.00 -0.17 0.00 0.00 175.17 176.38 3d4z n ILE 782 N 4.06 0.42 -1.18 4.11 3.06 -1.26 -4.32 119.36 124.25 3d4z n ILE 782 Ca 0.05 0.11 0.00 0.00 -2.50 0.00 0.00 62.75 60.40 3d4z n ILE 782 Cb 0.38 -0.77 0.00 0.00 0.54 0.00 0.00 39.64 39.79 3d4z n ILE 782 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3d4z n GLY 783 N 0.46 3.14 1.77 4.50 0.00 -1.26 -1.86 105.19 111.93 3d4z n GLY 783 Ca 0.09 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 3d4z n GLY 783 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d4z n SER 784 N 2.93 3.74 -4.56 1.61 3.41 -1.26 -4.90 113.62 114.59 3d4z n SER 784 Ca 0.00 -3.49 -0.32 0.00 -0.26 0.00 0.00 58.87 54.80 3d4z n SER 784 Cb 0.00 -0.73 -0.04 0.00 -0.26 0.00 0.00 64.21 63.17 3d4z n SER 784 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3d4z s LEU 785 N -3.16 3.29 0.68 1.04 1.43 -0.78 -4.96 118.68 116.22 3d4z s LEU 785 Ca 0.52 -1.12 -0.12 0.00 -1.03 0.00 0.00 54.13 52.38 3d4z s LEU 785 Cb 0.44 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 44.09 3d4z s LEU 785 CO 0.09 -2.34 1.06 -1.81 0.23 0.00 0.00 176.35 173.57 3d4z s ASP 786 N 6.75 5.43 -1.40 2.29 1.11 -1.26 -3.43 116.67 126.16 3d4z s ASP 786 Ca 0.62 1.66 -0.00 0.00 0.18 0.00 0.00 52.55 55.01 3d4z s ASP 786 Cb -0.03 -2.50 0.00 0.00 1.07 0.00 0.00 42.92 41.46 3d4z s ASP 786 CO -0.01 -1.41 0.44 0.59 1.18 0.00 0.00 175.17 175.96 3d4z n ASN 787 N -2.93 -0.40 -3.93 0.27 3.02 0.33 -4.97 115.26 106.65 3d4z n ASN 787 Ca 0.08 -1.00 -0.16 0.00 -0.03 0.00 0.00 54.58 53.47 3d4z n ASN 787 Cb 0.53 -3.11 -0.15 0.00 -0.61 0.00 0.00 39.78 36.45 3d4z n ASN 787 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3d4z s THR 788 N -3.93 0.39 -0.14 3.41 2.01 -0.60 -3.94 115.64 112.84 3d4z s THR 788 Ca 0.01 -0.17 0.02 0.00 0.31 0.00 0.00 61.69 61.86 3d4z s THR 788 Cb -0.01 -0.36 0.01 0.00 0.01 0.00 0.00 72.50 72.16 3d4z s THR 788 CO 0.88 0.13 -0.19 -1.61 -0.69 0.00 0.00 174.62 173.15 3d4z s GLU 789 N 0.13 2.67 -0.22 4.92 2.02 -0.29 -0.74 118.70 127.19 3d4z s GLU 789 Ca -0.01 -0.72 -0.15 0.00 0.02 0.00 0.00 54.97 54.11 3d4z s GLU 789 Cb -0.05 -2.24 -0.04 0.00 0.10 0.00 0.00 34.13 31.90 3d4z s GLU 789 CO -0.00 -0.09 0.36 0.42 0.02 0.00 0.00 175.26 175.97 3d4z s ILE 790 N 1.03 5.21 0.03 -1.63 1.01 -0.34 -0.72 121.20 125.80 3d4z s ILE 790 Ca -0.03 0.62 0.06 0.00 0.00 0.00 0.00 60.65 61.30 3d4z s ILE 790 Cb -0.15 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 3d4z s ILE 790 CO -0.05 0.24 -0.16 0.54 0.00 0.00 0.00 174.94 175.52 3d4z s VAL 791 N 1.42 2.93 -0.24 2.92 0.11 0.21 0.04 120.40 127.81 3d4z s VAL 791 Ca 0.17 -1.10 -0.09 0.00 -2.93 0.00 0.00 61.98 58.03 3d4z s VAL 791 Cb -0.15 -2.24 -0.04 0.00 -1.53 0.00 0.00 36.38 32.42 3d4z s VAL 791 CO 0.08 0.36 0.10 -0.32 -3.33 0.00 0.00 175.10 171.99 3d4z s MET 792 N -1.40 3.86 0.07 1.54 1.75 -0.39 -1.26 119.30 123.47 3d4z s MET 792 Ca 0.15 -0.38 0.09 0.00 -1.25 0.00 0.00 55.69 54.30 3d4z s MET 792 Cb -0.11 -3.39 -0.03 0.00 2.84 0.00 0.00 34.83 34.14 3d4z s MET 792 CO 0.05 -0.02 -0.22 0.50 -0.65 0.00 0.00 175.02 174.68 3d4z s ARG 793 N 1.21 1.83 -0.16 4.11 3.52 0.48 -0.75 118.95 129.20 3d4z s ARG 793 Ca 0.06 -1.11 -0.02 0.00 -0.13 0.00 0.00 55.73 54.52 3d4z s ARG 793 Cb -0.14 -2.06 -0.02 0.00 -1.56 0.00 0.00 34.95 31.17 3d4z s ARG 793 CO 0.04 0.51 -0.08 -0.51 -0.81 0.00 0.00 175.30 174.45 3d4z s LEU 794 N -1.57 2.95 -0.14 -0.88 1.43 0.77 -0.76 118.68 120.48 3d4z s LEU 794 Ca 0.14 -0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 52.97 3d4z s LEU 794 Cb -0.10 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.40 3d4z s LEU 794 CO 0.05 0.13 -0.11 -1.61 0.23 0.00 0.00 176.35 175.04 3d4z s GLU 795 N 0.57 3.40 0.29 1.70 2.02 0.16 -1.56 118.70 125.27 3d4z s GLU 795 Ca -0.05 -0.67 0.04 0.00 0.02 0.00 0.00 54.97 54.31 3d4z s GLU 795 Cb -0.15 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.35 3d4z s GLU 795 CO 0.03 0.16 0.21 0.95 0.02 0.00 0.00 175.26 176.63 3d4z s THR 796 N 0.50 0.06 -1.56 3.63 -4.23 -0.18 -1.01 115.64 112.84 3d4z s THR 796 Ca -0.08 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.62 3d4z s THR 796 Cb -0.16 -2.50 0.65 0.00 1.34 0.00 0.00 72.50 71.84 3d4z s THR 796 CO 0.04 0.00 1.55 1.41 -0.54 0.00 0.00 174.62 177.08 3d4z n HIS 797 N -0.51 1.19 -2.23 3.99 8.25 -1.26 -4.58 115.22 120.08 3d4z n HIS 797 Ca 0.04 -0.52 -0.42 0.00 -0.26 0.00 0.00 57.72 56.56 3d4z n HIS 797 Cb 0.64 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.59 3d4z n HIS 797 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3d4z s ILE 798 N -1.48 3.56 -1.45 1.59 1.01 -1.26 -4.87 121.20 118.30 3d4z s ILE 798 Ca 0.48 1.08 -0.10 0.00 0.00 0.00 0.00 60.65 62.10 3d4z s ILE 798 Cb 0.28 -3.69 0.04 0.00 0.01 0.00 0.00 42.46 39.10 3d4z s ILE 798 CO 0.27 0.06 2.42 -0.67 0.00 0.00 0.00 174.94 177.02 3d4z n ASP 799 N 4.40 6.53 0.20 3.58 2.03 -1.26 -2.48 116.55 129.54 3d4z n ASP 799 Ca 0.12 -2.88 0.12 0.00 0.52 0.00 0.00 54.79 52.67 3d4z n ASP 799 Cb 0.43 -1.53 0.14 0.00 -0.72 0.00 0.00 41.12 39.44 3d4z n ASP 799 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3d4z h SER 800 N 5.34 0.00 0.00 1.67 4.64 -1.90 -3.42 113.55 119.88 3d4z h SER 800 Ca 0.66 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.98 3d4z h SER 800 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3d4z h SER 800 CO 1.72 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 178.30 3d4z n GLY 801 N 1.12 3.17 0.71 -0.77 0.00 -1.26 -2.08 105.19 106.08 3d4z n GLY 801 Ca 0.03 -0.19 0.06 0.00 0.00 0.00 0.00 46.02 45.92 3d4z n GLY 801 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d4z n ASP 802 N 8.89 3.14 -4.80 1.61 5.68 -1.26 -3.08 116.55 126.73 3d4z n ASP 802 Ca 0.00 -2.17 -0.34 0.00 -0.50 0.00 0.00 54.79 51.78 3d4z n ASP 802 Cb 0.00 -0.29 -0.07 0.00 -1.14 0.00 0.00 41.12 39.62 3d4z n ASP 802 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 3d4z s ILE 803 N -1.30 4.90 0.28 2.12 -1.09 -0.88 -0.16 121.20 125.07 3d4z s ILE 803 Ca 0.27 -0.19 -0.15 0.00 -2.23 0.00 0.00 60.65 58.35 3d4z s ILE 803 Cb 0.16 -3.18 0.01 0.00 -1.58 0.00 0.00 42.46 37.87 3d4z s ILE 803 CO 0.15 0.47 0.59 0.72 -1.23 0.00 0.00 174.94 175.65 3d4z s PHE 804 N -1.10 0.23 -0.01 3.97 -0.71 -0.70 -4.73 117.98 114.93 3d4z s PHE 804 Ca 0.19 -0.65 0.04 0.00 -1.04 0.00 0.00 56.93 55.47 3d4z s PHE 804 Cb -0.12 0.41 -0.01 0.00 -1.21 0.00 0.00 43.02 42.09 3d4z s PHE 804 CO 0.09 -1.16 -0.14 0.71 -1.34 0.00 0.00 175.22 173.39 3d4z s TYR 805 N -3.67 1.24 0.11 3.49 1.51 0.09 0.37 117.35 120.50 3d4z s TYR 805 Ca 0.19 -0.24 0.03 0.00 -1.01 0.00 0.00 57.07 56.04 3d4z s TYR 805 Cb -0.03 -0.80 -0.04 0.00 -0.11 0.00 0.00 41.96 40.98 3d4z s TYR 805 CO 0.10 -0.03 -0.08 0.95 -1.11 0.00 0.00 175.55 175.38 3d4z s THR 806 N -0.29 0.90 0.42 -0.71 -4.23 -0.93 -0.91 115.64 109.89 3d4z s THR 806 Ca 0.05 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 3d4z s THR 806 Cb -0.06 -1.67 -0.01 0.00 1.34 0.00 0.00 72.50 72.10 3d4z s THR 806 CO -0.00 -0.77 0.63 1.51 -0.54 0.00 0.00 174.62 175.44 3d4z s ASP 807 N -2.97 5.99 -0.26 3.99 -4.77 -0.89 -0.74 116.67 117.02 3d4z s ASP 807 Ca 0.12 0.33 -0.00 0.00 -3.30 0.00 0.00 52.55 49.70 3d4z s ASP 807 Cb 0.03 -1.69 0.04 0.00 -1.09 0.00 0.00 42.92 40.21 3d4z s ASP 807 CO -0.02 -0.56 -0.07 -0.76 0.70 0.00 0.00 175.17 174.46 3d4z s LEU 808 N -4.47 3.35 -1.46 2.11 1.43 0.60 -4.33 118.68 115.91 3d4z s LEU 808 Ca 0.46 -1.07 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 3d4z s LEU 808 Cb -0.10 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.48 3d4z s LEU 808 CO 0.37 -0.17 0.00 0.59 0.23 0.00 0.00 176.35 177.38 3d4z n ASN 809 N 4.60 -4.74 0.00 2.29 4.13 -1.26 -0.84 115.26 119.45 3d4z n ASN 809 Ca -0.15 0.16 0.00 0.00 1.68 0.00 0.00 54.58 56.26 3d4z n ASN 809 Cb 0.45 -4.03 0.00 0.00 -1.54 0.00 0.00 39.78 34.66 3d4z n ASN 809 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3d4z n GLY 810 N -0.79 0.44 0.08 7.41 0.00 -1.26 -0.21 105.19 110.85 3d4z n GLY 810 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 3d4z n GLY 810 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d4z n LEU 811 N 0.00 1.96 -3.69 0.99 7.94 -0.02 -4.90 117.00 119.28 3d4z n LEU 811 Ca 0.00 -0.06 -0.13 0.00 -1.11 0.00 0.00 56.01 54.72 3d4z n LEU 811 Cb 0.11 -0.28 -0.07 0.00 0.53 0.00 0.00 43.42 43.72 3d4z n LEU 811 CO 0.00 0.63 0.12 0.00 -1.11 0.00 0.00 177.39 177.03 3d4z s GLN 812 N -2.33 0.88 -0.15 1.96 -2.07 -1.18 -4.99 119.66 111.78 3d4z s GLN 812 Ca -0.17 -0.39 -0.04 0.00 -1.82 0.00 0.00 55.36 52.94 3d4z s GLN 812 Cb 0.05 0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 32.33 3d4z s GLN 812 CO 0.44 -0.29 -0.01 -0.06 -1.32 0.00 0.00 175.29 174.04 3d4z s PHE 813 N -2.43 3.08 -0.05 9.60 0.40 -1.25 -0.29 117.98 127.04 3d4z s PHE 813 Ca -0.06 -0.17 0.05 0.00 -0.60 0.00 0.00 56.93 56.15 3d4z s PHE 813 Cb -0.01 -1.96 -0.02 0.00 0.51 0.00 0.00 43.02 41.53 3d4z s PHE 813 CO -0.02 0.06 -0.17 -1.50 0.70 0.00 0.00 175.22 174.28 3d4z s ILE 814 N 0.23 2.79 0.14 0.64 2.07 0.08 -1.86 121.20 125.29 3d4z s ILE 814 Ca -0.01 -0.82 -0.31 0.00 -1.41 0.00 0.00 60.65 58.10 3d4z s ILE 814 Cb -0.13 -2.07 -0.08 0.00 0.13 0.00 0.00 42.46 40.31 3d4z s ILE 814 CO 0.02 0.59 1.29 -0.75 -1.91 0.00 0.00 174.94 174.18 3d4z s LYS 815 N -0.65 4.39 0.07 3.50 2.20 -0.29 -2.18 119.74 126.79 3d4z s LYS 815 Ca 0.10 1.97 0.06 0.00 -0.36 0.00 0.00 55.97 57.74 3d4z s LYS 815 Cb -0.11 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 3d4z s LYS 815 CO 0.00 -0.28 -0.10 1.03 -0.36 0.00 0.00 175.35 175.64 3d4z s ARG 816 N 0.49 2.25 -0.13 4.03 1.81 0.16 -4.95 118.95 122.60 3d4z s ARG 816 Ca 0.59 -0.93 0.01 0.00 -1.72 0.00 0.00 55.73 53.67 3d4z s ARG 816 Cb -0.34 -2.35 0.02 0.00 -0.45 0.00 0.00 34.95 31.82 3d4z s ARG 816 CO 0.34 0.54 -0.14 0.50 -0.68 0.00 0.00 175.30 175.86 3d4z s ARG 817 N -1.91 2.18 0.17 3.54 3.52 -1.26 -1.72 118.95 123.47 3d4z s ARG 817 Ca 0.20 -0.52 -0.31 0.00 -0.13 0.00 0.00 55.73 54.96 3d4z s ARG 817 Cb -0.11 -1.98 -0.10 0.00 -1.56 0.00 0.00 34.95 31.20 3d4z s ARG 817 CO 0.11 -0.19 1.55 0.50 -0.81 0.00 0.00 175.30 176.47 3d4z s ARG 818 N 1.36 4.22 -0.21 5.12 3.52 0.77 -4.99 118.95 128.74 3d4z s ARG 818 Ca 0.01 2.35 0.00 0.00 -0.13 0.00 0.00 55.73 57.97 3d4z s ARG 818 Cb -0.13 -3.15 0.02 0.00 -1.56 0.00 0.00 34.95 30.12 3d4z s ARG 818 CO -0.08 -0.59 -0.15 -0.51 -0.81 0.00 0.00 175.30 173.17 3d4z s LEU 819 N 1.04 2.56 0.09 -0.88 1.43 -1.26 -4.90 118.68 116.76 3d4z s LEU 819 Ca 0.69 -0.75 0.23 0.00 -1.03 0.00 0.00 54.13 53.28 3d4z s LEU 819 Cb -0.43 -1.55 0.93 0.00 0.03 0.00 0.00 46.19 45.17 3d4z s LEU 819 CO 0.32 -0.05 1.73 0.47 0.23 0.00 0.00 176.35 179.05 3d4z n ASP 820 N 4.63 0.30 0.00 2.29 8.00 -1.26 -1.52 116.55 128.98 3d4z n ASP 820 Ca -0.19 0.55 0.10 0.00 0.71 0.00 0.00 54.79 55.95 3d4z n ASP 820 Cb 0.49 -0.62 0.46 0.00 -0.02 0.00 0.00 41.12 41.43 3d4z n ASP 820 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 3d4z n LYS 821 N -1.80 0.16 -4.16 -1.24 2.85 -1.26 -4.72 118.16 107.99 3d4z n LYS 821 Ca 0.05 0.13 -0.30 0.00 -1.05 0.00 0.00 58.31 57.14 3d4z n LYS 821 Cb 0.29 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 33.09 3d4z n LYS 821 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3d4z s LEU 822 N -2.76 3.32 0.86 -5.58 1.43 -0.58 -5.03 118.68 110.34 3d4z s LEU 822 Ca 0.15 -0.25 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 3d4z s LEU 822 Cb 0.13 -2.07 0.10 0.00 0.03 0.00 0.00 46.19 44.38 3d4z s LEU 822 CO 0.32 0.18 1.10 -2.16 0.23 0.00 0.00 176.35 176.02 3d4z s PRO 823 N -2.28 1.60 0.21 1.29 0.04 -1.26 -4.86 135.00 129.75 3d4z s PRO 823 Ca 0.24 0.69 -0.12 0.00 0.04 0.00 0.00 61.00 61.86 3d4z s PRO 823 Cb -0.11 -1.86 0.28 0.00 0.04 0.00 0.00 34.50 32.84 3d4z s PRO 823 CO 0.17 -1.97 1.65 1.25 0.04 0.00 0.00 177.00 178.14 3d4z h LEU 824 N -1.34 -0.40 -1.70 -3.56 6.46 -1.96 -0.15 115.31 112.66 3d4z h LEU 824 Ca -0.49 0.17 0.00 0.00 -0.12 0.00 0.00 57.88 57.44 3d4z h LEU 824 Cb 1.28 0.32 0.00 0.00 -0.73 0.00 0.00 40.66 41.53 3d4z h LEU 824 CO 0.57 -0.16 0.00 0.06 -0.62 0.00 0.00 178.44 178.30 3d4z h GLN 825 N 0.07 0.00 0.00 1.25 -0.00 -1.92 0.11 115.11 114.62 3d4z h GLN 825 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.97 3d4z h GLN 825 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.99 3d4z h GLN 825 CO -0.58 0.00 0.00 0.00 -0.00 0.00 0.00 178.83 178.25 3d4z h ALA 826 N 2.05 1.00 -0.27 0.06 0.00 -1.36 -3.11 119.26 117.63 3d4z h ALA 826 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d4z h ALA 826 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3d4z h ALA 826 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 3d4z n ASN 827 N -2.90 2.31 -4.78 0.00 3.02 0.02 -4.58 115.26 108.35 3d4z n ASN 827 Ca 0.04 -1.84 -0.39 0.00 -0.03 0.00 0.00 54.58 52.37 3d4z n ASN 827 Cb 0.50 -0.17 -0.06 0.00 -0.61 0.00 0.00 39.78 39.45 3d4z n ASN 827 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3d4z s TYR 828 N -1.66 3.81 0.16 3.10 1.51 -1.18 -4.61 117.35 118.49 3d4z s TYR 828 Ca 0.34 1.44 0.05 0.00 -1.01 0.00 0.00 57.07 57.89 3d4z s TYR 828 Cb 0.19 -2.68 -0.05 0.00 -0.11 0.00 0.00 41.96 39.31 3d4z s TYR 828 CO 0.27 0.46 -0.09 0.71 -1.11 0.00 0.00 175.55 175.79 3d4z s TYR 829 N -0.77 1.33 0.41 2.71 2.02 -0.05 -4.65 117.35 118.34 3d4z s TYR 829 Ca 0.34 -0.76 -0.26 0.00 -0.37 0.00 0.00 57.07 56.02 3d4z s TYR 829 Cb -0.21 -0.68 -0.09 0.00 -0.40 0.00 0.00 41.96 40.58 3d4z s TYR 829 CO 0.22 0.09 1.30 -2.14 -1.57 0.00 0.00 175.55 173.45 3d4z s PRO 830 N -3.75 3.96 -0.67 -1.71 0.02 -1.26 -1.40 135.00 130.18 3d4z s PRO 830 Ca 0.18 2.14 0.05 0.00 0.02 0.00 0.00 61.00 63.40 3d4z s PRO 830 Cb 0.03 -2.74 0.21 0.00 0.02 0.00 0.00 34.50 32.01 3d4z s PRO 830 CO 0.02 -0.50 0.62 -0.89 -0.33 0.00 0.00 177.00 175.92 3d4z n ILE 831 N 0.10 2.00 0.18 2.83 2.08 0.10 -4.51 119.36 122.15 3d4z n ILE 831 Ca 0.04 -5.05 0.03 0.00 0.56 0.00 0.00 62.75 58.33 3d4z n ILE 831 Cb 0.44 -2.14 0.31 0.00 -0.75 0.00 0.00 39.64 37.49 3d4z n ILE 831 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 3d4z h PRO 832 N 4.78 0.00 0.00 0.38 0.13 -1.78 -2.52 132.00 132.99 3d4z h PRO 832 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3d4z h PRO 832 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 3d4z h PRO 832 CO 0.78 0.44 0.00 -1.13 -0.23 0.00 0.00 178.00 177.86 3d4z n SER 833 N -3.73 0.00 0.00 1.44 3.41 -1.26 -3.82 113.62 109.66 3d4z n SER 833 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 3d4z n SER 833 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3d4z n SER 833 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d4z n GLY 834 N 0.00 0.57 3.32 5.00 0.00 -1.26 -0.55 105.19 112.27 3d4z n GLY 834 Ca 0.00 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 3d4z n GLY 834 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3d4z s MET 835 N -2.00 0.98 0.13 1.61 0.23 -0.37 -2.09 119.30 117.79 3d4z s MET 835 Ca 0.00 -0.53 -0.16 0.00 -1.03 0.00 0.00 55.69 53.97 3d4z s MET 835 Cb 0.00 0.43 0.03 0.00 -1.53 0.00 0.00 34.83 33.77 3d4z s MET 835 CO 0.00 -0.36 0.41 -0.59 -2.03 0.00 0.00 175.02 172.45 3d4z s PHE 836 N -3.08 -0.19 0.12 3.16 -0.12 -0.08 -0.83 117.98 116.96 3d4z s PHE 836 Ca -0.02 -0.12 0.06 0.00 -0.05 0.00 0.00 56.93 56.80 3d4z s PHE 836 Cb 0.00 0.26 -0.04 0.00 -0.63 0.00 0.00 43.02 42.62 3d4z s PHE 836 CO -0.07 -0.71 -0.15 0.96 -0.05 0.00 0.00 175.22 175.20 3d4z s ILE 837 N -3.81 1.39 0.13 -4.49 -4.36 -0.64 -0.73 121.20 108.68 3d4z s ILE 837 Ca 0.03 -1.72 -0.18 0.00 -0.26 0.00 0.00 60.65 58.52 3d4z s ILE 837 Cb 0.02 -1.55 0.04 0.00 1.25 0.00 0.00 42.46 42.22 3d4z s ILE 837 CO -0.11 -0.39 0.45 -1.83 0.24 0.00 0.00 174.94 173.29 3d4z s GLU 838 N -2.63 1.11 0.00 0.37 -1.05 -1.26 -1.04 118.70 114.19 3d4z s GLU 838 Ca 0.09 -0.63 0.00 0.00 -0.15 0.00 0.00 54.97 54.28 3d4z s GLU 838 Cb -0.05 0.49 0.00 0.00 -0.44 0.00 0.00 34.13 34.13 3d4z s GLU 838 CO 0.03 -0.44 0.00 -0.40 0.95 0.00 0.00 175.26 175.40 3d4z n ASP 839 N -0.22 1.26 0.24 0.83 5.68 -0.08 -4.15 116.55 120.12 3d4z n ASP 839 Ca -0.16 -0.11 0.09 0.00 -0.50 0.00 0.00 54.79 54.11 3d4z n ASP 839 Cb 0.64 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.27 3d4z n ASP 839 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3d4z h ALA 840 N 1.00 2.02 0.00 2.12 0.00 -1.97 -3.33 119.26 119.10 3d4z h ALA 840 Ca 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 3d4z h ALA 840 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3d4z h ALA 840 CO 0.00 -0.06 -1.41 0.09 0.00 0.00 0.00 179.25 177.87 3d4z n ASN 841 N -4.49 3.45 -4.07 0.00 3.02 -1.26 -3.42 115.26 108.49 3d4z n ASN 841 Ca -0.02 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.33 3d4z n ASN 841 Cb 0.13 0.75 -0.14 0.00 -0.61 0.00 0.00 39.78 39.91 3d4z n ASN 841 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3d4z s THR 842 N -2.20 0.88 0.02 3.41 2.01 -1.25 -0.11 115.64 118.40 3d4z s THR 842 Ca -0.03 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.45 3d4z s THR 842 Cb 0.02 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.76 3d4z s THR 842 CO 0.26 0.18 -0.16 -0.60 -0.69 0.00 0.00 174.62 173.61 3d4z s ARG 843 N -0.45 1.15 -0.14 4.92 3.52 -0.01 -0.90 118.95 127.04 3d4z s ARG 843 Ca 0.03 -0.69 0.01 0.00 -0.13 0.00 0.00 55.73 54.96 3d4z s ARG 843 Cb -0.05 -1.16 0.02 0.00 -1.56 0.00 0.00 34.95 32.20 3d4z s ARG 843 CO -0.00 0.30 -0.18 -1.17 -0.81 0.00 0.00 175.30 173.44 3d4z s LEU 844 N -0.78 1.92 -0.11 -0.88 2.96 -0.21 -0.97 118.68 120.60 3d4z s LEU 844 Ca 0.05 -0.55 0.03 0.00 -0.22 0.00 0.00 54.13 53.44 3d4z s LEU 844 Cb -0.07 -1.31 -0.00 0.00 0.50 0.00 0.00 46.19 45.31 3d4z s LEU 844 CO 0.00 0.01 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.95 3d4z s THR 845 N 1.14 2.37 -0.29 3.68 2.01 0.09 -1.63 115.64 123.02 3d4z s THR 845 Ca -0.01 -0.91 -0.04 0.00 0.31 0.00 0.00 61.69 61.04 3d4z s THR 845 Cb -0.14 -1.94 0.03 0.00 0.01 0.00 0.00 72.50 70.46 3d4z s THR 845 CO -0.07 0.55 0.02 -0.22 -0.69 0.00 0.00 174.62 174.21 3d4z s LEU 846 N 0.35 3.71 0.09 4.42 2.96 -0.01 -0.34 118.68 129.86 3d4z s LEU 846 Ca -0.16 -0.94 -0.07 0.00 -0.22 0.00 0.00 54.13 52.73 3d4z s LEU 846 Cb -0.17 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 3d4z s LEU 846 CO 0.08 -0.21 0.36 -0.76 -1.32 0.00 0.00 176.35 174.51 3d4z s LEU 847 N 1.38 4.32 0.12 -0.68 2.01 0.16 -1.23 118.68 124.76 3d4z s LEU 847 Ca -0.00 0.67 0.10 0.00 0.01 0.00 0.00 54.13 54.90 3d4z s LEU 847 Cb -0.18 -3.04 -0.04 0.00 0.01 0.00 0.00 46.19 42.94 3d4z s LEU 847 CO -0.00 0.14 -0.24 0.42 1.01 0.00 0.00 176.35 177.68 3d4z s THR 848 N -1.47 2.01 -1.55 5.49 -4.23 0.29 -1.44 115.64 114.73 3d4z s THR 848 Ca 0.35 -1.67 0.16 0.00 -1.18 0.00 0.00 61.69 59.35 3d4z s THR 848 Cb -0.13 -1.80 0.57 0.00 1.34 0.00 0.00 72.50 72.48 3d4z s THR 848 CO 0.20 0.01 1.46 0.61 -0.54 0.00 0.00 174.62 176.36 3d4z n GLY 849 N 0.96 2.06 3.58 3.99 0.00 -0.13 -4.70 105.19 110.96 3d4z n GLY 849 Ca -0.18 -0.68 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 3d4z n GLY 849 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3d4z s GLN 850 N -1.54 0.78 0.15 1.61 0.00 -1.26 -4.74 119.66 114.67 3d4z s GLN 850 Ca 0.41 0.47 -0.30 0.00 -0.00 0.00 0.00 55.36 55.95 3d4z s GLN 850 Cb 0.24 0.37 -0.07 0.00 0.00 0.00 0.00 33.01 33.56 3d4z s GLN 850 CO 0.23 -0.19 1.16 -1.25 0.00 0.00 0.00 175.29 175.24 3d4z s PRO 851 N -0.52 4.52 0.22 9.60 0.04 -1.25 -4.72 135.00 142.90 3d4z s PRO 851 Ca -0.03 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 62.75 3d4z s PRO 851 Cb -0.02 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 3d4z s PRO 851 CO 0.03 -0.06 0.24 -0.51 0.04 0.00 0.00 177.00 176.74 3d4z s LEU 852 N -0.00 0.95 0.19 -3.56 1.43 -0.95 -4.77 118.68 111.97 3d4z s LEU 852 Ca 0.53 -1.29 -0.06 0.00 -1.03 0.00 0.00 54.13 52.27 3d4z s LEU 852 Cb -0.30 0.79 -0.06 0.00 0.03 0.00 0.00 46.19 46.64 3d4z s LEU 852 CO 0.34 -0.95 0.45 -0.83 0.23 0.00 0.00 176.35 175.60 3d4z s GLY 853 N -3.14 2.21 0.22 -3.19 0.00 -0.98 0.03 107.32 102.48 3d4z s GLY 853 Ca 0.34 -0.46 -0.21 0.00 0.00 0.00 0.00 44.72 44.39 3d4z s GLY 853 CO 0.12 -0.36 0.99 -0.32 0.00 0.00 0.00 173.10 173.54 3d4z s GLY 854 N -2.49 0.17 0.25 0.20 0.00 -0.49 -0.25 107.32 104.72 3d4z s GLY 854 Ca 0.44 -0.42 -0.20 0.00 0.00 0.00 0.00 44.72 44.53 3d4z s GLY 854 CO 0.24 2.00 0.94 -0.45 0.00 0.00 0.00 173.10 175.83 3d4z s SER 855 N -3.36 -0.01 -0.32 1.64 0.15 -0.37 -0.87 113.70 110.56 3d4z s SER 855 Ca 0.21 -0.82 0.02 0.00 0.70 0.00 0.00 55.95 56.06 3d4z s SER 855 Cb -0.03 0.62 0.10 0.00 -1.71 0.00 0.00 66.02 65.00 3d4z s SER 855 CO 0.06 -1.23 0.06 -0.55 1.20 0.00 0.00 173.24 172.78 3d4z s SER 856 N -3.25 4.40 0.00 5.45 0.15 -1.26 -0.62 113.70 118.57 3d4z s SER 856 Ca 0.19 -1.87 0.26 0.00 0.70 0.00 0.00 55.95 55.23 3d4z s SER 856 Cb -0.03 -1.29 0.73 0.00 -1.71 0.00 0.00 66.02 63.72 3d4z s SER 856 CO 0.07 -0.38 1.55 0.18 1.20 0.00 0.00 173.24 175.86 3d4z n LEU 857 N 4.52 0.81 -3.64 3.45 4.77 -1.26 -4.81 117.00 120.84 3d4z n LEU 857 Ca 0.00 -0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.70 3d4z n LEU 857 Cb 0.42 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.28 3d4z n LEU 857 CO 0.17 0.16 0.19 0.00 -1.33 0.00 0.00 177.39 176.58 3d4z s ALA 858 N -2.65 -1.10 0.15 -1.18 0.00 -1.26 -5.09 121.76 110.63 3d4z s ALA 858 Ca 0.21 0.42 -0.34 0.00 0.00 0.00 0.00 51.96 52.25 3d4z s ALA 858 Cb 0.19 0.32 -0.16 0.00 0.00 0.00 0.00 23.12 23.47 3d4z s ALA 858 CO 0.57 -0.45 1.13 0.45 0.00 0.00 0.00 175.76 177.45 3d4z n SER 859 N 0.55 1.06 0.00 0.00 2.88 -1.18 -1.47 113.62 115.46 3d4z n SER 859 Ca -0.19 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 3d4z n SER 859 Cb 0.60 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 3d4z n SER 859 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d4z n GLY 860 N 2.00 1.36 3.68 0.46 0.00 -1.03 -4.88 105.19 106.79 3d4z n GLY 860 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3d4z n GLY 860 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d4z s GLU 861 N -0.27 2.51 0.05 1.61 2.02 -0.54 -1.02 118.70 123.06 3d4z s GLU 861 Ca 0.00 -0.92 0.05 0.00 0.02 0.00 0.00 54.97 54.13 3d4z s GLU 861 Cb 0.00 -2.49 -0.03 0.00 0.10 0.00 0.00 34.13 31.72 3d4z s GLU 861 CO 0.00 0.51 -0.15 -0.51 0.02 0.00 0.00 175.26 175.13 3d4z s LEU 862 N -2.51 2.21 0.02 1.80 1.43 -0.60 -4.47 118.68 116.56 3d4z s LEU 862 Ca 0.26 -0.53 -0.14 0.00 -1.03 0.00 0.00 54.13 52.70 3d4z s LEU 862 Cb -0.11 -0.63 0.02 0.00 0.03 0.00 0.00 46.19 45.50 3d4z s LEU 862 CO 0.18 0.01 0.29 -1.83 0.23 0.00 0.00 176.35 175.24 3d4z s GLU 863 N -1.38 0.75 -0.11 1.70 -1.05 0.21 -0.16 118.70 118.66 3d4z s GLU 863 Ca 0.01 -0.42 -0.05 0.00 -0.15 0.00 0.00 54.97 54.36 3d4z s GLU 863 Cb -0.09 0.33 0.05 0.00 -0.44 0.00 0.00 34.13 33.98 3d4z s GLU 863 CO 0.02 -0.23 0.26 -1.50 0.95 0.00 0.00 175.26 174.76 3d4z s ILE 864 N -2.15 -0.08 0.27 1.83 2.07 0.07 -1.23 121.20 121.97 3d4z s ILE 864 Ca -0.08 0.16 -0.29 0.00 -1.41 0.00 0.00 60.65 59.03 3d4z s ILE 864 Cb -0.02 -0.41 -0.09 0.00 0.13 0.00 0.00 42.46 42.07 3d4z s ILE 864 CO -0.01 0.07 1.16 -0.32 -1.91 0.00 0.00 174.94 173.93 3d4z s MET 865 N 1.41 4.55 -0.23 3.50 -2.45 0.66 -1.26 119.30 125.47 3d4z s MET 865 Ca -0.08 1.91 -0.06 0.00 -1.25 0.00 0.00 55.69 56.21 3d4z s MET 865 Cb -0.10 -3.17 -0.18 0.00 1.25 0.00 0.00 34.83 32.63 3d4z s MET 865 CO -0.09 0.07 -0.11 1.04 1.05 0.00 0.00 175.02 176.97 3d4z n GLN 866 N 1.37 0.65 -3.65 4.11 1.13 0.11 -4.46 117.38 116.64 3d4z n GLN 866 Ca 0.00 0.24 -0.07 0.00 -1.94 0.00 0.00 57.00 55.23 3d4z n GLN 866 Cb 0.44 -1.57 -0.02 0.00 0.11 0.00 0.00 30.24 29.21 3d4z n GLN 866 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3d4z s ASP 867 N -6.89 -0.32 -0.13 1.08 -1.08 -1.22 -4.84 116.67 103.28 3d4z s ASP 867 Ca -0.33 -0.27 -0.10 0.00 -0.52 0.00 0.00 52.55 51.33 3d4z s ASP 867 Cb 0.10 0.54 0.04 0.00 -1.46 0.00 0.00 42.92 42.14 3d4z s ASP 867 CO 0.60 -0.95 0.32 0.00 0.52 0.00 0.00 175.17 175.67 3d4z s ARG 868 N -3.48 0.34 -0.13 4.34 1.70 -1.26 -1.20 118.95 119.27 3d4z s ARG 868 Ca 0.08 0.53 -0.00 0.00 -0.47 0.00 0.00 55.73 55.87 3d4z s ARG 868 Cb -0.02 0.08 0.03 0.00 -0.57 0.00 0.00 34.95 34.46 3d4z s ARG 868 CO -0.02 -0.09 -0.09 0.50 -1.08 0.00 0.00 175.30 174.51 3d4z s ARG 869 N 0.63 1.74 -0.09 3.89 3.52 0.08 -4.84 118.95 123.87 3d4z s ARG 869 Ca -0.04 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.21 3d4z s ARG 869 Cb -0.05 -1.76 0.02 0.00 -1.56 0.00 0.00 34.95 31.60 3d4z s ARG 869 CO -0.04 -0.27 -0.08 -0.51 -0.81 0.00 0.00 175.30 173.60 3d4z s LEU 870 N 1.64 1.23 0.43 -0.88 1.43 0.23 -0.51 118.68 122.24 3d4z s LEU 870 Ca 0.05 -0.27 0.27 0.00 -1.03 0.00 0.00 54.13 53.16 3d4z s LEU 870 Cb -0.13 -0.77 0.87 0.00 0.03 0.00 0.00 46.19 46.19 3d4z s LEU 870 CO -0.09 -0.09 1.79 0.00 0.23 0.00 0.00 176.35 178.19 3d4z h ALA 871 N 7.86 1.00 -2.67 4.21 0.00 -1.88 0.20 119.26 127.99 3d4z h ALA 871 Ca -0.30 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.02 3d4z h ALA 871 Cb 1.14 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.82 3d4z h ALA 871 CO 0.41 0.00 -0.67 -1.12 0.00 0.00 0.00 179.25 177.87 3d4z s SER 872 N -5.53 4.57 0.35 0.00 0.01 -1.26 -4.35 113.70 107.48 3d4z s SER 872 Ca 0.05 -0.53 -0.25 0.00 1.31 0.00 0.00 55.95 56.53 3d4z s SER 872 Cb 0.08 -0.88 -0.10 0.00 0.21 0.00 0.00 66.02 65.33 3d4z s SER 872 CO 0.58 0.06 0.97 -0.62 0.41 0.00 0.00 173.24 174.64 3d4z s ASP 873 N -3.17 7.14 -0.29 2.44 2.15 -1.26 -3.91 116.67 119.78 3d4z s ASP 873 Ca 0.28 1.88 0.10 0.00 0.43 0.00 0.00 52.55 55.24 3d4z s ASP 873 Cb -0.08 -2.58 0.56 0.00 -0.30 0.00 0.00 42.92 40.52 3d4z s ASP 873 CO 0.18 -0.21 1.56 -0.90 -0.17 0.00 0.00 175.17 175.63 3d4z n ASP 874 N 0.26 3.27 -1.44 -0.34 5.75 -1.26 -4.82 116.55 117.97 3d4z n ASP 874 Ca 0.03 -3.50 -0.14 0.00 -0.01 0.00 0.00 54.79 51.17 3d4z n ASP 874 Cb 0.50 -0.66 -0.02 0.00 -1.03 0.00 0.00 41.12 39.92 3d4z n ASP 874 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3d4z n GLU 875 N -0.87 -1.08 -0.23 0.11 1.02 -1.26 -4.86 120.64 113.47 3d4z n GLU 875 Ca 0.35 0.78 0.07 0.00 -0.02 0.00 0.00 57.16 58.34 3d4z n GLU 875 Cb 1.13 -5.00 0.17 0.00 -0.02 0.00 0.00 31.44 27.72 3d4z n GLU 875 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3d4z n ARG 876 N -2.42 2.53 0.00 3.49 5.12 -1.26 -4.99 116.66 119.13 3d4z n ARG 876 Ca -0.16 -2.39 0.00 0.00 -1.93 0.00 0.00 57.85 53.37 3d4z n ARG 876 Cb 0.58 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.37 3d4z n ARG 876 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3d4z n GLY 877 N -0.50 0.33 0.21 -0.13 0.00 -1.26 -4.96 105.19 98.88 3d4z n GLY 877 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3d4z n GLY 877 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3d4z h LEU 878 N 0.00 0.61 0.99 0.99 5.85 -1.94 -3.47 115.31 118.34 3d4z h LEU 878 Ca 0.00 -0.32 -0.18 0.00 0.84 0.00 0.00 57.88 58.21 3d4z h LEU 878 Cb 0.00 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 3d4z h LEU 878 CO 0.00 1.03 -0.21 0.61 -0.34 0.00 0.00 178.44 179.53 3d4z n GLY 879 N 0.23 0.39 3.40 3.75 0.00 -1.26 -4.86 105.19 106.85 3d4z n GLY 879 Ca -0.03 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.32 3d4z n GLY 879 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3d4z s GLN 880 N -3.84 1.22 0.00 1.61 -2.07 -1.26 -4.99 119.66 110.34 3d4z s GLN 880 Ca 0.00 -0.48 0.00 0.00 -1.82 0.00 0.00 55.36 53.06 3d4z s GLN 880 Cb 0.00 0.56 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 3d4z s GLN 880 CO 0.00 -0.52 0.00 0.41 -1.32 0.00 0.00 175.29 173.86 3d4z n GLY 881 N -0.27 -0.67 2.89 2.60 0.00 -1.25 -4.17 105.19 104.31 3d4z n GLY 881 Ca -0.17 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 43.90 3d4z n GLY 881 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d4z s VAL 882 N 0.03 2.11 -0.08 1.61 1.01 0.72 -4.86 120.40 120.94 3d4z s VAL 882 Ca 0.00 -2.82 0.12 0.00 0.00 0.00 0.00 61.98 59.27 3d4z s VAL 882 Cb 0.00 -2.50 0.20 0.00 0.00 0.00 0.00 36.38 34.09 3d4z s VAL 882 CO 0.00 -0.78 1.10 0.18 0.00 0.00 0.00 175.10 175.60 3d4z n LEU 883 N 3.54 1.37 -0.91 3.92 4.77 -1.26 -0.61 117.00 127.83 3d4z n LEU 883 Ca 0.05 -2.28 0.02 0.00 -0.03 0.00 0.00 56.01 53.78 3d4z n LEU 883 Cb 0.35 -0.24 0.21 0.00 -2.33 0.00 0.00 43.42 41.41 3d4z n LEU 883 CO 0.28 0.58 0.66 -0.90 -1.33 0.00 0.00 177.39 176.69 3d4z n ASP 884 N -0.69 2.87 -4.61 -1.43 5.68 -1.26 -5.05 116.55 112.06 3d4z n ASP 884 Ca 0.09 -3.46 -0.38 0.00 -0.50 0.00 0.00 54.79 50.55 3d4z n ASP 884 Cb 0.71 -0.58 0.05 0.00 -1.14 0.00 0.00 41.12 40.17 3d4z n ASP 884 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3d4z n ASN 885 N -0.97 0.73 -3.89 -1.12 4.13 -1.26 -5.03 115.26 107.85 3d4z n ASN 885 Ca 0.26 0.82 -0.10 0.00 1.68 0.00 0.00 54.58 57.24 3d4z n ASN 885 Cb 0.92 -1.38 -0.09 0.00 -1.54 0.00 0.00 39.78 37.70 3d4z n ASN 885 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 3d4z s LYS 886 N -2.68 0.67 0.24 3.52 -2.85 -1.26 -4.97 119.74 112.40 3d4z s LYS 886 Ca 0.75 -0.75 -0.31 0.00 -1.00 0.00 0.00 55.97 54.65 3d4z s LYS 886 Cb -0.42 0.27 -0.13 0.00 -2.06 0.00 0.00 37.83 35.48 3d4z s LYS 886 CO 0.48 -0.18 1.44 -2.30 0.10 0.00 0.00 175.35 174.89 3d4z n PRO 887 N 0.59 2.11 -4.28 1.78 -0.02 -1.26 -4.80 135.00 129.11 3d4z n PRO 887 Ca -0.18 0.75 -0.18 0.00 -2.02 0.00 0.00 63.50 61.87 3d4z n PRO 887 Cb 0.59 -2.43 -0.15 0.00 -0.02 0.00 0.00 33.50 31.49 3d4z n PRO 887 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3d4z s VAL 888 N 0.03 0.61 -0.51 -1.45 0.11 -0.77 -4.89 120.40 113.54 3d4z s VAL 888 Ca 0.69 -0.30 -0.17 0.00 -2.93 0.00 0.00 61.98 59.27 3d4z s VAL 888 Cb -0.64 -0.53 0.09 0.00 -1.53 0.00 0.00 36.38 33.77 3d4z s VAL 888 CO 0.48 0.18 0.50 -0.22 -3.33 0.00 0.00 175.10 172.72 3d4z s LEU 889 N -0.00 5.62 0.16 2.54 2.96 -1.26 -0.23 118.68 128.48 3d4z s LEU 889 Ca 0.00 -1.38 -0.24 0.00 -0.22 0.00 0.00 54.13 52.29 3d4z s LEU 889 Cb -0.05 -2.25 -0.08 0.00 0.50 0.00 0.00 46.19 44.31 3d4z s LEU 889 CO -0.00 -0.81 0.75 -1.00 -1.32 0.00 0.00 176.35 173.97 3d4z s HIS 890 N 1.94 3.87 0.07 5.38 3.76 0.11 -4.91 115.29 125.52 3d4z s HIS 890 Ca 0.07 1.57 0.07 0.00 -0.15 0.00 0.00 55.06 56.62 3d4z s HIS 890 Cb -0.25 -2.72 -0.03 0.00 1.11 0.00 0.00 32.58 30.69 3d4z s HIS 890 CO 0.07 0.50 -0.18 0.96 -0.85 0.00 0.00 174.74 175.23 3d4z s ILE 891 N -1.19 1.49 0.12 0.60 -4.36 -1.26 -0.79 121.20 115.81 3d4z s ILE 891 Ca 0.36 -1.30 -0.10 0.00 -0.26 0.00 0.00 60.65 59.35 3d4z s ILE 891 Cb -0.22 -1.34 0.00 0.00 1.25 0.00 0.00 42.46 42.15 3d4z s ILE 891 CO 0.25 0.00 0.25 -0.31 0.24 0.00 0.00 174.94 175.37 3d4z s TYR 892 N -1.02 0.20 0.04 1.37 1.51 0.25 -0.95 117.35 118.75 3d4z s TYR 892 Ca 0.04 -0.59 0.07 0.00 -1.01 0.00 0.00 57.07 55.59 3d4z s TYR 892 Cb -0.09 -0.02 -0.03 0.00 -0.11 0.00 0.00 41.96 41.71 3d4z s TYR 892 CO 0.03 -0.63 -0.21 1.03 -1.11 0.00 0.00 175.55 174.66 3d4z s ARG 893 N -3.89 1.39 -0.23 -0.62 1.81 -0.52 -1.22 118.95 115.68 3d4z s ARG 893 Ca 0.09 -0.95 0.02 0.00 -1.72 0.00 0.00 55.73 53.17 3d4z s ARG 893 Cb 0.04 -1.51 0.04 0.00 -0.45 0.00 0.00 34.95 33.07 3d4z s ARG 893 CO -0.07 0.39 -0.14 -1.17 -0.68 0.00 0.00 175.30 173.63 3d4z s LEU 894 N -1.20 2.93 -0.29 2.53 2.96 -0.63 -0.66 118.68 124.32 3d4z s LEU 894 Ca 0.07 -1.05 0.01 0.00 -0.22 0.00 0.00 54.13 52.95 3d4z s LEU 894 Cb -0.09 -1.54 0.06 0.00 0.50 0.00 0.00 46.19 45.12 3d4z s LEU 894 CO 0.02 -0.11 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.20 3d4z s VAL 895 N 1.20 2.56 -0.17 1.68 1.01 0.54 -3.62 120.40 123.61 3d4z s VAL 895 Ca -0.02 -1.59 -0.15 0.00 0.00 0.00 0.00 61.98 60.21 3d4z s VAL 895 Cb -0.17 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 3d4z s VAL 895 CO -0.08 -0.12 0.35 -0.22 0.00 0.00 0.00 175.10 175.03 3d4z s LEU 896 N 1.15 4.22 0.02 3.92 2.96 -1.26 -0.73 118.68 128.96 3d4z s LEU 896 Ca -0.06 0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 54.38 3d4z s LEU 896 Cb -0.20 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.01 3d4z s LEU 896 CO -0.04 0.03 0.01 -1.61 -1.32 0.00 0.00 176.35 173.43 3d4z s GLU 897 N 0.76 0.42 -0.01 1.98 2.02 -0.15 -5.01 118.70 118.71 3d4z s GLU 897 Ca 0.19 -0.69 -0.27 0.00 0.02 0.00 0.00 54.97 54.22 3d4z s GLU 897 Cb -0.14 0.15 -0.04 0.00 0.10 0.00 0.00 34.13 34.21 3d4z s GLU 897 CO 0.06 -0.08 0.85 0.15 0.02 0.00 0.00 175.26 176.26 3d4z s LYS 898 N -1.96 4.52 0.00 1.61 -0.14 -1.26 -0.83 119.74 121.68 3d4z s LYS 898 Ca -0.11 1.18 0.00 0.00 -1.36 0.00 0.00 55.97 55.68 3d4z s LYS 898 Cb -0.06 -3.43 0.00 0.00 -1.68 0.00 0.00 37.83 32.66 3d4z s LYS 898 CO -0.02 0.06 0.81 1.33 -0.76 0.00 0.00 175.35 176.77 3d4z n VAL 899 N 3.61 0.63 0.29 3.17 0.24 0.85 -4.76 118.33 122.35 3d4z n VAL 899 Ca 0.02 -0.63 0.17 0.00 -2.04 0.00 0.00 64.34 61.86 3d4z n VAL 899 Cb 0.51 0.69 0.86 0.00 -1.47 0.00 0.00 33.84 34.43 3d4z n VAL 899 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3d4z h ASN 900 N 0.00 0.00 0.04 -1.34 -1.07 -1.57 -1.70 115.58 109.94 3d4z h ASN 900 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 3d4z h ASN 900 Cb 0.68 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.93 3d4z h ASN 900 CO 0.00 0.06 -0.10 0.59 0.07 0.00 0.00 177.43 178.04 3d4z n ASN 901 N -3.39 1.76 -4.78 6.14 3.02 -1.26 -4.95 115.26 111.81 3d4z n ASN 901 Ca -0.02 -1.47 -0.37 0.00 -0.03 0.00 0.00 54.58 52.69 3d4z n ASN 901 Cb 0.20 0.07 -0.06 0.00 -0.61 0.00 0.00 39.78 39.38 3d4z n ASN 901 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d4z s VAL 903 N -1.55 4.28 0.27 0.00 1.01 0.15 -5.00 120.40 119.56 3d4z s VAL 903 Ca 0.49 0.50 0.08 0.00 0.00 0.00 0.00 61.98 63.04 3d4z s VAL 903 Cb -0.20 -4.59 -0.04 0.00 0.00 0.00 0.00 36.38 31.55 3d4z s VAL 903 CO 0.25 -1.17 0.18 -0.13 0.00 0.00 0.00 175.10 174.22 3d4z s ARG 904 N 4.25 2.78 0.81 2.72 0.52 -1.26 -4.36 118.95 124.41 3d4z s ARG 904 Ca 0.35 -1.16 -0.13 0.00 -0.52 0.00 0.00 55.73 54.26 3d4z s ARG 904 Cb -0.11 -2.47 0.08 0.00 0.52 0.00 0.00 34.95 32.97 3d4z s ARG 904 CO 0.22 0.34 1.21 -2.14 0.02 0.00 0.00 175.30 174.94 3d4z s PRO 905 N -3.84 1.62 1.01 3.54 0.02 -1.26 -4.92 135.00 131.18 3d4z s PRO 905 Ca 0.34 1.76 -0.11 0.00 0.02 0.00 0.00 61.00 63.01 3d4z s PRO 905 Cb -0.07 -1.77 0.20 0.00 0.02 0.00 0.00 34.50 32.87 3d4z s PRO 905 CO 0.24 -2.23 1.09 -1.54 -0.33 0.00 0.00 177.00 174.23 3d4z s SER 906 N -2.15 2.24 0.55 2.53 1.04 -1.26 -4.88 113.70 111.77 3d4z s SER 906 Ca 0.73 1.77 0.24 0.00 0.48 0.00 0.00 55.95 59.18 3d4z s SER 906 Cb -0.29 -2.38 1.46 0.00 0.10 0.00 0.00 66.02 64.91 3d4z s SER 906 CO 0.51 -3.46 2.07 0.11 0.98 0.00 0.00 173.24 173.44 3d4z h LYS 907 N -2.11 0.00 -0.01 4.02 6.56 -2.00 -1.18 116.57 121.85 3d4z h LYS 907 Ca -0.52 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.07 3d4z h LYS 907 Cb 1.30 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.96 3d4z h LYS 907 CO 0.48 0.00 -0.13 1.28 -2.06 0.00 0.00 179.45 179.02 3d4z n LEU 908 N -4.21 0.89 -4.73 2.94 4.77 -1.26 -4.90 117.00 110.51 3d4z n LEU 908 Ca 0.04 -0.21 -0.41 0.00 -0.03 0.00 0.00 56.01 55.39 3d4z n LEU 908 Cb 0.39 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.34 3d4z n LEU 908 CO 0.33 0.16 0.70 -2.28 -1.33 0.00 0.00 177.39 174.97 3d4z s HIS 909 N -2.34 3.73 -1.62 -1.77 2.46 -0.45 -4.94 115.29 110.36 3d4z s HIS 909 Ca 0.30 1.72 0.29 0.00 0.47 0.00 0.00 55.06 57.85 3d4z s HIS 909 Cb 0.20 -3.12 1.55 0.00 -0.13 0.00 0.00 32.58 31.08 3d4z s HIS 909 CO 0.45 -0.04 2.03 -0.35 -2.47 0.00 0.00 174.74 174.36 3d4z n PRO 910 N 3.01 0.58 -4.08 2.88 -0.05 -1.26 -4.89 135.00 131.18 3d4z n PRO 910 Ca 0.03 0.01 -0.22 0.00 -0.05 0.00 0.00 63.50 63.27 3d4z n PRO 910 Cb 0.49 -1.50 -0.05 0.00 -0.05 0.00 0.00 33.50 32.38 3d4z n PRO 910 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3d4z s ALA 911 N -2.38 3.52 0.24 0.55 0.00 -1.26 -1.14 121.76 121.28 3d4z s ALA 911 Ca 0.33 -1.67 0.02 0.00 0.00 0.00 0.00 51.96 50.64 3d4z s ALA 911 Cb 0.20 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 3d4z s ALA 911 CO 0.41 0.12 0.06 0.20 0.00 0.00 0.00 175.76 176.55 3d4z s GLY 912 N -3.84 1.62 0.00 0.00 0.00 -0.78 -4.74 107.32 99.58 3d4z s GLY 912 Ca 0.36 -1.81 -0.00 0.00 0.00 0.00 0.00 44.72 43.27 3d4z s GLY 912 CO 0.23 -1.60 -0.00 -0.19 0.00 0.00 0.00 173.10 171.54 3d4z s TYR 913 N -3.67 0.04 0.73 1.90 2.02 -1.26 -3.95 117.35 113.16 3d4z s TYR 913 Ca 0.34 -0.09 -0.11 0.00 -0.37 0.00 0.00 57.07 56.84 3d4z s TYR 913 Cb 0.07 -0.03 0.03 0.00 -0.40 0.00 0.00 41.96 41.63 3d4z s TYR 913 CO 0.11 -0.04 1.07 -0.51 -1.57 0.00 0.00 175.55 174.62 3d4z s LEU 914 N -0.26 3.09 0.66 -1.29 1.43 -1.26 -4.63 118.68 116.41 3d4z s LEU 914 Ca -0.03 1.71 -0.10 0.00 -1.03 0.00 0.00 54.13 54.69 3d4z s LEU 914 Cb -0.02 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.70 3d4z s LEU 914 CO -0.00 -1.71 1.02 0.42 0.23 0.00 0.00 176.35 176.31 3d4z s THR 915 N -2.98 3.67 0.20 5.49 -4.23 -1.26 -0.65 115.64 115.88 3d4z s THR 915 Ca 0.59 0.36 -0.12 0.00 -1.18 0.00 0.00 61.69 61.34 3d4z s THR 915 Cb -0.15 -3.51 0.14 0.00 1.34 0.00 0.00 72.50 70.31 3d4z s THR 915 CO 0.55 -0.63 1.70 -1.28 -0.54 0.00 0.00 174.62 174.43 3d4z h SER 916 N -0.46 -0.07 -0.63 3.99 0.87 -1.94 -0.72 113.55 114.60 3d4z h SER 916 Ca -0.45 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.19 3d4z h SER 916 Cb 1.25 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 63.34 3d4z h SER 916 CO 0.63 -0.01 0.28 0.00 -0.53 0.00 0.00 176.83 177.20 3d4z h ALA 917 N 1.44 1.27 -0.06 6.23 0.00 -1.99 -0.20 119.26 125.95 3d4z h ALA 917 Ca 0.28 -0.15 -0.22 0.00 0.00 0.00 0.00 54.91 54.81 3d4z h ALA 917 Cb 0.40 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3d4z h ALA 917 CO -0.39 0.55 -0.85 0.00 0.00 0.00 0.00 179.25 178.56 3d4z h ALA 918 N 1.38 0.39 -0.29 0.00 0.00 -1.80 -0.30 119.26 118.63 3d4z h ALA 918 Ca 0.22 -0.65 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3d4z h ALA 918 Cb 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3d4z h ALA 918 CO -0.02 0.75 0.10 1.25 0.00 0.00 0.00 179.25 181.33 3d4z h HIS 919 N 0.34 0.46 -0.55 0.00 2.76 -0.84 0.04 115.15 117.36 3d4z h HIS 919 Ca -0.07 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.02 3d4z h HIS 919 Cb 1.47 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 30.27 3d4z h HIS 919 CO 0.07 0.47 0.16 0.87 -1.30 0.00 0.00 177.93 178.19 3d4z h LYS 920 N 0.32 0.83 -0.75 5.26 1.57 -0.96 -0.41 116.57 122.43 3d4z h LYS 920 Ca 0.10 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3d4z h LYS 920 Cb 0.21 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 3d4z h LYS 920 CO -0.01 0.73 0.23 0.00 -0.57 0.00 0.00 179.45 179.83 3d4z h ALA 921 N 1.37 0.98 -0.65 3.86 0.00 -0.73 -0.31 119.26 123.77 3d4z h ALA 921 Ca 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3d4z h ALA 921 Cb 0.26 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3d4z h ALA 921 CO -0.01 0.67 0.35 1.03 0.00 0.00 0.00 179.25 181.29 3d4z h SER 922 N 1.11 0.83 -0.01 0.00 0.87 -0.32 -2.14 113.55 113.90 3d4z h SER 922 Ca 0.24 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.67 3d4z h SER 922 Cb 0.32 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 3d4z h SER 922 CO -0.01 0.70 -0.06 1.56 -0.53 0.00 0.00 176.83 178.49 3d4z h GLN 923 N 0.90 0.17 0.00 2.24 4.20 -0.62 -0.77 115.11 121.22 3d4z h GLN 923 Ca 0.23 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 3d4z h GLN 923 Cb 0.06 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 3d4z h GLN 923 CO -0.03 0.24 -0.16 0.66 -0.67 0.00 0.00 178.83 178.87 3d4z h SER 924 N 0.16 0.00 0.11 1.46 4.64 -0.39 0.68 113.55 120.21 3d4z h SER 924 Ca 0.04 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.07 3d4z h SER 924 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3d4z h SER 924 CO 0.01 0.16 -1.47 -0.07 -0.87 0.00 0.00 176.83 174.58 3d4z h LEU 925 N 0.00 0.36 0.05 5.97 3.38 -1.03 -3.34 115.31 120.70 3d4z h LEU 925 Ca -0.00 -0.84 -0.30 0.00 0.09 0.00 0.00 57.88 56.83 3d4z h LEU 925 Cb 0.57 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3d4z h LEU 925 CO 0.02 1.64 -1.62 -0.07 0.09 0.00 0.00 178.44 178.50 3d4z h LEU 926 N -0.30 0.18 -6.02 1.67 3.38 -1.07 -3.41 115.31 109.74 3d4z h LEU 926 Ca -0.32 -0.31 -0.57 0.00 0.09 0.00 0.00 57.88 56.77 3d4z h LEU 926 Cb 1.77 -0.06 -0.40 0.00 0.09 0.00 0.00 40.66 42.06 3d4z h LEU 926 CO 0.05 1.27 -0.94 0.47 0.09 0.00 0.00 178.44 179.38 3d4z n ASP 927 N -3.27 1.54 -4.43 -0.43 8.00 0.22 -4.60 116.55 113.59 3d4z n ASP 927 Ca -0.17 -3.00 -0.29 0.00 0.71 0.00 0.00 54.79 52.04 3d4z n ASP 927 Cb 1.04 -0.64 0.21 0.00 -0.02 0.00 0.00 41.12 41.70 3d4z n ASP 927 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3d4z s PRO 928 N -1.81 -0.29 0.44 -0.24 0.04 -1.24 -4.71 135.00 127.18 3d4z s PRO 928 Ca 0.38 0.40 -0.26 0.00 0.04 0.00 0.00 61.00 61.55 3d4z s PRO 928 Cb 0.19 -1.66 -0.09 0.00 0.04 0.00 0.00 34.50 32.98 3d4z s PRO 928 CO -0.08 -3.19 1.45 -0.51 0.04 0.00 0.00 177.00 174.71 3d4z s LEU 929 N -6.73 4.15 0.13 -3.56 1.43 -1.26 -4.75 118.68 108.09 3d4z s LEU 929 Ca 0.67 2.96 -0.18 0.00 -1.03 0.00 0.00 54.13 56.55 3d4z s LEU 929 Cb -0.17 -3.88 -0.07 0.00 0.03 0.00 0.00 46.19 42.10 3d4z s LEU 929 CO 0.58 -1.13 0.60 -1.81 0.23 0.00 0.00 176.35 174.83 3d4z s ASP 930 N -0.42 7.00 -0.11 2.29 1.01 -0.20 -4.90 116.67 121.35 3d4z s ASP 930 Ca 0.59 1.25 0.03 0.00 0.71 0.00 0.00 52.55 55.13 3d4z s ASP 930 Cb -0.45 -2.35 -0.00 0.00 1.01 0.00 0.00 42.92 41.13 3d4z s ASP 930 CO 0.58 0.17 -0.22 -0.54 0.21 0.00 0.00 175.17 175.38 3d4z s LYS 931 N -1.54 3.12 -0.04 8.23 1.02 -1.26 -0.85 119.74 128.43 3d4z s LYS 931 Ca 0.35 -0.84 0.06 0.00 0.02 0.00 0.00 55.97 55.55 3d4z s LYS 931 Cb -0.18 -2.37 -0.01 0.00 -0.52 0.00 0.00 37.83 34.75 3d4z s LYS 931 CO 0.20 0.19 -0.21 -0.06 -0.92 0.00 0.00 175.35 174.54 3d4z s PHE 932 N 0.35 2.03 -0.19 3.18 0.40 0.51 -0.74 117.98 123.52 3d4z s PHE 932 Ca -0.17 -0.53 -0.02 0.00 -0.60 0.00 0.00 56.93 55.60 3d4z s PHE 932 Cb -0.18 -1.34 -0.01 0.00 0.51 0.00 0.00 43.02 42.01 3d4z s PHE 932 CO 0.08 -0.14 -0.08 0.42 0.70 0.00 0.00 175.22 176.20 3d4z s ILE 933 N -0.20 3.26 0.23 0.64 1.01 -0.01 -0.76 121.20 125.38 3d4z s ILE 933 Ca -0.00 -0.55 -0.31 0.00 0.00 0.00 0.00 60.65 59.79 3d4z s ILE 933 Cb -0.11 -2.44 -0.11 0.00 0.01 0.00 0.00 42.46 39.81 3d4z s ILE 933 CO 0.02 0.47 1.59 0.12 0.00 0.00 0.00 174.94 177.13 3d4z s PHE 934 N 1.02 2.91 -0.31 3.97 5.36 -0.63 -1.70 117.98 128.61 3d4z s PHE 934 Ca -0.00 0.69 0.23 0.00 -0.96 0.00 0.00 56.93 56.89 3d4z s PHE 934 Cb -0.15 -4.01 0.10 0.00 -0.34 0.00 0.00 43.02 38.63 3d4z s PHE 934 CO -0.01 -3.55 1.19 0.00 -1.46 0.00 0.00 175.22 171.40 3d4z h ALA 935 N 5.79 0.62 -5.79 11.12 0.00 -0.93 -3.46 119.26 126.61 3d4z h ALA 935 Ca -0.45 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 53.95 3d4z h ALA 935 Cb 1.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3d4z h ALA 935 CO 0.86 0.00 -0.22 0.39 0.00 0.00 0.00 179.25 180.28 3d4z n GLU 936 N -2.74 0.74 -0.01 0.00 1.02 -1.26 -5.05 120.64 113.34 3d4z n GLU 936 Ca 0.01 -3.08 -0.12 0.00 -0.02 0.00 0.00 57.16 53.95 3d4z n GLU 936 Cb 0.54 0.25 0.00 0.00 -0.02 0.00 0.00 31.44 32.21 3d4z n GLU 936 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 3d4z h ASN 937 N 0.52 0.73 -3.40 1.62 2.35 -1.97 -3.44 115.58 111.99 3d4z h ASN 937 Ca -0.31 -0.43 -0.46 0.00 -0.55 0.00 0.00 56.30 54.56 3d4z h ASN 937 Cb 1.15 -0.21 -0.34 0.00 0.05 0.00 0.00 38.32 38.97 3d4z h ASN 937 CO 0.47 1.18 -0.79 -0.70 -1.65 0.00 0.00 177.43 175.95 3d4z s GLU 938 N -3.90 1.18 -0.54 0.81 2.12 -1.26 -4.96 118.70 112.14 3d4z s GLU 938 Ca -0.08 -0.21 -0.17 0.00 0.36 0.00 0.00 54.97 54.87 3d4z s GLU 938 Cb 0.10 -1.12 0.11 0.00 0.26 0.00 0.00 34.13 33.49 3d4z s GLU 938 CO 0.86 -0.08 0.55 -0.46 -0.54 0.00 0.00 175.26 175.59 3d4z s TRP 939 N 0.98 3.17 0.19 5.30 -0.00 -1.26 -5.06 118.94 122.26 3d4z s TRP 939 Ca -0.10 -1.12 -0.27 0.00 -0.00 0.00 0.00 56.10 54.61 3d4z s TRP 939 Cb -0.15 -3.76 -0.08 0.00 -0.00 0.00 0.00 33.47 29.48 3d4z s TRP 939 CO 0.00 -1.06 0.85 0.42 -0.00 0.00 0.00 176.95 177.16 3d4z s ILE 940 N 1.95 4.26 0.00 5.86 1.01 -1.26 -3.41 121.20 129.61 3d4z s ILE 940 Ca 0.06 1.88 0.00 0.00 0.00 0.00 0.00 60.65 62.59 3d4z s ILE 940 Cb -0.27 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 37.97 3d4z s ILE 940 CO 0.05 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.10 3d4z n GLY 941 N 1.61 0.70 3.71 6.18 0.00 -1.26 -4.81 105.19 111.32 3d4z n GLY 941 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3d4z n GLY 941 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d4z n ALA 942 N 0.39 1.45 -2.59 4.61 0.00 -1.22 -0.68 120.51 122.47 3d4z n ALA 942 Ca 0.00 0.33 -0.26 0.00 0.00 0.00 0.00 53.44 53.50 3d4z n ALA 942 Cb 0.00 -2.28 -0.09 0.00 0.00 0.00 0.00 19.45 17.08 3d4z n ALA 942 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3d4z s GLN 943 N -2.02 2.11 0.08 0.00 -0.21 0.51 -4.85 119.66 115.29 3d4z s GLN 943 Ca 0.57 -1.26 0.06 0.00 0.02 0.00 0.00 55.36 54.75 3d4z s GLN 943 Cb -0.54 -2.18 -0.22 0.00 1.00 0.00 0.00 33.01 31.07 3d4z s GLN 943 CO 0.61 0.43 1.15 0.78 -2.12 0.00 0.00 175.29 176.14 3d4z h GLY 944 N 2.81 0.05 -3.85 3.09 0.00 -1.88 -3.43 103.07 99.85 3d4z h GLY 944 Ca -0.46 -0.12 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 3d4z h GLY 944 CO 0.55 0.10 0.07 1.62 0.00 0.00 0.00 176.54 178.88 3d4z s GLN 945 N -2.68 1.01 -0.03 4.80 0.74 -1.26 -1.17 119.66 121.07 3d4z s GLN 945 Ca -0.01 -0.06 0.02 0.00 0.05 0.00 0.00 55.36 55.36 3d4z s GLN 945 Cb 0.09 0.47 0.01 0.00 1.10 0.00 0.00 33.01 34.68 3d4z s GLN 945 CO 0.83 -0.34 -0.06 0.12 -0.55 0.00 0.00 175.29 175.28 3d4z s PHE 946 N -1.91 0.72 0.00 1.67 5.36 -0.46 -4.88 117.98 118.48 3d4z s PHE 946 Ca -0.08 -0.17 0.00 0.00 -0.96 0.00 0.00 56.93 55.72 3d4z s PHE 946 Cb -0.01 -0.56 0.00 0.00 -0.34 0.00 0.00 43.02 42.11 3d4z s PHE 946 CO 0.03 -0.11 0.00 0.41 -1.46 0.00 0.00 175.22 174.09 3d4z n GLY 947 N 3.50 0.80 0.32 13.12 0.00 -1.26 -0.86 105.19 120.79 3d4z n GLY 947 Ca -0.20 0.00 0.17 0.00 0.00 0.00 0.00 46.02 45.99 3d4z n GLY 947 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d4z h GLY 948 N 0.00 0.00 -2.01 -0.02 0.00 -1.89 0.14 103.07 99.28 3d4z h GLY 948 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3d4z h GLY 948 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 176.54 178.63 3d4z n ASP 949 N -3.63 3.04 -4.76 0.19 5.75 -1.26 -4.93 116.55 110.95 3d4z n ASP 949 Ca -0.02 -1.95 -0.41 0.00 -0.01 0.00 0.00 54.79 52.40 3d4z n ASP 949 Cb 0.15 -0.30 -0.03 0.00 -1.03 0.00 0.00 41.12 39.91 3d4z n ASP 949 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 3d4z s HIS 950 N -1.40 3.36 0.44 2.11 3.76 0.04 -4.99 115.29 118.61 3d4z s HIS 950 Ca 0.38 1.54 -0.25 0.00 -0.15 0.00 0.00 55.06 56.58 3d4z s HIS 950 Cb 0.21 -3.45 -0.08 0.00 1.11 0.00 0.00 32.58 30.36 3d4z s HIS 950 CO 0.29 -1.15 1.41 -2.14 -0.85 0.00 0.00 174.74 172.29 3d4z s PRO 951 N -1.33 3.74 -0.49 8.40 0.02 -1.26 -4.70 135.00 139.38 3d4z s PRO 951 Ca 0.48 2.37 -0.13 0.00 0.02 0.00 0.00 61.00 63.74 3d4z s PRO 951 Cb -0.35 -2.68 0.11 0.00 0.02 0.00 0.00 34.50 31.61 3d4z s PRO 951 CO 0.44 -0.76 0.41 0.45 -0.33 0.00 0.00 177.00 177.21 3d4z s SER 952 N -0.55 5.99 0.64 2.53 0.15 -1.26 -4.65 113.70 116.55 3d4z s SER 952 Ca 0.60 -1.70 -0.12 0.00 0.70 0.00 0.00 55.95 55.43 3d4z s SER 952 Cb -0.43 -2.13 -0.02 0.00 -1.71 0.00 0.00 66.02 61.74 3d4z s SER 952 CO 0.55 -0.74 1.05 0.00 1.20 0.00 0.00 173.24 175.30 3d4z s ALA 953 N 1.53 2.81 0.52 5.45 0.00 0.54 -2.74 121.76 129.87 3d4z s ALA 953 Ca 0.04 0.12 -0.21 0.00 0.00 0.00 0.00 51.96 51.91 3d4z s ALA 953 Cb -0.27 -3.16 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 3d4z s ALA 953 CO 0.03 -0.94 0.92 -2.13 0.00 0.00 0.00 175.76 173.64 3d4z n ARG 954 N -2.68 1.03 0.31 0.00 0.63 -1.26 -4.69 116.66 110.00 3d4z n ARG 954 Ca 0.07 0.39 0.21 0.00 -0.92 0.00 0.00 57.85 57.59 3d4z n ARG 954 Cb 0.54 -2.06 0.99 0.00 0.45 0.00 0.00 32.46 32.38 3d4z n ARG 954 CO 0.00 0.00 0.00 1.05 -2.51 0.00 0.00 177.63 176.17 3d4z h GLU 955 N 0.88 0.00 -0.01 -0.14 4.11 -1.97 -0.89 114.58 116.57 3d4z h GLU 955 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 3d4z h GLU 955 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3d4z h GLU 955 CO 0.53 0.00 -0.03 -0.40 0.07 0.00 0.00 179.01 179.18 3d4z n ASP 956 N -3.08 1.22 -4.81 3.06 5.75 -1.26 -4.85 116.55 112.58 3d4z n ASP 956 Ca -0.01 -1.34 -0.36 0.00 -0.01 0.00 0.00 54.79 53.07 3d4z n ASP 956 Cb 0.17 0.01 -0.07 0.00 -1.03 0.00 0.00 41.12 40.20 3d4z n ASP 956 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3d4z s LEU 957 N -2.07 4.15 0.05 -2.12 2.96 -0.34 -1.01 118.68 120.30 3d4z s LEU 957 Ca 0.37 0.35 0.05 0.00 -0.22 0.00 0.00 54.13 54.69 3d4z s LEU 957 Cb 0.21 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.87 3d4z s LEU 957 CO 0.36 0.38 -0.13 -0.62 -1.32 0.00 0.00 176.35 175.02 3d4z s ASP 958 N -0.84 1.59 -0.94 3.68 2.15 0.42 -4.76 116.67 117.96 3d4z s ASP 958 Ca 0.14 -0.52 -0.16 0.00 0.43 0.00 0.00 52.55 52.44 3d4z s ASP 958 Cb -0.12 -0.07 0.18 0.00 -0.30 0.00 0.00 42.92 42.61 3d4z s ASP 958 CO 0.03 -0.03 1.04 -0.69 -0.17 0.00 0.00 175.17 175.35 3d4z s VAL 959 N -1.04 5.17 0.28 1.11 1.01 -1.26 -1.14 120.40 124.53 3d4z s VAL 959 Ca -0.01 -2.15 -0.03 0.00 0.00 0.00 0.00 61.98 59.79 3d4z s VAL 959 Cb -0.09 -4.68 0.21 0.00 0.00 0.00 0.00 36.38 31.83 3d4z s VAL 959 CO 0.02 -1.33 1.89 0.28 0.00 0.00 0.00 175.10 175.95 3d4z h SER 960 N 8.11 0.93 -3.70 3.32 0.02 -1.19 -3.42 113.55 117.61 3d4z h SER 960 Ca 0.16 -0.09 -0.35 0.00 -0.84 0.00 0.00 61.79 60.67 3d4z h SER 960 Cb 1.00 -0.24 -0.31 0.00 0.14 0.00 0.00 62.40 62.99 3d4z h SER 960 CO 0.99 0.77 -0.76 -0.69 -1.14 0.00 0.00 176.83 176.00 3d4z s VAL 961 N -5.64 0.39 -0.11 2.27 1.01 -1.14 -4.96 120.40 112.23 3d4z s VAL 961 Ca -0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 61.98 61.74 3d4z s VAL 961 Cb 0.17 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 36.18 3d4z s VAL 961 CO 0.80 0.15 -0.08 -0.32 0.00 0.00 0.00 175.10 175.65 3d4z s MET 962 N 0.40 1.55 -0.07 2.72 0.00 -1.26 -1.13 119.30 121.51 3d4z s MET 962 Ca -0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 55.69 55.35 3d4z s MET 962 Cb -0.08 -1.57 0.04 0.00 0.00 0.00 0.00 34.83 33.22 3d4z s MET 962 CO -0.00 -0.24 0.12 0.50 0.00 0.00 0.00 175.02 175.40 3d4z s ARG 963 N 1.59 0.01 0.15 4.11 3.52 0.08 -3.30 118.95 125.11 3d4z s ARG 963 Ca 0.03 0.45 -0.30 0.00 -0.13 0.00 0.00 55.73 55.78 3d4z s ARG 963 Cb -0.13 -0.30 -0.07 0.00 -1.56 0.00 0.00 34.95 32.89 3d4z s ARG 963 CO -0.07 -0.27 1.22 0.50 -0.81 0.00 0.00 175.30 175.87 3d4z s ARG 964 N 1.92 4.46 0.00 5.12 3.52 -1.26 -0.18 118.95 132.53 3d4z s ARG 964 Ca -0.00 1.88 0.19 0.00 -0.13 0.00 0.00 55.73 57.67 3d4z s ARG 964 Cb -0.12 -3.26 -0.15 0.00 -1.56 0.00 0.00 34.95 29.86 3d4z s ARG 964 CO -0.05 -0.17 0.87 1.28 -0.81 0.00 0.00 175.30 176.42 3d4z n LEU 965 N 2.98 1.19 -4.39 -0.88 4.77 0.71 -4.91 117.00 116.47 3d4z n LEU 965 Ca 0.06 -0.58 -0.30 0.00 -0.03 0.00 0.00 56.01 55.16 3d4z n LEU 965 Cb 0.45 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.40 3d4z n LEU 965 CO 0.56 0.26 -0.55 0.42 -1.33 0.00 0.00 177.39 176.76 3d4z s THR 966 N -2.65 2.36 0.83 -5.08 -4.23 -1.22 -4.95 115.64 100.69 3d4z s THR 966 Ca 0.10 -1.38 -0.12 0.00 -1.18 0.00 0.00 61.69 59.11 3d4z s THR 966 Cb 0.15 -1.96 0.09 0.00 1.34 0.00 0.00 72.50 72.12 3d4z s THR 966 CO 0.71 0.32 1.13 -0.54 -0.54 0.00 0.00 174.62 175.70 3d4z s LYS 967 N -1.41 1.84 0.55 3.99 1.02 -1.26 -4.88 119.74 119.60 3d4z s LYS 967 Ca 0.13 0.38 0.34 0.00 0.02 0.00 0.00 55.97 56.84 3d4z s LYS 967 Cb -0.10 -1.91 1.51 0.00 -0.52 0.00 0.00 37.83 36.81 3d4z s LYS 967 CO 0.04 -1.73 2.05 0.66 -0.92 0.00 0.00 175.35 175.44 3d4z h SER 968 N -1.16 0.00 0.27 2.83 4.64 -1.97 -2.53 113.55 115.62 3d4z h SER 968 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3d4z h SER 968 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3d4z h SER 968 CO 0.62 0.04 -0.04 -1.54 -0.87 0.00 0.00 176.83 175.05 3d4z n SER 969 N -3.20 0.28 -4.69 4.97 3.41 -1.26 -4.79 113.62 108.34 3d4z n SER 969 Ca -0.00 -0.68 -0.42 0.00 -0.26 0.00 0.00 58.87 57.51 3d4z n SER 969 Cb 0.27 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 3d4z n SER 969 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d4z s ALA 970 N -2.31 3.61 0.21 7.33 0.00 -0.96 -4.91 121.76 124.74 3d4z s ALA 970 Ca 0.36 0.97 -0.10 0.00 0.00 0.00 0.00 51.96 53.19 3d4z s ALA 970 Cb 0.21 -3.63 0.16 0.00 0.00 0.00 0.00 23.12 19.86 3d4z s ALA 970 CO 0.43 -0.97 1.87 -0.22 0.00 0.00 0.00 175.76 176.86 3d4z h LYS 971 N 7.98 1.02 -4.37 0.00 3.64 -1.90 -3.37 116.57 119.57 3d4z h LYS 971 Ca -0.39 -0.08 -0.73 0.00 -1.27 0.00 0.00 60.65 58.18 3d4z h LYS 971 Cb 1.18 -0.22 -0.22 0.00 -0.41 0.00 0.00 32.23 32.56 3d4z h LYS 971 CO 0.91 0.70 -0.37 0.99 -2.27 0.00 0.00 179.45 179.41 3d4z s THR 972 N -6.06 5.21 0.44 1.00 2.01 -1.26 -1.29 115.64 115.67 3d4z s THR 972 Ca -0.13 -0.94 -0.22 0.00 0.31 0.00 0.00 61.69 60.71 3d4z s THR 972 Cb 0.15 -4.04 -0.09 0.00 0.01 0.00 0.00 72.50 68.53 3d4z s THR 972 CO 0.79 -0.49 1.03 -1.10 -0.69 0.00 0.00 174.62 174.16 3d4z s GLN 973 N 1.65 4.03 -0.02 4.92 -1.52 -0.12 -4.83 119.66 123.77 3d4z s GLN 973 Ca 0.04 1.40 0.02 0.00 -1.95 0.00 0.00 55.36 54.87 3d4z s GLN 973 Cb -0.22 -2.32 0.00 0.00 -0.22 0.00 0.00 33.01 30.25 3d4z s GLN 973 CO 0.08 -0.24 -0.06 1.03 -0.25 0.00 0.00 175.29 175.84 3d4z s ARG 974 N -2.87 0.70 -0.06 2.91 0.52 -1.26 -0.49 118.95 118.40 3d4z s ARG 974 Ca 0.62 -0.21 0.03 0.00 -0.52 0.00 0.00 55.73 55.65 3d4z s ARG 974 Cb -0.18 -0.68 0.01 0.00 0.52 0.00 0.00 34.95 34.62 3d4z s ARG 974 CO 0.22 0.07 -0.14 0.08 0.02 0.00 0.00 175.30 175.55 3d4z s VAL 975 N 0.23 1.27 -0.00 3.52 1.01 -0.17 -0.21 120.40 126.06 3d4z s VAL 975 Ca -0.03 -0.58 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 3d4z s VAL 975 Cb -0.07 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 3d4z s VAL 975 CO -0.00 0.38 0.08 -0.83 0.00 0.00 0.00 175.10 174.73 3d4z s GLY 976 N 0.44 2.02 -0.02 4.51 0.00 0.75 -1.07 107.32 113.94 3d4z s GLY 976 Ca -0.11 -0.88 0.02 0.00 0.00 0.00 0.00 44.72 43.75 3d4z s GLY 976 CO 0.04 -0.76 -0.08 -0.19 0.00 0.00 0.00 173.10 172.11 3d4z s TYR 977 N -1.20 0.85 -0.21 1.90 1.51 0.36 -0.74 117.35 119.80 3d4z s TYR 977 Ca 0.23 -0.20 -0.06 0.00 -1.01 0.00 0.00 57.07 56.04 3d4z s TYR 977 Cb -0.12 -0.60 -0.02 0.00 -0.11 0.00 0.00 41.96 41.10 3d4z s TYR 977 CO 0.14 -0.08 0.02 0.08 -1.11 0.00 0.00 175.55 174.60 3d4z s VAL 978 N 0.16 4.05 -0.17 0.71 1.01 -0.29 -0.80 120.40 125.07 3d4z s VAL 978 Ca -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 3d4z s VAL 978 Cb -0.07 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 3d4z s VAL 978 CO 0.00 0.40 -0.05 -0.76 0.00 0.00 0.00 175.10 174.70 3d4z s LEU 979 N 1.18 3.08 -0.08 3.92 1.43 0.12 -0.57 118.68 127.76 3d4z s LEU 979 Ca 0.03 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 3d4z s LEU 979 Cb -0.14 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.33 3d4z s LEU 979 CO 0.02 0.11 -0.20 -2.28 0.23 0.00 0.00 176.35 174.22 3d4z s HIS 980 N 0.71 2.19 -0.16 0.29 5.65 -0.29 -0.74 115.29 122.95 3d4z s HIS 980 Ca -0.02 -0.85 -0.00 0.00 0.25 0.00 0.00 55.06 54.43 3d4z s HIS 980 Cb -0.15 -1.49 -0.01 0.00 -1.18 0.00 0.00 32.58 29.76 3d4z s HIS 980 CO 0.02 -0.35 -0.13 0.50 -0.65 0.00 0.00 174.74 174.13 3d4z s ARG 981 N 0.38 3.29 0.32 2.88 3.52 -0.67 -0.44 118.95 128.23 3d4z s ARG 981 Ca -0.16 -0.71 -0.04 0.00 -0.13 0.00 0.00 55.73 54.70 3d4z s ARG 981 Cb -0.17 -2.68 0.07 0.00 -1.56 0.00 0.00 34.95 30.61 3d4z s ARG 981 CO 0.07 0.05 0.43 -2.37 -0.81 0.00 0.00 175.30 172.67 3d4z n THR 982 N 3.99 0.00 -4.04 4.11 5.66 -0.18 -0.25 114.28 123.58 3d4z n THR 982 Ca -0.19 -0.45 -0.28 0.00 -3.05 0.00 0.00 64.05 60.09 3d4z n THR 982 Cb 0.52 -1.56 -0.17 0.00 -1.55 0.00 0.00 70.33 67.57 3d4z n THR 982 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 3d4z s ASN 983 N -2.65 2.34 0.01 1.09 2.47 -1.26 -3.71 114.94 113.23 3d4z s ASN 983 Ca 0.26 -0.37 0.01 0.00 0.42 0.00 0.00 52.86 53.18 3d4z s ASN 983 Cb -0.01 -0.97 -0.04 0.00 -1.45 0.00 0.00 41.25 38.78 3d4z s ASN 983 CO 0.18 -0.08 0.02 -0.76 -3.72 0.00 0.00 177.10 172.74 3d4z s LEU 984 N 1.50 3.58 0.41 3.21 1.43 -1.26 -4.25 118.68 123.31 3d4z s LEU 984 Ca 0.03 0.01 -0.25 0.00 -1.03 0.00 0.00 54.13 52.88 3d4z s LEU 984 Cb -0.13 -2.08 -0.08 0.00 0.03 0.00 0.00 46.19 43.93 3d4z s LEU 984 CO -0.08 0.27 1.24 -0.04 0.23 0.00 0.00 176.35 177.98 3d4z s MET 985 N -1.65 3.94 -0.35 1.70 -1.94 0.18 -4.97 119.30 116.20 3d4z s MET 985 Ca 0.21 2.01 -0.25 0.00 -1.71 0.00 0.00 55.69 55.95 3d4z s MET 985 Cb -0.12 -2.67 0.01 0.00 2.01 0.00 0.00 34.83 34.06 3d4z s MET 985 CO 0.12 -0.47 0.87 -0.65 -0.01 0.00 0.00 175.02 174.88 3d4z s GLN 986 N -2.33 3.87 -0.10 2.03 -1.52 -1.26 -4.63 119.66 115.72 3d4z s GLN 986 Ca 0.58 0.56 0.14 0.00 -1.95 0.00 0.00 55.36 54.69 3d4z s GLN 986 Cb -0.35 -3.78 0.28 0.00 -0.22 0.00 0.00 33.01 28.94 3d4z s GLN 986 CO 0.44 -0.86 1.14 0.00 -0.25 0.00 0.00 175.29 175.76 3d4z n GLY 988 N -0.72 0.69 3.63 0.00 0.00 -1.26 -4.70 105.19 102.82 3d4z n GLY 988 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 3d4z n GLY 988 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d4z s THR 989 N -2.72 4.10 0.37 2.61 2.01 -1.26 -4.95 115.64 115.80 3d4z s THR 989 Ca 0.00 1.24 -0.26 0.00 0.31 0.00 0.00 61.69 62.98 3d4z s THR 989 Cb 0.00 -4.14 -0.12 0.00 0.01 0.00 0.00 72.50 68.25 3d4z s THR 989 CO 0.00 -0.48 1.09 -2.65 -0.69 0.00 0.00 174.62 171.88 3d4z n PRO 990 N 7.38 1.56 -2.90 4.92 -0.02 -1.26 -4.93 135.00 139.75 3d4z n PRO 990 Ca 0.15 0.55 -0.37 0.00 -2.02 0.00 0.00 63.50 61.81 3d4z n PRO 990 Cb 0.47 -2.07 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 3d4z n PRO 990 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3d4z s GLU 991 N -1.87 4.48 0.08 -0.52 2.12 -1.26 -5.06 118.70 116.66 3d4z s GLU 991 Ca 0.60 1.16 0.03 0.00 0.36 0.00 0.00 54.97 57.12 3d4z s GLU 991 Cb -0.59 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 3d4z s GLU 991 CO 0.59 0.35 0.09 -1.83 -0.54 0.00 0.00 175.26 173.92 3d4z s GLU 992 N -1.94 2.95 0.36 4.30 1.03 -1.26 -5.08 118.70 119.06 3d4z s GLU 992 Ca 0.46 -0.66 -0.28 0.00 0.03 0.00 0.00 54.97 54.53 3d4z s GLU 992 Cb -0.18 -2.77 -0.12 0.00 -0.80 0.00 0.00 34.13 30.26 3d4z s GLU 992 CO 0.23 0.57 1.40 0.72 -1.33 0.00 0.00 175.26 176.85 3d4z n HIS 993 N 0.44 2.66 -4.34 4.83 8.25 -1.26 -5.02 115.22 120.78 3d4z n HIS 993 Ca -0.08 0.50 -0.18 0.00 -0.26 0.00 0.00 57.72 57.70 3d4z n HIS 993 Cb 0.51 -2.48 -0.10 0.00 1.12 0.00 0.00 29.99 29.04 3d4z n HIS 993 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3d4z s THR 994 N -1.11 0.84 0.16 1.59 -4.23 -1.26 -5.10 115.64 106.52 3d4z s THR 994 Ca 0.54 -2.01 -0.20 0.00 -1.18 0.00 0.00 61.69 58.85 3d4z s THR 994 Cb -0.52 -2.56 -0.08 0.00 1.34 0.00 0.00 72.50 70.69 3d4z s THR 994 CO 0.63 -0.12 0.66 -1.10 -0.54 0.00 0.00 174.62 174.15 3d4z s GLN 995 N -3.95 4.25 0.26 3.99 -0.21 -1.11 -4.94 119.66 117.96 3d4z s GLN 995 Ca 0.34 0.82 -0.30 0.00 0.02 0.00 0.00 55.36 56.24 3d4z s GLN 995 Cb 0.07 -3.06 -0.11 0.00 1.00 0.00 0.00 33.01 30.92 3d4z s GLN 995 CO 0.12 0.51 1.53 0.21 -2.12 0.00 0.00 175.29 175.55 3d4z s LYS 996 N -1.57 4.19 -0.29 2.91 2.20 -1.26 -4.21 119.74 121.71 3d4z s LYS 996 Ca 0.37 2.45 -0.10 0.00 -0.36 0.00 0.00 55.97 58.32 3d4z s LYS 996 Cb -0.18 -3.07 -0.03 0.00 -1.51 0.00 0.00 37.83 33.04 3d4z s LYS 996 CO 0.21 -0.55 0.16 -1.17 -0.36 0.00 0.00 175.35 173.65 3d4z s LEU 997 N -0.27 3.99 -0.46 5.43 2.96 -1.26 -4.89 118.68 124.17 3d4z s LEU 997 Ca 0.62 -0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 54.27 3d4z s LEU 997 Cb -0.45 -2.05 0.12 0.00 0.50 0.00 0.00 46.19 44.31 3d4z s LEU 997 CO 0.44 -0.11 0.26 -0.62 -1.32 0.00 0.00 176.35 175.00 3d4z s ASP 998 N 1.69 5.23 0.56 3.68 2.15 -1.26 -4.55 116.67 124.16 3d4z s ASP 998 Ca 0.06 -2.26 0.27 0.00 0.43 0.00 0.00 52.55 51.05 3d4z s ASP 998 Cb -0.16 -1.83 1.63 0.00 -0.30 0.00 0.00 42.92 42.25 3d4z s ASP 998 CO 0.08 -0.49 2.18 -0.37 -0.17 0.00 0.00 175.17 176.40 3d4z h VAL 999 N 6.07 0.62 0.00 1.11 -1.51 -1.95 -1.64 116.25 118.96 3d4z h VAL 999 Ca -0.10 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 3d4z h VAL 999 Cb 1.02 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 31.29 3d4z h VAL 999 CO 0.70 0.04 0.00 0.00 -1.23 0.00 0.00 177.57 177.08 3d4z n HIS 1001N -2.45 1.13 0.17 0.00 8.25 -0.62 -4.50 115.22 117.20 3d4z n HIS 1001Ca 0.01 -0.68 0.02 0.00 -0.26 0.00 0.00 57.72 56.82 3d4z n HIS 1001Cb 0.21 -0.24 0.28 0.00 1.12 0.00 0.00 29.99 31.36 3d4z n HIS 1001CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3d4z h LEU 1002N 2.89 0.00 -9.14 2.41 3.38 -1.50 -3.43 115.31 109.92 3d4z h LEU 1002Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 3d4z h LEU 1002Cb 1.33 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.89 3d4z h LEU 1002CO 0.20 0.47 -0.74 -0.76 0.09 0.00 0.00 178.44 177.69 3d4z s LEU 1003N -7.49 2.98 0.96 1.67 1.43 -1.26 -5.12 118.68 111.83 3d4z s LEU 1003Ca -0.01 -0.27 -0.13 0.00 -1.03 0.00 0.00 54.13 52.69 3d4z s LEU 1003Cb 0.12 -1.73 0.16 0.00 0.03 0.00 0.00 46.19 44.77 3d4z s LEU 1003CO 0.72 0.26 1.13 -2.16 0.23 0.00 0.00 176.35 176.53 3d4z s PRO 1004N -1.56 0.78 -1.40 1.29 0.04 -1.26 -4.14 135.00 128.75 3d4z s PRO 1004Ca 0.17 0.29 -0.09 0.00 0.04 0.00 0.00 61.00 61.41 3d4z s PRO 1004Cb -0.11 -1.80 0.04 0.00 0.04 0.00 0.00 34.50 32.67 3d4z s PRO 1004CO 0.08 -2.44 1.06 0.09 0.04 0.00 0.00 177.00 175.82 3d4z n ASN 1005N -3.94 -4.98 -4.73 6.66 5.03 -1.26 -4.77 115.26 107.27 3d4z n ASN 1005Ca 0.07 -0.66 -0.42 0.00 0.87 0.00 0.00 54.58 54.45 3d4z n ASN 1005Cb 0.59 -4.55 -0.03 0.00 -1.02 0.00 0.00 39.78 34.77 3d4z n ASN 1005CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3d4z s VAL 1006N -3.35 3.08 -0.07 2.41 0.11 -1.26 -2.26 120.40 119.07 3d4z s VAL 1006Ca 0.51 0.86 0.04 0.00 -2.93 0.00 0.00 61.98 60.46 3d4z s VAL 1006Cb -0.24 -3.55 -0.05 0.00 -1.53 0.00 0.00 36.38 31.01 3d4z s VAL 1006CO 0.77 0.11 0.11 0.00 -3.33 0.00 0.00 175.10 172.77 3d4z n ALA 1007N 2.91 2.27 -3.54 1.54 0.00 0.12 -4.91 120.51 118.90 3d4z n ALA 1007Ca 0.08 -0.10 -0.15 0.00 0.00 0.00 0.00 53.44 53.27 3d4z n ALA 1007Cb 0.42 -0.13 -0.06 0.00 0.00 0.00 0.00 19.45 19.68 3d4z n ALA 1007CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3d4z s ARG 1008N -1.94 0.88 -0.07 0.00 3.52 -1.14 -4.98 118.95 115.22 3d4z s ARG 1008Ca -0.00 0.22 0.01 0.00 -0.13 0.00 0.00 55.73 55.82 3d4z s ARG 1008Cb 0.03 0.41 0.02 0.00 -1.56 0.00 0.00 34.95 33.85 3d4z s ARG 1008CO 0.16 -0.27 -0.07 0.00 -0.81 0.00 0.00 175.30 174.30 3d4z s GLU 1010N 1.10 1.16 0.14 0.00 2.02 -0.30 -1.03 118.70 121.79 3d4z s GLU 1010Ca -0.07 -0.54 -0.29 0.00 0.02 0.00 0.00 54.97 54.08 3d4z s GLU 1010Cb -0.14 -1.13 -0.07 0.00 0.10 0.00 0.00 34.13 32.89 3d4z s GLU 1010CO -0.01 0.31 0.93 0.50 0.02 0.00 0.00 175.26 177.01 3d4z s ARG 1011N -0.41 4.71 0.30 1.61 3.52 0.12 -0.47 118.95 128.32 3d4z s ARG 1011Ca 0.05 1.42 0.03 0.00 -0.13 0.00 0.00 55.73 57.10 3d4z s ARG 1011Cb -0.06 -3.35 -0.06 0.00 -1.56 0.00 0.00 34.95 29.92 3d4z s ARG 1011CO -0.00 0.30 0.06 0.95 -0.81 0.00 0.00 175.30 175.80 3d4z s THR 1012N -0.32 1.05 0.98 4.11 -4.23 0.28 0.10 115.64 117.62 3d4z s THR 1012Ca 0.44 -2.01 -0.11 0.00 -1.18 0.00 0.00 61.69 58.84 3d4z s THR 1012Cb -0.24 -2.71 0.19 0.00 1.34 0.00 0.00 72.50 71.08 3d4z s THR 1012CO 0.30 -0.04 1.12 0.42 -0.54 0.00 0.00 174.62 175.87 3d4z s THR 1013N -3.40 2.00 -0.13 3.99 -4.23 -0.53 -3.88 115.64 109.46 3d4z s THR 1013Ca 0.36 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.15 3d4z s THR 1013Cb 0.08 -2.00 0.30 0.00 1.34 0.00 0.00 72.50 72.22 3d4z s THR 1013CO 0.14 -0.00 1.85 -0.07 -0.54 0.00 0.00 174.62 176.00 3d4z h LEU 1014N -2.11 0.00 -0.50 4.79 3.38 -1.68 0.22 115.31 119.41 3d4z h LEU 1014Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3d4z h LEU 1014Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3d4z h LEU 1014CO 0.43 0.00 -0.11 0.35 0.09 0.00 0.00 178.44 179.20 3d4z n THR 1015N -2.54 0.00 -1.01 0.22 -2.24 -1.26 -4.93 114.28 102.52 3d4z n THR 1015Ca 0.00 -0.13 -0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3d4z n THR 1015Cb 0.18 0.18 -0.00 0.00 -2.10 0.00 0.00 70.33 68.59 3d4z n THR 1015CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3d4z n PHE 1016N -0.53 0.00 0.74 4.78 3.72 0.06 -4.91 117.46 121.32 3d4z n PHE 1016Ca 0.16 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.68 3d4z n PHE 1016Cb 0.30 -0.91 0.12 0.00 -0.94 0.00 0.00 39.48 38.06 3d4z n PHE 1016CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3d4z n LEU 1017N -0.03 0.62 -3.89 4.37 4.77 -1.26 -4.83 117.00 116.75 3d4z n LEU 1017Ca -0.00 0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.82 3d4z n LEU 1017Cb 0.22 -0.16 -0.16 0.00 -2.33 0.00 0.00 43.42 41.00 3d4z n LEU 1017CO 0.00 0.06 -0.39 -1.58 -1.33 0.00 0.00 177.39 174.15 3d4z s GLN 1018N -3.11 0.52 -0.07 3.23 0.74 -1.26 -5.01 119.66 114.69 3d4z s GLN 1018Ca 0.07 -0.08 -0.30 0.00 0.05 0.00 0.00 55.36 55.11 3d4z s GLN 1018Cb 0.15 -0.57 -0.02 0.00 1.10 0.00 0.00 33.01 33.68 3d4z s GLN 1018CO 0.75 -0.03 1.00 -0.80 -0.55 0.00 0.00 175.29 175.67 3d4z s ASN 1019N 0.57 7.28 -0.16 6.67 0.01 -1.26 -1.45 114.94 126.61 3d4z s ASN 1019Ca -0.07 1.58 0.10 0.00 -0.71 0.00 0.00 52.86 53.77 3d4z s ASN 1019Cb -0.10 -2.56 -0.17 0.00 0.41 0.00 0.00 41.25 38.83 3d4z s ASN 1019CO -0.00 -0.39 -0.00 0.18 -1.51 0.00 0.00 177.10 175.37 3d4z n LEU 1020N 4.65 0.72 -3.72 0.60 4.77 0.11 -4.96 117.00 119.18 3d4z n LEU 1020Ca 0.08 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.91 3d4z n LEU 1020Cb 0.49 0.12 -0.10 0.00 -2.33 0.00 0.00 43.42 41.60 3d4z n LEU 1020CO 0.52 0.48 0.08 -0.70 -1.33 0.00 0.00 177.39 176.44 3d4z s GLU 1021N -2.37 0.45 -0.29 3.23 2.12 -1.03 -4.96 118.70 115.86 3d4z s GLU 1021Ca -0.12 0.67 -0.19 0.00 0.36 0.00 0.00 54.97 55.69 3d4z s GLU 1021Cb 0.05 0.13 -0.02 0.00 0.26 0.00 0.00 34.13 34.56 3d4z s GLU 1021CO 0.57 -0.10 0.57 -1.58 -0.54 0.00 0.00 175.26 174.19 3d4z s HIS 1022N 0.69 3.24 -0.09 5.30 5.65 -1.26 -0.70 115.29 128.12 3d4z s HIS 1022Ca -0.04 0.59 -0.16 0.00 0.25 0.00 0.00 55.06 55.70 3d4z s HIS 1022Cb -0.05 -2.86 -0.05 0.00 -1.18 0.00 0.00 32.58 28.44 3d4z s HIS 1022CO -0.05 -0.39 0.41 -0.51 -0.65 0.00 0.00 174.74 173.55 3d4z s LEU 1023N 2.46 4.33 0.19 8.88 1.43 -0.19 -4.99 118.68 130.78 3d4z s LEU 1023Ca 0.23 0.78 -0.33 0.00 -1.03 0.00 0.00 54.13 53.78 3d4z s LEU 1023Cb -0.15 -2.58 -0.14 0.00 0.03 0.00 0.00 46.19 43.35 3d4z s LEU 1023CO 0.10 0.13 1.41 0.47 0.23 0.00 0.00 176.35 178.69 3d4z n ASP 1024N 3.06 2.49 -0.02 2.29 8.00 -1.26 -2.06 116.55 129.05 3d4z n ASP 1024Ca -0.10 1.12 -0.00 0.00 0.71 0.00 0.00 54.79 56.51 3d4z n ASP 1024Cb 0.52 -1.36 -0.00 0.00 -0.02 0.00 0.00 41.12 40.25 3d4z n ASP 1024CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d4z n GLY 1025N 2.56 0.23 2.79 0.44 0.00 -1.26 -2.42 105.19 107.52 3d4z n GLY 1025Ca 0.15 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 3d4z n GLY 1025CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3d4z n MET 1026N -0.64 -3.54 -4.26 1.61 2.81 -0.87 -4.98 117.12 107.25 3d4z n MET 1026Ca -0.00 0.91 -0.34 0.00 -1.81 0.00 0.00 57.70 56.46 3d4z n MET 1026Cb 0.30 -5.68 -0.12 0.00 -0.71 0.00 0.00 33.22 27.01 3d4z n MET 1026CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3d4z s VAL 1027N -3.09 3.91 -0.38 2.03 1.01 -1.02 -4.60 120.40 118.26 3d4z s VAL 1027Ca 0.18 -0.34 -0.19 0.00 0.00 0.00 0.00 61.98 61.63 3d4z s VAL 1027Cb -0.08 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.57 3d4z s VAL 1027CO 0.23 0.47 0.56 0.00 0.00 0.00 0.00 175.10 176.35 3d4z s ALA 1028N 0.64 3.44 0.80 5.51 0.00 -1.26 -4.67 121.76 126.22 3d4z s ALA 1028Ca -0.02 -1.08 -0.12 0.00 0.00 0.00 0.00 51.96 50.74 3d4z s ALA 1028Cb -0.14 -3.11 0.08 0.00 0.00 0.00 0.00 23.12 19.95 3d4z s ALA 1028CO 0.02 -1.41 1.16 -2.14 0.00 0.00 0.00 175.76 173.39 3d4z s PRO 1029N 2.52 1.77 0.83 0.00 0.02 -1.26 -4.47 135.00 134.41 3d4z s PRO 1029Ca 0.20 1.55 -0.12 0.00 0.02 0.00 0.00 61.00 62.65 3d4z s PRO 1029Cb -0.15 -1.81 0.09 0.00 0.02 0.00 0.00 34.50 32.65 3d4z s PRO 1029CO 0.15 -2.07 1.13 -1.21 -0.33 0.00 0.00 177.00 174.67 3d4z s GLU 1030N -4.38 1.82 0.33 5.54 2.02 -1.26 -4.99 118.70 117.77 3d4z s GLU 1030Ca 0.69 0.39 0.07 0.00 0.02 0.00 0.00 54.97 56.14 3d4z s GLU 1030Cb -0.24 -1.91 -0.02 0.00 0.10 0.00 0.00 34.13 32.06 3d4z s GLU 1030CO 0.52 -1.75 0.37 0.14 0.02 0.00 0.00 175.26 174.55 3d4z s VAL 1031N -3.30 3.90 0.64 2.63 -7.23 -1.26 -5.11 120.40 110.66 3d4z s VAL 1031Ca 0.62 -1.19 -0.11 0.00 -1.81 0.00 0.00 61.98 59.48 3d4z s VAL 1031Cb -0.13 -3.33 -0.03 0.00 0.56 0.00 0.00 36.38 33.45 3d4z s VAL 1031CO 0.53 -0.18 1.04 0.00 -0.31 0.00 0.00 175.10 176.17 3d4z n PRO 1033N -2.78 1.71 -0.94 0.00 -0.02 -1.26 -1.13 135.00 130.59 3d4z n PRO 1033Ca 0.07 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3d4z n PRO 1033Cb 0.54 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 3d4z n PRO 1033CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3d4z n MET 1034N 1.82 -0.77 -3.88 -0.52 2.81 0.66 -4.93 117.12 112.31 3d4z n MET 1034Ca 0.12 0.19 -0.23 0.00 -1.81 0.00 0.00 57.70 55.97 3d4z n MET 1034Cb 0.29 -3.90 -0.02 0.00 -0.71 0.00 0.00 33.22 28.88 3d4z n MET 1034CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 3d4z s GLU 1035N -0.89 3.45 -0.03 0.03 0.41 -0.28 -4.93 118.70 116.46 3d4z s GLU 1035Ca 0.00 -0.64 0.01 0.00 -0.41 0.00 0.00 54.97 53.94 3d4z s GLU 1035Cb 0.00 -2.88 0.01 0.00 -1.78 0.00 0.00 34.13 29.48 3d4z s GLU 1035CO 0.00 0.42 -0.05 0.99 -0.49 0.00 0.00 175.26 176.13 3d4z s THR 1036N -1.94 0.51 0.14 3.63 2.01 -1.26 -1.67 115.64 117.06 3d4z s THR 1036Ca 0.35 -0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.20 3d4z s THR 1036Cb -0.10 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 3d4z s THR 1036CO 0.30 0.19 -0.03 0.00 -0.69 0.00 0.00 174.62 174.39 3d4z s ALA 1037N 0.51 1.15 0.03 7.40 0.00 0.08 -4.98 121.76 125.95 3d4z s ALA 1037Ca -0.07 -1.47 0.06 0.00 0.00 0.00 0.00 51.96 50.48 3d4z s ALA 1037Cb -0.10 0.39 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 3d4z s ALA 1037CO 0.00 -0.29 -0.17 0.00 0.00 0.00 0.00 175.76 175.30 3d4z s ALA 1038N -3.67 1.42 0.05 0.00 0.00 -1.25 0.14 121.76 118.45 3d4z s ALA 1038Ca 0.18 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.31 3d4z s ALA 1038Cb 0.06 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 3d4z s ALA 1038CO -0.00 0.31 -0.10 0.71 0.00 0.00 0.00 175.76 176.68 3d4z s TYR 1039N -0.70 0.87 -0.09 0.00 2.02 0.02 -0.56 117.35 118.92 3d4z s TYR 1039Ca 0.05 -0.49 0.02 0.00 -0.37 0.00 0.00 57.07 56.28 3d4z s TYR 1039Cb -0.08 -0.51 0.01 0.00 -0.40 0.00 0.00 41.96 40.99 3d4z s TYR 1039CO 0.01 -0.03 -0.14 0.08 -1.57 0.00 0.00 175.55 173.89 3d4z s VAL 1040N -1.36 1.39 -0.13 0.71 1.01 0.38 -0.49 120.40 121.91 3d4z s VAL 1040Ca -0.07 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 3d4z s VAL 1040Cb -0.10 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 3d4z s VAL 1040CO 0.01 0.42 0.13 -0.94 0.00 0.00 0.00 175.10 174.71 3d4z s SER 1041N 0.90 6.27 -0.07 3.32 1.04 -0.23 -1.15 113.70 123.78 3d4z s SER 1041Ca -0.09 0.42 0.01 0.00 0.48 0.00 0.00 55.95 56.77 3d4z s SER 1041Cb -0.15 -2.03 -0.03 0.00 0.10 0.00 0.00 66.02 63.91 3d4z s SER 1041CO 0.00 0.38 -0.08 -0.44 0.98 0.00 0.00 173.24 174.08 3d4z s SER 1042N -0.85 4.51 -0.03 7.02 0.01 -0.14 -1.00 113.70 123.22 3d4z s SER 1042Ca 0.14 -0.07 0.01 0.00 1.31 0.00 0.00 55.95 57.35 3d4z s SER 1042Cb -0.12 -1.13 0.01 0.00 0.21 0.00 0.00 66.02 65.00 3d4z s SER 1042CO 0.03 0.35 -0.04 -1.00 0.41 0.00 0.00 173.24 172.99 3d4z s HIS 1043N -0.74 0.60 0.12 2.43 3.76 0.36 0.14 115.29 121.97 3d4z s HIS 1043Ca 0.11 -0.13 -0.30 0.00 -0.15 0.00 0.00 55.06 54.59 3d4z s HIS 1043Cb -0.11 -0.50 -0.07 0.00 1.11 0.00 0.00 32.58 33.01 3d4z s HIS 1043CO 0.01 -0.11 1.15 -1.12 -0.85 0.00 0.00 174.74 173.83 3d4z s SER 1044N 0.51 7.16 0.00 1.40 0.01 -0.96 -0.94 113.70 120.88 3d4z s SER 1044Ca -0.06 2.07 0.00 0.00 1.31 0.00 0.00 55.95 59.27 3d4z s SER 1044Cb -0.10 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.54 3d4z s SER 1044CO -0.00 -0.35 0.07 -1.54 0.41 0.00 0.00 173.24 171.82