#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n5m h ASN -1 N 0.00 0.95 0.00 4.04 -1.24 -2.05 -2.04 115.58 115.24 3n5m h ASN -1 Ca 0.00 -0.16 0.00 0.00 0.71 0.00 0.00 56.30 56.85 3n5m h ASN -1 Cb 0.00 -0.25 0.00 0.00 0.73 0.00 0.00 38.32 38.80 3n5m h ASN -1 CO 0.00 0.87 0.00 0.00 -1.29 0.00 0.00 177.43 177.01 3n5m n ALA 0 N -2.45 1.26 0.00 1.57 0.00 -1.26 -0.08 120.51 119.55 3n5m n ALA 0 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3n5m n ALA 0 Cb 0.21 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3n5m n ALA 0 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3n5m n LYS 2 N 0.57 0.00 -0.19 0.00 4.81 -0.77 -1.96 118.16 120.62 3n5m n LYS 2 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 3n5m n LYS 2 Cb 0.03 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.10 3n5m n LYS 2 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 3n5m h THR 3 N 0.00 1.21 -0.47 3.15 2.02 -0.75 -1.84 112.91 116.22 3n5m h THR 3 Ca 0.00 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 3n5m h THR 3 Cb 0.00 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 3n5m h THR 3 CO 0.00 0.24 0.12 0.50 0.37 0.00 0.00 175.52 176.75 3n5m h LYS 4 N 0.71 0.75 -0.74 6.66 1.63 -1.65 -1.97 116.57 121.97 3n5m h LYS 4 Ca 0.18 -0.18 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 3n5m h LYS 4 Cb 0.15 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 3n5m h LYS 4 CO -0.02 0.74 0.31 1.96 -3.45 0.00 0.00 179.45 178.98 3n5m h GLN 5 N 0.64 1.09 -0.40 1.90 4.20 -1.83 -1.63 115.11 119.08 3n5m h GLN 5 Ca 0.15 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3n5m h GLN 5 Cb 0.32 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 3n5m h GLN 5 CO 0.00 0.88 0.16 1.15 -0.67 0.00 0.00 178.83 180.35 3n5m h THR 6 N 1.07 1.19 -0.59 -0.54 2.02 -1.10 -1.65 112.91 113.32 3n5m h THR 6 Ca 0.25 -0.59 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 3n5m h THR 6 Cb 0.18 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 3n5m h THR 6 CO -0.02 0.22 0.24 0.44 0.37 0.00 0.00 175.52 176.76 3n5m h ASP 7 N 0.50 0.80 -0.73 4.18 5.19 -1.09 0.49 116.42 125.76 3n5m h ASP 7 Ca 0.13 -0.16 -0.03 0.00 -0.62 0.00 0.00 57.03 56.35 3n5m h ASP 7 Cb 0.18 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 39.45 3n5m h ASP 7 CO -0.01 0.75 0.35 -0.33 -3.12 0.00 0.00 179.24 176.88 3n5m h GLU 8 N 0.81 1.05 -0.37 3.56 5.08 -1.12 -0.73 114.58 122.86 3n5m h GLU 8 Ca 0.20 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 3n5m h GLU 8 Cb 0.19 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3n5m h GLU 8 CO -0.02 0.82 -0.07 1.25 -1.00 0.00 0.00 179.01 180.00 3n5m h LEU 9 N 1.02 0.70 -0.86 1.33 5.85 -0.89 -2.26 115.31 120.20 3n5m h LEU 9 Ca 0.25 -0.35 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 3n5m h LEU 9 Cb 0.12 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 3n5m h LEU 9 CO -0.03 0.89 0.22 -0.07 -0.34 0.00 0.00 178.44 179.11 3n5m h LEU 10 N 0.50 0.99 -0.54 2.25 3.38 -0.68 -0.79 115.31 120.43 3n5m h LEU 10 Ca 0.10 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3n5m h LEU 10 Cb 0.57 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3n5m h LEU 10 CO 0.03 0.92 0.16 0.00 0.09 0.00 0.00 178.44 179.64 3n5m h ALA 11 N 1.21 0.70 -0.73 1.53 0.00 -0.98 -1.28 119.26 119.71 3n5m h ALA 11 Ca 0.23 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3n5m h ALA 11 Cb 0.28 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3n5m h ALA 11 CO -0.01 0.38 0.24 0.87 0.00 0.00 0.00 179.25 180.73 3n5m h LYS 12 N 0.75 1.13 -0.46 0.00 1.57 -1.08 -2.21 116.57 116.26 3n5m h LYS 12 Ca 0.17 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 3n5m h LYS 12 Cb 0.30 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3n5m h LYS 12 CO -0.00 0.96 0.22 0.22 -0.57 0.00 0.00 179.45 180.28 3n5m h ASP 13 N 1.08 0.60 -0.60 0.86 3.58 -0.88 -0.75 116.42 120.32 3n5m h ASP 13 Ca 0.24 -0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 3n5m h ASP 13 Cb 0.29 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.16 3n5m h ASP 13 CO -0.01 0.56 0.30 -0.08 -2.88 0.00 0.00 179.24 177.13 3n5m h GLU 14 N 0.60 0.85 -0.47 0.28 4.81 -1.08 -0.37 114.58 119.21 3n5m h GLU 14 Ca 0.16 -0.12 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3n5m h GLU 14 Cb 0.12 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3n5m h GLU 14 CO -0.02 0.68 -0.09 0.37 -0.73 0.00 0.00 179.01 179.22 3n5m h GLN 15 N 0.81 0.84 0.00 1.92 4.15 -1.18 -3.40 115.11 118.26 3n5m h GLN 15 Ca 0.21 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3n5m h GLN 15 Cb 0.10 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.72 3n5m h GLN 15 CO -0.03 0.90 -0.82 0.66 -1.93 0.00 0.00 178.83 177.62 3n5m n TYR 16 N -4.16 0.00 -4.40 3.99 4.01 -0.31 -5.04 117.16 111.25 3n5m n TYR 16 Ca 0.02 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.42 3n5m n TYR 16 Cb 0.37 -0.03 -0.12 0.00 -0.31 0.00 0.00 39.34 39.25 3n5m n TYR 16 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3n5m s VAL 17 N -1.86 3.98 -0.27 -0.72 1.01 -0.18 -5.05 120.40 117.30 3n5m s VAL 17 Ca -0.00 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.54 3n5m s VAL 17 Cb 0.01 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 3n5m s VAL 17 CO 0.06 0.52 0.16 0.86 0.00 0.00 0.00 175.10 176.70 3n5m s TRP 18 N 0.06 3.19 -0.17 5.22 -0.11 -1.26 -4.80 118.94 121.08 3n5m s TRP 18 Ca 0.00 -0.02 -0.12 0.00 1.22 0.00 0.00 56.10 57.18 3n5m s TRP 18 Cb -0.13 -2.34 -0.05 0.00 -1.50 0.00 0.00 33.47 29.45 3n5m s TRP 18 CO 0.03 -0.20 0.23 -1.01 -4.62 0.00 0.00 176.95 171.37 3n5m s HIS 19 N 1.69 3.46 -1.00 5.86 3.76 -1.26 -5.16 115.29 122.64 3n5m s HIS 19 Ca 0.07 0.52 -0.21 0.00 -0.15 0.00 0.00 55.06 55.29 3n5m s HIS 19 Cb -0.16 -2.25 -0.10 0.00 1.11 0.00 0.00 32.58 31.19 3n5m s HIS 19 CO 0.09 0.31 1.96 0.41 -0.85 0.00 0.00 174.74 176.66 3n5m n GLY 20 N 3.27 2.55 0.00 -2.22 0.00 -1.26 -4.98 105.19 102.55 3n5m n GLY 20 Ca -0.14 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.66 3n5m n GLY 20 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3n5m n ARG 22 N 7.22 0.00 -1.46 1.61 1.85 -1.26 -5.22 116.66 119.40 3n5m n ARG 22 Ca 0.49 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 57.00 3n5m n ARG 22 Cb 0.42 0.00 0.09 0.00 -1.05 0.00 0.00 32.46 31.92 3n5m n ARG 22 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 3n5m s PRO 23 N -4.09 2.22 -0.66 2.89 0.02 -1.26 -4.83 135.00 129.29 3n5m s PRO 23 Ca 0.00 1.68 -0.27 0.00 0.02 0.00 0.00 61.00 62.43 3n5m s PRO 23 Cb 0.00 -1.85 0.04 0.00 0.02 0.00 0.00 34.50 32.70 3n5m s PRO 23 CO 0.00 -1.76 1.18 0.12 -0.33 0.00 0.00 177.00 176.22 3n5m s PHE 24 N -2.09 2.48 -0.44 6.54 5.36 -1.26 -4.85 117.98 123.72 3n5m s PHE 24 Ca 0.72 0.04 0.07 0.00 -0.96 0.00 0.00 56.93 56.81 3n5m s PHE 24 Cb -0.27 -4.50 0.24 0.00 -0.34 0.00 0.00 43.02 38.14 3n5m s PHE 24 CO 0.45 -1.81 0.53 -1.13 -1.46 0.00 0.00 175.22 171.80 3n5m n SER 25 N 8.71 0.72 -0.22 6.13 3.41 -1.26 -5.00 113.62 126.11 3n5m n SER 25 Ca 0.04 -2.78 -0.02 0.00 -0.26 0.00 0.00 58.87 55.85 3n5m n SER 25 Cb 0.48 -0.64 0.18 0.00 -0.26 0.00 0.00 64.21 63.97 3n5m n SER 25 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3n5m h PRO 26 N 4.31 1.01 -0.74 4.33 0.13 -1.99 -0.96 132.00 138.09 3n5m h PRO 26 Ca 0.12 -0.13 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 3n5m h PRO 26 Cb 0.85 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.75 3n5m h PRO 26 CO 0.51 0.78 0.36 -0.91 -0.23 0.00 0.00 178.00 178.51 3n5m h ASN 27 N 1.01 0.95 0.59 1.44 2.35 -1.95 -2.83 115.58 117.14 3n5m h ASN 27 Ca 0.25 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3n5m h ASN 27 Cb 0.09 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.22 3n5m h ASN 27 CO -0.03 0.80 0.00 -1.20 -1.65 0.00 0.00 177.43 175.35 3n5m n SER 28 N -4.33 0.43 -4.76 5.81 7.64 -0.37 -4.89 113.62 113.15 3n5m n SER 28 Ca 0.07 0.61 -0.41 0.00 1.01 0.00 0.00 58.87 60.15 3n5m n SER 28 Cb 0.13 -0.70 -0.01 0.00 -1.01 0.00 0.00 64.21 62.62 3n5m n SER 28 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3n5m s THR 29 N -3.22 2.01 -0.26 0.44 2.01 -1.07 -4.99 115.64 110.57 3n5m s THR 29 Ca 0.05 0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.99 3n5m s THR 29 Cb 0.09 -3.01 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 3n5m s THR 29 CO 0.33 0.00 0.07 -0.89 -0.69 0.00 0.00 174.62 173.44 3n5m s THR 30 N -0.54 4.21 -0.44 -0.82 2.01 -1.26 -5.07 115.64 113.72 3n5m s THR 30 Ca 0.58 -0.29 -0.16 0.00 0.31 0.00 0.00 61.69 62.13 3n5m s THR 30 Cb -0.48 -3.01 0.04 0.00 0.01 0.00 0.00 72.50 69.07 3n5m s THR 30 CO 0.56 0.29 0.39 -0.69 -0.69 0.00 0.00 174.62 174.48 3n5m s VAL 31 N 1.59 5.18 0.36 3.82 1.01 -1.26 -5.05 120.40 126.05 3n5m s VAL 31 Ca 0.06 -0.73 -0.28 0.00 0.00 0.00 0.00 61.98 61.02 3n5m s VAL 31 Cb -0.15 -4.06 -0.11 0.00 0.00 0.00 0.00 36.38 32.06 3n5m s VAL 31 CO 0.03 -0.48 1.44 -0.83 0.00 0.00 0.00 175.10 175.26 3n5m s GLY 32 N 2.13 2.93 -0.03 4.51 0.00 -1.26 -1.02 107.32 114.58 3n5m s GLY 32 Ca 0.07 1.49 -0.01 0.00 0.00 0.00 0.00 44.72 46.27 3n5m s GLY 32 CO 0.10 2.18 -0.03 0.00 0.00 0.00 0.00 173.10 175.34 3n5m n ALA 33 N 0.63 2.52 -3.83 3.20 0.00 0.05 -4.71 120.51 118.37 3n5m n ALA 33 Ca 0.01 -0.11 -0.07 0.00 0.00 0.00 0.00 53.44 53.27 3n5m n ALA 33 Cb 0.40 0.46 -0.00 0.00 0.00 0.00 0.00 19.45 20.30 3n5m n ALA 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3n5m s LYS 34 N -2.05 1.89 -0.03 0.00 -2.85 -1.05 -5.04 119.74 110.62 3n5m s LYS 34 Ca -0.04 -1.13 -0.29 0.00 -1.00 0.00 0.00 55.97 53.51 3n5m s LYS 34 Cb 0.01 0.59 0.10 0.00 -2.06 0.00 0.00 37.83 36.47 3n5m s LYS 34 CO 0.05 -0.88 0.88 0.00 0.10 0.00 0.00 175.35 175.50 3n5m s ALA 35 N -3.16 -1.83 -0.29 0.59 0.00 -1.26 -0.93 121.76 114.88 3n5m s ALA 35 Ca 0.13 1.11 -0.13 0.00 0.00 0.00 0.00 51.96 53.07 3n5m s ALA 35 Cb -0.05 0.21 0.11 0.00 0.00 0.00 0.00 23.12 23.39 3n5m s ALA 35 CO 0.08 -0.60 0.71 -2.00 0.00 0.00 0.00 175.76 173.95 3n5m s GLU 36 N -2.66 0.61 6.89 0.00 2.56 -0.46 -3.95 118.70 121.69 3n5m s GLU 36 Ca 0.02 1.27 0.00 0.00 0.00 0.00 0.00 54.97 56.26 3n5m s GLU 36 Cb -0.01 0.47 0.00 0.00 2.00 0.00 0.00 34.13 36.60 3n5m s GLU 36 CO -0.06 -0.16 0.00 0.41 -0.56 0.00 0.00 175.26 174.88 3n5m n GLY 37 N 4.81 2.28 0.71 -1.50 0.00 -0.31 -2.13 105.19 109.05 3n5m n GLY 37 Ca -0.16 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 45.89 3n5m n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5m s TRP 39 N -1.18 2.80 0.27 0.00 0.52 -0.90 -0.24 118.94 120.21 3n5m s TRP 39 Ca 0.23 -0.25 0.11 0.00 0.02 0.00 0.00 56.10 56.22 3n5m s TRP 39 Cb 0.14 -1.72 -0.05 0.00 -1.15 0.00 0.00 33.47 30.69 3n5m s TRP 39 CO 0.20 0.11 -0.16 0.14 0.02 0.00 0.00 176.95 177.26 3n5m s VAL 40 N -0.40 2.70 -0.01 4.03 -7.23 -0.25 -1.36 120.40 117.88 3n5m s VAL 40 Ca 0.05 -2.28 0.01 0.00 -1.81 0.00 0.00 61.98 57.94 3n5m s VAL 40 Cb -0.12 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.40 3n5m s VAL 40 CO 0.02 -0.38 -0.01 -0.70 -0.31 0.00 0.00 175.10 173.71 3n5m s GLU 41 N -3.52 0.16 0.77 4.82 2.12 -0.11 -0.58 118.70 122.36 3n5m s GLU 41 Ca 0.30 -0.03 -0.03 0.00 0.36 0.00 0.00 54.97 55.57 3n5m s GLU 41 Cb -0.05 -0.19 0.15 0.00 0.26 0.00 0.00 34.13 34.29 3n5m s GLU 41 CO 0.16 0.01 1.05 0.16 -0.54 0.00 0.00 175.26 176.10 3n5m s ASP 42 N 0.15 4.10 0.49 -1.70 1.47 -0.52 -0.77 116.67 119.90 3n5m s ASP 42 Ca -0.01 -0.35 0.23 0.00 1.18 0.00 0.00 52.55 53.60 3n5m s ASP 42 Cb -0.03 0.06 1.28 0.00 -0.34 0.00 0.00 42.92 43.89 3n5m s ASP 42 CO -0.00 -2.04 2.03 0.16 0.68 0.00 0.00 175.17 176.00 3n5m h ILE 43 N -0.71 0.76 -0.00 2.11 3.07 -1.36 -1.30 117.51 120.07 3n5m h ILE 43 Ca -0.37 -0.61 0.00 0.00 1.55 0.00 0.00 64.86 65.44 3n5m h ILE 43 Cb 1.26 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 39.18 3n5m h ILE 43 CO 0.38 0.15 -0.10 0.00 -1.05 0.00 0.00 178.15 177.54 3n5m n GLN 44 N -3.84 0.71 -0.17 0.16 1.13 -1.26 -4.93 117.38 109.18 3n5m n GLN 44 Ca -0.02 -0.23 0.00 0.00 -1.94 0.00 0.00 57.00 54.81 3n5m n GLN 44 Cb 0.25 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.11 3n5m n GLN 44 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3n5m n GLY 45 N 1.27 0.64 3.75 1.08 0.00 -0.49 -5.05 105.19 106.38 3n5m n GLY 45 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3n5m n GLY 45 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n5m s LYS 46 N -0.83 4.52 0.09 1.61 2.20 -1.26 -4.78 119.74 121.29 3n5m s LYS 46 Ca 0.00 1.90 0.05 0.00 -0.36 0.00 0.00 55.97 57.57 3n5m s LYS 46 Cb 0.00 -3.20 -0.04 0.00 -1.51 0.00 0.00 37.83 33.08 3n5m s LYS 46 CO 0.00 0.00 -0.03 -0.98 -0.36 0.00 0.00 175.35 173.98 3n5m s ARG 47 N -0.89 2.43 0.00 4.03 1.70 -1.26 -1.43 118.95 123.53 3n5m s ARG 47 Ca 0.49 -0.88 0.01 0.00 -0.47 0.00 0.00 55.73 54.89 3n5m s ARG 47 Cb -0.34 -2.47 -0.01 0.00 -0.57 0.00 0.00 34.95 31.57 3n5m s ARG 47 CO 0.41 0.54 -0.04 0.71 -1.08 0.00 0.00 175.30 175.83 3n5m s TYR 48 N -1.26 0.38 -0.14 5.89 2.02 0.26 -4.60 117.35 119.90 3n5m s TYR 48 Ca 0.24 -0.13 -0.29 0.00 -0.37 0.00 0.00 57.07 56.51 3n5m s TYR 48 Cb -0.11 -0.24 -0.02 0.00 -0.40 0.00 0.00 41.96 41.18 3n5m s TYR 48 CO 0.16 -0.02 1.25 -1.17 -1.57 0.00 0.00 175.55 174.20 3n5m s LEU 49 N -0.31 4.21 -0.95 -1.29 2.96 0.37 -1.09 118.68 122.58 3n5m s LEU 49 Ca -0.00 1.73 -0.20 0.00 -0.22 0.00 0.00 54.13 55.43 3n5m s LEU 49 Cb -0.03 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.22 3n5m s LEU 49 CO -0.00 -0.72 1.22 -0.62 -1.32 0.00 0.00 176.35 174.92 3n5m s ASP 50 N 1.85 6.57 0.00 3.68 -1.08 0.66 -0.71 116.67 127.64 3n5m s ASP 50 Ca 0.55 -1.82 -0.02 0.00 -0.52 0.00 0.00 52.55 50.74 3n5m s ASP 50 Cb -0.23 -2.45 -0.11 0.00 -1.46 0.00 0.00 42.92 38.67 3n5m s ASP 50 CO 0.17 -1.22 2.14 0.61 0.52 0.00 0.00 175.17 177.39 3n5m n GLY 51 N 5.92 2.20 2.61 2.66 0.00 -0.21 -4.35 105.19 114.01 3n5m n GLY 51 Ca 0.26 -0.48 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 3n5m n GLY 51 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3n5m n SER 53 N 2.20 -1.24 0.00 1.61 7.64 -0.96 -0.26 113.62 122.61 3n5m n SER 53 Ca 0.17 -1.79 0.00 0.00 1.01 0.00 0.00 58.87 58.26 3n5m n SER 53 Cb 0.52 0.95 0.00 0.00 -1.01 0.00 0.00 64.21 64.67 3n5m n SER 53 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n5m n GLY 54 N -0.53 1.53 2.33 0.23 0.00 -1.26 -1.19 105.19 106.29 3n5m n GLY 54 Ca -0.21 0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 3n5m n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n5m n LEU 55 N 0.00 0.90 -1.90 0.99 4.77 -1.26 -4.91 117.00 115.59 3n5m n LEU 55 Ca 0.00 -4.80 -0.19 0.00 -0.03 0.00 0.00 56.01 50.99 3n5m n LEU 55 Cb 0.00 0.28 -0.05 0.00 -2.33 0.00 0.00 43.42 41.32 3n5m n LEU 55 CO 0.00 2.00 -0.21 0.79 -1.33 0.00 0.00 177.39 178.64 3n5m n TRP 56 N 1.65 -0.50 0.00 -1.77 7.02 -1.20 -4.83 117.44 117.81 3n5m n TRP 56 Ca 0.24 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.72 3n5m n TRP 56 Cb 0.48 -3.44 0.00 0.00 -2.42 0.00 0.00 31.31 25.94 3n5m n TRP 56 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3n5m n VAL 58 N -0.99 4.18 -0.29 0.00 0.31 -0.33 -3.44 118.33 117.75 3n5m n VAL 58 Ca 0.00 -3.56 -0.06 0.00 -0.01 0.00 0.00 64.34 60.71 3n5m n VAL 58 Cb 0.14 -2.45 0.07 0.00 -0.91 0.00 0.00 33.84 30.69 3n5m n VAL 58 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 3n5m h ASN 59 N 5.50 1.10 -0.02 4.52 4.21 -1.86 -2.57 115.58 126.46 3n5m h ASN 59 Ca 0.60 -0.16 0.00 0.00 1.21 0.00 0.00 56.30 57.94 3n5m h ASN 59 Cb 0.51 -0.28 0.00 0.00 -1.12 0.00 0.00 38.32 37.43 3n5m h ASN 59 CO 1.73 0.96 0.00 -1.20 -1.29 0.00 0.00 177.43 177.63 3n5m n SER 60 N -4.29 0.81 0.00 5.81 7.64 -1.26 -0.38 113.62 121.95 3n5m n SER 60 Ca 0.07 -1.30 0.00 0.00 1.01 0.00 0.00 58.87 58.66 3n5m n SER 60 Cb 0.18 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 3n5m n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n5m n GLY 61 N 1.08 -0.31 3.92 0.23 0.00 -0.97 -4.77 105.19 104.37 3n5m n GLY 61 Ca 0.21 -1.74 -0.26 0.00 0.00 0.00 0.00 46.02 44.22 3n5m n GLY 61 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n5m s TYR 62 N -2.05 3.36 -0.08 1.61 1.51 0.19 -4.49 117.35 117.41 3n5m s TYR 62 Ca 0.00 0.64 0.00 0.00 -1.01 0.00 0.00 57.07 56.70 3n5m s TYR 62 Cb 0.00 -2.51 0.00 0.00 -0.11 0.00 0.00 41.96 39.34 3n5m s TYR 62 CO 0.00 -0.55 0.00 0.41 -1.11 0.00 0.00 175.55 174.30 3n5m n GLY 63 N -2.39 0.45 3.55 0.71 0.00 -1.25 -1.16 105.19 105.09 3n5m n GLY 63 Ca 0.03 -0.94 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 3n5m n GLY 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n5m s ARG 64 N -1.85 3.02 0.32 1.61 1.81 -1.26 -4.84 118.95 117.76 3n5m s ARG 64 Ca 0.00 -0.08 0.02 0.00 -1.72 0.00 0.00 55.73 53.95 3n5m s ARG 64 Cb 0.00 -4.42 0.54 0.00 -0.45 0.00 0.00 34.95 30.62 3n5m s ARG 64 CO 0.00 -2.41 1.88 0.87 -0.68 0.00 0.00 175.30 174.97 3n5m h LYS 65 N 11.58 0.68 0.00 3.54 1.79 -1.99 -2.48 116.57 129.70 3n5m h LYS 65 Ca -0.20 -0.12 -0.04 0.00 -2.18 0.00 0.00 60.65 58.11 3n5m h LYS 65 Cb 1.08 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.61 3n5m h LYS 65 CO 1.27 0.62 -0.20 1.05 -1.08 0.00 0.00 179.45 181.11 3n5m h GLU 66 N 0.67 0.00 0.02 3.15 9.09 -1.99 -0.65 114.58 124.87 3n5m h GLU 66 Ca 0.15 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.36 3n5m h GLU 66 Cb 0.23 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.35 3n5m h GLU 66 CO -0.00 0.20 -0.80 -0.07 0.05 0.00 0.00 179.01 178.39 3n5m h LEU 67 N 0.00 0.66 -0.58 3.06 3.38 -1.83 -2.37 115.31 117.63 3n5m h LEU 67 Ca -0.00 -0.78 0.07 0.00 0.09 0.00 0.00 57.88 57.27 3n5m h LEU 67 Cb 0.43 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 3n5m h LEU 67 CO 0.03 1.36 0.26 0.00 0.09 0.00 0.00 178.44 180.17 3n5m h ALA 68 N 0.32 0.76 -0.69 1.53 0.00 -1.20 -2.27 119.26 117.71 3n5m h ALA 68 Ca -0.11 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3n5m h ALA 68 Cb 1.50 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.25 3n5m h ALA 68 CO 0.16 -0.13 0.37 0.93 0.00 0.00 0.00 179.25 180.58 3n5m h GLU 69 N 0.48 0.96 -0.47 0.00 4.39 -1.15 -1.54 114.58 117.24 3n5m h GLU 69 Ca 0.28 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.86 3n5m h GLU 69 Cb 0.27 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 3n5m h GLU 69 CO -0.24 0.73 0.30 0.00 -1.16 0.00 0.00 179.01 178.64 3n5m h ALA 70 N 1.18 0.60 -0.14 3.43 0.00 -1.07 -0.01 119.26 123.26 3n5m h ALA 70 Ca 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3n5m h ALA 70 Cb 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3n5m h ALA 70 CO -0.04 0.08 0.03 0.00 0.00 0.00 0.00 179.25 179.32 3n5m h ALA 71 N 1.15 0.18 -0.36 0.00 0.00 -1.30 -2.70 119.26 116.22 3n5m h ALA 71 Ca 0.17 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.99 3n5m h ALA 71 Cb -0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3n5m h ALA 71 CO -0.03 -0.18 0.10 -0.92 0.00 0.00 0.00 179.25 178.22 3n5m h TYR 72 N 0.02 0.18 -1.00 0.00 3.20 -1.12 0.21 116.97 118.47 3n5m h TYR 72 Ca 0.04 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.94 3n5m h TYR 72 Cb 0.26 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 3n5m h TYR 72 CO 0.01 0.06 0.65 -0.22 -1.64 0.00 0.00 178.16 177.02 3n5m h LYS 73 N 0.24 1.32 -0.34 1.82 3.64 -0.98 -2.01 116.57 120.26 3n5m h LYS 73 Ca 0.17 -0.09 -0.15 0.00 -1.27 0.00 0.00 60.65 59.32 3n5m h LYS 73 Cb 0.16 -0.29 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3n5m h LYS 73 CO -0.19 0.88 -0.35 0.37 -2.27 0.00 0.00 179.45 177.88 3n5m h GLN 74 N 1.35 0.84 -0.07 1.90 5.75 -1.12 -2.98 115.11 120.78 3n5m h GLN 74 Ca 0.36 -0.45 0.01 0.00 -0.15 0.00 0.00 58.65 58.43 3n5m h GLN 74 Cb -0.14 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 28.42 3n5m h GLN 74 CO -0.08 1.09 0.05 -0.07 -2.65 0.00 0.00 178.83 177.17 3n5m h LEU 75 N 0.63 0.03 -0.02 -2.39 3.38 -0.65 -0.02 115.31 116.25 3n5m h LEU 75 Ca 0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3n5m h LEU 75 Cb 0.94 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.69 3n5m h LEU 75 CO 0.09 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.64 3n5m n GLN 76 N -4.52 0.18 -0.10 1.13 6.02 -0.78 -4.31 117.38 114.99 3n5m n GLN 76 Ca -0.01 0.16 -0.19 0.00 -0.01 0.00 0.00 57.00 56.95 3n5m n GLN 76 Cb 0.14 -1.71 -0.06 0.00 1.02 0.00 0.00 30.24 29.63 3n5m n GLN 76 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3n5m n THR 77 N -2.02 1.44 -3.48 5.09 -1.04 -0.16 -5.00 114.28 109.11 3n5m n THR 77 Ca 0.06 -0.12 -0.02 0.00 -2.04 0.00 0.00 64.05 61.93 3n5m n THR 77 Cb 0.39 -2.05 -0.05 0.00 -1.82 0.00 0.00 70.33 66.81 3n5m n THR 77 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3n5m s LEU 78 N -7.59 -1.07 0.01 -4.42 2.96 -0.40 -5.05 118.68 103.13 3n5m s LEU 78 Ca -0.31 1.14 0.11 0.00 -0.22 0.00 0.00 54.13 54.84 3n5m s LEU 78 Cb 0.09 1.97 -0.22 0.00 0.50 0.00 0.00 46.19 48.53 3n5m s LEU 78 CO 0.42 -0.24 0.86 0.77 -1.32 0.00 0.00 176.35 176.84 3n5m h SER 79 N 8.05 0.00 -4.02 3.68 4.64 -1.75 -3.42 113.55 120.74 3n5m h SER 79 Ca -0.19 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.97 3n5m h SER 79 Cb 1.12 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.97 3n5m h SER 79 CO 0.17 0.98 -0.40 -0.47 -0.87 0.00 0.00 176.83 176.23 3n5m s TYR 80 N -2.65 -0.26 -0.21 4.77 5.04 -1.26 -4.35 117.35 118.43 3n5m s TYR 80 Ca -0.03 0.61 -0.15 0.00 -2.44 0.00 0.00 57.07 55.07 3n5m s TYR 80 Cb 0.09 0.09 0.06 0.00 0.35 0.00 0.00 41.96 42.55 3n5m s TYR 80 CO 0.82 -0.17 0.54 0.12 -1.34 0.00 0.00 175.55 175.52 3n5m s PHE 81 N -0.10 -0.72 0.00 4.97 2.19 -1.26 -5.08 117.98 117.98 3n5m s PHE 81 Ca -0.02 1.58 0.00 0.00 0.33 0.00 0.00 56.93 58.82 3n5m s PHE 81 Cb -0.03 0.34 0.00 0.00 -1.31 0.00 0.00 43.02 42.02 3n5m s PHE 81 CO 0.01 -0.37 0.00 -0.35 1.83 0.00 0.00 175.22 176.34 3n5m n PRO 82 N 3.69 2.39 0.00 10.12 -0.04 -1.26 -4.89 135.00 145.01 3n5m n PRO 82 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 3n5m n PRO 82 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 3n5m n PRO 82 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3n5m n SER 84 N 0.00 0.00 -1.46 3.54 3.41 -1.26 -3.54 113.62 114.31 3n5m n SER 84 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3n5m n SER 84 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3n5m n SER 84 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n5m n GLN 85 N 0.00 1.67 -4.17 4.33 1.13 -1.26 -5.15 117.38 113.92 3n5m n GLN 85 Ca 0.00 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.95 3n5m n GLN 85 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 30.24 30.25 3n5m n GLN 85 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3n5m s SER 86 N -1.00 0.40 0.07 1.08 0.15 -1.23 -5.13 113.70 108.03 3n5m s SER 86 Ca 0.00 -1.24 -0.08 0.00 0.70 0.00 0.00 55.95 55.33 3n5m s SER 86 Cb 0.00 0.29 -0.00 0.00 -1.71 0.00 0.00 66.02 64.59 3n5m s SER 86 CO 0.00 -0.73 0.16 -1.38 1.20 0.00 0.00 173.24 172.49 3n5m s HIS 87 N -4.02 0.17 0.18 3.44 -3.43 -1.26 -4.92 115.29 105.45 3n5m s HIS 87 Ca 0.27 -0.56 -0.12 0.00 -0.80 0.00 0.00 55.06 53.86 3n5m s HIS 87 Cb 0.07 -0.09 0.10 0.00 -1.43 0.00 0.00 32.58 31.23 3n5m s HIS 87 CO 0.04 -0.49 1.77 0.93 -2.00 0.00 0.00 174.74 174.99 3n5m h GLU 88 N 3.01 0.91 -0.96 -0.38 5.08 -2.00 -2.51 114.58 117.72 3n5m h GLU 88 Ca -0.33 -0.13 0.09 0.00 -1.00 0.00 0.00 59.36 57.98 3n5m h GLU 88 Cb 1.19 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 30.20 3n5m h GLU 88 CO 0.55 0.72 0.60 -1.35 -1.00 0.00 0.00 179.01 178.54 3n5m h PRO 89 N 0.87 1.00 -0.56 2.33 0.11 -1.96 -0.02 132.00 133.77 3n5m h PRO 89 Ca 0.22 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.18 3n5m h PRO 89 Cb 0.11 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.97 3n5m h PRO 89 CO -0.03 0.66 0.02 0.00 -0.21 0.00 0.00 178.00 178.44 3n5m h ALA 90 N 1.48 0.76 -0.15 -0.75 0.00 -1.77 -1.19 119.26 117.63 3n5m h ALA 90 Ca 0.44 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3n5m h ALA 90 Cb 0.31 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3n5m h ALA 90 CO -0.22 0.57 0.01 0.82 0.00 0.00 0.00 179.25 180.43 3n5m h ILE 91 N 0.87 1.25 -0.80 0.00 2.04 -1.03 -0.83 117.51 119.00 3n5m h ILE 91 Ca 0.16 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 3n5m h ILE 91 Cb 0.52 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 38.05 3n5m h ILE 91 CO 0.03 0.24 0.37 0.11 0.00 0.00 0.00 178.15 178.89 3n5m h LYS 92 N 0.01 1.17 -0.44 2.37 1.57 -1.01 -2.00 116.57 118.23 3n5m h LYS 92 Ca 0.04 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.52 3n5m h LYS 92 Cb 0.36 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 3n5m h LYS 92 CO 0.01 0.92 -0.17 1.25 -0.57 0.00 0.00 179.45 180.88 3n5m h LEU 93 N 1.15 0.92 -0.69 2.94 5.85 -1.12 -1.26 115.31 123.09 3n5m h LEU 93 Ca 0.27 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.61 3n5m h LEU 93 Cb 0.15 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3n5m h LEU 93 CO -0.03 1.10 0.46 0.00 -0.34 0.00 0.00 178.44 179.62 3n5m h ALA 94 N 0.85 0.88 -0.59 1.25 0.00 -1.00 0.28 119.26 120.92 3n5m h ALA 94 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3n5m h ALA 94 Cb 0.73 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3n5m h ALA 94 CO 0.06 0.30 0.22 1.49 0.00 0.00 0.00 179.25 181.31 3n5m h GLU 95 N 0.93 0.90 -0.45 0.00 4.81 -1.29 -2.00 114.58 117.48 3n5m h GLU 95 Ca 0.26 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 3n5m h GLU 95 Cb -0.10 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 3n5m h GLU 95 CO -0.06 0.79 0.03 -0.22 -0.73 0.00 0.00 179.01 178.82 3n5m h LYS 96 N 0.83 0.78 -0.54 1.92 1.63 -0.52 -2.43 116.57 118.24 3n5m h LYS 96 Ca 0.20 -0.23 -0.04 0.00 -0.85 0.00 0.00 60.65 59.72 3n5m h LYS 96 Cb 0.24 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 3n5m h LYS 96 CO -0.01 0.82 0.16 -0.07 -3.45 0.00 0.00 179.45 176.90 3n5m h LEU 97 N 0.63 0.75 -0.87 5.20 3.38 -0.42 -1.24 115.31 122.74 3n5m h LEU 97 Ca 0.13 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3n5m h LEU 97 Cb 0.45 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3n5m h LEU 97 CO 0.02 0.72 0.25 -1.13 0.09 0.00 0.00 178.44 178.38 3n5m h ASN 98 N 0.79 1.01 -0.15 -0.43 -1.24 -1.11 0.51 115.58 114.95 3n5m h ASN 98 Ca 0.18 -0.17 -0.00 0.00 0.71 0.00 0.00 56.30 57.02 3n5m h ASN 98 Cb 0.25 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 3n5m h ASN 98 CO -0.01 0.92 0.07 -0.33 -1.29 0.00 0.00 177.43 176.79 3n5m h GLU 99 N 1.05 0.21 -0.89 6.67 5.08 -0.93 -0.38 114.58 125.40 3n5m h GLU 99 Ca 0.24 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 3n5m h GLU 99 Cb 0.25 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 3n5m h GLU 99 CO -0.01 0.25 0.51 -1.49 -1.00 0.00 0.00 179.01 177.26 3n5m h TRP 100 N 0.12 1.20 0.00 4.33 4.06 -0.90 -1.99 115.95 122.77 3n5m h TRP 100 Ca 0.05 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.98 3n5m h TRP 100 Cb 0.10 -0.39 0.00 0.00 -1.00 0.00 0.00 29.16 27.88 3n5m h TRP 100 CO -0.03 0.81 0.00 -0.07 -3.56 0.00 0.00 178.44 175.59 3n5m h LEU 101 N 1.23 0.00 0.00 -4.49 3.38 -0.80 -3.47 115.31 111.17 3n5m h LEU 101 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3n5m h LEU 101 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3n5m h LEU 101 CO -0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.09 3n5m n GLY 102 N 0.37 0.74 0.26 0.83 0.00 -0.75 -4.94 105.19 101.71 3n5m n GLY 102 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.08 3n5m n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n5m n GLY 103 N -2.34 -2.20 3.34 -0.02 0.00 -0.21 -5.00 105.19 98.75 3n5m n GLY 103 Ca 0.00 -1.42 -0.35 0.00 0.00 0.00 0.00 46.02 44.25 3n5m n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n5m s GLU 104 N -2.42 3.39 0.13 1.61 0.41 -1.26 -5.09 118.70 115.47 3n5m s GLU 104 Ca 0.00 -0.63 0.05 0.00 -0.41 0.00 0.00 54.97 53.98 3n5m s GLU 104 Cb 0.00 -3.11 -0.04 0.00 -1.78 0.00 0.00 34.13 29.20 3n5m s GLU 104 CO 0.00 -0.22 -0.12 0.71 -0.49 0.00 0.00 175.26 175.14 3n5m s TYR 105 N 1.50 1.29 -0.08 1.61 1.51 -1.26 -2.46 117.35 119.46 3n5m s TYR 105 Ca 0.05 -0.66 0.03 0.00 -1.01 0.00 0.00 57.07 55.49 3n5m s TYR 105 Cb -0.15 -0.66 -0.01 0.00 -0.11 0.00 0.00 41.96 41.02 3n5m s TYR 105 CO -0.01 0.10 -0.19 0.08 -1.11 0.00 0.00 175.55 174.42 3n5m s VAL 106 N -2.74 2.60 -0.19 0.71 1.01 0.34 -4.85 120.40 117.27 3n5m s VAL 106 Ca 0.12 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 3n5m s VAL 106 Cb -0.01 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 3n5m s VAL 106 CO 0.02 0.56 0.02 -0.63 0.00 0.00 0.00 175.10 175.07 3n5m s ILE 107 N -0.06 4.27 -0.20 2.22 -1.09 -1.26 -1.14 121.20 123.93 3n5m s ILE 107 Ca -0.05 -0.21 -0.07 0.00 -2.23 0.00 0.00 60.65 58.10 3n5m s ILE 107 Cb -0.14 -2.92 -0.03 0.00 -1.58 0.00 0.00 42.46 37.78 3n5m s ILE 107 CO 0.04 0.44 0.05 0.12 -1.23 0.00 0.00 174.94 174.36 3n5m s PHE 108 N 0.73 3.14 -0.06 3.97 2.19 -0.37 -4.96 117.98 122.62 3n5m s PHE 108 Ca 0.01 -0.19 -0.18 0.00 0.33 0.00 0.00 56.93 56.91 3n5m s PHE 108 Cb -0.14 -2.12 -0.05 0.00 -1.31 0.00 0.00 43.02 39.40 3n5m s PHE 108 CO 0.02 -0.08 0.49 -0.06 1.83 0.00 0.00 175.22 177.41 3n5m s PHE 109 N 0.86 3.61 0.13 10.12 0.08 -1.26 -0.87 117.98 130.65 3n5m s PHE 109 Ca 0.03 0.99 0.01 0.00 0.12 0.00 0.00 56.93 58.08 3n5m s PHE 109 Cb -0.14 -2.50 -0.04 0.00 -0.57 0.00 0.00 43.02 39.77 3n5m s PHE 109 CO 0.02 0.34 -0.03 -1.12 -0.10 0.00 0.00 175.22 174.33 3n5m s SER 110 N -0.02 1.07 0.07 1.36 0.01 0.15 -4.27 113.70 112.07 3n5m s SER 110 Ca 0.26 -1.08 -0.18 0.00 1.31 0.00 0.00 55.95 56.26 3n5m s SER 110 Cb -0.16 0.13 -0.10 0.00 0.21 0.00 0.00 66.02 66.09 3n5m s SER 110 CO 0.13 -0.53 1.42 0.78 0.41 0.00 0.00 173.24 175.45 3n5m h ASN 111 N 2.87 0.51 -2.25 2.44 2.35 -1.89 3.18 115.58 122.79 3n5m h ASN 111 Ca -0.36 -0.43 -0.58 0.00 -0.55 0.00 0.00 56.30 54.39 3n5m h ASN 111 Cb 1.18 -0.14 -0.14 0.00 0.05 0.00 0.00 38.32 39.27 3n5m h ASN 111 CO 0.64 0.83 -0.67 -0.94 -1.65 0.00 0.00 177.43 175.63 3n5m s SER 112 N -6.20 3.42 0.25 5.81 1.04 -1.26 -2.24 113.70 114.52 3n5m s SER 112 Ca -0.13 -1.22 -0.04 0.00 0.48 0.00 0.00 55.95 55.03 3n5m s SER 112 Cb 0.07 -0.29 0.30 0.00 0.10 0.00 0.00 66.02 66.20 3n5m s SER 112 CO 0.77 -0.28 1.83 1.23 0.98 0.00 0.00 173.24 177.77 3n5m h GLY 113 N 2.07 1.11 0.99 7.32 0.00 -1.93 -1.57 103.07 111.07 3n5m h GLY 113 Ca -0.42 -0.58 -0.00 0.00 0.00 0.00 0.00 47.33 46.33 3n5m h GLY 113 CO 0.71 0.55 0.30 1.76 0.00 0.00 0.00 176.54 179.86 3n5m h SER 114 N 1.02 0.57 -0.44 0.19 0.02 -1.97 -1.54 113.55 111.39 3n5m h SER 114 Ca 0.24 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.09 3n5m h SER 114 Cb 0.19 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3n5m h SER 114 CO -0.02 0.44 0.08 -0.33 -1.14 0.00 0.00 176.83 175.87 3n5m h GLU 115 N 0.64 0.79 -0.71 3.45 5.08 -1.89 -1.64 114.58 120.31 3n5m h GLU 115 Ca 0.17 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3n5m h GLU 115 Cb -0.03 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 3n5m h GLU 115 CO -0.03 0.74 0.20 0.00 -1.00 0.00 0.00 179.01 178.92 3n5m h ALA 116 N 1.33 0.94 -0.36 3.43 0.00 -0.83 -0.69 119.26 123.08 3n5m h ALA 116 Ca 0.16 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 3n5m h ALA 116 Cb 0.34 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3n5m h ALA 116 CO 0.01 0.64 -0.38 -0.91 0.00 0.00 0.00 179.25 178.61 3n5m h ASN 117 N 1.07 0.96 -0.77 0.00 2.35 -1.11 -2.25 115.58 115.83 3n5m h ASN 117 Ca 0.23 -0.47 0.04 0.00 -0.55 0.00 0.00 56.30 55.54 3n5m h ASN 117 Cb 0.34 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.39 3n5m h ASN 117 CO -0.00 1.24 0.48 -0.33 -1.65 0.00 0.00 177.43 177.17 3n5m h GLU 118 N 0.71 0.90 -0.73 0.81 4.39 -1.05 -1.60 114.58 118.01 3n5m h GLU 118 Ca 0.06 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3n5m h GLU 118 Cb 0.97 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 29.39 3n5m h GLU 118 CO 0.09 0.60 0.34 1.15 -1.16 0.00 0.00 179.01 180.03 3n5m h THR 119 N 0.93 1.24 -0.75 1.13 2.02 -1.01 -2.43 112.91 114.04 3n5m h THR 119 Ca 0.32 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.82 3n5m h THR 119 Cb 0.06 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 66.78 3n5m h THR 119 CO -0.13 0.29 0.49 0.00 0.37 0.00 0.00 175.52 176.54 3n5m h ALA 120 N 1.16 0.97 -0.33 6.16 0.00 -0.79 -1.11 119.26 125.33 3n5m h ALA 120 Ca 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3n5m h ALA 120 Cb 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3n5m h ALA 120 CO -0.03 0.32 0.21 0.74 0.00 0.00 0.00 179.25 180.49 3n5m h PHE 121 N 0.97 0.42 -0.50 0.00 0.04 -0.96 -1.22 116.94 115.70 3n5m h PHE 121 Ca 0.29 0.01 -0.12 0.00 2.80 0.00 0.00 57.97 60.94 3n5m h PHE 121 Cb -0.05 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 3n5m h PHE 121 CO -0.03 0.29 -0.16 0.87 -0.60 0.00 0.00 178.31 178.68 3n5m h LYS 122 N 0.44 1.00 -0.58 1.51 1.57 -1.18 -1.62 116.57 117.71 3n5m h LYS 122 Ca 0.12 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.45 3n5m h LYS 122 Cb -0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 3n5m h LYS 122 CO -0.02 1.08 0.18 0.82 -0.57 0.00 0.00 179.45 180.93 3n5m h ILE 123 N 0.86 1.24 -0.23 1.86 2.04 -1.16 -1.11 117.51 121.01 3n5m h ILE 123 Ca 0.12 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 3n5m h ILE 123 Cb 0.73 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 3n5m h ILE 123 CO 0.06 0.31 0.13 0.00 0.00 0.00 0.00 178.15 178.64 3n5m h ALA 124 N 1.05 0.29 -0.40 1.87 0.00 -0.94 0.69 119.26 121.81 3n5m h ALA 124 Ca 0.19 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3n5m h ALA 124 Cb 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3n5m h ALA 124 CO -0.01 -0.18 0.19 0.00 0.00 0.00 0.00 179.25 179.25 3n5m h ARG 125 N 0.26 0.58 -0.17 0.00 3.08 -1.21 -2.67 114.38 114.25 3n5m h ARG 125 Ca 0.08 -0.09 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 3n5m h ARG 125 Cb 0.06 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3n5m h ARG 125 CO -0.01 0.51 -0.43 0.37 -1.07 0.00 0.00 179.97 179.33 3n5m h GLN 126 N 0.51 0.41 -0.36 0.04 4.15 -1.07 -2.01 115.11 116.78 3n5m h GLN 126 Ca 0.14 -0.21 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3n5m h GLN 126 Cb 0.12 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 3n5m h GLN 126 CO -0.02 0.77 0.23 -0.92 -1.93 0.00 0.00 178.83 176.96 3n5m h TYR 127 N 0.34 0.47 -0.51 3.99 3.20 -0.75 -1.42 116.97 122.29 3n5m h TYR 127 Ca 0.03 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 3n5m h TYR 127 Cb 0.90 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 3n5m h TYR 127 CO 0.03 0.32 0.03 1.88 -1.64 0.00 0.00 178.16 178.77 3n5m h TYR 128 N 0.48 0.88 -0.51 -3.82 0.05 -1.36 -1.77 116.97 110.92 3n5m h TYR 128 Ca 0.13 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 3n5m h TYR 128 Cb -0.02 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.45 3n5m h TYR 128 CO -0.04 0.79 0.26 0.00 -1.05 0.00 0.00 178.16 178.12 3n5m h ALA 129 N 1.25 1.49 -0.12 3.88 0.00 -0.79 0.10 119.26 125.08 3n5m h ALA 129 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3n5m h ALA 129 Cb 0.43 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3n5m h ALA 129 CO 0.02 0.41 0.00 1.04 0.00 0.00 0.00 179.25 180.72 3n5m n GLN 130 N -4.39 1.92 -0.22 0.00 6.02 -0.59 -3.51 117.38 116.61 3n5m n GLN 130 Ca 0.04 -1.36 0.10 0.00 -0.01 0.00 0.00 57.00 55.77 3n5m n GLN 130 Cb 0.12 -1.45 0.21 0.00 1.02 0.00 0.00 30.24 30.14 3n5m n GLN 130 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 3n5m n LYS 131 N 0.61 2.48 -0.57 -1.09 4.81 -0.70 -4.95 118.16 118.74 3n5m n LYS 131 Ca 0.17 -2.24 0.00 0.00 -0.87 0.00 0.00 58.31 55.38 3n5m n LYS 131 Cb 0.42 -1.44 0.00 0.00 0.02 0.00 0.00 35.03 34.03 3n5m n LYS 131 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3n5m n GLY 132 N 1.22 0.74 2.35 3.14 0.00 -1.14 -5.01 105.19 106.48 3n5m n GLY 132 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3n5m n GLY 132 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3n5m n GLU 133 N -2.35 1.26 0.25 1.61 1.02 0.29 -4.94 120.64 117.78 3n5m n GLU 133 Ca 0.00 -3.75 0.10 0.00 -0.02 0.00 0.00 57.16 53.49 3n5m n GLU 133 Cb 0.00 -1.67 0.65 0.00 -0.02 0.00 0.00 31.44 30.40 3n5m n GLU 133 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3n5m h PRO 134 N 4.41 0.00 0.00 3.49 0.13 -1.80 -2.85 132.00 135.38 3n5m h PRO 134 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3n5m h PRO 134 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3n5m h PRO 134 CO 0.58 0.13 0.00 1.12 -0.23 0.00 0.00 178.00 179.60 3n5m h HIS 135 N 0.00 0.00 -2.77 1.56 2.07 -1.91 -3.41 115.15 110.69 3n5m h HIS 135 Ca -0.00 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.95 3n5m h HIS 135 Cb 0.30 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 30.18 3n5m h HIS 135 CO 0.00 0.00 0.87 1.03 -3.07 0.00 0.00 177.93 176.76 3n5m s ARG 136 N -3.39 3.28 0.00 5.12 0.52 -1.07 -4.39 118.95 119.02 3n5m s ARG 136 Ca 0.03 -0.22 0.00 0.00 -0.52 0.00 0.00 55.73 55.02 3n5m s ARG 136 Cb 0.09 -4.12 0.00 0.00 0.52 0.00 0.00 34.95 31.43 3n5m s ARG 136 CO 0.37 -1.86 0.01 2.48 0.02 0.00 0.00 175.30 176.32 3n5m n TYR 137 N 8.53 0.00 -3.09 -0.53 0.18 -0.81 -4.57 117.16 116.87 3n5m n TYR 137 Ca 0.03 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.44 3n5m n TYR 137 Cb 0.48 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.38 3n5m n TYR 137 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 3n5m s LYS 138 N -0.64 4.33 0.41 -3.48 1.02 -0.16 -4.70 119.74 116.52 3n5m s LYS 138 Ca 0.00 0.93 0.01 0.00 0.02 0.00 0.00 55.97 56.93 3n5m s LYS 138 Cb 0.00 -3.01 0.01 0.00 -0.52 0.00 0.00 37.83 34.30 3n5m s LYS 138 CO 0.00 0.47 0.04 1.19 -0.92 0.00 0.00 175.35 176.13 3n5m n PHE 139 N 1.05 0.71 0.00 3.18 3.72 0.09 -0.06 117.46 126.15 3n5m n PHE 139 Ca -0.04 -1.98 0.00 0.00 -0.05 0.00 0.00 57.45 55.38 3n5m n PHE 139 Cb 0.50 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3n5m n PHE 139 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3n5m n SER 141 N -1.33 0.00 -4.87 4.37 3.41 -0.37 -0.88 113.62 113.95 3n5m n SER 141 Ca -0.15 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.13 3n5m n SER 141 Cb 0.51 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.41 3n5m n SER 141 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3n5m s ARG 142 N -1.89 3.33 0.49 4.33 3.00 -1.26 -1.06 118.95 125.89 3n5m s ARG 142 Ca 0.00 -0.36 -0.23 0.00 0.00 0.00 0.00 55.73 55.14 3n5m s ARG 142 Cb 0.00 -3.03 -0.07 0.00 0.00 0.00 0.00 34.95 31.85 3n5m s ARG 142 CO 0.00 0.67 1.30 0.71 0.00 0.00 0.00 175.30 177.99 3n5m s TYR 143 N -1.28 2.55 0.00 -0.53 2.02 -0.36 -2.43 117.35 117.33 3n5m s TYR 143 Ca 0.26 1.41 0.00 0.00 -0.37 0.00 0.00 57.07 58.37 3n5m s TYR 143 Cb -0.12 -3.68 0.00 0.00 -0.40 0.00 0.00 41.96 37.76 3n5m s TYR 143 CO 0.17 -2.39 0.00 0.54 -1.57 0.00 0.00 175.55 172.29 3n5m n ARG 144 N -0.60 -0.02 -3.50 -0.62 1.74 0.05 -4.24 116.66 109.46 3n5m n ARG 144 Ca 0.08 0.01 -0.22 0.00 -0.77 0.00 0.00 57.85 56.95 3n5m n ARG 144 Cb 0.45 -2.90 -0.01 0.00 -1.02 0.00 0.00 32.46 28.98 3n5m n ARG 144 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3n5m s GLY 145 N -2.00 1.39 -0.02 -0.13 0.00 -1.02 -4.29 107.32 101.26 3n5m s GLY 145 Ca 0.00 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 43.60 3n5m s GLY 145 CO 0.00 -1.08 -0.10 -0.47 0.00 0.00 0.00 173.10 171.45 3n5m s TYR 146 N -2.23 0.99 0.00 1.90 6.14 -1.26 0.19 117.35 123.08 3n5m s TYR 146 Ca 0.41 -0.24 0.00 0.00 0.64 0.00 0.00 57.07 57.88 3n5m s TYR 146 Cb -0.09 -0.69 0.00 0.00 0.42 0.00 0.00 41.96 41.60 3n5m s TYR 146 CO 0.33 -0.08 0.21 0.72 0.64 0.00 0.00 175.55 177.37 3n5m n HIS 147 N 3.17 0.00 0.00 4.97 8.25 -1.26 -4.94 115.22 125.41 3n5m n HIS 147 Ca -0.17 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 3n5m n HIS 147 Cb 0.55 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 3n5m n HIS 147 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n5m n GLY 148 N -0.01 0.02 0.48 -1.41 0.00 -1.25 -4.49 105.19 98.53 3n5m n GLY 148 Ca 0.00 -1.53 0.05 0.00 0.00 0.00 0.00 46.02 44.54 3n5m n GLY 148 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3n5m n ASN 149 N 0.00 2.44 0.00 1.61 0.23 -1.26 -4.78 115.26 113.50 3n5m n ASN 149 Ca 0.00 -1.79 0.00 0.00 -0.53 0.00 0.00 54.58 52.26 3n5m n ASN 149 Cb 0.00 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.57 3n5m n ASN 149 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3n5m n THR 150 N 0.41 0.00 0.00 5.53 -2.24 -1.26 -5.00 114.28 111.72 3n5m n THR 150 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3n5m n THR 150 Cb 0.34 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 3n5m n THR 150 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n5m n ALA 152 N -3.00 0.00 0.04 6.98 0.00 -1.26 -4.44 120.51 118.84 3n5m n ALA 152 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3n5m n ALA 152 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3n5m n ALA 152 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3n5m n THR 153 N 0.00 1.33 0.00 0.00 -2.24 -1.26 -1.94 114.28 110.17 3n5m n THR 153 Ca 0.00 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3n5m n THR 153 Cb 0.00 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.01 3n5m n THR 153 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n5m n ALA 155 N 1.22 0.00 0.64 6.98 0.00 -1.26 -1.54 120.51 126.56 3n5m n ALA 155 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3n5m n ALA 155 Cb 0.41 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.32 3n5m n ALA 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n5m n ALA 156 N 0.00 2.09 -1.91 0.00 0.00 -0.82 -4.85 120.51 115.03 3n5m n ALA 156 Ca 0.00 -0.02 -0.37 0.00 0.00 0.00 0.00 53.44 53.06 3n5m n ALA 156 Cb 0.00 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 17.96 3n5m n ALA 156 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3n5m s THR 157 N -3.12 4.35 -0.49 0.00 2.01 -0.59 -4.69 115.64 113.12 3n5m s THR 157 Ca 0.10 1.61 0.13 0.00 0.31 0.00 0.00 61.69 63.84 3n5m s THR 157 Cb 0.13 -3.95 0.38 0.00 0.01 0.00 0.00 72.50 69.07 3n5m s THR 157 CO 0.50 0.17 1.30 0.61 -0.69 0.00 0.00 174.62 176.51 3n5m n GLY 158 N 0.63 3.46 3.27 4.40 0.00 0.13 -4.85 105.19 112.22 3n5m n GLY 158 Ca 0.00 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 3n5m n GLY 158 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n5m s GLN 159 N -1.90 2.72 0.56 1.61 -0.21 -1.11 -0.77 119.66 120.56 3n5m s GLN 159 Ca 0.30 -1.68 0.32 0.00 0.02 0.00 0.00 55.36 54.31 3n5m s GLN 159 Cb 0.22 -4.07 1.66 0.00 1.00 0.00 0.00 33.01 31.81 3n5m s GLN 159 CO 0.11 -1.21 2.13 0.00 -2.12 0.00 0.00 175.29 174.20 3n5m h ALA 160 N 8.64 1.22 0.00 6.09 0.00 -1.83 -1.87 119.26 131.51 3n5m h ALA 160 Ca -0.25 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3n5m h ALA 160 Cb 1.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3n5m h ALA 160 CO 0.92 0.09 0.00 1.04 0.00 0.00 0.00 179.25 181.30 3n5m n GLN 161 N -3.48 0.11 0.00 0.00 6.02 -1.04 -1.34 117.38 117.65 3n5m n GLN 161 Ca -0.02 0.21 0.12 0.00 -0.01 0.00 0.00 57.00 57.30 3n5m n GLN 161 Cb 0.20 -1.66 0.23 0.00 1.02 0.00 0.00 30.24 30.03 3n5m n GLN 161 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3n5m n ARG 162 N -1.87 0.84 -0.02 -1.09 5.12 -0.70 -4.41 116.66 114.52 3n5m n ARG 162 Ca 0.05 -0.58 -0.01 0.00 -1.93 0.00 0.00 57.85 55.38 3n5m n ARG 162 Cb 0.30 -1.49 -0.05 0.00 -1.16 0.00 0.00 32.46 30.06 3n5m n ARG 162 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3n5m n ARG 163 N -0.58 2.28 -1.84 5.56 1.74 -0.72 -4.97 116.66 118.12 3n5m n ARG 163 Ca 0.10 -0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.75 3n5m n ARG 163 Cb 0.38 -1.16 -0.03 0.00 -1.02 0.00 0.00 32.46 30.63 3n5m n ARG 163 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3n5m s TYR 164 N -2.23 2.94 0.00 -1.55 5.04 -0.45 -1.48 117.35 119.61 3n5m s TYR 164 Ca -0.03 0.63 0.00 0.00 -2.44 0.00 0.00 57.07 55.23 3n5m s TYR 164 Cb 0.02 -4.01 0.00 0.00 0.35 0.00 0.00 41.96 38.32 3n5m s TYR 164 CO 0.26 -3.63 0.00 1.04 -1.34 0.00 0.00 175.55 171.88 3n5m n GLN 165 N 3.33 -0.01 0.00 4.97 6.02 -1.26 -4.81 117.38 125.62 3n5m n GLN 165 Ca 0.12 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.17 3n5m n GLN 165 Cb 0.37 -2.77 -0.01 0.00 1.02 0.00 0.00 30.24 28.86 3n5m n GLN 165 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3n5m n TYR 166 N -2.47 0.00 -1.45 1.08 4.01 -0.55 -5.00 117.16 112.78 3n5m n TYR 166 Ca 0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.44 3n5m n TYR 166 Cb 0.00 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.13 3n5m n TYR 166 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3n5m s GLU 167 N -1.63 1.94 0.51 -0.72 2.02 -1.23 -4.75 118.70 114.84 3n5m s GLU 167 Ca 0.09 0.73 -0.15 0.00 0.02 0.00 0.00 54.97 55.66 3n5m s GLU 167 Cb 0.10 -1.89 -0.07 0.00 0.10 0.00 0.00 34.13 32.36 3n5m s GLU 167 CO 0.33 -1.74 0.95 -1.25 0.02 0.00 0.00 175.26 173.57 3n5m s PRO 168 N -5.08 3.88 0.50 0.39 0.04 -1.26 -5.14 135.00 128.33 3n5m s PRO 168 Ca 0.61 0.84 0.07 0.00 0.04 0.00 0.00 61.00 62.57 3n5m s PRO 168 Cb -0.15 -2.18 0.02 0.00 0.04 0.00 0.00 34.50 32.23 3n5m s PRO 168 CO 0.55 -0.26 0.44 -0.06 0.04 0.00 0.00 177.00 177.71 3n5m s PHE 169 N -2.64 2.03 0.66 0.56 2.99 -1.26 -5.12 117.98 115.20 3n5m s PHE 169 Ca 0.57 -0.69 -0.13 0.00 0.00 0.00 0.00 56.93 56.68 3n5m s PHE 169 Cb -0.10 -2.05 -0.01 0.00 0.00 0.00 0.00 43.02 40.86 3n5m s PHE 169 CO 0.34 -0.41 1.07 0.00 -0.00 0.00 0.00 175.22 176.21 3n5m s ALA 170 N -2.64 2.62 0.84 5.36 0.00 -1.26 -5.05 121.76 121.62 3n5m s ALA 170 Ca 0.43 0.31 -0.13 0.00 0.00 0.00 0.00 51.96 52.57 3n5m s ALA 170 Cb -0.03 -3.23 0.10 0.00 0.00 0.00 0.00 23.12 19.96 3n5m s ALA 170 CO 0.26 -1.12 1.20 -1.54 0.00 0.00 0.00 175.76 174.56 3n5m s SER 171 N -3.13 4.23 0.00 0.00 1.04 -1.26 -4.48 113.70 110.10 3n5m s SER 171 Ca 0.62 0.71 0.00 0.00 0.48 0.00 0.00 55.95 57.76 3n5m s SER 171 Cb -0.16 -1.13 0.00 0.00 0.10 0.00 0.00 66.02 64.83 3n5m s SER 171 CO 0.45 -2.07 0.00 0.61 0.98 0.00 0.00 173.24 173.21 3n5m n GLY 172 N -3.34 0.87 3.30 7.32 0.00 -1.26 -5.01 105.19 107.07 3n5m n GLY 172 Ca 0.09 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 3n5m n GLY 172 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n5m s PHE 173 N -2.00 2.92 0.17 1.61 0.40 -1.26 -0.73 117.98 119.09 3n5m s PHE 173 Ca 0.00 -0.97 0.11 0.00 -0.60 0.00 0.00 56.93 55.47 3n5m s PHE 173 Cb 0.00 -2.04 -0.04 0.00 0.51 0.00 0.00 43.02 41.45 3n5m s PHE 173 CO 0.00 -0.52 -0.25 -0.51 0.70 0.00 0.00 175.22 174.64 3n5m s LEU 174 N 1.27 2.41 0.05 -0.37 1.43 -0.06 -4.99 118.68 118.42 3n5m s LEU 174 Ca 0.03 -0.82 0.03 0.00 -1.03 0.00 0.00 54.13 52.34 3n5m s LEU 174 Cb -0.14 -1.20 -0.03 0.00 0.03 0.00 0.00 46.19 44.85 3n5m s LEU 174 CO -0.03 0.14 -0.09 -1.00 0.23 0.00 0.00 176.35 175.59 3n5m s HIS 175 N -1.48 0.84 0.27 0.29 3.76 -1.26 -1.24 115.29 116.48 3n5m s HIS 175 Ca 0.19 -0.51 0.04 0.00 -0.15 0.00 0.00 55.06 54.63 3n5m s HIS 175 Cb -0.09 -0.49 -0.06 0.00 1.11 0.00 0.00 32.58 33.06 3n5m s HIS 175 CO 0.09 -0.05 0.00 0.14 -0.85 0.00 0.00 174.74 174.07 3n5m s VAL 176 N -1.50 1.25 0.30 -0.90 -7.23 -0.23 -4.89 120.40 107.21 3n5m s VAL 176 Ca -0.06 -2.05 -0.30 0.00 -1.81 0.00 0.00 61.98 57.76 3n5m s VAL 176 Cb -0.09 -2.52 -0.11 0.00 0.56 0.00 0.00 36.38 34.22 3n5m s VAL 176 CO 0.01 -0.21 1.56 -0.89 -0.31 0.00 0.00 175.10 175.25 3n5m s THR 177 N -3.27 2.15 0.23 5.32 2.01 -1.26 -1.22 115.64 119.60 3n5m s THR 177 Ca 0.31 0.13 -0.25 0.00 0.31 0.00 0.00 61.69 62.19 3n5m s THR 177 Cb 0.06 -3.08 -0.09 0.00 0.01 0.00 0.00 72.50 69.40 3n5m s THR 177 CO 0.12 0.02 0.84 -2.16 -0.69 0.00 0.00 174.62 172.75 3n5m s PRO 178 N -0.65 4.56 0.07 4.92 0.04 -1.26 -4.82 135.00 137.86 3n5m s PRO 178 Ca 0.62 1.21 -0.31 0.00 0.04 0.00 0.00 61.00 62.56 3n5m s PRO 178 Cb -0.47 -3.07 -0.07 0.00 0.04 0.00 0.00 34.50 30.94 3n5m s PRO 178 CO 0.49 0.45 1.37 -1.25 0.04 0.00 0.00 177.00 178.10 3n5m s PRO 179 N -1.56 4.32 -0.29 0.56 0.04 -1.26 -5.00 135.00 131.80 3n5m s PRO 179 Ca 0.42 2.00 -0.01 0.00 0.04 0.00 0.00 61.00 63.46 3n5m s PRO 179 Cb -0.21 -3.38 0.13 0.00 0.04 0.00 0.00 34.50 31.08 3n5m s PRO 179 CO 0.26 -0.47 0.28 0.34 0.04 0.00 0.00 177.00 177.45 3n5m s ASP 180 N 1.39 1.88 0.10 6.66 -1.08 -1.26 -4.21 116.67 120.16 3n5m s ASP 180 Ca 0.64 -0.87 0.16 0.00 -0.52 0.00 0.00 52.55 51.95 3n5m s ASP 180 Cb -0.34 0.40 0.68 0.00 -1.46 0.00 0.00 42.92 42.20 3n5m s ASP 180 CO 0.29 -0.39 1.48 0.00 0.52 0.00 0.00 175.17 177.07 3n5m h TYR 182 N 0.00 0.00 -0.16 0.00 3.20 -2.00 -3.34 116.97 114.67 3n5m h TYR 182 Ca 0.00 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.71 3n5m h TYR 182 Cb 0.22 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.43 3n5m h TYR 182 CO 0.00 0.92 -0.07 0.54 -1.64 0.00 0.00 178.16 177.91 3n5m n ARG 183 N -4.60 1.63 -3.61 1.82 1.74 -1.08 -5.01 116.66 107.54 3n5m n ARG 183 Ca -0.12 -0.81 -0.12 0.00 -0.77 0.00 0.00 57.85 56.03 3n5m n ARG 183 Cb 0.44 -1.58 -0.07 0.00 -1.02 0.00 0.00 32.46 30.24 3n5m n ARG 183 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3n5m s PRO 185 N 0.01 0.71 0.00 5.56 0.04 -1.25 -5.07 135.00 135.00 3n5m s PRO 185 Ca 0.36 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.01 3n5m s PRO 185 Cb 0.19 0.34 0.00 0.00 0.04 0.00 0.00 34.50 35.07 3n5m s PRO 185 CO -0.02 -0.13 0.00 0.41 0.04 0.00 0.00 177.00 177.30 3n5m n GLY 186 N 1.96 1.17 0.22 0.56 0.00 -1.26 -4.91 105.19 102.92 3n5m n GLY 186 Ca -0.14 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.90 3n5m n GLY 186 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3n5m h ILE 187 N 0.00 1.23 -0.73 -0.61 3.07 -1.96 -2.93 117.51 115.58 3n5m h ILE 187 Ca 0.00 -1.07 -0.04 0.00 1.55 0.00 0.00 64.86 65.31 3n5m h ILE 187 Cb 0.00 1.43 -0.03 0.00 -0.27 0.00 0.00 36.82 37.95 3n5m h ILE 187 CO 0.00 0.32 0.32 -0.08 -1.05 0.00 0.00 178.15 177.66 3n5m h GLU 188 N 0.17 1.07 -0.48 0.16 4.81 -1.93 -3.07 114.58 115.31 3n5m h GLU 188 Ca 0.03 -0.17 -0.11 0.00 -0.13 0.00 0.00 59.36 58.98 3n5m h GLU 188 Cb 0.54 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 3n5m h GLU 188 CO 0.04 0.85 -0.13 0.00 -0.73 0.00 0.00 179.01 179.04 3n5m h ARG 189 N 1.05 0.90 -7.29 1.92 2.47 -1.94 -3.45 114.38 108.04 3n5m h ARG 189 Ca 0.25 -0.33 -0.52 0.00 -1.26 0.00 0.00 59.98 58.13 3n5m h ARG 189 Cb 0.16 -0.06 0.17 0.00 -1.65 0.00 0.00 29.97 28.59 3n5m h ARG 189 CO -0.03 0.97 0.27 -1.21 0.56 0.00 0.00 179.97 180.53 3n5m s GLU 190 N -4.79 1.57 0.23 0.04 2.02 -1.14 -4.94 118.70 111.69 3n5m s GLU 190 Ca -0.10 1.38 -0.30 0.00 0.02 0.00 0.00 54.97 55.96 3n5m s GLU 190 Cb 0.13 -1.80 -0.10 0.00 0.10 0.00 0.00 34.13 32.46 3n5m s GLU 190 CO 0.84 -2.19 1.50 1.21 0.02 0.00 0.00 175.26 176.64 3n5m s ASN 191 N -3.00 6.59 0.32 -0.19 3.84 -1.26 -4.88 114.94 116.36 3n5m s ASN 191 Ca 0.64 2.70 0.02 0.00 0.21 0.00 0.00 52.86 56.43 3n5m s ASN 191 Cb -0.20 -2.62 0.58 0.00 -0.55 0.00 0.00 41.25 38.46 3n5m s ASN 191 CO 0.57 -0.77 1.94 -0.29 -2.79 0.00 0.00 177.10 175.76 3n5m h ILE 192 N 3.64 1.08 0.00 -5.21 6.09 -1.92 -1.47 117.51 119.71 3n5m h ILE 192 Ca -0.45 -0.33 0.00 0.00 -1.37 0.00 0.00 64.86 62.71 3n5m h ILE 192 Cb 1.21 0.04 0.00 0.00 0.47 0.00 0.00 36.82 38.55 3n5m h ILE 192 CO 0.81 0.17 0.00 -1.22 -3.07 0.00 0.00 178.15 174.85 3n5m n TYR 193 N -4.47 0.00 1.06 2.19 4.01 -1.26 -1.66 117.16 117.03 3n5m n TYR 193 Ca 0.12 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.97 3n5m n TYR 193 Cb 0.17 -0.09 0.09 0.00 -0.31 0.00 0.00 39.34 39.21 3n5m n TYR 193 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3n5m n ASP 194 N -1.09 2.09 -4.70 7.72 8.00 -0.56 -4.70 116.55 123.31 3n5m n ASP 194 Ca 0.19 -1.54 -0.42 0.00 0.71 0.00 0.00 54.79 53.72 3n5m n ASP 194 Cb 0.13 0.31 -0.03 0.00 -0.02 0.00 0.00 41.12 41.52 3n5m n ASP 194 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3n5m s VAL 195 N -2.36 4.06 0.20 2.53 1.01 -0.66 -4.94 120.40 120.23 3n5m s VAL 195 Ca 0.22 1.44 -0.11 0.00 0.00 0.00 0.00 61.98 63.54 3n5m s VAL 195 Cb 0.19 -3.93 0.13 0.00 0.00 0.00 0.00 36.38 32.77 3n5m s VAL 195 CO 0.50 0.06 1.82 -0.08 0.00 0.00 0.00 175.10 177.39 3n5m h GLU 196 N 7.16 0.98 0.00 2.72 4.57 -1.92 -0.66 114.58 127.43 3n5m h GLU 196 Ca -0.39 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3n5m h GLU 196 Cb 1.19 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.59 3n5m h GLU 196 CO 0.85 0.72 0.00 0.00 -1.18 0.00 0.00 179.01 179.40 3n5m h VAL 198 N 0.00 1.15 -0.78 0.00 2.07 -1.59 -3.31 116.25 113.79 3n5m h VAL 198 Ca 0.00 -2.44 0.02 0.00 0.82 0.00 0.00 66.70 65.09 3n5m h VAL 198 Cb 0.41 2.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.98 3n5m h VAL 198 CO 0.00 0.71 0.52 0.11 0.02 0.00 0.00 177.57 178.93 3n5m h LYS 199 N -0.31 1.00 -0.88 1.57 1.57 -0.93 -2.75 116.57 115.84 3n5m h LYS 199 Ca -0.26 -0.06 0.13 0.00 -1.87 0.00 0.00 60.65 58.59 3n5m h LYS 199 Cb 1.75 -0.23 -0.09 0.00 0.08 0.00 0.00 32.23 33.74 3n5m h LYS 199 CO 0.09 0.66 0.49 1.49 -0.57 0.00 0.00 179.45 181.61 3n5m h GLU 200 N 1.03 0.71 -0.16 3.15 4.81 -1.12 -0.12 114.58 122.88 3n5m h GLU 200 Ca 0.30 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.49 3n5m h GLU 200 Cb -0.06 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 3n5m h GLU 200 CO -0.07 0.47 0.09 0.28 -0.73 0.00 0.00 179.01 179.04 3n5m h VAL 201 N 0.73 1.01 -0.28 0.32 2.07 -1.57 -0.64 116.25 117.90 3n5m h VAL 201 Ca 0.46 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.87 3n5m h VAL 201 Cb 0.58 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3n5m h VAL 201 CO -0.32 0.03 0.00 -0.78 0.02 0.00 0.00 177.57 176.53 3n5m h ASP 202 N 0.19 0.48 -0.05 0.57 3.58 -1.47 -3.19 116.42 116.52 3n5m h ASP 202 Ca 0.06 -0.30 0.01 0.00 0.42 0.00 0.00 57.03 57.22 3n5m h ASP 202 Cb -0.00 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 3n5m h ASP 202 CO -0.03 0.67 -0.02 0.03 -2.88 0.00 0.00 179.24 177.01 3n5m h ARG 203 N 0.28 -0.01 -1.87 0.28 3.08 -0.91 -1.74 114.38 113.49 3n5m h ARG 203 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3n5m h ARG 203 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3n5m h ARG 203 CO 0.01 -0.01 0.00 0.28 -1.07 0.00 0.00 179.97 179.19 3n5m n VAL 204 N -5.13 0.17 0.00 2.04 0.31 -0.26 -0.42 118.33 115.04 3n5m n VAL 204 Ca -0.06 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 3n5m n VAL 204 Cb 0.06 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 3n5m n VAL 204 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3n5m n THR 206 N 1.04 0.00 0.19 2.52 -1.04 -0.66 -1.06 114.28 115.27 3n5m n THR 206 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.08 3n5m n THR 206 Cb 0.07 0.00 0.26 0.00 -1.82 0.00 0.00 70.33 68.85 3n5m n THR 206 CO 0.00 0.00 0.00 -0.50 -0.64 0.00 0.00 175.07 173.93 3n5m h TRP 207 N 0.00 0.00 0.00 -1.42 6.55 -1.01 -2.66 115.95 117.42 3n5m h TRP 207 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3n5m h TRP 207 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.30 3n5m h TRP 207 CO 0.00 0.31 -0.49 0.39 -1.05 0.00 0.00 178.44 177.60 3n5m n GLU 208 N -3.29 0.07 -0.68 0.49 -0.58 -0.22 -5.04 120.64 111.38 3n5m n GLU 208 Ca 0.01 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 3n5m n GLU 208 Cb 0.56 -1.54 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 3n5m n GLU 208 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3n5m n LEU 209 N -1.64 -1.72 -0.33 -4.62 7.94 -1.00 -4.65 117.00 110.98 3n5m n LEU 209 Ca 0.05 0.00 0.19 0.00 -1.11 0.00 0.00 56.01 55.14 3n5m n LEU 209 Cb 0.36 -0.86 0.40 0.00 0.53 0.00 0.00 43.42 43.85 3n5m n LEU 209 CO 0.35 0.00 1.08 0.28 -1.11 0.00 0.00 177.39 177.99 3n5m h SER 210 N 0.00 0.43 0.20 1.96 0.02 -1.88 0.20 113.55 114.48 3n5m h SER 210 Ca 0.00 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3n5m h SER 210 Cb 0.00 0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.68 3n5m h SER 210 CO 0.00 -0.07 0.00 -0.62 -1.14 0.00 0.00 176.83 175.00 3n5m n GLU 211 N -5.05 0.01 0.00 3.45 4.71 -1.26 -1.72 120.64 120.78 3n5m n GLU 211 Ca 0.27 0.41 0.09 0.00 -0.01 0.00 0.00 57.16 57.92 3n5m n GLU 211 Cb 0.83 -1.53 0.04 0.00 -1.01 0.00 0.00 31.44 29.77 3n5m n GLU 211 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3n5m n THR 212 N -1.55 0.00 -3.36 2.62 -2.24 0.06 -3.21 114.28 106.59 3n5m n THR 212 Ca 0.01 -0.43 -0.39 0.00 -2.27 0.00 0.00 64.05 60.98 3n5m n THR 212 Cb 0.07 1.30 -0.08 0.00 -2.10 0.00 0.00 70.33 69.51 3n5m n THR 212 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3n5m s ILE 213 N -1.67 5.16 -0.20 2.28 -1.09 -0.70 -0.99 121.20 124.00 3n5m s ILE 213 Ca 0.18 0.66 -0.20 0.00 -2.23 0.00 0.00 60.65 59.05 3n5m s ILE 213 Cb 0.14 -3.73 -0.20 0.00 -1.58 0.00 0.00 42.46 37.09 3n5m s ILE 213 CO 0.30 0.17 0.24 0.00 -1.23 0.00 0.00 174.94 174.42 3n5m h ALA 214 N 7.94 0.27 -2.51 9.38 0.00 -0.72 -3.41 119.26 130.21 3n5m h ALA 214 Ca -0.32 -1.22 -0.05 0.00 0.00 0.00 0.00 54.91 53.32 3n5m h ALA 214 Cb 1.16 0.73 -0.16 0.00 0.00 0.00 0.00 17.79 19.52 3n5m h ALA 214 CO 0.68 0.75 0.15 0.00 0.00 0.00 0.00 179.25 180.82 3n5m s ALA 215 N -2.38 -1.57 -0.17 0.00 0.00 -1.05 -1.54 121.76 115.06 3n5m s ALA 215 Ca -0.28 0.80 -0.04 0.00 0.00 0.00 0.00 51.96 52.44 3n5m s ALA 215 Cb 0.06 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 3n5m s ALA 215 CO 0.61 -0.56 -0.03 0.12 0.00 0.00 0.00 175.76 175.91 3n5m s PHE 216 N -2.50 3.03 0.30 0.00 5.36 0.22 -4.28 117.98 120.11 3n5m s PHE 216 Ca -0.05 -0.33 0.09 0.00 -0.96 0.00 0.00 56.93 55.68 3n5m s PHE 216 Cb -0.01 -1.99 -0.05 0.00 -0.34 0.00 0.00 43.02 40.64 3n5m s PHE 216 CO -0.02 -0.08 0.00 -1.50 -1.46 0.00 0.00 175.22 172.16 3n5m s ILE 217 N 0.51 3.04 0.15 3.12 2.07 -1.26 -0.86 121.20 127.97 3n5m s ILE 217 Ca -0.03 -1.95 -0.18 0.00 -1.41 0.00 0.00 60.65 57.09 3n5m s ILE 217 Cb -0.14 -2.80 -0.07 0.00 0.13 0.00 0.00 42.46 39.58 3n5m s ILE 217 CO 0.03 -0.29 0.62 -1.61 -1.91 0.00 0.00 174.94 171.77 3n5m s GLU 219 N -3.70 4.15 0.35 3.50 2.02 -1.26 -4.38 118.70 119.39 3n5m s GLU 219 Ca 0.33 0.70 0.03 0.00 0.02 0.00 0.00 54.97 56.05 3n5m s GLU 219 Cb -0.04 -3.02 0.65 0.00 0.10 0.00 0.00 34.13 31.83 3n5m s GLU 219 CO 0.20 0.50 2.00 -1.35 0.02 0.00 0.00 175.26 176.63 3n5m h PRO 220 N 3.82 0.78 -5.39 0.39 0.11 -1.92 -3.40 132.00 126.40 3n5m h PRO 220 Ca -0.49 -0.06 -0.56 0.00 0.11 0.00 0.00 66.00 65.01 3n5m h PRO 220 Cb 1.20 -0.17 -0.31 0.00 0.11 0.00 0.00 31.00 31.83 3n5m h PRO 220 CO 0.65 0.54 -0.84 0.42 -0.21 0.00 0.00 178.00 178.56 3n5m s ILE 221 N -5.63 1.40 -0.60 4.15 1.01 -1.26 -4.72 121.20 115.55 3n5m s ILE 221 Ca -0.10 -0.72 -0.26 0.00 0.00 0.00 0.00 60.65 59.58 3n5m s ILE 221 Cb 0.17 -1.20 0.04 0.00 0.01 0.00 0.00 42.46 41.48 3n5m s ILE 221 CO 0.76 0.40 1.10 -0.63 0.00 0.00 0.00 174.94 176.58 3n5m s ILE 222 N -0.08 4.12 -0.15 2.92 1.01 -0.77 -4.87 121.20 123.40 3n5m s ILE 222 Ca -0.01 0.51 -0.11 0.00 0.00 0.00 0.00 60.65 61.04 3n5m s ILE 222 Cb -0.10 -4.69 -0.07 0.00 0.01 0.00 0.00 42.46 37.61 3n5m s ILE 222 CO 0.01 -1.36 -0.01 0.71 0.00 0.00 0.00 174.94 174.30 3n5m h THR 223 N 6.07 0.29 -0.46 2.92 1.35 -1.93 0.18 112.91 121.33 3n5m h THR 223 Ca -0.26 -1.31 -0.04 0.00 -0.55 0.00 0.00 66.41 64.25 3n5m h THR 223 Cb 1.06 0.64 -0.02 0.00 -1.73 0.00 0.00 68.15 68.10 3n5m h THR 223 CO 1.17 0.10 0.12 1.23 -0.25 0.00 0.00 175.52 177.89 3n5m h GLY 224 N -1.00 0.74 2.00 5.82 0.00 -1.93 -2.16 103.07 106.54 3n5m h GLY 224 Ca -0.07 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 3n5m h GLY 224 CO -0.04 0.38 -0.05 -1.33 0.00 0.00 0.00 176.54 175.50 3n5m h GLY 225 N 0.88 0.00 0.00 4.60 0.00 -1.75 -3.42 103.07 103.37 3n5m h GLY 225 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3n5m h GLY 225 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3n5m n GLY 226 N -0.65 -0.25 3.67 4.60 0.00 -0.86 -4.86 105.19 106.83 3n5m n GLY 226 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 3n5m n GLY 226 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3n5m n ILE 227 N 0.00 -3.52 -1.38 -0.61 2.08 0.29 -4.84 119.36 111.38 3n5m n ILE 227 Ca 0.00 -0.17 -0.30 0.00 0.56 0.00 0.00 62.75 62.84 3n5m n ILE 227 Cb 0.00 -3.82 0.21 0.00 -0.75 0.00 0.00 39.64 35.28 3n5m n ILE 227 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 3n5m s LEU 228 N -7.03 1.46 0.15 1.39 1.43 0.37 -4.86 118.68 111.60 3n5m s LEU 228 Ca 0.41 0.60 -0.13 0.00 -1.03 0.00 0.00 54.13 53.97 3n5m s LEU 228 Cb -0.19 -2.51 0.01 0.00 0.03 0.00 0.00 46.19 43.54 3n5m s LEU 228 CO 0.77 -3.50 0.37 0.00 0.23 0.00 0.00 176.35 174.23 3n5m s ALA 230 N -3.28 -0.55 0.71 4.21 0.00 -1.26 -1.84 121.76 119.74 3n5m s ALA 230 Ca 0.71 -0.43 -0.16 0.00 0.00 0.00 0.00 51.96 52.07 3n5m s ALA 230 Cb -0.09 0.76 0.00 0.00 0.00 0.00 0.00 23.12 23.80 3n5m s ALA 230 CO 0.55 -0.68 1.03 -2.30 0.00 0.00 0.00 175.76 174.36 3n5m n PRO 231 N -0.23 0.60 -0.32 0.00 -0.02 -1.26 -4.89 135.00 128.87 3n5m n PRO 231 Ca -0.11 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.75 3n5m n PRO 231 Cb 0.63 -2.27 0.30 0.00 -0.02 0.00 0.00 33.50 32.14 3n5m n PRO 231 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3n5m h GLN 232 N -0.13 0.52 -0.28 -0.52 5.75 -1.94 -1.98 115.11 116.53 3n5m h GLN 232 Ca -0.48 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 57.99 3n5m h GLN 232 Cb 1.34 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.77 3n5m h GLN 232 CO 0.48 0.35 0.00 -0.25 -2.65 0.00 0.00 178.83 176.76 3n5m n ASP 233 N -4.93 2.16 -0.50 -0.69 8.00 -1.26 -4.73 116.55 114.60 3n5m n ASP 233 Ca 0.22 -1.85 0.00 0.00 0.71 0.00 0.00 54.79 53.87 3n5m n ASP 233 Cb 0.60 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 3n5m n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n5m n TYR 234 N 0.65 0.00 0.00 1.24 9.36 -0.75 -1.52 117.16 126.15 3n5m n TYR 234 Ca 0.16 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.38 3n5m n TYR 234 Cb 0.39 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 39.08 3n5m n TYR 234 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 3n5m n LYS 236 N 0.44 0.00 -0.17 2.98 4.81 -1.26 -1.26 118.16 123.70 3n5m n LYS 236 Ca 0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.34 3n5m n LYS 236 Cb 0.03 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.10 3n5m n LYS 236 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3n5m h ALA 237 N 0.00 0.77 -0.50 3.14 0.00 -1.67 -1.27 119.26 119.73 3n5m h ALA 237 Ca 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 3n5m h ALA 237 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3n5m h ALA 237 CO 0.00 0.67 0.21 0.28 0.00 0.00 0.00 179.25 180.41 3n5m h VAL 238 N 0.89 1.21 -0.23 0.00 2.07 -1.44 -0.75 116.25 118.00 3n5m h VAL 238 Ca 0.13 -0.62 0.02 0.00 0.82 0.00 0.00 66.70 67.05 3n5m h VAL 238 Cb 0.70 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 3n5m h VAL 238 CO 0.05 0.24 0.10 -0.74 0.02 0.00 0.00 177.57 177.24 3n5m h HIS 239 N 0.66 0.18 -0.59 1.57 6.17 -1.78 0.11 115.15 121.46 3n5m h HIS 239 Ca 0.17 0.01 0.04 0.00 0.71 0.00 0.00 60.37 61.30 3n5m h HIS 239 Cb 0.17 -0.05 -0.03 0.00 2.52 0.00 0.00 27.41 30.02 3n5m h HIS 239 CO 0.00 0.09 0.39 0.93 0.71 0.00 0.00 177.93 180.06 3n5m h GLU 240 N 0.21 0.63 -0.31 5.26 5.08 -1.10 -0.75 114.58 123.61 3n5m h GLU 240 Ca 0.10 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 3n5m h GLU 240 Cb 0.04 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 3n5m h GLU 240 CO -0.08 0.42 -0.39 1.15 -1.00 0.00 0.00 179.01 179.10 3n5m h THR 241 N 0.65 1.29 -0.31 1.13 2.02 -0.55 -1.06 112.91 116.08 3n5m h THR 241 Ca 0.25 -1.58 0.04 0.00 0.77 0.00 0.00 66.41 65.89 3n5m h THR 241 Cb 0.16 1.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.11 3n5m h THR 241 CO -0.07 0.51 0.09 0.00 0.37 0.00 0.00 175.52 176.42 3n5m h GLN 243 N 0.21 0.83 -0.81 0.00 4.20 -1.09 0.12 115.11 118.58 3n5m h GLN 243 Ca 0.14 -0.11 0.13 0.00 0.06 0.00 0.00 58.65 58.86 3n5m h GLN 243 Cb 0.13 -0.15 -0.09 0.00 0.30 0.00 0.00 27.48 27.67 3n5m h GLN 243 CO -0.16 0.66 0.42 -0.22 -0.67 0.00 0.00 178.83 178.85 3n5m h LYS 244 N 0.79 0.62 -0.07 1.46 3.64 -1.02 -2.31 116.57 119.67 3n5m h LYS 244 Ca 0.20 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3n5m h LYS 244 Cb 0.09 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3n5m h LYS 244 CO -0.03 0.41 0.00 0.72 -2.27 0.00 0.00 179.45 178.28 3n5m n HIS 245 N -4.85 0.08 -1.00 1.91 8.25 -0.83 -4.94 115.22 113.84 3n5m n HIS 245 Ca 0.15 -0.04 -0.00 0.00 -0.26 0.00 0.00 57.72 57.57 3n5m n HIS 245 Cb 0.37 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.48 3n5m n HIS 245 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n5m n GLY 246 N 1.17 0.44 3.95 -1.41 0.00 -0.22 -4.65 105.19 104.47 3n5m n GLY 246 Ca 0.18 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 3n5m n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5m s ALA 247 N -2.00 3.89 0.31 4.61 0.00 0.27 -4.98 121.76 123.86 3n5m s ALA 247 Ca 0.00 -1.25 -0.07 0.00 0.00 0.00 0.00 51.96 50.64 3n5m s ALA 247 Cb 0.00 -1.68 -0.06 0.00 0.00 0.00 0.00 23.12 21.38 3n5m s ALA 247 CO 0.00 0.25 0.61 -0.51 0.00 0.00 0.00 175.76 176.10 3n5m s LEU 248 N -3.96 4.01 -0.21 0.00 1.43 -0.59 -3.97 118.68 115.39 3n5m s LEU 248 Ca 0.34 0.83 -0.04 0.00 -1.03 0.00 0.00 54.13 54.23 3n5m s LEU 248 Cb -0.09 -3.66 -0.02 0.00 0.03 0.00 0.00 46.19 42.45 3n5m s LEU 248 CO 0.29 -0.24 -0.02 -0.22 0.23 0.00 0.00 176.35 176.39 3n5m s LEU 249 N -3.58 3.06 -0.24 1.79 2.96 -1.26 -0.61 118.68 120.80 3n5m s LEU 249 Ca 0.46 -0.31 -0.07 0.00 -0.22 0.00 0.00 54.13 53.99 3n5m s LEU 249 Cb -0.11 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 3n5m s LEU 249 CO 0.30 0.01 0.07 -0.63 -1.32 0.00 0.00 176.35 174.78 3n5m s ILE 250 N 1.28 4.38 -0.36 6.68 1.01 -0.04 -2.14 121.20 132.02 3n5m s ILE 250 Ca 0.04 -0.15 -0.18 0.00 0.00 0.00 0.00 60.65 60.36 3n5m s ILE 250 Cb -0.14 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.28 3n5m s ILE 250 CO -0.00 0.35 0.51 -0.55 0.00 0.00 0.00 174.94 175.24 3n5m s SER 251 N 1.49 6.30 -0.70 3.58 0.15 -0.28 -4.36 113.70 119.88 3n5m s SER 251 Ca 0.06 -0.12 -0.27 0.00 0.70 0.00 0.00 55.95 56.31 3n5m s SER 251 Cb -0.15 -2.27 0.03 0.00 -1.71 0.00 0.00 66.02 61.93 3n5m s SER 251 CO 0.04 -0.51 1.24 -0.62 1.20 0.00 0.00 173.24 174.59 3n5m s ASP 252 N 1.78 6.23 -0.20 5.45 -1.08 -1.26 -1.84 116.67 125.75 3n5m s ASP 252 Ca 0.18 -0.35 0.15 0.00 -0.52 0.00 0.00 52.55 52.02 3n5m s ASP 252 Cb -0.16 -2.55 0.71 0.00 -1.46 0.00 0.00 42.92 39.47 3n5m s ASP 252 CO 0.14 -1.73 1.63 -0.62 0.52 0.00 0.00 175.17 175.10 3n5m n GLU 253 N 9.07 4.13 -0.14 4.34 -0.58 0.54 -4.23 120.64 133.78 3n5m n GLU 253 Ca 0.04 -3.01 -0.04 0.00 -0.42 0.00 0.00 57.16 53.73 3n5m n GLU 253 Cb 0.49 -2.07 0.04 0.00 -0.57 0.00 0.00 31.44 29.33 3n5m n GLU 253 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3n5m h VAL 254 N 3.36 0.75 0.08 2.62 2.07 -1.85 -0.11 116.25 123.16 3n5m h VAL 254 Ca 0.00 -0.07 -0.37 0.00 0.82 0.00 0.00 66.70 67.08 3n5m h VAL 254 Cb 1.72 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 3n5m h VAL 254 CO 0.37 0.04 -2.15 -0.38 0.02 0.00 0.00 177.57 175.46 3n5m n ILE 255 N -5.12 1.68 0.60 4.57 5.41 -1.26 -4.24 119.36 121.00 3n5m n ILE 255 Ca 0.04 -0.61 0.10 0.00 1.00 0.00 0.00 62.75 63.27 3n5m n ILE 255 Cb 0.21 -1.64 0.42 0.00 -0.71 0.00 0.00 39.64 37.92 3n5m n ILE 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3n5m s GLY 257 N -3.14 1.90 -0.87 0.00 0.00 -0.06 -3.49 107.32 101.67 3n5m s GLY 257 Ca 0.08 0.20 -0.01 0.00 0.00 0.00 0.00 44.72 45.00 3n5m s GLY 257 CO 0.37 0.50 0.73 0.69 0.00 0.00 0.00 173.10 175.39 3n5m n PHE 258 N -2.44 -1.62 -0.12 1.90 3.72 0.16 -3.75 117.46 115.30 3n5m n PHE 258 Ca 0.08 0.68 0.00 0.00 -0.05 0.00 0.00 57.45 58.15 3n5m n PHE 258 Cb 0.53 -4.17 0.00 0.00 -0.94 0.00 0.00 39.48 34.90 3n5m n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n5m n GLY 259 N -1.15 0.75 0.31 1.37 0.00 -0.92 -4.96 105.19 100.59 3n5m n GLY 259 Ca -0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.85 3n5m n GLY 259 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3n5m h ARG 260 N 3.87 0.87 -0.16 1.61 9.65 -1.67 -2.43 114.38 126.12 3n5m h ARG 260 Ca 0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 3n5m h ARG 260 Cb 0.00 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.38 3n5m h ARG 260 CO 0.00 0.57 0.00 0.25 2.80 0.00 0.00 179.97 183.59 3n5m n THR 261 N -4.67 0.19 -0.11 0.20 -2.24 -1.26 -1.84 114.28 104.55 3n5m n THR 261 Ca 0.12 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 3n5m n THR 261 Cb 0.21 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 3n5m n THR 261 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n5m n GLY 262 N 1.31 0.62 3.38 3.38 0.00 -0.91 -2.69 105.19 110.28 3n5m n GLY 262 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 3n5m n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n5m s LYS 263 N -0.89 1.47 0.20 1.61 -0.14 -1.26 -4.61 119.74 116.11 3n5m s LYS 263 Ca 0.00 -1.76 -0.11 0.00 -1.36 0.00 0.00 55.97 52.75 3n5m s LYS 263 Cb 0.00 -0.84 0.26 0.00 -1.68 0.00 0.00 37.83 35.56 3n5m s LYS 263 CO 0.00 -0.07 1.72 0.00 -0.76 0.00 0.00 175.35 176.24 3n5m h ALA 264 N 2.34 0.68 -2.62 5.17 0.00 -1.93 -2.95 119.26 119.95 3n5m h ALA 264 Ca -0.39 0.11 -0.28 0.00 0.00 0.00 0.00 54.91 54.34 3n5m h ALA 264 Cb 1.23 0.13 -0.17 0.00 0.00 0.00 0.00 17.79 18.97 3n5m h ALA 264 CO 0.66 -0.27 -0.72 -0.06 0.00 0.00 0.00 179.25 178.86 3n5m s PHE 265 N -6.11 0.97 0.26 0.00 0.08 -1.26 0.37 117.98 112.28 3n5m s PHE 265 Ca -0.13 -0.71 -0.05 0.00 0.12 0.00 0.00 56.93 56.16 3n5m s PHE 265 Cb 0.17 -0.54 0.31 0.00 -0.57 0.00 0.00 43.02 42.39 3n5m s PHE 265 CO 0.74 -0.05 1.93 0.78 -0.10 0.00 0.00 175.22 178.52 3n5m h GLY 266 N 3.48 1.33 -4.90 4.36 0.00 -1.83 -3.36 103.07 102.15 3n5m h GLY 266 Ca -0.36 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.44 3n5m h GLY 266 CO 0.55 0.50 0.42 1.97 0.00 0.00 0.00 176.54 179.98 3n5m n PHE 267 N -4.38 0.00 0.00 5.60 1.16 -1.26 -4.16 117.46 114.42 3n5m n PHE 267 Ca 0.11 -0.11 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 3n5m n PHE 267 Cb 0.03 -0.48 0.00 0.00 -1.61 0.00 0.00 39.48 37.41 3n5m n PHE 267 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 3n5m n ASN 269 N 2.93 0.00 -0.59 5.98 3.02 -1.26 -3.32 115.26 122.02 3n5m n ASN 269 Ca 0.03 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.65 3n5m n ASN 269 Cb 0.07 0.00 0.17 0.00 -0.61 0.00 0.00 39.78 39.41 3n5m n ASN 269 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3n5m n TYR 270 N 0.00 0.53 -3.67 3.10 4.01 -1.26 -5.03 117.16 114.84 3n5m n TYR 270 Ca 0.00 -0.69 -0.23 0.00 -0.16 0.00 0.00 57.90 56.83 3n5m n TYR 270 Cb 0.00 -0.15 0.05 0.00 -0.31 0.00 0.00 39.34 38.93 3n5m n TYR 270 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3n5m n ASP 271 N -0.18 -2.88 -4.17 7.72 2.03 -1.21 -4.38 116.55 113.48 3n5m n ASP 271 Ca 0.14 -0.73 -0.17 0.00 0.52 0.00 0.00 54.79 54.55 3n5m n ASP 271 Cb 0.59 -4.40 -0.12 0.00 -0.72 0.00 0.00 41.12 36.48 3n5m n ASP 271 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3n5m s VAL 272 N -3.47 1.07 -0.37 5.18 -7.23 -1.25 -4.88 120.40 109.45 3n5m s VAL 272 Ca 0.23 -1.40 -0.01 0.00 -1.81 0.00 0.00 61.98 58.98 3n5m s VAL 272 Cb -0.11 -1.14 0.09 0.00 0.56 0.00 0.00 36.38 35.78 3n5m s VAL 272 CO 0.79 -0.32 0.12 -0.75 -0.31 0.00 0.00 175.10 174.63 3n5m s LYS 273 N -2.03 1.99 0.47 4.82 2.47 -1.26 -5.00 119.74 121.21 3n5m s LYS 273 Ca 0.00 -1.70 -0.21 0.00 -1.56 0.00 0.00 55.97 52.50 3n5m s LYS 273 Cb -0.08 -3.41 -0.08 0.00 -1.46 0.00 0.00 37.83 32.80 3n5m s LYS 273 CO 0.02 -0.94 1.06 -2.14 0.16 0.00 0.00 175.35 173.51 3n5m s PRO 274 N 1.12 3.83 0.23 4.03 0.02 -1.26 -4.96 135.00 138.00 3n5m s PRO 274 Ca 0.06 1.45 -0.06 0.00 0.02 0.00 0.00 61.00 62.47 3n5m s PRO 274 Cb -0.21 -2.20 0.21 0.00 0.02 0.00 0.00 34.50 32.32 3n5m s PRO 274 CO -0.04 -0.42 1.75 -0.44 -0.33 0.00 0.00 177.00 177.52 3n5m h ASP 275 N 1.76 0.99 -4.01 2.53 3.32 -1.81 -3.44 116.42 115.74 3n5m h ASP 275 Ca -0.49 -0.20 -0.22 0.00 0.02 0.00 0.00 57.03 56.14 3n5m h ASP 275 Cb 1.23 -0.26 -0.26 0.00 0.22 0.00 0.00 39.33 40.25 3n5m h ASP 275 CO 0.60 0.95 -0.72 -0.63 -1.72 0.00 0.00 179.24 177.72 3n5m s ILE 276 N -5.28 0.03 -0.06 0.35 1.01 -1.08 -1.24 121.20 114.93 3n5m s ILE 276 Ca -0.11 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.35 3n5m s ILE 276 Cb 0.15 -0.07 0.01 0.00 0.01 0.00 0.00 42.46 42.56 3n5m s ILE 276 CO 0.83 -0.11 -0.11 -0.63 0.00 0.00 0.00 174.94 174.93 3n5m s ILE 277 N -0.33 1.01 0.33 2.92 1.01 0.42 -1.13 121.20 125.43 3n5m s ILE 277 Ca -0.04 -0.41 0.08 0.00 0.00 0.00 0.00 60.65 60.28 3n5m s ILE 277 Cb -0.02 -0.93 -0.04 0.00 0.01 0.00 0.00 42.46 41.48 3n5m s ILE 277 CO -0.00 0.32 0.14 0.42 0.00 0.00 0.00 174.94 175.82 3n5m s THR 278 N 0.64 3.14 0.00 2.92 -4.23 -0.77 0.05 115.64 117.39 3n5m s THR 278 Ca -0.13 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 3n5m s THR 278 Cb -0.15 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.70 3n5m s THR 278 CO 0.03 -0.21 0.00 0.00 -0.54 0.00 0.00 174.62 173.90 3n5m n ALA 280 N -1.14 0.00 -0.05 3.99 0.00 -1.26 -0.34 120.51 121.71 3n5m n ALA 280 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3n5m n ALA 280 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 3n5m n ALA 280 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3n5m n LYS 281 N 0.00 0.00 0.00 0.00 5.02 -1.26 -1.47 118.16 120.45 3n5m n LYS 281 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 3n5m n LYS 281 Cb 0.00 0.00 0.27 0.00 -0.02 0.00 0.00 35.03 35.28 3n5m n LYS 281 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3n5m n GLY 282 N 0.00 -0.75 0.37 0.72 0.00 -1.22 -2.36 105.19 101.94 3n5m n GLY 282 Ca 0.00 -0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.07 3n5m n GLY 282 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3n5m h ILE 283 N 0.00 0.90 -0.14 -0.61 2.10 -1.55 -1.93 117.51 116.28 3n5m h ILE 283 Ca 0.00 -0.24 0.00 0.00 1.08 0.00 0.00 64.86 65.70 3n5m h ILE 283 Cb 0.14 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 35.99 3n5m h ILE 283 CO 0.00 0.13 0.00 0.35 -1.08 0.00 0.00 178.15 177.55 3n5m n THR 284 N -4.53 1.34 -1.90 2.19 -2.24 -1.20 -4.58 114.28 103.37 3n5m n THR 284 Ca 0.15 -1.35 -0.12 0.00 -2.27 0.00 0.00 64.05 60.46 3n5m n THR 284 Cb 0.39 0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 3n5m n THR 284 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3n5m n SER 285 N -0.37 -3.42 -0.65 3.42 7.64 -0.73 -1.56 113.62 117.95 3n5m n SER 285 Ca 0.09 0.25 -0.09 0.00 1.01 0.00 0.00 58.87 60.14 3n5m n SER 285 Cb 0.46 -3.07 -0.04 0.00 -1.01 0.00 0.00 64.21 60.56 3n5m n SER 285 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3n5m n ALA 286 N -0.98 -0.13 0.10 -0.43 0.00 -1.00 -3.87 120.51 114.20 3n5m n ALA 286 Ca -0.13 0.14 0.01 0.00 0.00 0.00 0.00 53.44 53.46 3n5m n ALA 286 Cb 0.50 -1.49 0.32 0.00 0.00 0.00 0.00 19.45 18.78 3n5m n ALA 286 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3n5m h TYR 287 N 0.00 0.27 -3.90 0.00 -1.99 -1.62 -3.44 116.97 106.30 3n5m h TYR 287 Ca -0.17 -0.05 -0.13 0.00 2.00 0.00 0.00 58.73 60.38 3n5m h TYR 287 Cb 0.95 -0.07 -0.18 0.00 2.00 0.00 0.00 36.73 39.43 3n5m h TYR 287 CO 0.49 0.47 -0.57 -0.51 -0.00 0.00 0.00 178.16 178.04 3n5m s LEU 288 N -8.58 1.98 0.01 3.88 1.43 -1.26 -5.13 118.68 111.00 3n5m s LEU 288 Ca -0.05 -0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 52.15 3n5m s LEU 288 Cb 0.15 0.46 -0.04 0.00 0.03 0.00 0.00 46.19 46.79 3n5m s LEU 288 CO 0.75 -0.49 1.14 -2.84 0.23 0.00 0.00 176.35 175.14 3n5m s PRO 289 N -2.63 4.44 -0.23 1.29 0.02 -1.26 -4.74 135.00 131.89 3n5m s PRO 289 Ca -0.05 1.66 -0.26 0.00 0.02 0.00 0.00 61.00 62.36 3n5m s PRO 289 Cb -0.01 -3.43 0.11 0.00 0.02 0.00 0.00 34.50 31.19 3n5m s PRO 289 CO -0.05 -0.26 0.92 -1.17 -0.33 0.00 0.00 177.00 176.11 3n5m s LEU 290 N 1.35 -0.52 0.22 -5.54 2.96 -0.95 -4.77 118.68 111.43 3n5m s LEU 290 Ca 0.56 0.90 -0.07 0.00 -0.22 0.00 0.00 54.13 55.31 3n5m s LEU 290 Cb -0.26 2.08 -0.02 0.00 0.50 0.00 0.00 46.19 48.49 3n5m s LEU 290 CO 0.27 -0.25 0.31 -0.94 -1.32 0.00 0.00 176.35 174.41 3n5m s SER 291 N -0.11 0.03 -0.06 3.68 1.04 1.06 -4.34 113.70 115.00 3n5m s SER 291 Ca 0.00 -1.16 -0.15 0.00 0.48 0.00 0.00 55.95 55.13 3n5m s SER 291 Cb -0.04 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.60 3n5m s SER 291 CO -0.02 -0.99 0.35 0.00 0.98 0.00 0.00 173.24 173.56 3n5m s ALA 292 N -4.09 -0.88 -0.26 5.32 0.00 -1.26 -0.68 121.76 119.92 3n5m s ALA 292 Ca 0.31 0.62 0.02 0.00 0.00 0.00 0.00 51.96 52.91 3n5m s ALA 292 Cb 0.03 -0.17 0.06 0.00 0.00 0.00 0.00 23.12 23.04 3n5m s ALA 292 CO 0.11 -0.24 -0.10 0.99 0.00 0.00 0.00 175.76 176.52 3n5m s THR 293 N -0.79 2.27 -0.18 0.00 2.01 -0.04 -4.36 115.64 114.54 3n5m s THR 293 Ca -0.09 -1.55 -0.13 0.00 0.31 0.00 0.00 61.69 60.23 3n5m s THR 293 Cb -0.04 -2.30 -0.05 0.00 0.01 0.00 0.00 72.50 70.12 3n5m s THR 293 CO 0.03 0.01 0.27 0.00 -0.69 0.00 0.00 174.62 174.24 3n5m s ALA 294 N 1.13 3.60 -0.05 7.40 0.00 0.11 -1.23 121.76 132.72 3n5m s ALA 294 Ca -0.07 -0.56 0.04 0.00 0.00 0.00 0.00 51.96 51.37 3n5m s ALA 294 Cb -0.19 -2.40 -0.00 0.00 0.00 0.00 0.00 23.12 20.53 3n5m s ALA 294 CO -0.05 -0.01 -0.18 0.08 0.00 0.00 0.00 175.76 175.60 3n5m s VAL 295 N 0.69 1.49 0.40 0.00 1.01 -0.30 -0.44 120.40 123.26 3n5m s VAL 295 Ca 0.14 -0.74 -0.26 0.00 0.00 0.00 0.00 61.98 61.12 3n5m s VAL 295 Cb -0.13 -1.28 -0.10 0.00 0.00 0.00 0.00 36.38 34.87 3n5m s VAL 295 CO 0.04 0.43 1.26 0.29 0.00 0.00 0.00 175.10 177.11 3n5m n LYS 296 N 3.17 1.93 -0.36 2.72 5.02 -0.37 -0.50 118.16 129.78 3n5m n LYS 296 Ca -0.18 0.69 0.11 0.00 -2.02 0.00 0.00 58.31 56.90 3n5m n LYS 296 Cb 0.53 -2.35 0.29 0.00 -0.02 0.00 0.00 35.03 33.47 3n5m n LYS 296 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3n5m h ARG 297 N 2.15 0.83 0.00 1.97 2.43 -1.81 -1.39 114.38 118.56 3n5m h ARG 297 Ca -0.47 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 58.63 3n5m h ARG 297 Cb 1.29 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 3n5m h ARG 297 CO 0.60 0.55 -0.08 1.05 -1.51 0.00 0.00 179.97 180.58 3n5m h GLU 298 N 0.86 0.00 -0.07 0.20 9.09 -1.89 -1.96 114.58 120.81 3n5m h GLU 298 Ca 0.55 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.87 3n5m h GLU 298 Cb 0.73 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.84 3n5m h GLU 298 CO -0.34 0.08 -0.31 0.82 0.05 0.00 0.00 179.01 179.32 3n5m h ILE 299 N 0.00 1.43 -0.67 -1.06 2.04 -1.60 -3.24 117.51 114.40 3n5m h ILE 299 Ca -0.00 -1.71 0.11 0.00 1.00 0.00 0.00 64.86 64.26 3n5m h ILE 299 Cb 0.16 2.33 -0.04 0.00 -0.74 0.00 0.00 36.82 38.53 3n5m h ILE 299 CO 0.01 0.49 0.45 0.22 0.00 0.00 0.00 178.15 179.32 3n5m h TYR 300 N -0.17 0.48 -0.07 1.37 3.20 -1.21 -1.72 116.97 118.86 3n5m h TYR 300 Ca -0.02 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 3n5m h TYR 300 Cb 0.96 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 3n5m h TYR 300 CO 0.13 0.21 0.07 0.93 -1.64 0.00 0.00 178.16 177.87 3n5m h GLU 301 N 0.44 0.00 0.00 1.82 4.39 -1.40 -1.22 114.58 118.61 3n5m h GLU 301 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 3n5m h GLU 301 Cb 0.63 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 3n5m h GLU 301 CO -0.09 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.76 3n5m n ALA 302 N -2.34 2.07 -0.88 3.43 0.00 -0.64 -3.29 120.51 118.86 3n5m n ALA 302 Ca -0.01 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.42 3n5m n ALA 302 Cb 0.17 -1.36 0.29 0.00 0.00 0.00 0.00 19.45 18.55 3n5m n ALA 302 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3n5m n PHE 303 N -1.42 1.20 0.84 0.00 3.72 -0.46 -4.58 117.46 116.76 3n5m n PHE 303 Ca 0.07 -0.79 0.10 0.00 -0.05 0.00 0.00 57.45 56.78 3n5m n PHE 303 Cb 0.23 -0.33 0.06 0.00 -0.94 0.00 0.00 39.48 38.50 3n5m n PHE 303 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3n5m n LYS 304 N -0.05 1.71 -1.16 -1.08 5.02 -1.21 -4.26 118.16 117.12 3n5m n LYS 304 Ca 0.22 -1.46 -0.29 0.00 -2.02 0.00 0.00 58.31 54.77 3n5m n LYS 304 Cb 0.92 -1.38 0.19 0.00 -0.02 0.00 0.00 35.03 34.75 3n5m n LYS 304 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3n5m s GLY 305 N -1.84 1.57 0.00 0.72 0.00 -1.26 -4.97 107.32 101.54 3n5m s GLY 305 Ca 0.21 -0.53 0.25 0.00 0.00 0.00 0.00 44.72 44.64 3n5m s GLY 305 CO 0.32 0.15 1.35 0.28 0.00 0.00 0.00 173.10 175.21 3n5m n LYS 306 N -4.32 0.18 -1.70 2.90 4.76 -1.26 -4.75 118.16 113.97 3n5m n LYS 306 Ca 0.07 -0.12 -0.38 0.00 -2.87 0.00 0.00 58.31 55.01 3n5m n LYS 306 Cb 0.58 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.32 3n5m n LYS 306 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3n5m n GLY 307 N 1.47 0.39 0.31 0.72 0.00 -1.26 -4.92 105.19 101.90 3n5m n GLY 307 Ca 0.07 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.14 3n5m n GLY 307 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3n5m h GLU 308 N 1.10 0.54 -0.46 1.61 4.81 -2.02 -2.53 114.58 117.62 3n5m h GLU 308 Ca -0.50 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 3n5m h GLU 308 Cb 1.33 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3n5m h GLU 308 CO 0.55 0.36 0.00 0.66 -0.73 0.00 0.00 179.01 179.85 3n5m n TYR 309 N -4.92 0.91 0.24 0.92 4.01 -1.26 -4.67 117.16 112.38 3n5m n TYR 309 Ca 0.18 -0.61 0.13 0.00 -0.16 0.00 0.00 57.90 57.44 3n5m n TYR 309 Cb 0.48 -0.15 0.24 0.00 -0.31 0.00 0.00 39.34 39.60 3n5m n TYR 309 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 3n5m h GLU 310 N 2.81 0.00 -6.76 -0.72 5.08 -1.77 -3.45 114.58 109.76 3n5m h GLU 310 Ca 0.00 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.90 3n5m h GLU 310 Cb 1.11 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.40 3n5m h GLU 310 CO 0.11 0.00 -0.05 -0.59 -1.00 0.00 0.00 179.01 177.48 3n5m s PHE 311 N -3.26 3.20 -0.59 4.33 -0.12 -1.26 -4.41 117.98 115.87 3n5m s PHE 311 Ca 0.06 0.27 -0.27 0.00 -0.05 0.00 0.00 56.93 56.94 3n5m s PHE 311 Cb 0.06 -2.40 0.00 0.00 -0.63 0.00 0.00 43.02 40.05 3n5m s PHE 311 CO 0.65 -0.45 1.60 0.12 -0.05 0.00 0.00 175.22 177.09 3n5m s PHE 312 N -2.63 2.00 -1.35 3.49 5.36 -1.26 -4.90 117.98 118.69 3n5m s PHE 312 Ca 0.50 0.51 -0.11 0.00 -0.96 0.00 0.00 56.93 56.87 3n5m s PHE 312 Cb -0.10 -4.29 0.11 0.00 -0.34 0.00 0.00 43.02 38.40 3n5m s PHE 312 CO 0.39 -2.21 2.06 0.54 -1.46 0.00 0.00 175.22 174.55 3n5m n ARG 313 N 8.98 3.45 -3.70 10.12 1.74 -1.26 -4.86 116.66 131.12 3n5m n ARG 313 Ca 0.15 -3.18 -0.17 0.00 -0.77 0.00 0.00 57.85 53.88 3n5m n ARG 313 Cb 0.50 -3.02 -0.16 0.00 -1.02 0.00 0.00 32.46 28.76 3n5m n ARG 313 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3n5m s HIS 314 N 1.23 -0.09 -0.09 -1.55 2.46 -1.26 -5.14 115.29 110.86 3n5m s HIS 314 Ca 0.44 0.43 0.04 0.00 0.47 0.00 0.00 55.06 56.43 3n5m s HIS 314 Cb 0.12 -0.28 0.00 0.00 -0.13 0.00 0.00 32.58 32.30 3n5m s HIS 314 CO -0.03 -0.20 -0.20 -1.50 -2.47 0.00 0.00 174.74 170.33 3n5m s ILE 315 N 1.86 1.76 -0.28 0.89 1.10 -1.26 -5.04 121.20 120.22 3n5m s ILE 315 Ca -0.01 -0.85 0.02 0.00 -0.51 0.00 0.00 60.65 59.31 3n5m s ILE 315 Cb -0.12 -1.54 0.07 0.00 0.15 0.00 0.00 42.46 41.02 3n5m s ILE 315 CO -0.05 0.49 -0.07 0.21 -2.11 0.00 0.00 174.94 173.42 3n5m s ASN 316 N 0.41 4.57 0.14 4.50 3.84 -1.26 -5.04 114.94 122.10 3n5m s ASN 316 Ca -0.17 -1.52 -0.23 0.00 0.21 0.00 0.00 52.86 51.16 3n5m s ASN 316 Cb -0.17 -1.59 -0.00 0.00 -0.55 0.00 0.00 41.25 38.94 3n5m s ASN 316 CO 0.07 -0.24 1.65 0.74 -2.79 0.00 0.00 177.10 176.53 3n5m h THR 317 N 6.70 0.49 0.00 -5.21 2.02 -1.99 -3.06 112.91 111.86 3n5m h THR 317 Ca -0.17 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.97 3n5m h THR 317 Cb 1.04 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 3n5m h THR 317 CO 0.48 0.00 -1.31 0.49 0.37 0.00 0.00 175.52 175.55 3n5m n PHE 318 N -5.34 0.76 -1.65 3.16 3.72 -1.26 -4.91 117.46 111.94 3n5m n PHE 318 Ca -0.02 0.23 -0.47 0.00 -0.05 0.00 0.00 57.45 57.14 3n5m n PHE 318 Cb 0.26 -0.90 -0.04 0.00 -0.94 0.00 0.00 39.48 37.86 3n5m n PHE 318 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n5m n GLY 319 N 1.25 0.90 1.73 1.37 0.00 -1.16 -2.03 105.19 107.25 3n5m n GLY 319 Ca -0.03 0.61 -0.00 0.00 0.00 0.00 0.00 46.02 46.60 3n5m n GLY 319 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n5m n GLY 320 N 2.90 0.69 3.71 -0.02 0.00 -1.26 -4.75 105.19 106.48 3n5m n GLY 320 Ca 0.16 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 3n5m n GLY 320 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3n5m n ASN 321 N 1.61 3.52 -0.09 1.61 2.85 -0.86 -4.79 115.26 119.10 3n5m n ASN 321 Ca -0.00 1.13 -0.06 0.00 -0.11 0.00 0.00 54.58 55.53 3n5m n ASN 321 Cb 0.50 -1.53 -0.00 0.00 1.24 0.00 0.00 39.78 39.99 3n5m n ASN 321 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3n5m h PRO 322 N 5.05 -0.04 -0.87 1.20 0.11 -1.87 -0.42 132.00 135.16 3n5m h PRO 322 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3n5m h PRO 322 Cb 1.24 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 3n5m h PRO 322 CO 0.82 -0.03 0.51 0.00 -0.21 0.00 0.00 178.00 179.09 3n5m h ALA 323 N 1.25 1.11 -0.51 -0.75 0.00 -1.83 -0.85 119.26 117.68 3n5m h ALA 323 Ca 0.16 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3n5m h ALA 323 Cb 0.29 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3n5m h ALA 323 CO -0.36 0.58 -0.13 0.00 0.00 0.00 0.00 179.25 179.34 3n5m h ALA 324 N 1.28 0.80 -0.20 0.00 0.00 -1.74 -0.29 119.26 119.10 3n5m h ALA 324 Ca 0.31 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3n5m h ALA 324 Cb -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3n5m h ALA 324 CO -0.06 0.66 0.06 0.00 0.00 0.00 0.00 179.25 179.92 3n5m h ALA 326 N 0.88 0.98 -0.63 0.00 0.00 -1.03 -0.60 119.26 118.86 3n5m h ALA 326 Ca 0.06 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3n5m h ALA 326 Cb 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3n5m h ALA 326 CO -0.00 0.51 0.14 1.25 0.00 0.00 0.00 179.25 181.15 3n5m h LEU 327 N 1.06 0.97 -0.82 0.00 6.46 -0.96 -2.84 115.31 119.18 3n5m h LEU 327 Ca 0.27 -0.24 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 3n5m h LEU 327 Cb 0.06 -0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 39.69 3n5m h LEU 327 CO -0.04 0.96 0.47 0.00 -0.62 0.00 0.00 178.44 179.21 3n5m h ALA 328 N 1.05 1.05 -0.60 1.25 0.00 -0.05 -0.13 119.26 121.82 3n5m h ALA 328 Ca 0.20 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3n5m h ALA 328 Cb 0.37 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3n5m h ALA 328 CO 0.00 0.54 0.34 -0.07 0.00 0.00 0.00 179.25 180.07 3n5m h LEU 329 N 1.14 0.53 -0.77 0.00 3.38 -1.01 0.52 115.31 119.10 3n5m h LEU 329 Ca 0.29 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.18 3n5m h LEU 329 Cb 0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3n5m h LEU 329 CO -0.05 0.36 -0.10 0.50 0.09 0.00 0.00 178.44 179.24 3n5m h LYS 330 N 0.66 0.83 -0.72 1.13 1.63 -1.19 -2.09 116.57 116.81 3n5m h LYS 330 Ca 0.26 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 3n5m h LYS 330 Cb 0.10 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 3n5m h LYS 330 CO -0.14 0.89 0.40 -0.97 -3.45 0.00 0.00 179.45 176.19 3n5m h ASN 331 N 0.75 0.89 -0.17 4.20 -0.73 -0.26 -0.66 115.58 119.59 3n5m h ASN 331 Ca 0.13 -0.09 -0.10 0.00 1.87 0.00 0.00 56.30 58.11 3n5m h ASN 331 Cb 0.60 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.95 3n5m h ASN 331 CO 0.04 0.72 -0.22 -0.07 -0.37 0.00 0.00 177.43 177.53 3n5m h LEU 332 N 0.98 0.62 -0.64 0.34 3.38 -0.77 -1.69 115.31 117.54 3n5m h LEU 332 Ca 0.25 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3n5m h LEU 332 Cb 0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3n5m h LEU 332 CO -0.04 0.83 0.21 -0.08 0.09 0.00 0.00 178.44 179.45 3n5m h GLU 333 N 0.55 0.99 0.09 1.13 4.81 -0.92 -2.11 114.58 119.11 3n5m h GLU 333 Ca 0.08 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 3n5m h GLU 333 Cb 0.67 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.90 3n5m h GLU 333 CO 0.05 0.87 -0.04 0.82 -0.73 0.00 0.00 179.01 179.97 3n5m h ILE 334 N 0.92 0.93 -0.90 2.32 2.04 -0.91 0.31 117.51 122.22 3n5m h ILE 334 Ca 0.21 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 66.08 3n5m h ILE 334 Cb 0.28 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 37.25 3n5m h ILE 334 CO -0.01 0.01 0.57 0.40 0.00 0.00 0.00 178.15 179.13 3n5m h ILE 335 N -0.13 1.11 0.21 -0.67 2.04 -1.18 -0.59 117.51 118.30 3n5m h ILE 335 Ca -0.01 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 3n5m h ILE 335 Cb 0.11 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.12 3n5m h ILE 335 CO 0.02 0.20 -0.10 -0.08 0.00 0.00 0.00 178.15 178.18 3n5m h GLU 336 N 1.08 -0.28 -0.10 2.37 4.81 -1.27 -1.22 114.58 119.98 3n5m h GLU 336 Ca 0.37 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.59 3n5m h GLU 336 Cb 0.08 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 3n5m h GLU 336 CO -0.14 0.10 -0.10 -0.91 -0.73 0.00 0.00 179.01 177.22 3n5m h ASN 337 N -0.76 0.14 -0.36 1.04 2.35 -0.80 -2.41 115.58 114.79 3n5m h ASN 337 Ca -0.03 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3n5m h ASN 337 Cb 0.50 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3n5m h ASN 337 CO 0.05 0.27 0.00 -0.62 -1.65 0.00 0.00 177.43 175.48 3n5m n GLU 338 N -4.33 2.17 -3.61 0.81 1.02 -0.24 -4.95 120.64 111.50 3n5m n GLU 338 Ca -0.01 -1.78 -0.26 0.00 -0.02 0.00 0.00 57.16 55.09 3n5m n GLU 338 Cb 0.23 -1.44 0.05 0.00 -0.02 0.00 0.00 31.44 30.25 3n5m n GLU 338 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3n5m n ASN 339 N 0.98 -5.69 0.21 1.62 5.15 -0.91 -4.88 115.26 111.75 3n5m n ASN 339 Ca 0.18 -0.58 0.08 0.00 -0.60 0.00 0.00 54.58 53.66 3n5m n ASN 339 Cb 0.47 -4.52 0.45 0.00 -0.53 0.00 0.00 39.78 35.65 3n5m n ASN 339 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3n5m h LEU 340 N -2.21 0.00 -0.08 1.20 3.38 -1.49 -1.48 115.31 114.63 3n5m h LEU 340 Ca -0.56 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.40 3n5m h LEU 340 Cb 1.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 3n5m h LEU 340 CO 0.60 0.28 -0.00 0.40 0.09 0.00 0.00 178.44 179.81 3n5m h ILE 341 N 0.00 1.25 -0.45 1.22 2.04 -1.86 -0.26 117.51 119.45 3n5m h ILE 341 Ca -0.00 -0.80 -0.09 0.00 1.00 0.00 0.00 64.86 64.96 3n5m h ILE 341 Cb 0.72 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 3n5m h ILE 341 CO 0.04 0.22 -0.10 -0.08 0.00 0.00 0.00 178.15 178.23 3n5m h GLU 342 N -0.14 0.81 -0.75 2.37 4.57 -1.79 -2.37 114.58 117.28 3n5m h GLU 342 Ca 0.02 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 3n5m h GLU 342 Cb 0.35 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.84 3n5m h GLU 342 CO 0.00 0.88 0.48 0.00 -1.18 0.00 0.00 179.01 179.19 3n5m h ARG 343 N 0.73 1.00 -0.06 1.92 2.47 -1.18 -0.56 114.38 118.70 3n5m h ARG 343 Ca 0.12 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.77 3n5m h ARG 343 Cb 0.59 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.69 3n5m h ARG 343 CO 0.04 0.68 0.03 1.03 0.56 0.00 0.00 179.97 182.31 3n5m h SER 344 N 1.02 0.08 -0.28 7.04 0.87 -0.70 -2.96 113.55 118.63 3n5m h SER 344 Ca 0.27 -0.10 0.05 0.00 -1.23 0.00 0.00 61.79 60.78 3n5m h SER 344 Cb -0.09 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 61.81 3n5m h SER 344 CO -0.06 0.15 -0.00 0.00 -0.53 0.00 0.00 176.83 176.40 3n5m h ALA 345 N 0.93 0.25 0.00 6.23 0.00 -1.09 0.22 119.26 125.79 3n5m h ALA 345 Ca 0.02 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3n5m h ALA 345 Cb 0.09 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3n5m h ALA 345 CO -0.00 -0.41 0.00 1.04 0.00 0.00 0.00 179.25 179.87 3n5m n GLN 346 N -5.16 0.67 0.00 0.00 6.02 -0.25 -1.64 117.38 117.02 3n5m n GLN 346 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3n5m n GLN 346 Cb 0.14 -1.30 0.00 0.00 1.02 0.00 0.00 30.24 30.11 3n5m n GLN 346 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n5m n GLY 348 N 0.28 0.00 0.24 1.08 0.00 0.75 -1.92 105.19 105.63 3n5m n GLY 348 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 3n5m n GLY 348 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3n5m h SER 349 N 0.00 0.72 -0.59 1.61 0.02 -1.52 -1.14 113.55 112.65 3n5m h SER 349 Ca 0.00 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.80 3n5m h SER 349 Cb 0.00 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 3n5m h SER 349 CO 0.00 0.64 0.26 0.25 -1.14 0.00 0.00 176.83 176.83 3n5m h LEU 350 N 0.76 0.79 -0.56 5.07 5.85 -1.66 0.11 115.31 125.67 3n5m h LEU 350 Ca 0.19 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 3n5m h LEU 350 Cb 0.10 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3n5m h LEU 350 CO -0.03 0.73 0.25 0.25 -0.34 0.00 0.00 178.44 179.29 3n5m h LEU 351 N 0.81 0.76 -0.26 2.25 5.85 -1.78 -0.31 115.31 122.63 3n5m h LEU 351 Ca 0.20 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 3n5m h LEU 351 Cb 0.16 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3n5m h LEU 351 CO -0.02 0.70 -0.00 0.25 -0.34 0.00 0.00 178.44 179.03 3n5m h LEU 352 N 0.77 0.44 -0.28 2.25 5.85 -0.82 -1.21 115.31 122.31 3n5m h LEU 352 Ca 0.19 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 3n5m h LEU 352 Cb 0.17 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 3n5m h LEU 352 CO -0.02 0.65 -0.02 1.05 -0.34 0.00 0.00 178.44 179.76 3n5m h GLU 353 N 0.23 0.51 -0.63 1.25 4.11 -0.69 -2.49 114.58 116.87 3n5m h GLU 353 Ca 0.07 -0.17 -0.07 0.00 0.07 0.00 0.00 59.36 59.26 3n5m h GLU 353 Cb 0.42 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 3n5m h GLU 353 CO 0.01 0.68 0.12 1.96 0.07 0.00 0.00 179.01 181.86 3n5m h GLN 354 N 0.29 1.02 -0.64 1.06 4.20 -1.09 -2.33 115.11 117.61 3n5m h GLN 354 Ca 0.08 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.51 3n5m h GLN 354 Cb 0.46 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 3n5m h GLN 354 CO 0.02 0.92 0.29 -0.07 -0.67 0.00 0.00 178.83 179.32 3n5m h LEU 355 N 0.96 0.87 -0.41 1.46 3.38 -1.16 0.12 115.31 120.53 3n5m h LEU 355 Ca 0.20 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3n5m h LEU 355 Cb 0.39 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3n5m h LEU 355 CO 0.01 0.78 0.20 0.11 0.09 0.00 0.00 178.44 179.62 3n5m h LYS 356 N 0.90 0.59 -0.35 1.13 1.57 -1.23 -0.11 116.57 119.07 3n5m h LYS 356 Ca 0.22 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3n5m h LYS 356 Cb 0.16 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 3n5m h LYS 356 CO -0.02 0.51 0.17 0.93 -0.57 0.00 0.00 179.45 180.47 3n5m h GLU 357 N 0.52 0.50 -0.20 3.15 5.08 -1.16 0.33 114.58 122.80 3n5m h GLU 357 Ca 0.14 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.30 3n5m h GLU 357 Cb 0.12 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3n5m h GLU 357 CO -0.02 0.45 -0.35 0.93 -1.00 0.00 0.00 179.01 179.02 3n5m h GLU 358 N 0.42 0.60 0.00 2.33 4.39 -0.80 -3.39 114.58 118.12 3n5m h GLU 358 Ca 0.12 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.45 3n5m h GLU 358 Cb 0.12 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 3n5m h GLU 358 CO -0.02 0.98 0.00 0.44 -1.16 0.00 0.00 179.01 179.26 3n5m n ILE 359 N -4.29 0.64 -0.32 3.13 -5.35 -0.07 -4.82 119.36 108.28 3n5m n ILE 359 Ca -0.06 -0.64 -0.04 0.00 -0.27 0.00 0.00 62.75 61.74 3n5m n ILE 359 Cb 0.51 0.68 0.08 0.00 -1.74 0.00 0.00 39.64 39.17 3n5m n ILE 359 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3n5m h GLY 360 N 0.00 1.33 2.00 3.28 0.00 -0.30 -2.52 103.07 106.86 3n5m h GLY 360 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 46.70 3n5m h GLY 360 CO 0.00 0.60 0.00 1.18 0.00 0.00 0.00 176.54 178.32 3n5m n GLU 361 N -4.32 0.04 -1.73 4.80 1.02 -1.26 -4.83 120.64 114.36 3n5m n GLU 361 Ca 0.09 0.18 -0.42 0.00 -0.02 0.00 0.00 57.16 56.99 3n5m n GLU 361 Cb 0.12 -1.56 -0.02 0.00 -0.02 0.00 0.00 31.44 29.96 3n5m n GLU 361 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 3n5m n HIS 362 N -1.63 2.65 0.32 -0.32 -0.00 -0.95 -4.84 115.22 110.46 3n5m n HIS 362 Ca 0.05 0.35 0.10 0.00 0.46 0.00 0.00 57.72 58.68 3n5m n HIS 362 Cb 0.25 -2.54 0.47 0.00 -0.12 0.00 0.00 29.99 28.05 3n5m n HIS 362 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 3n5m n PRO 363 N 1.79 0.15 -0.11 1.57 -0.04 -1.26 -2.32 135.00 134.77 3n5m n PRO 363 Ca 0.08 0.46 0.05 0.00 -0.04 0.00 0.00 63.50 64.06 3n5m n PRO 363 Cb 0.36 -1.83 0.11 0.00 -0.04 0.00 0.00 33.50 32.09 3n5m n PRO 363 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3n5m n LEU 364 N -2.12 2.53 -4.43 1.53 4.77 -1.26 -4.50 117.00 113.51 3n5m n LEU 364 Ca 0.01 -1.65 -0.44 0.00 -0.03 0.00 0.00 56.01 53.91 3n5m n LEU 364 Cb 0.16 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 41.05 3n5m n LEU 364 CO 0.15 0.59 0.43 -0.69 -1.33 0.00 0.00 177.39 176.54 3n5m s VAL 365 N -0.96 4.77 0.06 4.08 1.01 -0.98 -0.56 120.40 127.82 3n5m s VAL 365 Ca 0.19 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.47 3n5m s VAL 365 Cb 0.11 -4.40 -0.24 0.00 0.00 0.00 0.00 36.38 31.84 3n5m s VAL 365 CO 0.14 -0.97 1.16 1.23 0.00 0.00 0.00 175.10 176.66 3n5m h GLY 366 N 10.03 0.72 -4.84 4.51 0.00 -0.88 -3.46 103.07 109.15 3n5m h GLY 366 Ca -0.28 -1.30 -0.06 0.00 0.00 0.00 0.00 47.33 45.70 3n5m h GLY 366 CO 1.03 1.15 0.08 -0.35 0.00 0.00 0.00 176.54 178.45 3n5m s ASP 367 N -7.22 -0.68 -0.12 0.19 2.15 -1.12 -4.99 116.67 104.89 3n5m s ASP 367 Ca -0.10 1.20 0.02 0.00 0.43 0.00 0.00 52.55 54.09 3n5m s ASP 367 Cb 0.06 1.19 0.01 0.00 -0.30 0.00 0.00 42.92 43.88 3n5m s ASP 367 CO 0.91 -0.31 -0.17 -0.63 -0.17 0.00 0.00 175.17 174.80 3n5m s ILE 368 N 0.03 1.69 0.10 4.11 1.01 -1.26 -0.21 121.20 126.67 3n5m s ILE 368 Ca -0.02 -0.76 -0.10 0.00 0.00 0.00 0.00 60.65 59.77 3n5m s ILE 368 Cb -0.04 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.91 3n5m s ILE 368 CO 0.03 0.48 0.23 0.00 0.00 0.00 0.00 174.94 175.67 3n5m s ARG 369 N 0.94 0.90 0.00 2.79 1.70 -0.67 -5.02 118.95 119.59 3n5m s ARG 369 Ca -0.07 -0.94 0.00 0.00 -0.47 0.00 0.00 55.73 54.25 3n5m s ARG 369 Cb -0.15 0.36 0.00 0.00 -0.57 0.00 0.00 34.95 34.59 3n5m s ARG 369 CO -0.02 -0.30 0.00 0.41 -1.08 0.00 0.00 175.30 174.31 3n5m n GLY 370 N -0.10 -0.48 3.45 3.88 0.00 -1.26 -0.26 105.19 110.42 3n5m n GLY 370 Ca -0.15 -1.06 -0.06 0.00 0.00 0.00 0.00 46.02 44.75 3n5m n GLY 370 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n5m s LYS 371 N -2.00 0.49 3.00 1.61 2.20 -0.62 -5.00 119.74 119.42 3n5m s LYS 371 Ca 0.00 1.15 0.00 0.00 -0.36 0.00 0.00 55.97 56.76 3n5m s LYS 371 Cb 0.00 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.71 3n5m s LYS 371 CO 0.00 -0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.20 3n5m n GLY 372 N 4.98 0.32 2.51 5.54 0.00 -1.10 -3.66 105.19 113.79 3n5m n GLY 372 Ca -0.15 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 3n5m n GLY 372 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n5m n LEU 373 N 0.00 7.96 -3.31 0.99 4.77 -0.77 -4.27 117.00 122.38 3n5m n LEU 373 Ca 0.00 -4.66 -0.09 0.00 -0.03 0.00 0.00 56.01 51.23 3n5m n LEU 373 Cb 0.00 -1.45 -0.06 0.00 -2.33 0.00 0.00 43.42 39.57 3n5m n LEU 373 CO 0.00 1.90 -0.06 -0.22 -1.33 0.00 0.00 177.39 177.68 3n5m s LEU 374 N -0.91 -0.76 -0.01 2.23 2.96 -1.24 -4.14 118.68 116.82 3n5m s LEU 374 Ca 0.56 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.24 3n5m s LEU 374 Cb 0.17 1.12 0.00 0.00 0.50 0.00 0.00 46.19 47.98 3n5m s LEU 374 CO -0.07 -0.34 -0.02 -0.69 -1.32 0.00 0.00 176.35 173.90 3n5m s VAL 375 N 2.55 0.23 -0.04 1.68 1.01 -0.30 -1.58 120.40 123.94 3n5m s VAL 375 Ca 0.11 -0.09 0.06 0.00 0.00 0.00 0.00 61.98 62.06 3n5m s VAL 375 Cb -0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 36.38 36.01 3n5m s VAL 375 CO -0.27 0.08 -0.23 -0.83 0.00 0.00 0.00 175.10 173.85 3n5m s GLY 376 N 0.15 1.17 -0.30 4.51 0.00 0.64 -0.70 107.32 112.79 3n5m s GLY 376 Ca -0.01 -0.98 -0.00 0.00 0.00 0.00 0.00 44.72 43.73 3n5m s GLY 376 CO -0.00 -0.69 -0.01 -0.42 0.00 0.00 0.00 173.10 171.98 3n5m s ILE 377 N -0.30 2.75 -0.27 0.90 1.09 -0.40 -1.68 121.20 123.28 3n5m s ILE 377 Ca 0.02 -1.59 -0.23 0.00 -1.10 0.00 0.00 60.65 57.76 3n5m s ILE 377 Cb -0.11 -2.65 -0.01 0.00 -1.06 0.00 0.00 42.46 38.62 3n5m s ILE 377 CO 0.01 -0.18 0.74 -0.70 -0.10 0.00 0.00 174.94 174.71 3n5m s GLU 378 N 1.18 4.06 -0.10 2.79 2.12 0.71 -1.59 118.70 127.87 3n5m s GLU 378 Ca -0.04 0.65 -0.11 0.00 0.36 0.00 0.00 54.97 55.83 3n5m s GLU 378 Cb -0.20 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.46 3n5m s GLU 378 CO -0.03 -0.55 0.26 -0.51 -0.54 0.00 0.00 175.26 173.89 3n5m s LEU 379 N 2.76 4.37 0.08 2.70 1.43 -0.60 -0.18 118.68 129.23 3n5m s LEU 379 Ca 0.31 0.61 0.03 0.00 -1.03 0.00 0.00 54.13 54.04 3n5m s LEU 379 Cb -0.15 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 3n5m s LEU 379 CO 0.10 0.29 -0.09 0.68 0.23 0.00 0.00 176.35 177.56 3n5m s VAL 380 N -0.58 0.83 0.08 -1.59 -7.23 0.28 -1.84 120.40 110.35 3n5m s VAL 380 Ca 0.17 -1.55 0.17 0.00 -1.81 0.00 0.00 61.98 58.97 3n5m s VAL 380 Cb -0.14 -1.24 0.10 0.00 0.56 0.00 0.00 36.38 35.67 3n5m s VAL 380 CO 0.06 -0.55 1.64 0.78 -0.31 0.00 0.00 175.10 176.72 3n5m h ASN 381 N 3.70 0.00 -2.76 4.85 2.35 -0.94 -3.41 115.58 119.38 3n5m h ASN 381 Ca -0.37 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.28 3n5m h ASN 381 Cb 1.19 0.00 -0.27 0.00 0.05 0.00 0.00 38.32 39.29 3n5m h ASN 381 CO 0.51 0.43 -0.35 -0.62 -1.65 0.00 0.00 177.43 175.76 3n5m s ASP 382 N -6.45 -0.32 0.47 5.81 2.15 -1.26 -4.95 116.67 112.12 3n5m s ASP 382 Ca 0.01 0.95 0.23 0.00 0.43 0.00 0.00 52.55 54.17 3n5m s ASP 382 Cb 0.10 1.14 1.16 0.00 -0.30 0.00 0.00 42.92 45.02 3n5m s ASP 382 CO 0.71 -0.22 1.96 0.11 -0.17 0.00 0.00 175.17 177.56 3n5m h LYS 383 N 7.83 0.00 0.04 4.34 1.57 -1.87 0.54 116.57 129.03 3n5m h LYS 383 Ca -0.22 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.46 3n5m h LYS 383 Cb 1.13 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.45 3n5m h LYS 383 CO 0.18 0.20 -0.39 0.93 -0.57 0.00 0.00 179.45 179.79 3n5m h GLU 384 N 0.00 0.19 0.00 3.15 4.39 -1.97 -3.35 114.58 116.99 3n5m h GLU 384 Ca -0.00 -0.26 -0.05 0.00 0.34 0.00 0.00 59.36 59.38 3n5m h GLU 384 Cb 0.50 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 3n5m h GLU 384 CO 0.03 1.06 -0.64 1.79 -1.16 0.00 0.00 179.01 180.09 3n5m h THR 385 N -0.55 0.28 -0.99 1.13 1.35 -1.99 -3.47 112.91 108.66 3n5m h THR 385 Ca -0.06 -1.45 -0.26 0.00 -0.55 0.00 0.00 66.41 64.09 3n5m h THR 385 Cb 1.23 1.96 -0.07 0.00 -1.73 0.00 0.00 68.15 69.54 3n5m h THR 385 CO 0.08 0.16 -0.26 0.29 -0.25 0.00 0.00 175.52 175.53 3n5m n LYS 386 N -2.98 -0.92 -1.95 4.72 5.02 0.18 -4.96 118.16 117.27 3n5m n LYS 386 Ca 0.00 0.84 -0.42 0.00 -2.02 0.00 0.00 58.31 56.71 3n5m n LYS 386 Cb 0.63 -4.93 -0.03 0.00 -0.02 0.00 0.00 35.03 30.69 3n5m n LYS 386 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3n5m s GLU 387 N -3.58 4.21 0.39 1.97 2.12 -1.23 -4.91 118.70 117.68 3n5m s GLU 387 Ca 0.00 2.32 -0.26 0.00 0.36 0.00 0.00 54.97 57.39 3n5m s GLU 387 Cb 0.00 -3.45 -0.11 0.00 0.26 0.00 0.00 34.13 30.83 3n5m s GLU 387 CO 0.00 -0.68 1.18 -2.30 -0.54 0.00 0.00 175.26 172.92 3n5m n PRO 388 N 5.03 1.75 -1.06 4.30 -0.02 -1.26 -0.47 135.00 143.26 3n5m n PRO 388 Ca 0.15 0.62 -0.31 0.00 -2.02 0.00 0.00 63.50 61.94 3n5m n PRO 388 Cb 0.40 -2.22 0.12 0.00 -0.02 0.00 0.00 33.50 31.78 3n5m n PRO 388 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3n5m s ILE 389 N -1.18 2.85 0.46 4.25 2.07 -0.77 -4.20 121.20 124.68 3n5m s ILE 389 Ca 0.60 0.28 -0.25 0.00 -1.41 0.00 0.00 60.65 59.87 3n5m s ILE 389 Cb -0.55 -2.60 -0.08 0.00 0.13 0.00 0.00 42.46 39.36 3n5m s ILE 389 CO 0.59 -0.36 1.39 -1.81 -1.91 0.00 0.00 174.94 172.84 3n5m s ASP 390 N -3.10 5.88 0.30 4.50 1.01 -1.26 -4.79 116.67 119.20 3n5m s ASP 390 Ca 0.63 2.84 0.02 0.00 0.71 0.00 0.00 52.55 56.75 3n5m s ASP 390 Cb -0.19 -2.65 0.56 0.00 1.01 0.00 0.00 42.92 41.65 3n5m s ASP 390 CO 0.56 -1.16 1.88 0.78 0.21 0.00 0.00 175.17 177.44 3n5m h ASN 391 N 2.27 0.90 -0.39 0.27 2.35 -1.94 -1.97 115.58 117.07 3n5m h ASN 391 Ca -0.51 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.24 3n5m h ASN 391 Cb 1.27 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 39.45 3n5m h ASN 391 CO 0.61 0.53 0.15 0.44 -1.65 0.00 0.00 177.43 177.51 3n5m h ASP 392 N 1.00 0.59 -0.00 5.81 3.32 -1.98 -1.08 116.42 124.08 3n5m h ASP 392 Ca 0.44 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.41 3n5m h ASP 392 Cb 0.36 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3n5m h ASP 392 CO -0.20 0.56 -0.01 0.11 -1.72 0.00 0.00 179.24 177.99 3n5m h LYS 393 N 0.64 0.01 -0.40 3.56 1.57 -1.73 -1.45 116.57 118.77 3n5m h LYS 393 Ca 0.15 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.83 3n5m h LYS 393 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 3n5m h LYS 393 CO -0.01 0.57 -0.14 0.97 -0.57 0.00 0.00 179.45 180.27 3n5m h ILE 394 N -0.55 1.26 -0.76 1.86 2.10 -1.50 -2.69 117.51 117.23 3n5m h ILE 394 Ca 0.00 -1.19 -0.03 0.00 1.08 0.00 0.00 64.86 64.71 3n5m h ILE 394 Cb 0.57 1.10 -0.03 0.00 -1.09 0.00 0.00 36.82 37.37 3n5m h ILE 394 CO 0.00 0.40 0.34 0.00 -1.08 0.00 0.00 178.15 177.81 3n5m h ALA 395 N 1.18 1.16 -0.16 0.18 0.00 -1.17 -1.61 119.26 118.84 3n5m h ALA 395 Ca 0.11 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3n5m h ALA 395 Cb 0.61 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3n5m h ALA 395 CO 0.04 0.62 -0.22 0.66 0.00 0.00 0.00 179.25 180.36 3n5m h SER 396 N 1.09 0.27 -0.29 0.00 4.64 -1.00 -1.39 113.55 116.88 3n5m h SER 396 Ca 0.26 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.43 3n5m h SER 396 Cb 0.15 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 3n5m h SER 396 CO -0.03 0.51 -0.12 0.58 -0.87 0.00 0.00 176.83 176.90 3n5m h VAL 397 N 0.26 1.29 -0.66 0.95 2.07 -1.08 -0.37 116.25 118.71 3n5m h VAL 397 Ca 0.04 -1.20 0.01 0.00 0.82 0.00 0.00 66.70 66.37 3n5m h VAL 397 Cb 0.53 1.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 3n5m h VAL 397 CO 0.04 0.38 0.44 0.58 0.02 0.00 0.00 177.57 179.03 3n5m h VAL 398 N 0.34 1.17 -0.28 2.57 2.07 -1.08 -1.92 116.25 119.12 3n5m h VAL 398 Ca 0.07 -0.31 -0.16 0.00 0.82 0.00 0.00 66.70 67.13 3n5m h VAL 398 Cb 0.63 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 3n5m h VAL 398 CO 0.04 0.16 -0.45 0.78 0.02 0.00 0.00 177.57 178.12 3n5m h ASN 399 N 0.89 0.79 -0.67 0.57 2.35 -1.20 -2.41 115.58 115.90 3n5m h ASN 399 Ca 0.24 -0.38 -0.04 0.00 -0.55 0.00 0.00 56.30 55.58 3n5m h ASN 399 Cb -0.10 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.02 3n5m h ASN 399 CO -0.05 1.12 0.28 0.00 -1.65 0.00 0.00 177.43 177.12 3n5m h ALA 400 N 0.91 0.88 -0.54 -0.83 0.00 -0.94 -2.18 119.26 116.55 3n5m h ALA 400 Ca 0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3n5m h ALA 400 Cb 1.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3n5m h ALA 400 CO 0.10 0.49 0.22 0.00 0.00 0.00 0.00 179.25 180.05 3n5m h LYS 402 N 0.73 1.17 -0.55 0.00 3.64 -0.92 0.55 116.57 121.19 3n5m h LYS 402 Ca 0.18 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3n5m h LYS 402 Cb 0.19 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3n5m h LYS 402 CO -0.02 0.88 0.32 0.93 -2.27 0.00 0.00 179.45 179.30 3n5m h GLU 403 N 1.17 0.74 -0.55 1.90 4.39 -1.24 -1.85 114.58 119.13 3n5m h GLU 403 Ca 0.29 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.92 3n5m h GLU 403 Cb 0.08 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 3n5m h GLU 403 CO -0.04 0.53 0.00 1.63 -1.16 0.00 0.00 179.01 179.97 3n5m n LYS 404 N -4.42 2.44 -1.95 2.33 4.76 -0.37 -4.91 118.16 116.04 3n5m n LYS 404 Ca 0.05 -1.61 -0.07 0.00 -2.87 0.00 0.00 58.31 53.81 3n5m n LYS 404 Cb 0.08 -1.56 -0.01 0.00 -1.84 0.00 0.00 35.03 31.70 3n5m n LYS 404 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3n5m n GLY 405 N 0.85 0.24 3.28 0.72 0.00 -0.70 -5.00 105.19 104.59 3n5m n GLY 405 Ca 0.15 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 3n5m n GLY 405 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3n5m s LEU 406 N -1.95 2.34 -0.36 0.99 2.96 0.04 -0.47 118.68 122.23 3n5m s LEU 406 Ca 0.00 -0.47 -0.19 0.00 -0.22 0.00 0.00 54.13 53.25 3n5m s LEU 406 Cb 0.00 -1.50 0.00 0.00 0.50 0.00 0.00 46.19 45.20 3n5m s LEU 406 CO 0.00 0.15 0.55 -0.63 -1.32 0.00 0.00 176.35 175.10 3n5m s ILE 407 N 0.40 4.98 0.11 6.68 1.01 0.11 -2.17 121.20 132.31 3n5m s ILE 407 Ca -0.15 0.34 0.10 0.00 0.00 0.00 0.00 60.65 60.95 3n5m s ILE 407 Cb -0.17 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 3n5m s ILE 407 CO 0.07 -0.28 -0.26 -0.51 0.00 0.00 0.00 174.94 173.96 3n5m s ILE 408 N 2.48 2.31 0.52 2.92 2.07 -1.26 -1.05 121.20 129.19 3n5m s ILE 408 Ca 0.20 -1.63 0.07 0.00 -1.41 0.00 0.00 60.65 57.89 3n5m s ILE 408 Cb -0.15 -1.99 0.05 0.00 0.13 0.00 0.00 42.46 40.50 3n5m s ILE 408 CO 0.14 0.17 0.72 -0.83 -1.91 0.00 0.00 174.94 173.23 3n5m s GLY 409 N -1.85 1.83 -0.08 1.50 0.00 -0.26 -4.93 107.32 103.53 3n5m s GLY 409 Ca 0.14 -1.84 -0.19 0.00 0.00 0.00 0.00 44.72 42.83 3n5m s GLY 409 CO 0.05 -1.50 0.45 -1.60 0.00 0.00 0.00 173.10 170.50 3n5m s ARG 410 N -4.59 0.71 -1.32 2.90 3.52 -1.26 -0.37 118.95 118.54 3n5m s ARG 410 Ca 0.59 0.22 -0.08 0.00 -0.13 0.00 0.00 55.73 56.33 3n5m s ARG 410 Cb -0.08 0.33 -0.02 0.00 -1.56 0.00 0.00 34.95 33.62 3n5m s ARG 410 CO 0.37 -0.17 2.79 0.27 -0.81 0.00 0.00 175.30 177.75 3n5m n ASN 411 N 1.78 8.10 -3.80 -2.12 6.94 -0.43 -4.89 115.26 120.84 3n5m n ASN 411 Ca -0.18 -2.82 -0.40 0.00 -0.02 0.00 0.00 54.58 51.16 3n5m n ASN 411 Cb 0.56 -1.45 -0.07 0.00 -2.36 0.00 0.00 39.78 36.46 3n5m n ASN 411 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3n5m n GLY 412 N 2.63 1.87 0.00 4.83 0.00 -1.26 -4.51 105.19 108.75 3n5m n GLY 412 Ca 0.68 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3n5m n GLY 412 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3n5m n THR 414 N 6.57 0.00 -4.94 2.61 -2.24 -1.26 -5.07 114.28 109.95 3n5m n THR 414 Ca 0.48 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.98 3n5m n THR 414 Cb 0.42 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.48 3n5m n THR 414 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3n5m s THR 415 N 0.00 1.63 0.17 4.28 2.01 -1.26 -2.50 115.64 119.97 3n5m s THR 415 Ca 0.00 -0.79 -0.32 0.00 0.31 0.00 0.00 61.69 60.90 3n5m s THR 415 Cb 0.00 -1.42 -0.11 0.00 0.01 0.00 0.00 72.50 70.99 3n5m s THR 415 CO 0.00 0.46 1.63 0.00 -0.69 0.00 0.00 174.62 176.03 3n5m s ALA 416 N 0.32 3.83 0.00 7.40 0.00 -1.26 -1.71 121.76 130.34 3n5m s ALA 416 Ca -0.13 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.27 3n5m s ALA 416 Cb -0.15 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.31 3n5m s ALA 416 CO 0.05 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.36 3n5m n GLY 417 N 3.86 0.87 2.41 0.00 0.00 -1.26 -4.87 105.19 106.20 3n5m n GLY 417 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 3n5m n GLY 417 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3n5m n TYR 418 N -2.20 2.12 -0.58 1.61 4.02 -0.69 -4.68 117.16 116.76 3n5m n TYR 418 Ca 0.00 -2.29 -0.05 0.00 -0.01 0.00 0.00 57.90 55.55 3n5m n TYR 418 Cb 0.00 -0.28 0.24 0.00 -0.02 0.00 0.00 39.34 39.28 3n5m n TYR 418 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3n5m n ASN 419 N -0.61 4.21 -0.99 7.72 4.13 -1.25 -4.57 115.26 123.91 3n5m n ASN 419 Ca 0.27 -2.95 0.10 0.00 1.68 0.00 0.00 54.58 53.68 3n5m n ASN 419 Cb 0.87 -0.70 0.26 0.00 -1.54 0.00 0.00 39.78 38.68 3n5m n ASN 419 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 3n5m n ASN 420 N -0.06 2.90 -4.41 6.41 6.94 -1.26 -4.56 115.26 121.22 3n5m n ASN 420 Ca 0.32 -1.94 -0.36 0.00 -0.02 0.00 0.00 54.58 52.58 3n5m n ASN 420 Cb 1.17 -0.29 -0.13 0.00 -2.36 0.00 0.00 39.78 38.18 3n5m n ASN 420 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3n5m s ILE 421 N -1.42 3.96 0.33 1.53 1.01 -1.26 -1.56 121.20 123.78 3n5m s ILE 421 Ca 0.37 -0.30 -0.28 0.00 0.00 0.00 0.00 60.65 60.45 3n5m s ILE 421 Cb 0.20 -2.82 -0.09 0.00 0.01 0.00 0.00 42.46 39.75 3n5m s ILE 421 CO 0.28 0.39 1.14 -0.76 0.00 0.00 0.00 174.94 175.99 3n5m s LEU 422 N 1.39 4.41 -0.05 2.97 1.43 -0.62 -1.32 118.68 126.90 3n5m s LEU 422 Ca 0.05 2.33 0.04 0.00 -1.03 0.00 0.00 54.13 55.52 3n5m s LEU 422 Cb -0.15 -3.78 -0.00 0.00 0.03 0.00 0.00 46.19 42.29 3n5m s LEU 422 CO 0.01 -0.36 -0.18 0.42 0.23 0.00 0.00 176.35 176.48 3n5m s THR 423 N -1.27 1.49 -0.15 5.49 -4.23 0.50 -1.28 115.64 116.19 3n5m s THR 423 Ca 0.49 -0.74 0.01 0.00 -1.18 0.00 0.00 61.69 60.28 3n5m s THR 423 Cb -0.32 -1.29 0.01 0.00 1.34 0.00 0.00 72.50 72.24 3n5m s THR 423 CO 0.41 0.43 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.97 3n5m s LEU 424 N 0.12 2.29 -0.49 4.79 1.43 0.12 -1.10 118.68 125.84 3n5m s LEU 424 Ca -0.06 -0.55 0.05 0.00 -1.03 0.00 0.00 54.13 52.54 3n5m s LEU 424 Cb -0.13 -1.51 0.20 0.00 0.03 0.00 0.00 46.19 44.78 3n5m s LEU 424 CO 0.03 0.07 0.46 0.00 0.23 0.00 0.00 176.35 177.14 3n5m n ALA 425 N 4.15 3.01 -1.45 4.21 0.00 0.64 -1.15 120.51 129.92 3n5m n ALA 425 Ca -0.20 -3.65 -0.31 0.00 0.00 0.00 0.00 53.44 49.28 3n5m n ALA 425 Cb 0.51 -0.84 0.06 0.00 0.00 0.00 0.00 19.45 19.19 3n5m n ALA 425 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3n5m s PRO 426 N -0.82 2.69 0.52 0.00 0.04 -1.03 -2.26 135.00 134.14 3n5m s PRO 426 Ca 0.32 1.10 -0.22 0.00 0.04 0.00 0.00 61.00 62.24 3n5m s PRO 426 Cb 0.06 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.60 3n5m s PRO 426 CO -0.15 -1.30 1.31 -2.14 0.04 0.00 0.00 177.00 174.75 3n5m s PRO 427 N -4.82 3.30 0.00 0.56 0.02 -1.26 -4.81 135.00 127.99 3n5m s PRO 427 Ca 0.60 2.12 0.15 0.00 0.02 0.00 0.00 61.00 63.90 3n5m s PRO 427 Cb -0.16 -2.30 0.72 0.00 0.02 0.00 0.00 34.50 32.78 3n5m s PRO 427 CO 0.53 -1.02 1.46 1.28 -0.33 0.00 0.00 177.00 178.91 3n5m n LEU 428 N -0.88 0.00 -0.36 -5.54 4.77 0.49 -1.27 117.00 114.21 3n5m n LEU 428 Ca 0.09 0.39 0.14 0.00 -0.03 0.00 0.00 56.01 56.60 3n5m n LEU 428 Cb 0.46 -0.39 0.60 0.00 -2.33 0.00 0.00 43.42 41.76 3n5m n LEU 428 CO 0.52 -0.19 0.91 1.33 -1.33 0.00 0.00 177.39 178.63 3n5m n VAL 429 N -1.39 0.03 -1.69 4.08 0.24 -1.26 -4.52 118.33 113.82 3n5m n VAL 429 Ca 0.06 -0.20 -0.41 0.00 -2.04 0.00 0.00 64.34 61.75 3n5m n VAL 429 Cb 0.15 0.23 0.02 0.00 -1.47 0.00 0.00 33.84 32.76 3n5m n VAL 429 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3n5m n ILE 430 N -0.11 2.74 -3.64 1.34 3.06 -0.39 -4.99 119.36 117.37 3n5m n ILE 430 Ca 0.19 -0.50 -0.20 0.00 -2.50 0.00 0.00 62.75 59.75 3n5m n ILE 430 Cb 0.28 -1.52 -0.02 0.00 0.54 0.00 0.00 39.64 38.93 3n5m n ILE 430 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3n5m s SER 431 N -0.62 5.83 0.27 9.51 1.04 -1.26 -4.98 113.70 123.48 3n5m s SER 431 Ca 0.63 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.83 3n5m s SER 431 Cb -0.50 -1.25 0.53 0.00 0.10 0.00 0.00 66.02 64.90 3n5m s SER 431 CO 0.56 -0.35 1.81 0.28 0.98 0.00 0.00 173.24 176.53 3n5m h SER 432 N 1.04 0.80 -0.08 7.02 0.02 -1.99 -1.20 113.55 119.17 3n5m h SER 432 Ca -0.46 0.06 -0.15 0.00 -0.84 0.00 0.00 61.79 60.39 3n5m h SER 432 Cb 1.25 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 3n5m h SER 432 CO 0.55 0.41 -0.49 -0.08 -1.14 0.00 0.00 176.83 176.09 3n5m h GLU 433 N 0.88 0.64 -0.24 3.45 4.81 -1.99 -1.95 114.58 120.17 3n5m h GLU 433 Ca 0.48 -0.37 -0.12 0.00 -0.13 0.00 0.00 59.36 59.21 3n5m h GLU 433 Cb 0.52 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 3n5m h GLU 433 CO -0.29 0.98 -0.36 0.93 -0.73 0.00 0.00 179.01 179.54 3n5m h GLU 434 N 0.51 0.53 -0.94 1.92 5.08 -1.81 -2.05 114.58 117.83 3n5m h GLU 434 Ca 0.03 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 3n5m h GLU 434 Cb 1.03 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.23 3n5m h GLU 434 CO 0.10 0.82 0.62 0.82 -1.00 0.00 0.00 179.01 180.37 3n5m h ILE 435 N 0.45 1.24 -0.74 3.13 1.08 -1.02 0.40 117.51 122.06 3n5m h ILE 435 Ca 0.05 -0.44 -0.03 0.00 -0.39 0.00 0.00 64.86 64.05 3n5m h ILE 435 Cb 0.84 -0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 34.41 3n5m h ILE 435 CO 0.07 0.23 0.34 0.00 -0.69 0.00 0.00 178.15 178.10 3n5m h ALA 436 N 1.34 0.95 -0.34 1.87 0.00 -1.00 -0.66 119.26 121.43 3n5m h ALA 436 Ca 0.34 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3n5m h ALA 436 Cb -0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 3n5m h ALA 436 CO -0.07 0.53 0.21 0.35 0.00 0.00 0.00 179.25 180.26 3n5m h PHE 437 N 1.04 0.45 0.11 0.00 3.57 -0.68 0.16 116.94 121.59 3n5m h PHE 437 Ca 0.25 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.77 3n5m h PHE 437 Cb 0.14 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 3n5m h PHE 437 CO 0.01 0.32 -0.34 0.28 -2.23 0.00 0.00 178.31 176.35 3n5m h VAL 438 N 0.44 0.27 -0.42 1.41 2.07 -0.58 -0.40 116.25 119.04 3n5m h VAL 438 Ca 0.12 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.56 3n5m h VAL 438 Cb 0.00 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 3n5m h VAL 438 CO -0.02 0.00 -0.07 0.40 0.02 0.00 0.00 177.57 177.89 3n5m h ILE 439 N -0.57 1.27 -0.57 4.57 2.04 -1.03 -1.17 117.51 122.05 3n5m h ILE 439 Ca 0.03 -1.15 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 3n5m h ILE 439 Cb 0.60 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 3n5m h ILE 439 CO -0.21 0.39 0.34 1.23 0.00 0.00 0.00 178.15 179.90 3n5m h GLY 440 N 0.61 0.83 0.90 5.37 0.00 -0.59 0.18 103.07 110.37 3n5m h GLY 440 Ca 0.11 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 3n5m h GLY 440 CO 0.04 0.34 0.05 -0.84 0.00 0.00 0.00 176.54 176.12 3n5m h THR 441 N 0.77 1.24 -0.10 4.70 2.02 -0.89 -2.20 112.91 118.44 3n5m h THR 441 Ca 0.20 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.56 3n5m h THR 441 Cb -0.01 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 3n5m h THR 441 CO -0.04 0.27 0.06 0.25 0.37 0.00 0.00 175.52 176.43 3n5m h LEU 442 N 0.36 0.12 -0.56 2.58 5.85 -1.03 -1.09 115.31 121.55 3n5m h LEU 442 Ca 0.10 -0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.86 3n5m h LEU 442 Cb 0.35 -0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.26 3n5m h LEU 442 CO 0.01 0.15 0.05 0.50 -0.34 0.00 0.00 178.44 178.81 3n5m h LYS 443 N 0.08 0.17 -0.57 1.25 3.64 -0.57 -1.42 116.57 119.14 3n5m h LYS 443 Ca 0.03 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 3n5m h LYS 443 Cb 0.06 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3n5m h LYS 443 CO -0.01 0.11 0.29 1.15 -2.27 0.00 0.00 179.45 178.72 3n5m h THR 444 N 0.17 1.20 0.00 1.00 2.02 -1.21 -2.99 112.91 113.10 3n5m h THR 444 Ca 0.29 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 3n5m h THR 444 Cb 0.45 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3n5m h THR 444 CO -0.43 0.22 0.01 0.00 0.37 0.00 0.00 175.52 175.69 3n5m n ALA 445 N -2.32 2.06 0.00 6.16 0.00 -0.43 -4.14 120.51 121.84 3n5m n ALA 445 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3n5m n ALA 445 Cb 0.11 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 17.76 3n5m n ALA 445 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3n5m n GLU 447 N 1.94 0.00 0.00 0.00 1.02 -1.13 -4.39 120.64 118.08 3n5m n GLU 447 Ca 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.30 3n5m n GLU 447 Cb 0.11 0.00 0.78 0.00 -0.02 0.00 0.00 31.44 32.32 3n5m n GLU 447 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 3n5m n ARG 448 N 0.00 1.02 0.00 3.49 1.85 -1.26 -5.26 116.66 116.50 3n5m n ARG 448 Ca 0.00 -0.24 0.00 0.00 -1.00 0.00 0.00 57.85 56.61 3n5m n ARG 448 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 3n5m n ARG 448 CO 0.00 0.00 0.00 0.44 -0.01 0.00 0.00 177.63 178.06