#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2inf s PHE 7 N 0.00 3.77 -0.48 -1.42 5.36 -1.26 -4.90 117.98 119.05 2inf s PHE 7 Ca 0.00 1.68 -0.22 0.00 -0.96 0.00 0.00 56.93 57.43 2inf s PHE 7 Cb 0.00 -2.98 0.03 0.00 -0.34 0.00 0.00 43.02 39.73 2inf s PHE 7 CO 0.00 0.20 0.76 1.21 -1.46 0.00 0.00 175.22 175.93 2inf s ASN 8 N 0.09 6.35 0.00 6.13 3.04 0.74 -4.92 114.94 126.37 2inf s ASN 8 Ca 0.45 -0.34 0.24 0.00 0.04 0.00 0.00 52.86 53.25 2inf s ASN 8 Cb -0.22 -2.37 0.82 0.00 -1.54 0.00 0.00 41.25 37.94 2inf s ASN 8 CO 0.27 -0.94 1.60 -0.62 -3.04 0.00 0.00 177.10 174.37 2inf n GLU 9 N 6.68 1.79 -0.05 0.43 -0.58 -1.26 -4.30 120.64 123.33 2inf n GLU 9 Ca -0.00 -1.17 -0.08 0.00 -0.42 0.00 0.00 57.16 55.50 2inf n GLU 9 Cb 0.48 -1.44 -0.02 0.00 -0.57 0.00 0.00 31.44 29.89 2inf n GLU 9 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 2inf h THR 10 N 2.56 0.81 -0.33 2.62 2.02 -1.91 -2.31 112.91 116.37 2inf h THR 10 Ca 0.00 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.19 2inf h THR 10 Cb 0.55 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 2inf h THR 10 CO 0.00 0.01 0.14 0.15 0.37 0.00 0.00 175.52 176.18 2inf h PHE 11 N 0.05 0.25 -0.42 3.16 3.57 -1.82 -1.81 116.94 119.92 2inf h PHE 11 Ca 0.11 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 2inf h PHE 11 Cb 0.15 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2inf h PHE 11 CO -0.21 0.12 -0.11 -0.07 -2.23 0.00 0.00 178.31 175.82 2inf h LEU 12 N 0.29 0.74 -0.08 0.59 3.38 -1.84 -1.51 115.31 116.87 2inf h LEU 12 Ca 0.14 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2inf h LEU 12 Cb 0.09 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2inf h LEU 12 CO -0.13 0.87 -0.01 0.11 0.09 0.00 0.00 178.44 179.37 2inf h LYS 13 N 0.68 0.15 -0.58 1.13 1.57 -1.08 -1.13 116.57 117.32 2inf h LYS 13 Ca 0.12 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 2inf h LYS 13 Cb 0.57 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 2inf h LYS 13 CO 0.04 0.46 0.35 0.00 -0.57 0.00 0.00 179.45 179.72 2inf h ALA 14 N 0.69 0.74 -0.65 3.86 0.00 -1.29 0.31 119.26 122.92 2inf h ALA 14 Ca 0.02 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.00 2inf h ALA 14 Cb 0.40 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2inf h ALA 14 CO 0.01 0.07 0.43 0.00 0.00 0.00 0.00 179.25 179.76 2inf h ALA 15 N 1.25 1.84 -0.04 0.00 0.00 -1.21 0.29 119.26 121.39 2inf h ALA 15 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2inf h ALA 15 Cb 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2inf h ALA 15 CO -0.10 0.04 0.00 0.54 0.00 0.00 0.00 179.25 179.73 2inf n ARG 16 N -4.48 1.44 -2.72 0.00 1.74 -0.43 -4.76 116.66 107.45 2inf n ARG 16 Ca 0.10 -0.64 -0.15 0.00 -0.77 0.00 0.00 57.85 56.38 2inf n ARG 16 Cb 0.28 -1.45 0.02 0.00 -1.02 0.00 0.00 32.46 30.30 2inf n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2inf n GLY 17 N 1.08 -0.15 3.68 -0.13 0.00 0.09 -5.00 105.19 104.76 2inf n GLY 17 Ca 0.19 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 2inf n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2inf s GLU 18 N -5.25 2.47 0.31 1.61 2.02 0.98 -4.57 118.70 116.28 2inf s GLU 18 Ca 0.18 -1.00 -0.29 0.00 0.02 0.00 0.00 54.97 53.88 2inf s GLU 18 Cb -0.08 -2.44 -0.12 0.00 0.10 0.00 0.00 34.13 31.59 2inf s GLU 18 CO 0.23 0.49 1.37 1.63 0.02 0.00 0.00 175.26 178.99 2inf n LYS 19 N 0.12 2.21 -4.02 1.61 5.02 -1.26 -3.92 118.16 117.93 2inf n LYS 19 Ca -0.10 0.78 -0.09 0.00 -2.02 0.00 0.00 58.31 56.88 2inf n LYS 19 Cb 0.54 -2.42 -0.08 0.00 -0.02 0.00 0.00 35.03 33.05 2inf n LYS 19 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2inf s ALA 20 N -0.71 0.29 -0.40 7.82 0.00 -1.26 -4.89 121.76 122.62 2inf s ALA 20 Ca 0.59 -1.06 0.25 0.00 0.00 0.00 0.00 51.96 51.74 2inf s ALA 20 Cb -0.57 0.76 0.51 0.00 0.00 0.00 0.00 23.12 23.82 2inf s ALA 20 CO 0.58 -0.55 1.67 -0.44 0.00 0.00 0.00 175.76 177.02 2inf h ASP 21 N 2.73 0.00 -5.32 0.00 3.32 -1.97 -3.46 116.42 111.72 2inf h ASP 21 Ca -0.33 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.60 2inf h ASP 21 Cb 1.21 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.63 2inf h ASP 21 CO 0.54 0.00 -0.34 -1.38 -1.72 0.00 0.00 179.24 176.35 2inf s HIS 22 N -3.26 0.54 -0.09 4.55 -3.43 -1.26 -4.07 115.29 108.27 2inf s HIS 22 Ca 0.07 -0.88 -0.30 0.00 -0.80 0.00 0.00 55.06 53.15 2inf s HIS 22 Cb 0.06 -0.10 -0.02 0.00 -1.43 0.00 0.00 32.58 31.09 2inf s HIS 22 CO 0.64 -0.76 1.04 0.99 -2.00 0.00 0.00 174.74 174.65 2inf s THR 23 N -4.02 4.70 0.51 -5.38 2.01 -1.26 -4.98 115.64 107.22 2inf s THR 23 Ca 0.23 1.97 -0.17 0.00 0.31 0.00 0.00 61.69 64.03 2inf s THR 23 Cb 0.03 -4.26 -0.08 0.00 0.01 0.00 0.00 72.50 68.20 2inf s THR 23 CO 0.04 0.01 0.99 -2.16 -0.69 0.00 0.00 174.62 172.81 2inf s PRO 24 N 1.97 3.95 -0.05 4.92 0.04 -1.26 -4.62 135.00 139.96 2inf s PRO 24 Ca 0.50 0.96 -0.03 0.00 0.04 0.00 0.00 61.00 62.47 2inf s PRO 24 Cb -0.20 -2.14 0.02 0.00 0.04 0.00 0.00 34.50 32.23 2inf s PRO 24 CO 0.19 -0.27 0.11 0.08 0.04 0.00 0.00 177.00 177.16 2inf s VAL 25 N -2.61 -0.02 0.18 -0.36 1.01 -1.26 -1.42 120.40 115.91 2inf s VAL 25 Ca 0.59 0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.58 2inf s VAL 25 Cb -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2inf s VAL 25 CO 0.31 0.03 0.24 -1.66 0.00 0.00 0.00 175.10 174.02 2inf s TRP 26 N 0.52 0.62 -0.03 5.22 1.48 -1.15 -1.09 118.94 124.51 2inf s TRP 26 Ca -0.04 -0.96 0.07 0.00 -1.06 0.00 0.00 56.10 54.11 2inf s TRP 26 Cb -0.05 -0.19 -0.01 0.00 -1.16 0.00 0.00 33.47 32.05 2inf s TRP 26 CO -0.02 -0.70 -0.24 0.71 -4.06 0.00 0.00 176.95 172.63 2inf s TYR 27 N -4.02 2.22 0.11 1.66 1.51 -1.26 -4.23 117.35 113.33 2inf s TYR 27 Ca 0.23 -0.52 -0.31 0.00 -1.01 0.00 0.00 57.07 55.47 2inf s TYR 27 Cb 0.04 -1.44 -0.09 0.00 -0.11 0.00 0.00 41.96 40.36 2inf s TYR 27 CO 0.04 -0.10 1.70 -1.64 -1.11 0.00 0.00 175.55 174.44 2inf s MET 28 N -0.39 4.17 -0.94 -0.62 -1.94 -1.26 -1.52 119.30 116.80 2inf s MET 28 Ca 0.04 2.44 -0.02 0.00 -1.71 0.00 0.00 55.69 56.44 2inf s MET 28 Cb -0.11 -3.51 0.00 0.00 2.01 0.00 0.00 34.83 33.23 2inf s MET 28 CO 0.01 -0.75 0.26 0.54 -0.01 0.00 0.00 175.02 175.07 2inf n ARG 29 N 5.32 -2.37 0.21 2.03 1.74 -1.26 0.04 116.66 122.36 2inf n ARG 29 Ca 0.16 0.54 0.10 0.00 -0.77 0.00 0.00 57.85 57.88 2inf n ARG 29 Cb 0.39 -4.64 0.64 0.00 -1.02 0.00 0.00 32.46 27.83 2inf n ARG 29 CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 2inf h GLN 30 N -0.60 0.02 -4.84 5.56 3.07 -1.64 -3.35 115.11 113.33 2inf h GLN 30 Ca -0.30 -0.00 -0.66 0.00 0.09 0.00 0.00 58.65 57.77 2inf h GLN 30 Cb 1.21 -0.00 -0.21 0.00 0.08 0.00 0.00 27.48 28.55 2inf h GLN 30 CO 0.33 0.01 -0.56 0.00 0.09 0.00 0.00 178.83 178.70 2inf s ALA 31 N -5.08 3.30 0.00 0.06 0.00 -1.26 -4.69 121.76 114.10 2inf s ALA 31 Ca -0.05 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.64 2inf s ALA 31 Cb 0.17 -2.33 0.00 0.00 0.00 0.00 0.00 23.12 20.96 2inf s ALA 31 CO 0.68 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2inf n GLY 32 N 4.99 -0.74 0.00 0.00 0.00 -1.26 -5.00 105.19 103.17 2inf n GLY 32 Ca -0.14 -0.92 0.02 0.00 0.00 0.00 0.00 46.02 44.98 2inf n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2inf n ARG 33 N 0.00 0.07 0.11 1.61 1.74 -1.26 -1.46 116.66 117.47 2inf n ARG 33 Ca 0.00 0.23 -0.04 0.00 -0.77 0.00 0.00 57.85 57.27 2inf n ARG 33 Cb 0.00 -1.50 0.14 0.00 -1.02 0.00 0.00 32.46 30.08 2inf n ARG 33 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2inf h SER 34 N 0.00 0.16 -3.36 0.55 4.64 -1.83 -3.44 113.55 110.27 2inf h SER 34 Ca 0.00 -0.09 -0.58 0.00 -0.47 0.00 0.00 61.79 60.65 2inf h SER 34 Cb 0.04 -0.05 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 2inf h SER 34 CO 0.00 0.73 0.19 -1.10 -0.87 0.00 0.00 176.83 175.78 2inf s GLN 35 N -3.68 4.30 0.55 4.77 -0.21 -0.53 -4.53 119.66 120.33 2inf s GLN 35 Ca -0.03 0.81 0.24 0.00 0.02 0.00 0.00 55.36 56.40 2inf s GLN 35 Cb 0.12 -3.54 1.56 0.00 1.00 0.00 0.00 33.01 32.15 2inf s GLN 35 CO 0.78 -0.18 2.19 -1.00 -2.12 0.00 0.00 175.29 174.97 2inf h PRO 36 N 7.23 0.00 0.00 2.91 0.13 -1.87 -2.63 132.00 137.76 2inf h PRO 36 Ca -0.33 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.66 2inf h PRO 36 Cb 1.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2inf h PRO 36 CO 0.79 0.02 -0.63 1.05 -0.23 0.00 0.00 178.00 179.00 2inf h GLU 37 N 0.00 0.00 0.04 0.86 9.09 -1.94 -2.19 114.58 120.44 2inf h GLU 37 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 2inf h GLU 37 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 2inf h GLU 37 CO 0.00 0.63 -0.02 -0.92 0.05 0.00 0.00 179.01 178.76 2inf h TYR 38 N 0.00 -0.04 -0.90 2.06 3.20 -1.76 -1.54 116.97 117.99 2inf h TYR 38 Ca -0.01 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 2inf h TYR 38 Cb 1.36 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.60 2inf h TYR 38 CO 0.00 0.23 0.54 0.00 -1.64 0.00 0.00 178.16 177.29 2inf h ARG 39 N -0.32 1.22 0.01 1.82 3.08 -1.46 0.11 114.38 118.85 2inf h ARG 39 Ca -0.00 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 2inf h ARG 39 Cb 0.30 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2inf h ARG 39 CO 0.01 0.85 -0.01 0.87 -1.07 0.00 0.00 179.97 180.62 2inf h LYS 40 N 1.24 -0.02 -0.26 0.04 1.57 -1.41 -1.54 116.57 116.18 2inf h LYS 40 Ca 0.32 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.16 2inf h LYS 40 Cb -0.05 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 2inf h LYS 40 CO -0.06 0.32 -0.06 1.25 -0.57 0.00 0.00 179.45 180.33 2inf h LEU 41 N -0.36 -0.24 -0.51 2.94 5.85 -0.95 -0.30 115.31 121.75 2inf h LEU 41 Ca -0.00 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.87 2inf h LEU 41 Cb 0.35 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 2inf h LEU 41 CO 0.00 -0.08 0.17 0.50 -0.34 0.00 0.00 178.44 178.69 2inf h LYS 42 N 0.00 0.33 -0.54 1.25 3.64 -0.80 0.30 116.57 120.76 2inf h LYS 42 Ca 0.13 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 2inf h LYS 42 Cb 0.19 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2inf h LYS 42 CO -0.27 0.22 0.17 0.93 -2.27 0.00 0.00 179.45 178.23 2inf h GLU 43 N 0.34 0.83 -0.03 1.90 5.08 -0.99 0.29 114.58 122.00 2inf h GLU 43 Ca 0.25 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2inf h GLU 43 Cb 0.28 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2inf h GLU 43 CO -0.26 0.76 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.24 2inf h LYS 44 N 0.74 0.08 0.00 2.33 3.64 -0.64 -3.37 116.57 119.35 2inf h LYS 44 Ca 0.17 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2inf h LYS 44 Cb 0.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2inf h LYS 44 CO -0.01 0.59 -1.76 0.66 -2.27 0.00 0.00 179.45 176.67 2inf n TYR 45 N -4.76 0.08 0.00 1.91 4.02 0.10 -5.09 117.16 113.42 2inf n TYR 45 Ca -0.08 0.02 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 2inf n TYR 45 Cb 0.30 -0.47 0.00 0.00 -0.02 0.00 0.00 39.34 39.15 2inf n TYR 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2inf n GLY 46 N 1.29 -0.74 0.23 2.72 0.00 0.10 -4.40 105.19 104.39 2inf n GLY 46 Ca -0.02 -1.51 0.07 0.00 0.00 0.00 0.00 46.02 44.55 2inf n GLY 46 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2inf h LEU 47 N 0.00 0.00 0.11 0.99 7.12 -1.94 -2.58 115.31 119.01 2inf h LEU 47 Ca 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 2inf h LEU 47 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 2inf h LEU 47 CO 0.00 0.19 -0.05 0.15 -0.13 0.00 0.00 178.44 178.60 2inf h PHE 48 N 0.00 -0.13 -1.39 1.25 3.57 -1.95 -2.43 116.94 115.86 2inf h PHE 48 Ca -0.00 -0.00 0.40 0.00 3.53 0.00 0.00 57.97 61.90 2inf h PHE 48 Cb 0.38 0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 2inf h PHE 48 CO 0.00 -0.08 0.99 0.93 -2.23 0.00 0.00 178.31 177.92 2inf h GLU 49 N -0.20 0.01 0.00 1.11 4.39 -1.76 -0.17 114.58 117.96 2inf h GLU 49 Ca -0.01 -0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.54 2inf h GLU 49 Cb 0.11 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 2inf h GLU 49 CO 0.02 0.01 -0.67 0.97 -1.16 0.00 0.00 179.01 178.18 2inf h ILE 50 N 0.02 1.19 -0.55 3.13 6.09 -1.42 0.52 117.51 126.49 2inf h ILE 50 Ca 0.67 -2.58 0.00 0.00 -1.37 0.00 0.00 64.86 61.58 2inf h ILE 50 Cb 2.63 2.52 0.00 0.00 0.47 0.00 0.00 36.82 42.44 2inf h ILE 50 CO -0.03 0.66 0.00 0.35 -3.07 0.00 0.00 178.15 176.06 2inf n THR 51 N -3.32 0.99 0.00 2.19 -2.24 -0.34 -3.97 114.28 107.59 2inf n THR 51 Ca 0.01 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 2inf n THR 51 Cb 0.78 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 2inf n THR 51 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2inf n HIS 52 N 1.13 0.00 -3.02 4.78 8.25 -0.22 -4.78 115.22 121.37 2inf n HIS 52 Ca 0.19 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.23 2inf n HIS 52 Cb 0.53 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.59 2inf n HIS 52 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2inf s GLN 53 N -1.17 3.87 0.35 -0.41 2.00 0.18 -4.83 119.66 119.65 2inf s GLN 53 Ca 0.00 0.39 0.09 0.00 -2.00 0.00 0.00 55.36 53.83 2inf s GLN 53 Cb 0.00 -3.75 0.81 0.00 0.80 0.00 0.00 33.01 30.87 2inf s GLN 53 CO 0.00 -0.68 1.86 -1.35 -0.50 0.00 0.00 175.29 174.62 2inf h PRO 54 N 8.25 0.68 -0.37 1.67 0.11 -1.85 -0.25 132.00 140.23 2inf h PRO 54 Ca -0.25 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 2inf h PRO 54 Cb 1.10 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 2inf h PRO 54 CO 0.86 0.45 -0.13 0.93 -0.21 0.00 0.00 178.00 179.90 2inf h GLU 55 N 0.70 0.65 0.22 1.05 4.39 -1.94 -1.95 114.58 117.70 2inf h GLU 55 Ca 0.45 -0.21 -0.35 0.00 0.34 0.00 0.00 59.36 59.60 2inf h GLU 55 Cb 0.73 -0.06 0.02 0.00 -0.10 0.00 0.00 28.75 29.34 2inf h GLU 55 CO -0.21 0.76 -1.63 -0.07 -1.16 0.00 0.00 179.01 176.70 2inf h LEU 56 N 0.60 0.72 -1.01 1.33 3.38 -1.66 -3.04 115.31 115.63 2inf h LEU 56 Ca 0.10 -0.92 0.06 0.00 0.09 0.00 0.00 57.88 57.21 2inf h LEU 56 Cb 0.57 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 2inf h LEU 56 CO 0.04 1.75 0.66 0.00 0.09 0.00 0.00 178.44 180.97 2inf h ALA 58 N 1.44 0.51 -0.40 0.00 0.00 -1.43 -0.26 119.26 119.12 2inf h ALA 58 Ca 0.42 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2inf h ALA 58 Cb 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2inf h ALA 58 CO -0.16 0.43 -0.00 -0.92 0.00 0.00 0.00 179.25 178.60 2inf h TYR 59 N 0.54 0.77 -0.82 0.00 3.20 -1.39 -1.13 116.97 118.13 2inf h TYR 59 Ca 0.08 -0.14 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 2inf h TYR 59 Cb 0.70 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.73 2inf h TYR 59 CO 0.06 0.79 0.49 0.28 -1.64 0.00 0.00 178.16 178.13 2inf h VAL 60 N 0.53 1.23 -0.36 1.81 2.07 -1.28 -1.64 116.25 118.62 2inf h VAL 60 Ca 0.11 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 2inf h VAL 60 Cb 0.48 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 2inf h VAL 60 CO 0.02 0.25 0.15 0.74 0.02 0.00 0.00 177.57 178.74 2inf h THR 61 N 1.13 1.19 0.00 2.57 2.02 -0.77 -3.29 112.91 115.76 2inf h THR 61 Ca 0.29 -0.57 -0.12 0.00 0.77 0.00 0.00 66.41 66.79 2inf h THR 61 Cb -0.03 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2inf h THR 61 CO -0.05 0.20 -0.67 0.08 0.37 0.00 0.00 175.52 175.45 2inf h ARG 62 N 0.43 0.00 -0.78 6.66 0.11 -1.08 -3.38 114.38 116.35 2inf h ARG 62 Ca 0.12 0.00 0.13 0.00 0.10 0.00 0.00 59.98 60.33 2inf h ARG 62 Cb 0.18 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 31.13 2inf h ARG 62 CO -0.01 0.48 -0.37 -0.07 0.10 0.00 0.00 179.97 180.10 2inf h LEU 63 N 0.00 -1.31 -1.26 0.08 3.38 -1.37 0.71 115.31 115.53 2inf h LEU 63 Ca -0.03 0.27 0.14 0.00 0.09 0.00 0.00 57.88 58.34 2inf h LEU 63 Cb 1.43 0.67 -0.07 0.00 0.09 0.00 0.00 40.66 42.77 2inf h LEU 63 CO 0.06 -0.30 0.58 -0.65 0.09 0.00 0.00 178.44 178.22 2inf h PRO 64 N -0.09 0.70 -0.25 1.13 0.11 -1.78 -0.61 132.00 131.21 2inf h PRO 64 Ca 0.28 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.28 2inf h PRO 64 Cb 0.57 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 2inf h PRO 64 CO -0.82 0.47 -0.11 0.28 -0.21 0.00 0.00 178.00 177.61 2inf h VAL 65 N 0.73 1.30 -0.25 3.15 2.07 -1.14 0.25 116.25 122.36 2inf h VAL 65 Ca 0.45 -1.17 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 2inf h VAL 65 Cb 0.67 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2inf h VAL 65 CO -0.21 0.37 -0.13 -0.33 0.02 0.00 0.00 177.57 177.29 2inf h GLU 66 N 0.25 0.41 0.11 1.57 5.08 -0.89 -0.81 114.58 120.30 2inf h GLU 66 Ca 0.06 -0.11 -0.34 0.00 -1.00 0.00 0.00 59.36 57.97 2inf h GLU 66 Cb 0.61 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2inf h GLU 66 CO 0.03 0.54 -1.80 1.96 -1.00 0.00 0.00 179.01 178.74 2inf h GLN 67 N 0.38 0.24 0.00 2.33 4.20 -0.95 -3.40 115.11 117.91 2inf h GLN 67 Ca 0.07 -0.40 -0.25 0.00 0.06 0.00 0.00 58.65 58.13 2inf h GLN 67 Cb 0.46 0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.34 2inf h GLN 67 CO 0.03 1.08 -2.07 0.66 -0.67 0.00 0.00 178.83 177.85 2inf n TYR 68 N -3.42 0.00 -1.86 2.96 0.53 0.87 -4.82 117.16 111.42 2inf n TYR 68 Ca -0.25 0.00 -0.01 0.00 -1.02 0.00 0.00 57.90 56.63 2inf n TYR 68 Cb 1.05 -0.75 -0.00 0.00 -1.03 0.00 0.00 39.34 38.62 2inf n TYR 68 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2inf n GLY 69 N 1.91 0.35 3.73 2.72 0.00 -0.31 -4.66 105.19 108.95 2inf n GLY 69 Ca -0.23 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.56 2inf n GLY 69 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2inf s VAL 70 N -2.03 2.56 -2.07 1.61 -7.23 -1.25 -4.94 120.40 107.05 2inf s VAL 70 Ca 0.00 0.27 0.29 0.00 -1.81 0.00 0.00 61.98 60.73 2inf s VAL 70 Cb 0.00 -2.80 0.63 0.00 0.56 0.00 0.00 36.38 34.77 2inf s VAL 70 CO 0.00 -0.16 1.93 0.47 -0.31 0.00 0.00 175.10 177.04 2inf n ASP 71 N -2.69 0.70 -3.67 4.85 8.00 -0.25 -4.85 116.55 118.63 2inf n ASP 71 Ca 0.12 -1.05 -0.15 0.00 0.71 0.00 0.00 54.79 54.43 2inf n ASP 71 Cb 0.51 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.51 2inf n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2inf s ALA 72 N -2.15 -1.28 -0.11 2.24 0.00 -1.26 -4.18 121.76 115.03 2inf s ALA 72 Ca 0.38 1.14 -0.06 0.00 0.00 0.00 0.00 51.96 53.42 2inf s ALA 72 Cb 0.21 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 2inf s ALA 72 CO 0.39 -0.28 0.12 0.00 0.00 0.00 0.00 175.76 175.99 2inf s ALA 73 N -0.49 3.80 -0.20 0.00 0.00 -0.77 -4.82 121.76 119.28 2inf s ALA 73 Ca -0.06 -0.67 -0.05 0.00 0.00 0.00 0.00 51.96 51.18 2inf s ALA 73 Cb -0.03 -1.90 -0.02 0.00 0.00 0.00 0.00 23.12 21.17 2inf s ALA 73 CO 0.04 0.62 -0.00 -1.50 0.00 0.00 0.00 175.76 174.92 2inf s ILE 74 N -1.02 3.94 0.09 0.00 1.10 -1.26 -0.16 121.20 123.88 2inf s ILE 74 Ca 0.15 -0.32 -0.32 0.00 -0.51 0.00 0.00 60.65 59.65 2inf s ILE 74 Cb -0.12 -2.78 -0.11 0.00 0.15 0.00 0.00 42.46 39.60 2inf s ILE 74 CO 0.04 0.43 1.81 -0.11 -2.11 0.00 0.00 174.94 175.00 2inf n LEU 75 N 4.27 3.78 -4.64 8.50 7.94 -0.09 -4.84 117.00 131.92 2inf n LEU 75 Ca -0.17 1.00 -0.43 0.00 -1.11 0.00 0.00 56.01 55.30 2inf n LEU 75 Cb 0.52 -1.49 -0.03 0.00 0.53 0.00 0.00 43.42 42.95 2inf n LEU 75 CO 0.31 0.06 0.82 -0.47 -1.11 0.00 0.00 177.39 177.00 2inf s TYR 76 N 2.76 3.26 0.27 1.96 5.04 -1.26 -4.89 117.35 124.48 2inf s TYR 76 Ca 0.84 1.22 -0.20 0.00 -2.44 0.00 0.00 57.07 56.49 2inf s TYR 76 Cb -0.55 -3.33 0.06 0.00 0.35 0.00 0.00 41.96 38.49 2inf s TYR 76 CO 0.40 -0.55 0.91 -1.59 -1.34 0.00 0.00 175.55 173.38 2inf s LYS 77 N 3.20 1.69 0.17 4.97 -2.85 -1.26 -4.96 119.74 120.71 2inf s LYS 77 Ca 0.41 -1.06 -0.24 0.00 -1.00 0.00 0.00 55.97 54.07 2inf s LYS 77 Cb -0.14 0.49 -0.08 0.00 -2.06 0.00 0.00 37.83 36.04 2inf s LYS 77 CO 0.10 -0.79 0.76 0.34 0.10 0.00 0.00 175.35 175.86 2inf s ASP 78 N -3.18 7.32 0.58 0.03 2.15 -1.26 -4.95 116.67 117.37 2inf s ASP 78 Ca 0.17 1.59 0.28 0.00 0.43 0.00 0.00 52.55 55.03 2inf s ASP 78 Cb -0.04 -2.48 1.58 0.00 -0.30 0.00 0.00 42.92 41.68 2inf s ASP 78 CO 0.07 0.19 2.03 -0.29 -0.17 0.00 0.00 175.17 177.00 2inf h ILE 79 N 3.25 0.46 -0.14 4.11 2.10 -2.00 -2.05 117.51 123.24 2inf h ILE 79 Ca -0.47 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.47 2inf h ILE 79 Cb 1.20 0.77 0.00 0.00 -1.09 0.00 0.00 36.82 37.70 2inf h ILE 79 CO 0.66 0.00 0.00 0.23 -1.08 0.00 0.00 178.15 177.96 2inf n MET 80 N -3.82 2.02 -0.32 2.19 2.81 -1.26 -4.42 117.12 114.31 2inf n MET 80 Ca 0.04 -1.50 0.08 0.00 -1.81 0.00 0.00 57.70 54.51 2inf n MET 80 Cb 0.44 -1.46 0.18 0.00 -0.71 0.00 0.00 33.22 31.68 2inf n MET 80 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2inf h THR 81 N 3.32 0.10 -0.00 2.03 2.02 -1.77 -1.53 112.91 117.08 2inf h THR 81 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2inf h THR 81 Cb 0.72 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2inf h THR 81 CO 0.00 0.00 -0.04 -0.81 0.37 0.00 0.00 175.52 175.05 2inf n PRO 82 N -5.52 0.25 -0.06 6.66 -0.04 -1.26 -4.31 135.00 130.73 2inf n PRO 82 Ca 0.17 -0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.50 2inf n PRO 82 Cb 0.56 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.47 2inf n PRO 82 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2inf h LEU 83 N 0.05 0.28 -1.96 1.53 3.38 -1.61 -2.87 115.31 114.12 2inf h LEU 83 Ca 0.00 -0.25 0.20 0.00 0.09 0.00 0.00 57.88 57.92 2inf h LEU 83 Cb 0.39 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2inf h LEU 83 CO 0.00 0.46 0.51 -0.65 0.09 0.00 0.00 178.44 178.86 2inf h PRO 84 N 0.09 0.04 -0.15 1.13 0.11 -1.71 -1.57 132.00 129.94 2inf h PRO 84 Ca 0.06 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 2inf h PRO 84 Cb 0.30 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 2inf h PRO 84 CO 0.00 0.02 0.07 0.77 -0.21 0.00 0.00 178.00 178.66 2inf h SER 85 N 0.04 0.18 -0.64 -2.05 0.02 -1.78 -1.85 113.55 107.46 2inf h SER 85 Ca 0.34 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2inf h SER 85 Cb 1.32 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2inf h SER 85 CO -0.02 0.16 0.00 2.30 -1.14 0.00 0.00 176.83 178.13 2inf n ILE 86 N -4.48 1.05 -0.06 3.27 -5.35 -0.62 -4.42 119.36 108.75 2inf n ILE 86 Ca -0.01 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 61.56 2inf n ILE 86 Cb 0.10 0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.35 2inf n ILE 86 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2inf n GLY 87 N 1.42 0.97 3.62 3.28 0.00 -0.70 0.43 105.19 114.21 2inf n GLY 87 Ca 0.22 -0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 2inf n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2inf s VAL 88 N -2.00 5.29 -0.89 1.61 0.11 -1.02 -4.99 120.40 118.52 2inf s VAL 88 Ca 0.00 0.28 -0.25 0.00 -2.93 0.00 0.00 61.98 59.09 2inf s VAL 88 Cb 0.00 -3.56 -0.00 0.00 -1.53 0.00 0.00 36.38 31.28 2inf s VAL 88 CO 0.00 0.26 1.68 -0.62 -3.33 0.00 0.00 175.10 173.09 2inf s ASP 89 N 1.49 5.76 0.06 3.54 2.15 -1.26 -2.78 116.67 125.62 2inf s ASP 89 Ca 0.09 -0.79 -0.25 0.00 0.43 0.00 0.00 52.55 52.03 2inf s ASP 89 Cb -0.15 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.85 2inf s ASP 89 CO 0.09 -2.15 0.76 0.68 -0.17 0.00 0.00 175.17 174.38 2inf s VAL 90 N 7.64 4.69 -0.18 1.11 -7.23 -1.26 -3.79 120.40 121.38 2inf s VAL 90 Ca 0.57 1.63 -0.02 0.00 -1.81 0.00 0.00 61.98 62.35 2inf s VAL 90 Cb -0.05 -4.11 0.05 0.00 0.56 0.00 0.00 36.38 32.83 2inf s VAL 90 CO 0.01 0.39 0.01 -0.70 -0.31 0.00 0.00 175.10 174.50 2inf s GLU 91 N -0.20 0.81 -0.68 4.82 2.12 0.69 -4.85 118.70 121.42 2inf s GLU 91 Ca 0.38 -0.40 -0.27 0.00 0.36 0.00 0.00 54.97 55.04 2inf s GLU 91 Cb -0.21 -1.97 0.02 0.00 0.26 0.00 0.00 34.13 32.24 2inf s GLU 91 CO 0.23 -0.56 1.36 0.42 -0.54 0.00 0.00 175.26 176.17 2inf s ILE 92 N 1.82 3.72 0.00 -3.70 1.01 -1.25 0.70 121.20 123.49 2inf s ILE 92 Ca -0.00 0.47 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2inf s ILE 92 Cb -0.16 -4.71 0.00 0.00 0.01 0.00 0.00 42.46 37.59 2inf s ILE 92 CO -0.07 -1.59 0.00 0.29 0.00 0.00 0.00 174.94 173.56 2inf n LYS 93 N 9.16 1.95 0.00 2.79 5.02 -0.67 -4.89 118.16 131.52 2inf n LYS 93 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2inf n LYS 93 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 2inf n LYS 93 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2inf n ASN 94 N -1.28 0.00 0.10 4.39 6.94 -1.26 -4.56 115.26 119.59 2inf n ASN 94 Ca 0.00 0.03 -0.07 0.00 -0.02 0.00 0.00 54.58 54.52 2inf n ASN 94 Cb 0.00 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.38 2inf n ASN 94 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 2inf h GLY 95 N 0.00 -1.01 -1.98 4.83 0.00 -2.03 -3.43 103.07 99.45 2inf h GLY 95 Ca 0.00 0.46 -0.49 0.00 0.00 0.00 0.00 47.33 47.30 2inf h GLY 95 CO 0.00 -0.33 0.15 -0.26 0.00 0.00 0.00 176.54 176.10 2inf s ILE 96 N -4.12 4.87 0.00 2.60 -0.00 -1.26 -5.11 121.20 118.19 2inf s ILE 96 Ca -0.07 0.32 0.00 0.00 -0.00 0.00 0.00 60.65 60.90 2inf s ILE 96 Cb 0.02 -3.85 0.00 0.00 -0.00 0.00 0.00 42.46 38.62 2inf s ILE 96 CO 0.24 -0.86 0.00 0.61 -0.00 0.00 0.00 174.94 174.93 2inf n GLY 97 N -2.23 -0.01 3.71 6.27 0.00 -1.26 -3.11 105.19 108.56 2inf n GLY 97 Ca 0.01 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 2inf n GLY 97 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2inf n PRO 98 N 0.00 2.68 -3.84 1.61 -0.04 -1.25 -1.67 135.00 132.50 2inf n PRO 98 Ca 0.00 0.97 -0.13 0.00 -0.04 0.00 0.00 63.50 64.31 2inf n PRO 98 Cb 0.00 -2.82 -0.14 0.00 -0.04 0.00 0.00 33.50 30.51 2inf n PRO 98 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2inf s VAL 99 N 1.46 -0.01 -0.50 0.52 1.01 0.22 -4.81 120.40 118.28 2inf s VAL 99 Ca 0.77 0.03 -0.21 0.00 0.00 0.00 0.00 61.98 62.58 2inf s VAL 99 Cb -0.53 -0.10 0.05 0.00 0.00 0.00 0.00 36.38 35.80 2inf s VAL 99 CO 0.34 0.01 0.70 -0.63 0.00 0.00 0.00 175.10 175.53 2inf s ILE 100 N 0.20 4.75 0.16 2.22 1.01 -1.26 -0.22 121.20 128.06 2inf s ILE 100 Ca -0.01 -0.19 0.21 0.00 0.00 0.00 0.00 60.65 60.66 2inf s ILE 100 Cb -0.02 -4.34 0.19 0.00 0.01 0.00 0.00 42.46 38.30 2inf s ILE 100 CO -0.01 -0.83 1.79 -2.24 0.00 0.00 0.00 174.94 173.65 2inf h ASP 101 N 9.04 0.00 -3.26 3.58 2.03 -1.95 -3.39 116.42 122.47 2inf h ASP 101 Ca -0.27 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.48 2inf h ASP 101 Cb 1.09 0.00 -0.40 0.00 -0.83 0.00 0.00 39.33 39.19 2inf h ASP 101 CO 0.98 0.29 -0.76 0.00 -1.03 0.00 0.00 179.24 178.71 2inf s GLN 102 N -3.65 0.77 0.68 4.15 -2.07 -1.26 -5.12 119.66 113.16 2inf s GLN 102 Ca 0.00 -0.70 -0.15 0.00 -1.82 0.00 0.00 55.36 52.70 2inf s GLN 102 Cb 0.11 -2.10 0.01 0.00 -1.09 0.00 0.00 33.01 29.94 2inf s GLN 102 CO 0.66 -0.76 1.13 -1.25 -1.32 0.00 0.00 175.29 173.75 2inf s PRO 103 N 1.74 2.61 0.17 9.60 0.04 -1.26 -4.98 135.00 142.91 2inf s PRO 103 Ca 0.02 1.46 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 2inf s PRO 103 Cb -0.17 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 2inf s PRO 103 CO -0.14 -1.41 1.49 0.42 0.04 0.00 0.00 177.00 177.40 2inf s ILE 104 N -2.30 2.82 0.00 0.56 -1.09 0.89 -4.90 121.20 117.18 2inf s ILE 104 Ca 0.68 0.60 0.00 0.00 -2.23 0.00 0.00 60.65 59.70 2inf s ILE 104 Cb -0.22 -3.39 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 2inf s ILE 104 CO 0.43 0.06 0.00 0.54 -1.23 0.00 0.00 174.94 174.74 2inf n ARG 105 N 3.66 1.92 -4.36 2.79 1.74 -1.26 -4.70 116.66 116.45 2inf n ARG 105 Ca 0.12 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 57.01 2inf n ARG 105 Cb 0.40 -0.77 -0.10 0.00 -1.02 0.00 0.00 32.46 30.97 2inf n ARG 105 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2inf s SER 106 N -2.26 1.61 0.23 0.55 1.04 -1.26 -5.05 113.70 108.57 2inf s SER 106 Ca 0.00 -1.45 0.01 0.00 0.48 0.00 0.00 55.95 54.98 2inf s SER 106 Cb 0.00 0.21 0.25 0.00 0.10 0.00 0.00 66.02 66.57 2inf s SER 106 CO 0.00 -0.77 1.59 0.25 0.98 0.00 0.00 173.24 175.29 2inf h LEU 107 N 2.24 0.49 -1.13 2.42 5.85 -1.99 -2.90 115.31 120.28 2inf h LEU 107 Ca -0.37 -0.23 0.08 0.00 0.84 0.00 0.00 57.88 58.20 2inf h LEU 107 Cb 1.25 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.08 2inf h LEU 107 CO 0.60 0.88 0.60 0.00 -0.34 0.00 0.00 178.44 180.17 2inf h ALA 108 N 1.14 1.54 0.27 1.25 0.00 -1.99 -0.03 119.26 121.44 2inf h ALA 108 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2inf h ALA 108 Cb 0.95 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2inf h ALA 108 CO 0.08 0.29 -0.19 -0.44 0.00 0.00 0.00 179.25 178.99 2inf h ASP 109 N 0.99 -0.49 -0.67 0.00 3.32 -1.92 -3.05 116.42 114.59 2inf h ASP 109 Ca 0.41 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.52 2inf h ASP 109 Cb 0.30 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 2inf h ASP 109 CO -0.17 -0.30 0.43 0.40 -1.72 0.00 0.00 179.24 177.88 2inf h ILE 110 N -0.46 1.14 -0.09 0.35 2.04 -1.47 -3.12 117.51 115.89 2inf h ILE 110 Ca -0.02 -0.30 0.03 0.00 1.00 0.00 0.00 64.86 65.57 2inf h ILE 110 Cb 0.40 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2inf h ILE 110 CO 0.00 0.16 0.07 -0.33 0.00 0.00 0.00 178.15 178.05 2inf h GLU 111 N 0.87 0.00 -0.03 2.37 5.08 -0.93 -1.60 114.58 120.33 2inf h GLU 111 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2inf h GLU 111 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2inf h GLU 111 CO -0.08 0.00 0.00 0.36 -1.00 0.00 0.00 179.01 178.29 2inf n LYS 112 N -4.45 1.56 -1.88 2.33 2.85 -1.16 -4.90 118.16 112.50 2inf n LYS 112 Ca -0.01 -0.82 -0.41 0.00 -1.05 0.00 0.00 58.31 56.02 2inf n LYS 112 Cb 0.18 -1.47 -0.01 0.00 -0.65 0.00 0.00 35.03 33.08 2inf n LYS 112 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2inf s LEU 113 N -1.96 4.35 0.00 -5.58 1.43 -0.61 -4.90 118.68 111.43 2inf s LEU 113 Ca 0.39 2.90 0.00 0.00 -1.03 0.00 0.00 54.13 56.39 2inf s LEU 113 Cb 0.21 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2inf s LEU 113 CO 0.33 -0.80 0.00 0.61 0.23 0.00 0.00 176.35 176.72 2inf n GLY 114 N 1.26 1.47 3.38 -3.19 0.00 0.17 -5.01 105.19 103.27 2inf n GLY 114 Ca 0.04 -1.92 -0.29 0.00 0.00 0.00 0.00 46.02 43.84 2inf n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2inf s GLN 115 N 2.62 1.58 0.23 1.61 -0.21 -1.26 -4.73 119.66 119.50 2inf s GLN 115 Ca 0.00 -1.25 -0.26 0.00 0.02 0.00 0.00 55.36 53.87 2inf s GLN 115 Cb 0.00 -1.94 -0.09 0.00 1.00 0.00 0.00 33.01 31.98 2inf s GLN 115 CO 0.00 0.48 0.85 -1.50 -2.12 0.00 0.00 175.29 173.00 2inf s ILE 116 N -0.96 4.27 -0.56 1.08 2.07 -1.26 -4.58 121.20 121.26 2inf s ILE 116 Ca 0.13 1.79 0.04 0.00 -1.41 0.00 0.00 60.65 61.20 2inf s ILE 116 Cb -0.10 -4.13 0.15 0.00 0.13 0.00 0.00 42.46 38.51 2inf s ILE 116 CO 0.05 0.40 0.36 -0.62 -1.91 0.00 0.00 174.94 173.21 2inf s ASP 117 N -1.32 4.01 0.32 4.50 2.15 -1.26 -4.98 116.67 120.09 2inf s ASP 117 Ca 0.41 -3.26 0.04 0.00 0.43 0.00 0.00 52.55 50.18 2inf s ASP 117 Cb -0.22 -1.35 0.66 0.00 -0.30 0.00 0.00 42.92 41.70 2inf s ASP 117 CO 0.27 -0.18 1.87 -0.65 -0.17 0.00 0.00 175.17 176.31 2inf h PRO 118 N 6.02 0.85 -0.77 4.34 0.11 -1.94 1.09 132.00 141.70 2inf h PRO 118 Ca 0.07 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.14 2inf h PRO 118 Cb 0.85 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 31.73 2inf h PRO 118 CO 0.61 0.57 0.51 1.49 -0.21 0.00 0.00 178.00 180.97 2inf h GLU 119 N 0.88 1.00 0.02 1.05 4.57 -1.96 0.28 114.58 120.43 2inf h GLU 119 Ca 0.45 -0.06 -0.29 0.00 -1.18 0.00 0.00 59.36 58.28 2inf h GLU 119 Cb 0.51 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 28.83 2inf h GLU 119 CO -0.21 0.66 -1.64 1.96 -1.18 0.00 0.00 179.01 178.60 2inf h GLN 120 N 1.03 0.05 0.05 1.92 4.20 -1.40 -3.36 115.11 117.59 2inf h GLN 120 Ca 0.29 -0.08 -0.36 0.00 0.06 0.00 0.00 58.65 58.56 2inf h GLN 120 Cb -0.10 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 2inf h GLN 120 CO -0.07 0.67 -2.02 -0.25 -0.67 0.00 0.00 178.83 176.49 2inf n ASP 121 N -3.16 2.00 -2.57 1.46 8.00 0.36 -4.58 116.55 118.07 2inf n ASP 121 Ca -0.16 0.20 -0.22 0.00 0.71 0.00 0.00 54.79 55.31 2inf n ASP 121 Cb 1.04 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 2inf n ASP 121 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2inf n VAL 122 N -3.78 2.02 0.27 2.53 0.24 0.06 -4.88 118.33 114.80 2inf n VAL 122 Ca -0.39 -4.52 0.14 0.00 -2.04 0.00 0.00 64.34 57.53 2inf n VAL 122 Cb 0.92 -0.79 0.67 0.00 -1.47 0.00 0.00 33.84 33.18 2inf n VAL 122 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2inf h PRO 123 N 2.72 0.00 0.00 7.34 0.13 -1.65 -2.06 132.00 138.48 2inf h PRO 123 Ca 0.19 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.16 2inf h PRO 123 Cb 0.95 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 2inf h PRO 123 CO 0.75 0.00 -0.76 0.10 -0.23 0.00 0.00 178.00 177.87 2inf h TYR 124 N 0.00 0.00 -0.08 1.56 -0.00 -1.88 -1.57 116.97 115.00 2inf h TYR 124 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 58.73 58.50 2inf h TYR 124 Cb 0.16 0.00 0.01 0.00 0.00 0.00 0.00 36.73 36.90 2inf h TYR 124 CO 0.00 0.76 -0.85 -0.39 -0.00 0.00 0.00 178.16 177.68 2inf h VAL 125 N 0.00 1.29 -0.16 -0.90 -1.51 -1.70 -2.71 116.25 110.55 2inf h VAL 125 Ca -0.01 -2.07 0.03 0.00 -1.23 0.00 0.00 66.70 63.42 2inf h VAL 125 Cb 1.52 2.19 -0.03 0.00 -2.13 0.00 0.00 31.29 32.84 2inf h VAL 125 CO 0.10 0.64 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.98 2inf h LEU 126 N 0.41 -0.15 -0.50 4.19 4.07 -1.54 -1.75 115.31 120.05 2inf h LEU 126 Ca -0.08 0.05 0.07 0.00 0.08 0.00 0.00 57.88 57.99 2inf h LEU 126 Cb 1.49 0.10 -0.06 0.00 1.08 0.00 0.00 40.66 43.28 2inf h LEU 126 CO 0.17 -0.05 0.17 -0.08 -1.08 0.00 0.00 178.44 177.57 2inf h GLU 127 N 0.00 0.34 0.14 1.13 4.81 -1.38 -0.97 114.58 118.65 2inf h GLU 127 Ca 0.08 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2inf h GLU 127 Cb 0.12 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 2inf h GLU 127 CO -0.16 0.22 -0.16 1.15 -0.73 0.00 0.00 179.01 179.33 2inf h THR 128 N 0.35 0.65 -0.42 0.32 2.02 -1.23 -0.40 112.91 114.20 2inf h THR 128 Ca 0.24 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.49 2inf h THR 128 Cb 0.26 0.65 -0.06 0.00 -1.74 0.00 0.00 68.15 67.25 2inf h THR 128 CO -0.25 0.00 0.05 0.40 0.37 0.00 0.00 175.52 176.09 2inf h ILE 129 N -0.33 0.74 -0.39 3.11 2.04 -1.13 -0.53 117.51 121.02 2inf h ILE 129 Ca 0.01 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.83 2inf h ILE 129 Cb 0.33 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2inf h ILE 129 CO -0.05 0.03 0.21 0.11 0.00 0.00 0.00 178.15 178.45 2inf h LYS 130 N 0.17 0.42 -0.54 2.37 1.57 -1.00 -0.53 116.57 119.03 2inf h LYS 130 Ca 0.21 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 59.01 2inf h LYS 130 Cb 0.27 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.44 2inf h LYS 130 CO -0.30 0.28 0.28 1.25 -0.57 0.00 0.00 179.45 180.39 2inf h LEU 131 N 0.43 0.41 -0.08 2.94 6.46 -0.58 0.18 115.31 125.07 2inf h LEU 131 Ca 0.16 0.03 -0.04 0.00 -0.12 0.00 0.00 57.88 57.90 2inf h LEU 131 Cb 0.04 -0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 39.91 2inf h LEU 131 CO -0.09 0.28 -0.11 -0.07 -0.62 0.00 0.00 178.44 177.83 2inf h LEU 132 N 0.55 0.22 -0.16 2.25 3.38 -0.89 -2.98 115.31 117.68 2inf h LEU 132 Ca 0.24 -0.53 -0.13 0.00 0.09 0.00 0.00 57.88 57.56 2inf h LEU 132 Cb 0.13 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2inf h LEU 132 CO -0.16 0.71 -0.39 0.58 0.09 0.00 0.00 178.44 179.27 2inf h VAL 133 N -0.25 1.35 0.00 1.22 2.07 -1.01 -0.53 116.25 119.09 2inf h VAL 133 Ca 0.01 -1.65 -0.11 0.00 0.82 0.00 0.00 66.70 65.77 2inf h VAL 133 Cb 0.66 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 2inf h VAL 133 CO 0.02 0.50 -0.53 0.78 0.02 0.00 0.00 177.57 178.36 2inf h ASN 134 N 0.19 0.00 0.00 0.57 2.35 -1.09 -3.42 115.58 114.18 2inf h ASN 134 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2inf h ASN 134 Cb 1.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.37 2inf h ASN 134 CO 0.08 0.53 -0.67 -0.62 -1.65 0.00 0.00 177.43 175.11 2inf n GLU 135 N -3.64 0.49 -0.09 0.81 1.02 -1.13 -4.97 120.64 113.13 2inf n GLU 135 Ca -0.01 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.01 2inf n GLU 135 Cb 0.59 -0.83 -0.10 0.00 -0.02 0.00 0.00 31.44 31.08 2inf n GLU 135 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2inf n GLN 136 N -2.05 0.70 -3.72 3.49 6.02 -0.80 -5.01 117.38 116.01 2inf n GLN 136 Ca 0.00 0.09 -0.37 0.00 -0.01 0.00 0.00 57.00 56.71 2inf n GLN 136 Cb 0.33 -1.39 -0.07 0.00 1.02 0.00 0.00 30.24 30.14 2inf n GLN 136 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2inf s LEU 137 N -5.93 4.35 -0.15 1.08 1.43 -0.27 -4.92 118.68 114.26 2inf s LEU 137 Ca -0.22 0.53 0.15 0.00 -1.03 0.00 0.00 54.13 53.55 2inf s LEU 137 Cb 0.06 -2.22 0.56 0.00 0.03 0.00 0.00 46.19 44.62 2inf s LEU 137 CO 0.49 0.30 1.47 0.59 0.23 0.00 0.00 176.35 179.43 2inf n ASN 138 N 2.50 4.13 -4.12 2.29 3.02 -1.26 -4.93 115.26 116.90 2inf n ASN 138 Ca -0.17 -2.76 -0.17 0.00 -0.03 0.00 0.00 54.58 51.45 2inf n ASN 138 Cb 0.53 -0.52 -0.12 0.00 -0.61 0.00 0.00 39.78 39.06 2inf n ASN 138 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2inf s VAL 139 N -2.38 0.92 0.53 2.41 1.01 -1.26 -0.18 120.40 121.45 2inf s VAL 139 Ca 0.42 -1.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.12 2inf s VAL 139 Cb 0.31 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 2inf s VAL 139 CO 0.13 -0.17 1.22 -2.16 0.00 0.00 0.00 175.10 174.12 2inf s PRO 140 N -1.40 3.30 -0.19 2.72 0.04 -1.26 -4.82 135.00 133.40 2inf s PRO 140 Ca -0.03 1.87 -0.11 0.00 0.04 0.00 0.00 61.00 62.77 2inf s PRO 140 Cb -0.09 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 2inf s PRO 140 CO 0.01 -0.95 0.20 -1.17 0.04 0.00 0.00 177.00 175.13 2inf s LEU 141 N -3.59 4.20 -0.33 -3.56 2.96 -1.26 -1.84 118.68 115.26 2inf s LEU 141 Ca 0.71 0.31 -0.17 0.00 -0.22 0.00 0.00 54.13 54.76 2inf s LEU 141 Cb -0.31 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.17 2inf s LEU 141 CO 0.36 0.12 0.46 -0.63 -1.32 0.00 0.00 176.35 175.34 2inf s ILE 142 N 0.55 5.08 0.75 6.68 1.01 0.78 -1.03 121.20 135.02 2inf s ILE 142 Ca 0.11 0.36 -0.09 0.00 0.00 0.00 0.00 60.65 61.03 2inf s ILE 142 Cb -0.12 -3.88 0.07 0.00 0.01 0.00 0.00 42.46 38.54 2inf s ILE 142 CO 0.01 -0.10 1.08 -0.83 0.00 0.00 0.00 174.94 175.10 2inf s GLY 143 N 1.72 1.64 0.12 6.18 0.00 -0.28 -0.91 107.32 115.78 2inf s GLY 143 Ca 0.17 -0.80 -0.21 0.00 0.00 0.00 0.00 44.72 43.88 2inf s GLY 143 CO 0.12 -0.36 0.52 -0.11 0.00 0.00 0.00 173.10 173.26 2inf s PHE 144 N -3.38 -0.40 0.02 1.90 -0.12 -1.26 -1.09 117.98 113.64 2inf s PHE 144 Ca 0.61 0.22 -0.09 0.00 -0.05 0.00 0.00 56.93 57.62 2inf s PHE 144 Cb -0.11 0.40 0.00 0.00 -0.63 0.00 0.00 43.02 42.69 2inf s PHE 144 CO 0.47 -0.75 0.18 0.45 -0.05 0.00 0.00 175.22 175.52 2inf s SER 145 N -2.56 0.01 0.69 1.98 0.15 -1.06 -4.97 113.70 107.94 2inf s SER 145 Ca 0.00 -0.26 -0.14 0.00 0.70 0.00 0.00 55.95 56.25 2inf s SER 145 Cb 0.00 0.26 0.02 0.00 -1.71 0.00 0.00 66.02 64.58 2inf s SER 145 CO -0.10 -0.47 1.11 -0.83 1.20 0.00 0.00 173.24 174.15 2inf s GLY 146 N -1.74 2.01 0.51 9.45 0.00 -1.26 -1.52 107.32 114.77 2inf s GLY 146 Ca -0.10 0.47 -0.06 0.00 0.00 0.00 0.00 44.72 45.03 2inf s GLY 146 CO -0.01 0.82 0.82 0.00 0.00 0.00 0.00 173.10 174.73 2inf s ALA 147 N -2.51 3.37 0.17 3.20 0.00 0.29 -4.78 121.76 121.51 2inf s ALA 147 Ca 0.65 -0.54 -0.18 0.00 0.00 0.00 0.00 51.96 51.89 2inf s ALA 147 Cb -0.20 -2.61 0.09 0.00 0.00 0.00 0.00 23.12 20.41 2inf s ALA 147 CO 0.46 -0.46 1.65 -1.35 0.00 0.00 0.00 175.76 176.05 2inf h PRO 148 N 0.11 -0.08 -0.31 0.00 0.11 -1.91 -0.54 132.00 129.38 2inf h PRO 148 Ca -0.46 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.68 2inf h PRO 148 Cb 1.22 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 2inf h PRO 148 CO 0.61 -0.05 0.13 0.35 -0.21 0.00 0.00 178.00 178.84 2inf h PHE 149 N -0.08 0.25 -0.46 0.65 3.57 -1.97 0.44 116.94 119.33 2inf h PHE 149 Ca 0.19 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.64 2inf h PHE 149 Cb 0.37 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2inf h PHE 149 CO -0.39 0.12 0.06 1.15 -2.23 0.00 0.00 178.31 177.02 2inf h THR 150 N 0.29 1.25 -0.47 4.41 2.02 -1.86 0.15 112.91 118.70 2inf h THR 150 Ca 0.13 -0.94 -0.07 0.00 0.77 0.00 0.00 66.41 66.30 2inf h THR 150 Cb 0.07 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2inf h THR 150 CO -0.11 0.33 0.03 -0.07 0.37 0.00 0.00 175.52 176.06 2inf h LEU 151 N 0.64 0.79 -1.09 2.58 3.38 -0.80 -2.67 115.31 118.13 2inf h LEU 151 Ca 0.14 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.88 2inf h LEU 151 Cb 0.41 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 2inf h LEU 151 CO 0.01 0.88 0.61 0.00 0.09 0.00 0.00 178.44 180.04 2inf h ALA 152 N 0.93 1.46 -0.52 1.53 0.00 0.07 -2.05 119.26 120.69 2inf h ALA 152 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2inf h ALA 152 Cb 0.46 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2inf h ALA 152 CO 0.02 0.41 0.26 0.77 0.00 0.00 0.00 179.25 180.72 2inf h SER 153 N 1.11 0.66 -0.85 0.00 0.02 -0.71 0.13 113.55 113.92 2inf h SER 153 Ca 0.40 -0.11 0.04 0.00 -0.84 0.00 0.00 61.79 61.28 2inf h SER 153 Cb 0.15 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.47 2inf h SER 153 CO -0.15 0.59 0.54 1.88 -1.14 0.00 0.00 176.83 178.55 2inf h TYR 154 N 0.69 1.01 0.00 3.45 -1.99 -1.14 0.22 116.97 119.22 2inf h TYR 154 Ca 0.18 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.90 2inf h TYR 154 Cb 0.09 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 38.48 2inf h TYR 154 CO -0.01 0.57 -0.18 0.52 -0.00 0.00 0.00 178.16 179.06 2inf h MET 155 N 1.04 0.00 0.00 4.88 2.86 -0.80 -3.34 114.93 119.57 2inf h MET 155 Ca 0.35 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.72 2inf h MET 155 Cb 0.04 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 2inf h MET 155 CO -0.13 0.18 -1.99 2.41 1.06 0.00 0.00 176.91 178.44 2inf n THR 156 N -3.29 1.00 -0.05 2.22 -1.04 0.42 -0.07 114.28 113.46 2inf n THR 156 Ca 0.01 -0.47 -0.15 0.00 -2.04 0.00 0.00 64.05 61.40 2inf n THR 156 Cb 0.44 -0.94 -0.07 0.00 -1.82 0.00 0.00 70.33 67.94 2inf n THR 156 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2inf h GLU 157 N 0.00 0.65 0.00 -2.82 4.39 -0.72 -3.43 114.58 112.65 2inf h GLU 157 Ca -0.39 -0.46 0.00 0.00 0.34 0.00 0.00 59.36 58.85 2inf h GLU 157 Cb 1.71 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 30.43 2inf h GLU 157 CO -0.03 1.08 0.00 0.41 -1.16 0.00 0.00 179.01 179.31 2inf n GLY 158 N 0.52 1.62 3.72 -3.84 0.00 -1.25 -4.94 105.19 101.02 2inf n GLY 158 Ca -0.06 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 2inf n GLY 158 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2inf s GLY 159 N 0.00 1.66 0.25 -0.02 0.00 -1.26 -4.69 107.32 103.25 2inf s GLY 159 Ca 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 44.72 44.94 2inf s GLY 159 CO 0.00 0.66 1.79 -0.56 0.00 0.00 0.00 173.10 174.99 2inf h PRO 160 N -1.47 0.68 -2.79 2.90 0.13 -1.99 -3.49 132.00 125.97 2inf h PRO 160 Ca -0.46 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2inf h PRO 160 Cb 1.26 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2inf h PRO 160 CO 0.50 0.45 -0.67 0.45 -0.23 0.00 0.00 178.00 178.50 2inf n SER 161 N -4.81 -6.90 -0.10 1.44 2.88 -1.26 -4.98 113.62 99.90 2inf n SER 161 Ca 0.15 0.93 -0.11 0.00 -1.33 0.00 0.00 58.87 58.51 2inf n SER 161 Cb 0.34 -3.24 -0.16 0.00 -0.75 0.00 0.00 64.21 60.41 2inf n SER 161 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2inf n LYS 162 N -0.35 0.68 -0.07 -1.46 5.02 -1.26 -4.74 118.16 115.98 2inf n LYS 162 Ca 0.00 0.03 -0.07 0.00 -2.02 0.00 0.00 58.31 56.24 2inf n LYS 162 Cb 0.00 -1.54 -0.09 0.00 -0.02 0.00 0.00 35.03 33.37 2inf n LYS 162 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2inf n ASN 163 N -2.81 2.10 -2.17 4.39 3.02 -1.26 -5.03 115.26 113.49 2inf n ASN 163 Ca -0.33 -0.02 -0.15 0.00 -0.03 0.00 0.00 54.58 54.05 2inf n ASN 163 Cb 1.14 0.57 0.03 0.00 -0.61 0.00 0.00 39.78 40.90 2inf n ASN 163 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2inf n TYR 164 N -2.58 -1.39 -0.20 3.10 4.02 -1.26 -4.95 117.16 113.89 2inf n TYR 164 Ca -0.22 0.38 -0.02 0.00 -0.01 0.00 0.00 57.90 58.03 2inf n TYR 164 Cb 0.88 -3.43 0.08 0.00 -0.02 0.00 0.00 39.34 36.85 2inf n TYR 164 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2inf h ASN 165 N -1.02 0.44 -0.58 7.72 2.35 -1.99 -1.75 115.58 120.75 2inf h ASN 165 Ca -0.37 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.40 2inf h ASN 165 Cb 1.25 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 39.55 2inf h ASN 165 CO 0.39 0.29 0.28 0.11 -1.65 0.00 0.00 177.43 176.85 2inf h LYS 166 N 0.58 0.83 -0.20 0.81 1.79 -1.95 0.58 116.57 119.02 2inf h LYS 166 Ca 0.27 -0.12 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 2inf h LYS 166 Cb 0.19 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 2inf h LYS 166 CO -0.19 0.67 0.10 1.15 -1.08 0.00 0.00 179.45 180.10 2inf h THR 167 N 0.78 1.13 -0.43 -0.16 2.02 -1.81 -2.11 112.91 112.33 2inf h THR 167 Ca 0.20 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 2inf h THR 167 Cb 0.11 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2inf h THR 167 CO -0.03 0.12 -0.11 0.11 0.37 0.00 0.00 175.52 175.99 2inf h LYS 168 N 0.20 0.83 -0.72 6.66 1.57 -1.23 -1.64 116.57 122.24 2inf h LYS 168 Ca 0.07 -0.32 0.05 0.00 -1.87 0.00 0.00 60.65 58.58 2inf h LYS 168 Cb 0.11 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 2inf h LYS 168 CO -0.01 0.95 0.43 0.00 -0.57 0.00 0.00 179.45 180.24 2inf h ALA 169 N 0.86 0.97 -0.36 3.86 0.00 -0.84 0.10 119.26 123.84 2inf h ALA 169 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2inf h ALA 169 Cb 0.64 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2inf h ALA 169 CO 0.04 0.15 0.19 0.35 0.00 0.00 0.00 179.25 179.98 2inf h PHE 170 N 0.80 0.50 -0.35 0.00 3.57 -1.27 0.27 116.94 120.47 2inf h PHE 170 Ca 0.31 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.86 2inf h PHE 170 Cb 0.13 -0.16 -0.07 0.00 2.79 0.00 0.00 35.95 38.65 2inf h PHE 170 CO -0.06 0.41 -0.09 1.98 -2.23 0.00 0.00 178.31 178.32 2inf h MET 171 N 0.45 -0.01 -0.10 1.11 4.05 -0.56 -0.28 114.93 119.60 2inf h MET 171 Ca 0.13 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.53 2inf h MET 171 Cb 0.08 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.88 2inf h MET 171 CO -0.02 -0.01 0.00 1.88 0.23 0.00 0.00 176.91 179.00 2inf h TYR 172 N -0.01 0.18 0.00 1.39 0.99 -0.53 -3.26 116.97 115.73 2inf h TYR 172 Ca 0.17 -0.03 -0.14 0.00 2.00 0.00 0.00 58.73 60.73 2inf h TYR 172 Cb 0.26 -0.05 -0.02 0.00 1.00 0.00 0.00 36.73 37.93 2inf h TYR 172 CO -0.32 0.42 -0.65 0.77 -0.00 0.00 0.00 178.16 178.38 2inf h SER 173 N -0.10 0.00 -2.01 3.88 0.02 -0.33 -3.37 113.55 111.64 2inf h SER 173 Ca 0.03 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.46 2inf h SER 173 Cb 0.34 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.48 2inf h SER 173 CO 0.00 0.65 -1.13 0.23 -1.14 0.00 0.00 176.83 175.44 2inf n MET 174 N -3.64 0.99 0.24 3.45 2.81 -0.13 -4.96 117.12 115.88 2inf n MET 174 Ca -0.01 -3.40 0.09 0.00 -1.81 0.00 0.00 57.70 52.57 2inf n MET 174 Cb 0.67 -1.55 0.60 0.00 -0.71 0.00 0.00 33.22 32.22 2inf n MET 174 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2inf h PRO 175 N 3.41 0.00 -0.17 0.03 0.13 -1.73 0.24 132.00 133.90 2inf h PRO 175 Ca 0.09 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 2inf h PRO 175 Cb 0.91 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 2inf h PRO 175 CO 0.50 0.19 0.07 0.22 -0.23 0.00 0.00 178.00 178.75 2inf h ASP 176 N 0.00 0.24 -0.08 1.44 3.58 -1.92 -0.80 116.42 118.87 2inf h ASP 176 Ca -0.00 -0.17 -0.10 0.00 0.42 0.00 0.00 57.03 57.18 2inf h ASP 176 Cb 0.42 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 2inf h ASP 176 CO 0.02 0.34 -0.26 0.00 -2.88 0.00 0.00 179.24 176.46 2inf h ALA 177 N 0.91 1.05 0.16 -0.78 0.00 -1.67 -2.94 119.26 115.99 2inf h ALA 177 Ca 0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2inf h ALA 177 Cb 0.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2inf h ALA 177 CO -0.00 0.58 -0.08 2.35 0.00 0.00 0.00 179.25 182.09 2inf h TRP 178 N 0.46 -0.20 -0.88 0.00 2.91 -0.76 -2.01 115.95 115.46 2inf h TRP 178 Ca 0.06 -0.00 0.07 0.00 1.13 0.00 0.00 58.89 60.15 2inf h TRP 178 Cb 0.70 0.07 -0.06 0.00 -0.51 0.00 0.00 29.16 29.35 2inf h TRP 178 CO 0.02 -0.03 0.55 -0.91 -1.03 0.00 0.00 178.44 177.05 2inf h ASN 179 N -0.33 0.85 -0.38 2.65 4.21 -1.15 0.05 115.58 121.48 2inf h ASN 179 Ca -0.02 0.02 -0.00 0.00 1.21 0.00 0.00 56.30 57.51 2inf h ASN 179 Cb 0.26 -0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 37.29 2inf h ASN 179 CO 0.04 0.54 0.23 0.25 -1.29 0.00 0.00 177.43 177.19 2inf h LEU 180 N 0.98 0.45 -0.74 1.61 5.85 -1.45 -1.13 115.31 120.88 2inf h LEU 180 Ca 0.39 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 59.07 2inf h LEU 180 Cb 0.20 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 2inf h LEU 180 CO -0.18 0.37 0.49 0.25 -0.34 0.00 0.00 178.44 179.02 2inf h LEU 181 N 0.49 0.85 -0.77 2.25 5.85 -0.66 0.19 115.31 123.51 2inf h LEU 181 Ca 0.14 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.86 2inf h LEU 181 Cb -0.00 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.77 2inf h LEU 181 CO -0.03 0.62 0.49 0.24 -0.34 0.00 0.00 178.44 179.42 2inf h MET 182 N 1.00 0.94 -0.33 1.25 2.86 -0.89 -2.00 114.93 117.76 2inf h MET 182 Ca 0.27 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.74 2inf h MET 182 Cb -0.11 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.33 2inf h MET 182 CO -0.06 0.62 -0.23 1.03 1.06 0.00 0.00 176.91 179.34 2inf h SER 183 N 0.97 0.78 -0.66 1.22 0.87 -0.06 0.38 113.55 117.05 2inf h SER 183 Ca 0.30 -0.43 -0.01 0.00 -1.23 0.00 0.00 61.79 60.41 2inf h SER 183 Cb -0.02 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.70 2inf h SER 183 CO -0.10 1.04 0.36 0.11 -0.53 0.00 0.00 176.83 177.71 2inf h LYS 184 N 0.52 0.92 -0.21 2.24 1.79 -0.59 -1.80 116.57 119.43 2inf h LYS 184 Ca 0.07 -0.11 -0.15 0.00 -2.18 0.00 0.00 60.65 58.28 2inf h LYS 184 Cb 0.78 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.25 2inf h LYS 184 CO 0.06 0.69 -0.48 -0.07 -1.08 0.00 0.00 179.45 178.57 2inf h LEU 185 N 0.90 0.61 -0.25 2.94 3.38 -1.26 -2.60 115.31 119.02 2inf h LEU 185 Ca 0.23 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2inf h LEU 185 Cb 0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2inf h LEU 185 CO -0.04 0.99 0.12 0.00 0.09 0.00 0.00 178.44 179.60 2inf h ALA 186 N 1.03 0.32 -0.39 1.53 0.00 -0.75 0.13 119.26 121.14 2inf h ALA 186 Ca 0.02 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.91 2inf h ALA 186 Cb 1.00 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 2inf h ALA 186 CO 0.09 -0.11 0.05 -0.44 0.00 0.00 0.00 179.25 178.84 2inf h ASP 187 N 0.27 -0.05 0.03 0.00 3.32 -1.29 -0.65 116.42 118.05 2inf h ASP 187 Ca 0.09 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 2inf h ASP 187 Cb 0.12 0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2inf h ASP 187 CO -0.01 0.01 -0.01 -0.03 -1.72 0.00 0.00 179.24 177.48 2inf h MET 188 N 0.17 -0.03 -0.63 3.56 4.05 -1.30 -2.47 114.93 118.27 2inf h MET 188 Ca 0.19 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 2inf h MET 188 Cb 0.25 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.02 2inf h MET 188 CO -0.28 -0.01 0.39 0.82 0.23 0.00 0.00 176.91 178.07 2inf h ILE 189 N -0.05 1.17 -0.13 1.77 2.04 -0.55 0.11 117.51 121.88 2inf h ILE 189 Ca -0.00 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 2inf h ILE 189 Cb 0.04 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2inf h ILE 189 CO 0.01 0.17 0.06 0.40 0.00 0.00 0.00 178.15 178.79 2inf h ILE 190 N 0.85 1.13 -0.26 -0.67 2.04 -1.10 -0.07 117.51 119.42 2inf h ILE 190 Ca 0.23 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2inf h ILE 190 Cb -0.06 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2inf h ILE 190 CO -0.05 0.12 0.09 0.58 0.00 0.00 0.00 178.15 178.89 2inf h VAL 191 N 0.07 1.18 -0.03 1.67 2.07 -1.21 -0.93 116.25 119.07 2inf h VAL 191 Ca 0.04 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.04 2inf h VAL 191 Cb 0.13 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 2inf h VAL 191 CO -0.01 0.19 -0.31 0.22 0.02 0.00 0.00 177.57 177.68 2inf h TYR 192 N 0.26 -0.85 -0.40 1.57 3.20 -0.68 -2.06 116.97 118.01 2inf h TYR 192 Ca 0.08 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 2inf h TYR 192 Cb 0.20 0.38 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 2inf h TYR 192 CO -0.00 -0.40 0.09 0.28 -1.64 0.00 0.00 178.16 176.49 2inf h VAL 193 N -0.44 1.23 -0.71 1.81 2.07 -0.97 -2.34 116.25 116.91 2inf h VAL 193 Ca 0.07 -0.80 0.10 0.00 0.82 0.00 0.00 66.70 66.89 2inf h VAL 193 Cb 0.54 0.99 -0.08 0.00 -1.52 0.00 0.00 31.29 31.23 2inf h VAL 193 CO -0.28 0.28 0.34 0.11 0.02 0.00 0.00 177.57 178.03 2inf h LYS 194 N 0.50 0.55 -0.70 1.57 1.57 -1.08 -1.64 116.57 117.33 2inf h LYS 194 Ca 0.12 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 2inf h LYS 194 Cb 0.32 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 2inf h LYS 194 CO 0.00 0.36 0.25 0.00 -0.57 0.00 0.00 179.45 179.50 2inf h ALA 195 N 1.45 1.12 -0.46 3.86 0.00 -1.09 -0.96 119.26 123.18 2inf h ALA 195 Ca 0.36 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2inf h ALA 195 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2inf h ALA 195 CO -0.29 0.62 0.20 1.96 0.00 0.00 0.00 179.25 181.74 2inf h GLN 196 N 1.03 0.68 -0.11 0.00 4.20 -0.87 -1.13 115.11 118.91 2inf h GLN 196 Ca 0.23 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2inf h GLN 196 Cb 0.24 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2inf h GLN 196 CO -0.02 0.60 0.07 0.82 -0.67 0.00 0.00 178.83 179.63 2inf h ILE 197 N 0.61 1.03 -0.60 2.54 2.04 -1.11 -1.58 117.51 120.44 2inf h ILE 197 Ca 0.16 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 66.03 2inf h ILE 197 Cb 0.16 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 37.05 2inf h ILE 197 CO -0.02 0.03 0.28 0.50 0.00 0.00 0.00 178.15 178.94 2inf h LYS 198 N 0.14 0.50 0.00 2.37 1.63 -1.13 -0.68 116.57 119.40 2inf h LYS 198 Ca 0.04 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2inf h LYS 198 Cb -0.01 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.50 2inf h LYS 198 CO -0.01 0.33 0.00 0.00 -3.45 0.00 0.00 179.45 176.32 2inf h ALA 199 N 1.36 1.00 0.00 5.00 0.00 -0.84 -3.46 119.26 122.32 2inf h ALA 199 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2inf h ALA 199 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2inf h ALA 199 CO -0.23 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.43 2inf n GLY 200 N -0.13 -0.35 3.73 0.00 0.00 -0.26 -3.72 105.19 104.47 2inf n GLY 200 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2inf n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2inf s ALA 201 N -0.60 3.74 -1.38 4.61 0.00 -0.67 -4.75 121.76 122.71 2inf s ALA 201 Ca 0.00 1.42 0.23 0.00 0.00 0.00 0.00 51.96 53.61 2inf s ALA 201 Cb 0.00 -3.61 0.05 0.00 0.00 0.00 0.00 23.12 19.56 2inf s ALA 201 CO 0.00 -0.83 1.11 1.63 0.00 0.00 0.00 175.76 177.67 2inf n LYS 202 N 3.07 0.44 -3.87 0.00 5.02 -0.20 -4.50 118.16 118.12 2inf n LYS 202 Ca 0.11 -0.34 -0.09 0.00 -2.02 0.00 0.00 58.31 55.96 2inf n LYS 202 Cb 0.38 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.85 2inf n LYS 202 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2inf s ALA 203 N -2.80 -0.41 -0.03 7.82 0.00 -1.13 -4.05 121.76 121.16 2inf s ALA 203 Ca 0.13 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.51 2inf s ALA 203 Cb 0.17 0.86 0.01 0.00 0.00 0.00 0.00 23.12 24.16 2inf s ALA 203 CO 0.72 -0.72 -0.07 0.42 0.00 0.00 0.00 175.76 176.11 2inf s ILE 204 N -3.93 0.69 -0.16 0.00 -1.09 -0.39 -1.13 121.20 115.20 2inf s ILE 204 Ca 0.14 -0.27 -0.03 0.00 -2.23 0.00 0.00 60.65 58.25 2inf s ILE 204 Cb 0.01 -0.65 -0.02 0.00 -1.58 0.00 0.00 42.46 40.22 2inf s ILE 204 CO -0.01 0.24 -0.05 -1.58 -1.23 0.00 0.00 174.94 172.30 2inf s GLN 205 N 0.46 3.60 -0.26 2.79 0.74 -0.25 -0.49 119.66 126.25 2inf s GLN 205 Ca -0.07 -0.56 -0.13 0.00 0.05 0.00 0.00 55.36 54.66 2inf s GLN 205 Cb -0.11 -2.87 -0.04 0.00 1.10 0.00 0.00 33.01 31.09 2inf s GLN 205 CO 0.01 0.21 0.27 0.42 -0.55 0.00 0.00 175.29 175.64 2inf s ILE 206 N 0.44 5.26 -0.37 -2.34 -1.09 0.19 -2.57 121.20 120.71 2inf s ILE 206 Ca -0.05 0.36 -0.14 0.00 -2.23 0.00 0.00 60.65 58.60 2inf s ILE 206 Cb -0.15 -3.60 0.00 0.00 -1.58 0.00 0.00 42.46 37.13 2inf s ILE 206 CO 0.03 0.24 0.27 -0.36 -1.23 0.00 0.00 174.94 173.89 2inf s PHE 207 N 1.68 3.23 -0.76 3.97 0.40 -0.58 -1.73 117.98 124.19 2inf s PHE 207 Ca 0.11 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 56.07 2inf s PHE 207 Cb -0.15 -2.53 0.25 0.00 0.51 0.00 0.00 43.02 41.10 2inf s PHE 207 CO 0.09 -0.47 0.88 -3.47 0.70 0.00 0.00 175.22 172.94 2inf n ASP 208 N 5.13 4.28 0.12 1.36 -0.08 -0.43 -0.54 116.55 126.39 2inf n ASP 208 Ca -0.12 -3.39 0.06 0.00 -1.51 0.00 0.00 54.79 49.84 2inf n ASP 208 Cb 0.48 -0.84 0.54 0.00 2.34 0.00 0.00 41.12 43.64 2inf n ASP 208 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2inf h SER 209 N 4.73 0.23 -0.01 1.67 0.02 -1.94 -3.16 113.55 115.09 2inf h SER 209 Ca 0.19 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2inf h SER 209 Cb 0.68 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2inf h SER 209 CO 0.93 0.17 -0.15 0.79 -1.14 0.00 0.00 176.83 177.43 2inf n TRP 210 N -4.50 0.00 0.33 3.45 8.01 -1.26 -4.06 117.44 119.41 2inf n TRP 210 Ca 0.00 0.00 0.15 0.00 -1.31 0.00 0.00 57.50 56.34 2inf n TRP 210 Cb 0.09 0.00 0.59 0.00 -2.01 0.00 0.00 31.31 29.99 2inf n TRP 210 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.69 176.44 2inf h VAL 211 N 1.67 0.00 0.00 -0.99 3.04 -1.87 -2.12 116.25 115.98 2inf h VAL 211 Ca 0.00 -0.41 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 2inf h VAL 211 Cb 0.43 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 31.01 2inf h VAL 211 CO 0.00 0.00 0.02 0.61 -1.01 0.00 0.00 177.57 177.19 2inf n GLY 212 N 0.08 -0.52 0.13 3.17 0.00 -1.26 -0.88 105.19 105.90 2inf n GLY 212 Ca 0.01 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.17 2inf n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2inf n ALA 213 N -1.51 1.62 -2.84 4.61 0.00 -0.80 -4.71 120.51 116.88 2inf n ALA 213 Ca -0.00 0.09 -0.37 0.00 0.00 0.00 0.00 53.44 53.16 2inf n ALA 213 Cb 0.02 -1.38 -0.07 0.00 0.00 0.00 0.00 19.45 18.03 2inf n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2inf s LEU 214 N -4.43 4.26 0.93 0.00 1.02 -0.06 -5.11 118.68 115.29 2inf s LEU 214 Ca 0.04 0.40 -0.14 0.00 0.02 0.00 0.00 54.13 54.45 2inf s LEU 214 Cb 0.09 -2.03 0.16 0.00 0.02 0.00 0.00 46.19 44.42 2inf s LEU 214 CO 0.37 0.39 1.19 0.54 0.02 0.00 0.00 176.35 178.86 2inf s ASN 215 N -0.90 3.35 0.31 2.29 2.20 -1.26 -4.82 114.94 116.11 2inf s ASN 215 Ca 0.14 0.70 0.01 0.00 -0.94 0.00 0.00 52.86 52.77 2inf s ASN 215 Cb -0.12 -1.08 0.50 0.00 -2.00 0.00 0.00 41.25 38.56 2inf s ASN 215 CO 0.03 -2.62 1.90 -0.61 -2.94 0.00 0.00 177.10 172.86 2inf h GLN 216 N -1.55 0.80 -0.39 3.55 4.15 -1.99 0.08 115.11 119.77 2inf h GLN 216 Ca -0.47 -0.12 -0.09 0.00 0.77 0.00 0.00 58.65 58.74 2inf h GLN 216 Cb 1.30 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.84 2inf h GLN 216 CO 0.54 0.66 -0.12 0.00 -1.93 0.00 0.00 178.83 177.97 2inf h ALA 217 N 1.45 0.54 -0.04 3.38 0.00 -1.98 -1.49 119.26 121.11 2inf h ALA 217 Ca 0.19 -0.33 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 2inf h ALA 217 Cb 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2inf h ALA 217 CO -0.02 0.43 -0.85 -0.44 0.00 0.00 0.00 179.25 178.37 2inf h ASP 218 N 0.57 0.56 -0.06 0.00 3.32 -1.90 -1.23 116.42 117.68 2inf h ASP 218 Ca 0.09 -0.41 0.03 0.00 0.02 0.00 0.00 57.03 56.77 2inf h ASP 218 Cb 0.65 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 2inf h ASP 218 CO 0.04 1.19 -0.17 0.22 -1.72 0.00 0.00 179.24 178.80 2inf h TYR 219 N 0.28 -0.44 -0.70 4.55 3.20 -0.90 0.57 116.97 123.53 2inf h TYR 219 Ca -0.06 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 2inf h TYR 219 Cb 1.46 0.21 -0.03 0.00 1.54 0.00 0.00 36.73 39.90 2inf h TYR 219 CO 0.06 -0.25 0.35 0.00 -1.64 0.00 0.00 178.16 176.68 2inf h ARG 220 N -0.25 0.99 -0.02 1.82 3.08 -1.24 0.11 114.38 118.88 2inf h ARG 220 Ca 0.07 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2inf h ARG 220 Cb 0.35 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 2inf h ARG 220 CO -0.21 0.77 0.00 1.15 -1.07 0.00 0.00 179.97 180.61 2inf h THR 221 N 0.97 1.23 0.00 2.04 2.02 -1.02 -3.37 112.91 114.78 2inf h THR 221 Ca 0.24 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.73 2inf h THR 221 Cb 0.09 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2inf h THR 221 CO -0.03 0.18 -1.62 -1.22 0.37 0.00 0.00 175.52 173.20 2inf n TYR 222 N -4.93 0.00 0.00 3.16 4.02 0.17 -4.79 117.16 114.79 2inf n TYR 222 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 2inf n TYR 222 Cb 0.17 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.16 2inf n TYR 222 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 2inf n ILE 223 N -1.98 0.00 -0.27 -0.72 2.08 -0.48 -4.85 119.36 113.14 2inf n ILE 223 Ca -0.02 0.00 0.06 0.00 0.56 0.00 0.00 62.75 63.35 2inf n ILE 223 Cb 0.42 -1.03 0.20 0.00 -0.75 0.00 0.00 39.64 38.48 2inf n ILE 223 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 2inf h LYS 224 N 0.00 0.43 -0.55 0.38 3.64 -1.00 -2.13 116.57 117.34 2inf h LYS 224 Ca 0.00 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 2inf h LYS 224 Cb 0.71 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.38 2inf h LYS 224 CO 0.00 0.28 0.28 -1.35 -2.27 0.00 0.00 179.45 176.40 2inf h PRO 225 N 0.44 0.53 -0.54 1.90 0.11 -1.85 -0.19 132.00 132.40 2inf h PRO 225 Ca 0.44 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.47 2inf h PRO 225 Cb 0.68 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 2inf h PRO 225 CO -0.42 0.35 0.17 -0.24 -0.21 0.00 0.00 178.00 177.65 2inf h VAL 226 N 0.54 1.23 -0.85 3.15 3.04 -1.73 -2.38 116.25 119.25 2inf h VAL 226 Ca 0.25 -0.78 0.06 0.00 -1.01 0.00 0.00 66.70 65.22 2inf h VAL 226 Cb 0.15 0.72 -0.06 0.00 -2.01 0.00 0.00 31.29 30.09 2inf h VAL 226 CO -0.17 0.29 0.53 0.24 -1.01 0.00 0.00 177.57 177.45 2inf h MET 227 N 0.75 0.93 -0.88 4.17 2.86 -1.15 -1.09 114.93 120.51 2inf h MET 227 Ca 0.18 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2inf h MET 227 Cb 0.27 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 2inf h MET 227 CO -0.01 0.61 0.58 -0.97 1.06 0.00 0.00 176.91 178.19 2inf h ASN 228 N 0.96 1.01 -0.28 1.22 -1.24 -0.78 -0.78 115.58 115.69 2inf h ASN 228 Ca 0.37 -0.02 -0.03 0.00 0.71 0.00 0.00 56.30 57.33 2inf h ASN 228 Cb 0.18 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 2inf h ASN 228 CO -0.18 0.72 0.06 -0.09 -1.29 0.00 0.00 177.43 176.66 2inf h ARG 229 N 1.19 0.45 0.17 6.67 2.43 -0.95 -1.07 114.38 123.26 2inf h ARG 229 Ca 0.33 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 2inf h ARG 229 Cb -0.12 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2inf h ARG 229 CO -0.07 0.54 -0.09 0.82 -1.51 0.00 0.00 179.97 179.65 2inf h ILE 230 N 0.28 0.80 -0.33 1.20 2.04 -0.69 -2.02 117.51 118.80 2inf h ILE 230 Ca 0.09 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.82 2inf h ILE 230 Cb 0.30 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2inf h ILE 230 CO 0.00 0.00 -0.32 -0.26 0.00 0.00 0.00 178.15 177.57 2inf h PHE 231 N -0.25 0.83 -0.36 1.37 -1.00 -1.21 -1.53 116.94 114.79 2inf h PHE 231 Ca -0.02 -0.22 0.02 0.00 2.81 0.00 0.00 57.97 60.56 2inf h PHE 231 Cb 0.20 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 39.55 2inf h PHE 231 CO -0.08 0.94 0.20 0.77 -1.61 0.00 0.00 178.31 178.54 2inf h SER 232 N 0.60 0.32 -0.39 2.17 0.02 -1.09 0.53 113.55 115.70 2inf h SER 232 Ca 0.07 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2inf h SER 232 Cb 0.84 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 2inf h SER 232 CO 0.07 0.23 0.22 -0.33 -1.14 0.00 0.00 176.83 175.88 2inf h GLU 233 N 0.41 0.55 0.00 3.45 4.39 -1.29 -3.04 114.58 119.05 2inf h GLU 233 Ca 0.15 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2inf h GLU 233 Cb 0.02 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 2inf h GLU 233 CO -0.08 0.44 0.00 -0.07 -1.16 0.00 0.00 179.01 178.14 2inf h LEU 234 N 0.51 0.00 -1.88 1.33 3.38 -1.02 -3.17 115.31 114.46 2inf h LEU 234 Ca 0.14 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2inf h LEU 234 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2inf h LEU 234 CO -0.02 0.00 -0.13 0.00 0.09 0.00 0.00 178.44 178.38 2inf h ALA 235 N 2.06 1.39 0.00 1.53 0.00 -0.77 -2.64 119.26 120.83 2inf h ALA 235 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2inf h ALA 235 Cb 0.64 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2inf h ALA 235 CO 0.00 0.16 0.00 1.63 0.00 0.00 0.00 179.25 181.04 2inf n LYS 236 N -3.81 0.18 0.09 0.00 5.02 -1.20 -2.61 118.16 115.83 2inf n LYS 236 Ca -0.02 0.35 0.13 0.00 -2.02 0.00 0.00 58.31 56.76 2inf n LYS 236 Cb 0.23 -1.80 0.44 0.00 -0.02 0.00 0.00 35.03 33.88 2inf n LYS 236 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2inf n GLU 237 N -2.13 0.22 -2.80 1.97 -0.58 -0.99 -4.96 120.64 111.37 2inf n GLU 237 Ca 0.03 0.18 -0.21 0.00 -0.42 0.00 0.00 57.16 56.74 2inf n GLU 237 Cb 0.26 -1.75 0.01 0.00 -0.57 0.00 0.00 31.44 29.39 2inf n GLU 237 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2inf n ASN 238 N -2.14 -5.68 -4.57 1.62 5.03 -1.07 -5.02 115.26 103.43 2inf n ASN 238 Ca 0.06 -0.17 -0.30 0.00 0.87 0.00 0.00 54.58 55.04 2inf n ASN 238 Cb 0.42 -4.66 -0.10 0.00 -1.02 0.00 0.00 39.78 34.42 2inf n ASN 238 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2inf s VAL 239 N -3.07 3.35 0.27 2.41 -7.23 -1.26 -5.09 120.40 109.79 2inf s VAL 239 Ca 0.19 -1.28 -0.31 0.00 -1.81 0.00 0.00 61.98 58.77 2inf s VAL 239 Cb -0.09 -2.57 -0.12 0.00 0.56 0.00 0.00 36.38 34.17 2inf s VAL 239 CO 0.23 0.11 1.65 -2.65 -0.31 0.00 0.00 175.10 174.13 2inf n PRO 240 N 0.70 2.77 -4.51 4.82 -0.02 -1.26 -4.84 135.00 132.66 2inf n PRO 240 Ca -0.13 0.99 -0.33 0.00 -2.02 0.00 0.00 63.50 62.00 2inf n PRO 240 Cb 0.52 -2.80 -0.15 0.00 -0.02 0.00 0.00 33.50 31.06 2inf n PRO 240 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2inf s LEU 241 N -0.03 2.68 0.03 2.45 1.43 -1.26 -1.27 118.68 122.71 2inf s LEU 241 Ca 0.67 -0.38 0.07 0.00 -1.03 0.00 0.00 54.13 53.45 2inf s LEU 241 Cb -0.49 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.08 2inf s LEU 241 CO 0.44 0.10 -0.19 -0.63 0.23 0.00 0.00 176.35 176.30 2inf s ILE 242 N 0.72 2.74 -0.04 -0.59 1.01 0.35 -0.23 121.20 125.16 2inf s ILE 242 Ca -0.06 -1.14 0.02 0.00 0.00 0.00 0.00 60.65 59.48 2inf s ILE 242 Cb -0.15 -2.13 0.01 0.00 0.01 0.00 0.00 42.46 40.20 2inf s ILE 242 CO 0.02 0.38 -0.10 -0.32 0.00 0.00 0.00 174.94 174.92 2inf s MET 243 N -1.29 1.17 0.01 2.79 1.75 -0.98 0.53 119.30 123.27 2inf s MET 243 Ca 0.14 -0.33 -0.01 0.00 -1.25 0.00 0.00 55.69 54.24 2inf s MET 243 Cb -0.10 -1.06 -0.01 0.00 2.84 0.00 0.00 34.83 36.50 2inf s MET 243 CO 0.04 0.08 0.01 0.12 -0.65 0.00 0.00 175.02 174.62 2inf s PHE 244 N 0.37 0.12 -0.14 4.11 5.36 -0.71 -0.93 117.98 126.17 2inf s PHE 244 Ca -0.07 -0.25 -0.27 0.00 -0.96 0.00 0.00 56.93 55.38 2inf s PHE 244 Cb -0.11 -0.09 0.07 0.00 -0.34 0.00 0.00 43.02 42.54 2inf s PHE 244 CO 0.01 -0.12 0.67 0.20 -1.46 0.00 0.00 175.22 174.52 2inf s GLY 245 N -0.83 -0.54 0.34 13.12 0.00 -1.26 -1.31 107.32 116.83 2inf s GLY 245 Ca -0.09 1.57 -0.20 0.00 0.00 0.00 0.00 44.72 46.00 2inf s GLY 245 CO -0.00 1.26 0.85 0.54 0.00 0.00 0.00 173.10 175.75 2inf s VAL 246 N -0.49 4.45 -0.89 1.40 0.11 -1.26 -4.13 120.40 119.59 2inf s VAL 246 Ca -0.06 1.40 -0.02 0.00 -2.93 0.00 0.00 61.98 60.36 2inf s VAL 246 Cb -0.02 -3.75 0.00 0.00 -1.53 0.00 0.00 36.38 31.08 2inf s VAL 246 CO 0.06 -0.08 0.28 0.61 -3.33 0.00 0.00 175.10 172.64 2inf n GLY 247 N -0.02 -0.01 1.11 6.54 0.00 -1.26 -4.41 105.19 107.13 2inf n GLY 247 Ca 0.03 -0.30 0.05 0.00 0.00 0.00 0.00 46.02 45.80 2inf n GLY 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2inf n ALA 248 N -2.56 2.94 -0.04 4.61 0.00 -1.26 -4.45 120.51 119.75 2inf n ALA 248 Ca -0.08 -2.77 0.02 0.00 0.00 0.00 0.00 53.44 50.61 2inf n ALA 248 Cb 0.57 -0.57 0.36 0.00 0.00 0.00 0.00 19.45 19.81 2inf n ALA 248 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2inf h SER 249 N 1.00 0.55 0.34 0.00 0.02 -1.92 -1.25 113.55 112.30 2inf h SER 249 Ca -0.13 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2inf h SER 249 Cb 1.50 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.90 2inf h SER 249 CO 0.06 0.45 0.00 0.00 -1.14 0.00 0.00 176.83 176.20 2inf n HIS 250 N -4.42 0.03 0.69 3.45 1.44 -1.26 -2.42 115.22 112.75 2inf n HIS 250 Ca 0.04 0.01 0.07 0.00 -2.01 0.00 0.00 57.72 55.83 2inf n HIS 250 Cb 0.10 -0.52 -0.09 0.00 0.12 0.00 0.00 29.99 29.60 2inf n HIS 250 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2inf n LEU 251 N -1.53 0.69 -0.32 2.39 4.77 -0.48 -4.71 117.00 117.82 2inf n LEU 251 Ca 0.02 -0.48 0.19 0.00 -0.03 0.00 0.00 56.01 55.71 2inf n LEU 251 Cb 0.11 0.00 0.39 0.00 -2.33 0.00 0.00 43.42 41.59 2inf n LEU 251 CO 0.09 0.17 1.03 0.00 -1.33 0.00 0.00 177.39 177.36 2inf h ALA 252 N 2.14 1.63 -0.47 -1.18 0.00 -1.41 0.04 119.26 120.00 2inf h ALA 252 Ca 0.00 0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 2inf h ALA 252 Cb 0.37 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2inf h ALA 252 CO 0.00 -0.52 -0.00 0.78 0.00 0.00 0.00 179.25 179.50 2inf h GLY 253 N 0.27 0.90 1.37 0.00 0.00 -1.84 -0.08 103.07 103.69 2inf h GLY 253 Ca 0.65 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 47.26 2inf h GLY 253 CO -0.64 0.61 0.10 -0.55 0.00 0.00 0.00 176.54 176.07 2inf h ASP 254 N 0.69 0.74 -0.61 0.19 5.19 -1.38 -1.76 116.42 119.48 2inf h ASP 254 Ca 0.13 -0.14 -0.04 0.00 -0.62 0.00 0.00 57.03 56.36 2inf h ASP 254 Cb 0.51 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.80 2inf h ASP 254 CO 0.03 0.74 0.22 -0.50 -3.12 0.00 0.00 179.24 176.61 2inf h TRP 255 N 0.76 0.97 0.00 4.55 4.06 -0.94 -3.02 115.95 122.33 2inf h TRP 255 Ca 0.16 -0.07 -0.06 0.00 2.06 0.00 0.00 58.89 60.98 2inf h TRP 255 Cb 0.32 -0.29 -0.01 0.00 -1.00 0.00 0.00 29.16 28.18 2inf h TRP 255 CO 0.02 0.76 -0.29 1.25 -3.56 0.00 0.00 178.44 176.62 2inf h HIS 256 N 0.93 0.00 -0.13 0.49 2.76 -0.18 -1.87 115.15 117.14 2inf h HIS 256 Ca 0.21 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.32 2inf h HIS 256 Cb 0.23 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2inf h HIS 256 CO 0.02 0.29 -0.20 -0.44 -1.30 0.00 0.00 177.93 176.29 2inf h ASP 257 N 0.00 0.21 -4.04 3.26 3.32 -1.24 -3.45 116.42 114.48 2inf h ASP 257 Ca -0.00 -0.05 -0.49 0.00 0.02 0.00 0.00 57.03 56.51 2inf h ASP 257 Cb 0.67 -0.06 0.04 0.00 0.22 0.00 0.00 39.33 40.21 2inf h ASP 257 CO 0.04 0.43 0.42 -0.76 -1.72 0.00 0.00 179.24 177.65 2inf s LEU 258 N -8.62 3.90 0.00 1.55 1.43 -0.70 -4.90 118.68 111.34 2inf s LEU 258 Ca -0.05 2.09 -0.00 0.00 -1.03 0.00 0.00 54.13 55.13 2inf s LEU 258 Cb 0.15 -4.44 -0.02 0.00 0.03 0.00 0.00 46.19 41.91 2inf s LEU 258 CO 0.74 -0.87 1.21 -0.81 0.23 0.00 0.00 176.35 176.84 2inf n PRO 259 N -0.80 0.60 -2.26 1.29 -0.04 -1.26 -4.80 135.00 127.72 2inf n PRO 259 Ca 0.09 -0.08 -0.26 0.00 -0.04 0.00 0.00 63.50 63.21 2inf n PRO 259 Cb 0.51 -1.31 0.10 0.00 -0.04 0.00 0.00 33.50 32.76 2inf n PRO 259 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2inf s LEU 260 N 0.00 2.85 -0.13 1.53 0.05 -1.26 -4.74 118.68 116.99 2inf s LEU 260 Ca 0.05 0.19 0.03 0.00 0.05 0.00 0.00 54.13 54.45 2inf s LEU 260 Cb 0.02 -2.64 -0.10 0.00 -2.05 0.00 0.00 46.19 41.42 2inf s LEU 260 CO 0.00 -1.89 -0.09 0.47 -0.55 0.00 0.00 176.35 174.30 2inf n ASP 261 N -3.06 2.83 -4.10 1.48 8.00 0.68 -4.95 116.55 117.42 2inf n ASP 261 Ca 0.11 -0.06 -0.29 0.00 0.71 0.00 0.00 54.79 55.26 2inf n ASP 261 Cb 0.60 -0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.53 2inf n ASP 261 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2inf s VAL 262 N -2.27 1.64 -0.32 2.53 1.01 -0.33 -2.98 120.40 119.68 2inf s VAL 262 Ca -0.15 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 2inf s VAL 262 Cb 0.04 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 2inf s VAL 262 CO 0.34 0.47 0.35 -0.69 0.00 0.00 0.00 175.10 175.57 2inf s VAL 263 N 0.74 5.18 0.13 2.92 1.01 -0.34 -2.32 120.40 127.73 2inf s VAL 263 Ca -0.11 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 2inf s VAL 263 Cb -0.16 -3.77 -0.06 0.00 0.00 0.00 0.00 36.38 32.39 2inf s VAL 263 CO 0.02 -0.01 0.97 -0.83 0.00 0.00 0.00 175.10 175.25 2inf s GLY 264 N 1.72 3.00 0.03 4.51 0.00 -0.10 -0.51 107.32 115.97 2inf s GLY 264 Ca 0.12 0.60 0.06 0.00 0.00 0.00 0.00 44.72 45.51 2inf s GLY 264 CO 0.11 1.46 -0.16 1.08 0.00 0.00 0.00 173.10 175.59 2inf s LEU 265 N -0.14 2.69 0.00 0.66 1.43 0.53 -4.75 118.68 119.11 2inf s LEU 265 Ca 0.47 -0.38 -0.03 0.00 -1.03 0.00 0.00 54.13 53.15 2inf s LEU 265 Cb -0.24 -1.57 0.10 0.00 0.03 0.00 0.00 46.19 44.51 2inf s LEU 265 CO 0.30 0.26 0.65 -0.90 0.23 0.00 0.00 176.35 176.90 2inf n ASP 266 N 1.56 0.54 0.00 2.29 3.85 -1.26 -3.88 116.55 119.66 2inf n ASP 266 Ca -0.16 -1.53 0.12 0.00 -0.71 0.00 0.00 54.79 52.50 2inf n ASP 266 Cb 0.52 -0.45 0.58 0.00 -1.35 0.00 0.00 41.12 40.42 2inf n ASP 266 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 177.20 173.52 2inf n TRP 267 N -2.54 0.00 1.11 2.11 2.14 -1.21 -3.25 117.44 115.80 2inf n TRP 267 Ca 0.10 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.79 2inf n TRP 267 Cb 0.34 -0.32 0.17 0.00 -0.81 0.00 0.00 31.31 30.69 2inf n TRP 267 CO 0.00 0.00 0.00 0.54 2.07 0.00 0.00 177.69 180.30 2inf n ARG 268 N -1.32 1.10 -3.95 -2.67 1.74 -1.26 -4.55 116.66 105.74 2inf n ARG 268 Ca 0.10 -0.82 -0.31 0.00 -0.77 0.00 0.00 57.85 56.06 2inf n ARG 268 Cb 0.21 -1.48 -0.15 0.00 -1.02 0.00 0.00 32.46 30.01 2inf n ARG 268 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2inf s LEU 269 N -2.46 3.46 0.79 0.55 2.96 -1.20 -5.04 118.68 117.74 2inf s LEU 269 Ca 0.22 -1.66 -0.12 0.00 -0.22 0.00 0.00 54.13 52.35 2inf s LEU 269 Cb 0.19 -1.35 0.07 0.00 0.50 0.00 0.00 46.19 45.61 2inf s LEU 269 CO 0.54 -0.31 1.14 -0.83 -1.32 0.00 0.00 176.35 175.56 2inf s GLY 270 N 1.21 1.91 0.06 7.98 0.00 -1.26 -4.70 107.32 112.52 2inf s GLY 270 Ca 0.03 0.57 -0.33 0.00 0.00 0.00 0.00 44.72 44.98 2inf s GLY 270 CO -0.10 0.95 1.58 -2.22 0.00 0.00 0.00 173.10 173.31 2inf h ILE 271 N -1.02 0.30 -0.75 0.90 2.04 -1.95 -0.36 117.51 116.67 2inf h ILE 271 Ca -0.45 -0.04 0.13 0.00 1.00 0.00 0.00 64.86 65.51 2inf h ILE 271 Cb 1.26 0.31 -0.09 0.00 -0.74 0.00 0.00 36.82 37.56 2inf h ILE 271 CO 0.48 0.00 0.32 0.44 0.00 0.00 0.00 178.15 179.40 2inf h ASP 272 N -0.98 0.34 -0.17 1.72 3.32 -1.95 -0.02 116.42 118.69 2inf h ASP 272 Ca -0.10 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.07 2inf h ASP 272 Cb 0.73 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 2inf h ASP 272 CO 0.16 0.15 0.06 -0.08 -1.72 0.00 0.00 179.24 177.80 2inf h GLU 273 N 0.49 0.13 -0.47 3.56 4.81 -1.93 -1.97 114.58 119.21 2inf h GLU 273 Ca 0.41 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.68 2inf h GLU 273 Cb 0.58 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.88 2inf h GLU 273 CO -0.37 0.09 0.20 0.00 -0.73 0.00 0.00 179.01 178.20 2inf h ALA 274 N 1.11 0.58 -0.36 2.92 0.00 -0.19 -2.21 119.26 121.11 2inf h ALA 274 Ca 0.07 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.08 2inf h ALA 274 Cb 0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2inf h ALA 274 CO -0.08 -0.17 0.03 0.00 0.00 0.00 0.00 179.25 179.04 2inf h ARG 275 N 0.41 0.14 0.00 0.00 -0.00 -0.85 -0.20 114.38 113.87 2inf h ARG 275 Ca 0.21 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.68 2inf h ARG 275 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 30.10 2inf h ARG 275 CO -0.18 0.09 0.00 0.66 0.00 0.00 0.00 179.97 180.54 2inf h SER 276 N 0.14 0.00 -0.01 7.04 4.64 -1.04 -0.95 113.55 123.36 2inf h SER 276 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2inf h SER 276 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2inf h SER 276 CO -0.26 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.99 2inf n LYS 277 N -2.73 1.26 -0.57 4.77 5.02 -0.86 -4.91 118.16 120.13 2inf n LYS 277 Ca 0.01 -0.38 0.00 0.00 -2.02 0.00 0.00 58.31 55.93 2inf n LYS 277 Cb 0.29 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 2inf n LYS 277 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2inf n GLY 278 N 1.05 0.67 3.53 0.72 0.00 -0.36 -5.02 105.19 105.77 2inf n GLY 278 Ca 0.21 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2inf n GLY 278 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2inf s ILE 279 N -2.00 3.99 -0.07 -0.61 1.01 -0.14 -4.84 121.20 118.53 2inf s ILE 279 Ca 0.00 0.33 0.17 0.00 0.00 0.00 0.00 60.65 61.14 2inf s ILE 279 Cb 0.00 -4.79 -0.25 0.00 0.01 0.00 0.00 42.46 37.43 2inf s ILE 279 CO 0.00 -1.58 0.27 1.07 0.00 0.00 0.00 174.94 174.69 2inf n THR 280 N 6.32 0.41 -0.72 2.92 5.66 -1.26 -4.11 114.28 123.49 2inf n THR 280 Ca 0.02 -0.51 -0.29 0.00 -3.05 0.00 0.00 64.05 60.22 2inf n THR 280 Cb 0.48 -0.14 0.20 0.00 -1.55 0.00 0.00 70.33 69.32 2inf n THR 280 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2inf s LYS 281 N -2.93 0.12 0.62 1.09 1.02 -1.26 -4.94 119.74 113.46 2inf s LYS 281 Ca -0.07 1.07 -0.18 0.00 0.02 0.00 0.00 55.97 56.81 2inf s LYS 281 Cb 0.09 -1.66 -0.02 0.00 -0.52 0.00 0.00 37.83 35.72 2inf s LYS 281 CO 0.71 -3.09 1.23 0.95 -0.92 0.00 0.00 175.35 174.23 2inf s THR 282 N -2.61 2.46 0.07 2.17 -4.23 -1.16 -4.83 115.64 107.50 2inf s THR 282 Ca 0.67 0.28 0.09 0.00 -1.18 0.00 0.00 61.69 61.55 2inf s THR 282 Cb -0.23 -3.07 -0.03 0.00 1.34 0.00 0.00 72.50 70.51 2inf s THR 282 CO 0.61 -0.07 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.67 2inf s VAL 283 N -1.60 2.08 -0.04 2.29 1.01 -0.96 -1.20 120.40 121.99 2inf s VAL 283 Ca 0.78 -1.45 0.03 0.00 0.00 0.00 0.00 61.98 61.34 2inf s VAL 283 Cb -0.32 -1.80 -0.00 0.00 0.00 0.00 0.00 36.38 34.26 2inf s VAL 283 CO 0.36 0.26 -0.13 -1.58 0.00 0.00 0.00 175.10 174.01 2inf s GLN 284 N -1.44 1.40 0.38 2.72 0.74 0.33 -1.72 119.66 122.06 2inf s GLN 284 Ca 0.11 -0.46 0.00 0.00 0.05 0.00 0.00 55.36 55.06 2inf s GLN 284 Cb -0.10 -1.25 0.00 0.00 1.10 0.00 0.00 33.01 32.77 2inf s GLN 284 CO 0.03 0.18 0.00 0.41 -0.55 0.00 0.00 175.29 175.36 2inf n GLY 285 N 3.22 -3.37 0.00 2.59 0.00 0.21 -0.35 105.19 107.49 2inf n GLY 285 Ca -0.18 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2inf n GLY 285 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2inf n ASN 286 N -2.78 0.00 -4.67 1.61 2.85 0.04 -3.81 115.26 108.50 2inf n ASN 286 Ca -0.03 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 54.00 2inf n ASN 286 Cb 0.36 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.34 2inf n ASN 286 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2inf n LEU 287 N -0.48 3.88 -4.63 1.20 7.94 -1.10 -3.36 117.00 120.44 2inf n LEU 287 Ca 0.00 0.94 -0.45 0.00 -1.11 0.00 0.00 56.01 55.39 2inf n LEU 287 Cb 0.00 -1.47 -0.04 0.00 0.53 0.00 0.00 43.42 42.44 2inf n LEU 287 CO 0.00 0.10 1.64 -0.67 -1.11 0.00 0.00 177.39 177.35 2inf n ASP 288 N 6.89 3.52 0.09 1.96 -0.08 -1.26 0.70 116.55 128.37 2inf n ASP 288 Ca 0.21 0.73 0.18 0.00 -1.51 0.00 0.00 54.79 54.39 2inf n ASP 288 Cb 0.36 -1.45 0.72 0.00 2.34 0.00 0.00 41.12 43.09 2inf n ASP 288 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2inf h PRO 289 N 11.28 0.00 -0.36 -0.67 0.11 -1.90 -0.79 132.00 139.67 2inf h PRO 289 Ca -0.45 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.74 2inf h PRO 289 Cb 1.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 2inf h PRO 289 CO 0.96 0.00 0.25 0.66 -0.21 0.00 0.00 178.00 179.65 2inf h SER 290 N 0.00 0.10 0.01 -2.05 4.64 -1.96 -0.80 113.55 113.50 2inf h SER 290 Ca 0.17 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2inf h SER 290 Cb 0.76 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 2inf h SER 290 CO -0.00 0.06 -0.01 0.40 -0.87 0.00 0.00 176.83 176.41 2inf h ILE 291 N 0.11 0.88 0.00 0.95 2.04 -1.52 -2.63 117.51 117.34 2inf h ILE 291 Ca 0.17 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.00 2inf h ILE 291 Cb 0.51 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2inf h ILE 291 CO -0.02 0.01 0.00 0.18 0.00 0.00 0.00 178.15 178.32 2inf n LEU 292 N -4.34 0.12 0.01 1.44 4.77 -0.30 -1.14 117.00 117.55 2inf n LEU 292 Ca -0.03 0.55 0.11 0.00 -0.03 0.00 0.00 56.01 56.61 2inf n LEU 292 Cb 0.10 -0.56 -0.08 0.00 -2.33 0.00 0.00 43.42 40.55 2inf n LEU 292 CO 0.32 -0.53 -0.31 0.18 -1.33 0.00 0.00 177.39 175.72 2inf n LEU 293 N -1.65 0.47 -4.70 2.23 4.77 -0.99 -4.80 117.00 112.33 2inf n LEU 293 Ca 0.00 -0.07 -0.30 0.00 -0.03 0.00 0.00 56.01 55.61 2inf n LEU 293 Cb 0.04 -0.04 0.14 0.00 -2.33 0.00 0.00 43.42 41.24 2inf n LEU 293 CO 0.05 0.04 0.66 0.00 -1.33 0.00 0.00 177.39 176.81 2inf s ALA 294 N -3.30 1.46 0.79 -1.18 0.00 -0.29 -5.01 121.76 114.23 2inf s ALA 294 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 51.96 51.82 2inf s ALA 294 Cb 0.14 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 20.10 2inf s ALA 294 CO 0.86 -2.44 1.10 -2.30 0.00 0.00 0.00 175.76 172.98 2inf n PRO 295 N -3.95 0.24 -0.29 0.00 -0.02 -1.26 -4.77 135.00 124.95 2inf n PRO 295 Ca 0.07 0.15 0.14 0.00 -2.02 0.00 0.00 63.50 61.84 2inf n PRO 295 Cb 0.55 -2.35 0.39 0.00 -0.02 0.00 0.00 33.50 32.06 2inf n PRO 295 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 2inf h TRP 296 N -0.77 0.84 -0.68 6.00 2.91 -1.94 -1.40 115.95 120.89 2inf h TRP 296 Ca -0.46 0.03 0.09 0.00 1.13 0.00 0.00 58.89 59.67 2inf h TRP 296 Cb 1.31 -0.26 -0.07 0.00 -0.51 0.00 0.00 29.16 29.63 2inf h TRP 296 CO 0.44 0.25 0.32 1.49 -1.03 0.00 0.00 178.44 179.92 2inf h GLU 297 N 0.66 0.54 -0.06 2.65 4.81 -1.99 0.20 114.58 121.38 2inf h GLU 297 Ca 0.49 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.68 2inf h GLU 297 Cb 0.88 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 2inf h GLU 297 CO -0.25 0.36 -0.02 0.28 -0.73 0.00 0.00 179.01 178.65 2inf h VAL 298 N 0.55 1.31 -0.66 0.32 2.07 -1.62 -2.00 116.25 116.22 2inf h VAL 298 Ca 0.34 -0.97 0.12 0.00 0.82 0.00 0.00 66.70 67.01 2inf h VAL 298 Cb 0.37 1.83 -0.08 0.00 -1.52 0.00 0.00 31.29 31.89 2inf h VAL 298 CO -0.28 0.27 0.23 0.40 0.02 0.00 0.00 177.57 178.20 2inf h ILE 299 N -0.23 0.69 -0.00 4.57 2.04 -1.06 -1.22 117.51 122.31 2inf h ILE 299 Ca 0.02 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2inf h ILE 299 Cb 0.43 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2inf h ILE 299 CO 0.01 0.07 0.00 -0.08 0.00 0.00 0.00 178.15 178.15 2inf h GLU 300 N 0.38 0.00 -0.46 2.37 4.81 -0.60 -1.41 114.58 119.68 2inf h GLU 300 Ca 0.35 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.61 2inf h GLU 300 Cb 0.49 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 2inf h GLU 300 CO -0.37 0.29 0.24 0.37 -0.73 0.00 0.00 179.01 178.81 2inf h GLN 301 N -0.28 0.47 -0.30 1.92 -0.00 -1.04 -0.11 115.11 115.77 2inf h GLN 301 Ca 0.00 -0.03 -0.15 0.00 -0.00 0.00 0.00 58.65 58.47 2inf h GLN 301 Cb 0.28 -0.11 -0.01 0.00 0.00 0.00 0.00 27.48 27.65 2inf h GLN 301 CO 0.00 0.31 -0.41 0.87 0.00 0.00 0.00 178.83 179.60 2inf h LYS 302 N 0.49 0.74 -0.26 1.69 1.79 -1.23 -2.44 116.57 117.34 2inf h LYS 302 Ca 0.19 -0.39 -0.14 0.00 -2.18 0.00 0.00 60.65 58.14 2inf h LYS 302 Cb 0.08 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2inf h LYS 302 CO -0.12 1.01 -0.38 1.15 -1.08 0.00 0.00 179.45 180.02 2inf h THR 303 N 0.60 1.31 -0.53 -0.16 2.02 -1.03 -2.88 112.91 112.25 2inf h THR 303 Ca 0.05 -1.58 0.10 0.00 0.77 0.00 0.00 66.41 65.74 2inf h THR 303 Cb 0.96 1.70 -0.08 0.00 -1.74 0.00 0.00 68.15 68.99 2inf h THR 303 CO 0.09 0.50 0.08 0.50 0.37 0.00 0.00 175.52 177.07 2inf h LYS 304 N 0.44 0.21 -0.53 6.66 3.64 -0.97 -0.38 116.57 125.63 2inf h LYS 304 Ca 0.02 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.48 2inf h LYS 304 Cb 0.98 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.68 2inf h LYS 304 CO 0.09 0.14 0.16 0.93 -2.27 0.00 0.00 179.45 178.49 2inf h GLU 305 N 0.21 0.30 -0.35 1.90 5.08 -1.38 0.29 114.58 120.64 2inf h GLU 305 Ca 0.27 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.51 2inf h GLU 305 Cb 0.38 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2inf h GLU 305 CO -0.37 0.20 -0.17 0.82 -1.00 0.00 0.00 179.01 178.50 2inf h ILE 306 N 0.31 1.29 -0.13 3.13 2.04 -1.24 -2.52 117.51 120.39 2inf h ILE 306 Ca 0.26 -1.28 -0.00 0.00 1.00 0.00 0.00 64.86 64.84 2inf h ILE 306 Cb 0.33 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 2inf h ILE 306 CO -0.30 0.42 0.08 -0.07 0.00 0.00 0.00 178.15 178.28 2inf h LEU 307 N 0.51 0.15 -1.58 1.44 3.38 -0.71 0.19 115.31 118.69 2inf h LEU 307 Ca 0.08 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.12 2inf h LEU 307 Cb 0.70 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 2inf h LEU 307 CO 0.05 0.15 0.45 0.44 0.09 0.00 0.00 178.44 179.61 2inf h ASP 308 N 0.14 0.42 0.02 -0.43 3.32 -0.95 0.27 116.42 119.21 2inf h ASP 308 Ca 0.05 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 2inf h ASP 308 Cb 0.02 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.51 2inf h ASP 308 CO -0.01 0.24 -0.56 1.56 -1.72 0.00 0.00 179.24 178.76 2inf h GLN 309 N 0.46 0.34 -0.40 3.56 4.20 -1.09 -3.37 115.11 118.80 2inf h GLN 309 Ca 0.31 -0.39 -0.09 0.00 0.06 0.00 0.00 58.65 58.54 2inf h GLN 309 Cb 0.60 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 2inf h GLN 309 CO -0.10 1.09 -0.11 0.78 -0.67 0.00 0.00 178.83 179.82 2inf h GLY 310 N -0.24 0.76 0.56 3.46 0.00 0.26 -3.02 103.07 104.85 2inf h GLY 310 Ca -0.08 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.69 2inf h GLY 310 CO 0.11 0.52 0.00 1.03 0.00 0.00 0.00 176.54 178.20 2inf n MET 311 N -4.17 0.90 0.26 4.80 2.81 0.86 -3.25 117.12 119.32 2inf n MET 311 Ca 0.01 0.00 0.15 0.00 -1.81 0.00 0.00 57.70 56.05 2inf n MET 311 Cb 0.35 -1.28 0.58 0.00 -0.71 0.00 0.00 33.22 32.16 2inf n MET 311 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2inf h GLU 312 N 0.00 0.00 -4.52 0.03 5.08 -1.70 -3.44 114.58 110.03 2inf h GLU 312 Ca 0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 2inf h GLU 312 Cb 0.00 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.10 2inf h GLU 312 CO 0.00 0.06 -0.66 -1.54 -1.00 0.00 0.00 179.01 175.87 2inf s SER 313 N -5.87 0.62 0.37 1.42 1.04 -1.20 -5.06 113.70 105.02 2inf s SER 313 Ca 0.02 -1.16 0.18 0.00 0.48 0.00 0.00 55.95 55.47 2inf s SER 313 Cb 0.09 0.23 0.67 0.00 0.10 0.00 0.00 66.02 67.11 2inf s SER 313 CO 0.58 -0.66 1.73 0.44 0.98 0.00 0.00 173.24 176.31 2inf h ASP 314 N 2.86 0.00 -0.49 7.02 3.32 -1.84 -3.39 116.42 123.90 2inf h ASP 314 Ca -0.35 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.02 2inf h ASP 314 Cb 1.19 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.68 2inf h ASP 314 CO 0.61 0.38 2.53 0.61 -1.72 0.00 0.00 179.24 181.66 2inf n GLY 315 N 0.22 3.24 3.33 2.75 0.00 -1.26 -4.49 105.19 108.99 2inf n GLY 315 Ca -0.00 -1.48 -0.08 0.00 0.00 0.00 0.00 46.02 44.46 2inf n GLY 315 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2inf s PHE 316 N 4.10 -0.85 -0.19 1.61 5.36 -1.25 -2.27 117.98 124.50 2inf s PHE 316 Ca 0.52 1.62 -0.00 0.00 -0.96 0.00 0.00 56.93 58.10 2inf s PHE 316 Cb 0.08 0.38 0.01 0.00 -0.34 0.00 0.00 43.02 43.15 2inf s PHE 316 CO 0.02 -0.49 -0.16 0.42 -1.46 0.00 0.00 175.22 173.56 2inf s ILE 317 N 2.41 2.44 0.21 3.12 1.01 -0.70 -4.46 121.20 125.24 2inf s ILE 317 Ca -0.04 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.50 2inf s ILE 317 Cb -0.11 -2.05 -0.08 0.00 0.01 0.00 0.00 42.46 40.22 2inf s ILE 317 CO -0.14 0.51 1.17 0.12 0.00 0.00 0.00 174.94 176.60 2inf s PHE 318 N 1.31 3.46 0.30 3.97 5.36 -0.51 -0.62 117.98 131.25 2inf s PHE 318 Ca 0.05 1.49 -0.19 0.00 -0.96 0.00 0.00 56.93 57.31 2inf s PHE 318 Cb -0.13 -3.40 0.04 0.00 -0.34 0.00 0.00 43.02 39.18 2inf s PHE 318 CO -0.10 -1.05 0.77 1.21 -1.46 0.00 0.00 175.22 174.59 2inf s ASN 319 N -0.09 -0.15 0.83 6.13 3.84 -1.26 -2.93 114.94 121.31 2inf s ASN 319 Ca 0.51 -0.78 -0.12 0.00 0.21 0.00 0.00 52.86 52.67 2inf s ASN 319 Cb -0.32 0.75 0.09 0.00 -0.55 0.00 0.00 41.25 41.22 2inf s ASN 319 CO 0.38 -1.43 1.19 -0.76 -2.79 0.00 0.00 177.10 173.69 2inf s LEU 320 N -2.99 2.49 0.00 3.21 1.43 -1.26 -0.78 118.68 120.77 2inf s LEU 320 Ca 0.13 0.75 0.22 0.00 -1.03 0.00 0.00 54.13 54.19 2inf s LEU 320 Cb -0.05 -3.19 0.64 0.00 0.03 0.00 0.00 46.19 43.62 2inf s LEU 320 CO 0.08 -2.02 1.50 0.61 0.23 0.00 0.00 176.35 176.75 2inf n GLY 321 N -3.29 0.70 3.86 -3.19 0.00 0.22 -3.36 105.19 100.13 2inf n GLY 321 Ca 0.09 -0.52 -0.03 0.00 0.00 0.00 0.00 46.02 45.55 2inf n GLY 321 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2inf s HIS 322 N -1.73 0.04 0.55 1.61 5.65 -1.26 -4.27 115.29 115.88 2inf s HIS 322 Ca 0.34 -0.43 -0.18 0.00 0.25 0.00 0.00 55.06 55.03 2inf s HIS 322 Cb 0.19 0.69 -0.05 0.00 -1.18 0.00 0.00 32.58 32.23 2inf s HIS 322 CO 0.28 -0.92 1.09 0.20 -0.65 0.00 0.00 174.74 174.74 2inf s GLY 323 N -3.33 2.44 0.23 1.59 0.00 -1.26 -4.68 107.32 102.31 2inf s GLY 323 Ca 0.20 0.65 -0.32 0.00 0.00 0.00 0.00 44.72 45.25 2inf s GLY 323 CO 0.05 0.98 1.68 -0.62 0.00 0.00 0.00 173.10 175.19 2inf n VAL 324 N -1.48 0.32 -4.10 1.40 0.31 0.11 -4.90 118.33 109.98 2inf n VAL 324 Ca 0.10 -0.08 -0.25 0.00 -0.01 0.00 0.00 64.34 64.11 2inf n VAL 324 Cb 0.52 -1.96 -0.05 0.00 -0.91 0.00 0.00 33.84 31.44 2inf n VAL 324 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 2inf s PHE 325 N 0.80 3.12 0.35 3.52 -0.12 -1.26 -4.82 117.98 119.57 2inf s PHE 325 Ca 0.72 -0.06 0.13 0.00 -0.05 0.00 0.00 56.93 57.67 2inf s PHE 325 Cb -0.51 -1.46 0.98 0.00 -0.63 0.00 0.00 43.02 41.39 2inf s PHE 325 CO 0.37 0.52 1.75 -1.35 -0.05 0.00 0.00 175.22 176.47 2inf h PRO 326 N 2.08 0.49 -0.53 1.99 0.11 -1.96 -1.80 132.00 132.38 2inf h PRO 326 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2inf h PRO 326 Cb 1.21 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2inf h PRO 326 CO 0.62 0.33 0.00 -0.40 -0.21 0.00 0.00 178.00 178.34 2inf n ASP 327 N -4.76 2.88 -4.73 -2.05 5.68 -1.26 -3.72 116.55 108.59 2inf n ASP 327 Ca 0.26 -2.11 -0.42 0.00 -0.50 0.00 0.00 54.79 52.02 2inf n ASP 327 Cb 0.80 -0.38 -0.03 0.00 -1.14 0.00 0.00 41.12 40.37 2inf n ASP 327 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2inf s VAL 328 N -1.50 2.95 0.02 2.12 1.01 -0.68 -5.00 120.40 119.33 2inf s VAL 328 Ca 0.33 0.73 -0.30 0.00 0.00 0.00 0.00 61.98 62.74 2inf s VAL 328 Cb 0.19 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 2inf s VAL 328 CO 0.20 0.08 1.10 -0.55 0.00 0.00 0.00 175.10 175.93 2inf s SER 329 N 0.78 7.21 0.41 3.32 0.15 -1.26 -4.78 113.70 119.52 2inf s SER 329 Ca 0.63 1.83 0.07 0.00 0.70 0.00 0.00 55.95 59.19 2inf s SER 329 Cb -0.40 -2.57 0.86 0.00 -1.71 0.00 0.00 66.02 62.20 2inf s SER 329 CO 0.35 -0.39 2.05 -0.65 1.20 0.00 0.00 173.24 175.81 2inf h PRO 330 N 6.86 0.52 -0.31 5.44 0.11 -1.95 -2.59 132.00 140.07 2inf h PRO 330 Ca -0.40 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.62 2inf h PRO 330 Cb 1.21 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2inf h PRO 330 CO 0.79 0.35 -0.00 0.93 -0.21 0.00 0.00 178.00 179.86 2inf h GLU 331 N 0.53 0.48 -0.32 1.05 5.08 -1.98 -1.06 114.58 118.36 2inf h GLU 331 Ca 0.14 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 2inf h GLU 331 Cb -0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2inf h GLU 331 CO -0.03 0.51 -0.15 0.28 -1.00 0.00 0.00 179.01 178.62 2inf h VAL 332 N 0.46 1.29 -0.39 3.13 2.07 -1.88 -1.56 116.25 119.37 2inf h VAL 332 Ca 0.10 -1.26 -0.10 0.00 0.82 0.00 0.00 66.70 66.26 2inf h VAL 332 Cb 0.31 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 2inf h VAL 332 CO 0.01 0.41 -0.16 -0.07 0.02 0.00 0.00 177.57 177.78 2inf h LEU 333 N 0.43 0.72 0.08 2.57 3.38 -1.27 0.91 115.31 122.14 2inf h LEU 333 Ca 0.07 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.82 2inf h LEU 333 Cb 0.68 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2inf h LEU 333 CO 0.05 0.89 -0.16 0.50 0.09 0.00 0.00 178.44 179.81 2inf h LYS 334 N 0.65 -0.30 -0.44 1.13 3.64 -1.14 -1.42 116.57 118.69 2inf h LYS 334 Ca 0.10 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2inf h LYS 334 Cb 0.63 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 2inf h LYS 334 CO 0.04 -0.20 0.23 -0.22 -2.27 0.00 0.00 179.45 177.04 2inf h LYS 335 N -0.31 0.63 -0.83 1.90 3.64 -0.96 -2.63 116.57 118.01 2inf h LYS 335 Ca 0.03 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2inf h LYS 335 Cb 0.33 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.99 2inf h LYS 335 CO -0.09 0.52 0.55 1.25 -2.27 0.00 0.00 179.45 179.40 2inf h LEU 336 N 0.58 0.94 -0.01 5.20 5.85 -0.78 -1.83 115.31 125.26 2inf h LEU 336 Ca 0.15 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2inf h LEU 336 Cb 0.08 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 2inf h LEU 336 CO -0.02 0.67 0.00 0.74 -0.34 0.00 0.00 178.44 179.49 2inf h THR 337 N 1.11 1.07 -0.87 1.05 2.02 -1.00 -0.24 112.91 116.05 2inf h THR 337 Ca 0.31 -0.21 0.06 0.00 0.77 0.00 0.00 66.41 67.34 2inf h THR 337 Cb -0.10 1.20 -0.06 0.00 -1.74 0.00 0.00 68.15 67.45 2inf h THR 337 CO -0.08 0.06 0.54 0.00 0.37 0.00 0.00 175.52 176.41 2inf h ALA 338 N 0.91 1.21 -0.34 6.16 0.00 -1.35 -1.47 119.26 124.39 2inf h ALA 338 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2inf h ALA 338 Cb 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2inf h ALA 338 CO -0.00 0.28 0.02 0.35 0.00 0.00 0.00 179.25 179.90 2inf h PHE 339 N 0.98 0.63 -0.65 0.00 3.57 -1.02 0.14 116.94 120.59 2inf h PHE 339 Ca 0.38 -0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.81 2inf h PHE 339 Cb 0.19 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 2inf h PHE 339 CO -0.03 0.68 0.40 0.28 -2.23 0.00 0.00 178.31 177.42 2inf h VAL 340 N 0.40 1.07 0.12 1.41 2.07 -0.73 -0.29 116.25 120.30 2inf h VAL 340 Ca 0.10 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 2inf h VAL 340 Cb 0.42 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 2inf h VAL 340 CO 0.01 0.14 -0.06 0.45 0.02 0.00 0.00 177.57 178.14 2inf h HIS 341 N 0.78 -0.15 0.02 1.57 3.86 -1.05 -2.14 115.15 118.03 2inf h HIS 341 Ca 0.27 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2inf h HIS 341 Cb 0.04 0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2inf h HIS 341 CO -0.05 0.08 -0.01 0.93 0.86 0.00 0.00 177.93 179.74 2inf h GLU 342 N -0.37 -0.02 -0.19 2.45 5.08 -0.89 -1.63 114.58 119.01 2inf h GLU 342 Ca -0.02 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2inf h GLU 342 Cb 0.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2inf h GLU 342 CO 0.03 0.19 0.04 -0.92 -1.00 0.00 0.00 179.01 177.34 2inf h TYR 343 N -0.23 0.07 -0.33 4.33 3.20 -1.13 -1.82 116.97 121.05 2inf h TYR 343 Ca -0.00 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.76 2inf h TYR 343 Cb 0.22 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 2inf h TYR 343 CO -0.01 0.02 -0.27 0.66 -1.64 0.00 0.00 178.16 176.92 2inf h SER 344 N 0.12 0.71 0.09 -2.11 4.64 -1.41 -2.45 113.55 113.14 2inf h SER 344 Ca 0.09 -0.27 -0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2inf h SER 344 Cb 0.08 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2inf h SER 344 CO -0.11 0.94 -0.04 -0.61 -0.87 0.00 0.00 176.83 176.14 2inf h GLN 345 N 0.59 -0.12 -0.59 4.77 4.15 -1.17 -1.40 115.11 121.35 2inf h GLN 345 Ca 0.08 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.59 2inf h GLN 345 Cb 0.77 0.03 -0.07 0.00 0.21 0.00 0.00 27.48 28.42 2inf h GLN 345 CO 0.06 -0.04 0.22 -0.91 -1.93 0.00 0.00 178.83 176.23 2inf h ASN 346 N -0.16 0.23 -0.47 -0.69 2.35 -1.28 -1.96 115.58 113.60 2inf h ASN 346 Ca -0.01 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2inf h ASN 346 Cb 0.13 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 2inf h ASN 346 CO 0.02 0.14 0.15 0.50 -1.65 0.00 0.00 177.43 176.60 2inf h LYS 347 N 0.41 0.72 0.00 0.81 1.63 -1.32 -3.12 116.57 115.69 2inf h LYS 347 Ca 0.29 -0.15 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 2inf h LYS 347 Cb 0.35 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 2inf h LYS 347 CO -0.29 0.68 0.00 0.87 -3.45 0.00 0.00 179.45 177.26 2inf h LYS 348 N 0.62 0.00 0.00 1.90 1.57 -0.98 -3.52 116.57 116.16 2inf h LYS 348 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2inf h LYS 348 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2inf h LYS 348 CO -0.01 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.54