#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orw s ARG 40 N 0.00 2.90 0.93 -1.46 3.00 -1.26 -5.06 118.95 118.00 1orw s ARG 40 Ca 0.00 0.78 -0.16 0.00 0.00 0.00 0.00 55.73 56.36 1orw s ARG 40 Cb 0.00 -2.00 0.22 0.00 0.00 0.00 0.00 34.95 33.17 1orw s ARG 40 CO 0.00 -1.08 1.04 0.54 0.00 0.00 0.00 175.30 175.80 1orw n ARG 41 N -3.09 -1.89 -4.46 3.54 3.00 -1.26 -4.66 116.66 107.84 1orw n ARG 41 Ca 0.07 -1.62 -0.24 0.00 -0.01 0.00 0.00 57.85 56.04 1orw n ARG 41 Cb 0.55 -1.26 -0.10 0.00 0.00 0.00 0.00 32.46 31.64 1orw n ARG 41 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1orw s THR 42 N -3.10 2.47 -0.38 0.55 -4.23 -1.26 -1.11 115.64 108.58 1orw s THR 42 Ca 0.62 -2.35 -0.28 0.00 -1.18 0.00 0.00 61.69 58.49 1orw s THR 42 Cb -0.04 -2.28 -0.01 0.00 1.34 0.00 0.00 72.50 71.52 1orw s THR 42 CO 0.45 -0.36 1.68 -0.47 -0.54 0.00 0.00 174.62 175.38 1orw s TYR 43 N -2.39 1.99 0.44 3.99 5.04 -1.26 -4.91 117.35 120.24 1orw s TYR 43 Ca 0.29 0.64 -0.03 0.00 -2.44 0.00 0.00 57.07 55.53 1orw s TYR 43 Cb -0.05 -4.19 -0.03 0.00 0.35 0.00 0.00 41.96 38.04 1orw s TYR 43 CO 0.14 -2.60 0.70 0.95 -1.34 0.00 0.00 175.55 173.40 1orw s THR 44 N 6.56 4.77 0.29 4.34 -4.23 -1.26 -4.16 115.64 121.96 1orw s THR 44 Ca 0.73 -0.12 0.03 0.00 -1.18 0.00 0.00 61.69 61.15 1orw s THR 44 Cb -0.19 -3.79 0.29 0.00 1.34 0.00 0.00 72.50 70.15 1orw s THR 44 CO 0.32 -0.66 1.82 0.25 -0.54 0.00 0.00 174.62 175.81 1orw h LEU 45 N 0.39 0.88 -0.99 4.79 5.85 -1.93 0.60 115.31 124.90 1orw h LEU 45 Ca -0.48 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.23 1orw h LEU 45 Cb 1.22 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 1orw h LEU 45 CO 0.61 0.42 -0.07 0.74 -0.34 0.00 0.00 178.44 179.81 1orw h THR 46 N 0.92 1.24 -0.55 1.05 2.02 -1.99 -0.67 112.91 114.93 1orw h THR 46 Ca 0.52 -1.02 -0.04 0.00 0.77 0.00 0.00 66.41 66.64 1orw h THR 46 Cb 0.62 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1orw h THR 46 CO -0.30 0.35 0.18 0.44 0.37 0.00 0.00 175.52 176.56 1orw h ASP 47 N 0.60 0.76 -0.15 4.18 3.32 -1.28 -0.69 116.42 123.17 1orw h ASP 47 Ca 0.11 -0.11 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 1orw h ASP 47 Cb 0.48 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.84 1orw h ASP 47 CO 0.03 0.71 -0.51 0.22 -1.72 0.00 0.00 179.24 177.96 1orw h TYR 48 N 0.80 0.80 -0.40 4.55 3.20 -0.83 -1.90 116.97 123.19 1orw h TYR 48 Ca 0.19 -0.33 -0.15 0.00 3.14 0.00 0.00 58.73 61.58 1orw h TYR 48 Cb 0.22 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1orw h TYR 48 CO 0.01 1.11 -0.33 -0.07 -1.64 0.00 0.00 178.16 177.25 1orw h LEU 49 N 0.25 0.95 -3.05 2.82 3.38 -0.89 -3.17 115.31 115.60 1orw h LEU 49 Ca -0.02 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1orw h LEU 49 Cb 1.14 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1orw h LEU 49 CO 0.11 1.18 0.00 0.29 0.09 0.00 0.00 178.44 180.11 1orw n LYS 50 N -4.07 3.53 -4.12 1.13 5.02 -0.29 -4.95 118.16 114.42 1orw n LYS 50 Ca -0.01 -2.86 -0.35 0.00 -2.02 0.00 0.00 58.31 53.07 1orw n LYS 50 Cb 0.51 -1.83 -0.04 0.00 -0.02 0.00 0.00 35.03 33.65 1orw n LYS 50 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1orw n SER 51 N 1.29 -2.62 -0.26 4.39 7.64 -0.77 -4.76 113.62 118.53 1orw n SER 51 Ca 0.26 -0.91 0.33 0.00 1.01 0.00 0.00 58.87 59.56 1orw n SER 51 Cb 0.84 -2.21 0.71 0.00 -1.01 0.00 0.00 64.21 62.54 1orw n SER 51 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1orw h THR 52 N -1.07 0.30 -3.40 0.44 1.35 -1.68 -3.25 112.91 105.60 1orw h THR 52 Ca -0.53 0.00 -0.71 0.00 -0.55 0.00 0.00 66.41 64.62 1orw h THR 52 Cb 1.34 0.36 -0.31 0.00 -1.73 0.00 0.00 68.15 67.81 1orw h THR 52 CO 0.74 0.00 -0.47 -0.36 -0.25 0.00 0.00 175.52 175.18 1orw s PHE 53 N -4.79 3.47 0.02 4.73 0.08 -1.26 -5.08 117.98 115.14 1orw s PHE 53 Ca -0.04 -2.01 -0.27 0.00 0.12 0.00 0.00 56.93 54.72 1orw s PHE 53 Cb 0.20 -3.28 -0.04 0.00 -0.57 0.00 0.00 43.02 39.33 1orw s PHE 53 CO 0.71 -0.96 0.86 1.03 -0.10 0.00 0.00 175.22 176.76 1orw s ARG 54 N 1.29 4.54 -0.52 0.44 3.00 -1.23 -5.03 118.95 121.45 1orw s ARG 54 Ca 0.06 1.21 -0.17 0.00 0.00 0.00 0.00 55.73 56.84 1orw s ARG 54 Cb -0.24 -3.42 0.10 0.00 0.00 0.00 0.00 34.95 31.39 1orw s ARG 54 CO -0.02 0.11 0.50 0.08 0.00 0.00 0.00 175.30 175.98 1orw s VAL 55 N 0.49 5.13 0.73 3.52 1.01 -1.26 -4.67 120.40 125.35 1orw s VAL 55 Ca 0.44 -1.18 -0.13 0.00 0.00 0.00 0.00 61.98 61.11 1orw s VAL 55 Cb -0.21 -4.28 0.03 0.00 0.00 0.00 0.00 36.38 31.93 1orw s VAL 55 CO 0.25 -0.80 1.10 -0.54 0.00 0.00 0.00 175.10 175.11 1orw s LYS 56 N 1.86 2.46 0.19 2.72 1.02 -1.26 -5.06 119.74 121.67 1orw s LYS 56 Ca 0.06 1.29 0.02 0.00 0.02 0.00 0.00 55.97 57.36 1orw s LYS 56 Cb -0.26 -1.91 -0.01 0.00 -0.52 0.00 0.00 37.83 35.13 1orw s LYS 56 CO 0.06 -1.51 0.21 1.97 -0.92 0.00 0.00 175.35 175.16 1orw n PHE 57 N -3.03 -0.70 -3.47 3.18 1.16 -1.26 -4.87 117.46 108.47 1orw n PHE 57 Ca 0.10 -1.49 -0.17 0.00 -1.87 0.00 0.00 57.45 54.01 1orw n PHE 57 Cb 0.52 0.23 -0.12 0.00 -1.61 0.00 0.00 39.48 38.50 1orw n PHE 57 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 1orw s TYR 58 N -3.21 -0.35 -0.29 2.97 6.14 -1.26 -4.98 117.35 116.37 1orw s TYR 58 Ca 0.20 0.28 -0.08 0.00 0.64 0.00 0.00 57.07 58.11 1orw s TYR 58 Cb 0.00 -0.32 -0.01 0.00 0.42 0.00 0.00 41.96 42.06 1orw s TYR 58 CO 0.14 -0.63 0.10 0.99 0.64 0.00 0.00 175.55 176.79 1orw s THR 59 N 2.35 4.28 0.27 4.34 2.01 -1.26 -5.09 115.64 122.55 1orw s THR 59 Ca 0.08 -0.45 0.09 0.00 0.31 0.00 0.00 61.69 61.72 1orw s THR 59 Cb -0.16 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.16 1orw s THR 59 CO -0.13 0.15 -0.12 -1.48 -0.69 0.00 0.00 174.62 172.35 1orw s LEU 60 N 1.57 2.58 -0.13 4.42 0.05 -1.26 -4.45 118.68 121.45 1orw s LEU 60 Ca 0.04 -1.11 0.00 0.00 0.05 0.00 0.00 54.13 53.12 1orw s LEU 60 Cb -0.16 -0.83 0.02 0.00 -2.05 0.00 0.00 46.19 43.17 1orw s LEU 60 CO 0.04 -0.18 -0.11 -1.10 -0.55 0.00 0.00 176.35 174.45 1orw s GLN 61 N -3.63 1.96 0.48 1.48 -0.21 -0.00 -4.90 119.66 114.83 1orw s GLN 61 Ca 0.28 -0.43 -0.21 0.00 0.02 0.00 0.00 55.36 55.02 1orw s GLN 61 Cb 0.00 -1.89 -0.08 0.00 1.00 0.00 0.00 33.01 32.04 1orw s GLN 61 CO 0.12 -0.26 1.07 -1.58 -2.12 0.00 0.00 175.29 172.53 1orw s TRP 62 N 1.58 2.97 0.00 0.91 0.52 -1.26 0.22 118.94 123.88 1orw s TRP 62 Ca 0.05 1.58 0.00 0.00 0.02 0.00 0.00 56.10 57.75 1orw s TRP 62 Cb -0.13 -3.16 0.00 0.00 -1.15 0.00 0.00 33.47 29.03 1orw s TRP 62 CO -0.10 -1.02 0.66 0.44 0.02 0.00 0.00 176.95 176.96 1orw n ILE 63 N -0.79 0.00 -3.11 2.03 -5.35 -0.23 -4.84 119.36 107.08 1orw n ILE 63 Ca 0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 1orw n ILE 63 Cb 0.51 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 39.03 1orw n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1orw n SER 64 N 0.00 0.00 -0.56 7.28 3.41 -1.20 -4.93 113.62 117.62 1orw n SER 64 Ca 0.00 -0.34 0.12 0.00 -0.26 0.00 0.00 58.87 58.39 1orw n SER 64 Cb 0.58 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.69 1orw n SER 64 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1orw n ASP 65 N -0.08 2.01 -0.13 4.04 5.68 -1.26 -0.48 116.55 126.33 1orw n ASP 65 Ca 0.00 -1.51 0.00 0.00 -0.50 0.00 0.00 54.79 52.78 1orw n ASP 65 Cb 0.00 0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 1orw n ASP 65 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1orw n HIS 66 N 0.20 0.00 -4.06 2.11 1.44 -1.26 -4.25 115.22 109.40 1orw n HIS 66 Ca 0.12 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.69 1orw n HIS 66 Cb 0.46 0.01 -0.14 0.00 0.12 0.00 0.00 29.99 30.45 1orw n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1orw s GLU 67 N 0.00 0.28 0.02 -1.40 2.02 -1.26 -0.12 118.70 118.25 1orw s GLU 67 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 54.97 54.85 1orw s GLU 67 Cb 0.00 -0.26 -0.02 0.00 0.10 0.00 0.00 34.13 33.95 1orw s GLU 67 CO 0.00 0.07 -0.04 1.52 0.02 0.00 0.00 175.26 176.83 1orw s TYR 68 N -0.14 0.33 0.21 1.61 -0.85 -1.18 -1.06 117.35 116.26 1orw s TYR 68 Ca 0.01 -0.55 -0.10 0.00 -0.52 0.00 0.00 57.07 55.91 1orw s TYR 68 Cb -0.02 -0.23 -0.07 0.00 0.38 0.00 0.00 41.96 42.03 1orw s TYR 68 CO -0.00 -0.18 0.53 -0.51 -1.52 0.00 0.00 175.55 173.87 1orw s LEU 69 N -1.53 4.20 -0.15 -3.49 1.43 0.58 -1.65 118.68 118.08 1orw s LEU 69 Ca -0.14 0.91 -0.08 0.00 -1.03 0.00 0.00 54.13 53.79 1orw s LEU 69 Cb -0.09 -3.58 0.05 0.00 0.03 0.00 0.00 46.19 42.60 1orw s LEU 69 CO -0.01 -0.03 0.35 -0.47 0.23 0.00 0.00 176.35 176.42 1orw s TYR 70 N -1.75 -0.50 -0.15 0.29 5.04 -0.30 -0.82 117.35 119.16 1orw s TYR 70 Ca 0.45 1.10 -0.21 0.00 -2.44 0.00 0.00 57.07 55.98 1orw s TYR 70 Cb -0.12 0.18 -0.03 0.00 0.35 0.00 0.00 41.96 42.34 1orw s TYR 70 CO 0.21 -0.30 0.60 0.21 -1.34 0.00 0.00 175.55 174.93 1orw s LYS 71 N 1.35 4.30 -0.09 4.97 2.20 -1.26 0.11 119.74 131.32 1orw s LYS 71 Ca -0.09 0.62 -0.02 0.00 -0.36 0.00 0.00 55.97 56.11 1orw s LYS 71 Cb -0.09 -3.51 0.04 0.00 -1.51 0.00 0.00 37.83 32.76 1orw s LYS 71 CO -0.11 -0.06 0.05 -1.14 -0.36 0.00 0.00 175.35 173.73 1orw s GLN 72 N 1.30 0.22 -1.46 4.03 0.74 0.93 -4.80 119.66 120.61 1orw s GLN 72 Ca 0.30 0.13 -0.09 0.00 0.05 0.00 0.00 55.36 55.75 1orw s GLN 72 Cb -0.16 -1.06 0.04 0.00 1.10 0.00 0.00 33.01 32.93 1orw s GLN 72 CO 0.12 -0.42 0.78 0.39 -0.55 0.00 0.00 175.29 175.61 1orw n GLU 73 N 5.23 -5.33 -1.38 1.67 1.02 -1.26 -1.25 120.64 119.34 1orw n GLU 73 Ca -0.06 0.73 -0.11 0.00 -0.02 0.00 0.00 57.16 57.71 1orw n GLU 73 Cb 0.50 -5.61 -0.04 0.00 -0.02 0.00 0.00 31.44 26.26 1orw n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1orw n ASN 74 N -2.64 -4.21 -4.62 1.62 3.02 -1.26 -4.84 115.26 102.33 1orw n ASN 74 Ca -0.03 0.24 -0.29 0.00 -0.03 0.00 0.00 54.58 54.46 1orw n ASN 74 Cb 0.57 -2.71 -0.09 0.00 -0.61 0.00 0.00 39.78 36.94 1orw n ASN 74 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1orw s ASN 75 N -2.86 4.62 -0.36 6.41 -0.87 -0.38 -3.66 114.94 117.85 1orw s ASN 75 Ca 0.00 -0.34 -0.12 0.00 -1.57 0.00 0.00 52.86 50.83 1orw s ASN 75 Cb 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 41.25 40.28 1orw s ASN 75 CO 0.00 0.16 0.22 -0.63 -2.57 0.00 0.00 177.10 174.28 1orw s ILE 76 N -1.34 4.95 0.11 0.60 1.01 -0.13 -0.05 121.20 126.36 1orw s ILE 76 Ca 0.24 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.41 1orw s ILE 76 Cb -0.11 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 1orw s ILE 76 CO 0.16 -0.11 0.16 -0.76 0.00 0.00 0.00 174.94 174.39 1orw s LEU 77 N 1.65 4.01 -0.30 2.97 1.43 0.12 -0.30 118.68 128.24 1orw s LEU 77 Ca 0.05 0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1orw s LEU 77 Cb -0.18 -2.63 0.05 0.00 0.03 0.00 0.00 46.19 43.45 1orw s LEU 77 CO 0.08 0.12 0.01 -0.22 0.23 0.00 0.00 176.35 176.58 1orw s LEU 78 N -2.75 3.94 0.42 1.79 2.96 0.48 -1.16 118.68 124.37 1orw s LEU 78 Ca 0.32 -1.25 0.01 0.00 -0.22 0.00 0.00 54.13 52.99 1orw s LEU 78 Cb -0.12 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.83 1orw s LEU 78 CO 0.25 -0.27 0.63 -0.36 -1.32 0.00 0.00 176.35 175.28 1orw s PHE 79 N 1.28 3.28 -0.18 5.38 0.08 -0.66 -1.33 117.98 125.83 1orw s PHE 79 Ca -0.05 0.23 0.01 0.00 0.12 0.00 0.00 56.93 57.24 1orw s PHE 79 Cb -0.20 -2.19 0.04 0.00 -0.57 0.00 0.00 43.02 40.10 1orw s PHE 79 CO -0.01 -0.22 -0.10 1.21 -0.10 0.00 0.00 175.22 176.00 1orw s ASN 80 N -4.17 3.18 0.84 1.36 3.84 -0.65 -3.10 114.94 116.24 1orw s ASN 80 Ca 0.46 -0.79 -0.13 0.00 0.21 0.00 0.00 52.86 52.62 1orw s ASN 80 Cb -0.10 -1.16 0.08 0.00 -0.55 0.00 0.00 41.25 39.51 1orw s ASN 80 CO 0.37 -0.14 1.04 0.00 -2.79 0.00 0.00 177.10 175.58 1orw n ALA 81 N 4.73 -0.61 0.00 1.71 0.00 0.83 0.49 120.51 127.67 1orw n ALA 81 Ca -0.14 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1orw n ALA 81 Cb 0.47 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.77 1orw n ALA 81 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1orw n GLU 82 N -3.03 0.00 -0.15 0.00 2.13 -1.26 -4.05 120.64 114.27 1orw n GLU 82 Ca 0.12 0.00 0.06 0.00 0.66 0.00 0.00 57.16 58.00 1orw n GLU 82 Cb 0.51 0.00 0.37 0.00 0.27 0.00 0.00 31.44 32.59 1orw n GLU 82 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 1orw h TYR 83 N 0.00 0.71 0.00 4.31 0.05 -1.95 -3.46 116.97 116.64 1orw h TYR 83 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1orw h TYR 83 Cb 0.00 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.50 1orw h TYR 83 CO 0.00 0.39 0.00 0.41 -1.05 0.00 0.00 178.16 177.91 1orw n GLY 84 N -1.46 2.36 3.65 3.88 0.00 0.18 -4.99 105.19 108.81 1orw n GLY 84 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1orw n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1orw s ASN 85 N -1.80 2.51 -0.01 1.61 4.22 -1.25 -4.70 114.94 115.53 1orw s ASN 85 Ca 0.00 1.39 -0.20 0.00 -2.14 0.00 0.00 52.86 51.92 1orw s ASN 85 Cb 0.00 -2.08 0.04 0.00 1.28 0.00 0.00 41.25 40.49 1orw s ASN 85 CO 0.00 -3.23 0.43 -0.94 -2.04 0.00 0.00 177.10 171.32 1orw s SER 86 N -3.21 -0.33 0.11 3.54 1.04 -1.26 -1.64 113.70 111.96 1orw s SER 86 Ca 0.65 0.24 0.07 0.00 0.48 0.00 0.00 55.95 57.39 1orw s SER 86 Cb -0.20 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.28 1orw s SER 86 CO 0.59 -0.53 -0.17 -0.94 0.98 0.00 0.00 173.24 173.16 1orw s SER 87 N -1.42 2.28 -0.04 7.02 1.04 -0.44 -4.94 113.70 117.20 1orw s SER 87 Ca -0.11 -0.74 -0.30 0.00 0.48 0.00 0.00 55.95 55.28 1orw s SER 87 Cb -0.03 -0.11 -0.06 0.00 0.10 0.00 0.00 66.02 65.92 1orw s SER 87 CO 0.05 -0.03 1.60 -0.63 0.98 0.00 0.00 173.24 175.20 1orw s ILE 88 N -1.59 3.57 -0.14 -1.02 1.01 -1.26 -0.38 121.20 121.39 1orw s ILE 88 Ca 0.07 0.78 0.15 0.00 0.00 0.00 0.00 60.65 61.65 1orw s ILE 88 Cb -0.08 -3.50 -0.24 0.00 0.01 0.00 0.00 42.46 38.65 1orw s ILE 88 CO 0.04 -0.05 0.30 0.33 0.00 0.00 0.00 174.94 175.56 1orw n PHE 89 N 6.69 0.40 -3.65 3.97 -0.00 0.58 -4.84 117.46 120.61 1orw n PHE 89 Ca 0.16 0.14 -0.02 0.00 -0.00 0.00 0.00 57.45 57.73 1orw n PHE 89 Cb 0.43 -1.07 -0.05 0.00 -0.00 0.00 0.00 39.48 38.78 1orw n PHE 89 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1orw s LEU 90 N -5.75 -1.07 0.22 -2.13 2.96 -0.43 -4.98 118.68 107.49 1orw s LEU 90 Ca -0.08 1.50 -0.30 0.00 -0.22 0.00 0.00 54.13 55.03 1orw s LEU 90 Cb 0.07 2.19 -0.08 0.00 0.50 0.00 0.00 46.19 48.87 1orw s LEU 90 CO 0.82 -0.22 1.07 -1.61 -1.32 0.00 0.00 176.35 175.09 1orw s GLU 91 N 2.80 4.66 0.29 1.98 2.02 -1.26 -0.95 118.70 128.23 1orw s GLU 91 Ca -0.06 1.69 0.14 0.00 0.02 0.00 0.00 54.97 56.77 1orw s GLU 91 Cb -0.12 -3.26 0.76 0.00 0.10 0.00 0.00 34.13 31.62 1orw s GLU 91 CO -0.18 0.20 1.35 0.27 0.02 0.00 0.00 175.26 176.91 1orw n ASN 92 N 1.89 0.36 0.16 -0.19 0.23 -1.24 0.42 115.26 116.90 1orw n ASN 92 Ca 0.01 0.59 0.13 0.00 -0.53 0.00 0.00 54.58 54.78 1orw n ASN 92 Cb 0.46 -0.58 0.53 0.00 -2.08 0.00 0.00 39.78 38.11 1orw n ASN 92 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1orw h SER 93 N 0.00 0.00 0.54 0.53 0.02 -1.91 -2.02 113.55 110.71 1orw h SER 93 Ca 0.00 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.76 1orw h SER 93 Cb 0.39 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1orw h SER 93 CO 0.00 0.00 -0.82 0.74 -1.14 0.00 0.00 176.83 175.61 1orw h THR 94 N 0.00 1.47 0.26 -2.27 2.02 -0.41 -3.24 112.91 110.74 1orw h THR 94 Ca 0.00 -2.50 -0.01 0.00 0.77 0.00 0.00 66.41 64.67 1orw h THR 94 Cb 0.41 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.20 1orw h THR 94 CO 0.00 0.73 -0.13 -0.26 0.37 0.00 0.00 175.52 176.23 1orw h PHE 95 N 0.12 -0.33 -0.29 3.16 0.04 -1.51 -3.28 116.94 114.86 1orw h PHE 95 Ca -0.04 -0.01 0.08 0.00 2.80 0.00 0.00 57.97 60.81 1orw h PHE 95 Cb 1.43 0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.68 1orw h PHE 95 CO 0.03 0.04 0.38 -0.44 -0.60 0.00 0.00 178.31 177.72 1orw h ASP 96 N -0.81 0.00 1.79 2.17 3.32 -1.62 0.19 116.42 121.46 1orw h ASP 96 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1orw h ASP 96 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1orw h ASP 96 CO 0.06 0.00 0.00 -0.33 -1.72 0.00 0.00 179.24 177.25 1orw h GLU 97 N 0.00 0.00 -6.66 3.56 5.08 -1.61 -3.44 114.58 111.51 1orw h GLU 97 Ca 0.14 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.99 1orw h GLU 97 Cb 0.90 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1orw h GLU 97 CO -0.00 0.00 0.39 -0.51 -1.00 0.00 0.00 179.01 177.89 1orw s LEU 98 N -5.80 4.54 -0.67 1.33 1.43 0.67 -4.95 118.68 115.24 1orw s LEU 98 Ca 0.07 1.94 -0.06 0.00 -1.03 0.00 0.00 54.13 55.06 1orw s LEU 98 Cb 0.07 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.63 1orw s LEU 98 CO 0.64 -0.04 3.01 0.61 0.23 0.00 0.00 176.35 180.80 1orw n GLY 99 N 1.91 4.06 3.58 -3.19 0.00 -1.26 -4.87 105.19 105.42 1orw n GLY 99 Ca 0.01 -1.64 0.02 0.00 0.00 0.00 0.00 46.02 44.42 1orw n GLY 99 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1orw s TYR 100 N -0.09 -0.01 -0.61 1.61 -0.85 -1.26 -5.11 117.35 111.03 1orw s TYR 100 Ca 0.62 -0.00 -0.25 0.00 -0.52 0.00 0.00 57.07 56.92 1orw s TYR 100 Cb 0.29 0.51 0.05 0.00 0.38 0.00 0.00 41.96 43.18 1orw s TYR 100 CO -0.10 -0.04 1.02 -1.12 -1.52 0.00 0.00 175.55 173.79 1orw s SER 101 N -2.80 6.28 -0.62 -0.18 0.01 -1.26 -4.98 113.70 110.16 1orw s SER 101 Ca 0.14 -0.48 -0.27 0.00 1.31 0.00 0.00 55.95 56.65 1orw s SER 101 Cb 0.06 -2.46 -0.00 0.00 0.21 0.00 0.00 66.02 63.83 1orw s SER 101 CO -0.06 -1.39 1.63 -0.89 0.41 0.00 0.00 173.24 172.95 1orw s THR 102 N 4.31 3.53 -0.38 1.44 2.01 -1.26 -4.47 115.64 120.82 1orw s THR 102 Ca 0.30 0.36 0.25 0.00 0.31 0.00 0.00 61.69 62.91 1orw s THR 102 Cb -0.13 -4.25 0.34 0.00 0.01 0.00 0.00 72.50 68.48 1orw s THR 102 CO 0.17 -1.15 1.67 -1.13 -0.69 0.00 0.00 174.62 173.49 1orw h ASN 103 N 12.92 0.00 -4.46 3.53 -0.73 -1.26 -3.48 115.58 122.10 1orw h ASN 103 Ca -0.27 0.00 0.05 0.00 1.87 0.00 0.00 56.30 57.95 1orw h ASN 103 Cb 1.12 0.00 -0.20 0.00 0.27 0.00 0.00 38.32 39.51 1orw h ASN 103 CO 1.21 0.00 0.44 -0.62 -0.37 0.00 0.00 177.43 178.10 1orw s ASP 104 N -6.02 -0.44 0.10 1.15 -1.08 -0.94 -5.00 116.67 104.44 1orw s ASP 104 Ca 0.06 0.37 0.03 0.00 -0.52 0.00 0.00 52.55 52.49 1orw s ASP 104 Cb 0.06 0.38 -0.04 0.00 -1.46 0.00 0.00 42.92 41.87 1orw s ASP 104 CO 0.64 -0.48 -0.09 -0.72 0.52 0.00 0.00 175.17 175.04 1orw s TYR 105 N -1.67 0.99 -0.13 -5.34 -0.85 -1.26 0.14 117.35 109.22 1orw s TYR 105 Ca -0.02 -0.75 -0.06 0.00 -0.52 0.00 0.00 57.07 55.72 1orw s TYR 105 Cb -0.00 -0.55 0.06 0.00 0.38 0.00 0.00 41.96 41.85 1orw s TYR 105 CO 0.01 -0.05 0.29 0.45 -1.52 0.00 0.00 175.55 174.73 1orw s SER 106 N -2.68 0.01 -0.06 -0.18 0.15 -0.53 -4.97 113.70 105.44 1orw s SER 106 Ca 0.08 0.65 -0.12 0.00 0.70 0.00 0.00 55.95 57.26 1orw s SER 106 Cb 0.00 0.70 -0.05 0.00 -1.71 0.00 0.00 66.02 64.96 1orw s SER 106 CO -0.02 -0.21 0.29 0.68 1.20 0.00 0.00 173.24 175.18 1orw s VAL 107 N 2.00 5.24 0.39 4.45 -7.23 -1.26 0.11 120.40 124.09 1orw s VAL 107 Ca -0.03 0.57 -0.27 0.00 -1.81 0.00 0.00 61.98 60.44 1orw s VAL 107 Cb -0.11 -3.58 -0.11 0.00 0.56 0.00 0.00 36.38 33.14 1orw s VAL 107 CO -0.09 0.57 1.33 -1.54 -0.31 0.00 0.00 175.10 175.06 1orw n SER 108 N 2.08 2.92 0.27 4.85 3.41 0.28 -4.84 113.62 122.59 1orw n SER 108 Ca -0.16 1.17 0.17 0.00 -0.26 0.00 0.00 58.87 59.79 1orw n SER 108 Cb 0.53 -1.52 0.90 0.00 -0.26 0.00 0.00 64.21 63.85 1orw n SER 108 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1orw h PRO 109 N 2.43 0.00 -0.38 4.33 0.13 -1.81 0.14 132.00 136.84 1orw h PRO 109 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1orw h PRO 109 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1orw h PRO 109 CO 0.62 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.99 1orw n ASP 110 N -2.72 2.16 -2.07 1.44 5.68 -0.92 -4.79 116.55 115.33 1orw n ASP 110 Ca -0.02 -1.96 -0.19 0.00 -0.50 0.00 0.00 54.79 52.13 1orw n ASP 110 Cb 0.14 -0.25 -0.04 0.00 -1.14 0.00 0.00 41.12 39.83 1orw n ASP 110 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1orw n ARG 111 N 0.67 -1.67 -0.03 0.11 3.00 0.49 -4.87 116.66 114.36 1orw n ARG 111 Ca 0.14 0.98 0.04 0.00 -0.01 0.00 0.00 57.85 59.00 1orw n ARG 111 Cb 0.35 -5.51 -0.15 0.00 0.00 0.00 0.00 32.46 27.15 1orw n ARG 111 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1orw n GLN 112 N -2.68 0.73 -4.17 5.56 6.02 -1.26 -4.88 117.38 116.70 1orw n GLN 112 Ca -0.21 -0.13 -0.11 0.00 -0.01 0.00 0.00 57.00 56.55 1orw n GLN 112 Cb 0.65 -1.46 -0.10 0.00 1.02 0.00 0.00 30.24 30.34 1orw n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1orw s PHE 113 N -3.07 0.92 -0.01 1.08 0.08 -1.26 -0.18 117.98 115.54 1orw s PHE 113 Ca -0.08 -1.03 0.01 0.00 0.12 0.00 0.00 56.93 55.95 1orw s PHE 113 Cb 0.10 -0.54 0.01 0.00 -0.57 0.00 0.00 43.02 42.02 1orw s PHE 113 CO 0.79 -0.28 -0.01 -1.50 -0.10 0.00 0.00 175.22 174.12 1orw s ILE 114 N -3.76 0.16 -0.07 0.64 2.07 -0.15 -0.56 121.20 119.52 1orw s ILE 114 Ca 0.17 -0.02 -0.14 0.00 -1.41 0.00 0.00 60.65 59.25 1orw s ILE 114 Cb 0.06 -0.18 -0.05 0.00 0.13 0.00 0.00 42.46 42.42 1orw s ILE 114 CO -0.02 0.08 0.35 -0.22 -1.91 0.00 0.00 174.94 173.23 1orw s LEU 115 N 0.35 4.39 -0.28 8.50 2.96 0.29 -0.26 118.68 134.63 1orw s LEU 115 Ca -0.03 0.77 -0.01 0.00 -0.22 0.00 0.00 54.13 54.64 1orw s LEU 115 Cb -0.06 -2.48 0.04 0.00 0.50 0.00 0.00 46.19 44.20 1orw s LEU 115 CO -0.01 0.25 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.87 1orw s PHE 116 N -0.51 3.19 -0.21 5.38 2.99 0.07 -1.46 117.98 127.43 1orw s PHE 116 Ca 0.21 -1.83 -0.21 0.00 0.00 0.00 0.00 56.93 55.10 1orw s PHE 116 Cb -0.15 -2.06 -0.02 0.00 0.00 0.00 0.00 43.02 40.79 1orw s PHE 116 CO 0.10 -0.79 0.65 -2.00 -0.00 0.00 0.00 175.22 173.18 1orw s GLU 117 N 1.25 4.20 0.12 0.44 2.12 0.37 -2.59 118.70 124.61 1orw s GLU 117 Ca -0.04 0.65 -0.08 0.00 0.36 0.00 0.00 54.97 55.85 1orw s GLU 117 Cb -0.19 -3.59 -0.01 0.00 0.26 0.00 0.00 34.13 30.60 1orw s GLU 117 CO -0.03 -0.29 0.21 1.52 -0.54 0.00 0.00 175.26 176.13 1orw s TYR 118 N 2.08 0.27 -0.60 5.30 1.13 -0.42 -0.65 117.35 124.46 1orw s TYR 118 Ca 0.29 -0.68 -0.01 0.00 -1.41 0.00 0.00 57.07 55.26 1orw s TYR 118 Cb -0.16 -0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.63 1orw s TYR 118 CO 0.10 -0.60 0.15 0.09 -2.51 0.00 0.00 175.55 172.78 1orw n ASN 119 N -0.11 -3.10 -4.70 -0.18 3.02 -1.26 0.31 115.26 109.24 1orw n ASN 119 Ca -0.12 -0.07 -0.43 0.00 -0.03 0.00 0.00 54.58 53.93 1orw n ASN 119 Cb 0.63 -2.15 -0.01 0.00 -0.61 0.00 0.00 39.78 37.64 1orw n ASN 119 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1orw n TYR 120 N -3.81 2.34 -3.38 3.10 9.36 -1.26 -4.37 117.16 119.15 1orw n TYR 120 Ca -0.06 0.51 -0.19 0.00 3.32 0.00 0.00 57.90 61.49 1orw n TYR 120 Cb 0.55 -2.44 -0.08 0.00 -0.63 0.00 0.00 39.34 36.74 1orw n TYR 120 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1orw s VAL 121 N -0.88 -0.26 0.38 2.97 1.01 -0.61 -5.00 120.40 118.01 1orw s VAL 121 Ca 0.58 -1.09 -0.25 0.00 0.00 0.00 0.00 61.98 61.21 1orw s VAL 121 Cb -0.57 -0.74 -0.12 0.00 0.00 0.00 0.00 36.38 34.95 1orw s VAL 121 CO 0.60 -0.65 1.00 1.17 0.00 0.00 0.00 175.10 177.22 1orw n LYS 122 N 4.23 1.35 0.00 2.72 4.81 -1.26 -2.51 118.16 127.49 1orw n LYS 122 Ca 0.11 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 1orw n LYS 122 Cb 0.44 -1.98 0.00 0.00 0.02 0.00 0.00 35.03 33.51 1orw n LYS 122 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1orw n GLN 123 N 0.34 0.00 0.00 1.64 7.27 -0.09 -4.89 117.38 121.65 1orw n GLN 123 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.16 1orw n GLN 123 Cb 0.37 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.02 1orw n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1orw n TRP 124 N 0.00 0.00 -0.22 3.69 5.03 -1.20 -4.94 117.44 119.80 1orw n TRP 124 Ca 0.00 0.00 -0.04 0.00 3.03 0.00 0.00 57.50 60.49 1orw n TRP 124 Cb 0.00 0.00 0.12 0.00 -1.03 0.00 0.00 31.31 30.40 1orw n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 1orw h ARG 125 N 0.00 1.03 0.00 -0.99 2.43 -1.99 -3.37 114.38 111.50 1orw h ARG 125 Ca 0.00 -0.20 -0.15 0.00 -0.81 0.00 0.00 59.98 58.82 1orw h ARG 125 Cb 0.00 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 1orw h ARG 125 CO 0.00 0.87 -1.54 0.72 -1.51 0.00 0.00 179.97 178.51 1orw n HIS 126 N -4.27 0.00 -1.23 2.20 8.25 -1.26 -5.06 115.22 113.84 1orw n HIS 126 Ca 0.06 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.18 1orw n HIS 126 Cb 0.21 -0.36 0.12 0.00 1.12 0.00 0.00 29.99 31.07 1orw n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1orw s SER 127 N -5.24 3.77 0.00 0.41 1.04 -1.26 -4.80 113.70 107.62 1orw s SER 127 Ca -0.13 2.42 0.00 0.00 0.48 0.00 0.00 55.95 58.72 1orw s SER 127 Cb 0.04 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1orw s SER 127 CO 0.20 -2.55 0.00 0.00 0.98 0.00 0.00 173.24 171.87 1orw n TYR 128 N -3.04 0.00 -4.24 5.02 0.18 -1.26 -0.91 117.16 112.91 1orw n TYR 128 Ca 0.14 0.00 -0.23 0.00 1.88 0.00 0.00 57.90 59.69 1orw n TYR 128 Cb 0.50 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.39 1orw n TYR 128 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1orw s THR 129 N -2.00 3.24 0.36 -3.48 -4.23 -1.05 -4.61 115.64 103.87 1orw s THR 129 Ca 0.00 -1.85 -0.10 0.00 -1.18 0.00 0.00 61.69 58.57 1orw s THR 129 Cb 0.00 -2.89 0.04 0.00 1.34 0.00 0.00 72.50 70.99 1orw s THR 129 CO 0.00 -0.29 0.64 0.00 -0.54 0.00 0.00 174.62 174.43 1orw n ALA 130 N -0.98 -1.19 -2.38 3.99 0.00 -0.31 -1.57 120.51 118.07 1orw n ALA 130 Ca -0.05 -1.31 -0.29 0.00 0.00 0.00 0.00 53.44 51.79 1orw n ALA 130 Cb 0.60 1.05 -0.13 0.00 0.00 0.00 0.00 19.45 20.96 1orw n ALA 130 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1orw s SER 131 N -2.97 3.31 0.04 0.00 0.01 0.15 -1.01 113.70 113.23 1orw s SER 131 Ca 0.19 -0.69 0.02 0.00 1.31 0.00 0.00 55.95 56.78 1orw s SER 131 Cb -0.03 -0.26 -0.02 0.00 0.21 0.00 0.00 66.02 65.92 1orw s SER 131 CO 0.14 0.20 -0.08 -0.31 0.41 0.00 0.00 173.24 173.60 1orw s TYR 132 N -0.99 0.71 -0.01 2.43 1.51 -1.26 -1.30 117.35 118.44 1orw s TYR 132 Ca 0.14 -0.49 0.04 0.00 -1.01 0.00 0.00 57.07 55.74 1orw s TYR 132 Cb -0.10 -0.42 -0.01 0.00 -0.11 0.00 0.00 41.96 41.32 1orw s TYR 132 CO 0.05 -0.07 -0.12 -0.51 -1.11 0.00 0.00 175.55 173.79 1orw s ASP 133 N -1.57 1.41 -0.16 2.29 1.01 -1.07 -4.28 116.67 114.30 1orw s ASP 133 Ca -0.09 -0.22 -0.06 0.00 0.71 0.00 0.00 52.55 52.89 1orw s ASP 133 Cb -0.10 -0.17 -0.04 0.00 1.01 0.00 0.00 42.92 43.62 1orw s ASP 133 CO 0.01 0.14 0.05 -0.63 0.21 0.00 0.00 175.17 174.95 1orw s ILE 134 N -0.25 4.67 -0.13 0.77 1.01 -1.26 -0.75 121.20 125.25 1orw s ILE 134 Ca 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 60.65 60.59 1orw s ILE 134 Cb -0.05 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.33 1orw s ILE 134 CO -0.00 0.50 -0.10 -0.47 0.00 0.00 0.00 174.94 174.87 1orw s TYR 135 N 0.06 2.88 -0.49 3.97 5.04 0.64 -1.53 117.35 127.93 1orw s TYR 135 Ca 0.05 -0.49 -0.25 0.00 -2.44 0.00 0.00 57.07 53.94 1orw s TYR 135 Cb -0.12 -1.87 0.03 0.00 0.35 0.00 0.00 41.96 40.35 1orw s TYR 135 CO 0.01 -0.12 0.90 0.34 -1.34 0.00 0.00 175.55 175.34 1orw s ASP 136 N 0.28 6.43 0.34 4.32 -1.08 -0.33 -0.98 116.67 125.65 1orw s ASP 136 Ca -0.07 -0.07 0.08 0.00 -0.52 0.00 0.00 52.55 51.97 1orw s ASP 136 Cb -0.15 -2.43 0.63 0.00 -1.46 0.00 0.00 42.92 39.50 1orw s ASP 136 CO 0.05 -1.08 1.82 -0.07 0.52 0.00 0.00 175.17 176.41 1orw h LEU 137 N 10.60 0.25 0.40 -1.34 3.38 -0.87 0.98 115.31 128.72 1orw h LEU 137 Ca -0.25 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1orw h LEU 137 Cb 1.08 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1orw h LEU 137 CO 1.03 0.51 -0.19 0.78 0.09 0.00 0.00 178.44 180.65 1orw h ASN 138 N 0.23 -0.46 -0.22 -0.43 2.35 -1.90 -3.19 115.58 111.95 1orw h ASN 138 Ca 0.04 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1orw h ASN 138 Cb 0.57 0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.06 1orw h ASN 138 CO 0.04 -0.02 0.00 2.29 -1.65 0.00 0.00 177.43 178.09 1orw n LYS 139 N -5.15 1.57 -4.38 0.81 2.85 -1.24 -4.92 118.16 107.70 1orw n LYS 139 Ca -0.09 -0.88 -0.36 0.00 -1.05 0.00 0.00 58.31 55.93 1orw n LYS 139 Cb 0.27 -1.24 -0.08 0.00 -0.65 0.00 0.00 35.03 33.33 1orw n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1orw n ARG 140 N 0.19 -1.18 -4.53 -1.58 1.74 0.31 -4.95 116.66 106.67 1orw n ARG 140 Ca 0.10 0.15 -0.28 0.00 -0.77 0.00 0.00 57.85 57.06 1orw n ARG 140 Cb 0.22 -4.20 -0.10 0.00 -1.02 0.00 0.00 32.46 27.36 1orw n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1orw s GLN 141 N -7.24 2.03 -0.52 5.56 -0.21 -1.04 -4.95 119.66 113.28 1orw s GLN 141 Ca 0.38 -2.08 -0.07 0.00 0.02 0.00 0.00 55.36 53.61 1orw s GLN 141 Cb -0.22 -1.70 0.13 0.00 1.00 0.00 0.00 33.01 32.22 1orw s GLN 141 CO 1.00 -0.09 0.37 -1.17 -2.12 0.00 0.00 175.29 173.27 1orw s LEU 142 N -3.77 5.59 -0.48 2.90 0.20 -1.26 -1.19 118.68 120.67 1orw s LEU 142 Ca 0.34 -2.21 -0.44 0.00 0.69 0.00 0.00 54.13 52.51 1orw s LEU 142 Cb 0.08 -1.95 -0.19 0.00 -0.43 0.00 0.00 46.19 43.70 1orw s LEU 142 CO 0.18 -0.58 2.04 -0.38 -0.29 0.00 0.00 176.35 177.32 1orw n ILE 143 N 4.45 0.02 -0.71 6.68 5.41 -0.59 -4.83 119.36 129.80 1orw n ILE 143 Ca -0.01 -0.02 0.08 0.00 1.00 0.00 0.00 62.75 63.80 1orw n ILE 143 Cb 0.41 -0.60 0.28 0.00 -0.71 0.00 0.00 39.64 39.02 1orw n ILE 143 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1orw n THR 144 N 6.09 1.95 -4.22 1.39 -2.24 -1.26 -4.54 114.28 111.44 1orw n THR 144 Ca 0.49 -1.46 -0.17 0.00 -2.27 0.00 0.00 64.05 60.65 1orw n THR 144 Cb -0.02 0.01 -0.14 0.00 -2.10 0.00 0.00 70.33 68.08 1orw n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1orw s GLU 145 N -2.17 0.55 -1.06 -0.78 -1.05 -1.26 -4.75 118.70 108.18 1orw s GLU 145 Ca 0.42 -0.32 -0.04 0.00 -0.15 0.00 0.00 54.97 54.87 1orw s GLU 145 Cb 0.30 -0.51 0.00 0.00 -0.44 0.00 0.00 34.13 33.48 1orw s GLU 145 CO 0.15 0.14 0.91 0.39 0.95 0.00 0.00 175.26 177.80 1orw n GLU 146 N 2.70 -6.10 -0.71 -4.83 -0.58 -1.26 -4.65 120.64 105.21 1orw n GLU 146 Ca -0.14 0.69 -0.29 0.00 -0.42 0.00 0.00 57.16 57.00 1orw n GLU 146 Cb 0.57 -5.27 0.23 0.00 -0.57 0.00 0.00 31.44 26.40 1orw n GLU 146 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1orw s ARG 147 N -5.69 -0.49 0.16 3.49 0.52 -1.26 -4.80 118.95 110.87 1orw s ARG 147 Ca 0.29 0.81 -0.26 0.00 -0.52 0.00 0.00 55.73 56.04 1orw s ARG 147 Cb -0.13 -1.61 -0.08 0.00 0.52 0.00 0.00 34.95 33.66 1orw s ARG 147 CO 0.60 -3.43 0.80 0.42 0.02 0.00 0.00 175.30 173.71 1orw s ILE 148 N -2.59 4.39 0.66 1.52 1.01 -1.26 -5.02 121.20 119.90 1orw s ILE 148 Ca 0.68 1.75 -0.15 0.00 0.00 0.00 0.00 60.65 62.92 1orw s ILE 148 Cb -0.23 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.08 1orw s ILE 148 CO 0.63 0.49 1.12 -2.84 0.00 0.00 0.00 174.94 174.34 1orw s PRO 149 N -0.96 2.76 0.33 2.79 0.02 -1.26 -4.58 135.00 134.10 1orw s PRO 149 Ca 0.37 1.45 -0.27 0.00 0.02 0.00 0.00 61.00 62.57 1orw s PRO 149 Cb -0.23 -1.94 -0.09 0.00 0.02 0.00 0.00 34.50 32.25 1orw s PRO 149 CO 0.27 -1.29 1.00 -0.80 -0.33 0.00 0.00 177.00 175.85 1orw s ASN 150 N -2.47 7.19 0.00 2.53 0.01 -1.26 -3.70 114.94 117.25 1orw s ASN 150 Ca 0.68 1.99 0.00 0.00 -0.71 0.00 0.00 52.86 54.82 1orw s ASN 150 Cb -0.22 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.85 1orw s ASN 150 CO 0.41 -0.18 0.00 0.59 -1.51 0.00 0.00 177.10 176.41 1orw n ASN 151 N 0.61 -1.61 -4.71 -1.22 3.02 -0.69 -5.01 115.26 105.64 1orw n ASN 151 Ca 0.02 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.16 1orw n ASN 151 Cb 0.49 -0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.21 1orw n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1orw s THR 152 N -2.76 4.97 0.11 3.41 2.01 -0.18 -4.56 115.64 118.63 1orw s THR 152 Ca 0.00 1.69 0.04 0.00 0.31 0.00 0.00 61.69 63.73 1orw s THR 152 Cb 0.00 -4.15 -0.23 0.00 0.01 0.00 0.00 72.50 68.13 1orw s THR 152 CO 0.00 0.19 1.24 1.56 -0.69 0.00 0.00 174.62 176.92 1orw h GLN 153 N 6.83 0.08 -1.48 4.92 4.20 -1.43 -0.82 115.11 127.41 1orw h GLN 153 Ca -0.40 -0.13 0.10 0.00 0.06 0.00 0.00 58.65 58.28 1orw h GLN 153 Cb 1.20 0.05 -0.26 0.00 0.30 0.00 0.00 27.48 28.76 1orw h GLN 153 CO 0.76 1.06 0.57 -0.46 -0.67 0.00 0.00 178.83 180.09 1orw s TRP 154 N -2.69 -0.36 0.06 2.96 -0.11 -1.21 -4.64 118.94 112.95 1orw s TRP 154 Ca -0.00 0.80 -0.05 0.00 1.22 0.00 0.00 56.10 58.07 1orw s TRP 154 Cb 0.09 0.41 -0.02 0.00 -1.50 0.00 0.00 33.47 32.46 1orw s TRP 154 CO 0.84 -0.22 0.08 -1.50 -4.62 0.00 0.00 176.95 171.53 1orw s ILE 155 N -0.23 0.16 -0.24 5.86 2.07 -1.26 0.03 121.20 127.59 1orw s ILE 155 Ca 0.03 -1.33 -0.27 0.00 -1.41 0.00 0.00 60.65 57.66 1orw s ILE 155 Cb -0.04 -1.20 0.14 0.00 0.13 0.00 0.00 42.46 41.49 1orw s ILE 155 CO -0.06 -0.74 1.10 0.28 -1.91 0.00 0.00 174.94 173.62 1orw s THR 156 N -3.35 0.00 0.62 4.00 -1.32 -0.58 -5.00 115.64 110.01 1orw s THR 156 Ca 0.01 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.37 1orw s THR 156 Cb 0.03 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.99 1orw s THR 156 CO -0.08 0.00 1.03 0.26 -2.21 0.00 0.00 174.62 173.62 1orw s TRP 157 N -0.44 3.48 0.62 9.09 0.52 -1.26 -2.04 118.94 128.91 1orw s TRP 157 Ca 0.02 1.35 -0.15 0.00 0.02 0.00 0.00 56.10 57.35 1orw s TRP 157 Cb -0.03 -2.77 -0.02 0.00 -1.15 0.00 0.00 33.47 29.50 1orw s TRP 157 CO -0.05 -0.76 1.07 -1.54 0.02 0.00 0.00 176.95 175.69 1orw s SER 158 N -3.87 5.59 0.62 2.95 1.04 -0.88 -4.90 113.70 114.24 1orw s SER 158 Ca 0.57 1.81 0.32 0.00 0.48 0.00 0.00 55.95 59.12 1orw s SER 158 Cb -0.12 -2.53 1.78 0.00 0.10 0.00 0.00 66.02 65.25 1orw s SER 158 CO 0.50 -1.30 2.11 -0.65 0.98 0.00 0.00 173.24 174.88 1orw h PRO 159 N 0.16 0.00 -4.82 4.02 0.11 -1.80 -3.43 132.00 126.24 1orw h PRO 159 Ca -0.46 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.37 1orw h PRO 159 Cb 1.22 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.19 1orw h PRO 159 CO 0.57 0.00 -0.69 0.14 -0.21 0.00 0.00 178.00 177.81 1orw s VAL 160 N -4.46 0.80 0.00 3.15 -7.23 -1.26 -4.77 120.40 106.63 1orw s VAL 160 Ca -0.04 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 1orw s VAL 160 Cb 0.14 -1.92 0.00 0.00 0.56 0.00 0.00 36.38 35.16 1orw s VAL 160 CO 0.48 -0.66 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 1orw n GLY 161 N -0.17 2.19 2.76 2.32 0.00 -1.26 -4.33 105.19 106.70 1orw n GLY 161 Ca -0.09 -0.48 -0.01 0.00 0.00 0.00 0.00 46.02 45.43 1orw n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1orw n HIS 162 N 13.29 -0.34 -1.80 1.61 1.44 -1.26 -2.17 115.22 125.99 1orw n HIS 162 Ca 0.00 -1.96 -0.30 0.00 -2.01 0.00 0.00 57.72 53.45 1orw n HIS 162 Cb 0.00 0.63 0.05 0.00 0.12 0.00 0.00 29.99 30.79 1orw n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1orw s LYS 163 N -1.92 2.71 0.02 -1.40 1.02 -1.26 -4.69 119.74 114.23 1orw s LYS 163 Ca 0.19 0.52 0.01 0.00 0.02 0.00 0.00 55.97 56.71 1orw s LYS 163 Cb 0.38 -2.00 -0.01 0.00 -0.52 0.00 0.00 37.83 35.68 1orw s LYS 163 CO -0.08 -1.15 -0.05 -0.51 -0.92 0.00 0.00 175.35 172.64 1orw s LEU 164 N -5.45 2.15 -0.03 3.17 1.43 0.12 -2.07 118.68 117.99 1orw s LEU 164 Ca 0.59 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 1orw s LEU 164 Cb -0.12 -0.13 0.01 0.00 0.03 0.00 0.00 46.19 45.99 1orw s LEU 164 CO 0.52 -0.11 -0.05 0.00 0.23 0.00 0.00 176.35 176.94 1orw s ALA 165 N -0.84 0.65 0.04 4.21 0.00 -0.87 -0.24 121.76 124.72 1orw s ALA 165 Ca -0.06 -0.13 -0.10 0.00 0.00 0.00 0.00 51.96 51.67 1orw s ALA 165 Cb -0.06 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.72 1orw s ALA 165 CO -0.00 0.04 0.20 1.52 0.00 0.00 0.00 175.76 177.53 1orw s TYR 166 N 0.58 0.04 -0.12 0.00 -0.85 0.02 -1.52 117.35 115.49 1orw s TYR 166 Ca -0.08 -0.23 -0.03 0.00 -0.52 0.00 0.00 57.07 56.21 1orw s TYR 166 Cb -0.11 -0.02 -0.03 0.00 0.38 0.00 0.00 41.96 42.18 1orw s TYR 166 CO 0.00 -0.42 -0.00 0.08 -1.52 0.00 0.00 175.55 173.69 1orw s VAL 167 N -2.45 4.25 -0.18 -3.49 1.01 0.10 -0.74 120.40 118.90 1orw s VAL 167 Ca -0.06 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 1orw s VAL 167 Cb -0.02 -2.83 0.08 0.00 0.00 0.00 0.00 36.38 33.61 1orw s VAL 167 CO -0.03 0.54 0.38 0.86 0.00 0.00 0.00 175.10 176.85 1orw s TRP 168 N -0.26 -0.67 -1.41 5.22 -0.00 -0.19 -1.25 118.94 120.37 1orw s TRP 168 Ca 0.06 1.35 -0.06 0.00 -0.00 0.00 0.00 56.10 57.45 1orw s TRP 168 Cb -0.12 0.23 0.01 0.00 -0.00 0.00 0.00 33.47 33.58 1orw s TRP 168 CO 0.02 -0.42 0.73 0.09 -0.00 0.00 0.00 176.95 177.37 1orw n ASN 169 N 5.11 -5.94 -1.64 5.86 5.03 -1.26 -1.94 115.26 120.49 1orw n ASN 169 Ca -0.12 -0.34 -0.18 0.00 0.87 0.00 0.00 54.58 54.82 1orw n ASN 169 Cb 0.51 -4.71 -0.05 0.00 -1.02 0.00 0.00 39.78 34.51 1orw n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1orw n ASN 170 N -2.38 -5.21 -4.37 6.41 5.03 -1.26 -4.46 115.26 109.02 1orw n ASN 170 Ca -0.07 0.28 -0.22 0.00 0.87 0.00 0.00 54.58 55.44 1orw n ASN 170 Cb 0.60 -4.29 -0.11 0.00 -1.02 0.00 0.00 39.78 34.96 1orw n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1orw s ASP 171 N -2.58 2.87 -0.16 6.41 1.01 -0.82 -2.11 116.67 121.29 1orw s ASP 171 Ca 0.00 -0.93 -0.07 0.00 0.71 0.00 0.00 52.55 52.25 1orw s ASP 171 Cb 0.00 -0.18 -0.04 0.00 1.01 0.00 0.00 42.92 43.70 1orw s ASP 171 CO 0.00 -0.05 0.09 -0.63 0.21 0.00 0.00 175.17 174.79 1orw s ILE 172 N -2.35 5.06 -0.03 0.77 1.01 -1.26 -1.02 121.20 123.38 1orw s ILE 172 Ca 0.20 0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.95 1orw s ILE 172 Cb -0.04 -3.26 -0.00 0.00 0.01 0.00 0.00 42.46 39.17 1orw s ILE 172 CO 0.08 0.51 -0.14 -0.31 0.00 0.00 0.00 174.94 175.08 1orw s TYR 173 N -0.09 1.42 -0.16 3.97 1.51 0.08 -0.13 117.35 123.95 1orw s TYR 173 Ca 0.08 -0.36 -0.00 0.00 -1.01 0.00 0.00 57.07 55.78 1orw s TYR 173 Cb -0.12 -0.96 -0.00 0.00 -0.11 0.00 0.00 41.96 40.77 1orw s TYR 173 CO 0.01 -0.11 -0.14 0.08 -1.11 0.00 0.00 175.55 174.27 1orw s VAL 174 N -0.01 2.74 -0.26 0.71 1.01 -0.90 -0.80 120.40 122.89 1orw s VAL 174 Ca -0.01 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1orw s VAL 174 Cb -0.09 -2.16 0.04 0.00 0.00 0.00 0.00 36.38 34.16 1orw s VAL 174 CO 0.01 0.51 -0.06 -0.54 0.00 0.00 0.00 175.10 175.03 1orw s LYS 175 N 0.80 2.66 -0.06 2.72 1.02 0.67 -0.52 119.74 127.03 1orw s LYS 175 Ca -0.05 -1.09 -0.27 0.00 0.02 0.00 0.00 55.97 54.58 1orw s LYS 175 Cb -0.15 -3.01 -0.22 0.00 -0.52 0.00 0.00 37.83 33.92 1orw s LYS 175 CO 0.00 -0.47 1.08 -0.91 -0.92 0.00 0.00 175.35 174.14 1orw h ASN 176 N 7.98 0.03 -4.11 2.83 -0.26 -1.84 0.35 115.58 120.55 1orw h ASN 176 Ca -0.28 -0.68 -0.69 0.00 -0.56 0.00 0.00 56.30 54.08 1orw h ASN 176 Cb 1.09 -0.01 -0.26 0.00 -1.06 0.00 0.00 38.32 38.08 1orw h ASN 176 CO 0.55 0.70 -0.81 -1.61 -1.06 0.00 0.00 177.43 175.21 1orw s GLU 177 N -3.49 2.49 0.50 0.81 0.41 -1.26 -4.18 118.70 113.99 1orw s GLU 177 Ca -0.17 -0.78 0.21 0.00 -0.41 0.00 0.00 54.97 53.83 1orw s GLU 177 Cb 0.00 -2.29 1.29 0.00 -1.78 0.00 0.00 34.13 31.34 1orw s GLU 177 CO 0.69 0.54 2.00 -1.35 -0.49 0.00 0.00 175.26 176.65 1orw h PRO 178 N 5.58 0.11 -0.69 0.39 0.11 -1.86 -1.67 132.00 133.98 1orw h PRO 178 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1orw h PRO 178 Cb 1.15 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1orw h PRO 178 CO 0.50 0.07 0.00 0.27 -0.21 0.00 0.00 178.00 178.63 1orw n ASN 179 N -4.42 3.69 -4.44 -2.05 6.94 -1.26 -4.81 115.26 108.90 1orw n ASN 179 Ca 0.09 -2.01 -0.27 0.00 -0.02 0.00 0.00 54.58 52.36 1orw n ASN 179 Cb 0.51 -0.46 -0.12 0.00 -2.36 0.00 0.00 39.78 37.35 1orw n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1orw s LEU 180 N -1.03 2.50 0.42 -4.53 2.01 -0.63 -4.80 118.68 112.63 1orw s LEU 180 Ca 0.46 -0.81 -0.23 0.00 0.01 0.00 0.00 54.13 53.56 1orw s LEU 180 Cb 0.24 -1.25 -0.11 0.00 0.01 0.00 0.00 46.19 45.08 1orw s LEU 180 CO 0.31 0.13 0.81 -1.20 1.01 0.00 0.00 176.35 177.41 1orw n SER 181 N 0.32 0.33 -4.89 2.29 7.64 -1.26 -4.73 113.62 113.31 1orw n SER 181 Ca -0.13 0.98 -0.29 0.00 1.01 0.00 0.00 58.87 60.45 1orw n SER 181 Cb 0.55 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 1orw n SER 181 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1orw s SER 182 N -0.85 6.27 -0.27 6.43 1.04 -1.26 -4.72 113.70 120.33 1orw s SER 182 Ca 0.64 1.09 -0.02 0.00 0.48 0.00 0.00 55.95 58.14 1orw s SER 182 Cb -0.58 -2.32 0.03 0.00 0.10 0.00 0.00 66.02 63.25 1orw s SER 182 CO 0.57 -0.66 -0.03 -1.58 0.98 0.00 0.00 173.24 172.52 1orw s GLN 183 N -4.83 2.69 0.33 4.02 2.00 0.32 -4.90 119.66 119.30 1orw s GLN 183 Ca 0.50 -1.08 -0.29 0.00 -2.00 0.00 0.00 55.36 52.49 1orw s GLN 183 Cb -0.10 -3.08 -0.12 0.00 0.80 0.00 0.00 33.01 30.51 1orw s GLN 183 CO 0.47 -0.49 1.47 0.54 -0.50 0.00 0.00 175.29 176.78 1orw n ARG 184 N 4.66 2.50 -0.06 1.67 1.74 -1.26 -2.12 116.66 123.80 1orw n ARG 184 Ca -0.15 0.88 -0.08 0.00 -0.77 0.00 0.00 57.85 57.73 1orw n ARG 184 Cb 0.46 -2.59 -0.06 0.00 -1.02 0.00 0.00 32.46 29.25 1orw n ARG 184 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1orw n ILE 185 N 1.03 0.71 -4.44 0.55 2.08 0.81 -4.94 119.36 115.16 1orw n ILE 185 Ca 0.05 -0.28 -0.23 0.00 0.56 0.00 0.00 62.75 62.85 1orw n ILE 185 Cb 0.37 -0.93 -0.10 0.00 -0.75 0.00 0.00 39.64 38.23 1orw n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1orw s THR 186 N -2.25 2.23 0.00 1.39 -4.23 -1.25 -4.95 115.64 106.59 1orw s THR 186 Ca -0.16 -2.33 0.00 0.00 -1.18 0.00 0.00 61.69 58.02 1orw s THR 186 Cb 0.04 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.62 1orw s THR 186 CO 0.29 -0.43 0.15 0.79 -0.54 0.00 0.00 174.62 174.88 1orw n TRP 187 N -0.57 0.00 0.37 3.99 7.02 -1.26 -4.58 117.44 122.41 1orw n TRP 187 Ca -0.06 -0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.54 1orw n TRP 187 Cb 0.60 -0.00 0.23 0.00 -2.42 0.00 0.00 31.31 29.73 1orw n TRP 187 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 1orw h THR 188 N 0.76 0.00 -1.04 -0.99 1.35 -1.96 -3.47 112.91 107.55 1orw h THR 188 Ca 0.00 -0.79 -0.73 0.00 -0.55 0.00 0.00 66.41 64.34 1orw h THR 188 Cb 0.37 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 1orw h THR 188 CO 0.00 0.00 1.15 0.61 -0.25 0.00 0.00 175.52 177.03 1orw n GLY 189 N 1.20 0.49 2.78 5.82 0.00 -1.25 -4.77 105.19 109.46 1orw n GLY 189 Ca 0.04 0.98 -0.15 0.00 0.00 0.00 0.00 46.02 46.88 1orw n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1orw s LYS 190 N 4.91 0.02 0.12 1.61 2.20 -0.88 -4.84 119.74 122.89 1orw s LYS 190 Ca 1.07 0.16 -0.35 0.00 -0.36 0.00 0.00 55.97 56.49 1orw s LYS 190 Cb -1.12 -0.29 -0.16 0.00 -1.51 0.00 0.00 37.83 34.76 1orw s LYS 190 CO 0.61 -0.16 1.35 -1.91 -0.36 0.00 0.00 175.35 174.89 1orw n GLU 191 N 4.15 1.35 -2.19 4.03 2.13 -1.26 -0.63 120.64 128.22 1orw n GLU 191 Ca -0.27 0.49 -0.19 0.00 0.66 0.00 0.00 57.16 57.84 1orw n GLU 191 Cb 0.50 -2.13 -0.03 0.00 0.27 0.00 0.00 31.44 30.06 1orw n GLU 191 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1orw n ASN 192 N 2.57 -5.43 0.00 4.31 5.03 -1.26 -4.69 115.26 115.78 1orw n ASN 192 Ca 0.17 0.14 0.00 0.00 0.87 0.00 0.00 54.58 55.76 1orw n ASN 192 Cb 0.22 -4.61 0.00 0.00 -1.02 0.00 0.00 39.78 34.37 1orw n ASN 192 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 1orw n VAL 193 N -3.48 0.00 -3.77 2.41 3.14 -0.85 -4.73 118.33 111.05 1orw n VAL 193 Ca -0.22 0.00 -0.26 0.00 -2.96 0.00 0.00 64.34 60.90 1orw n VAL 193 Cb 0.66 0.00 -0.17 0.00 -1.06 0.00 0.00 33.84 33.27 1orw n VAL 193 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1orw s ILE 194 N -1.00 0.53 -0.17 1.55 -1.09 0.19 -0.09 121.20 121.12 1orw s ILE 194 Ca 0.00 -0.24 -0.01 0.00 -2.23 0.00 0.00 60.65 58.17 1orw s ILE 194 Cb 0.00 -0.83 -0.01 0.00 -1.58 0.00 0.00 42.46 40.05 1orw s ILE 194 CO 0.00 0.06 -0.11 -0.31 -1.23 0.00 0.00 174.94 173.35 1orw s TYR 195 N 1.89 2.86 -0.28 3.97 1.51 -0.08 -2.07 117.35 125.15 1orw s TYR 195 Ca 0.02 -0.92 -0.04 0.00 -1.01 0.00 0.00 57.07 55.12 1orw s TYR 195 Cb -0.14 -1.96 0.02 0.00 -0.11 0.00 0.00 41.96 39.77 1orw s TYR 195 CO -0.07 -0.44 0.02 -0.80 -1.11 0.00 0.00 175.55 173.16 1orw s ASN 196 N 0.94 4.83 0.00 2.29 0.01 -0.90 0.04 114.94 122.15 1orw s ASN 196 Ca -0.02 -0.88 0.00 0.00 -0.71 0.00 0.00 52.86 51.25 1orw s ASN 196 Cb -0.15 -1.78 0.00 0.00 0.41 0.00 0.00 41.25 39.73 1orw s ASN 196 CO -0.01 -0.19 0.00 0.61 -1.51 0.00 0.00 177.10 176.00 1orw n GLY 197 N 4.76 0.84 3.04 0.66 0.00 -0.84 -4.27 105.19 109.38 1orw n GLY 197 Ca -0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1orw n GLY 197 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1orw s VAL 198 N -3.30 0.03 0.80 1.61 -7.23 -1.26 -0.29 120.40 110.75 1orw s VAL 198 Ca 0.00 -0.28 -0.11 0.00 -1.81 0.00 0.00 61.98 59.79 1orw s VAL 198 Cb 0.00 -0.27 0.07 0.00 0.56 0.00 0.00 36.38 36.74 1orw s VAL 198 CO 0.00 -0.15 1.09 0.42 -0.31 0.00 0.00 175.10 176.15 1orw s THR 199 N -0.48 3.21 0.34 5.32 -4.23 -0.43 -4.74 115.64 114.63 1orw s THR 199 Ca -0.06 0.39 -0.00 0.00 -1.18 0.00 0.00 61.69 60.84 1orw s THR 199 Cb -0.04 -2.90 0.07 0.00 1.34 0.00 0.00 72.50 70.97 1orw s THR 199 CO 0.00 -0.51 0.46 -0.90 -0.54 0.00 0.00 174.62 173.13 1orw n ASP 200 N -3.58 0.60 -0.05 3.99 5.75 -1.26 -4.81 116.55 117.20 1orw n ASP 200 Ca 0.08 -1.51 -0.08 0.00 -0.01 0.00 0.00 54.79 53.27 1orw n ASP 200 Cb 0.54 -0.30 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 1orw n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1orw h TRP 201 N -0.50 -0.12 -0.02 2.11 7.01 -1.99 -2.00 115.95 120.44 1orw h TRP 201 Ca -0.15 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 60.73 1orw h TRP 201 Cb 0.56 0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.69 1orw h TRP 201 CO 0.00 -0.10 -0.61 -0.24 -2.79 0.00 0.00 178.44 174.71 1orw h VAL 202 N -0.01 1.42 -0.01 2.65 3.04 -1.95 -2.12 116.25 119.27 1orw h VAL 202 Ca 0.11 -2.05 -0.21 0.00 -1.01 0.00 0.00 66.70 63.53 1orw h VAL 202 Cb 0.17 2.09 -0.00 0.00 -2.01 0.00 0.00 31.29 31.53 1orw h VAL 202 CO -0.23 0.59 -0.90 1.88 -1.01 0.00 0.00 177.57 177.91 1orw h TYR 203 N 0.05 0.56 0.60 3.17 -1.99 -1.91 -0.28 116.97 117.17 1orw h TYR 203 Ca -0.01 -0.30 -0.03 0.00 2.00 0.00 0.00 58.73 60.40 1orw h TYR 203 Cb 1.08 -0.07 0.01 0.00 2.00 0.00 0.00 36.73 39.75 1orw h TYR 203 CO 0.01 1.10 -0.29 1.49 -0.00 0.00 0.00 178.16 180.47 1orw h GLU 204 N 0.22 -0.77 -0.07 4.88 4.81 -1.29 0.36 114.58 122.72 1orw h GLU 204 Ca -0.07 0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1orw h GLU 204 Cb 1.52 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 31.08 1orw h GLU 204 CO 0.15 -0.50 -0.11 1.49 -0.73 0.00 0.00 179.01 179.32 1orw h GLU 205 N -0.85 0.20 0.00 1.92 4.57 -1.44 -0.87 114.58 118.11 1orw h GLU 205 Ca -0.08 -0.12 -0.32 0.00 -1.18 0.00 0.00 59.36 57.66 1orw h GLU 205 Cb 0.63 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.18 1orw h GLU 205 CO 0.13 0.68 -2.01 0.39 -1.18 0.00 0.00 179.01 177.02 1orw n GLU 206 N -4.66 0.66 -0.05 1.92 -0.58 -0.12 -4.49 120.64 113.33 1orw n GLU 206 Ca -0.08 0.15 -0.08 0.00 -0.42 0.00 0.00 57.16 56.74 1orw n GLU 206 Cb 0.34 -1.67 -0.04 0.00 -0.57 0.00 0.00 31.44 29.50 1orw n GLU 206 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1orw n VAL 207 N -2.90 0.58 0.45 2.62 0.24 -0.78 -4.81 118.33 113.73 1orw n VAL 207 Ca -0.24 -0.21 0.11 0.00 -2.04 0.00 0.00 64.34 61.96 1orw n VAL 207 Cb 1.09 -1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 32.34 1orw n VAL 207 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1orw n PHE 208 N -2.94 0.11 -3.94 6.34 3.72 0.12 -4.96 117.46 115.91 1orw n PHE 208 Ca -0.19 0.03 -0.32 0.00 -0.05 0.00 0.00 57.45 56.93 1orw n PHE 208 Cb 0.68 -0.36 -0.01 0.00 -0.94 0.00 0.00 39.48 38.85 1orw n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1orw n SER 209 N -1.97 -3.65 -3.63 4.37 7.64 -0.35 -4.88 113.62 111.16 1orw n SER 209 Ca 0.00 -0.80 -0.07 0.00 1.01 0.00 0.00 58.87 59.01 1orw n SER 209 Cb 0.46 -2.98 -0.02 0.00 -1.01 0.00 0.00 64.21 60.66 1orw n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1orw s ALA 210 N -3.17 -1.64 -0.39 -0.43 0.00 -1.12 -4.97 121.76 110.04 1orw s ALA 210 Ca 0.64 0.42 0.21 0.00 0.00 0.00 0.00 51.96 53.23 1orw s ALA 210 Cb -0.34 0.64 -0.29 0.00 0.00 0.00 0.00 23.12 23.13 1orw s ALA 210 CO 0.79 -0.88 0.62 0.98 0.00 0.00 0.00 175.76 177.27 1orw n TYR 211 N -0.38 0.00 -3.15 0.00 9.36 -1.26 -4.09 117.16 117.64 1orw n TYR 211 Ca -0.09 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.75 1orw n TYR 211 Cb 0.62 -0.29 -0.06 0.00 -0.63 0.00 0.00 39.34 38.97 1orw n TYR 211 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 1orw s SER 212 N -3.84 7.18 -0.33 2.98 1.04 -1.26 -1.31 113.70 118.16 1orw s SER 212 Ca -0.02 1.42 0.16 0.00 0.48 0.00 0.00 55.95 57.99 1orw s SER 212 Cb 0.14 -2.42 0.46 0.00 0.10 0.00 0.00 66.02 64.31 1orw s SER 212 CO 0.86 0.21 1.03 0.00 0.98 0.00 0.00 173.24 176.32 1orw n ALA 213 N 1.51 3.68 -2.63 5.32 0.00 0.60 -4.63 120.51 124.36 1orw n ALA 213 Ca -0.07 -3.33 -0.21 0.00 0.00 0.00 0.00 53.44 49.83 1orw n ALA 213 Cb 0.50 -0.81 -0.12 0.00 0.00 0.00 0.00 19.45 19.01 1orw n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1orw s LEU 214 N -3.36 2.26 -0.29 0.00 1.43 -1.24 -1.99 118.68 115.49 1orw s LEU 214 Ca 0.33 -0.61 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 1orw s LEU 214 Cb 0.42 -0.68 0.17 0.00 0.03 0.00 0.00 46.19 46.13 1orw s LEU 214 CO -0.02 -0.00 0.48 0.26 0.23 0.00 0.00 176.35 177.30 1orw s TRP 215 N -1.15 -1.33 0.60 0.29 0.51 0.10 -4.96 118.94 113.01 1orw s TRP 215 Ca 0.02 0.64 -0.18 0.00 -2.12 0.00 0.00 56.10 54.46 1orw s TRP 215 Cb -0.10 0.03 -0.03 0.00 -0.81 0.00 0.00 33.47 32.57 1orw s TRP 215 CO 0.03 -1.02 1.17 -1.58 -0.51 0.00 0.00 176.95 175.04 1orw s TRP 216 N 2.65 2.49 0.61 -1.98 0.52 -1.26 -1.11 118.94 120.86 1orw s TRP 216 Ca 0.10 1.54 -0.11 0.00 0.02 0.00 0.00 56.10 57.65 1orw s TRP 216 Cb -0.12 -3.37 -0.04 0.00 -1.15 0.00 0.00 33.47 28.80 1orw s TRP 216 CO -0.28 -1.95 1.01 -1.54 0.02 0.00 0.00 176.95 174.21 1orw s SER 217 N -1.84 6.24 0.30 2.95 1.04 -0.58 -4.89 113.70 116.91 1orw s SER 217 Ca 0.74 1.38 0.00 0.00 0.48 0.00 0.00 55.95 58.56 1orw s SER 217 Cb -0.26 -2.45 0.70 0.00 0.10 0.00 0.00 66.02 64.11 1orw s SER 217 CO 0.33 -0.84 1.59 -0.65 0.98 0.00 0.00 173.24 174.65 1orw h PRO 218 N -0.25 0.04 -0.64 4.02 0.11 -1.92 0.25 132.00 133.61 1orw h PRO 218 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1orw h PRO 218 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1orw h PRO 218 CO 0.62 0.03 0.00 0.09 -0.21 0.00 0.00 178.00 178.53 1orw n ASN 219 N -5.44 5.08 -0.98 -2.05 3.02 -1.26 -4.38 115.26 109.25 1orw n ASN 219 Ca 0.22 -2.58 -0.13 0.00 -0.03 0.00 0.00 54.58 52.06 1orw n ASN 219 Cb 0.71 -0.62 -0.05 0.00 -0.61 0.00 0.00 39.78 39.21 1orw n ASN 219 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1orw n GLY 220 N 1.03 1.31 0.15 7.41 0.00 0.88 -4.87 105.19 111.10 1orw n GLY 220 Ca 0.27 -0.23 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 1orw n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1orw h THR 221 N 0.00 0.79 -2.47 2.61 2.02 -1.92 -3.46 112.91 110.49 1orw h THR 221 Ca -0.26 -0.99 -0.48 0.00 0.77 0.00 0.00 66.41 65.45 1orw h THR 221 Cb 0.97 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 1orw h THR 221 CO 0.38 0.19 -0.36 -0.36 0.37 0.00 0.00 175.52 175.74 1orw s PHE 222 N -3.71 3.47 -0.38 3.16 0.08 -1.26 -1.76 117.98 117.58 1orw s PHE 222 Ca -0.13 0.14 0.01 0.00 0.12 0.00 0.00 56.93 57.06 1orw s PHE 222 Cb 0.01 -1.70 0.13 0.00 -0.57 0.00 0.00 43.02 40.89 1orw s PHE 222 CO 0.49 0.35 0.20 -1.17 -0.10 0.00 0.00 175.22 174.99 1orw s LEU 223 N -3.92 2.07 0.37 -0.37 2.96 -0.04 -1.52 118.68 118.23 1orw s LEU 223 Ca 0.36 -2.26 -0.25 0.00 -0.22 0.00 0.00 54.13 51.76 1orw s LEU 223 Cb -0.10 -0.81 -0.09 0.00 0.50 0.00 0.00 46.19 45.69 1orw s LEU 223 CO 0.31 -0.31 1.01 0.00 -1.32 0.00 0.00 176.35 176.03 1orw s ALA 224 N 0.86 3.13 -0.08 5.97 0.00 -0.27 -2.66 121.76 128.72 1orw s ALA 224 Ca 0.16 0.62 -0.27 0.00 0.00 0.00 0.00 51.96 52.47 1orw s ALA 224 Cb -0.22 -3.23 0.06 0.00 0.00 0.00 0.00 23.12 19.72 1orw s ALA 224 CO -0.06 -0.05 0.62 1.52 0.00 0.00 0.00 175.76 177.79 1orw s TYR 225 N -1.68 -0.59 0.06 0.00 1.13 0.69 0.02 117.35 116.97 1orw s TYR 225 Ca 0.55 1.09 0.01 0.00 -1.41 0.00 0.00 57.07 57.32 1orw s TYR 225 Cb -0.20 0.33 -0.04 0.00 -1.10 0.00 0.00 41.96 40.95 1orw s TYR 225 CO 0.25 -0.53 0.14 0.00 -2.51 0.00 0.00 175.55 172.90 1orw s ALA 226 N -0.96 3.78 -0.09 9.51 0.00 -0.84 -0.63 121.76 132.53 1orw s ALA 226 Ca -0.10 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 50.98 1orw s ALA 226 Cb -0.02 -1.64 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 1orw s ALA 226 CO 0.08 0.78 -0.17 -1.14 0.00 0.00 0.00 175.76 175.30 1orw s GLN 227 N -2.36 2.89 -0.15 0.00 0.74 0.55 -1.98 119.66 119.35 1orw s GLN 227 Ca 0.31 -0.76 -0.01 0.00 0.05 0.00 0.00 55.36 54.96 1orw s GLN 227 Cb -0.13 -2.42 -0.01 0.00 1.10 0.00 0.00 33.01 31.56 1orw s GLN 227 CO 0.24 0.38 -0.12 -0.06 -0.55 0.00 0.00 175.29 175.17 1orw s PHE 228 N -0.11 2.83 -0.31 1.67 0.08 0.11 -1.74 117.98 120.50 1orw s PHE 228 Ca -0.03 -0.78 -0.06 0.00 0.12 0.00 0.00 56.93 56.19 1orw s PHE 228 Cb -0.14 -1.89 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 1orw s PHE 228 CO 0.04 -0.32 0.07 1.21 -0.10 0.00 0.00 175.22 176.12 1orw s ASN 229 N 0.61 5.11 0.00 1.36 3.84 -0.51 -0.90 114.94 124.45 1orw s ASN 229 Ca -0.07 -0.93 0.21 0.00 0.21 0.00 0.00 52.86 52.27 1orw s ASN 229 Cb -0.15 -1.84 0.37 0.00 -0.55 0.00 0.00 41.25 39.07 1orw s ASN 229 CO 0.03 -0.24 1.32 0.47 -2.79 0.00 0.00 177.10 175.89 1orw n ASP 230 N 4.81 3.24 -0.29 -4.21 9.92 0.88 -1.04 116.55 129.86 1orw n ASP 230 Ca -0.14 -1.94 0.01 0.00 -0.53 0.00 0.00 54.79 52.19 1orw n ASP 230 Cb 0.46 -0.21 0.05 0.00 -0.64 0.00 0.00 41.12 40.78 1orw n ASP 230 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1orw n THR 231 N 1.30 -0.38 -0.33 -3.53 -1.04 -1.24 -0.67 114.28 108.39 1orw n THR 231 Ca 0.17 1.78 0.08 0.00 -2.04 0.00 0.00 64.05 64.04 1orw n THR 231 Cb 0.56 -2.38 0.31 0.00 -1.82 0.00 0.00 70.33 67.00 1orw n THR 231 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1orw n GLU 232 N -5.16 3.46 -3.17 -2.82 1.02 -1.26 -4.91 120.64 107.80 1orw n GLU 232 Ca 0.09 -2.49 -0.39 0.00 -0.02 0.00 0.00 57.16 54.35 1orw n GLU 232 Cb 0.33 -1.85 -0.05 0.00 -0.02 0.00 0.00 31.44 29.84 1orw n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1orw s VAL 233 N -1.88 5.10 0.91 2.62 1.01 0.16 -4.61 120.40 123.71 1orw s VAL 233 Ca 0.44 1.19 -0.10 0.00 0.00 0.00 0.00 61.98 63.52 1orw s VAL 233 Cb 0.29 -3.93 0.14 0.00 0.00 0.00 0.00 36.38 32.89 1orw s VAL 233 CO 0.20 0.26 1.13 -2.84 0.00 0.00 0.00 175.10 173.85 1orw s PRO 234 N 0.94 1.03 -0.13 2.72 0.02 -1.26 -4.71 135.00 133.60 1orw s PRO 234 Ca 0.31 1.43 -0.04 0.00 0.02 0.00 0.00 61.00 62.72 1orw s PRO 234 Cb -0.16 -1.74 -0.03 0.00 0.02 0.00 0.00 34.50 32.59 1orw s PRO 234 CO 0.13 -2.58 0.02 -0.51 -0.33 0.00 0.00 177.00 173.73 1orw s LEU 235 N -6.56 3.61 -0.06 -5.54 1.43 -1.26 -1.46 118.68 108.84 1orw s LEU 235 Ca 0.66 0.08 -0.18 0.00 -1.03 0.00 0.00 54.13 53.66 1orw s LEU 235 Cb -0.22 -1.87 -0.05 0.00 0.03 0.00 0.00 46.19 44.08 1orw s LEU 235 CO 0.58 0.27 0.48 -0.51 0.23 0.00 0.00 176.35 177.40 1orw s ILE 236 N -0.21 5.08 -0.05 -0.59 1.10 -0.23 -4.91 121.20 121.40 1orw s ILE 236 Ca 0.06 0.97 0.04 0.00 -0.51 0.00 0.00 60.65 61.21 1orw s ILE 236 Cb -0.12 -3.81 -0.00 0.00 0.15 0.00 0.00 42.46 38.68 1orw s ILE 236 CO 0.02 0.42 -0.17 -1.61 -2.11 0.00 0.00 174.94 171.49 1orw s GLU 237 N -0.03 1.79 0.18 3.50 2.02 -1.26 -2.01 118.70 122.88 1orw s GLU 237 Ca 0.26 -0.59 -0.08 0.00 0.02 0.00 0.00 54.97 54.58 1orw s GLU 237 Cb -0.16 -1.54 -0.01 0.00 0.10 0.00 0.00 34.13 32.52 1orw s GLU 237 CO 0.12 0.22 0.28 1.52 0.02 0.00 0.00 175.26 177.42 1orw s TYR 238 N 0.11 0.50 0.04 1.61 1.13 -0.90 -5.00 117.35 114.84 1orw s TYR 238 Ca -0.05 -0.85 -0.10 0.00 -1.41 0.00 0.00 57.07 54.66 1orw s TYR 238 Cb -0.12 -0.10 -0.05 0.00 -1.10 0.00 0.00 41.96 40.59 1orw s TYR 238 CO 0.02 -0.74 0.36 -1.12 -2.51 0.00 0.00 175.55 171.56 1orw s SER 239 N -3.00 6.62 -0.14 -0.18 0.01 -1.26 -1.17 113.70 114.57 1orw s SER 239 Ca 0.21 0.75 0.00 0.00 1.31 0.00 0.00 55.95 58.22 1orw s SER 239 Cb 0.03 -2.16 0.02 0.00 0.21 0.00 0.00 66.02 64.12 1orw s SER 239 CO 0.03 0.22 -0.13 0.12 0.41 0.00 0.00 173.24 173.89 1orw s PHE 240 N -1.31 2.06 0.01 2.43 5.36 -0.08 -4.62 117.98 121.82 1orw s PHE 240 Ca 0.30 -1.15 0.02 0.00 -0.96 0.00 0.00 56.93 55.14 1orw s PHE 240 Cb -0.14 -1.54 -0.25 0.00 -0.34 0.00 0.00 43.02 40.75 1orw s PHE 240 CO 0.16 -0.65 0.88 1.88 -1.46 0.00 0.00 175.22 176.04 1orw h TYR 241 N 8.07 0.27 -1.22 10.12 -1.99 -1.96 -0.52 116.97 129.74 1orw h TYR 241 Ca -0.37 -0.19 0.00 0.00 2.00 0.00 0.00 58.73 60.17 1orw h TYR 241 Cb 1.13 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.85 1orw h TYR 241 CO 0.47 1.24 0.00 0.45 -0.00 0.00 0.00 178.16 180.32 1orw n SER 242 N -3.34 -3.67 -4.75 3.88 2.88 -1.26 -4.75 113.62 102.61 1orw n SER 242 Ca -0.14 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.02 1orw n SER 242 Cb 1.02 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.53 1orw n SER 242 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1orw s ASP 243 N -4.00 5.28 0.35 -3.46 -1.08 -1.26 -4.87 116.67 107.62 1orw s ASP 243 Ca 0.00 2.80 0.16 0.00 -0.52 0.00 0.00 52.55 55.00 1orw s ASP 243 Cb 0.00 -2.64 1.19 0.00 -1.46 0.00 0.00 42.92 40.01 1orw s ASP 243 CO 0.00 -1.57 1.59 -0.08 0.52 0.00 0.00 175.17 175.63 1orw h GLU 244 N 1.51 0.06 0.00 4.34 4.81 -2.05 0.21 114.58 123.46 1orw h GLU 244 Ca -0.51 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1orw h GLU 244 Cb 1.30 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 1orw h GLU 244 CO 0.57 0.04 -0.00 0.66 -0.73 0.00 0.00 179.01 179.55 1orw h SER 245 N 0.06 0.00 -2.16 1.04 4.64 -1.94 -3.41 113.55 111.78 1orw h SER 245 Ca 0.78 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 61.58 1orw h SER 245 Cb 1.95 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.01 1orw h SER 245 CO -0.77 0.00 1.34 -0.22 -0.87 0.00 0.00 176.83 176.31 1orw s LEU 246 N -6.30 3.35 0.21 5.97 0.20 0.73 -4.88 118.68 117.97 1orw s LEU 246 Ca -0.05 0.59 -0.09 0.00 0.69 0.00 0.00 54.13 55.27 1orw s LEU 246 Cb 0.13 -2.77 0.23 0.00 -0.43 0.00 0.00 46.19 43.35 1orw s LEU 246 CO 0.42 -2.23 1.83 -0.61 -0.29 0.00 0.00 176.35 175.48 1orw h GLN 247 N 14.57 0.77 -6.28 1.98 4.15 -1.88 -3.41 115.11 125.01 1orw h GLN 247 Ca -0.28 -0.05 -0.69 0.00 0.77 0.00 0.00 58.65 58.41 1orw h GLN 247 Cb 1.17 -0.17 -0.23 0.00 0.21 0.00 0.00 27.48 28.45 1orw h GLN 247 CO 1.17 0.51 -0.77 0.71 -1.93 0.00 0.00 178.83 178.53 1orw s TYR 248 N -6.10 2.72 0.73 3.99 1.51 -1.26 -5.11 117.35 113.82 1orw s TYR 248 Ca -0.13 -0.17 -0.13 0.00 -1.01 0.00 0.00 57.07 55.63 1orw s TYR 248 Cb 0.16 -1.64 0.04 0.00 -0.11 0.00 0.00 41.96 40.40 1orw s TYR 248 CO 0.77 0.18 1.12 -2.14 -1.11 0.00 0.00 175.55 174.37 1orw s PRO 249 N -0.69 2.37 -0.15 -1.71 0.02 -1.26 -5.01 135.00 128.56 1orw s PRO 249 Ca 0.11 1.39 -0.09 0.00 0.02 0.00 0.00 61.00 62.42 1orw s PRO 249 Cb -0.11 -1.90 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 1orw s PRO 249 CO 0.01 -1.59 0.15 0.21 -0.33 0.00 0.00 177.00 175.45 1orw s LYS 250 N -4.38 3.78 -0.42 5.54 2.20 -0.20 -4.95 119.74 121.31 1orw s LYS 250 Ca 0.66 -0.15 -0.18 0.00 -0.36 0.00 0.00 55.97 55.94 1orw s LYS 250 Cb -0.21 -3.29 0.02 0.00 -1.51 0.00 0.00 37.83 32.84 1orw s LYS 250 CO 0.48 0.56 0.50 0.99 -0.36 0.00 0.00 175.35 177.52 1orw s THR 251 N -0.41 5.01 0.06 3.43 2.01 -1.26 -0.91 115.64 123.57 1orw s THR 251 Ca 0.12 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.67 1orw s THR 251 Cb -0.12 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.28 1orw s THR 251 CO 0.02 -0.44 0.96 -0.69 -0.69 0.00 0.00 174.62 173.77 1orw s VAL 252 N 2.34 4.67 -0.06 3.82 1.01 -0.32 -4.93 120.40 126.93 1orw s VAL 252 Ca 0.15 2.04 0.01 0.00 0.00 0.00 0.00 61.98 64.18 1orw s VAL 252 Cb -0.16 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 31.93 1orw s VAL 252 CO 0.15 0.25 -0.08 0.00 0.00 0.00 0.00 175.10 175.43 1orw s ARG 253 N 0.43 1.26 -0.05 2.72 3.03 -1.26 -2.13 118.95 122.96 1orw s ARG 253 Ca 0.48 -0.24 0.04 0.00 2.03 0.00 0.00 55.73 58.05 1orw s ARG 253 Cb -0.22 -1.18 -0.00 0.00 -1.03 0.00 0.00 34.95 32.51 1orw s ARG 253 CO 0.29 -0.08 -0.18 0.42 -1.13 0.00 0.00 175.30 174.62 1orw s ILE 254 N 1.00 1.48 -0.51 4.99 1.01 -0.85 -4.96 121.20 123.36 1orw s ILE 254 Ca -0.09 -0.73 -0.28 0.00 0.00 0.00 0.00 60.65 59.54 1orw s ILE 254 Cb -0.15 -1.28 0.01 0.00 0.01 0.00 0.00 42.46 41.05 1orw s ILE 254 CO -0.00 0.43 1.50 -2.84 0.00 0.00 0.00 174.94 174.02 1orw s PRO 255 N 0.10 3.30 -0.17 2.79 0.02 -1.26 -1.06 135.00 138.72 1orw s PRO 255 Ca -0.06 0.69 0.00 0.00 0.02 0.00 0.00 61.00 61.65 1orw s PRO 255 Cb -0.12 -4.13 0.04 0.00 0.02 0.00 0.00 34.50 30.30 1orw s PRO 255 CO 0.03 -1.92 -0.09 -0.47 -0.33 0.00 0.00 177.00 174.22 1orw s TYR 256 N 6.29 2.00 -0.32 6.54 6.14 -0.53 -4.57 117.35 132.89 1orw s TYR 256 Ca 0.59 -1.24 -0.23 0.00 0.64 0.00 0.00 57.07 56.82 1orw s TYR 256 Cb -0.13 -1.46 0.00 0.00 0.42 0.00 0.00 41.96 40.79 1orw s TYR 256 CO 0.27 -0.66 0.79 -1.25 0.64 0.00 0.00 175.55 175.35 1orw s PRO 257 N 1.54 3.92 0.49 4.97 0.04 -1.26 -4.49 135.00 140.21 1orw s PRO 257 Ca 0.01 0.54 -0.01 0.00 0.04 0.00 0.00 61.00 61.59 1orw s PRO 257 Cb -0.15 -3.74 0.00 0.00 0.04 0.00 0.00 34.50 30.65 1orw s PRO 257 CO -0.08 -0.72 0.73 0.15 0.04 0.00 0.00 177.00 177.11 1orw s LYS 258 N 3.00 2.95 -0.02 4.56 1.02 -1.26 -0.85 119.74 129.14 1orw s LYS 258 Ca 0.32 -0.46 -0.35 0.00 0.02 0.00 0.00 55.97 55.51 1orw s LYS 258 Cb -0.14 -2.50 -0.17 0.00 -0.52 0.00 0.00 37.83 34.50 1orw s LYS 258 CO 0.13 -0.41 0.95 0.00 -0.92 0.00 0.00 175.35 175.10 1orw n ALA 259 N -2.21 -3.14 -0.79 5.17 0.00 0.14 -0.69 120.51 118.99 1orw n ALA 259 Ca 0.03 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1orw n ALA 259 Cb 0.58 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1orw n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 260 N 1.39 0.36 3.92 0.00 0.00 -1.26 -4.91 105.19 104.70 1orw n GLY 260 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1orw n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw s ALA 261 N -2.02 3.35 -0.01 4.61 0.00 0.13 -4.98 121.76 122.83 1orw s ALA 261 Ca 0.00 -0.79 -0.33 0.00 0.00 0.00 0.00 51.96 50.84 1orw s ALA 261 Cb 0.00 -2.54 -0.12 0.00 0.00 0.00 0.00 23.12 20.46 1orw s ALA 261 CO 0.00 -0.84 1.83 0.39 0.00 0.00 0.00 175.76 177.14 1orw n GLU 262 N -2.58 2.30 -3.04 0.00 -0.58 -1.26 -4.87 120.64 110.61 1orw n GLU 262 Ca 0.05 0.84 -0.23 0.00 -0.42 0.00 0.00 57.16 57.40 1orw n GLU 262 Cb 0.58 -2.69 0.01 0.00 -0.57 0.00 0.00 31.44 28.77 1orw n GLU 262 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1orw s ASN 263 N 3.42 5.92 0.69 1.62 0.01 -1.26 -4.38 114.94 120.96 1orw s ASN 263 Ca 0.89 0.33 -0.13 0.00 -0.71 0.00 0.00 52.86 53.24 1orw s ASN 263 Cb -0.64 -1.63 0.01 0.00 0.41 0.00 0.00 41.25 39.40 1orw s ASN 263 CO 0.47 -0.63 1.08 -2.16 -1.51 0.00 0.00 177.10 174.35 1orw s PRO 264 N -4.52 2.74 0.31 -0.60 0.04 -1.26 -4.77 135.00 126.94 1orw s PRO 264 Ca 0.47 1.19 0.07 0.00 0.04 0.00 0.00 61.00 62.76 1orw s PRO 264 Cb -0.10 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 1orw s PRO 264 CO 0.38 -1.27 0.34 0.95 0.04 0.00 0.00 177.00 177.44 1orw s THR 265 N -2.71 4.08 0.05 1.26 -4.23 -0.21 -4.91 115.64 108.98 1orw s THR 265 Ca 0.62 -1.21 0.03 0.00 -1.18 0.00 0.00 61.69 59.95 1orw s THR 265 Cb -0.17 -3.38 -0.03 0.00 1.34 0.00 0.00 72.50 70.26 1orw s THR 265 CO 0.48 -0.22 -0.09 0.54 -0.54 0.00 0.00 174.62 174.79 1orw s VAL 266 N -2.19 0.67 -0.02 2.29 0.11 -1.26 -1.42 120.40 118.57 1orw s VAL 266 Ca 0.40 -1.14 0.02 0.00 -2.93 0.00 0.00 61.98 58.32 1orw s VAL 266 Cb -0.08 -0.73 0.01 0.00 -1.53 0.00 0.00 36.38 34.05 1orw s VAL 266 CO 0.28 -0.35 -0.06 -0.54 -3.33 0.00 0.00 175.10 171.10 1orw s LYS 267 N -1.65 0.68 0.10 1.54 1.02 -0.71 -4.98 119.74 115.74 1orw s LYS 267 Ca -0.08 -0.18 0.03 0.00 0.02 0.00 0.00 55.97 55.76 1orw s LYS 267 Cb -0.10 -0.67 -0.04 0.00 -0.52 0.00 0.00 37.83 36.50 1orw s LYS 267 CO 0.01 0.04 0.14 0.12 -0.92 0.00 0.00 175.35 174.74 1orw s PHE 268 N 0.33 3.27 -0.07 3.18 5.36 -1.26 -0.33 117.98 128.46 1orw s PHE 268 Ca -0.04 0.09 -0.12 0.00 -0.96 0.00 0.00 56.93 55.90 1orw s PHE 268 Cb -0.08 -1.63 0.03 0.00 -0.34 0.00 0.00 43.02 41.00 1orw s PHE 268 CO -0.00 0.53 0.29 -0.06 -1.46 0.00 0.00 175.22 174.53 1orw s PHE 269 N -1.54 -0.25 -0.14 10.12 0.40 0.20 -2.96 117.98 123.80 1orw s PHE 269 Ca 0.31 0.56 0.02 0.00 -0.60 0.00 0.00 56.93 57.23 1orw s PHE 269 Cb -0.12 0.10 0.01 0.00 0.51 0.00 0.00 43.02 43.52 1orw s PHE 269 CO 0.24 -0.25 -0.22 0.08 0.70 0.00 0.00 175.22 175.78 1orw s VAL 270 N -0.46 2.04 -0.10 -0.44 1.01 -0.75 -0.23 120.40 121.48 1orw s VAL 270 Ca -0.06 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 60.96 1orw s VAL 270 Cb -0.04 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1orw s VAL 270 CO 0.02 0.55 -0.08 -0.69 0.00 0.00 0.00 175.10 174.90 1orw s VAL 271 N 0.87 3.59 -0.53 2.92 1.01 -1.09 -1.61 120.40 125.57 1orw s VAL 271 Ca -0.06 -0.50 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 1orw s VAL 271 Cb -0.15 -2.50 0.05 0.00 0.00 0.00 0.00 36.38 33.78 1orw s VAL 271 CO -0.03 0.56 0.77 -0.62 0.00 0.00 0.00 175.10 175.78 1orw s ASP 272 N -0.30 6.27 0.40 3.32 3.68 -0.34 -0.86 116.67 128.85 1orw s ASP 272 Ca 0.04 -0.68 0.28 0.00 2.13 0.00 0.00 52.55 54.32 1orw s ASP 272 Cb -0.13 -2.36 1.10 0.00 -1.45 0.00 0.00 42.92 40.09 1orw s ASP 272 CO 0.02 -1.05 1.84 0.71 0.13 0.00 0.00 175.17 176.82 1orw h THR 273 N 5.93 0.00 -0.19 1.71 1.35 -1.66 -3.24 112.91 116.82 1orw h THR 273 Ca -0.27 -0.44 0.04 0.00 -0.55 0.00 0.00 66.41 65.19 1orw h THR 273 Cb 1.09 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.83 1orw h THR 273 CO 1.02 0.00 0.14 0.03 -0.25 0.00 0.00 175.52 176.46 1orw h ARG 274 N 0.00 0.06 -0.64 4.72 3.08 -1.91 -1.62 114.38 118.07 1orw h ARG 274 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1orw h ARG 274 Cb 0.51 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1orw h ARG 274 CO 0.00 0.04 0.00 0.25 -1.07 0.00 0.00 179.97 179.19 1orw n THR 275 N -4.49 2.36 -2.39 2.04 -2.24 -1.22 -4.92 114.28 103.43 1orw n THR 275 Ca 0.01 -1.20 -0.43 0.00 -2.27 0.00 0.00 64.05 60.17 1orw n THR 275 Cb 0.23 -0.31 -0.02 0.00 -2.10 0.00 0.00 70.33 68.13 1orw n THR 275 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1orw s LEU 276 N -2.35 3.84 -0.24 3.22 1.02 -0.61 -4.83 118.68 118.73 1orw s LEU 276 Ca 0.47 1.19 -0.21 0.00 0.02 0.00 0.00 54.13 55.59 1orw s LEU 276 Cb 0.36 -3.54 0.06 0.00 0.02 0.00 0.00 46.19 43.09 1orw s LEU 276 CO 0.14 -1.14 0.63 -0.55 0.02 0.00 0.00 176.35 175.44 1orw s SER 277 N 3.07 -0.66 0.39 2.29 0.15 -1.26 -5.05 113.70 112.63 1orw s SER 277 Ca 0.58 1.27 0.23 0.00 0.70 0.00 0.00 55.95 58.73 1orw s SER 277 Cb -0.17 1.28 1.31 0.00 -1.71 0.00 0.00 66.02 66.73 1orw s SER 277 CO 0.25 -0.22 1.62 1.55 1.20 0.00 0.00 173.24 177.64 1orw h PRO 278 N 5.25 0.13 -0.70 5.44 0.13 -1.98 0.27 132.00 140.54 1orw h PRO 278 Ca -0.29 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.73 1orw h PRO 278 Cb 1.17 -0.03 -0.06 0.00 0.13 0.00 0.00 31.00 32.21 1orw h PRO 278 CO 0.11 0.08 0.14 0.09 -0.23 0.00 0.00 178.00 178.19 1orw n ASN 279 N -4.94 5.01 -4.14 1.44 3.02 -1.26 -4.91 115.26 109.47 1orw n ASN 279 Ca 0.36 -3.00 -0.23 0.00 -0.03 0.00 0.00 54.58 51.68 1orw n ASN 279 Cb 1.26 -0.70 -0.15 0.00 -0.61 0.00 0.00 39.78 39.58 1orw n ASN 279 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1orw s ALA 280 N -2.72 1.29 1.35 5.41 0.00 0.96 -5.14 121.76 122.92 1orw s ALA 280 Ca 0.51 -0.69 -0.22 0.00 0.00 0.00 0.00 51.96 51.56 1orw s ALA 280 Cb 0.40 -0.32 0.34 0.00 0.00 0.00 0.00 23.12 23.54 1orw s ALA 280 CO 0.14 0.31 0.99 -1.54 0.00 0.00 0.00 175.76 175.66 1orw s SER 281 N -0.44 -0.43 -0.18 0.00 1.04 -1.26 -4.56 113.70 107.88 1orw s SER 281 Ca 0.06 0.76 -0.09 0.00 0.48 0.00 0.00 55.95 57.15 1orw s SER 281 Cb -0.06 -1.06 -0.05 0.00 0.10 0.00 0.00 66.02 64.95 1orw s SER 281 CO -0.00 -4.96 0.13 -0.69 0.98 0.00 0.00 173.24 168.70 1orw s VAL 282 N -2.54 5.43 -0.38 5.02 1.01 -1.26 -4.81 120.40 122.87 1orw s VAL 282 Ca 0.70 0.19 -0.19 0.00 0.00 0.00 0.00 61.98 62.68 1orw s VAL 282 Cb -0.12 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.82 1orw s VAL 282 CO 0.57 0.48 0.57 -0.89 0.00 0.00 0.00 175.10 175.83 1orw s THR 283 N 0.02 4.94 -0.02 3.92 2.01 -1.26 -5.02 115.64 120.24 1orw s THR 283 Ca 0.10 0.26 -0.13 0.00 0.31 0.00 0.00 61.69 62.23 1orw s THR 283 Cb -0.11 -4.06 0.02 0.00 0.01 0.00 0.00 72.50 68.36 1orw s THR 283 CO -0.01 -0.36 0.28 -0.94 -0.69 0.00 0.00 174.62 172.90 1orw s SER 284 N 1.84 -0.16 -0.04 3.53 1.04 -1.26 -1.20 113.70 117.45 1orw s SER 284 Ca 0.20 0.07 0.06 0.00 0.48 0.00 0.00 55.95 56.76 1orw s SER 284 Cb -0.15 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 66.28 1orw s SER 284 CO 0.15 -0.40 -0.21 -0.47 0.98 0.00 0.00 173.24 173.29 1orw s TYR 285 N -1.22 1.96 -0.28 5.02 5.04 -0.63 -4.96 117.35 122.29 1orw s TYR 285 Ca -0.13 -0.49 -0.15 0.00 -2.44 0.00 0.00 57.07 53.86 1orw s TYR 285 Cb -0.05 -1.29 -0.03 0.00 0.35 0.00 0.00 41.96 40.93 1orw s TYR 285 CO 0.03 -0.12 0.37 -1.14 -1.34 0.00 0.00 175.55 173.36 1orw s GLN 286 N -0.24 3.97 -0.33 4.97 0.74 -1.26 -1.81 119.66 125.70 1orw s GLN 286 Ca 0.01 -0.01 -0.19 0.00 0.05 0.00 0.00 55.36 55.23 1orw s GLN 286 Cb -0.11 -3.67 -0.01 0.00 1.10 0.00 0.00 33.01 30.32 1orw s GLN 286 CO 0.01 -0.31 0.55 0.42 -0.55 0.00 0.00 175.29 175.42 1orw s ILE 287 N 2.07 4.99 0.32 -2.34 1.01 -1.16 -5.01 121.20 121.09 1orw s ILE 287 Ca 0.15 0.55 -0.06 0.00 0.00 0.00 0.00 60.65 61.29 1orw s ILE 287 Cb -0.16 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 1orw s ILE 287 CO 0.10 -0.17 0.60 -0.69 0.00 0.00 0.00 174.94 174.78 1orw s VAL 288 N 2.47 4.98 0.74 2.92 1.01 -1.26 -4.21 120.40 127.05 1orw s VAL 288 Ca 0.21 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.21 1orw s VAL 288 Cb -0.15 -3.75 0.04 0.00 0.00 0.00 0.00 36.38 32.52 1orw s VAL 288 CO 0.13 -0.40 1.09 -2.16 0.00 0.00 0.00 175.10 173.76 1orw s PRO 289 N -3.71 2.53 0.61 2.72 0.04 -1.26 -4.98 135.00 130.95 1orw s PRO 289 Ca 0.45 0.60 -0.18 0.00 0.04 0.00 0.00 61.00 61.91 1orw s PRO 289 Cb -0.11 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1orw s PRO 289 CO 0.31 -1.30 1.03 -2.30 0.04 0.00 0.00 177.00 174.79 1orw n PRO 290 N -3.21 0.95 -0.34 0.56 -0.02 -1.26 -4.44 135.00 127.24 1orw n PRO 290 Ca 0.07 0.37 0.11 0.00 -2.02 0.00 0.00 63.50 62.03 1orw n PRO 290 Cb 0.56 -2.24 0.29 0.00 -0.02 0.00 0.00 33.50 32.09 1orw n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1orw h ALA 291 N 0.51 1.56 -0.34 3.55 0.00 -1.96 0.36 119.26 122.93 1orw h ALA 291 Ca -0.49 0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.60 1orw h ALA 291 Cb 1.36 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1orw h ALA 291 CO 0.51 -0.06 0.48 0.66 0.00 0.00 0.00 179.25 180.84 1orw h SER 292 N 0.72 0.00 0.00 0.00 4.64 -2.02 0.41 113.55 117.31 1orw h SER 292 Ca 0.55 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.54 1orw h SER 292 Cb 0.83 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.86 1orw h SER 292 CO -0.38 0.00 -2.24 0.52 -0.87 0.00 0.00 176.83 173.86 1orw n VAL 293 N -3.46 1.25 0.23 0.95 0.31 -0.23 -4.37 118.33 113.01 1orw n VAL 293 Ca 0.06 -0.47 0.17 0.00 -0.01 0.00 0.00 64.34 64.09 1orw n VAL 293 Cb 0.63 -1.30 0.86 0.00 -0.91 0.00 0.00 33.84 33.12 1orw n VAL 293 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1orw h LEU 294 N -0.05 0.00 -0.94 7.52 6.46 0.03 -2.53 115.31 125.81 1orw h LEU 294 Ca -0.49 0.00 0.29 0.00 -0.12 0.00 0.00 57.88 57.55 1orw h LEU 294 Cb 1.74 0.00 -0.16 0.00 -0.73 0.00 0.00 40.66 41.51 1orw h LEU 294 CO -0.09 0.00 0.32 0.40 -0.62 0.00 0.00 178.44 178.45 1orw h ILE 295 N 0.00 0.22 -1.70 4.05 2.04 -1.16 -3.45 117.51 117.51 1orw h ILE 295 Ca 0.07 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1orw h ILE 295 Cb 0.42 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 1orw h ILE 295 CO -0.00 0.03 0.00 0.61 0.00 0.00 0.00 178.15 178.79 1orw n GLY 296 N -1.36 3.43 3.56 5.37 0.00 -0.95 -5.12 105.19 110.12 1orw n GLY 296 Ca 0.26 -1.29 -0.52 0.00 0.00 0.00 0.00 46.02 44.47 1orw n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1orw n ASP 297 N -1.47 1.17 -4.05 1.61 8.00 -1.26 -4.84 116.55 115.71 1orw n ASP 297 Ca 0.00 1.13 -0.10 0.00 0.71 0.00 0.00 54.79 56.54 1orw n ASP 297 Cb 0.00 -1.15 -0.06 0.00 -0.02 0.00 0.00 41.12 39.89 1orw n ASP 297 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 1orw s HIS 298 N 0.13 0.56 0.03 1.24 -3.43 -1.26 -0.07 115.29 112.49 1orw s HIS 298 Ca 0.81 -0.88 0.04 0.00 -0.80 0.00 0.00 55.06 54.23 1orw s HIS 298 Cb -0.97 0.00 -0.02 0.00 -1.43 0.00 0.00 32.58 30.16 1orw s HIS 298 CO 0.51 -0.90 -0.12 0.71 -2.00 0.00 0.00 174.74 172.93 1orw s TYR 299 N -4.05 1.09 -0.36 0.38 2.02 0.20 -4.83 117.35 111.80 1orw s TYR 299 Ca 0.26 -0.33 -0.16 0.00 -0.37 0.00 0.00 57.07 56.48 1orw s TYR 299 Cb 0.01 -0.66 -0.00 0.00 -0.40 0.00 0.00 41.96 40.91 1orw s TYR 299 CO 0.10 0.01 0.40 -1.17 -1.57 0.00 0.00 175.55 173.32 1orw s LEU 300 N -0.98 4.54 -0.15 -1.29 2.96 -1.26 -0.20 118.68 122.29 1orw s LEU 300 Ca 0.01 -0.32 0.17 0.00 -0.22 0.00 0.00 54.13 53.76 1orw s LEU 300 Cb -0.07 -2.39 0.33 0.00 0.50 0.00 0.00 46.19 44.56 1orw s LEU 300 CO 0.01 -0.42 1.17 0.00 -1.32 0.00 0.00 176.35 175.79 1orw s GLY 302 N -2.98 0.45 -0.12 0.00 0.00 -1.10 -4.89 107.32 98.68 1orw s GLY 302 Ca 0.34 3.64 -0.04 0.00 0.00 0.00 0.00 44.72 48.66 1orw s GLY 302 CO -0.00 2.22 0.08 0.14 0.00 0.00 0.00 173.10 175.54 1orw s VAL 303 N 0.36 -0.11 -0.14 1.40 1.01 -1.26 -0.76 120.40 120.91 1orw s VAL 303 Ca 0.02 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 1orw s VAL 303 Cb -0.04 -0.40 0.04 0.00 0.00 0.00 0.00 36.38 35.97 1orw s VAL 303 CO -0.14 -0.09 -0.05 -0.89 0.00 0.00 0.00 175.10 173.94 1orw s THR 304 N 2.16 0.94 0.11 3.92 2.01 0.58 -5.00 115.64 120.36 1orw s THR 304 Ca 0.03 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 1orw s THR 304 Cb -0.14 -1.10 -0.06 0.00 0.01 0.00 0.00 72.50 71.21 1orw s THR 304 CO -0.07 0.19 1.05 0.26 -0.69 0.00 0.00 174.62 175.36 1orw s TRP 305 N 1.72 3.66 -0.24 4.92 0.52 -1.26 -0.14 118.94 128.12 1orw s TRP 305 Ca 0.02 1.65 -0.09 0.00 0.02 0.00 0.00 56.10 57.70 1orw s TRP 305 Cb -0.14 -3.19 -0.12 0.00 -1.15 0.00 0.00 33.47 28.87 1orw s TRP 305 CO -0.08 -0.31 -0.28 0.28 0.02 0.00 0.00 176.95 176.58 1orw n VAL 306 N 2.98 1.32 -4.16 4.03 0.31 -0.26 -4.93 118.33 117.62 1orw n VAL 306 Ca 0.04 -0.38 -0.17 0.00 -0.01 0.00 0.00 64.34 63.82 1orw n VAL 306 Cb 0.48 -1.69 -0.05 0.00 -0.91 0.00 0.00 33.84 31.66 1orw n VAL 306 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1orw s THR 307 N -2.44 0.00 -0.17 2.52 -4.23 -1.06 -4.83 115.64 105.42 1orw s THR 307 Ca -0.33 -1.74 0.29 0.00 -1.18 0.00 0.00 61.69 58.73 1orw s THR 307 Cb 0.12 -2.62 0.32 0.00 1.34 0.00 0.00 72.50 71.66 1orw s THR 307 CO 0.45 0.00 1.86 -0.33 -0.54 0.00 0.00 174.62 176.06 1orw h GLU 308 N 2.10 0.00 -0.00 3.99 4.39 -1.98 -3.00 114.58 120.08 1orw h GLU 308 Ca -0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.43 1orw h GLU 308 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1orw h GLU 308 CO 0.38 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 178.62 1orw n GLU 309 N -2.66 1.36 -3.68 2.33 1.02 -1.26 -4.90 120.64 112.84 1orw n GLU 309 Ca 0.01 -2.54 -0.14 0.00 -0.02 0.00 0.00 57.16 54.47 1orw n GLU 309 Cb 0.26 -1.48 -0.14 0.00 -0.02 0.00 0.00 31.44 30.06 1orw n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1orw s ARG 310 N -2.80 0.12 0.02 3.49 3.52 -1.14 -0.24 118.95 121.93 1orw s ARG 310 Ca 0.31 0.65 0.08 0.00 -0.13 0.00 0.00 55.73 56.64 1orw s ARG 310 Cb 0.27 -0.11 -0.02 0.00 -1.56 0.00 0.00 34.95 33.52 1orw s ARG 310 CO 0.03 -0.27 -0.24 -1.50 -0.81 0.00 0.00 175.30 172.52 1orw s ILE 311 N 2.16 1.88 -0.26 4.11 2.07 -0.12 -1.10 121.20 129.93 1orw s ILE 311 Ca -0.00 -1.17 -0.04 0.00 -1.41 0.00 0.00 60.65 58.02 1orw s ILE 311 Cb -0.12 -1.60 0.02 0.00 0.13 0.00 0.00 42.46 40.89 1orw s ILE 311 CO -0.08 0.38 -0.01 -0.55 -1.91 0.00 0.00 174.94 172.78 1orw s SER 312 N -0.94 4.63 0.02 4.50 0.15 0.79 0.23 113.70 123.09 1orw s SER 312 Ca 0.09 -0.78 0.03 0.00 0.70 0.00 0.00 55.95 55.99 1orw s SER 312 Cb -0.09 -1.75 -0.04 0.00 -1.71 0.00 0.00 66.02 62.43 1orw s SER 312 CO 0.01 -0.14 -0.02 -0.76 1.20 0.00 0.00 173.24 173.53 1orw s LEU 313 N 1.40 3.42 -0.13 3.45 1.43 -1.12 -0.31 118.68 126.83 1orw s LEU 313 Ca 0.01 -0.08 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 1orw s LEU 313 Cb -0.17 -2.01 0.02 0.00 0.03 0.00 0.00 46.19 44.06 1orw s LEU 313 CO -0.02 0.26 -0.17 -1.58 0.23 0.00 0.00 176.35 175.07 1orw s GLN 314 N -1.71 2.46 0.23 1.70 0.74 0.06 -1.26 119.66 121.89 1orw s GLN 314 Ca 0.20 -0.64 0.11 0.00 0.05 0.00 0.00 55.36 55.09 1orw s GLN 314 Cb -0.11 -2.11 -0.05 0.00 1.10 0.00 0.00 33.01 31.84 1orw s GLN 314 CO 0.12 -0.11 -0.21 -1.58 -0.55 0.00 0.00 175.29 172.95 1orw s TRP 315 N 1.11 2.33 0.02 1.67 0.52 -0.75 -0.78 118.94 123.06 1orw s TRP 315 Ca -0.03 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.76 1orw s TRP 315 Cb -0.14 -1.09 -0.02 0.00 -1.15 0.00 0.00 33.47 31.07 1orw s TRP 315 CO -0.05 0.59 -0.03 -1.50 0.02 0.00 0.00 176.95 175.97 1orw s ILE 316 N -2.00 0.19 0.49 2.03 2.07 0.72 -1.69 121.20 123.00 1orw s ILE 316 Ca 0.25 -0.73 -0.18 0.00 -1.41 0.00 0.00 60.65 58.58 1orw s ILE 316 Cb -0.07 -0.28 -0.09 0.00 0.13 0.00 0.00 42.46 42.15 1orw s ILE 316 CO 0.12 -0.35 0.98 -0.13 -1.91 0.00 0.00 174.94 173.66 1orw s ARG 317 N -1.12 4.00 0.33 3.50 0.52 -1.09 0.61 118.95 125.70 1orw s ARG 317 Ca -0.11 1.05 0.11 0.00 -0.52 0.00 0.00 55.73 56.26 1orw s ARG 317 Cb -0.08 -2.14 0.98 0.00 0.52 0.00 0.00 34.95 34.23 1orw s ARG 317 CO -0.00 -0.23 1.68 -0.09 0.02 0.00 0.00 175.30 176.67 1orw h ARG 318 N 1.26 0.35 -5.68 3.54 2.43 -0.80 -2.82 114.38 112.67 1orw h ARG 318 Ca -0.48 -0.02 -0.61 0.00 -0.81 0.00 0.00 59.98 58.06 1orw h ARG 318 Cb 1.19 -0.08 -0.13 0.00 -0.42 0.00 0.00 29.97 30.53 1orw h ARG 318 CO 0.61 0.23 0.60 0.00 -1.51 0.00 0.00 179.97 179.91 1orw s ALA 319 N -5.74 3.09 0.00 2.80 0.00 -1.26 -4.78 121.76 115.87 1orw s ALA 319 Ca -0.10 -1.59 -0.01 0.00 0.00 0.00 0.00 51.96 50.25 1orw s ALA 319 Cb 0.29 -3.86 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 1orw s ALA 319 CO 0.79 -2.70 1.20 1.04 0.00 0.00 0.00 175.76 176.08 1orw n GLN 320 N 7.81 0.56 0.00 0.00 6.02 -1.06 -3.61 117.38 127.10 1orw n GLN 320 Ca -0.01 -0.17 0.03 0.00 -0.01 0.00 0.00 57.00 56.84 1orw n GLN 320 Cb 0.46 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 30.28 1orw n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1orw n ASN 321 N 2.23 1.52 -3.95 1.08 6.94 -1.26 -0.77 115.26 121.05 1orw n ASN 321 Ca 0.07 -1.26 -0.26 0.00 -0.02 0.00 0.00 54.58 53.11 1orw n ASN 321 Cb 0.27 0.01 -0.17 0.00 -2.36 0.00 0.00 39.78 37.53 1orw n ASN 321 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 1orw s TYR 322 N -0.54 1.46 0.02 -2.53 6.14 -1.24 -0.91 117.35 119.75 1orw s TYR 322 Ca 0.07 -0.66 0.01 0.00 0.64 0.00 0.00 57.07 57.13 1orw s TYR 322 Cb 0.05 -1.16 -0.02 0.00 0.42 0.00 0.00 41.96 41.26 1orw s TYR 322 CO 0.08 -0.42 -0.04 0.45 0.64 0.00 0.00 175.55 176.26 1orw s SER 323 N 1.30 0.42 -0.03 4.32 0.15 0.16 -2.67 113.70 117.34 1orw s SER 323 Ca -0.03 -0.41 -0.03 0.00 0.70 0.00 0.00 55.95 56.19 1orw s SER 323 Cb -0.14 0.05 0.01 0.00 -1.71 0.00 0.00 66.02 64.23 1orw s SER 323 CO -0.04 -0.20 0.08 -0.51 1.20 0.00 0.00 173.24 173.78 1orw s ILE 324 N -1.10 0.01 -0.18 6.45 2.07 -0.68 0.10 121.20 127.86 1orw s ILE 324 Ca -0.10 -0.05 -0.07 0.00 -1.41 0.00 0.00 60.65 59.02 1orw s ILE 324 Cb -0.08 -0.14 -0.04 0.00 0.13 0.00 0.00 42.46 42.33 1orw s ILE 324 CO -0.00 -0.03 0.05 -0.63 -1.91 0.00 0.00 174.94 172.42 1orw s ILE 325 N -0.05 4.68 -0.40 2.00 1.01 0.60 -1.82 121.20 127.22 1orw s ILE 325 Ca -0.01 -0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.60 1orw s ILE 325 Cb -0.01 -3.10 0.11 0.00 0.01 0.00 0.00 42.46 39.47 1orw s ILE 325 CO 0.00 0.47 0.13 -0.62 0.00 0.00 0.00 174.94 174.92 1orw s ASP 326 N 0.34 4.43 -0.60 3.58 2.15 -0.39 -1.35 116.67 124.84 1orw s ASP 326 Ca 0.02 -2.38 -0.28 0.00 0.43 0.00 0.00 52.55 50.35 1orw s ASP 326 Cb -0.13 -1.47 0.02 0.00 -0.30 0.00 0.00 42.92 41.05 1orw s ASP 326 CO 0.00 -0.33 1.28 -0.63 -0.17 0.00 0.00 175.17 175.32 1orw s ILE 327 N 0.61 3.90 0.01 4.11 1.01 -1.04 -2.78 121.20 127.02 1orw s ILE 327 Ca 0.13 0.75 -0.10 0.00 0.00 0.00 0.00 60.65 61.43 1orw s ILE 327 Cb -0.21 -4.67 -0.05 0.00 0.01 0.00 0.00 42.46 37.54 1orw s ILE 327 CO -0.07 -1.37 0.34 0.00 0.00 0.00 0.00 174.94 173.84 1orw s ASP 329 N -1.44 4.59 0.09 0.00 1.01 -0.18 -0.95 116.67 119.79 1orw s ASP 329 Ca 0.26 -0.25 -0.30 0.00 0.71 0.00 0.00 52.55 52.98 1orw s ASP 329 Cb -0.14 -1.00 -0.05 0.00 1.01 0.00 0.00 42.92 42.73 1orw s ASP 329 CO 0.14 0.22 0.94 -0.47 0.21 0.00 0.00 175.17 176.22 1orw s TYR 330 N -1.13 3.79 -0.42 4.23 5.04 0.67 -0.46 117.35 129.06 1orw s TYR 330 Ca 0.20 1.76 -0.07 0.00 -2.44 0.00 0.00 57.07 56.52 1orw s TYR 330 Cb -0.11 -3.04 0.10 0.00 0.35 0.00 0.00 41.96 39.25 1orw s TYR 330 CO 0.12 0.19 0.25 0.34 -1.34 0.00 0.00 175.55 175.10 1orw s ASP 331 N 0.11 5.48 0.55 4.32 3.68 -0.66 -4.94 116.67 125.21 1orw s ASP 331 Ca 0.47 -1.76 0.29 0.00 2.13 0.00 0.00 52.55 53.68 1orw s ASP 331 Cb -0.23 -1.92 1.46 0.00 -1.45 0.00 0.00 42.92 40.78 1orw s ASP 331 CO 0.29 -0.56 1.92 -0.33 0.13 0.00 0.00 175.17 176.62 1orw h GLU 332 N 8.28 0.00 -0.00 4.34 5.08 -1.95 0.16 114.58 130.49 1orw h GLU 332 Ca -0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1orw h GLU 332 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1orw h GLU 332 CO 0.75 0.00 -0.04 -1.13 -1.00 0.00 0.00 179.01 177.59 1orw n SER 333 N -4.13 0.10 0.00 1.42 3.41 -1.26 -4.28 113.62 108.89 1orw n SER 333 Ca 0.13 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1orw n SER 333 Cb 0.79 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1orw n SER 333 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1orw n THR 334 N -1.29 0.00 0.00 6.66 -2.24 -0.65 -5.01 114.28 111.75 1orw n THR 334 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1orw n THR 334 Cb 0.27 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 1orw n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1orw n GLY 335 N 0.26 1.58 3.70 3.38 0.00 0.47 -5.04 105.19 109.54 1orw n GLY 335 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1orw n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1orw s ARG 336 N -0.50 1.40 -0.35 1.61 0.52 -1.25 -4.73 118.95 115.64 1orw s ARG 336 Ca 0.00 1.26 0.02 0.00 -0.52 0.00 0.00 55.73 56.48 1orw s ARG 336 Cb 0.00 -1.79 0.10 0.00 0.52 0.00 0.00 34.95 33.77 1orw s ARG 336 CO 0.00 -2.27 0.07 -1.58 0.02 0.00 0.00 175.30 171.54 1orw s TRP 337 N -2.78 3.64 0.01 -0.53 0.52 -1.26 -1.66 118.94 116.89 1orw s TRP 337 Ca 0.64 -2.71 -0.17 0.00 0.02 0.00 0.00 56.10 53.88 1orw s TRP 337 Cb -0.20 -2.85 -0.06 0.00 -1.15 0.00 0.00 33.47 29.21 1orw s TRP 337 CO 0.58 -0.94 0.48 0.42 0.02 0.00 0.00 176.95 177.51 1orw s ILE 338 N 1.01 4.94 0.12 2.03 1.01 0.39 -4.78 121.20 125.91 1orw s ILE 338 Ca 0.07 1.01 0.07 0.00 0.00 0.00 0.00 60.65 61.80 1orw s ILE 338 Cb -0.20 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 1orw s ILE 338 CO -0.06 0.53 -0.10 -0.94 0.00 0.00 0.00 174.94 174.38 1orw s SER 339 N -0.85 4.39 -0.02 3.58 1.04 -1.26 -1.02 113.70 119.56 1orw s SER 339 Ca 0.26 -0.41 -0.00 0.00 0.48 0.00 0.00 55.95 56.27 1orw s SER 339 Cb -0.18 -0.83 0.02 0.00 0.10 0.00 0.00 66.02 65.14 1orw s SER 339 CO 0.15 0.16 0.04 -0.94 0.98 0.00 0.00 173.24 173.63 1orw s SER 340 N -2.33 0.03 0.48 7.02 1.04 -1.26 -5.02 113.70 113.66 1orw s SER 340 Ca 0.22 0.06 0.37 0.00 0.48 0.00 0.00 55.95 57.08 1orw s SER 340 Cb -0.11 -0.02 1.55 0.00 0.10 0.00 0.00 66.02 67.54 1orw s SER 340 CO 0.14 -0.10 1.61 0.58 0.98 0.00 0.00 173.24 176.45 1orw h VAL 341 N 5.97 0.07 -0.58 5.02 2.07 -1.99 0.81 116.25 127.62 1orw h VAL 341 Ca -0.40 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1orw h VAL 341 Cb 1.14 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1orw h VAL 341 CO 0.48 0.01 0.28 0.00 0.02 0.00 0.00 177.57 178.36 1orw h ALA 342 N 1.42 0.75 -0.04 1.67 0.00 -1.95 -2.51 119.26 118.60 1orw h ALA 342 Ca 0.86 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.64 1orw h ALA 342 Cb 2.99 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 20.55 1orw h ALA 342 CO -0.29 0.32 0.01 0.54 0.00 0.00 0.00 179.25 179.82 1orw n ARG 343 N -4.54 1.25 -4.76 0.00 1.74 0.28 -4.15 116.66 106.49 1orw n ARG 343 Ca 0.03 -0.22 -0.33 0.00 -0.77 0.00 0.00 57.85 56.56 1orw n ARG 343 Cb 0.12 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 29.92 1orw n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1orw s GLN 344 N -1.02 3.38 -0.22 5.56 -0.21 -0.95 -2.50 119.66 123.71 1orw s GLN 344 Ca 0.04 -0.68 0.02 0.00 0.02 0.00 0.00 55.36 54.75 1orw s GLN 344 Cb 0.03 -2.64 0.05 0.00 1.00 0.00 0.00 33.01 31.45 1orw s GLN 344 CO 0.01 0.21 -0.12 -1.01 -2.12 0.00 0.00 175.29 172.25 1orw s HIS 345 N 0.37 2.81 -0.10 0.91 3.76 -0.46 -4.87 115.29 117.72 1orw s HIS 345 Ca -0.11 -1.90 -0.20 0.00 -0.15 0.00 0.00 55.06 52.71 1orw s HIS 345 Cb -0.16 -1.80 -0.04 0.00 1.11 0.00 0.00 32.58 31.69 1orw s HIS 345 CO 0.05 -0.81 0.54 0.42 -0.85 0.00 0.00 174.74 174.09 1orw s ILE 346 N 1.26 5.14 -0.09 0.60 1.01 -1.26 -0.29 121.20 127.57 1orw s ILE 346 Ca -0.03 1.10 0.03 0.00 0.00 0.00 0.00 60.65 61.75 1orw s ILE 346 Cb -0.17 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.42 1orw s ILE 346 CO -0.08 0.31 -0.21 -0.70 0.00 0.00 0.00 174.94 174.26 1orw s GLU 347 N 0.65 2.66 0.04 2.79 2.12 0.28 -4.98 118.70 122.26 1orw s GLU 347 Ca 0.29 -0.75 -0.04 0.00 0.36 0.00 0.00 54.97 54.84 1orw s GLU 347 Cb -0.16 -2.05 -0.02 0.00 0.26 0.00 0.00 34.13 32.17 1orw s GLU 347 CO 0.13 0.13 0.06 0.96 -0.54 0.00 0.00 175.26 176.00 1orw s ILE 348 N 0.44 0.15 -0.03 -3.70 -4.36 -1.26 0.35 121.20 112.80 1orw s ILE 348 Ca -0.18 -1.24 0.07 0.00 -0.26 0.00 0.00 60.65 59.05 1orw s ILE 348 Cb -0.17 -0.99 -0.02 0.00 1.25 0.00 0.00 42.46 42.53 1orw s ILE 348 CO 0.07 -0.68 -0.23 -0.55 0.24 0.00 0.00 174.94 173.79 1orw s SER 349 N -2.27 3.30 -0.00 4.36 0.15 -0.09 -4.99 113.70 114.15 1orw s SER 349 Ca -0.03 -0.40 0.13 0.00 0.70 0.00 0.00 55.95 56.35 1orw s SER 349 Cb 0.00 -0.48 -0.14 0.00 -1.71 0.00 0.00 66.02 63.69 1orw s SER 349 CO -0.06 0.32 0.52 0.35 1.20 0.00 0.00 173.24 175.58 1orw n THR 350 N 2.42 0.00 0.51 6.45 -2.24 -1.26 -4.46 114.28 115.70 1orw n THR 350 Ca -0.16 -0.21 0.05 0.00 -2.27 0.00 0.00 64.05 61.46 1orw n THR 350 Cb 0.51 0.93 -0.07 0.00 -2.10 0.00 0.00 70.33 69.61 1orw n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1orw n THR 351 N -1.36 0.00 0.00 4.28 -2.24 -1.26 -5.07 114.28 108.62 1orw n THR 351 Ca 0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1orw n THR 351 Cb 0.21 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1orw n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1orw n GLY 352 N 1.30 0.87 3.48 3.38 0.00 -1.26 -4.81 105.19 108.15 1orw n GLY 352 Ca 0.02 0.38 -0.24 0.00 0.00 0.00 0.00 46.02 46.18 1orw n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1orw s TRP 353 N 2.24 2.32 0.11 1.61 -2.14 -1.26 -4.59 118.94 117.23 1orw s TRP 353 Ca 0.00 -0.32 -0.30 0.00 2.66 0.00 0.00 56.10 58.14 1orw s TRP 353 Cb 0.00 -1.01 -0.06 0.00 -3.10 0.00 0.00 33.47 29.30 1orw s TRP 353 CO 0.00 0.71 1.07 0.08 -2.66 0.00 0.00 176.95 176.15 1orw s VAL 354 N -2.49 4.19 0.00 -0.66 1.01 0.05 -4.84 120.40 117.65 1orw s VAL 354 Ca 0.30 1.76 0.00 0.00 0.00 0.00 0.00 61.98 64.04 1orw s VAL 354 Cb -0.05 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1orw s VAL 354 CO 0.15 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1orw n GLY 355 N 2.45 -1.94 0.11 4.51 0.00 -1.26 -3.70 105.19 105.35 1orw n GLY 355 Ca 0.04 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 1orw n GLY 355 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1orw n ARG 356 N 0.00 0.68 0.00 1.61 1.74 -1.26 -4.76 116.66 114.67 1orw n ARG 356 Ca 0.00 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1orw n ARG 356 Cb 0.00 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 29.86 1orw n ARG 356 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1orw n PHE 357 N -2.99 0.00 -3.46 -1.55 3.72 -1.26 -4.79 117.46 107.13 1orw n PHE 357 Ca -0.34 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 56.94 1orw n PHE 357 Cb 1.09 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.60 1orw n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1orw s ARG 358 N -0.49 1.12 0.37 -1.08 1.70 -1.26 -5.01 118.95 114.30 1orw s ARG 358 Ca 0.00 -0.30 -0.28 0.00 -0.47 0.00 0.00 55.73 54.67 1orw s ARG 358 Cb 0.00 0.52 -0.11 0.00 -0.57 0.00 0.00 34.95 34.79 1orw s ARG 358 CO 0.00 -0.47 1.45 -1.25 -1.08 0.00 0.00 175.30 173.96 1orw s PRO 359 N -3.14 4.15 0.67 3.89 0.04 -1.24 -4.35 135.00 135.02 1orw s PRO 359 Ca 0.00 2.51 -0.17 0.00 0.04 0.00 0.00 61.00 63.38 1orw s PRO 359 Cb -0.01 -2.98 -0.03 0.00 0.04 0.00 0.00 34.50 31.52 1orw s PRO 359 CO -0.08 -0.48 0.89 0.00 0.04 0.00 0.00 177.00 177.37 1orw n ALA 360 N 0.51 -0.28 -2.72 8.56 0.00 -1.26 -4.97 120.51 120.35 1orw n ALA 360 Ca 0.01 -0.11 -0.34 0.00 0.00 0.00 0.00 53.44 53.00 1orw n ALA 360 Cb 0.40 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 17.73 1orw n ALA 360 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1orw s GLU 361 N -2.98 3.62 0.22 0.00 2.02 -1.26 -4.88 118.70 115.43 1orw s GLU 361 Ca 0.73 -0.05 -0.30 0.00 0.02 0.00 0.00 54.97 55.37 1orw s GLU 361 Cb -0.38 -3.01 -0.09 0.00 0.10 0.00 0.00 34.13 30.76 1orw s GLU 361 CO 0.50 0.59 1.18 -1.25 0.02 0.00 0.00 175.26 176.30 1orw s PRO 362 N -2.04 4.52 -0.38 0.39 0.04 -1.26 -4.67 135.00 131.59 1orw s PRO 362 Ca 0.32 1.88 -0.05 0.00 0.04 0.00 0.00 61.00 63.20 1orw s PRO 362 Cb -0.13 -3.22 0.08 0.00 0.04 0.00 0.00 34.50 31.28 1orw s PRO 362 CO 0.19 -0.03 0.17 -1.01 0.04 0.00 0.00 177.00 176.37 1orw s HIS 363 N -0.38 3.43 0.61 0.56 3.76 -0.38 -4.94 115.29 117.95 1orw s HIS 363 Ca 0.51 -1.99 -0.08 0.00 -0.15 0.00 0.00 55.06 53.34 1orw s HIS 363 Cb -0.33 -2.85 -0.01 0.00 1.11 0.00 0.00 32.58 30.50 1orw s HIS 363 CO 0.39 -0.89 0.96 -0.06 -0.85 0.00 0.00 174.74 174.29 1orw s PHE 364 N 1.26 3.39 0.37 1.40 0.40 -1.26 0.44 117.98 123.98 1orw s PHE 364 Ca 0.03 0.90 -0.07 0.00 -0.60 0.00 0.00 56.93 57.20 1orw s PHE 364 Cb -0.22 -2.77 -0.05 0.00 0.51 0.00 0.00 43.02 40.49 1orw s PHE 364 CO -0.01 -0.82 0.68 0.95 0.70 0.00 0.00 175.22 176.71 1orw s THR 365 N -3.10 4.92 0.26 0.64 -4.23 0.20 -4.91 115.64 109.42 1orw s THR 365 Ca 0.54 0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 61.19 1orw s THR 365 Cb -0.11 -3.77 0.38 0.00 1.34 0.00 0.00 72.50 70.34 1orw s THR 365 CO 0.49 -0.51 1.57 -1.28 -0.54 0.00 0.00 174.62 174.35 1orw h SER 366 N 1.18 -0.94 -0.15 3.99 0.87 -1.93 0.31 113.55 116.88 1orw h SER 366 Ca -0.47 0.28 -0.09 0.00 -1.23 0.00 0.00 61.79 60.27 1orw h SER 366 Cb 1.19 0.59 -0.02 0.00 -0.44 0.00 0.00 62.40 63.73 1orw h SER 366 CO 0.64 -0.30 -0.19 -2.24 -0.53 0.00 0.00 176.83 174.21 1orw h ASP 367 N -0.01 0.57 0.00 6.23 2.03 -1.93 -3.47 116.42 119.84 1orw h ASP 367 Ca 0.42 -0.18 0.00 0.00 -0.73 0.00 0.00 57.03 56.54 1orw h ASP 367 Cb 0.65 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 1orw h ASP 367 CO -0.94 0.77 0.00 0.61 -1.03 0.00 0.00 179.24 178.65 1orw n GLY 368 N -0.43 0.90 0.00 7.15 0.00 0.11 -4.95 105.19 107.98 1orw n GLY 368 Ca 0.00 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.04 1orw n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1orw n ASN 369 N 0.15 0.86 -3.97 1.61 4.13 -1.26 -4.83 115.26 111.95 1orw n ASN 369 Ca 0.00 -0.82 -0.08 0.00 1.68 0.00 0.00 54.58 55.35 1orw n ASN 369 Cb 0.00 1.01 -0.09 0.00 -1.54 0.00 0.00 39.78 39.16 1orw n ASN 369 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1orw s SER 370 N -3.17 0.27 0.09 6.41 1.04 -1.26 0.95 113.70 118.03 1orw s SER 370 Ca 0.07 -0.71 -0.08 0.00 0.48 0.00 0.00 55.95 55.71 1orw s SER 370 Cb 0.16 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 66.51 1orw s SER 370 CO 0.86 -0.57 0.17 0.72 0.98 0.00 0.00 173.24 175.40 1orw s PHE 371 N -3.21 0.20 -0.09 5.02 -0.12 -0.97 -0.63 117.98 118.17 1orw s PHE 371 Ca 0.00 -0.64 0.04 0.00 -0.05 0.00 0.00 56.93 56.28 1orw s PHE 371 Cb 0.02 -0.09 -0.00 0.00 -0.63 0.00 0.00 43.02 42.32 1orw s PHE 371 CO -0.07 -0.54 -0.23 0.71 -0.05 0.00 0.00 175.22 175.04 1orw s TYR 372 N -3.87 2.56 -0.03 3.49 1.51 0.17 -0.85 117.35 120.33 1orw s TYR 372 Ca 0.06 -0.96 -0.08 0.00 -1.01 0.00 0.00 57.07 55.07 1orw s TYR 372 Cb 0.05 -1.70 0.01 0.00 -0.11 0.00 0.00 41.96 40.21 1orw s TYR 372 CO -0.10 -0.37 0.19 0.21 -1.11 0.00 0.00 175.55 174.36 1orw s LYS 373 N 0.25 0.41 -0.08 -0.62 2.20 -0.87 -1.25 119.74 119.77 1orw s LYS 373 Ca -0.16 -0.09 -0.25 0.00 -0.36 0.00 0.00 55.97 55.11 1orw s LYS 373 Cb -0.17 0.18 -0.03 0.00 -1.51 0.00 0.00 37.83 36.30 1orw s LYS 373 CO 0.08 -0.09 0.77 0.42 -0.36 0.00 0.00 175.35 176.17 1orw s ILE 374 N -0.76 4.98 0.33 5.43 1.01 -1.26 -0.67 121.20 130.25 1orw s ILE 374 Ca -0.09 1.58 0.03 0.00 0.00 0.00 0.00 60.65 62.18 1orw s ILE 374 Cb -0.05 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.30 1orw s ILE 374 CO 0.01 0.18 0.34 0.27 0.00 0.00 0.00 174.94 175.74 1orw s ILE 375 N 1.19 0.00 0.03 2.92 -4.36 -0.54 -4.40 121.20 116.04 1orw s ILE 375 Ca 0.40 -1.86 -0.20 0.00 -0.26 0.00 0.00 60.65 58.73 1orw s ILE 375 Cb -0.18 -2.55 -0.06 0.00 1.25 0.00 0.00 42.46 40.92 1orw s ILE 375 CO 0.18 0.00 0.57 -0.44 0.24 0.00 0.00 174.94 175.49 1orw s SER 376 N -3.31 7.01 1.41 4.36 0.01 -1.26 -0.72 113.70 121.20 1orw s SER 376 Ca 0.37 1.20 -0.22 0.00 1.31 0.00 0.00 55.95 58.61 1orw s SER 376 Cb 0.02 -2.36 0.36 0.00 0.21 0.00 0.00 66.02 64.25 1orw s SER 376 CO 0.24 0.20 0.86 0.59 0.41 0.00 0.00 173.24 175.53 1orw n ASN 377 N 2.20 -3.75 -0.06 2.44 3.02 0.14 -4.80 115.26 114.44 1orw n ASN 377 Ca -0.09 -0.73 0.14 0.00 -0.03 0.00 0.00 54.58 53.87 1orw n ASN 377 Cb 0.51 -1.03 0.61 0.00 -0.61 0.00 0.00 39.78 39.26 1orw n ASN 377 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1orw n GLU 378 N -5.44 0.48 -0.39 3.52 4.71 -1.26 -2.35 120.64 119.90 1orw n GLU 378 Ca 0.11 -0.13 0.08 0.00 -0.01 0.00 0.00 57.16 57.21 1orw n GLU 378 Cb 0.58 -1.50 0.24 0.00 -1.01 0.00 0.00 31.44 29.76 1orw n GLU 378 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1orw n GLU 379 N -1.15 3.13 -1.09 3.49 2.13 -1.26 -4.98 120.64 120.91 1orw n GLU 379 Ca 0.13 -2.55 -0.03 0.00 0.66 0.00 0.00 57.16 55.36 1orw n GLU 379 Cb 0.28 -1.64 -0.01 0.00 0.27 0.00 0.00 31.44 30.34 1orw n GLU 379 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1orw n GLY 380 N 0.29 0.57 3.59 8.31 0.00 -0.99 -4.84 105.19 112.11 1orw n GLY 380 Ca 0.19 -0.23 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1orw n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1orw s TYR 381 N -1.85 3.14 -0.25 1.61 1.51 -1.26 0.49 117.35 120.74 1orw s TYR 381 Ca 0.00 -0.05 -0.29 0.00 -1.01 0.00 0.00 57.07 55.72 1orw s TYR 381 Cb 0.00 -1.97 -0.01 0.00 -0.11 0.00 0.00 41.96 39.88 1orw s TYR 381 CO 0.00 0.15 1.35 0.15 -1.11 0.00 0.00 175.55 176.09 1orw s LYS 382 N 0.09 3.98 0.19 -0.62 1.02 -1.26 0.23 119.74 123.38 1orw s LYS 382 Ca 0.02 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.45 1orw s LYS 382 Cb -0.13 -3.88 -0.04 0.00 -0.52 0.00 0.00 37.83 33.26 1orw s LYS 382 CO 0.02 -1.03 0.07 -1.01 -0.92 0.00 0.00 175.35 172.48 1orw s HIS 383 N 4.27 1.21 -0.27 3.18 3.76 0.10 -1.78 115.29 125.75 1orw s HIS 383 Ca 0.59 -1.20 -0.29 0.00 -0.15 0.00 0.00 55.06 54.00 1orw s HIS 383 Cb -0.20 -0.67 0.01 0.00 1.11 0.00 0.00 32.58 32.83 1orw s HIS 383 CO 0.22 -0.42 1.18 0.42 -0.85 0.00 0.00 174.74 175.28 1orw s ILE 384 N -3.90 4.37 -0.07 0.60 1.01 -1.26 -1.46 121.20 120.48 1orw s ILE 384 Ca 0.32 1.59 -0.01 0.00 0.00 0.00 0.00 60.65 62.54 1orw s ILE 384 Cb 0.07 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 1orw s ILE 384 CO 0.08 -0.38 0.01 0.00 0.00 0.00 0.00 174.94 174.65 1orw s HIS 386 N -0.94 3.26 0.23 0.00 2.46 0.23 -2.05 115.29 118.49 1orw s HIS 386 Ca 0.15 0.51 0.08 0.00 0.47 0.00 0.00 55.06 56.27 1orw s HIS 386 Cb -0.11 -2.63 -0.04 0.00 -0.13 0.00 0.00 32.58 29.67 1orw s HIS 386 CO 0.04 -0.24 0.09 -0.06 -2.47 0.00 0.00 174.74 172.10 1orw s PHE 387 N 2.12 2.93 -0.16 3.88 0.40 -0.03 -0.98 117.98 126.13 1orw s PHE 387 Ca 0.18 -0.14 -0.05 0.00 -0.60 0.00 0.00 56.93 56.32 1orw s PHE 387 Cb -0.16 -1.34 -0.03 0.00 0.51 0.00 0.00 43.02 42.00 1orw s PHE 387 CO 0.09 0.55 -0.01 -1.14 0.70 0.00 0.00 175.22 175.42 1orw s GLN 388 N -3.53 3.75 0.63 0.44 2.00 -1.26 -2.30 119.66 119.39 1orw s GLN 388 Ca 0.31 -0.48 0.21 0.00 -2.00 0.00 0.00 55.36 53.41 1orw s GLN 388 Cb -0.08 -2.99 1.01 0.00 0.80 0.00 0.00 33.01 31.75 1orw s GLN 388 CO 0.22 0.25 1.53 1.15 -0.50 0.00 0.00 175.29 177.94 1orw h THR 389 N 5.08 0.09 0.00 -0.34 2.02 0.26 -2.48 112.91 117.54 1orw h THR 389 Ca -0.33 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.85 1orw h THR 389 Cb 1.18 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1orw h THR 389 CO 0.65 0.00 -0.07 -0.90 0.37 0.00 0.00 175.52 175.57 1orw n ASP 390 N -3.08 0.65 -4.42 4.18 5.68 -1.26 -4.11 116.55 114.18 1orw n ASP 390 Ca 0.07 -1.51 -0.34 0.00 -0.50 0.00 0.00 54.79 52.52 1orw n ASP 390 Cb 0.90 -0.05 -0.13 0.00 -1.14 0.00 0.00 41.12 40.69 1orw n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1orw s LYS 391 N -0.43 3.52 0.50 0.11 -0.14 -0.93 -4.60 119.74 117.78 1orw s LYS 391 Ca 0.02 -0.60 0.33 0.00 -1.36 0.00 0.00 55.97 54.36 1orw s LYS 391 Cb 0.02 -2.83 1.41 0.00 -1.68 0.00 0.00 37.83 34.74 1orw s LYS 391 CO 0.00 0.17 1.97 0.66 -0.76 0.00 0.00 175.35 177.38 1orw h SER 392 N 6.92 0.00 -3.46 2.83 4.64 -1.85 -3.37 113.55 119.27 1orw h SER 392 Ca -0.31 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.49 1orw h SER 392 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1orw h SER 392 CO 0.60 0.00 -0.08 0.54 -0.87 0.00 0.00 176.83 177.02 1orw s ASN 393 N -5.32 6.61 0.31 4.97 2.20 -1.26 -4.98 114.94 117.47 1orw s ASN 393 Ca 0.01 0.95 0.03 0.00 -0.94 0.00 0.00 52.86 52.91 1orw s ASN 393 Cb 0.09 -2.24 -0.04 0.00 -2.00 0.00 0.00 41.25 37.06 1orw s ASN 393 CO 0.49 -0.13 0.13 0.00 -2.94 0.00 0.00 177.10 174.65 1orw s THR 395 N -3.53 0.86 -0.14 0.00 2.01 -0.15 -4.86 115.64 109.83 1orw s THR 395 Ca 0.34 -0.25 -0.29 0.00 0.31 0.00 0.00 61.69 61.80 1orw s THR 395 Cb 0.06 -0.86 -0.03 0.00 0.01 0.00 0.00 72.50 71.67 1orw s THR 395 CO 0.16 0.32 1.51 -0.36 -0.69 0.00 0.00 174.62 175.55 1orw s PHE 396 N 1.25 2.30 -1.64 4.92 0.08 -1.26 0.75 117.98 124.39 1orw s PHE 396 Ca -0.05 0.55 0.26 0.00 0.12 0.00 0.00 56.93 57.81 1orw s PHE 396 Cb -0.14 -3.80 0.62 0.00 -0.57 0.00 0.00 43.02 39.13 1orw s PHE 396 CO -0.02 -2.89 1.48 0.44 -0.10 0.00 0.00 175.22 174.13 1orw n ILE 397 N 5.68 0.00 -4.08 0.64 -5.35 0.20 -4.89 119.36 111.56 1orw n ILE 397 Ca 0.16 -0.11 -0.12 0.00 -0.27 0.00 0.00 62.75 62.41 1orw n ILE 397 Cb 0.44 0.46 -0.11 0.00 -1.74 0.00 0.00 39.64 38.69 1orw n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1orw s THR 398 N -2.59 0.54 0.18 7.28 -4.23 -1.23 -4.90 115.64 110.68 1orw s THR 398 Ca 0.21 -1.30 -0.21 0.00 -1.18 0.00 0.00 61.69 59.21 1orw s THR 398 Cb 0.19 -0.88 0.05 0.00 1.34 0.00 0.00 72.50 73.20 1orw s THR 398 CO 0.56 -0.53 0.59 -1.59 -0.54 0.00 0.00 174.62 173.11 1orw s LYS 399 N -2.21 1.36 0.00 3.99 0.00 -1.26 -4.60 119.74 117.03 1orw s LYS 399 Ca -0.04 -0.65 0.00 0.00 0.00 0.00 0.00 55.97 55.27 1orw s LYS 399 Cb -0.06 0.57 0.00 0.00 0.00 0.00 0.00 37.83 38.34 1orw s LYS 399 CO -0.01 -0.59 0.00 0.41 0.00 0.00 0.00 175.35 175.15 1orw n GLY 400 N -0.37 1.30 2.83 0.59 0.00 -1.26 -4.93 105.19 103.36 1orw n GLY 400 Ca -0.13 -1.96 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 1orw n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw n ALA 401 N -1.12 5.62 -3.85 4.61 0.00 -1.26 -4.82 120.51 119.68 1orw n ALA 401 Ca 0.00 -4.64 -0.04 0.00 0.00 0.00 0.00 53.44 48.76 1orw n ALA 401 Cb 0.00 -2.40 0.01 0.00 0.00 0.00 0.00 19.45 17.06 1orw n ALA 401 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1orw s TRP 402 N -2.81 0.05 0.10 0.00 1.48 -1.26 -5.03 118.94 111.46 1orw s TRP 402 Ca 0.36 -0.48 0.02 0.00 -1.06 0.00 0.00 56.10 54.94 1orw s TRP 402 Cb 0.11 0.72 -0.04 0.00 -1.16 0.00 0.00 33.47 33.09 1orw s TRP 402 CO 0.01 -1.02 -0.07 -1.21 -4.06 0.00 0.00 176.95 170.59 1orw s GLU 403 N -2.37 0.83 -0.12 3.25 2.02 -1.26 -4.58 118.70 116.47 1orw s GLU 403 Ca 0.19 -1.29 -0.19 0.00 0.02 0.00 0.00 54.97 53.70 1orw s GLU 403 Cb -0.03 -0.27 -0.04 0.00 0.10 0.00 0.00 34.13 33.89 1orw s GLU 403 CO 0.06 0.00 0.51 0.08 0.02 0.00 0.00 175.26 175.93 1orw s VAL 404 N -3.35 5.16 -0.03 2.63 1.01 -0.73 -2.51 120.40 122.59 1orw s VAL 404 Ca 0.10 1.01 -0.15 0.00 0.00 0.00 0.00 61.98 62.94 1orw s VAL 404 Cb 0.03 -3.85 -0.32 0.00 0.00 0.00 0.00 36.38 32.24 1orw s VAL 404 CO -0.04 0.30 0.81 0.40 0.00 0.00 0.00 175.10 176.57 1orw h ILE 405 N 4.77 1.16 -1.32 2.22 1.08 0.68 -3.45 117.51 122.65 1orw h ILE 405 Ca -0.40 -2.57 0.26 0.00 -0.39 0.00 0.00 64.86 61.76 1orw h ILE 405 Cb 1.18 2.93 -0.21 0.00 -3.07 0.00 0.00 36.82 37.65 1orw h ILE 405 CO 0.75 0.80 0.86 -0.83 -0.69 0.00 0.00 178.15 179.05 1orw s GLY 406 N -4.81 -0.21 -0.19 5.37 0.00 -1.10 -4.99 107.32 101.40 1orw s GLY 406 Ca -0.14 1.88 -0.23 0.00 0.00 0.00 0.00 44.72 46.24 1orw s GLY 406 CO 0.87 0.67 0.73 -0.42 0.00 0.00 0.00 173.10 174.95 1orw s ILE 407 N -2.06 4.95 -0.21 0.90 1.01 -1.26 -0.76 121.20 123.77 1orw s ILE 407 Ca 0.09 1.40 -0.10 0.00 0.00 0.00 0.00 60.65 62.05 1orw s ILE 407 Cb -0.01 -4.04 -0.19 0.00 0.01 0.00 0.00 42.46 38.23 1orw s ILE 407 CO -0.04 0.06 0.04 -0.62 0.00 0.00 0.00 174.94 174.38 1orw n GLU 408 N 5.19 0.65 -3.81 2.79 -0.58 0.18 -4.97 120.64 120.09 1orw n GLU 408 Ca 0.02 0.31 -0.09 0.00 -0.42 0.00 0.00 57.16 56.97 1orw n GLU 408 Cb 0.49 -1.63 -0.07 0.00 -0.57 0.00 0.00 31.44 29.67 1orw n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1orw s ALA 409 N -2.49 -0.39 -0.12 0.62 0.00 -1.02 -4.87 121.76 113.49 1orw s ALA 409 Ca -0.30 -0.47 -0.04 0.00 0.00 0.00 0.00 51.96 51.15 1orw s ALA 409 Cb 0.09 0.51 0.06 0.00 0.00 0.00 0.00 23.12 23.78 1orw s ALA 409 CO 0.63 -0.53 0.24 -1.17 0.00 0.00 0.00 175.76 174.93 1orw s LEU 410 N -2.79 -0.13 0.47 0.00 2.96 -1.26 -0.58 118.68 117.36 1orw s LEU 410 Ca 0.04 0.53 0.04 0.00 -0.22 0.00 0.00 54.13 54.51 1orw s LEU 410 Cb 0.04 0.61 -0.03 0.00 0.50 0.00 0.00 46.19 47.31 1orw s LEU 410 CO -0.11 -0.23 0.06 0.42 -1.32 0.00 0.00 176.35 175.18 1orw s THR 411 N 2.19 1.60 -1.24 3.68 -4.23 0.13 -4.97 115.64 112.79 1orw s THR 411 Ca -0.00 -1.91 0.12 0.00 -1.18 0.00 0.00 61.69 58.72 1orw s THR 411 Cb -0.12 -2.51 0.17 0.00 1.34 0.00 0.00 72.50 71.38 1orw s THR 411 CO -0.08 0.00 1.35 -1.54 -0.54 0.00 0.00 174.62 173.81 1orw n SER 412 N -1.22 0.00 0.00 3.99 3.41 -1.26 -3.42 113.62 115.12 1orw n SER 412 Ca -0.11 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1orw n SER 412 Cb 0.66 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1orw n SER 412 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1orw n ASP 413 N -1.38 3.51 -4.31 4.04 8.00 -1.26 -4.97 116.55 120.18 1orw n ASP 413 Ca 0.05 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.38 1orw n ASP 413 Cb 0.12 0.34 -0.10 0.00 -0.02 0.00 0.00 41.12 41.46 1orw n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1orw s TYR 414 N -1.71 1.54 -0.07 1.24 1.51 -1.22 -1.69 117.35 116.95 1orw s TYR 414 Ca 0.00 -0.64 -0.01 0.00 -1.01 0.00 0.00 57.07 55.40 1orw s TYR 414 Cb 0.00 -0.74 0.03 0.00 -0.11 0.00 0.00 41.96 41.14 1orw s TYR 414 CO 0.00 0.25 -0.00 -1.17 -1.11 0.00 0.00 175.55 173.52 1orw s LEU 415 N -3.26 0.61 -0.16 -1.29 0.20 -0.65 0.17 118.68 114.29 1orw s LEU 415 Ca 0.20 -0.09 -0.11 0.00 0.69 0.00 0.00 54.13 54.82 1orw s LEU 415 Cb 0.01 -0.45 -0.05 0.00 -0.43 0.00 0.00 46.19 45.27 1orw s LEU 415 CO 0.04 -0.19 0.21 -0.31 -0.29 0.00 0.00 176.35 175.81 1orw s TYR 416 N 1.95 3.47 0.13 5.38 1.51 0.26 -1.54 117.35 128.51 1orw s TYR 416 Ca 0.05 0.50 -0.02 0.00 -1.01 0.00 0.00 57.07 56.58 1orw s TYR 416 Cb -0.12 -2.21 -0.03 0.00 -0.11 0.00 0.00 41.96 39.49 1orw s TYR 416 CO -0.05 0.35 0.09 1.52 -1.11 0.00 0.00 175.55 176.35 1orw s TYR 417 N 0.12 0.75 -0.10 2.71 -0.85 -0.28 0.47 117.35 120.17 1orw s TYR 417 Ca 0.13 -1.14 0.01 0.00 -0.52 0.00 0.00 57.07 55.55 1orw s TYR 417 Cb -0.12 -0.40 -0.02 0.00 0.38 0.00 0.00 41.96 41.80 1orw s TYR 417 CO 0.02 -0.54 -0.13 0.42 -1.52 0.00 0.00 175.55 173.80 1orw s ILE 418 N -4.02 3.13 0.26 -3.49 1.01 0.06 -0.24 121.20 117.91 1orw s ILE 418 Ca 0.22 -0.65 -0.05 0.00 0.00 0.00 0.00 60.65 60.16 1orw s ILE 418 Cb 0.07 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 1orw s ILE 418 CO 0.01 0.55 0.36 -0.94 0.00 0.00 0.00 174.94 174.91 1orw s SER 419 N -0.02 0.36 -0.36 3.58 1.04 -1.03 0.13 113.70 117.40 1orw s SER 419 Ca -0.03 -1.27 0.05 0.00 0.48 0.00 0.00 55.95 55.18 1orw s SER 419 Cb -0.14 0.55 0.46 0.00 0.10 0.00 0.00 66.02 66.98 1orw s SER 419 CO 0.04 -1.09 1.36 -0.46 0.98 0.00 0.00 173.24 174.07 1orw n ASN 420 N -0.70 5.42 0.06 7.02 0.23 -1.04 -2.25 115.26 124.00 1orw n ASN 420 Ca 0.01 -3.76 -0.21 0.00 -0.53 0.00 0.00 54.58 50.09 1orw n ASN 420 Cb 0.63 -0.47 -0.11 0.00 -2.08 0.00 0.00 39.78 37.74 1orw n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1orw h GLU 421 N 2.12 0.68 -6.25 -3.83 4.81 -1.84 -3.29 114.58 106.97 1orw h GLU 421 Ca 0.41 -0.79 -0.69 0.00 -0.13 0.00 0.00 59.36 58.16 1orw h GLU 421 Cb 1.39 0.24 0.05 0.00 0.63 0.00 0.00 28.75 31.06 1orw h GLU 421 CO 0.91 1.35 0.47 1.58 -0.73 0.00 0.00 179.01 182.60 1orw n HIS 422 N -3.84 1.52 -2.52 0.92 -0.00 -1.26 0.33 115.22 110.36 1orw n HIS 422 Ca -0.12 0.65 -0.13 0.00 0.46 0.00 0.00 57.72 58.57 1orw n HIS 422 Cb 0.92 -2.33 -0.00 0.00 -0.12 0.00 0.00 29.99 28.46 1orw n HIS 422 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1orw n LYS 423 N 2.71 -2.37 -2.73 1.57 4.01 -1.26 -1.43 118.16 118.66 1orw n LYS 423 Ca 0.19 0.60 -0.07 0.00 -0.51 0.00 0.00 58.31 58.52 1orw n LYS 423 Cb 0.18 -5.22 -0.01 0.00 -0.51 0.00 0.00 35.03 29.47 1orw n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1orw n GLY 424 N -0.85 -0.45 3.39 0.72 0.00 0.15 -4.81 105.19 103.34 1orw n GLY 424 Ca -0.14 0.01 -0.45 0.00 0.00 0.00 0.00 46.02 45.45 1orw n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1orw s MET 425 N -5.08 3.28 0.57 1.61 -1.94 -0.51 -4.93 119.30 112.29 1orw s MET 425 Ca 0.14 -1.58 0.31 0.00 -1.71 0.00 0.00 55.69 52.84 1orw s MET 425 Cb -0.08 -4.45 1.45 0.00 2.01 0.00 0.00 34.83 33.76 1orw s MET 425 CO 0.17 -1.58 1.84 -1.00 -0.01 0.00 0.00 175.02 174.44 1orw h PRO 426 N 8.89 0.00 -0.83 2.03 0.13 -1.88 0.12 132.00 140.47 1orw h PRO 426 Ca -0.12 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.86 1orw h PRO 426 Cb 1.06 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.10 1orw h PRO 426 CO 1.05 0.00 0.19 0.41 -0.23 0.00 0.00 178.00 179.42 1orw n GLY 427 N -1.63 3.06 3.58 1.56 0.00 -1.26 -4.86 105.19 105.64 1orw n GLY 427 Ca 0.15 -0.70 -0.25 0.00 0.00 0.00 0.00 46.02 45.22 1orw n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1orw s GLY 428 N -0.58 2.04 -0.08 -0.02 0.00 0.03 -2.37 107.32 106.34 1orw s GLY 428 Ca 0.39 -1.96 -0.03 0.00 0.00 0.00 0.00 44.72 43.12 1orw s GLY 428 CO 0.10 -1.93 0.17 0.50 0.00 0.00 0.00 173.10 171.94 1orw s ARG 429 N -3.65 0.11 0.04 2.90 1.81 0.24 -4.13 118.95 116.28 1orw s ARG 429 Ca 0.33 0.44 -0.03 0.00 -1.72 0.00 0.00 55.73 54.74 1orw s ARG 429 Cb -0.01 -0.17 -0.02 0.00 -0.45 0.00 0.00 34.95 34.30 1orw s ARG 429 CO 0.18 -0.18 0.04 -0.80 -0.68 0.00 0.00 175.30 173.86 1orw s ASN 430 N 1.35 0.28 -0.16 0.23 0.01 -0.95 0.39 114.94 116.08 1orw s ASN 430 Ca -0.08 -0.69 -0.17 0.00 -0.71 0.00 0.00 52.86 51.22 1orw s ASN 430 Cb -0.11 0.21 -0.04 0.00 0.41 0.00 0.00 41.25 41.71 1orw s ASN 430 CO -0.07 -0.52 0.43 -0.22 -1.51 0.00 0.00 177.10 175.21 1orw s LEU 431 N -2.33 4.21 0.16 0.60 2.96 -1.26 -2.48 118.68 120.54 1orw s LEU 431 Ca -0.02 0.65 0.09 0.00 -0.22 0.00 0.00 54.13 54.63 1orw s LEU 431 Cb 0.01 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.07 1orw s LEU 431 CO -0.06 -0.04 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.41 1orw s TYR 432 N 0.97 1.99 -0.06 5.38 1.51 0.67 -0.52 117.35 127.28 1orw s TYR 432 Ca 0.22 -0.42 0.04 0.00 -1.01 0.00 0.00 57.07 55.90 1orw s TYR 432 Cb -0.15 -1.01 0.00 0.00 -0.11 0.00 0.00 41.96 40.69 1orw s TYR 432 CO 0.08 0.35 -0.18 0.50 -1.11 0.00 0.00 175.55 175.20 1orw s ARG 433 N -2.52 2.11 -0.02 -0.62 3.52 0.47 -1.12 118.95 120.76 1orw s ARG 433 Ca 0.15 -0.63 0.06 0.00 -0.13 0.00 0.00 55.73 55.19 1orw s ARG 433 Cb -0.08 -1.72 -0.02 0.00 -1.56 0.00 0.00 34.95 31.58 1orw s ARG 433 CO 0.07 0.17 -0.21 -1.50 -0.81 0.00 0.00 175.30 173.01 1orw s ILE 434 N 0.30 1.69 -0.24 4.11 2.07 -0.59 -0.18 121.20 128.36 1orw s ILE 434 Ca -0.11 -0.91 -0.25 0.00 -1.41 0.00 0.00 60.65 57.97 1orw s ILE 434 Cb -0.15 -1.40 -0.00 0.00 0.13 0.00 0.00 42.46 41.04 1orw s ILE 434 CO 0.04 0.48 0.86 -1.10 -1.91 0.00 0.00 174.94 173.31 1orw s GLN 435 N -0.48 4.19 0.53 3.50 -0.21 -1.02 -1.64 119.66 124.53 1orw s GLN 435 Ca 0.08 1.00 0.20 0.00 0.02 0.00 0.00 55.36 56.65 1orw s GLN 435 Cb -0.08 -3.64 1.40 0.00 1.00 0.00 0.00 33.01 31.68 1orw s GLN 435 CO -0.01 -0.53 2.16 -0.07 -2.12 0.00 0.00 175.29 174.72 1orw h LEU 436 N 9.21 0.00 -0.21 2.90 4.07 -1.67 -1.73 115.31 127.88 1orw h LEU 436 Ca -0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.74 1orw h LEU 436 Cb 1.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.83 1orw h LEU 436 CO 0.89 0.03 -0.26 -0.46 -1.08 0.00 0.00 178.44 177.56 1orw n ASN 437 N -4.28 0.59 -3.14 -0.43 0.23 -1.26 -4.69 115.26 102.27 1orw n ASN 437 Ca -0.03 -0.45 0.04 0.00 -0.53 0.00 0.00 54.58 53.61 1orw n ASN 437 Cb 0.11 0.03 -0.00 0.00 -2.08 0.00 0.00 39.78 37.85 1orw n ASN 437 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1orw s ASP 438 N -2.70 -1.34 0.00 0.53 2.15 -0.66 -5.02 116.67 109.63 1orw s ASP 438 Ca 0.21 -0.02 0.00 0.00 0.43 0.00 0.00 52.55 53.16 1orw s ASP 438 Cb 0.19 1.81 0.00 0.00 -0.30 0.00 0.00 42.92 44.62 1orw s ASP 438 CO 0.56 -0.23 0.31 -1.22 -0.17 0.00 0.00 175.17 174.43 1orw n TYR 439 N 5.11 0.00 -0.02 -5.34 4.01 -1.17 -2.34 117.16 117.40 1orw n TYR 439 Ca 0.07 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.79 1orw n TYR 439 Cb 0.56 -0.01 -0.13 0.00 -0.31 0.00 0.00 39.34 39.45 1orw n TYR 439 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1orw n THR 440 N -0.22 1.09 -3.22 -0.72 -1.04 -1.26 -4.74 114.28 104.17 1orw n THR 440 Ca 0.00 -0.72 -0.46 0.00 -2.04 0.00 0.00 64.05 60.83 1orw n THR 440 Cb 0.03 -0.56 -0.04 0.00 -1.82 0.00 0.00 70.33 67.94 1orw n THR 440 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1orw s LYS 441 N -2.86 3.14 -0.09 -2.82 1.02 -0.99 -5.01 119.74 112.12 1orw s LYS 441 Ca -0.06 -1.70 0.04 0.00 0.02 0.00 0.00 55.97 54.27 1orw s LYS 441 Cb 0.09 -4.34 -0.00 0.00 -0.52 0.00 0.00 37.83 33.05 1orw s LYS 441 CO 0.83 -1.42 -0.23 0.08 -0.92 0.00 0.00 175.35 173.69 1orw s VAL 442 N 1.81 2.17 -0.08 3.17 1.01 -1.26 -2.44 120.40 124.79 1orw s VAL 442 Ca 0.10 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 61.13 1orw s VAL 442 Cb -0.23 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.32 1orw s VAL 442 CO 0.02 0.56 -0.21 -0.89 0.00 0.00 0.00 175.10 174.58 1orw s THR 443 N 0.22 1.76 -0.54 3.92 2.01 0.75 -4.94 115.64 118.81 1orw s THR 443 Ca -0.14 -0.86 -0.22 0.00 0.31 0.00 0.00 61.69 60.77 1orw s THR 443 Cb -0.17 -1.52 0.05 0.00 0.01 0.00 0.00 72.50 70.87 1orw s THR 443 CO 0.07 0.49 0.83 0.00 -0.69 0.00 0.00 174.62 175.32 1orw h LEU 445 N 10.51 0.00 0.00 0.00 3.38 -1.16 -3.34 115.31 124.70 1orw h LEU 445 Ca -0.27 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1orw h LEU 445 Cb 1.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1orw h LEU 445 CO 1.05 0.00 -1.12 -1.54 0.09 0.00 0.00 178.44 176.91 1orw n SER 446 N -2.46 4.41 -0.39 -0.43 3.41 -1.22 -4.79 113.62 112.14 1orw n SER 446 Ca 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.58 1orw n SER 446 Cb 0.29 1.08 -0.02 0.00 -0.26 0.00 0.00 64.21 65.30 1orw n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1orw n GLU 448 N -5.35 4.37 -0.03 0.00 4.71 -1.26 -4.03 120.64 119.04 1orw n GLU 448 Ca 0.07 -2.98 -0.17 0.00 -0.01 0.00 0.00 57.16 54.07 1orw n GLU 448 Cb 0.34 -2.11 -0.07 0.00 -1.01 0.00 0.00 31.44 28.59 1orw n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1orw h LEU 449 N 3.97 0.92 -5.10 -4.62 3.38 -1.79 -3.40 115.31 108.66 1orw h LEU 449 Ca 0.00 -0.61 -0.25 0.00 0.09 0.00 0.00 57.88 57.11 1orw h LEU 449 Cb 1.74 -0.27 -0.17 0.00 0.09 0.00 0.00 40.66 42.06 1orw h LEU 449 CO 0.38 1.38 -0.55 0.59 0.09 0.00 0.00 178.44 180.33 1orw n ASN 450 N -3.99 -2.63 -0.08 -0.43 4.13 -1.26 -5.02 115.26 105.98 1orw n ASN 450 Ca -0.07 -3.23 0.26 0.00 1.68 0.00 0.00 54.58 53.22 1orw n ASN 450 Cb 0.71 1.58 0.63 0.00 -1.54 0.00 0.00 39.78 41.16 1orw n ASN 450 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1orw h PRO 451 N 4.05 0.00 0.03 3.52 0.13 -1.78 0.44 132.00 138.40 1orw h PRO 451 Ca -0.12 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.66 1orw h PRO 451 Cb 1.02 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.10 1orw h PRO 451 CO 0.33 0.00 -2.11 0.39 -0.23 0.00 0.00 178.00 176.38 1orw n GLU 452 N -3.56 0.68 -0.03 0.86 -0.58 -1.26 -4.53 120.64 112.22 1orw n GLU 452 Ca 0.16 0.18 -0.03 0.00 -0.42 0.00 0.00 57.16 57.05 1orw n GLU 452 Cb 1.07 -1.65 -0.14 0.00 -0.57 0.00 0.00 31.44 30.15 1orw n GLU 452 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1orw n ARG 453 N -3.11 0.66 -3.97 3.49 0.63 -0.65 -4.56 116.66 109.15 1orw n ARG 453 Ca -0.30 0.06 -0.31 0.00 -0.92 0.00 0.00 57.85 56.38 1orw n ARG 453 Cb 1.07 -1.64 -0.15 0.00 0.45 0.00 0.00 32.46 32.19 1orw n ARG 453 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1orw n GLN 455 N 4.53 0.66 -3.54 0.00 6.02 -0.37 -4.44 117.38 120.24 1orw n GLN 455 Ca -0.09 -0.69 -0.27 0.00 -0.01 0.00 0.00 57.00 55.94 1orw n GLN 455 Cb 0.43 -0.77 -0.15 0.00 1.02 0.00 0.00 30.24 30.77 1orw n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1orw s TYR 456 N -0.30 0.20 0.39 1.08 6.14 -1.17 -0.59 117.35 123.10 1orw s TYR 456 Ca 0.00 -0.65 0.08 0.00 0.64 0.00 0.00 57.07 57.13 1orw s TYR 456 Cb 0.00 -0.80 -0.07 0.00 0.42 0.00 0.00 41.96 41.51 1orw s TYR 456 CO 0.00 -0.76 -0.00 0.71 0.64 0.00 0.00 175.55 176.14 1orw s TYR 457 N 2.14 2.50 -0.06 4.97 1.51 0.16 -1.46 117.35 127.12 1orw s TYR 457 Ca 0.07 -0.61 -0.18 0.00 -1.01 0.00 0.00 57.07 55.34 1orw s TYR 457 Cb -0.16 -1.69 0.04 0.00 -0.11 0.00 0.00 41.96 40.04 1orw s TYR 457 CO -0.30 0.46 0.42 -1.54 -1.11 0.00 0.00 175.55 173.48 1orw s SER 458 N -3.70 -0.35 0.33 2.29 1.04 -0.89 -4.47 113.70 107.95 1orw s SER 458 Ca 0.35 0.40 0.04 0.00 0.48 0.00 0.00 55.95 57.22 1orw s SER 458 Cb 0.07 0.50 -0.06 0.00 0.10 0.00 0.00 66.02 66.63 1orw s SER 458 CO 0.18 -0.42 0.06 0.00 0.98 0.00 0.00 173.24 174.05 1orw s ALA 459 N -0.95 2.40 -0.06 5.32 0.00 -1.26 -0.60 121.76 126.61 1orw s ALA 459 Ca -0.10 -2.02 -0.03 0.00 0.00 0.00 0.00 51.96 49.81 1orw s ALA 459 Cb -0.04 0.66 0.04 0.00 0.00 0.00 0.00 23.12 23.78 1orw s ALA 459 CO 0.05 -0.31 0.12 0.45 0.00 0.00 0.00 175.76 176.07 1orw s SER 460 N -3.50 0.84 0.07 0.00 0.15 -0.43 -4.97 113.70 105.86 1orw s SER 460 Ca 0.36 0.22 0.01 0.00 0.70 0.00 0.00 55.95 57.24 1orw s SER 460 Cb 0.09 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.45 1orw s SER 460 CO 0.15 -0.24 0.16 -0.36 1.20 0.00 0.00 173.24 174.16 1orw s PHE 461 N 2.16 3.39 0.92 3.44 0.40 -1.26 0.49 117.98 127.52 1orw s PHE 461 Ca 0.03 0.18 -0.12 0.00 -0.60 0.00 0.00 56.93 56.42 1orw s PHE 461 Cb -0.12 -1.70 0.14 0.00 0.51 0.00 0.00 43.02 41.85 1orw s PHE 461 CO -0.05 0.56 1.11 -1.54 0.70 0.00 0.00 175.22 176.00 1orw s SER 462 N -2.49 3.35 0.30 1.36 1.04 0.10 -4.84 113.70 112.53 1orw s SER 462 Ca 0.33 1.19 -0.00 0.00 0.48 0.00 0.00 55.95 57.95 1orw s SER 462 Cb -0.13 -1.84 0.69 0.00 0.10 0.00 0.00 66.02 64.84 1orw s SER 462 CO 0.26 -2.68 1.56 0.59 0.98 0.00 0.00 173.24 173.95 1orw n ASN 463 N -3.88 -0.17 -0.81 7.02 5.03 0.36 -0.47 115.26 122.35 1orw n ASN 463 Ca 0.06 1.70 0.07 0.00 0.87 0.00 0.00 54.58 57.28 1orw n ASN 463 Cb 0.57 -0.59 0.22 0.00 -1.02 0.00 0.00 39.78 38.95 1orw n ASN 463 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1orw n LYS 464 N -5.53 2.96 -2.66 3.52 4.81 -1.26 -4.93 118.16 115.06 1orw n LYS 464 Ca 0.22 -2.48 -0.12 0.00 -0.87 0.00 0.00 58.31 55.06 1orw n LYS 464 Cb 0.71 -1.58 0.02 0.00 0.02 0.00 0.00 35.03 34.19 1orw n LYS 464 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1orw n ALA 465 N 0.03 -0.51 0.66 3.14 0.00 0.38 -4.90 120.51 119.31 1orw n ALA 465 Ca 0.17 0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.89 1orw n ALA 465 Cb 0.68 -2.29 0.28 0.00 0.00 0.00 0.00 19.45 18.11 1orw n ALA 465 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1orw n LYS 466 N -2.46 0.23 -3.64 0.00 4.81 -1.26 -4.63 118.16 111.21 1orw n LYS 466 Ca -0.06 0.11 -0.13 0.00 -0.87 0.00 0.00 58.31 57.36 1orw n LYS 466 Cb 0.56 -1.69 -0.06 0.00 0.02 0.00 0.00 35.03 33.87 1orw n LYS 466 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1orw s TYR 467 N -3.12 -0.30 -0.11 5.64 2.02 -1.26 -2.17 117.35 118.05 1orw s TYR 467 Ca 0.08 0.24 -0.12 0.00 -0.37 0.00 0.00 57.07 56.91 1orw s TYR 467 Cb 0.14 0.26 0.03 0.00 -0.40 0.00 0.00 41.96 41.99 1orw s TYR 467 CO 0.67 -0.61 0.32 1.52 -1.57 0.00 0.00 175.55 175.88 1orw s TYR 468 N -2.66 -0.33 -0.15 2.71 1.13 -0.40 0.03 117.35 117.68 1orw s TYR 468 Ca -0.04 0.79 -0.14 0.00 -1.41 0.00 0.00 57.07 56.27 1orw s TYR 468 Cb -0.00 0.12 -0.05 0.00 -1.10 0.00 0.00 41.96 40.93 1orw s TYR 468 CO -0.04 -0.20 0.30 -1.14 -2.51 0.00 0.00 175.55 171.97 1orw s GLN 469 N -0.03 4.22 -0.16 -3.49 0.74 0.18 -1.10 119.66 120.03 1orw s GLN 469 Ca -0.02 0.12 -0.06 0.00 0.05 0.00 0.00 55.36 55.45 1orw s GLN 469 Cb -0.03 -3.41 -0.04 0.00 1.10 0.00 0.00 33.01 30.63 1orw s GLN 469 CO 0.01 0.27 0.06 -0.51 -0.55 0.00 0.00 175.29 174.56 1orw s LEU 470 N 0.37 3.82 -0.24 3.68 1.43 -0.57 -1.32 118.68 125.86 1orw s LEU 470 Ca 0.17 0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1orw s LEU 470 Cb -0.13 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.15 1orw s LEU 470 CO 0.05 0.24 -0.04 -0.13 0.23 0.00 0.00 176.35 176.69 1orw s ARG 471 N -0.00 3.10 -0.44 1.70 3.00 0.23 -1.97 118.95 124.57 1orw s ARG 471 Ca 0.06 -0.81 -0.10 0.00 0.00 0.00 0.00 55.73 54.87 1orw s ARG 471 Cb -0.12 -3.02 0.09 0.00 0.00 0.00 0.00 34.95 31.89 1orw s ARG 471 CO 0.01 -0.31 0.30 0.00 0.00 0.00 0.00 175.30 175.30 1orw n PHE 473 N 4.98 0.00 0.00 0.00 3.01 -0.53 -0.72 117.46 124.19 1orw n PHE 473 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 1orw n PHE 473 Cb 0.43 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 1orw n PHE 473 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1orw n GLY 474 N 1.21 0.40 0.25 1.37 0.00 -1.25 0.36 105.19 107.53 1orw n GLY 474 Ca 0.18 -1.11 0.14 0.00 0.00 0.00 0.00 46.02 45.23 1orw n GLY 474 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1orw h PRO 475 N 0.00 0.00 0.00 1.61 0.13 -0.92 -0.94 132.00 131.88 1orw h PRO 475 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1orw h PRO 475 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 1orw h PRO 475 CO 0.00 0.02 0.02 0.41 -0.23 0.00 0.00 178.00 178.21 1orw n GLY 476 N 0.53 -1.86 3.74 1.56 0.00 0.07 -4.46 105.19 104.77 1orw n GLY 476 Ca 0.02 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 1orw n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1orw s LEU 477 N 0.00 4.41 0.32 0.99 1.43 -1.26 -4.58 118.68 119.99 1orw s LEU 477 Ca 0.04 2.46 -0.25 0.00 -1.03 0.00 0.00 54.13 55.35 1orw s LEU 477 Cb -0.00 -3.61 -0.15 0.00 0.03 0.00 0.00 46.19 42.46 1orw s LEU 477 CO 0.03 -0.55 0.57 -2.65 0.23 0.00 0.00 176.35 173.98 1orw n PRO 478 N 2.45 0.47 -3.69 1.29 -0.02 -1.25 -4.83 135.00 129.42 1orw n PRO 478 Ca 0.06 0.17 -0.17 0.00 -2.02 0.00 0.00 63.50 61.54 1orw n PRO 478 Cb 0.42 -1.34 -0.16 0.00 -0.02 0.00 0.00 33.50 32.40 1orw n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1orw s LEU 479 N 2.25 0.26 -0.10 2.45 2.96 0.10 -4.30 118.68 122.31 1orw s LEU 479 Ca 0.62 0.23 -0.01 0.00 -0.22 0.00 0.00 54.13 54.75 1orw s LEU 479 Cb -0.73 0.14 -0.03 0.00 0.50 0.00 0.00 46.19 46.07 1orw s LEU 479 CO 0.58 -0.22 -0.04 -0.31 -1.32 0.00 0.00 176.35 175.05 1orw s TYR 480 N 1.92 3.03 0.12 5.38 1.51 0.35 -0.90 117.35 128.76 1orw s TYR 480 Ca -0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 57.07 56.01 1orw s TYR 480 Cb -0.12 -1.80 -0.02 0.00 -0.11 0.00 0.00 41.96 39.91 1orw s TYR 480 CO -0.05 0.29 0.13 0.95 -1.11 0.00 0.00 175.55 175.76 1orw s THR 481 N -0.55 0.12 -0.11 -0.71 -4.23 -0.83 -1.38 115.64 107.96 1orw s THR 481 Ca 0.09 -1.60 0.01 0.00 -1.18 0.00 0.00 61.69 59.01 1orw s THR 481 Cb -0.12 -1.75 -0.01 0.00 1.34 0.00 0.00 72.50 71.96 1orw s THR 481 CO 0.02 -0.56 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.16 1orw s LEU 482 N -2.96 2.58 0.15 4.79 0.20 -0.35 -1.51 118.68 121.56 1orw s LEU 482 Ca 0.15 -0.36 0.07 0.00 0.69 0.00 0.00 54.13 54.68 1orw s LEU 482 Cb 0.06 -1.56 -0.04 0.00 -0.43 0.00 0.00 46.19 44.22 1orw s LEU 482 CO -0.04 0.19 -0.16 -1.00 -0.29 0.00 0.00 176.35 175.05 1orw s HIS 483 N 0.20 1.62 -0.23 5.38 3.76 -0.25 0.37 115.29 126.13 1orw s HIS 483 Ca -0.10 -0.52 -0.07 0.00 -0.15 0.00 0.00 55.06 54.23 1orw s HIS 483 Cb -0.16 -0.82 -0.03 0.00 1.11 0.00 0.00 32.58 32.69 1orw s HIS 483 CO 0.06 0.24 0.05 0.45 -0.85 0.00 0.00 174.74 174.69 1orw s SER 484 N -2.61 5.06 0.57 1.40 0.15 -1.14 -1.27 113.70 115.86 1orw s SER 484 Ca 0.13 -0.20 0.32 0.00 0.70 0.00 0.00 55.95 56.90 1orw s SER 484 Cb -0.05 -1.90 1.74 0.00 -1.71 0.00 0.00 66.02 64.10 1orw s SER 484 CO 0.05 -0.00 1.97 0.28 1.20 0.00 0.00 173.24 176.73 1orw h SER 485 N 7.99 0.00 0.00 5.45 0.02 -1.70 0.55 113.55 125.87 1orw h SER 485 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1orw h SER 485 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1orw h SER 485 CO 0.59 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.74 1orw n SER 486 N -2.76 0.00 -0.45 3.07 3.41 -1.26 -4.30 113.62 111.33 1orw n SER 486 Ca -0.02 0.59 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 1orw n SER 486 Cb 0.21 -0.42 0.36 0.00 -0.26 0.00 0.00 64.21 64.10 1orw n SER 486 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1orw n SER 487 N -1.76 1.56 -0.33 4.04 3.41 -1.20 -4.92 113.62 114.42 1orw n SER 487 Ca 0.00 -1.33 -0.04 0.00 -0.26 0.00 0.00 58.87 57.25 1orw n SER 487 Cb 0.00 0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.04 1orw n SER 487 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1orw n ASP 488 N -0.03 -4.60 -4.80 4.04 10.43 0.19 -4.92 116.55 116.87 1orw n ASP 488 Ca 0.15 0.09 -0.35 0.00 2.57 0.00 0.00 54.79 57.25 1orw n ASP 488 Cb 0.39 -3.08 -0.04 0.00 1.84 0.00 0.00 41.12 40.23 1orw n ASP 488 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 1orw s LYS 489 N -1.97 4.00 -0.45 -1.24 2.20 -1.26 -4.71 119.74 116.32 1orw s LYS 489 Ca 0.00 1.37 -0.29 0.00 -0.36 0.00 0.00 55.97 56.69 1orw s LYS 489 Cb 0.00 -2.26 0.02 0.00 -1.51 0.00 0.00 37.83 34.08 1orw s LYS 489 CO 0.00 -0.26 1.35 -2.00 -0.36 0.00 0.00 175.35 174.07 1orw s GLU 490 N -2.97 3.57 0.22 4.03 2.12 -1.26 -2.89 118.70 121.52 1orw s GLU 490 Ca 0.63 0.78 -0.04 0.00 0.36 0.00 0.00 54.97 56.70 1orw s GLU 490 Cb -0.17 -4.01 0.22 0.00 0.26 0.00 0.00 34.13 30.43 1orw s GLU 490 CO 0.21 -1.58 1.66 -0.07 -0.54 0.00 0.00 175.26 174.95 1orw h LEU 491 N 12.09 0.79 0.00 2.70 3.38 -0.43 -3.48 115.31 130.36 1orw h LEU 491 Ca -0.26 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1orw h LEU 491 Cb 1.09 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1orw h LEU 491 CO 1.11 0.95 0.00 -2.11 0.09 0.00 0.00 178.44 178.48 1orw n ARG 492 N -4.14 0.00 -3.12 1.13 1.85 -1.20 -5.00 116.66 106.19 1orw n ARG 492 Ca 0.01 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.45 1orw n ARG 492 Cb 0.40 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.74 1orw n ARG 492 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1orw s VAL 493 N -2.00 4.96 0.04 8.89 1.01 -1.26 -1.21 120.40 130.82 1orw s VAL 493 Ca 0.00 0.97 0.00 0.00 0.00 0.00 0.00 61.98 62.95 1orw s VAL 493 Cb 0.00 -3.96 -0.26 0.00 0.00 0.00 0.00 36.38 32.15 1orw s VAL 493 CO 0.00 -0.06 0.98 -0.07 0.00 0.00 0.00 175.10 175.95 1orw h LEU 494 N 9.05 0.29 -6.86 3.92 3.38 -1.56 -3.47 115.31 120.06 1orw h LEU 494 Ca -0.27 -0.37 0.11 0.00 0.09 0.00 0.00 57.88 57.44 1orw h LEU 494 Cb 1.12 -0.09 -0.24 0.00 0.09 0.00 0.00 40.66 41.54 1orw h LEU 494 CO 0.79 1.30 0.17 -0.70 0.09 0.00 0.00 178.44 180.09 1orw s GLU 495 N -2.64 0.46 0.00 1.13 2.56 -1.07 -4.98 118.70 114.15 1orw s GLU 495 Ca -0.06 0.94 0.01 0.00 0.00 0.00 0.00 54.97 55.87 1orw s GLU 495 Cb 0.08 0.34 0.01 0.00 2.00 0.00 0.00 34.13 36.56 1orw s GLU 495 CO 0.85 -0.12 0.44 -0.40 -0.56 0.00 0.00 175.26 175.47 1orw n ASP 496 N 4.51 0.89 -2.28 -1.70 5.68 -1.26 -0.50 116.55 121.90 1orw n ASP 496 Ca -0.15 -0.95 -0.20 0.00 -0.50 0.00 0.00 54.79 52.99 1orw n ASP 496 Cb 0.55 0.21 -0.02 0.00 -1.14 0.00 0.00 41.12 40.72 1orw n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1orw n ASN 497 N -0.16 -5.72 -0.24 -1.12 3.02 -1.26 -4.81 115.26 104.97 1orw n ASN 497 Ca 0.01 0.08 0.18 0.00 -0.03 0.00 0.00 54.58 54.81 1orw n ASN 497 Cb 0.03 -4.81 0.49 0.00 -0.61 0.00 0.00 39.78 34.88 1orw n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1orw h SER 498 N 0.00 0.44 0.67 6.41 4.64 -1.94 -0.96 113.55 122.80 1orw h SER 498 Ca -0.47 0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 60.86 1orw h SER 498 Cb 1.35 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1orw h SER 498 CO 0.58 0.18 -0.32 0.00 -0.87 0.00 0.00 176.83 176.40 1orw h ALA 499 N 1.61 -0.90 -0.84 5.18 0.00 -1.98 -2.21 119.26 120.12 1orw h ALA 499 Ca 0.46 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 55.32 1orw h ALA 499 Cb 1.08 0.35 -0.10 0.00 0.00 0.00 0.00 17.79 19.13 1orw h ALA 499 CO -0.18 -1.00 0.42 1.25 0.00 0.00 0.00 179.25 179.75 1orw h LEU 500 N -0.92 0.49 -1.57 0.00 5.85 -1.49 -0.52 115.31 117.15 1orw h LEU 500 Ca -0.09 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.79 1orw h LEU 500 Cb 0.70 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1orw h LEU 500 CO 0.15 0.20 0.39 -0.78 -0.34 0.00 0.00 178.44 178.06 1orw h ASP 501 N 0.59 0.46 -0.27 1.25 3.58 -0.95 -1.91 116.42 119.17 1orw h ASP 501 Ca 0.46 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.73 1orw h ASP 501 Cb 0.67 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.62 1orw h ASP 501 CO -0.37 0.30 -0.55 0.50 -2.88 0.00 0.00 179.24 176.23 1orw h LYS 502 N 0.52 0.86 0.22 0.28 1.63 -0.48 -3.15 116.57 116.45 1orw h LYS 502 Ca 0.26 -0.56 -0.01 0.00 -0.85 0.00 0.00 60.65 59.49 1orw h LYS 502 Cb 0.34 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1orw h LYS 502 CO -0.07 1.19 -0.10 0.52 -3.45 0.00 0.00 179.45 177.53 1orw h MET 503 N 0.64 -0.28 -0.04 1.90 2.86 -1.16 -3.29 114.93 115.56 1orw h MET 503 Ca 0.01 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1orw h MET 503 Cb 1.16 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.88 1orw h MET 503 CO 0.12 0.06 0.04 -0.07 1.06 0.00 0.00 176.91 178.12 1orw h LEU 504 N -0.66 0.00 -1.65 1.22 3.38 -1.46 0.05 115.31 116.19 1orw h LEU 504 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1orw h LEU 504 Cb 0.47 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1orw h LEU 504 CO 0.05 0.00 -0.11 0.06 0.09 0.00 0.00 178.44 178.53 1orw h GLN 505 N 0.00 0.00 -0.94 1.13 3.07 -1.61 -1.60 115.11 115.16 1orw h GLN 505 Ca 0.02 0.00 -0.25 0.00 0.09 0.00 0.00 58.65 58.50 1orw h GLN 505 Cb 0.09 0.00 -0.15 0.00 0.08 0.00 0.00 27.48 27.50 1orw h GLN 505 CO -0.00 0.11 0.32 -3.47 0.09 0.00 0.00 178.83 175.88 1orw n ASP 506 N -3.36 3.57 -3.69 0.06 4.64 0.00 -4.83 116.55 112.94 1orw n ASP 506 Ca -0.01 -2.91 -0.12 0.00 -1.38 0.00 0.00 54.79 50.37 1orw n ASP 506 Cb 0.30 -0.69 -0.09 0.00 -1.04 0.00 0.00 41.12 39.60 1orw n ASP 506 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1orw s VAL 507 N -2.06 -0.01 -1.14 5.18 0.11 -0.60 -4.03 120.40 117.86 1orw s VAL 507 Ca 0.35 0.02 -0.24 0.00 -2.93 0.00 0.00 61.98 59.18 1orw s VAL 507 Cb 0.29 -0.72 -0.11 0.00 -1.53 0.00 0.00 36.38 34.31 1orw s VAL 507 CO 0.07 0.01 1.98 -1.10 -3.33 0.00 0.00 175.10 172.74 1orw s GLN 508 N 0.64 2.20 0.32 1.54 -0.21 -0.26 -4.93 119.66 118.97 1orw s GLN 508 Ca -0.03 -0.92 -0.28 0.00 0.02 0.00 0.00 55.36 54.16 1orw s GLN 508 Cb -0.05 -5.17 -0.09 0.00 1.00 0.00 0.00 33.01 28.70 1orw s GLN 508 CO -0.04 -4.27 1.09 -1.64 -2.12 0.00 0.00 175.29 168.30 1orw s MET 509 N 6.97 4.48 0.69 2.91 -1.94 -1.26 -4.39 119.30 126.76 1orw s MET 509 Ca 0.72 1.73 -0.11 0.00 -1.71 0.00 0.00 55.69 56.31 1orw s MET 509 Cb -0.02 -2.99 0.00 0.00 2.01 0.00 0.00 34.83 33.84 1orw s MET 509 CO 0.13 0.09 1.07 -1.25 -0.01 0.00 0.00 175.02 175.05 1orw s PRO 510 N -1.78 2.98 0.06 2.03 0.04 -1.26 -4.60 135.00 132.48 1orw s PRO 510 Ca 0.49 0.66 0.03 0.00 0.04 0.00 0.00 61.00 62.22 1orw s PRO 510 Cb -0.29 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 1orw s PRO 510 CO 0.37 -0.99 0.05 -1.54 0.04 0.00 0.00 177.00 174.94 1orw s SER 511 N -4.14 5.40 -0.25 6.66 1.04 -0.49 -4.92 113.70 117.00 1orw s SER 511 Ca 0.58 -0.02 -0.02 0.00 0.48 0.00 0.00 55.95 56.96 1orw s SER 511 Cb -0.12 -1.43 0.02 0.00 0.10 0.00 0.00 66.02 64.59 1orw s SER 511 CO 0.53 0.20 -0.05 -0.75 0.98 0.00 0.00 173.24 174.15 1orw s LYS 512 N -2.20 2.90 -0.13 4.02 2.20 -1.26 -0.39 119.74 124.87 1orw s LYS 512 Ca 0.27 -0.94 -0.01 0.00 -0.36 0.00 0.00 55.97 54.93 1orw s LYS 512 Cb -0.12 -3.01 -0.02 0.00 -1.51 0.00 0.00 37.83 33.18 1orw s LYS 512 CO 0.19 -0.39 -0.12 0.21 -0.36 0.00 0.00 175.35 174.89 1orw s LYS 513 N 1.35 3.41 0.01 4.03 2.20 -1.03 -4.98 119.74 124.73 1orw s LYS 513 Ca 0.01 -0.67 -0.00 0.00 -0.36 0.00 0.00 55.97 54.95 1orw s LYS 513 Cb -0.16 -2.67 -0.04 0.00 -1.51 0.00 0.00 37.83 33.45 1orw s LYS 513 CO -0.04 0.21 0.12 -0.51 -0.36 0.00 0.00 175.35 174.77 1orw s LEU 514 N 0.38 4.07 0.00 5.43 1.02 -1.26 -1.94 118.68 126.37 1orw s LEU 514 Ca -0.10 0.19 -0.02 0.00 0.02 0.00 0.00 54.13 54.22 1orw s LEU 514 Cb -0.16 -2.48 0.01 0.00 0.02 0.00 0.00 46.19 43.59 1orw s LEU 514 CO 0.05 0.24 0.12 -0.67 0.02 0.00 0.00 176.35 176.11 1orw n ASP 515 N 0.91 -0.30 -4.22 2.29 4.64 -0.93 -5.01 116.55 113.93 1orw n ASP 515 Ca -0.11 -1.20 -0.13 0.00 -1.38 0.00 0.00 54.79 51.98 1orw n ASP 515 Cb 0.52 0.50 -0.10 0.00 -1.04 0.00 0.00 41.12 41.00 1orw n ASP 515 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1orw s VAL 516 N -2.78 0.82 0.16 5.18 1.01 -1.26 -2.03 120.40 121.50 1orw s VAL 516 Ca 0.02 -1.98 -0.06 0.00 0.00 0.00 0.00 61.98 59.96 1orw s VAL 516 Cb -0.01 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1orw s VAL 516 CO 0.01 -0.70 0.20 0.27 0.00 0.00 0.00 175.10 174.88 1orw s ILE 517 N -3.55 0.07 -0.18 2.22 -4.36 -0.94 -4.99 121.20 109.48 1orw s ILE 517 Ca 0.17 -1.60 -0.03 0.00 -0.26 0.00 0.00 60.65 58.93 1orw s ILE 517 Cb 0.05 -1.95 -0.02 0.00 1.25 0.00 0.00 42.46 41.79 1orw s ILE 517 CO -0.00 -0.34 -0.07 0.21 0.24 0.00 0.00 174.94 174.98 1orw s ASN 518 N -3.01 4.35 -0.04 4.36 2.47 -1.26 -1.51 114.94 120.31 1orw s ASN 518 Ca 0.21 -0.31 0.02 0.00 0.42 0.00 0.00 52.86 53.20 1orw s ASN 518 Cb 0.05 -1.71 0.01 0.00 -1.45 0.00 0.00 41.25 38.14 1orw s ASN 518 CO 0.01 0.08 -0.09 -0.76 -3.72 0.00 0.00 177.10 172.63 1orw s LEU 519 N 0.88 1.62 -1.57 3.21 1.43 -0.73 -4.75 118.68 118.77 1orw s LEU 519 Ca -0.01 -0.20 -0.14 0.00 -1.03 0.00 0.00 54.13 52.74 1orw s LEU 519 Cb -0.15 -0.61 0.10 0.00 0.03 0.00 0.00 46.19 45.56 1orw s LEU 519 CO 0.01 0.03 0.88 1.41 0.23 0.00 0.00 176.35 178.90 1orw n HIS 520 N 3.64 -2.08 -2.31 0.29 8.25 -1.26 -0.98 115.22 120.77 1orw n HIS 520 Ca -0.22 0.86 -0.21 0.00 -0.26 0.00 0.00 57.72 57.90 1orw n HIS 520 Cb 0.52 -3.67 -0.02 0.00 1.12 0.00 0.00 29.99 27.94 1orw n HIS 520 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1orw n GLY 521 N -1.61 -0.23 3.34 -1.41 0.00 -1.26 -5.00 105.19 99.02 1orw n GLY 521 Ca 0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 1orw n GLY 521 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1orw s THR 522 N -3.01 1.57 -0.61 2.61 2.01 -0.15 -5.10 115.64 112.94 1orw s THR 522 Ca 0.00 -2.16 -0.16 0.00 0.31 0.00 0.00 61.69 59.68 1orw s THR 522 Cb 0.00 -2.09 0.15 0.00 0.01 0.00 0.00 72.50 70.57 1orw s THR 522 CO 0.00 -0.56 0.58 -1.59 -0.69 0.00 0.00 174.62 172.36 1orw s LYS 523 N -3.69 3.14 -0.14 4.92 -2.85 -1.26 -1.77 119.74 118.09 1orw s LYS 523 Ca 0.23 -1.87 -0.07 0.00 -1.00 0.00 0.00 55.97 53.26 1orw s LYS 523 Cb 0.01 -4.33 -0.04 0.00 -2.06 0.00 0.00 37.83 31.40 1orw s LYS 523 CO 0.07 -1.34 0.11 -0.06 0.10 0.00 0.00 175.35 174.23 1orw s PHE 524 N 1.33 3.45 0.36 1.78 0.40 -0.57 -4.91 117.98 119.81 1orw s PHE 524 Ca 0.07 0.38 -0.17 0.00 -0.60 0.00 0.00 56.93 56.61 1orw s PHE 524 Cb -0.25 -1.98 -0.10 0.00 0.51 0.00 0.00 43.02 41.21 1orw s PHE 524 CO 0.00 0.53 0.81 -1.58 0.70 0.00 0.00 175.22 175.68 1orw s TRP 525 N -0.54 3.36 0.29 0.36 0.52 -1.26 -2.21 118.94 119.46 1orw s TRP 525 Ca 0.12 1.36 -0.06 0.00 0.02 0.00 0.00 56.10 57.54 1orw s TRP 525 Cb -0.12 -2.64 -0.01 0.00 -1.15 0.00 0.00 33.47 29.55 1orw s TRP 525 CO 0.02 0.03 0.43 1.52 0.02 0.00 0.00 176.95 178.97 1orw s TYR 526 N -2.04 0.84 -0.04 -1.98 -0.85 -0.86 -2.01 117.35 110.42 1orw s TYR 526 Ca 0.56 -1.12 -0.15 0.00 -0.52 0.00 0.00 57.07 55.85 1orw s TYR 526 Cb -0.10 -0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.21 1orw s TYR 526 CO 0.16 -1.02 0.33 1.14 -1.52 0.00 0.00 175.55 174.64 1orw s GLN 527 N -3.51 0.62 -0.07 -3.49 -2.07 -0.67 -2.18 119.66 108.29 1orw s GLN 527 Ca 0.29 -0.02 0.01 0.00 -1.82 0.00 0.00 55.36 53.82 1orw s GLN 527 Cb 0.01 0.28 0.02 0.00 -1.09 0.00 0.00 33.01 32.23 1orw s GLN 527 CO 0.15 -0.16 -0.08 -1.64 -1.32 0.00 0.00 175.29 172.25 1orw s MET 528 N -0.97 1.27 -0.63 9.60 -1.94 -0.82 -1.45 119.30 124.35 1orw s MET 528 Ca -0.10 -0.23 -0.21 0.00 -1.71 0.00 0.00 55.69 53.43 1orw s MET 528 Cb -0.04 -1.19 0.08 0.00 2.01 0.00 0.00 34.83 35.68 1orw s MET 528 CO 0.04 -0.09 0.87 0.42 -0.01 0.00 0.00 175.02 176.25 1orw s ILE 529 N 1.03 4.50 0.16 2.53 -1.09 0.16 -2.47 121.20 126.02 1orw s ILE 529 Ca -0.09 -0.56 -0.25 0.00 -2.23 0.00 0.00 60.65 57.53 1orw s ILE 529 Cb -0.14 -4.61 -0.08 0.00 -1.58 0.00 0.00 42.46 36.05 1orw s ILE 529 CO -0.00 -1.33 0.76 -0.76 -1.23 0.00 0.00 174.94 172.38 1orw s LEU 530 N 3.58 4.59 0.76 2.97 1.43 0.48 -2.60 118.68 129.89 1orw s LEU 530 Ca 0.19 1.62 -0.14 0.00 -1.03 0.00 0.00 54.13 54.77 1orw s LEU 530 Cb -0.19 -3.27 0.05 0.00 0.03 0.00 0.00 46.19 42.81 1orw s LEU 530 CO 0.09 0.21 1.16 -2.84 0.23 0.00 0.00 176.35 175.20 1orw s PRO 531 N -1.10 2.05 0.89 1.29 0.02 -1.26 -1.39 135.00 135.50 1orw s PRO 531 Ca 0.35 1.59 -0.14 0.00 0.02 0.00 0.00 61.00 62.82 1orw s PRO 531 Cb -0.23 -1.84 0.02 0.00 0.02 0.00 0.00 34.50 32.47 1orw s PRO 531 CO 0.26 -1.86 0.46 -2.30 -0.33 0.00 0.00 177.00 173.22 1orw n PRO 532 N -3.05 -0.11 -4.01 5.54 -0.02 -1.26 -2.74 135.00 129.36 1orw n PRO 532 Ca 0.12 0.01 -0.27 0.00 -2.02 0.00 0.00 63.50 61.34 1orw n PRO 532 Cb 0.51 -1.86 -0.07 0.00 -0.02 0.00 0.00 33.50 32.06 1orw n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1orw n HIS 533 N -3.25 -1.05 -1.52 6.00 8.25 -1.26 -4.77 115.22 117.62 1orw n HIS 533 Ca 0.08 0.45 -0.41 0.00 -0.26 0.00 0.00 57.72 57.58 1orw n HIS 533 Cb 0.52 -2.31 0.02 0.00 1.12 0.00 0.00 29.99 29.35 1orw n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1orw n PHE 534 N -4.01 0.10 -3.54 4.41 7.35 -1.11 -4.96 117.46 115.70 1orw n PHE 534 Ca -0.25 0.55 -0.28 0.00 -0.76 0.00 0.00 57.45 56.71 1orw n PHE 534 Cb 0.56 -2.07 -0.11 0.00 0.35 0.00 0.00 39.48 38.21 1orw n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1orw s ASP 535 N -0.94 2.65 0.81 -2.13 2.15 -1.26 -5.10 116.67 112.85 1orw s ASP 535 Ca 0.65 -2.95 -0.14 0.00 0.43 0.00 0.00 52.55 50.54 1orw s ASP 535 Cb -0.55 -0.73 0.01 0.00 -0.30 0.00 0.00 42.92 41.35 1orw s ASP 535 CO 0.56 -0.20 0.65 2.29 -0.17 0.00 0.00 175.17 178.30 1orw n LYS 536 N 3.06 0.10 0.00 4.34 2.85 -1.26 -1.51 118.16 125.74 1orw n LYS 536 Ca 0.21 0.09 0.00 0.00 -1.05 0.00 0.00 58.31 57.56 1orw n LYS 536 Cb 0.41 -1.98 0.00 0.00 -0.65 0.00 0.00 35.03 32.81 1orw n LYS 536 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1orw n SER 537 N -1.28 0.00 -4.85 -5.58 7.64 -1.26 -5.01 113.62 103.28 1orw n SER 537 Ca 0.10 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.65 1orw n SER 537 Cb 0.51 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.65 1orw n SER 537 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1orw s LYS 538 N 0.00 4.02 -0.47 1.43 2.20 -0.57 -4.89 119.74 121.46 1orw s LYS 538 Ca 0.00 0.64 -0.15 0.00 -0.36 0.00 0.00 55.97 56.10 1orw s LYS 538 Cb 0.00 -2.57 0.07 0.00 -1.51 0.00 0.00 37.83 33.82 1orw s LYS 538 CO 0.00 0.24 0.38 0.15 -0.36 0.00 0.00 175.35 175.76 1orw s LYS 539 N -2.72 2.95 0.36 4.03 1.02 -1.26 -4.30 119.74 119.82 1orw s LYS 539 Ca 0.50 -1.35 -0.09 0.00 0.02 0.00 0.00 55.97 55.06 1orw s LYS 539 Cb -0.12 -4.10 -0.06 0.00 -0.52 0.00 0.00 37.83 33.03 1orw s LYS 539 CO 0.19 -1.01 0.70 0.71 -0.92 0.00 0.00 175.35 175.01 1orw s TYR 540 N 1.63 3.46 0.48 3.18 1.51 0.12 -4.53 117.35 123.20 1orw s TYR 540 Ca 0.04 0.93 -0.17 0.00 -1.01 0.00 0.00 57.07 56.86 1orw s TYR 540 Cb -0.24 -2.34 -0.09 0.00 -0.11 0.00 0.00 41.96 39.18 1orw s TYR 540 CO 0.06 -0.00 0.95 -1.25 -1.11 0.00 0.00 175.55 174.20 1orw s PRO 541 N -3.68 4.01 -0.06 -1.71 0.04 -1.26 -0.89 135.00 131.45 1orw s PRO 541 Ca 0.49 0.94 0.05 0.00 0.04 0.00 0.00 61.00 62.53 1orw s PRO 541 Cb -0.10 -2.18 -0.01 0.00 0.04 0.00 0.00 34.50 32.25 1orw s PRO 541 CO 0.30 -0.17 -0.23 -1.17 0.04 0.00 0.00 177.00 175.77 1orw s LEU 542 N -3.78 2.03 -0.14 -3.56 2.96 -0.39 -1.70 118.68 114.11 1orw s LEU 542 Ca 0.59 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.04 1orw s LEU 542 Cb -0.10 -1.28 0.01 0.00 0.50 0.00 0.00 46.19 45.32 1orw s LEU 542 CO 0.26 0.21 -0.21 -0.22 -1.32 0.00 0.00 176.35 175.07 1orw s LEU 543 N -0.04 2.07 -0.26 -0.68 2.96 0.40 -0.34 118.68 122.78 1orw s LEU 543 Ca -0.06 -0.59 -0.10 0.00 -0.22 0.00 0.00 54.13 53.16 1orw s LEU 543 Cb -0.14 -1.41 -0.05 0.00 0.50 0.00 0.00 46.19 45.10 1orw s LEU 543 CO 0.04 0.07 0.16 -0.63 -1.32 0.00 0.00 176.35 174.68 1orw s ILE 544 N 0.83 5.15 -0.23 6.68 -1.09 0.15 -0.75 121.20 131.94 1orw s ILE 544 Ca -0.07 0.11 -0.10 0.00 -2.23 0.00 0.00 60.65 58.36 1orw s ILE 544 Cb -0.15 -3.43 -0.05 0.00 -1.58 0.00 0.00 42.46 37.24 1orw s ILE 544 CO -0.02 0.29 0.15 -0.70 -1.23 0.00 0.00 174.94 173.44 1orw s GLU 545 N 1.53 4.10 0.02 2.79 2.12 0.34 -0.32 118.70 129.27 1orw s GLU 545 Ca 0.07 -0.26 0.01 0.00 0.36 0.00 0.00 54.97 55.15 1orw s GLU 545 Cb -0.15 -3.51 -0.01 0.00 0.26 0.00 0.00 34.13 30.71 1orw s GLU 545 CO 0.08 0.11 -0.05 0.54 -0.54 0.00 0.00 175.26 175.40 1orw s VAL 546 N 0.91 0.36 0.04 3.70 0.11 -0.61 -4.22 120.40 120.69 1orw s VAL 546 Ca 0.08 -0.60 -0.01 0.00 -2.93 0.00 0.00 61.98 58.52 1orw s VAL 546 Cb -0.13 -0.39 -0.00 0.00 -1.53 0.00 0.00 36.38 34.33 1orw s VAL 546 CO 0.03 -0.17 -0.01 0.00 -3.33 0.00 0.00 175.10 171.62 1orw n TYR 547 N 2.23 0.00 -0.51 1.54 9.36 -1.26 -4.26 117.16 124.26 1orw n TYR 547 Ca -0.18 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.04 1orw n TYR 547 Cb 0.57 -0.02 0.00 0.00 -0.63 0.00 0.00 39.34 39.26 1orw n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1orw n ALA 548 N -3.02 0.00 -1.29 2.98 0.00 -1.26 -2.97 120.51 114.95 1orw n ALA 548 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 1orw n ALA 548 Cb 0.02 -0.44 0.06 0.00 0.00 0.00 0.00 19.45 19.09 1orw n ALA 548 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 549 N -2.00 -1.61 3.68 0.00 0.00 -1.26 -4.75 105.19 99.26 1orw n GLY 549 Ca 0.00 -0.35 -0.45 0.00 0.00 0.00 0.00 46.02 45.22 1orw n GLY 549 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1orw n PRO 550 N -0.52 2.41 -1.04 1.61 -0.04 -1.26 -1.44 135.00 134.72 1orw n PRO 550 Ca 0.10 0.88 -0.01 0.00 -0.04 0.00 0.00 63.50 64.42 1orw n PRO 550 Cb 0.49 -2.73 -0.01 0.00 -0.04 0.00 0.00 33.50 31.22 1orw n PRO 550 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1orw s SER 552 N -2.62 4.36 -0.27 0.00 1.04 -0.52 -3.58 113.70 112.10 1orw s SER 552 Ca 0.00 0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.90 1orw s SER 552 Cb 0.00 -0.93 0.15 0.00 0.10 0.00 0.00 66.02 65.34 1orw s SER 552 CO 0.00 -1.93 0.41 -1.58 0.98 0.00 0.00 173.24 171.12 1orw s GLN 553 N -5.47 0.40 0.04 4.02 0.74 -1.26 -1.65 119.66 116.48 1orw s GLN 553 Ca 0.64 0.32 0.17 0.00 0.05 0.00 0.00 55.36 56.53 1orw s GLN 553 Cb -0.09 -0.32 -0.15 0.00 1.10 0.00 0.00 33.01 33.55 1orw s GLN 553 CO 0.48 -0.88 0.77 1.63 -0.55 0.00 0.00 175.29 176.74 1orw n LYS 554 N 5.36 0.63 -3.16 1.67 4.76 -1.26 -4.76 118.16 121.40 1orw n LYS 554 Ca -0.01 0.21 -0.44 0.00 -2.87 0.00 0.00 58.31 55.20 1orw n LYS 554 Cb 0.50 -1.79 -0.06 0.00 -1.84 0.00 0.00 35.03 31.84 1orw n LYS 554 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1orw s VAL 555 N -2.90 4.87 0.24 -0.18 1.01 -1.26 -4.95 120.40 117.23 1orw s VAL 555 Ca -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1orw s VAL 555 Cb 0.09 -4.30 -0.00 0.00 0.00 0.00 0.00 36.38 32.17 1orw s VAL 555 CO 0.82 -0.80 0.30 -0.90 0.00 0.00 0.00 175.10 174.52 1orw n ASP 556 N 6.17 -0.83 -1.24 3.32 5.68 -1.26 -4.40 116.55 123.98 1orw n ASP 556 Ca -0.06 -2.37 -0.03 0.00 -0.50 0.00 0.00 54.79 51.83 1orw n ASP 556 Cb 0.45 1.61 0.22 0.00 -1.14 0.00 0.00 41.12 42.27 1orw n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1orw n THR 557 N -0.41 2.57 -2.74 2.12 -2.24 -1.00 -5.00 114.28 107.57 1orw n THR 557 Ca 0.02 -2.35 -0.41 0.00 -2.27 0.00 0.00 64.05 59.04 1orw n THR 557 Cb 0.41 -0.32 -0.04 0.00 -2.10 0.00 0.00 70.33 68.28 1orw n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1orw s VAL 558 N -3.12 4.58 -0.01 2.28 1.01 -1.26 -1.80 120.40 122.08 1orw s VAL 558 Ca 0.46 2.04 -0.30 0.00 0.00 0.00 0.00 61.98 64.18 1orw s VAL 558 Cb 0.40 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1orw s VAL 558 CO 0.04 0.29 1.15 0.12 0.00 0.00 0.00 175.10 176.70 1orw s PHE 559 N 0.17 3.38 -0.02 5.22 5.36 0.16 -4.90 117.98 127.35 1orw s PHE 559 Ca 0.47 1.36 -0.01 0.00 -0.96 0.00 0.00 56.93 57.79 1orw s PHE 559 Cb -0.23 -3.35 0.02 0.00 -0.34 0.00 0.00 43.02 39.12 1orw s PHE 559 CO 0.29 -1.00 0.04 1.03 -1.46 0.00 0.00 175.22 174.12 1orw s ARG 560 N 1.60 -0.01 -0.72 10.12 0.52 -1.26 -4.91 118.95 124.28 1orw s ARG 560 Ca 0.56 0.17 -0.15 0.00 -0.52 0.00 0.00 55.73 55.78 1orw s ARG 560 Cb -0.25 -0.17 0.17 0.00 0.52 0.00 0.00 34.95 35.22 1orw s ARG 560 CO 0.25 -0.12 0.70 -0.51 0.02 0.00 0.00 175.30 175.64 1orw s LEU 561 N 0.79 6.34 0.00 2.53 1.02 -1.26 -4.87 118.68 123.23 1orw s LEU 561 Ca -0.06 -2.25 0.00 0.00 0.02 0.00 0.00 54.13 51.84 1orw s LEU 561 Cb -0.09 -2.23 0.00 0.00 0.02 0.00 0.00 46.19 43.89 1orw s LEU 561 CO -0.02 -0.75 0.00 -1.54 0.02 0.00 0.00 176.35 174.06 1orw n SER 562 N 4.77 1.38 -0.00 2.29 3.41 -1.26 -4.99 113.62 119.21 1orw n SER 562 Ca 0.04 -0.95 -0.13 0.00 -0.26 0.00 0.00 58.87 57.56 1orw n SER 562 Cb 0.44 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.39 1orw n SER 562 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 1orw h TRP 563 N 0.66 0.83 -0.73 7.33 7.01 -1.96 -2.96 115.95 126.12 1orw h TRP 563 Ca 0.00 -0.34 -0.01 0.00 2.11 0.00 0.00 58.89 60.65 1orw h TRP 563 Cb 0.00 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 26.89 1orw h TRP 563 CO 0.00 1.12 0.43 0.00 -2.79 0.00 0.00 178.44 177.20 1orw h ALA 564 N 0.79 1.37 -0.15 2.65 0.00 -1.97 0.21 119.26 122.15 1orw h ALA 564 Ca -0.02 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1orw h ALA 564 Cb 1.26 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1orw h ALA 564 CO 0.13 0.53 -0.28 1.15 0.00 0.00 0.00 179.25 180.79 1orw h THR 565 N 1.01 0.35 -0.17 0.00 2.02 -1.85 0.19 112.91 114.46 1orw h THR 565 Ca 0.26 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.45 1orw h THR 565 Cb -0.02 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 66.73 1orw h THR 565 CO -0.05 0.00 0.08 0.22 0.37 0.00 0.00 175.52 176.14 1orw h TYR 566 N -0.34 0.14 -1.00 3.16 3.20 -1.33 0.19 116.97 121.00 1orw h TYR 566 Ca 0.11 0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.17 1orw h TYR 566 Cb 0.50 -0.04 -0.10 0.00 1.54 0.00 0.00 36.73 38.63 1orw h TYR 566 CO -0.38 0.08 0.62 -0.07 -1.64 0.00 0.00 178.16 176.76 1orw h LEU 567 N 0.17 0.79 0.12 2.82 3.38 0.06 0.13 115.31 122.77 1orw h LEU 567 Ca 0.07 0.09 -0.34 0.00 0.09 0.00 0.00 57.88 57.79 1orw h LEU 567 Cb 0.02 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1orw h LEU 567 CO -0.05 0.29 -1.84 0.00 0.09 0.00 0.00 178.44 176.94 1orw h ALA 568 N 1.63 0.42 -0.26 1.53 0.00 -0.31 -1.38 119.26 120.89 1orw h ALA 568 Ca 0.57 -1.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.02 1orw h ALA 568 Cb 0.87 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1orw h ALA 568 CO -0.36 1.28 -0.40 1.03 0.00 0.00 0.00 179.25 180.80 1orw h SER 569 N 0.07 0.80 0.00 0.00 0.87 -0.36 -3.06 113.55 111.87 1orw h SER 569 Ca -0.36 -0.52 -0.08 0.00 -1.23 0.00 0.00 61.79 59.60 1orw h SER 569 Cb 2.04 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 63.76 1orw h SER 569 CO 0.12 1.16 -1.10 0.41 -0.53 0.00 0.00 176.83 176.89 1orw n THR 570 N -4.18 1.48 1.68 2.23 -1.04 0.43 -4.54 114.28 110.34 1orw n THR 570 Ca -0.05 0.07 0.15 0.00 -2.04 0.00 0.00 64.05 62.18 1orw n THR 570 Cb 0.54 -2.27 0.82 0.00 -1.82 0.00 0.00 70.33 67.60 1orw n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1orw n GLU 571 N -4.47 0.75 -3.75 -2.82 -0.58 -1.06 -4.91 120.64 103.79 1orw n GLU 571 Ca -0.19 0.01 -0.26 0.00 -0.42 0.00 0.00 57.16 56.29 1orw n GLU 571 Cb 0.51 -1.50 0.05 0.00 -0.57 0.00 0.00 31.44 29.93 1orw n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1orw n ASN 572 N -1.10 -5.08 -4.61 1.62 4.13 -0.90 -4.93 115.26 104.38 1orw n ASN 572 Ca 0.19 -0.68 -0.34 0.00 1.68 0.00 0.00 54.58 55.43 1orw n ASN 572 Cb 0.15 -4.43 -0.11 0.00 -1.54 0.00 0.00 39.78 33.85 1orw n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1orw s ILE 573 N -3.34 4.07 -0.03 2.41 1.01 -0.57 -4.49 121.20 120.25 1orw s ILE 573 Ca 0.56 -0.33 -0.27 0.00 0.00 0.00 0.00 60.65 60.61 1orw s ILE 573 Cb -0.26 -2.72 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 1orw s ILE 573 CO 0.78 0.58 0.86 -0.63 0.00 0.00 0.00 174.94 176.53 1orw s ILE 574 N -0.57 4.94 -0.23 2.92 1.01 -0.69 -3.46 121.20 125.13 1orw s ILE 574 Ca 0.09 1.79 -0.03 0.00 0.00 0.00 0.00 60.65 62.50 1orw s ILE 574 Cb -0.12 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.16 1orw s ILE 574 CO 0.02 0.19 -0.05 -0.69 0.00 0.00 0.00 174.94 174.41 1orw s VAL 575 N 0.98 3.14 0.15 2.92 1.01 -1.07 -0.46 120.40 127.08 1orw s VAL 575 Ca 0.46 -0.70 0.10 0.00 0.00 0.00 0.00 61.98 61.83 1orw s VAL 575 Cb -0.19 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 1orw s VAL 575 CO 0.23 0.35 -0.22 0.00 0.00 0.00 0.00 175.10 175.46 1orw s ALA 576 N 1.42 2.19 0.04 5.51 0.00 0.07 0.40 121.76 131.40 1orw s ALA 576 Ca 0.04 -1.48 0.05 0.00 0.00 0.00 0.00 51.96 50.58 1orw s ALA 576 Cb -0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1orw s ALA 576 CO -0.04 0.38 -0.15 -1.12 0.00 0.00 0.00 175.76 174.83 1orw s SER 577 N -2.38 1.77 -0.02 0.00 0.01 -0.53 -0.51 113.70 112.04 1orw s SER 577 Ca 0.15 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.92 1orw s SER 577 Cb -0.08 -0.11 0.03 0.00 0.21 0.00 0.00 66.02 66.07 1orw s SER 577 CO 0.07 0.03 0.03 0.12 0.41 0.00 0.00 173.24 173.90 1orw s PHE 578 N -0.90 0.04 -0.49 2.43 5.36 -1.26 -1.66 117.98 121.50 1orw s PHE 578 Ca 0.02 0.12 -0.12 0.00 -0.96 0.00 0.00 56.93 55.99 1orw s PHE 578 Cb -0.08 -0.25 0.11 0.00 -0.34 0.00 0.00 43.02 42.46 1orw s PHE 578 CO 0.01 -0.09 0.39 -0.51 -1.46 0.00 0.00 175.22 173.56 1orw s ASP 579 N 1.08 5.92 0.00 6.13 1.01 -0.85 -4.86 116.67 125.09 1orw s ASP 579 Ca -0.09 -1.72 0.00 0.00 0.71 0.00 0.00 52.55 51.45 1orw s ASP 579 Cb -0.13 -2.10 0.00 0.00 1.01 0.00 0.00 42.92 41.70 1orw s ASP 579 CO -0.03 -0.72 0.00 0.61 0.21 0.00 0.00 175.17 175.25 1orw n GLY 580 N 5.07 1.90 3.76 0.21 0.00 -1.26 -4.19 105.19 110.68 1orw n GLY 580 Ca -0.11 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 1orw n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1orw s ARG 581 N 4.43 4.16 0.00 1.61 3.00 -1.26 -2.47 118.95 128.42 1orw s ARG 581 Ca 0.00 2.50 0.00 0.00 0.00 0.00 0.00 55.73 58.23 1orw s ARG 581 Cb 0.00 -3.02 0.00 0.00 0.00 0.00 0.00 34.95 31.93 1orw s ARG 581 CO 0.00 -0.51 0.00 0.41 0.00 0.00 0.00 175.30 175.20 1orw n GLY 582 N 1.34 3.25 3.63 -3.53 0.00 -0.09 -3.93 105.19 105.87 1orw n GLY 582 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1orw n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1orw s SER 583 N -0.80 2.28 0.52 1.61 1.04 -1.03 0.43 113.70 117.75 1orw s SER 583 Ca 0.00 1.36 0.05 0.00 0.48 0.00 0.00 55.95 57.83 1orw s SER 583 Cb 0.00 -2.05 0.02 0.00 0.10 0.00 0.00 66.02 64.09 1orw s SER 583 CO 0.00 -3.37 0.29 -0.83 0.98 0.00 0.00 173.24 170.31 1orw s GLY 584 N -3.17 2.52 -0.49 7.32 0.00 -0.66 -3.32 107.32 109.52 1orw s GLY 584 Ca 0.66 -1.13 0.00 0.00 0.00 0.00 0.00 44.72 44.25 1orw s GLY 584 CO 0.59 -1.99 0.00 -1.72 0.00 0.00 0.00 173.10 169.98 1orw n TYR 585 N -1.59 0.00 -0.44 1.90 4.01 -1.26 -4.87 117.16 114.91 1orw n TYR 585 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 1orw n TYR 585 Cb 0.65 -1.20 0.00 0.00 -0.31 0.00 0.00 39.34 38.48 1orw n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1orw n GLN 586 N -2.51 1.69 0.00 -0.72 6.02 -1.26 -4.42 117.38 116.18 1orw n GLN 586 Ca -0.05 -1.07 0.00 0.00 -0.01 0.00 0.00 57.00 55.88 1orw n GLN 586 Cb 0.20 -0.78 0.00 0.00 1.02 0.00 0.00 30.24 30.67 1orw n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1orw n GLY 587 N -0.28 2.43 0.28 1.08 0.00 -1.26 -4.66 105.19 102.78 1orw n GLY 587 Ca 0.00 -1.83 0.02 0.00 0.00 0.00 0.00 46.02 44.21 1orw n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1orw h ASP 588 N 0.00 0.41 -0.95 1.61 5.19 -0.29 -2.52 116.42 119.87 1orw h ASP 588 Ca 0.00 -0.05 0.11 0.00 -0.62 0.00 0.00 57.03 56.47 1orw h ASP 588 Cb 0.00 -0.10 -0.07 0.00 0.18 0.00 0.00 39.33 39.33 1orw h ASP 588 CO 0.00 0.41 0.61 0.50 -3.12 0.00 0.00 179.24 177.64 1orw h LYS 589 N 0.45 0.92 0.03 3.56 3.64 -1.88 0.18 116.57 123.47 1orw h LYS 589 Ca 0.11 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1orw h LYS 589 Cb 0.16 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1orw h LYS 589 CO -0.01 0.61 -0.01 0.82 -2.27 0.00 0.00 179.45 178.59 1orw h ILE 590 N 0.95 1.21 0.89 2.00 1.08 -1.76 -3.33 117.51 118.55 1orw h ILE 590 Ca 0.45 -1.77 -0.04 0.00 -0.39 0.00 0.00 64.86 63.11 1orw h ILE 590 Cb 0.45 2.23 0.01 0.00 -3.07 0.00 0.00 36.82 36.44 1orw h ILE 590 CO -0.21 0.39 -0.43 -0.03 -0.69 0.00 0.00 178.15 177.18 1orw h MET 591 N -0.95 -1.15 0.00 2.37 4.05 -1.18 -0.18 114.93 117.90 1orw h MET 591 Ca -0.00 0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1orw h MET 591 Cb 0.67 0.26 0.00 0.00 -0.80 0.00 0.00 31.60 31.73 1orw h MET 591 CO 0.01 -0.77 0.00 0.72 0.23 0.00 0.00 176.91 177.10 1orw n HIS 592 N -5.20 0.00 0.19 1.39 8.25 0.60 -3.57 115.22 116.87 1orw n HIS 592 Ca -0.15 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.43 1orw n HIS 592 Cb 0.47 0.00 0.67 0.00 1.12 0.00 0.00 29.99 32.25 1orw n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1orw h ALA 593 N 2.32 2.11 -0.67 -1.41 0.00 -1.65 -1.67 119.26 118.30 1orw h ALA 593 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1orw h ALA 593 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1orw h ALA 593 CO 0.00 -0.20 0.00 0.44 0.00 0.00 0.00 179.25 179.49 1orw n ILE 594 N -4.43 1.57 -1.68 0.00 -5.35 -1.23 -4.92 119.36 103.31 1orw n ILE 594 Ca 0.01 -1.11 -0.44 0.00 -0.27 0.00 0.00 62.75 60.94 1orw n ILE 594 Cb 0.25 0.22 -0.04 0.00 -1.74 0.00 0.00 39.64 38.33 1orw n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1orw n ASN 595 N 1.28 3.74 -0.18 7.28 4.05 -0.63 -0.94 115.26 129.86 1orw n ASN 595 Ca 0.25 1.01 -0.02 0.00 0.45 0.00 0.00 54.58 56.26 1orw n ASN 595 Cb 0.81 -1.49 -0.01 0.00 1.23 0.00 0.00 39.78 40.32 1orw n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1orw n ARG 596 N 5.33 -0.98 -2.72 1.20 1.74 0.57 -4.86 116.66 116.95 1orw n ARG 596 Ca 0.19 0.39 -0.09 0.00 -0.77 0.00 0.00 57.85 57.57 1orw n ARG 596 Cb 0.34 -4.21 0.06 0.00 -1.02 0.00 0.00 32.46 27.63 1orw n ARG 596 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1orw n ARG 597 N -1.29 1.14 -1.86 5.56 1.85 -0.11 -4.84 116.66 117.11 1orw n ARG 597 Ca -0.02 -2.67 -0.39 0.00 -1.00 0.00 0.00 57.85 53.78 1orw n ARG 597 Cb 0.28 -0.83 0.03 0.00 -1.05 0.00 0.00 32.46 30.89 1orw n ARG 597 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1orw s LEU 598 N -3.05 3.93 0.00 2.89 1.43 -1.21 -3.11 118.68 119.57 1orw s LEU 598 Ca 0.26 2.73 0.00 0.00 -1.03 0.00 0.00 54.13 56.09 1orw s LEU 598 Cb 0.42 -4.19 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1orw s LEU 598 CO -0.02 -1.39 0.00 0.61 0.23 0.00 0.00 176.35 175.78 1orw n GLY 599 N 0.66 0.50 0.00 -3.19 0.00 -1.26 -4.84 105.19 97.07 1orw n GLY 599 Ca 0.09 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1orw n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1orw n THR 600 N -3.20 0.00 -0.31 2.61 -2.24 -1.18 -4.79 114.28 105.17 1orw n THR 600 Ca 0.00 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.95 1orw n THR 600 Cb 0.19 0.00 0.35 0.00 -2.10 0.00 0.00 70.33 68.77 1orw n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1orw h PHE 601 N 0.00 0.49 -0.60 4.78 0.04 -1.93 0.35 116.94 120.06 1orw h PHE 601 Ca 0.00 0.05 -0.09 0.00 2.80 0.00 0.00 57.97 60.73 1orw h PHE 601 Cb 0.00 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1orw h PHE 601 CO 0.00 -0.24 0.03 1.05 -0.60 0.00 0.00 178.31 178.55 1orw h GLU 602 N 0.21 1.03 -0.01 1.51 9.09 -1.93 0.80 114.58 125.28 1orw h GLU 602 Ca 0.62 -0.30 -0.24 0.00 0.05 0.00 0.00 59.36 59.49 1orw h GLU 602 Cb 1.33 -0.11 0.02 0.00 -1.65 0.00 0.00 28.75 28.34 1orw h GLU 602 CO -0.68 0.99 -0.95 -0.24 0.05 0.00 0.00 179.01 178.19 1orw h VAL 603 N 0.95 1.30 -0.47 -1.06 3.04 -1.47 -2.39 116.25 116.16 1orw h VAL 603 Ca 0.18 -2.19 0.02 0.00 -1.01 0.00 0.00 66.70 63.70 1orw h VAL 603 Cb 0.50 2.39 -0.03 0.00 -2.01 0.00 0.00 31.29 32.15 1orw h VAL 603 CO 0.02 0.67 0.31 -0.33 -1.01 0.00 0.00 177.57 177.24 1orw h GLU 604 N 0.32 0.54 0.00 4.17 5.08 -0.05 -1.14 114.58 123.50 1orw h GLU 604 Ca -0.12 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1orw h GLU 604 Cb 1.61 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.73 1orw h GLU 604 CO 0.19 0.36 -0.27 -0.44 -1.00 0.00 0.00 179.01 177.84 1orw h ASP 605 N 0.56 0.00 -0.02 1.42 5.19 0.76 -2.43 116.42 121.90 1orw h ASP 605 Ca 0.19 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.38 1orw h ASP 605 Cb 0.06 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.57 1orw h ASP 605 CO -0.05 0.27 -0.77 1.56 -3.12 0.00 0.00 179.24 177.13 1orw h GLN 606 N 0.00 0.68 0.07 3.56 1.08 -0.69 -2.69 115.11 117.11 1orw h GLN 606 Ca -0.00 -0.56 -0.00 0.00 -1.45 0.00 0.00 58.65 56.64 1orw h GLN 606 Cb 0.95 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.50 1orw h GLN 606 CO 0.04 1.17 -0.03 0.82 -0.95 0.00 0.00 178.83 179.87 1orw h ILE 607 N 0.46 1.16 -0.46 2.54 2.04 -1.37 -1.37 117.51 120.51 1orw h ILE 607 Ca -0.05 -0.85 0.06 0.00 1.00 0.00 0.00 64.86 65.02 1orw h ILE 607 Cb 1.38 1.71 -0.05 0.00 -0.74 0.00 0.00 36.82 39.13 1orw h ILE 607 CO 0.15 0.21 0.17 -0.08 0.00 0.00 0.00 178.15 178.60 1orw h GLU 608 N -0.48 0.33 -0.18 2.37 4.22 -1.52 0.87 114.58 120.20 1orw h GLU 608 Ca -0.01 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.41 1orw h GLU 608 Cb 0.41 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1orw h GLU 608 CO 0.02 0.22 0.11 0.00 -2.18 0.00 0.00 179.01 177.18 1orw h ALA 609 N 1.30 0.23 -0.31 2.92 0.00 -1.49 -2.13 119.26 119.78 1orw h ALA 609 Ca 0.22 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1orw h ALA 609 Cb 0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1orw h ALA 609 CO -0.22 -0.27 0.19 1.15 0.00 0.00 0.00 179.25 180.10 1orw h THR 610 N 0.22 1.06 -0.92 0.00 2.02 -0.79 -0.85 112.91 113.64 1orw h THR 610 Ca 0.06 -0.14 0.26 0.00 0.77 0.00 0.00 66.41 67.37 1orw h THR 610 Cb 0.01 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.01 1orw h THR 610 CO -0.01 0.07 0.66 -0.09 0.37 0.00 0.00 175.52 176.52 1orw h ARG 611 N 0.40 0.03 0.01 6.66 2.43 -0.47 1.12 114.38 124.55 1orw h ARG 611 Ca 0.12 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1orw h ARG 611 Cb -0.02 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1orw h ARG 611 CO -0.04 0.02 -0.10 1.96 -1.51 0.00 0.00 179.97 180.29 1orw h GLN 612 N 0.03 0.05 -0.91 0.20 4.20 -0.54 -2.87 115.11 115.28 1orw h GLN 612 Ca 0.44 -0.07 0.11 0.00 0.06 0.00 0.00 58.65 59.19 1orw h GLN 612 Cb 1.73 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 29.46 1orw h GLN 612 CO -0.02 0.94 0.58 0.74 -0.67 0.00 0.00 178.83 180.41 1orw h PHE 613 N -0.81 0.95 -0.46 2.96 0.04 0.23 -1.13 116.94 118.72 1orw h PHE 613 Ca -0.02 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.79 1orw h PHE 613 Cb 0.99 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.81 1orw h PHE 613 CO 0.24 0.41 0.29 0.66 -0.60 0.00 0.00 178.31 179.31 1orw h SER 614 N 0.86 0.49 0.00 2.17 4.64 0.11 -1.80 113.55 120.02 1orw h SER 614 Ca 0.43 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1orw h SER 614 Cb 0.48 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1orw h SER 614 CO -0.19 0.35 0.00 0.29 -0.87 0.00 0.00 176.83 176.41 1orw n LYS 615 N -4.80 0.86 -2.26 4.77 5.02 -0.45 -4.39 118.16 116.91 1orw n LYS 615 Ca 0.02 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.03 1orw n LYS 615 Cb 0.04 -1.07 0.03 0.00 -0.02 0.00 0.00 35.03 34.01 1orw n LYS 615 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1orw s MET 616 N -2.00 3.01 -0.01 1.97 -1.94 -0.68 -5.02 119.30 114.63 1orw s MET 616 Ca 0.06 0.18 -0.25 0.00 -1.71 0.00 0.00 55.69 53.96 1orw s MET 616 Cb 0.03 -2.21 -0.19 0.00 2.01 0.00 0.00 34.83 34.47 1orw s MET 616 CO 0.04 -0.73 1.30 0.78 -0.01 0.00 0.00 175.02 176.40 1orw h GLY 617 N -0.27 0.05 0.24 -0.03 0.00 -1.86 -3.25 103.07 97.95 1orw h GLY 617 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1orw h GLY 617 CO 0.62 0.04 0.00 1.97 0.00 0.00 0.00 176.54 179.17 1orw n PHE 618 N -4.83 0.00 -4.28 5.60 1.16 -1.26 -4.64 117.46 109.21 1orw n PHE 618 Ca -0.08 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.16 1orw n PHE 618 Cb 0.25 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 37.98 1orw n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1orw s VAL 619 N -2.00 3.21 -1.03 1.97 1.01 -1.23 -0.70 120.40 121.64 1orw s VAL 619 Ca 0.08 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.31 1orw s VAL 619 Cb 0.04 -2.41 0.13 0.00 0.00 0.00 0.00 36.38 34.14 1orw s VAL 619 CO 0.06 0.47 1.26 -0.62 0.00 0.00 0.00 175.10 176.28 1orw s ASP 620 N 0.96 6.74 0.38 3.32 2.15 -0.07 -4.76 116.67 125.39 1orw s ASP 620 Ca -0.01 -2.25 0.11 0.00 0.43 0.00 0.00 52.55 50.83 1orw s ASP 620 Cb -0.15 -2.42 0.58 0.00 -0.30 0.00 0.00 42.92 40.63 1orw s ASP 620 CO -0.00 -1.03 1.20 -2.24 -0.17 0.00 0.00 175.17 172.93 1orw h ASP 621 N 8.44 0.00 -0.05 -0.34 3.04 -1.87 0.26 116.42 125.91 1orw h ASP 621 Ca 0.21 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.00 1orw h ASP 621 Cb 0.98 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.27 1orw h ASP 621 CO 1.19 0.00 0.00 0.29 -2.04 0.00 0.00 179.24 178.68 1orw n LYS 622 N -2.08 1.21 -3.09 4.15 5.02 -1.26 -4.29 118.16 117.82 1orw n LYS 622 Ca -0.01 -0.31 -0.17 0.00 -2.02 0.00 0.00 58.31 55.81 1orw n LYS 622 Cb 0.47 -1.32 -0.04 0.00 -0.02 0.00 0.00 35.03 34.12 1orw n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1orw n ARG 623 N -0.47 0.43 -4.46 1.97 1.74 0.93 -4.94 116.66 111.85 1orw n ARG 623 Ca 0.14 -2.65 -0.27 0.00 -0.77 0.00 0.00 57.85 54.30 1orw n ARG 623 Cb 0.14 -1.52 -0.17 0.00 -1.02 0.00 0.00 32.46 29.89 1orw n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1orw s ILE 624 N 0.24 1.38 0.30 0.55 1.01 -1.26 -1.26 121.20 122.17 1orw s ILE 624 Ca 0.32 -0.58 0.07 0.00 0.00 0.00 0.00 60.65 60.46 1orw s ILE 624 Cb 0.06 -1.27 -0.06 0.00 0.01 0.00 0.00 42.46 41.20 1orw s ILE 624 CO -0.14 0.42 -0.05 0.00 0.00 0.00 0.00 174.94 175.17 1orw s ALA 625 N 0.95 2.50 -0.08 9.38 0.00 0.54 -0.23 121.76 134.82 1orw s ALA 625 Ca -0.08 -1.98 -0.06 0.00 0.00 0.00 0.00 51.96 49.84 1orw s ALA 625 Cb -0.15 0.21 0.03 0.00 0.00 0.00 0.00 23.12 23.20 1orw s ALA 625 CO -0.01 -0.08 0.19 -1.50 0.00 0.00 0.00 175.76 174.37 1orw s ILE 626 N -2.96 -0.02 0.06 0.00 2.07 -1.07 0.33 121.20 119.62 1orw s ILE 626 Ca 0.31 0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.59 1orw s ILE 626 Cb 0.05 -0.29 -0.03 0.00 0.13 0.00 0.00 42.46 42.31 1orw s ILE 626 CO 0.13 0.02 0.01 -1.66 -1.91 0.00 0.00 174.94 171.54 1orw s TRP 627 N 0.52 0.45 0.12 3.50 1.48 0.56 -2.31 118.94 123.26 1orw s TRP 627 Ca -0.03 -0.98 -0.26 0.00 -1.06 0.00 0.00 56.10 53.77 1orw s TRP 627 Cb -0.05 -0.33 0.08 0.00 -1.16 0.00 0.00 33.47 32.01 1orw s TRP 627 CO -0.03 -0.40 1.02 0.20 -4.06 0.00 0.00 176.95 173.68 1orw s GLY 628 N -2.88 -0.27 0.14 3.67 0.00 -0.98 -1.57 107.32 105.42 1orw s GLY 628 Ca 0.06 0.26 0.10 0.00 0.00 0.00 0.00 44.72 45.14 1orw s GLY 628 CO -0.10 0.04 -0.24 0.86 0.00 0.00 0.00 173.10 173.66 1orw s TRP 629 N -3.11 2.11 0.00 1.90 -0.11 -1.26 -1.58 118.94 116.89 1orw s TRP 629 Ca 0.12 -0.40 0.00 0.00 1.22 0.00 0.00 56.10 57.05 1orw s TRP 629 Cb -0.00 -1.12 0.00 0.00 -1.50 0.00 0.00 33.47 30.85 1orw s TRP 629 CO 0.01 0.33 0.00 0.45 -4.62 0.00 0.00 176.95 173.12 1orw n SER 630 N 0.77 0.00 -0.03 5.86 2.88 -0.57 0.17 113.62 122.70 1orw n SER 630 Ca -0.17 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.44 1orw n SER 630 Cb 0.54 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 64.45 1orw n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1orw h TYR 631 N 0.00 0.49 -0.64 0.66 5.03 -1.85 0.53 116.97 121.18 1orw h TYR 631 Ca 0.00 0.01 -0.08 0.00 2.58 0.00 0.00 58.73 61.24 1orw h TYR 631 Cb 0.00 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.09 1orw h TYR 631 CO 0.00 0.28 0.09 0.78 -1.32 0.00 0.00 178.16 177.99 1orw h GLY 632 N 0.50 1.16 1.02 1.82 0.00 0.19 0.47 103.07 108.23 1orw h GLY 632 Ca 0.20 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1orw h GLY 632 CO -0.05 0.72 0.47 -1.33 0.00 0.00 0.00 176.54 176.35 1orw h GLY 633 N 0.99 1.23 0.89 4.60 0.00 -0.17 0.48 103.07 111.10 1orw h GLY 633 Ca 0.19 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.96 1orw h GLY 633 CO 0.01 0.53 0.08 -1.82 0.00 0.00 0.00 176.54 175.34 1orw h TYR 634 N 1.15 0.42 -0.45 5.60 3.20 -0.81 -1.56 116.97 124.52 1orw h TYR 634 Ca 0.29 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 62.04 1orw h TYR 634 Cb 0.01 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 1orw h TYR 634 CO 0.00 0.46 -0.04 0.28 -1.64 0.00 0.00 178.16 177.22 1orw h VAL 635 N 0.26 1.25 -0.11 1.81 2.07 -0.25 -1.20 116.25 120.07 1orw h VAL 635 Ca 0.08 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1orw h VAL 635 Cb 0.23 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1orw h VAL 635 CO -0.00 0.37 0.07 0.74 0.02 0.00 0.00 177.57 178.76 1orw h THR 636 N 0.71 1.04 -0.23 2.57 2.02 0.16 -2.53 112.91 116.65 1orw h THR 636 Ca 0.13 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.22 1orw h THR 636 Cb 0.50 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1orw h THR 636 CO 0.03 0.04 0.15 0.28 0.37 0.00 0.00 175.52 176.39 1orw h SER 637 N 0.13 0.27 -0.55 4.18 0.02 -0.93 -0.78 113.55 115.89 1orw h SER 637 Ca 0.04 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1orw h SER 637 Cb 0.00 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1orw h SER 637 CO -0.01 0.20 0.36 0.24 -1.14 0.00 0.00 176.83 176.49 1orw h MET 638 N 0.31 0.58 0.12 3.45 2.86 -1.19 0.51 114.93 121.58 1orw h MET 638 Ca 0.09 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1orw h MET 638 Cb -0.03 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.50 1orw h MET 638 CO -0.02 0.39 -0.06 0.28 1.06 0.00 0.00 176.91 178.56 1orw h VAL 639 N 0.60 1.02 -1.00 -2.22 2.07 -1.01 -2.49 116.25 113.22 1orw h VAL 639 Ca 0.22 -1.25 0.19 0.00 0.82 0.00 0.00 66.70 66.69 1orw h VAL 639 Cb 0.14 1.71 -0.11 0.00 -1.52 0.00 0.00 31.29 31.52 1orw h VAL 639 CO -0.06 0.27 0.61 -0.07 0.02 0.00 0.00 177.57 178.34 1orw h LEU 640 N -0.81 0.78 -1.50 2.57 3.38 -0.89 0.18 115.31 119.02 1orw h LEU 640 Ca -0.02 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1orw h LEU 640 Cb 0.56 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1orw h LEU 640 CO 0.03 0.27 0.00 0.61 0.09 0.00 0.00 178.44 179.44 1orw n GLY 641 N -1.33 1.15 0.00 0.83 0.00 0.15 -3.74 105.19 102.25 1orw n GLY 641 Ca 0.23 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1orw n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orw n ALA 642 N 0.31 3.25 -3.24 4.61 0.00 0.64 -4.63 120.51 121.44 1orw n ALA 642 Ca 0.10 -0.29 -0.23 0.00 0.00 0.00 0.00 53.44 53.02 1orw n ALA 642 Cb 0.42 -1.21 0.04 0.00 0.00 0.00 0.00 19.45 18.70 1orw n ALA 642 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 643 N 1.50 -0.52 0.18 0.00 0.00 -1.25 -4.84 105.19 100.26 1orw n GLY 643 Ca 0.06 0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.38 1orw n GLY 643 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1orw n SER 644 N -2.59 0.59 0.00 1.61 3.41 -1.26 -4.91 113.62 110.47 1orw n SER 644 Ca -0.06 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.55 1orw n SER 644 Cb 0.59 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1orw n SER 644 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1orw n GLY 645 N 1.14 0.02 0.15 5.00 0.00 -1.26 -4.81 105.19 105.43 1orw n GLY 645 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1orw n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1orw h VAL 646 N 0.00 1.39 -3.08 1.61 2.07 -1.96 -3.46 116.25 112.82 1orw h VAL 646 Ca 0.00 -2.40 -0.61 0.00 0.82 0.00 0.00 66.70 64.50 1orw h VAL 646 Cb 0.44 2.85 -0.08 0.00 -1.52 0.00 0.00 31.29 32.97 1orw h VAL 646 CO 0.00 0.71 -0.35 -0.36 0.02 0.00 0.00 177.57 177.59 1orw s PHE 647 N -2.85 3.55 -0.14 1.57 0.40 -1.26 -4.62 117.98 114.62 1orw s PHE 647 Ca -0.12 0.65 -0.27 0.00 -0.60 0.00 0.00 56.93 56.59 1orw s PHE 647 Cb 0.04 -2.22 -0.24 0.00 0.51 0.00 0.00 43.02 41.10 1orw s PHE 647 CO 0.88 0.45 0.71 -0.22 0.70 0.00 0.00 175.22 177.74 1orw h LYS 648 N 5.84 0.00 -4.37 0.44 3.64 -0.94 -3.46 116.57 117.71 1orw h LYS 648 Ca -0.47 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 58.74 1orw h LYS 648 Cb 1.19 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.86 1orw h LYS 648 CO 0.68 0.94 -0.62 0.00 -2.27 0.00 0.00 179.45 178.18 1orw s GLY 650 N -3.04 -0.41 -0.10 0.00 0.00 -0.23 -2.58 107.32 100.97 1orw s GLY 650 Ca 0.23 1.10 0.03 0.00 0.00 0.00 0.00 44.72 46.08 1orw s GLY 650 CO 0.01 0.82 -0.20 -0.42 0.00 0.00 0.00 173.10 173.31 1orw s ILE 651 N -0.80 2.39 -0.13 0.90 1.01 -0.98 -0.72 121.20 122.87 1orw s ILE 651 Ca -0.09 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1orw s ILE 651 Cb -0.03 -1.94 0.02 0.00 0.01 0.00 0.00 42.46 40.52 1orw s ILE 651 CO 0.06 0.55 -0.17 0.00 0.00 0.00 0.00 174.94 175.38 1orw s ALA 652 N 0.26 1.91 -0.17 9.38 0.00 -0.43 -2.33 121.76 130.38 1orw s ALA 652 Ca -0.14 -0.89 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 1orw s ALA 652 Cb -0.17 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 21.99 1orw s ALA 652 CO 0.07 -0.16 -0.10 0.08 0.00 0.00 0.00 175.76 175.65 1orw s VAL 653 N 1.09 3.15 -1.45 0.00 1.01 -0.61 -1.31 120.40 122.28 1orw s VAL 653 Ca -0.03 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 1orw s VAL 653 Cb -0.14 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.87 1orw s VAL 653 CO -0.05 0.49 0.26 0.00 0.00 0.00 0.00 175.10 175.80 1orw n ALA 654 N 4.04 -2.08 -1.70 5.51 0.00 0.40 -1.52 120.51 125.17 1orw n ALA 654 Ca -0.18 -0.36 -0.32 0.00 0.00 0.00 0.00 53.44 52.57 1orw n ALA 654 Cb 0.52 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.63 1orw n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1orw s PRO 655 N -6.98 3.40 0.23 0.00 0.04 -1.26 -3.24 135.00 127.19 1orw s PRO 655 Ca 0.05 1.10 -0.18 0.00 0.04 0.00 0.00 61.00 62.01 1orw s PRO 655 Cb -0.03 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 1orw s PRO 655 CO 0.94 -0.74 0.70 0.08 0.04 0.00 0.00 177.00 178.03 1orw s VAL 656 N -2.61 4.63 0.00 -0.36 1.01 -1.24 -4.59 120.40 117.24 1orw s VAL 656 Ca 0.61 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.75 1orw s VAL 656 Cb -0.14 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1orw s VAL 656 CO 0.39 0.15 0.00 -1.54 0.00 0.00 0.00 175.10 174.10 1orw n SER 657 N 0.56 3.87 -3.61 3.32 3.41 -1.26 -4.22 113.62 115.68 1orw n SER 657 Ca -0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.49 1orw n SER 657 Cb 0.51 0.53 -0.10 0.00 -0.26 0.00 0.00 64.21 64.89 1orw n SER 657 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1orw s LYS 658 N -1.69 0.28 0.43 4.33 2.20 -1.26 -0.58 119.74 123.45 1orw s LYS 658 Ca 0.00 0.88 0.14 0.00 -0.36 0.00 0.00 55.97 56.63 1orw s LYS 658 Cb 0.00 0.11 1.02 0.00 -1.51 0.00 0.00 37.83 37.45 1orw s LYS 658 CO 0.00 -0.32 1.97 -1.49 -0.36 0.00 0.00 175.35 175.15 1orw h TRP 659 N 8.21 0.46 0.00 4.03 4.06 -1.89 0.85 115.95 131.66 1orw h TRP 659 Ca -0.16 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.80 1orw h TRP 659 Cb 1.12 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 29.13 1orw h TRP 659 CO 0.28 0.21 0.14 0.39 -3.56 0.00 0.00 178.44 175.90 1orw n GLU 660 N -4.47 0.11 0.14 0.49 4.71 -1.26 -0.68 120.64 119.68 1orw n GLU 660 Ca 0.10 0.60 0.12 0.00 -0.01 0.00 0.00 57.16 57.97 1orw n GLU 660 Cb 0.39 -2.00 0.06 0.00 -1.01 0.00 0.00 31.44 28.87 1orw n GLU 660 CO 0.00 0.00 0.00 1.88 0.09 0.00 0.00 177.13 179.10 1orw h TYR 661 N 0.00 0.00 -3.64 -0.32 0.05 -1.21 -3.32 116.97 108.53 1orw h TYR 661 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 1orw h TYR 661 Cb 0.28 0.00 0.07 0.00 1.01 0.00 0.00 36.73 38.09 1orw h TYR 661 CO 0.00 0.00 0.19 -0.47 -1.05 0.00 0.00 178.16 176.83 1orw s TYR 662 N -3.31 3.03 0.66 4.88 5.04 0.15 -4.84 117.35 122.95 1orw s TYR 662 Ca 0.02 0.48 -0.15 0.00 -2.44 0.00 0.00 57.07 54.98 1orw s TYR 662 Cb 0.08 -3.00 0.00 0.00 0.35 0.00 0.00 41.96 39.39 1orw s TYR 662 CO 0.75 -1.17 1.11 0.16 -1.34 0.00 0.00 175.55 175.07 1orw s ASP 663 N -4.44 5.07 0.07 4.32 1.47 -1.26 -0.68 116.67 121.22 1orw s ASP 663 Ca 0.58 2.02 -0.27 0.00 1.18 0.00 0.00 52.55 56.05 1orw s ASP 663 Cb -0.11 -2.55 -0.17 0.00 -0.34 0.00 0.00 42.92 39.75 1orw s ASP 663 CO 0.44 -1.66 1.62 0.77 0.68 0.00 0.00 175.17 177.03 1orw h SER 664 N 0.02 -0.34 -0.59 2.11 4.64 -1.14 -0.96 113.55 117.29 1orw h SER 664 Ca -0.47 -0.03 0.12 0.00 -0.47 0.00 0.00 61.79 60.95 1orw h SER 664 Cb 1.25 0.09 -0.11 0.00 -0.31 0.00 0.00 62.40 63.32 1orw h SER 664 CO 0.54 -0.20 -0.07 0.58 -0.87 0.00 0.00 176.83 176.82 1orw h VAL 665 N -0.45 0.46 0.01 0.95 2.07 -1.94 0.26 116.25 117.61 1orw h VAL 665 Ca -0.04 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1orw h VAL 665 Cb 0.34 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1orw h VAL 665 CO 0.07 0.01 -0.01 0.22 0.02 0.00 0.00 177.57 177.88 1orw h TYR 666 N 0.06 -0.01 -0.22 1.57 5.03 -1.93 -3.19 116.97 118.27 1orw h TYR 666 Ca 0.30 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.60 1orw h TYR 666 Cb 0.48 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.75 1orw h TYR 666 CO -0.41 0.80 0.10 1.15 -1.32 0.00 0.00 178.16 178.47 1orw h THR 667 N -0.91 1.15 0.00 1.81 2.02 -1.04 -2.71 112.91 113.23 1orw h THR 667 Ca -0.00 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1orw h THR 667 Cb 0.82 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1orw h THR 667 CO 0.00 0.15 0.00 -0.33 0.37 0.00 0.00 175.52 175.71 1orw h GLU 668 N 0.22 0.00 0.00 6.66 5.08 -0.63 0.18 114.58 126.09 1orw h GLU 668 Ca 0.08 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 1orw h GLU 668 Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1orw h GLU 668 CO -0.01 0.00 -0.48 -0.09 -1.00 0.00 0.00 179.01 177.43 1orw h ARG 669 N 0.00 0.00 0.00 2.33 2.43 -1.47 -0.59 114.38 117.09 1orw h ARG 669 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1orw h ARG 669 Cb 0.31 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1orw h ARG 669 CO 0.00 0.48 -1.29 0.66 -1.51 0.00 0.00 179.97 178.31 1orw n TYR 670 N -3.54 0.00 0.21 2.20 4.01 -0.94 -4.70 117.16 114.39 1orw n TYR 670 Ca -0.00 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.78 1orw n TYR 670 Cb 0.58 -0.16 -0.06 0.00 -0.31 0.00 0.00 39.34 39.40 1orw n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1orw n MET 671 N -1.80 2.21 0.00 -0.72 2.81 0.58 0.21 117.12 120.42 1orw n MET 671 Ca -0.03 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 1orw n MET 671 Cb 0.25 -1.06 0.00 0.00 -0.71 0.00 0.00 33.22 31.70 1orw n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1orw n GLY 672 N 1.59 0.58 3.72 3.03 0.00 -0.23 -4.64 105.19 109.25 1orw n GLY 672 Ca 0.00 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.79 1orw n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1orw s LEU 673 N 0.00 3.95 0.00 0.99 1.02 -1.26 -4.14 118.68 119.24 1orw s LEU 673 Ca 0.00 0.22 -0.02 0.00 0.02 0.00 0.00 54.13 54.35 1orw s LEU 673 Cb 0.00 -1.97 -0.08 0.00 0.02 0.00 0.00 46.19 44.16 1orw s LEU 673 CO 0.00 0.29 2.12 -0.81 0.02 0.00 0.00 176.35 177.98 1orw n PRO 674 N 2.74 1.10 -4.32 1.29 -0.04 -1.26 -1.53 135.00 132.99 1orw n PRO 674 Ca -0.18 -0.31 -0.24 0.00 -0.04 0.00 0.00 63.50 62.73 1orw n PRO 674 Cb 0.53 -1.42 -0.08 0.00 -0.04 0.00 0.00 33.50 32.50 1orw n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1orw s THR 675 N 0.82 3.29 0.45 0.52 -4.23 -1.26 -4.52 115.64 110.71 1orw s THR 675 Ca 0.21 -1.94 0.11 0.00 -1.18 0.00 0.00 61.69 58.88 1orw s THR 675 Cb 0.10 -2.74 0.25 0.00 1.34 0.00 0.00 72.50 71.45 1orw s THR 675 CO 0.00 -0.34 2.07 1.55 -0.54 0.00 0.00 174.62 177.36 1orw h PRO 676 N 2.07 0.29 0.00 3.99 0.13 -1.94 0.22 132.00 136.75 1orw h PRO 676 Ca -0.44 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1orw h PRO 676 Cb 1.25 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1orw h PRO 676 CO 0.60 0.23 0.00 -0.85 -0.23 0.00 0.00 178.00 177.74 1orw n GLU 677 N -4.47 0.25 0.00 0.86 0.00 -1.26 -4.71 120.64 111.32 1orw n GLU 677 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 57.16 57.19 1orw n GLU 677 Cb 0.10 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.04 1orw n GLU 677 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1orw n ASP 678 N -1.36 0.00 -0.01 -1.84 -0.08 -0.44 -5.03 116.55 107.79 1orw n ASP 678 Ca 0.11 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.40 1orw n ASP 678 Cb 0.25 0.00 0.02 0.00 2.34 0.00 0.00 41.12 43.73 1orw n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1orw n ASN 679 N 0.00 1.98 -0.63 1.67 4.05 -0.58 -4.81 115.26 116.94 1orw n ASN 679 Ca 0.00 -2.12 0.48 0.00 0.45 0.00 0.00 54.58 53.39 1orw n ASN 679 Cb 0.00 -0.06 0.74 0.00 1.23 0.00 0.00 39.78 41.69 1orw n ASN 679 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1orw n LEU 680 N -0.61 0.03 0.06 1.20 7.94 -0.06 -0.84 117.00 124.72 1orw n LEU 680 Ca 0.02 0.98 -0.06 0.00 -1.11 0.00 0.00 56.01 55.84 1orw n LEU 680 Cb 0.31 -0.49 0.11 0.00 0.53 0.00 0.00 43.42 43.88 1orw n LEU 680 CO 0.00 -1.00 0.49 0.44 -1.11 0.00 0.00 177.39 176.21 1orw h ASP 681 N 0.00 0.38 1.31 1.96 3.32 -1.87 -1.62 116.42 119.89 1orw h ASP 681 Ca 0.86 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.70 1orw h ASP 681 Cb 3.37 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 42.81 1orw h ASP 681 CO -0.08 0.88 -0.24 1.88 -1.72 0.00 0.00 179.24 179.95 1orw h TYR 682 N 0.26 0.00 0.03 4.55 -1.99 -1.31 -2.90 116.97 115.61 1orw h TYR 682 Ca -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 1orw h TYR 682 Cb 1.09 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.82 1orw h TYR 682 CO 0.03 0.00 -0.01 1.88 -0.00 0.00 0.00 178.16 180.06 1orw h TYR 683 N 0.00 -0.03 -0.46 4.88 0.05 -1.40 -3.07 116.97 116.94 1orw h TYR 683 Ca 0.00 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.82 1orw h TYR 683 Cb 0.77 0.01 -0.04 0.00 1.01 0.00 0.00 36.73 38.49 1orw h TYR 683 CO 0.00 0.51 0.23 0.00 -1.05 0.00 0.00 178.16 177.85 1orw h ARG 684 N -0.60 0.44 -0.62 4.88 2.47 -1.24 -2.93 114.38 116.78 1orw h ARG 684 Ca -0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1orw h ARG 684 Cb 0.56 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1orw h ARG 684 CO 0.01 0.29 0.00 0.27 0.56 0.00 0.00 179.97 181.10 1orw n ASN 685 N -4.90 3.79 -0.61 7.04 6.94 -1.10 -4.01 115.26 122.40 1orw n ASN 685 Ca 0.03 -2.33 0.07 0.00 -0.02 0.00 0.00 54.58 52.33 1orw n ASN 685 Cb 0.12 -0.50 0.10 0.00 -2.36 0.00 0.00 39.78 37.14 1orw n ASN 685 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1orw n SER 686 N 0.86 2.47 -4.80 0.53 3.41 -1.11 -5.00 113.62 109.98 1orw n SER 686 Ca 0.20 -1.72 -0.30 0.00 -0.26 0.00 0.00 58.87 56.79 1orw n SER 686 Cb 0.71 -0.10 0.08 0.00 -0.26 0.00 0.00 64.21 64.63 1orw n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1orw s THR 687 N -1.05 3.46 0.02 6.66 -4.23 -1.25 -4.87 115.64 114.38 1orw s THR 687 Ca 0.20 0.47 -0.08 0.00 -1.18 0.00 0.00 61.69 61.10 1orw s THR 687 Cb 0.12 -3.17 -0.30 0.00 1.34 0.00 0.00 72.50 70.48 1orw s THR 687 CO 0.17 -0.62 0.93 0.58 -0.54 0.00 0.00 174.62 175.15 1orw h VAL 688 N -0.98 1.24 -0.69 2.29 2.07 -1.19 -3.33 116.25 115.66 1orw h VAL 688 Ca -0.45 -2.79 0.15 0.00 0.82 0.00 0.00 66.70 64.42 1orw h VAL 688 Cb 1.24 2.88 -0.11 0.00 -1.52 0.00 0.00 31.29 33.78 1orw h VAL 688 CO 0.57 0.84 0.07 0.24 0.02 0.00 0.00 177.57 179.31 1orw h MET 689 N 0.10 0.16 0.00 1.57 2.86 -1.92 0.36 114.93 118.06 1orw h MET 689 Ca -0.24 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.39 1orw h MET 689 Cb 2.06 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.68 1orw h MET 689 CO 0.20 0.11 0.15 -1.13 1.06 0.00 0.00 176.91 177.30 1orw n SER 690 N -5.25 0.03 -0.21 1.22 3.41 -1.25 0.19 113.62 111.76 1orw n SER 690 Ca 0.12 0.37 0.02 0.00 -0.26 0.00 0.00 58.87 59.12 1orw n SER 690 Cb 0.42 -0.37 0.05 0.00 -0.26 0.00 0.00 64.21 64.05 1orw n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1orw n ARG 691 N -1.40 2.61 -0.31 4.33 1.74 0.13 -4.79 116.66 118.96 1orw n ARG 691 Ca -0.00 -1.59 0.17 0.00 -0.77 0.00 0.00 57.85 55.66 1orw n ARG 691 Cb 0.15 -1.09 0.35 0.00 -1.02 0.00 0.00 32.46 30.86 1orw n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1orw h ALA 692 N 0.70 1.52 -0.61 7.54 0.00 -0.13 -1.91 119.26 126.37 1orw h ALA 692 Ca 0.00 0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.18 1orw h ALA 692 Cb 0.54 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1orw h ALA 692 CO 0.00 -0.49 0.31 0.93 0.00 0.00 0.00 179.25 180.00 1orw h GLU 693 N 0.27 0.55 0.00 0.00 3.07 -1.86 -1.65 114.58 114.95 1orw h GLU 693 Ca 0.62 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 1orw h GLU 693 Cb 1.30 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 1orw h GLU 693 CO -0.63 0.36 0.00 0.09 -1.40 0.00 0.00 179.01 177.43 1orw n ASN 694 N -4.87 0.00 0.03 1.42 5.03 -0.72 -1.70 115.26 114.46 1orw n ASN 694 Ca 0.08 0.16 0.12 0.00 0.87 0.00 0.00 54.58 55.81 1orw n ASN 694 Cb 0.19 -0.23 0.49 0.00 -1.02 0.00 0.00 39.78 39.22 1orw n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1orw n PHE 695 N -1.23 0.27 0.29 3.10 3.01 -0.62 -2.71 117.46 119.57 1orw n PHE 695 Ca 0.02 0.09 0.15 0.00 1.01 0.00 0.00 57.45 58.72 1orw n PHE 695 Cb 0.03 -0.64 0.73 0.00 -0.01 0.00 0.00 39.48 39.59 1orw n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1orw h LYS 696 N 0.00 0.00 -0.04 -1.08 1.57 -1.52 -2.67 116.57 112.84 1orw h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1orw h LYS 696 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1orw h LYS 696 CO 0.00 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.92 1orw n GLN 697 N -2.64 2.00 -4.01 3.15 6.02 -1.10 -4.99 117.38 115.82 1orw n GLN 697 Ca -0.00 -1.46 -0.08 0.00 -0.01 0.00 0.00 57.00 55.45 1orw n GLN 697 Cb 0.16 -1.47 -0.09 0.00 1.02 0.00 0.00 30.24 29.86 1orw n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1orw s VAL 698 N -1.98 0.17 -0.22 5.09 -7.23 -1.01 -4.94 120.40 110.28 1orw s VAL 698 Ca 0.33 -1.59 -0.18 0.00 -1.81 0.00 0.00 61.98 58.72 1orw s VAL 698 Cb 0.20 -1.53 -0.03 0.00 0.56 0.00 0.00 36.38 35.58 1orw s VAL 698 CO 0.32 -0.79 0.53 -1.61 -0.31 0.00 0.00 175.10 173.23 1orw s GLU 699 N -3.92 4.14 -0.05 4.82 2.02 -0.37 -4.98 118.70 120.36 1orw s GLU 699 Ca 0.09 0.39 0.03 0.00 0.02 0.00 0.00 54.97 55.51 1orw s GLU 699 Cb 0.07 -3.60 0.00 0.00 0.10 0.00 0.00 34.13 30.70 1orw s GLU 699 CO -0.09 -0.24 -0.15 -0.47 0.02 0.00 0.00 175.26 174.34 1orw s TYR 700 N 1.93 1.59 -0.15 1.61 5.04 -1.26 -1.06 117.35 125.04 1orw s TYR 700 Ca 0.23 -0.50 -0.02 0.00 -2.44 0.00 0.00 57.07 54.34 1orw s TYR 700 Cb -0.15 -1.10 -0.02 0.00 0.35 0.00 0.00 41.96 41.04 1orw s TYR 700 CO 0.09 -0.20 -0.08 -1.17 -1.34 0.00 0.00 175.55 172.85 1orw s LEU 701 N 0.25 2.94 -0.25 6.97 0.20 0.10 0.32 118.68 129.20 1orw s LEU 701 Ca -0.08 -0.27 0.02 0.00 0.69 0.00 0.00 54.13 54.50 1orw s LEU 701 Cb -0.13 -1.69 0.06 0.00 -0.43 0.00 0.00 46.19 44.00 1orw s LEU 701 CO 0.03 0.14 -0.06 -0.22 -0.29 0.00 0.00 176.35 175.94 1orw s LEU 702 N 0.53 3.07 -0.02 -0.68 0.20 0.44 -1.31 118.68 120.92 1orw s LEU 702 Ca -0.06 -1.35 0.03 0.00 0.69 0.00 0.00 54.13 53.44 1orw s LEU 702 Cb -0.15 -1.35 -0.03 0.00 -0.43 0.00 0.00 46.19 44.23 1orw s LEU 702 CO 0.03 -0.23 -0.09 -0.63 -0.29 0.00 0.00 176.35 175.13 1orw s ILE 703 N 1.25 3.45 -0.28 6.68 1.01 -0.43 -0.92 121.20 131.96 1orw s ILE 703 Ca -0.05 -0.76 -0.21 0.00 0.00 0.00 0.00 60.65 59.63 1orw s ILE 703 Cb -0.19 -2.45 0.10 0.00 0.01 0.00 0.00 42.46 39.93 1orw s ILE 703 CO -0.06 0.46 0.84 -2.28 0.00 0.00 0.00 174.94 173.90 1orw s HIS 704 N -0.90 -0.73 0.17 3.97 2.46 -0.98 -0.46 115.29 118.82 1orw s HIS 704 Ca 0.15 1.63 -0.30 0.00 0.47 0.00 0.00 55.06 57.01 1orw s HIS 704 Cb -0.11 0.40 -0.07 0.00 -0.13 0.00 0.00 32.58 32.67 1orw s HIS 704 CO 0.05 -0.36 1.10 0.20 -2.47 0.00 0.00 174.74 173.26 1orw s GLY 705 N 0.83 2.84 0.00 1.59 0.00 -1.26 -2.44 107.32 108.87 1orw s GLY 705 Ca -0.03 0.80 0.27 0.00 0.00 0.00 0.00 44.72 45.76 1orw s GLY 705 CO -0.09 1.66 1.90 -1.30 0.00 0.00 0.00 173.10 175.27 1orw n THR 706 N 2.46 0.14 -1.63 0.90 -2.24 -1.04 -2.94 114.28 109.94 1orw n THR 706 Ca 0.03 0.03 -0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1orw n THR 706 Cb 0.46 -0.58 0.18 0.00 -2.10 0.00 0.00 70.33 68.29 1orw n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1orw n ALA 707 N -1.36 4.00 -2.60 6.98 0.00 -0.70 -4.55 120.51 122.28 1orw n ALA 707 Ca 0.11 -3.35 -0.42 0.00 0.00 0.00 0.00 53.44 49.77 1orw n ALA 707 Cb 0.25 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 1orw n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1orw s ASP 708 N -3.14 6.43 0.37 0.00 -1.08 -1.15 -4.20 116.67 113.90 1orw s ASP 708 Ca 0.41 -0.00 0.20 0.00 -0.52 0.00 0.00 52.55 52.64 1orw s ASP 708 Cb 0.38 -2.52 0.30 0.00 -1.46 0.00 0.00 42.92 39.62 1orw s ASP 708 CO -0.04 -1.38 1.57 -2.24 0.52 0.00 0.00 175.17 173.59 1orw h ASP 709 N 9.44 0.00 0.00 -0.34 2.03 -1.93 -3.27 116.42 122.35 1orw h ASP 709 Ca -0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 1orw h ASP 709 Cb 1.06 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 1orw h ASP 709 CO 1.15 0.24 0.00 -3.20 -1.03 0.00 0.00 179.24 176.40 1orw n ASN 710 N -3.18 0.00 -4.33 4.15 2.85 -1.26 -4.60 115.26 108.90 1orw n ASN 710 Ca 0.03 0.31 -0.46 0.00 -0.11 0.00 0.00 54.58 54.35 1orw n ASN 710 Cb 0.61 -0.33 -0.04 0.00 1.24 0.00 0.00 39.78 41.25 1orw n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1orw s VAL 711 N -0.67 5.19 0.51 3.44 1.01 -1.26 -4.86 120.40 123.75 1orw s VAL 711 Ca 0.00 -1.55 -0.21 0.00 0.00 0.00 0.00 61.98 60.22 1orw s VAL 711 Cb 0.00 -4.39 -0.08 0.00 0.00 0.00 0.00 36.38 31.91 1orw s VAL 711 CO 0.00 -0.95 1.01 1.41 0.00 0.00 0.00 175.10 176.56 1orw n HIS 712 N 5.29 1.07 -0.25 5.22 8.25 -1.23 -4.67 115.22 128.90 1orw n HIS 712 Ca -0.09 0.49 0.11 0.00 -0.26 0.00 0.00 57.72 57.97 1orw n HIS 712 Cb 0.42 -2.20 0.38 0.00 1.12 0.00 0.00 29.99 29.71 1orw n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1orw h PHE 713 N 1.07 0.80 -0.97 4.41 3.57 -1.77 -0.39 116.94 123.66 1orw h PHE 713 Ca -0.47 0.02 0.35 0.00 3.53 0.00 0.00 57.97 61.41 1orw h PHE 713 Cb 1.35 -0.25 -0.18 0.00 2.79 0.00 0.00 35.95 39.66 1orw h PHE 713 CO 0.41 0.31 0.33 0.94 -2.23 0.00 0.00 178.31 178.07 1orw n GLN 714 N -4.54 -0.07 -0.31 1.11 7.27 -1.26 0.14 117.38 119.71 1orw n GLN 714 Ca 0.16 1.39 0.05 0.00 0.07 0.00 0.00 57.00 58.67 1orw n GLN 714 Cb 0.44 -2.37 0.20 0.00 2.41 0.00 0.00 30.24 30.91 1orw n GLN 714 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1orw h GLN 715 N 0.00 0.80 0.18 3.69 4.20 -1.39 0.23 115.11 122.82 1orw h GLN 715 Ca 0.73 -0.05 -0.32 0.00 0.06 0.00 0.00 58.65 59.08 1orw h GLN 715 Cb 1.81 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 29.42 1orw h GLN 715 CO -0.81 0.53 -1.48 0.77 -0.67 0.00 0.00 178.83 177.17 1orw h SER 716 N 0.82 0.59 -0.67 1.46 0.02 -0.48 -2.79 113.55 112.50 1orw h SER 716 Ca 0.43 -0.71 0.12 0.00 -0.84 0.00 0.00 61.79 60.80 1orw h SER 716 Cb 0.44 -0.19 -0.09 0.00 0.14 0.00 0.00 62.40 62.70 1orw h SER 716 CO -0.27 1.57 0.24 0.00 -1.14 0.00 0.00 176.83 177.23 1orw h ALA 717 N 0.34 0.89 -0.27 3.77 0.00 -0.41 -0.02 119.26 123.57 1orw h ALA 717 Ca -0.24 0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.65 1orw h ALA 717 Cb 2.07 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.95 1orw h ALA 717 CO 0.21 -0.22 -0.37 1.96 0.00 0.00 0.00 179.25 180.83 1orw h GLN 718 N 0.40 0.61 0.28 0.00 1.08 -0.62 -2.69 115.11 114.16 1orw h GLN 718 Ca 0.36 -0.30 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1orw h GLN 718 Cb 0.51 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1orw h GLN 718 CO -0.37 0.88 -0.14 1.25 -0.95 0.00 0.00 178.83 179.51 1orw h LEU 719 N 0.50 -0.32 -0.76 1.46 5.85 -0.95 -2.53 115.31 118.56 1orw h LEU 719 Ca 0.05 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.70 1orw h LEU 719 Cb 0.87 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.92 1orw h LEU 719 CO 0.08 -0.02 0.42 0.77 -0.34 0.00 0.00 178.44 179.35 1orw h SER 720 N -0.64 0.60 -0.53 1.25 4.64 -1.10 -0.99 113.55 116.78 1orw h SER 720 Ca -0.04 0.05 0.06 0.00 -0.47 0.00 0.00 61.79 61.39 1orw h SER 720 Cb 0.45 -0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 62.42 1orw h SER 720 CO 0.06 0.35 0.22 0.50 -0.87 0.00 0.00 176.83 177.10 1orw h LYS 721 N 0.73 0.42 -0.17 4.77 3.64 -1.47 0.41 116.57 124.90 1orw h LYS 721 Ca 0.36 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.73 1orw h LYS 721 Cb 0.32 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1orw h LYS 721 CO -0.24 0.28 0.06 0.00 -2.27 0.00 0.00 179.45 177.28 1orw h ALA 722 N 1.33 0.18 -0.40 5.00 0.00 -0.77 -0.46 119.26 124.13 1orw h ALA 722 Ca 0.25 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1orw h ALA 722 Cb 0.24 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1orw h ALA 722 CO -0.22 -0.38 0.25 -0.07 0.00 0.00 0.00 179.25 178.83 1orw h LEU 723 N 0.14 0.40 -1.54 0.00 3.38 -0.58 -1.24 115.31 115.88 1orw h LEU 723 Ca 0.07 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1orw h LEU 723 Cb 0.04 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1orw h LEU 723 CO -0.07 0.29 0.32 0.58 0.09 0.00 0.00 178.44 179.65 1orw h VAL 724 N 0.50 1.11 -0.00 1.22 2.07 0.23 -0.40 116.25 120.98 1orw h VAL 724 Ca 0.16 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1orw h VAL 724 Cb -0.01 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1orw h VAL 724 CO -0.06 0.12 -0.02 0.47 0.02 0.00 0.00 177.57 178.09 1orw n ASP 725 N -4.47 0.03 -0.96 0.57 8.00 -0.22 -2.46 116.55 117.05 1orw n ASP 725 Ca 0.04 0.16 0.08 0.00 0.71 0.00 0.00 54.79 55.79 1orw n ASP 725 Cb 0.07 -0.37 0.23 0.00 -0.02 0.00 0.00 41.12 41.02 1orw n ASP 725 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1orw n ALA 726 N -1.39 2.27 -2.02 2.24 0.00 -0.24 -4.95 120.51 116.44 1orw n ALA 726 Ca 0.10 -1.20 -0.19 0.00 0.00 0.00 0.00 53.44 52.16 1orw n ALA 726 Cb 0.29 -0.66 -0.04 0.00 0.00 0.00 0.00 19.45 19.05 1orw n ALA 726 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orw n GLY 727 N 1.03 0.52 3.84 0.00 0.00 -0.96 -4.90 105.19 104.73 1orw n GLY 727 Ca 0.17 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1orw n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1orw s VAL 728 N -2.83 5.11 -0.14 1.61 1.01 -0.73 -5.04 120.40 119.39 1orw s VAL 728 Ca 0.00 0.73 -0.07 0.00 0.00 0.00 0.00 61.98 62.64 1orw s VAL 728 Cb 0.00 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1orw s VAL 728 CO 0.00 0.58 0.10 -0.62 0.00 0.00 0.00 175.10 175.17 1orw s ASP 729 N -1.08 6.04 0.23 3.32 2.15 -1.26 -4.41 116.67 121.66 1orw s ASP 729 Ca 0.22 0.31 -0.15 0.00 0.43 0.00 0.00 52.55 53.36 1orw s ASP 729 Cb -0.16 -1.96 0.01 0.00 -0.30 0.00 0.00 42.92 40.51 1orw s ASP 729 CO 0.12 0.32 0.50 0.72 -0.17 0.00 0.00 175.17 176.66 1orw s PHE 730 N -0.50 0.16 0.03 -5.34 -0.71 -1.26 -4.70 117.98 105.65 1orw s PHE 730 Ca 0.11 -0.53 0.01 0.00 -1.04 0.00 0.00 56.93 55.49 1orw s PHE 730 Cb -0.12 0.29 -0.04 0.00 -1.21 0.00 0.00 43.02 41.95 1orw s PHE 730 CO 0.02 -0.98 0.07 -0.65 -1.34 0.00 0.00 175.22 172.34 1orw s GLN 731 N -3.96 2.95 0.28 1.99 -0.21 0.15 -5.01 119.66 115.85 1orw s GLN 731 Ca 0.17 -0.58 0.05 0.00 0.02 0.00 0.00 55.36 55.01 1orw s GLN 731 Cb -0.01 -2.78 -0.06 0.00 1.00 0.00 0.00 33.01 31.16 1orw s GLN 731 CO 0.05 0.61 -0.02 -0.08 -2.12 0.00 0.00 175.29 173.73 1orw s THR 732 N -1.25 1.42 -0.30 -0.19 -1.32 -1.26 -0.42 115.64 112.32 1orw s THR 732 Ca 0.25 -2.07 -0.03 0.00 -1.21 0.00 0.00 61.69 58.62 1orw s THR 732 Cb -0.12 -2.51 0.19 0.00 -1.51 0.00 0.00 72.50 68.55 1orw s THR 732 CO 0.16 -0.24 0.76 -0.32 -2.21 0.00 0.00 174.62 172.78 1orw s MET 733 N -3.79 0.42 0.25 7.08 0.00 -0.09 -4.83 119.30 118.34 1orw s MET 733 Ca 0.31 0.59 0.01 0.00 0.00 0.00 0.00 55.69 56.60 1orw s MET 733 Cb 0.05 0.31 -0.04 0.00 0.00 0.00 0.00 34.83 35.16 1orw s MET 733 CO 0.12 -0.60 0.43 1.67 0.00 0.00 0.00 175.02 176.64 1orw s TRP 734 N 2.89 3.48 -0.33 4.11 -2.14 -1.26 -2.31 118.94 123.38 1orw s TRP 734 Ca 0.14 0.25 0.00 0.00 2.66 0.00 0.00 56.10 59.15 1orw s TRP 734 Cb -0.10 -1.79 0.10 0.00 -3.10 0.00 0.00 33.47 28.58 1orw s TRP 734 CO -0.21 0.32 0.10 0.71 -2.66 0.00 0.00 176.95 175.21 1orw s TYR 735 N -2.03 2.12 -0.33 1.66 2.02 -1.02 -4.92 117.35 114.84 1orw s TYR 735 Ca 0.38 -2.03 -0.39 0.00 -0.37 0.00 0.00 57.07 54.66 1orw s TYR 735 Cb -0.10 -1.96 -0.14 0.00 -0.40 0.00 0.00 41.96 39.36 1orw s TYR 735 CO 0.31 -0.88 1.98 2.41 -1.57 0.00 0.00 175.55 177.79 1orw n THR 736 N 4.64 0.23 -0.01 -0.71 -1.04 -1.26 -1.79 114.28 114.34 1orw n THR 736 Ca -0.00 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1orw n THR 736 Cb 0.41 -1.30 0.00 0.00 -1.82 0.00 0.00 70.33 67.62 1orw n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1orw n ASP 737 N 7.45 0.00 -4.76 8.00 8.00 -1.26 -4.93 116.55 129.05 1orw n ASP 737 Ca 0.36 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.53 1orw n ASP 737 Cb 0.15 -0.56 0.06 0.00 -0.02 0.00 0.00 41.12 40.75 1orw n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1orw s GLU 738 N -0.00 2.56 0.00 -1.24 0.41 -0.74 -4.48 118.70 115.21 1orw s GLU 738 Ca 0.00 1.46 0.00 0.00 -0.41 0.00 0.00 54.97 56.02 1orw s GLU 738 Cb 0.00 -1.91 0.00 0.00 -1.78 0.00 0.00 34.13 30.44 1orw s GLU 738 CO 0.00 -1.45 0.00 -0.40 -0.49 0.00 0.00 175.26 172.92 1orw n ASP 739 N -2.61 1.12 -0.31 -0.19 5.68 -1.26 -1.72 116.55 117.26 1orw n ASP 739 Ca 0.11 -0.10 0.30 0.00 -0.50 0.00 0.00 54.79 54.60 1orw n ASP 739 Cb 0.52 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.15 1orw n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1orw h HIS 740 N 0.05 0.26 0.00 2.11 -0.00 -1.90 0.22 115.15 115.89 1orw h HIS 740 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1orw h HIS 740 Cb 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.34 1orw h HIS 740 CO 0.00 0.02 -0.66 0.41 -0.00 0.00 0.00 177.93 177.70 1orw n GLY 741 N -1.65 -1.32 4.08 5.26 0.00 -1.26 -4.94 105.19 105.36 1orw n GLY 741 Ca 0.25 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 1orw n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1orw n ILE 742 N -1.88 -1.86 0.59 -0.61 5.41 0.78 -4.84 119.36 116.95 1orw n ILE 742 Ca 0.04 -0.50 0.09 0.00 1.00 0.00 0.00 62.75 63.38 1orw n ILE 742 Cb 0.40 -1.62 0.11 0.00 -0.71 0.00 0.00 39.64 37.82 1orw n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1orw n ALA 743 N -4.51 2.44 -1.28 -1.39 0.00 -1.26 -3.55 120.51 110.95 1orw n ALA 743 Ca -0.16 -0.75 -0.35 0.00 0.00 0.00 0.00 53.44 52.18 1orw n ALA 743 Cb 0.54 -0.64 0.10 0.00 0.00 0.00 0.00 19.45 19.44 1orw n ALA 743 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1orw n SER 744 N 1.06 0.41 -0.32 0.00 3.41 -1.26 -4.63 113.62 112.29 1orw n SER 744 Ca 0.12 0.63 -0.04 0.00 -0.26 0.00 0.00 58.87 59.33 1orw n SER 744 Cb 0.48 -1.41 0.08 0.00 -0.26 0.00 0.00 64.21 63.10 1orw n SER 744 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1orw h ASN 745 N -0.43 1.10 -0.20 4.04 4.21 -1.99 0.13 115.58 122.43 1orw h ASN 745 Ca -0.47 -0.10 -0.03 0.00 1.21 0.00 0.00 56.30 56.91 1orw h ASN 745 Cb 1.33 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 38.24 1orw h ASN 745 CO 0.46 0.88 0.01 0.24 -1.29 0.00 0.00 177.43 177.73 1orw h MET 746 N 1.22 0.35 0.46 0.81 2.86 -1.98 -2.77 114.93 115.88 1orw h MET 746 Ca 0.31 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.82 1orw h MET 746 Cb 0.03 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1orw h MET 746 CO -0.05 0.53 -0.22 0.00 1.06 0.00 0.00 176.91 178.23 1orw h ALA 747 N 0.81 -0.62 -1.00 6.32 0.00 -1.85 -2.06 119.26 120.86 1orw h ALA 747 Ca 0.06 -0.16 0.38 0.00 0.00 0.00 0.00 54.91 55.18 1orw h ALA 747 Cb 0.36 0.24 -0.18 0.00 0.00 0.00 0.00 17.79 18.22 1orw h ALA 747 CO 0.01 -0.79 0.43 1.25 0.00 0.00 0.00 179.25 180.15 1orw h HIS 748 N -0.74 0.64 -0.02 0.00 6.17 -0.74 0.86 115.15 121.33 1orw h HIS 748 Ca -0.06 0.05 -0.03 0.00 0.71 0.00 0.00 60.37 61.03 1orw h HIS 748 Cb 0.53 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 30.35 1orw h HIS 748 CO -0.02 -0.44 -0.11 1.96 0.71 0.00 0.00 177.93 180.04 1orw h GLN 749 N 0.04 0.10 -0.42 5.26 4.20 -1.22 -3.23 115.11 119.84 1orw h GLN 749 Ca 0.78 -0.09 0.07 0.00 0.06 0.00 0.00 58.65 59.48 1orw h GLN 749 Cb 1.95 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 29.69 1orw h GLN 749 CO -0.79 0.77 0.04 1.25 -0.67 0.00 0.00 178.83 179.44 1orw h HIS 750 N -0.54 0.05 -0.22 2.96 2.76 -0.16 0.18 115.15 120.18 1orw h HIS 750 Ca -0.01 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 1orw h HIS 750 Cb 0.80 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.78 1orw h HIS 750 CO 0.16 -0.04 -0.06 0.97 -1.30 0.00 0.00 177.93 177.66 1orw h ILE 751 N 0.16 1.17 0.03 6.26 2.10 -1.39 0.38 117.51 126.22 1orw h ILE 751 Ca 0.21 -0.73 -0.23 0.00 1.08 0.00 0.00 64.86 65.19 1orw h ILE 751 Cb 0.28 1.08 -0.02 0.00 -1.09 0.00 0.00 36.82 37.07 1orw h ILE 751 CO -0.31 0.24 -1.10 1.88 -1.08 0.00 0.00 178.15 177.78 1orw h TYR 752 N 0.32 0.11 -0.09 2.19 0.05 -1.43 -1.22 116.97 116.91 1orw h TYR 752 Ca 0.07 -0.08 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 1orw h TYR 752 Cb 0.33 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 1orw h TYR 752 CO 0.01 1.07 -0.10 1.15 -1.05 0.00 0.00 178.16 179.23 1orw h THR 753 N 0.02 1.37 0.22 -2.88 2.02 -0.45 -1.37 112.91 111.84 1orw h THR 753 Ca -0.05 -1.29 0.01 0.00 0.77 0.00 0.00 66.41 65.85 1orw h THR 753 Cb 1.83 2.02 -0.04 0.00 -1.74 0.00 0.00 68.15 70.22 1orw h THR 753 CO 0.14 0.36 -0.44 -0.74 0.37 0.00 0.00 175.52 175.22 1orw h HIS 754 N -0.19 -1.23 -0.05 3.16 -0.00 -0.30 -0.70 115.15 115.85 1orw h HIS 754 Ca 0.01 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.42 1orw h HIS 754 Cb 0.63 0.51 -0.00 0.00 -0.00 0.00 0.00 27.41 28.55 1orw h HIS 754 CO 0.09 -0.55 0.04 0.52 -0.00 0.00 0.00 177.93 178.04 1orw h MET 755 N -0.74 0.00 -0.19 5.26 2.07 -1.25 -1.24 114.93 118.85 1orw h MET 755 Ca -0.00 0.00 -0.10 0.00 -2.07 0.00 0.00 59.70 57.52 1orw h MET 755 Cb 0.72 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.45 1orw h MET 755 CO -0.19 0.00 -0.29 0.77 1.07 0.00 0.00 176.91 178.26 1orw h SER 756 N 0.00 0.58 0.36 1.22 0.02 -0.18 -1.42 113.55 114.14 1orw h SER 756 Ca 0.02 -0.53 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 1orw h SER 756 Cb 0.11 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 1orw h SER 756 CO -0.00 0.99 -0.20 0.45 -1.14 0.00 0.00 176.83 176.93 1orw h HIS 757 N 0.18 -0.53 -0.53 3.45 3.86 -0.04 -0.78 115.15 120.76 1orw h HIS 757 Ca 0.02 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.32 1orw h HIS 757 Cb 0.87 0.18 -0.09 0.00 1.06 0.00 0.00 27.41 29.44 1orw h HIS 757 CO 0.09 -0.32 0.02 0.35 0.86 0.00 0.00 177.93 178.93 1orw h PHE 758 N -0.53 0.00 -0.18 2.45 3.57 -1.37 0.12 116.94 120.99 1orw h PHE 758 Ca -0.04 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1orw h PHE 758 Cb 0.43 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1orw h PHE 758 CO -0.08 -0.11 0.12 -0.07 -2.23 0.00 0.00 178.31 175.94 1orw h LEU 759 N 0.14 0.21 -1.01 0.59 3.38 -1.04 -1.97 115.31 115.62 1orw h LEU 759 Ca 0.27 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1orw h LEU 759 Cb 0.41 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 1orw h LEU 759 CO -0.43 0.18 0.63 0.11 0.09 0.00 0.00 178.44 179.01 1orw h LYS 760 N 0.23 1.30 0.39 1.13 1.79 -0.18 -0.59 116.57 120.63 1orw h LYS 760 Ca 0.07 -0.09 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 1orw h LYS 760 Cb -0.00 -0.29 0.00 0.00 -1.58 0.00 0.00 32.23 30.36 1orw h LYS 760 CO -0.01 0.87 -0.22 1.96 -1.08 0.00 0.00 179.45 180.97 1orw h GLN 761 N 1.33 -0.55 -1.07 3.15 1.08 -0.53 0.47 115.11 118.99 1orw h GLN 761 Ca 0.35 0.04 0.29 0.00 -1.45 0.00 0.00 58.65 57.88 1orw h GLN 761 Cb -0.12 0.13 -0.10 0.00 -0.05 0.00 0.00 27.48 27.33 1orw h GLN 761 CO -0.07 -0.37 0.69 0.00 -0.95 0.00 0.00 178.83 178.13 1orw n PHE 763 N -4.64 0.19 -3.08 0.00 3.72 -0.24 -4.90 117.46 108.50 1orw n PHE 763 Ca 0.27 -0.09 -0.23 0.00 -0.05 0.00 0.00 57.45 57.35 1orw n PHE 763 Cb 0.94 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.52 1orw n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1orw n SER 764 N 0.11 -6.06 -4.80 4.37 7.64 0.20 -4.97 113.62 110.11 1orw n SER 764 Ca 0.15 -0.31 -0.36 0.00 1.01 0.00 0.00 58.87 59.36 1orw n SER 764 Cb 0.27 -4.89 -0.07 0.00 -1.01 0.00 0.00 64.21 58.51 1orw n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1orw s LEU 765 N -6.73 4.30 0.00 -3.43 1.43 0.16 -5.02 118.68 109.39 1orw s LEU 765 Ca 0.33 0.39 0.09 0.00 -1.03 0.00 0.00 54.13 53.90 1orw s LEU 765 Cb -0.15 -2.12 0.51 0.00 0.03 0.00 0.00 46.19 44.46 1orw s LEU 765 CO 0.41 0.28 0.96 -0.81 0.23 0.00 0.00 176.35 177.42