#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wtd s ASN 2 N 0.00 5.46 0.25 6.12 4.22 -1.26 -4.96 114.94 124.77 1wtd s ASN 2 Ca 0.00 -0.01 -0.09 0.00 -2.14 0.00 0.00 52.86 50.62 1wtd s ASN 2 Cb 0.00 -1.46 0.40 0.00 1.28 0.00 0.00 41.25 41.47 1wtd s ASN 2 CO 0.00 0.19 1.61 0.50 -2.04 0.00 0.00 177.10 177.36 1wtd h LYS 3 N 3.47 0.04 0.00 3.55 3.64 -2.00 -1.03 116.57 124.24 1wtd h LYS 3 Ca -0.47 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 1wtd h LYS 3 Cb 1.17 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1wtd h LYS 3 CO 0.64 0.02 -0.08 1.96 -2.27 0.00 0.00 179.45 179.73 1wtd h GLN 4 N 0.04 0.00 0.12 1.90 1.08 -1.98 -2.03 115.11 114.24 1wtd h GLN 4 Ca 0.41 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 57.39 1wtd h GLN 4 Cb 0.68 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.13 1wtd h GLN 4 CO -0.76 0.08 -0.93 0.93 -0.95 0.00 0.00 178.83 177.19 1wtd h GLU 5 N 0.00 0.41 -0.67 1.46 3.07 -1.61 -1.31 114.58 115.94 1wtd h GLU 5 Ca -0.00 -0.61 -0.03 0.00 -0.50 0.00 0.00 59.36 58.22 1wtd h GLU 5 Cb 0.81 0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 28.90 1wtd h GLU 5 CO 0.01 1.27 0.29 0.28 -1.40 0.00 0.00 179.01 179.45 1wtd h VAL 6 N -0.13 1.23 0.22 3.13 2.07 -1.41 -2.39 116.25 118.97 1wtd h VAL 6 Ca -0.15 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 1wtd h VAL 6 Cb 1.69 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1wtd h VAL 6 CO 0.18 0.28 -0.11 0.40 0.02 0.00 0.00 177.57 178.34 1wtd h ILE 7 N 0.94 0.85 -0.38 4.57 2.04 -1.41 -1.99 117.51 122.12 1wtd h ILE 7 Ca 0.22 -0.63 0.05 0.00 1.00 0.00 0.00 64.86 65.50 1wtd h ILE 7 Cb 0.17 1.20 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 1wtd h ILE 7 CO -0.02 0.14 0.10 0.25 0.00 0.00 0.00 178.15 178.62 1wtd h LEU 8 N -0.64 0.07 -0.18 1.44 6.46 -1.27 0.77 115.31 121.96 1wtd h LEU 8 Ca -0.03 0.05 -0.18 0.00 -0.12 0.00 0.00 57.88 57.60 1wtd h LEU 8 Cb 0.45 0.06 0.01 0.00 -0.73 0.00 0.00 40.66 40.45 1wtd h LEU 8 CO 0.05 0.08 -0.59 0.11 -0.62 0.00 0.00 178.44 177.47 1wtd h LYS 9 N 0.24 0.72 -0.74 1.25 1.57 -1.49 -1.13 116.57 116.98 1wtd h LYS 9 Ca 0.18 -0.53 -0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1wtd h LYS 9 Cb 0.19 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1wtd h LYS 9 CO -0.21 1.15 0.45 0.28 -0.57 0.00 0.00 179.45 180.55 1wtd h VAL 10 N 0.43 1.21 -0.55 0.50 2.07 -1.26 -1.80 116.25 116.85 1wtd h VAL 10 Ca -0.02 -0.47 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1wtd h VAL 10 Cb 1.21 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1wtd h VAL 10 CO 0.12 0.22 0.04 -0.61 0.02 0.00 0.00 177.57 177.37 1wtd h GLN 11 N 1.02 0.94 -0.80 1.57 4.15 -0.74 0.61 115.11 121.87 1wtd h GLN 11 Ca 0.27 -0.28 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 1wtd h GLN 11 Cb -0.03 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.52 1wtd h GLN 11 CO -0.05 0.93 0.39 1.49 -1.93 0.00 0.00 178.83 179.66 1wtd h GLU 12 N 0.83 1.14 -0.22 1.69 4.81 -1.10 -2.09 114.58 119.63 1wtd h GLU 12 Ca 0.16 -0.16 -0.18 0.00 -0.13 0.00 0.00 59.36 59.06 1wtd h GLU 12 Cb 0.48 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1wtd h GLU 12 CO 0.02 0.87 -0.55 0.00 -0.73 0.00 0.00 179.01 178.62 1wtd h ALA 14 N 0.61 1.38 -0.17 0.00 0.00 -0.75 -2.75 119.26 117.57 1wtd h ALA 14 Ca -0.01 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1wtd h ALA 14 Cb 1.16 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1wtd h ALA 14 CO 0.12 0.11 -0.06 0.00 0.00 0.00 0.00 179.25 179.42 1wtd h ALA 15 N 1.91 0.24 -0.86 0.00 0.00 -1.39 -0.36 119.26 118.80 1wtd h ALA 15 Ca -0.00 -0.26 0.16 0.00 0.00 0.00 0.00 54.91 54.81 1wtd h ALA 15 Cb 0.24 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.87 1wtd h ALA 15 CO 0.01 0.03 0.43 -1.49 0.00 0.00 0.00 179.25 178.23 1wtd h TRP 16 N 0.04 0.75 -0.14 0.00 4.06 -1.54 -0.53 115.95 118.59 1wtd h TRP 16 Ca 0.04 0.04 -0.10 0.00 2.06 0.00 0.00 58.89 60.93 1wtd h TRP 16 Cb 0.51 -0.20 0.00 0.00 -1.00 0.00 0.00 29.16 28.47 1wtd h TRP 16 CO 0.06 0.14 -0.30 2.35 -3.56 0.00 0.00 178.44 177.13 1wtd h TRP 17 N 0.58 0.56 -0.59 0.49 7.01 -1.39 -0.77 115.95 121.84 1wtd h TRP 17 Ca 0.48 -0.21 0.03 0.00 2.11 0.00 0.00 58.89 61.31 1wtd h TRP 17 Cb 0.74 -0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 27.66 1wtd h TRP 17 CO -0.10 0.92 0.35 0.82 -2.79 0.00 0.00 178.44 177.64 1wtd h ILE 18 N 0.05 1.04 0.11 2.65 2.04 -0.84 0.26 117.51 122.82 1wtd h ILE 18 Ca 0.00 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1wtd h ILE 18 Cb 0.90 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 1wtd h ILE 18 CO 0.07 0.12 -0.22 0.25 0.00 0.00 0.00 178.15 178.37 1wtd h LEU 19 N 0.68 -0.62 -1.04 1.44 6.46 -1.06 0.12 115.31 121.28 1wtd h LEU 19 Ca 0.24 0.07 0.11 0.00 -0.12 0.00 0.00 57.88 58.19 1wtd h LEU 19 Cb 0.06 0.23 -0.08 0.00 -0.73 0.00 0.00 40.66 40.14 1wtd h LEU 19 CO -0.12 -0.30 0.63 -0.08 -0.62 0.00 0.00 178.44 177.95 1wtd h GLU 20 N -0.41 0.96 -0.27 1.25 4.81 -0.74 -0.94 114.58 119.24 1wtd h GLU 20 Ca 0.03 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.06 1wtd h GLU 20 Cb 0.43 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1wtd h GLU 20 CO -0.12 0.64 -0.40 0.00 -0.73 0.00 0.00 179.01 178.39 1wtd h ARG 21 N 0.99 0.65 -0.33 1.92 2.47 -0.42 -3.10 114.38 116.57 1wtd h ARG 21 Ca 0.48 -0.33 -0.06 0.00 -1.26 0.00 0.00 59.98 58.80 1wtd h ARG 21 Cb 0.46 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.77 1wtd h ARG 21 CO -0.24 0.94 -0.07 1.96 0.56 0.00 0.00 179.97 183.12 1wtd h GLN 22 N 0.54 0.54 -0.34 0.04 1.08 0.21 -2.67 115.11 114.50 1wtd h GLN 22 Ca 0.05 -0.14 0.10 0.00 -1.45 0.00 0.00 58.65 57.20 1wtd h GLN 22 Cb 0.92 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.27 1wtd h GLN 22 CO 0.08 0.61 0.28 0.66 -0.95 0.00 0.00 178.83 179.51 1wtd h SER 23 N 0.51 0.00 0.26 1.46 4.64 -1.13 -2.55 113.55 116.74 1wtd h SER 23 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1wtd h SER 23 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1wtd h SER 23 CO 0.02 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.27 1wtd n LYS 24 N -4.18 0.15 -0.84 4.77 4.76 -1.01 -3.92 118.16 117.89 1wtd n LYS 24 Ca 0.05 0.19 0.05 0.00 -2.87 0.00 0.00 58.31 55.73 1wtd n LYS 24 Cb 0.45 -1.50 0.37 0.00 -1.84 0.00 0.00 35.03 32.50 1wtd n LYS 24 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1wtd n LEU 25 N -1.32 5.41 -4.99 -0.35 4.77 -0.96 -4.71 117.00 114.85 1wtd n LEU 25 Ca 0.05 -2.75 -0.19 0.00 -0.03 0.00 0.00 56.01 53.09 1wtd n LEU 25 Cb 0.10 -0.68 -0.00 0.00 -2.33 0.00 0.00 43.42 40.51 1wtd n LEU 25 CO 0.10 0.61 0.06 0.42 -1.33 0.00 0.00 177.39 177.25 1wtd s THR 26 N -2.64 4.09 0.17 -5.08 -4.23 -1.25 -4.76 115.64 101.94 1wtd s THR 26 Ca 0.50 -0.99 -0.17 0.00 -1.18 0.00 0.00 61.69 59.86 1wtd s THR 26 Cb 0.39 -3.42 0.09 0.00 1.34 0.00 0.00 72.50 70.90 1wtd s THR 26 CO 0.14 -0.16 1.67 0.07 -0.54 0.00 0.00 174.62 175.81 1wtd h LYS 27 N 0.89 0.02 -0.91 3.99 -0.00 -1.96 -1.64 116.57 116.96 1wtd h LYS 27 Ca -0.46 -0.00 0.04 0.00 -0.00 0.00 0.00 60.65 60.23 1wtd h LYS 27 Cb 1.26 -0.00 -0.06 0.00 -0.00 0.00 0.00 32.23 33.43 1wtd h LYS 27 CO 0.53 0.01 0.58 1.25 -0.00 0.00 0.00 179.45 181.82 1wtd h LEU 28 N 0.02 0.96 -1.60 7.07 5.85 -1.98 -2.15 115.31 123.48 1wtd h LEU 28 Ca 0.20 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1wtd h LEU 28 Cb 0.30 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1wtd h LEU 28 CO -0.40 0.65 -0.22 -0.03 -0.34 0.00 0.00 178.44 178.10 1wtd h MET 29 N 1.12 0.00 -0.10 1.25 4.05 -1.64 -2.83 114.93 116.79 1wtd h MET 29 Ca 0.37 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.82 1wtd h MET 29 Cb 0.04 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.83 1wtd h MET 29 CO -0.13 0.22 0.07 0.66 0.23 0.00 0.00 176.91 177.96 1wtd h SER 30 N 0.00 0.00 0.61 1.39 4.64 -0.76 -0.94 113.55 118.49 1wtd h SER 30 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wtd h SER 30 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1wtd h SER 30 CO 0.03 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.66 1wtd h GLU 31 N 0.00 0.00 0.07 4.77 3.07 -1.60 -2.79 114.58 118.10 1wtd h GLU 31 Ca 0.05 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 58.64 1wtd h GLU 31 Cb 0.19 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1wtd h GLU 31 CO -0.00 0.00 -1.33 1.79 -1.40 0.00 0.00 179.01 178.07 1wtd h THR 32 N 0.00 1.37 -0.11 1.13 1.35 -1.34 -3.45 112.91 111.86 1wtd h THR 32 Ca 0.00 -3.04 -0.56 0.00 -0.55 0.00 0.00 66.41 62.27 1wtd h THR 32 Cb 0.30 2.79 -0.07 0.00 -1.73 0.00 0.00 68.15 69.44 1wtd h THR 32 CO 0.00 0.84 1.66 0.23 -0.25 0.00 0.00 175.52 178.00 1wtd n MET 33 N -3.39 0.08 -1.93 4.72 2.00 -1.06 -4.94 117.12 112.61 1wtd n MET 33 Ca -0.10 0.01 -0.32 0.00 0.00 0.00 0.00 57.70 57.29 1wtd n MET 33 Cb 1.01 -1.62 0.02 0.00 0.00 0.00 0.00 33.22 32.62 1wtd n MET 33 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1wtd s SER 34 N 8.53 5.75 -0.06 7.83 0.15 -1.26 -5.08 113.70 129.56 1wtd s SER 34 Ca 1.30 1.72 -0.03 0.00 0.70 0.00 0.00 55.95 59.64 1wtd s SER 34 Cb -1.24 -2.52 0.04 0.00 -1.71 0.00 0.00 66.02 60.59 1wtd s SER 34 CO 0.51 -1.19 0.13 -0.63 1.20 0.00 0.00 173.24 173.27 1wtd s ILE 35 N -2.68 -0.09 -0.45 6.45 1.01 -1.26 -5.02 121.20 119.17 1wtd s ILE 35 Ca 0.61 0.22 -0.23 0.00 0.00 0.00 0.00 60.65 61.25 1wtd s ILE 35 Cb -0.15 -0.23 0.03 0.00 0.01 0.00 0.00 42.46 42.12 1wtd s ILE 35 CO 0.42 0.09 0.77 0.21 0.00 0.00 0.00 174.94 176.44 1wtd s ASN 36 N 1.38 6.40 0.34 3.58 3.84 -1.26 -4.94 114.94 124.28 1wtd s ASN 36 Ca -0.07 -0.13 0.27 0.00 0.21 0.00 0.00 52.86 53.14 1wtd s ASN 36 Cb -0.12 -2.38 1.00 0.00 -0.55 0.00 0.00 41.25 39.20 1wtd s ASN 36 CO -0.06 -0.90 1.79 1.55 -2.79 0.00 0.00 177.10 176.69 1wtd h PRO 37 N 8.97 0.00 -0.00 0.43 0.13 -1.94 -2.00 132.00 137.58 1wtd h PRO 37 Ca -0.25 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.70 1wtd h PRO 37 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1wtd h PRO 37 CO 0.95 0.00 -0.83 0.74 -0.23 0.00 0.00 178.00 178.63 1wtd h PHE 38 N 0.00 0.18 0.00 1.56 -1.00 -1.94 -3.35 116.94 112.39 1wtd h PHE 38 Ca 0.00 -0.10 0.00 0.00 2.81 0.00 0.00 57.97 60.68 1wtd h PHE 38 Cb 0.52 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.06 1wtd h PHE 38 CO 0.00 0.89 -0.47 0.52 -1.61 0.00 0.00 178.31 177.65 1wtd h MET 39 N 0.07 0.00 -0.94 1.51 2.86 -1.78 -3.38 114.93 113.27 1wtd h MET 39 Ca -0.03 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.72 1wtd h MET 39 Cb 1.45 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 33.04 1wtd h MET 39 CO 0.12 0.00 0.60 1.79 1.06 0.00 0.00 176.91 180.48 1wtd h THR 40 N 0.00 0.95 -0.45 2.22 1.35 -1.67 -2.36 112.91 112.94 1wtd h THR 40 Ca 0.00 -0.32 -0.09 0.00 -0.55 0.00 0.00 66.41 65.45 1wtd h THR 40 Cb 0.85 -0.05 -0.02 0.00 -1.73 0.00 0.00 68.15 67.20 1wtd h THR 40 CO 0.00 0.17 -0.09 -0.65 -0.25 0.00 0.00 175.52 174.69 1wtd h PRO 41 N 0.92 0.80 -0.05 4.72 0.11 -1.85 -2.02 132.00 134.63 1wtd h PRO 41 Ca 0.44 -0.26 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 1wtd h PRO 41 Cb 0.45 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.49 1wtd h PRO 41 CO -0.21 0.87 0.01 0.35 -0.21 0.00 0.00 178.00 178.81 1wtd h PHE 42 N 0.73 0.09 -0.94 0.65 3.57 -1.72 -2.96 116.94 116.36 1wtd h PHE 42 Ca 0.12 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1wtd h PHE 42 Cb 0.58 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.25 1wtd h PHE 42 CO 0.03 0.32 0.61 0.82 -2.23 0.00 0.00 178.31 177.86 1wtd h ILE 43 N -0.17 1.24 -0.77 1.41 2.04 -1.41 0.14 117.51 119.99 1wtd h ILE 43 Ca 0.02 -0.46 0.09 0.00 1.00 0.00 0.00 64.86 65.51 1wtd h ILE 43 Cb 0.28 -0.12 -0.07 0.00 -0.74 0.00 0.00 36.82 36.17 1wtd h ILE 43 CO 0.00 0.24 0.42 0.15 0.00 0.00 0.00 178.15 178.96 1wtd h PHE 44 N 1.27 0.75 0.04 1.37 3.57 -1.32 -2.58 116.94 120.04 1wtd h PHE 44 Ca 0.34 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.68 1wtd h PHE 44 Cb -0.13 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.37 1wtd h PHE 44 CO -0.00 0.29 -1.00 -0.44 -2.23 0.00 0.00 178.31 174.93 1wtd h ASP 45 N 0.70 0.12 -0.91 0.41 3.45 -1.22 0.26 116.42 119.23 1wtd h ASP 45 Ca 0.37 -0.74 0.19 0.00 0.43 0.00 0.00 57.03 57.28 1wtd h ASP 45 Cb 0.36 -0.04 -0.07 0.00 -0.56 0.00 0.00 39.33 39.02 1wtd h ASP 45 CO -0.26 1.41 0.59 0.22 -1.57 0.00 0.00 179.24 179.63 1wtd h TYR 46 N -0.78 0.67 -0.38 4.55 3.20 -0.78 -0.79 116.97 122.66 1wtd h TYR 46 Ca -0.25 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.64 1wtd h TYR 46 Cb 1.37 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.44 1wtd h TYR 46 CO 0.15 0.19 0.00 0.72 -1.64 0.00 0.00 178.16 177.58 1wtd n HIS 47 N -4.55 0.83 -3.82 -3.82 8.25 -0.97 -4.97 115.22 106.16 1wtd n HIS 47 Ca 0.19 -0.66 -0.26 0.00 -0.26 0.00 0.00 57.72 56.74 1wtd n HIS 47 Cb 0.62 -0.17 0.02 0.00 1.12 0.00 0.00 29.99 31.59 1wtd n HIS 47 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1wtd n SER 48 N 0.27 -2.55 -4.85 0.41 7.64 -0.30 -4.93 113.62 109.31 1wtd n SER 48 Ca 0.18 -0.83 -0.32 0.00 1.01 0.00 0.00 58.87 58.91 1wtd n SER 48 Cb 0.68 -3.86 -0.02 0.00 -1.01 0.00 0.00 64.21 60.00 1wtd n SER 48 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1wtd s LEU 49 N -6.96 3.49 -0.03 -3.43 1.43 0.89 -5.02 118.68 109.05 1wtd s LEU 49 Ca 0.28 1.53 0.13 0.00 -1.03 0.00 0.00 54.13 55.04 1wtd s LEU 49 Cb -0.14 -4.50 -0.20 0.00 0.03 0.00 0.00 46.19 41.38 1wtd s LEU 49 CO 0.83 -0.71 0.26 0.59 0.23 0.00 0.00 176.35 177.56 1wtd n ASN 50 N -1.98 1.91 -3.37 2.29 3.02 -1.26 -4.84 115.26 111.02 1wtd n ASN 50 Ca 0.06 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.55 1wtd n ASN 50 Cb 0.54 1.52 0.01 0.00 -0.61 0.00 0.00 39.78 41.23 1wtd n ASN 50 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 1wtd s ASP 51 N -3.68 -0.10 0.36 6.41 1.47 -1.26 -4.72 116.67 115.15 1wtd s ASP 51 Ca -0.05 -0.82 0.06 0.00 1.18 0.00 0.00 52.55 52.92 1wtd s ASP 51 Cb 0.08 0.71 0.68 0.00 -0.34 0.00 0.00 42.92 44.05 1wtd s ASP 51 CO 0.56 -1.38 1.91 0.15 0.68 0.00 0.00 175.17 177.08 1wtd h PHE 52 N 2.00 0.47 -0.69 2.11 3.57 -1.73 -1.31 116.94 121.36 1wtd h PHE 52 Ca -0.27 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.20 1wtd h PHE 52 Cb 1.24 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.81 1wtd h PHE 52 CO 0.96 0.47 0.46 -0.44 -2.23 0.00 0.00 178.31 177.53 1wtd h ASP 53 N 0.45 0.79 -0.21 0.41 5.19 -1.98 -0.86 116.42 120.21 1wtd h ASP 53 Ca 0.10 -0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.43 1wtd h ASP 53 Cb 0.29 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.58 1wtd h ASP 53 CO 0.01 0.57 -0.04 -0.33 -3.12 0.00 0.00 179.24 176.33 1wtd h GLU 54 N 0.93 0.53 0.41 3.56 5.08 -1.67 -1.38 114.58 122.04 1wtd h GLU 54 Ca 0.25 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1wtd h GLU 54 Cb -0.11 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1wtd h GLU 54 CO -0.05 0.59 -0.19 1.25 -1.00 0.00 0.00 179.01 179.60 1wtd h LEU 55 N 0.50 -0.46 -0.80 1.33 5.85 -0.82 -2.81 115.31 118.10 1wtd h LEU 55 Ca 0.10 -0.11 0.10 0.00 0.84 0.00 0.00 57.88 58.81 1wtd h LEU 55 Cb 0.39 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 1wtd h LEU 55 CO 0.02 -0.13 0.45 0.58 -0.34 0.00 0.00 178.44 179.01 1wtd h VAL 56 N -0.82 0.89 -0.98 1.05 2.07 -1.11 -0.43 116.25 116.91 1wtd h VAL 56 Ca -0.06 -0.26 0.10 0.00 0.82 0.00 0.00 66.70 67.31 1wtd h VAL 56 Cb 0.54 0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.32 1wtd h VAL 56 CO 0.09 0.14 0.63 -0.08 0.02 0.00 0.00 177.57 178.36 1wtd h GLU 57 N 0.74 1.00 -0.01 1.57 4.81 -1.26 -1.18 114.58 120.25 1wtd h GLU 57 Ca 0.39 -0.06 -0.22 0.00 -0.13 0.00 0.00 59.36 59.34 1wtd h GLU 57 Cb 0.38 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 1wtd h GLU 57 CO -0.26 0.66 -0.91 0.00 -0.73 0.00 0.00 179.01 177.78 1wtd h ALA 58 N 1.52 0.41 -0.13 2.92 0.00 -0.82 -2.07 119.26 121.09 1wtd h ALA 58 Ca 0.46 -0.70 -0.18 0.00 0.00 0.00 0.00 54.91 54.49 1wtd h ALA 58 Cb 0.38 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1wtd h ALA 58 CO -0.22 0.82 -0.68 0.82 0.00 0.00 0.00 179.25 179.99 1wtd h ILE 59 N 0.22 1.34 0.57 0.00 2.04 -1.14 -2.65 117.51 117.89 1wtd h ILE 59 Ca -0.07 -2.00 -0.03 0.00 1.00 0.00 0.00 64.86 63.77 1wtd h ILE 59 Cb 1.54 1.97 0.01 0.00 -0.74 0.00 0.00 36.82 39.60 1wtd h ILE 59 CO 0.16 0.61 -0.27 0.40 0.00 0.00 0.00 178.15 179.04 1wtd h ILE 60 N 0.38 0.39 -0.99 -0.67 2.04 -1.16 -0.46 117.51 117.03 1wtd h ILE 60 Ca -0.02 -0.22 0.20 0.00 1.00 0.00 0.00 64.86 65.82 1wtd h ILE 60 Cb 1.25 0.47 -0.19 0.00 -0.74 0.00 0.00 36.82 37.61 1wtd h ILE 60 CO 0.12 0.03 -0.23 0.00 0.00 0.00 0.00 178.15 178.08 1wtd h ALA 61 N -0.57 0.68 -0.27 1.87 0.00 -1.42 0.22 119.26 119.77 1wtd h ALA 61 Ca -0.08 0.38 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 1wtd h ALA 61 Cb 0.64 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1wtd h ALA 61 CO 0.13 -0.39 -0.30 -0.22 0.00 0.00 0.00 179.25 178.46 1wtd h LYS 62 N 0.00 0.56 0.18 0.00 3.11 -1.26 -0.98 116.57 118.18 1wtd h LYS 62 Ca 0.48 -0.24 -0.01 0.00 -2.81 0.00 0.00 60.65 58.07 1wtd h LYS 62 Cb 0.75 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.97 1wtd h LYS 62 CO -1.01 0.80 -0.08 1.25 -2.81 0.00 0.00 179.45 177.60 1wtd h HIS 63 N 0.48 -0.22 0.46 1.91 2.76 0.11 -1.71 115.15 118.94 1wtd h HIS 63 Ca 0.06 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 1wtd h HIS 63 Cb 0.77 0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.81 1wtd h HIS 63 CO 0.03 0.03 -0.22 -0.07 -1.30 0.00 0.00 177.93 176.40 1wtd h LEU 64 N -0.46 -0.53 -0.88 0.26 3.38 -1.00 -2.04 115.31 114.05 1wtd h LEU 64 Ca -0.02 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.03 1wtd h LEU 64 Cb 0.35 0.14 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 1wtd h LEU 64 CO 0.04 -0.36 0.53 -0.03 0.09 0.00 0.00 178.44 178.71 1wtd h MET 65 N -0.65 0.90 -0.02 1.13 4.05 -1.19 0.11 114.93 119.26 1wtd h MET 65 Ca -0.06 -0.05 -0.16 0.00 -0.28 0.00 0.00 59.70 59.15 1wtd h MET 65 Cb 0.49 -0.20 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 1wtd h MET 65 CO 0.10 0.59 -0.70 1.15 0.23 0.00 0.00 176.91 178.29 1wtd h THR 66 N 0.92 1.46 -0.91 -0.77 2.02 -1.37 -3.03 112.91 111.24 1wtd h THR 66 Ca 0.40 -2.30 0.00 0.00 0.77 0.00 0.00 66.41 65.29 1wtd h THR 66 Cb 0.28 2.23 -0.04 0.00 -1.74 0.00 0.00 68.15 68.88 1wtd h THR 66 CO -0.21 0.67 0.58 1.23 0.37 0.00 0.00 175.52 178.15 1wtd h GLY 67 N 1.85 1.29 0.74 2.16 0.00 -0.17 -1.52 103.07 107.41 1wtd h GLY 67 Ca -0.01 -0.50 0.02 0.00 0.00 0.00 0.00 47.33 46.84 1wtd h GLY 67 CO 0.10 0.49 -0.07 0.45 0.00 0.00 0.00 176.54 177.51 1wtd h HIS 68 N 1.24 -0.16 0.19 5.60 3.86 -0.78 0.06 115.15 125.15 1wtd h HIS 68 Ca 0.33 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.56 1wtd h HIS 68 Cb -0.11 0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 1wtd h HIS 68 CO -0.00 -0.10 -0.23 -0.44 0.86 0.00 0.00 177.93 178.01 1wtd h ASP 69 N -0.08 -0.62 -0.81 2.45 3.45 -1.47 0.51 116.42 119.86 1wtd h ASP 69 Ca 0.05 0.06 0.06 0.00 0.43 0.00 0.00 57.03 57.64 1wtd h ASP 69 Cb 0.16 0.22 -0.06 0.00 -0.56 0.00 0.00 39.33 39.09 1wtd h ASP 69 CO -0.12 -0.33 0.49 0.74 -1.57 0.00 0.00 179.24 178.45 1wtd h THR 70 N -0.47 1.02 -0.18 0.35 2.02 -1.13 -0.49 112.91 114.03 1wtd h THR 70 Ca 0.01 -0.31 -0.17 0.00 0.77 0.00 0.00 66.41 66.71 1wtd h THR 70 Cb 0.45 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1wtd h THR 70 CO -0.08 0.16 -0.58 1.23 0.37 0.00 0.00 175.52 176.63 1wtd h GLY 71 N 0.89 0.64 0.88 2.16 0.00 -0.45 -2.66 103.07 104.53 1wtd h GLY 71 Ca 0.35 -0.77 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1wtd h GLY 71 CO -0.18 0.69 0.07 -2.75 0.00 0.00 0.00 176.54 174.37 1wtd h PHE 72 N 0.44 0.29 -0.63 5.60 3.57 0.33 -0.75 116.94 125.80 1wtd h PHE 72 Ca 0.00 -0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.60 1wtd h PHE 72 Cb 1.13 -0.09 -0.12 0.00 2.79 0.00 0.00 35.95 39.67 1wtd h PHE 72 CO 0.05 0.36 -0.27 0.78 -2.23 0.00 0.00 178.31 177.00 1wtd h GLY 73 N 0.14 0.13 1.06 2.40 0.00 -1.05 0.93 103.07 106.69 1wtd h GLY 73 Ca 0.06 0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.68 1wtd h GLY 73 CO -0.00 -0.23 0.21 0.07 0.00 0.00 0.00 176.54 176.58 1wtd h LYS 74 N -0.10 1.15 -0.03 4.80 5.09 -1.38 -1.33 116.57 124.76 1wtd h LYS 74 Ca 0.27 -0.26 0.04 0.00 0.09 0.00 0.00 60.65 60.79 1wtd h LYS 74 Cb 0.54 -0.16 -0.06 0.00 0.10 0.00 0.00 32.23 32.65 1wtd h LYS 74 CO -0.70 0.99 -0.36 1.25 -2.09 0.00 0.00 179.45 178.55 1wtd h LEU 75 N 1.09 -1.08 0.21 7.07 6.46 0.64 0.18 115.31 129.89 1wtd h LEU 75 Ca 0.23 0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 58.12 1wtd h LEU 75 Cb 0.33 0.43 0.00 0.00 -0.73 0.00 0.00 40.66 40.70 1wtd h LEU 75 CO -0.00 -0.41 -0.10 0.40 -0.62 0.00 0.00 178.44 177.71 1wtd h ILE 76 N -0.49 0.82 -0.47 4.05 1.08 -0.88 -0.50 117.51 121.10 1wtd h ILE 76 Ca 0.06 -0.11 -0.04 0.00 -0.39 0.00 0.00 64.86 64.38 1wtd h ILE 76 Cb 0.59 0.88 -0.02 0.00 -3.07 0.00 0.00 36.82 35.21 1wtd h ILE 76 CO -0.30 0.03 0.13 -0.78 -0.69 0.00 0.00 178.15 176.53 1wtd h ASP 77 N -0.34 0.71 0.01 1.72 -0.00 -1.03 -2.12 116.42 115.37 1wtd h ASP 77 Ca -0.03 -0.22 -0.31 0.00 -0.00 0.00 0.00 57.03 56.47 1wtd h ASP 77 Cb 0.26 -0.19 -0.06 0.00 -0.00 0.00 0.00 39.33 39.35 1wtd h ASP 77 CO 0.05 0.75 -2.31 -0.62 -0.00 0.00 0.00 179.24 177.10 1wtd n GLU 78 N -4.50 0.68 -0.02 0.28 1.02 0.61 -4.58 120.64 114.14 1wtd n GLU 78 Ca 0.01 -0.04 -0.04 0.00 -0.02 0.00 0.00 57.16 57.07 1wtd n GLU 78 Cb 0.21 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 1wtd n GLU 78 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1wtd n LYS 79 N -2.67 0.23 0.33 3.49 4.76 -0.39 -4.58 118.16 119.33 1wtd n LYS 79 Ca -0.28 0.09 -0.16 0.00 -2.87 0.00 0.00 58.31 55.09 1wtd n LYS 79 Cb 1.06 -0.89 -0.08 0.00 -1.84 0.00 0.00 35.03 33.28 1wtd n LYS 79 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1wtd h ILE 80 N -0.44 0.35 0.39 -0.18 1.08 -1.19 0.62 117.51 118.14 1wtd h ILE 80 Ca 0.00 -0.19 -0.01 0.00 -0.39 0.00 0.00 64.86 64.27 1wtd h ILE 80 Cb 0.44 0.41 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 1wtd h ILE 80 CO 0.00 0.03 -0.43 -0.07 -0.69 0.00 0.00 178.15 176.99 1wtd h LEU 81 N -0.95 -1.19 0.55 1.44 4.07 -1.62 0.64 115.31 118.26 1wtd h LEU 81 Ca -0.08 0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.96 1wtd h LEU 81 Cb 0.67 0.40 -0.02 0.00 1.08 0.00 0.00 40.66 42.79 1wtd h LEU 81 CO 0.14 -0.55 -0.44 -0.65 -1.08 0.00 0.00 178.44 175.86 1wtd h PRO 82 N -0.82 -0.94 0.00 1.13 0.11 -1.51 -0.66 132.00 129.31 1wtd h PRO 82 Ca -0.05 0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.99 1wtd h PRO 82 Cb 0.72 0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1wtd h PRO 82 CO -0.07 -0.63 -0.64 0.00 -0.21 0.00 0.00 178.00 176.45 1wtd h ARG 83 N -0.97 0.00 0.00 1.05 3.08 -0.89 -0.89 114.38 115.76 1wtd h ARG 83 Ca -0.06 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 1wtd h ARG 83 Cb 0.82 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1wtd h ARG 83 CO -0.00 0.64 -0.57 0.28 -1.07 0.00 0.00 179.97 179.25 1wtd h VAL 84 N 0.00 0.38 -0.17 2.04 2.07 -0.95 -3.43 116.25 116.19 1wtd h VAL 84 Ca -0.01 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.10 1wtd h VAL 84 Cb 1.43 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1wtd h VAL 84 CO 0.08 0.13 0.00 0.49 0.02 0.00 0.00 177.57 178.29 1wtd n PHE 85 N -4.60 0.21 -1.06 1.57 3.72 -0.58 -4.98 117.46 111.75 1wtd n PHE 85 Ca -0.13 -0.20 -0.02 0.00 -0.05 0.00 0.00 57.45 57.06 1wtd n PHE 85 Cb 0.34 -0.01 -0.01 0.00 -0.94 0.00 0.00 39.48 38.87 1wtd n PHE 85 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wtd n GLY 86 N 0.71 0.52 3.46 1.37 0.00 -0.34 -4.95 105.19 105.97 1wtd n GLY 86 Ca 0.10 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1wtd n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wtd s ALA 87 N -1.90 3.19 0.30 4.61 0.00 -0.92 -4.55 121.76 122.49 1wtd s ALA 87 Ca 0.00 -2.32 -0.28 0.00 0.00 0.00 0.00 51.96 49.36 1wtd s ALA 87 Cb 0.00 -4.02 -0.09 0.00 0.00 0.00 0.00 23.12 19.01 1wtd s ALA 87 CO 0.00 -2.96 1.06 0.71 0.00 0.00 0.00 175.76 174.56 1wtd s TYR 88 N 3.52 3.57 0.16 0.00 1.51 -0.16 -2.17 117.35 123.77 1wtd s TYR 88 Ca 0.30 1.72 -0.30 0.00 -1.01 0.00 0.00 57.07 57.78 1wtd s TYR 88 Cb -0.09 -3.19 -0.07 0.00 -0.11 0.00 0.00 41.96 38.50 1wtd s TYR 88 CO -0.01 -0.39 1.09 0.21 -1.11 0.00 0.00 175.55 175.34 1wtd s LYS 89 N -1.68 4.60 -1.25 -0.62 2.20 -1.26 -1.01 119.74 120.71 1wtd s LYS 89 Ca 0.47 1.68 -0.19 0.00 -0.36 0.00 0.00 55.97 57.57 1wtd s LYS 89 Cb -0.28 -3.30 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1wtd s LYS 89 CO 0.36 0.07 1.86 1.47 -0.36 0.00 0.00 175.35 178.75 1wtd n LEU 90 N 2.55 4.49 -0.08 5.43 -0.00 -0.60 -4.63 117.00 124.17 1wtd n LEU 90 Ca 0.03 -3.65 -0.09 0.00 -0.00 0.00 0.00 56.01 52.30 1wtd n LEU 90 Cb 0.47 -1.70 -0.04 0.00 -0.00 0.00 0.00 43.42 42.15 1wtd n LEU 90 CO 0.54 -0.41 -0.46 0.47 -0.00 0.00 0.00 177.39 177.53 1wtd n ASP 91 N 9.99 1.84 0.00 1.45 9.92 -1.26 -5.00 116.55 133.48 1wtd n ASP 91 Ca 0.48 0.55 0.00 0.00 -0.53 0.00 0.00 54.79 55.29 1wtd n ASP 91 Cb 0.45 -0.87 0.00 0.00 -0.64 0.00 0.00 41.12 40.06 1wtd n ASP 91 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1wtd n LYS 92 N -4.55 0.00 0.00 -1.24 4.76 -1.26 -5.23 118.16 110.64 1wtd n LYS 92 Ca -0.14 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.30 1wtd n LYS 92 Cb 0.39 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.58 1wtd n LYS 92 CO 0.00 0.00 0.00 1.97 -1.37 0.00 0.00 177.40 178.00 1wtd n PHE 101 N 0.00 0.00 -3.54 2.13 1.16 -1.26 -5.24 117.46 110.72 1wtd n PHE 101 Ca 0.00 0.00 -0.21 0.00 -1.87 0.00 0.00 57.45 55.37 1wtd n PHE 101 Cb 0.00 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 37.85 1wtd n PHE 101 CO 0.00 0.00 0.00 0.96 -1.87 0.00 0.00 176.76 175.85 1wtd s ILE 102 N -0.06 2.53 0.00 1.97 -4.36 -1.26 -4.94 121.20 115.08 1wtd s ILE 102 Ca 0.00 -1.32 0.00 0.00 -0.26 0.00 0.00 60.65 59.07 1wtd s ILE 102 Cb 0.00 -2.84 0.00 0.00 1.25 0.00 0.00 42.46 40.87 1wtd s ILE 102 CO 0.00 0.00 0.00 1.41 0.24 0.00 0.00 174.94 176.59 1wtd n HIS 103 N -1.63 0.00 0.00 1.37 8.25 -1.26 -5.15 115.22 116.80 1wtd n HIS 103 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1wtd n HIS 103 Cb 0.62 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.73 1wtd n HIS 103 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1wtd n PRO 104 N 0.00 0.00 -2.41 -0.41 -0.02 -1.26 -4.60 135.00 126.30 1wtd n PRO 104 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.09 1wtd n PRO 104 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 33.50 1wtd n PRO 104 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wtd n PHE 106 N -0.24 2.02 -0.14 0.00 0.99 -1.26 -4.73 117.46 114.10 1wtd n PHE 106 Ca 0.48 -2.05 -0.10 0.00 -0.00 0.00 0.00 57.45 55.78 1wtd n PHE 106 Cb 0.27 -0.66 -0.01 0.00 -1.00 0.00 0.00 39.48 38.07 1wtd n PHE 106 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 1wtd h ASP 107 N 1.48 0.66 0.99 4.37 3.32 -1.92 -3.07 116.42 122.25 1wtd h ASP 107 Ca 0.36 -0.28 -0.07 0.00 0.02 0.00 0.00 57.03 57.05 1wtd h ASP 107 Cb 1.55 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.91 1wtd h ASP 107 CO 0.75 0.78 -0.33 -0.33 -1.72 0.00 0.00 179.24 178.38 1wtd h GLU 108 N 0.51 0.00 -6.30 3.56 4.39 -2.00 -3.43 114.58 111.32 1wtd h GLU 108 Ca 0.12 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.27 1wtd h GLU 108 Cb 0.42 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.03 1wtd h GLU 108 CO 0.01 0.33 0.12 0.96 -1.16 0.00 0.00 179.01 179.28 1wtd s ILE 109 N -3.52 4.69 -0.11 3.13 -5.25 -1.16 -4.52 121.20 114.46 1wtd s ILE 109 Ca 0.01 1.56 0.07 0.00 -0.99 0.00 0.00 60.65 61.29 1wtd s ILE 109 Cb 0.10 -4.08 -0.11 0.00 2.95 0.00 0.00 42.46 41.32 1wtd s ILE 109 CO 0.68 0.41 -0.01 0.47 -1.79 0.00 0.00 174.94 174.69 1wtd n ASP 110 N 2.51 2.61 -4.15 4.36 8.00 0.27 -4.92 116.55 125.22 1wtd n ASP 110 Ca -0.04 -0.02 -0.10 0.00 0.71 0.00 0.00 54.79 55.34 1wtd n ASP 110 Cb 0.50 0.44 -0.10 0.00 -0.02 0.00 0.00 41.12 41.94 1wtd n ASP 110 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1wtd s HIS 111 N -2.26 0.80 -0.02 1.24 3.76 -0.34 -1.55 115.29 116.92 1wtd s HIS 111 Ca -0.09 -1.00 0.04 0.00 -0.15 0.00 0.00 55.06 53.86 1wtd s HIS 111 Cb 0.04 -0.49 -0.01 0.00 1.11 0.00 0.00 32.58 33.23 1wtd s HIS 111 CO 0.39 -0.25 -0.14 0.08 -0.85 0.00 0.00 174.74 173.96 1wtd s VAL 112 N -3.75 1.14 0.06 -0.90 1.01 -0.18 -0.52 120.40 117.25 1wtd s VAL 112 Ca 0.12 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.58 1wtd s VAL 112 Cb 0.06 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 1wtd s VAL 112 CO -0.05 0.33 -0.17 -0.63 0.00 0.00 0.00 175.10 174.58 1wtd s ILE 113 N -0.10 1.34 -0.35 2.22 1.09 -0.85 -0.99 121.20 123.56 1wtd s ILE 113 Ca 0.01 -1.19 0.02 0.00 -1.10 0.00 0.00 60.65 58.39 1wtd s ILE 113 Cb -0.08 -1.21 0.10 0.00 -1.06 0.00 0.00 42.46 40.21 1wtd s ILE 113 CO 0.00 0.00 0.09 -1.10 -0.10 0.00 0.00 174.94 173.84 1wtd s GLN 114 N -1.38 1.24 0.82 2.79 -1.52 -1.26 -1.95 119.66 118.41 1wtd s GLN 114 Ca 0.03 -1.67 -0.11 0.00 -1.95 0.00 0.00 55.36 51.67 1wtd s GLN 114 Cb -0.09 -2.74 0.09 0.00 -0.22 0.00 0.00 33.01 30.05 1wtd s GLN 114 CO 0.02 -0.98 1.12 1.03 -0.25 0.00 0.00 175.29 176.23 1wtd s ARG 115 N 1.02 1.78 0.40 2.91 3.00 -0.91 -4.88 118.95 122.27 1wtd s ARG 115 Ca 0.11 1.37 0.24 0.00 0.00 0.00 0.00 55.73 57.46 1wtd s ARG 115 Cb -0.19 -1.83 1.29 0.00 0.00 0.00 0.00 34.95 34.22 1wtd s ARG 115 CO -0.13 -2.03 1.66 -0.44 0.00 0.00 0.00 175.30 174.36 1wtd h ASP 116 N -1.31 0.35 0.00 0.23 5.19 -2.00 -2.01 116.42 116.86 1wtd h ASP 116 Ca -0.44 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.12 1wtd h ASP 116 Cb 1.25 0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.88 1wtd h ASP 116 CO 0.47 -0.14 0.00 -0.90 -3.12 0.00 0.00 179.24 175.55 1wtd n ASP 117 N -4.80 0.00 0.00 6.45 5.68 -1.26 -5.02 116.55 117.60 1wtd n ASP 117 Ca 0.34 0.61 0.00 0.00 -0.50 0.00 0.00 54.79 55.24 1wtd n ASP 117 Cb 1.22 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 40.75 1wtd n ASP 117 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1wtd n GLY 118 N 1.14 0.00 3.77 6.12 0.00 -0.76 -5.15 105.19 110.32 1wtd n GLY 118 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1wtd n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wtd s ARG 119 N 0.00 4.25 -0.31 1.61 0.52 -1.26 -4.81 118.95 118.94 1wtd s ARG 119 Ca 0.00 2.25 -0.04 0.00 -0.52 0.00 0.00 55.73 57.42 1wtd s ARG 119 Cb 0.00 -2.99 0.04 0.00 0.52 0.00 0.00 34.95 32.52 1wtd s ARG 119 CO 0.00 -0.29 0.04 0.42 0.02 0.00 0.00 175.30 175.49 1wtd s ILE 120 N -1.16 3.38 -0.05 1.52 -1.09 -1.26 -2.15 121.20 120.39 1wtd s ILE 120 Ca 0.51 -1.21 -0.04 0.00 -2.23 0.00 0.00 60.65 57.68 1wtd s ILE 120 Cb -0.40 -2.90 -0.04 0.00 -1.58 0.00 0.00 42.46 37.54 1wtd s ILE 120 CO 0.53 -0.10 0.16 -1.61 -1.23 0.00 0.00 174.94 172.69 1wtd s GLU 121 N 1.34 3.41 -0.17 2.79 2.02 -0.82 -0.82 118.70 126.44 1wtd s GLU 121 Ca -0.03 -0.27 -0.01 0.00 0.02 0.00 0.00 54.97 54.68 1wtd s GLU 121 Cb -0.19 -3.11 -0.01 0.00 0.10 0.00 0.00 34.13 30.92 1wtd s GLU 121 CO 0.01 0.71 -0.11 -0.51 0.02 0.00 0.00 175.26 175.38 1wtd s LEU 122 N -1.62 2.68 -0.19 1.80 1.43 0.47 -2.00 118.68 121.26 1wtd s LEU 122 Ca 0.23 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 52.89 1wtd s LEU 122 Cb -0.12 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 1wtd s LEU 122 CO 0.13 0.06 -0.08 -0.22 0.23 0.00 0.00 176.35 176.47 1wtd s LEU 123 N 0.97 2.80 -0.46 1.79 2.96 0.32 -0.07 118.68 126.99 1wtd s LEU 123 Ca -0.02 -0.37 -0.14 0.00 -0.22 0.00 0.00 54.13 53.38 1wtd s LEU 123 Cb -0.15 -1.68 0.07 0.00 0.50 0.00 0.00 46.19 44.93 1wtd s LEU 123 CO -0.01 0.05 0.37 -0.55 -1.32 0.00 0.00 176.35 174.89 1wtd s SER 124 N 1.04 6.05 -0.01 3.68 0.15 -0.15 0.94 113.70 125.40 1wtd s SER 124 Ca 0.00 -1.34 -0.28 0.00 0.70 0.00 0.00 55.95 55.04 1wtd s SER 124 Cb -0.15 -2.15 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1wtd s SER 124 CO -0.01 -0.62 0.87 -0.22 1.20 0.00 0.00 173.24 174.47 1wtd s LEU 125 N 1.60 4.36 0.20 3.45 2.96 -1.26 -1.89 118.68 128.11 1wtd s LEU 125 Ca 0.04 1.50 0.09 0.00 -0.22 0.00 0.00 54.13 55.53 1wtd s LEU 125 Cb -0.24 -3.39 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 1wtd s LEU 125 CO 0.06 -0.19 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.20 1wtd s LYS 126 N 0.84 1.36 0.00 1.98 -0.14 0.03 -4.97 119.74 118.84 1wtd s LYS 126 Ca 0.46 -1.56 0.00 0.00 -1.36 0.00 0.00 55.97 53.51 1wtd s LYS 126 Cb -0.20 -1.28 0.00 0.00 -1.68 0.00 0.00 37.83 34.67 1wtd s LYS 126 CO 0.24 0.23 0.00 0.00 -0.76 0.00 0.00 175.35 175.07 1wtd n ALA 127 N -0.20 0.45 -1.00 5.17 0.00 -1.26 -2.02 120.51 121.65 1wtd n ALA 127 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1wtd n ALA 127 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1wtd n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wtd n GLY 128 N 2.73 -1.63 0.32 0.00 0.00 -1.26 -3.35 105.19 102.00 1wtd n GLY 128 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1wtd n GLY 128 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wtd h LYS 129 N 0.00 -0.04 -3.62 1.61 1.79 -1.90 -3.43 116.57 110.98 1wtd h LYS 129 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1wtd h LYS 129 Cb 0.00 0.01 0.03 0.00 -1.58 0.00 0.00 32.23 30.69 1wtd h LYS 129 CO 0.00 -0.03 -0.13 1.87 -1.08 0.00 0.00 179.45 180.08 1wtd n TRP 130 N -5.49 -0.68 -2.69 -1.35 -0.00 -1.26 -4.80 117.44 101.17 1wtd n TRP 130 Ca 0.09 0.25 -0.42 0.00 -0.00 0.00 0.00 57.50 57.43 1wtd n TRP 130 Cb 0.39 -2.62 -0.04 0.00 -0.00 0.00 0.00 31.31 29.04 1wtd n TRP 130 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1wtd s THR 131 N -3.06 4.64 -0.02 5.87 2.01 -1.26 -5.06 115.64 118.76 1wtd s THR 131 Ca 0.07 2.01 0.07 0.00 0.31 0.00 0.00 61.69 64.15 1wtd s THR 131 Cb -0.01 -4.29 -0.02 0.00 0.01 0.00 0.00 72.50 68.20 1wtd s THR 131 CO 0.19 0.22 -0.24 0.27 -0.69 0.00 0.00 174.62 174.37 1wtd s ILE 132 N 0.59 1.86 0.64 1.82 -4.36 -1.26 -5.13 121.20 115.35 1wtd s ILE 132 Ca 0.50 -1.00 -0.16 0.00 -0.26 0.00 0.00 60.65 59.73 1wtd s ILE 132 Cb -0.23 -1.55 -0.01 0.00 1.25 0.00 0.00 42.46 41.92 1wtd s ILE 132 CO 0.29 0.53 1.13 0.00 0.24 0.00 0.00 174.94 177.13 1wtd s GLN 133 N -0.51 2.86 0.46 0.37 1.03 -1.26 -4.81 119.66 117.79 1wtd s GLN 133 Ca 0.08 1.52 0.26 0.00 0.04 0.00 0.00 55.36 57.27 1wtd s GLN 133 Cb -0.09 -1.95 1.31 0.00 0.03 0.00 0.00 33.01 32.30 1wtd s GLN 133 CO -0.01 -1.23 1.79 1.25 -2.54 0.00 0.00 175.29 174.55 1wtd h LEU 134 N 0.33 0.25 -0.10 2.60 6.46 -1.99 -1.22 115.31 121.63 1wtd h LEU 134 Ca -0.48 0.05 -0.24 0.00 -0.12 0.00 0.00 57.88 57.09 1wtd h LEU 134 Cb 1.26 0.01 0.01 0.00 -0.73 0.00 0.00 40.66 41.22 1wtd h LEU 134 CO 0.54 0.04 -0.86 0.71 -0.62 0.00 0.00 178.44 178.25 1wtd h THR 135 N 0.21 1.28 -0.29 1.05 1.35 -1.99 -2.44 112.91 112.08 1wtd h THR 135 Ca 0.58 -2.06 -0.11 0.00 -0.55 0.00 0.00 66.41 64.27 1wtd h THR 135 Cb 1.84 2.12 -0.01 0.00 -1.73 0.00 0.00 68.15 70.36 1wtd h THR 135 CO -0.18 0.65 -0.28 0.24 -0.25 0.00 0.00 175.52 175.70 1wtd h MET 136 N 0.49 0.59 -0.53 4.72 2.86 -1.62 -0.28 114.93 121.17 1wtd h MET 136 Ca -0.08 -0.25 -0.02 0.00 -2.06 0.00 0.00 59.70 57.29 1wtd h MET 136 Cb 1.50 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 33.12 1wtd h MET 136 CO 0.18 0.82 0.25 0.00 1.06 0.00 0.00 176.91 179.21 1wtd h ALA 137 N 1.18 0.68 -0.29 6.32 0.00 -1.35 0.12 119.26 125.92 1wtd h ALA 137 Ca 0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1wtd h ALA 137 Cb 0.75 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1wtd h ALA 137 CO 0.06 0.25 0.13 0.28 0.00 0.00 0.00 179.25 179.97 1wtd h VAL 138 N 0.71 1.16 -0.59 0.00 2.07 -1.26 -2.17 116.25 116.17 1wtd h VAL 138 Ca 0.18 -0.47 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 1wtd h VAL 138 Cb 0.13 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1wtd h VAL 138 CO -0.02 0.16 0.14 1.56 0.02 0.00 0.00 177.57 179.44 1wtd h GLN 139 N 0.33 0.95 -0.43 1.57 4.20 -0.85 -2.67 115.11 118.22 1wtd h GLN 139 Ca 0.10 -0.23 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1wtd h GLN 139 Cb 0.14 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1wtd h GLN 139 CO -0.01 0.88 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.78 1wtd h LEU 140 N 0.86 0.83 -1.50 1.46 4.07 -0.76 -2.49 115.31 117.78 1wtd h LEU 140 Ca 0.19 -0.28 0.02 0.00 0.08 0.00 0.00 57.88 57.88 1wtd h LEU 140 Cb 0.35 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.84 1wtd h LEU 140 CO 0.00 1.00 0.36 -1.13 -1.08 0.00 0.00 178.44 177.59 1wtd h ASN 141 N 0.73 0.57 -0.50 -0.43 -1.24 -1.24 0.57 115.58 114.04 1wtd h ASN 141 Ca 0.11 -0.01 -0.08 0.00 0.71 0.00 0.00 56.30 57.03 1wtd h ASN 141 Cb 0.70 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.59 1wtd h ASN 141 CO 0.05 0.40 -0.01 0.11 -1.29 0.00 0.00 177.43 176.69 1wtd h LYS 142 N 0.66 0.89 -0.42 6.67 1.79 -1.13 -0.30 116.57 124.74 1wtd h LYS 142 Ca 0.21 -0.29 -0.04 0.00 -2.18 0.00 0.00 60.65 58.35 1wtd h LYS 142 Cb 0.03 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.58 1wtd h LYS 142 CO -0.05 0.93 0.09 0.00 -1.08 0.00 0.00 179.45 179.34 1wtd h ALA 143 N 0.93 0.56 -0.32 3.86 0.00 -0.93 -0.91 119.26 122.44 1wtd h ALA 143 Ca 0.14 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1wtd h ALA 143 Cb 0.53 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1wtd h ALA 143 CO 0.03 0.25 -0.35 0.74 0.00 0.00 0.00 179.25 179.92 1wtd h PHE 144 N 0.55 0.97 -0.53 0.00 0.05 -0.89 -1.88 116.94 115.20 1wtd h PHE 144 Ca 0.13 -0.30 0.02 0.00 3.82 0.00 0.00 57.97 61.64 1wtd h PHE 144 Cb 0.34 -0.20 -0.03 0.00 2.00 0.00 0.00 35.95 38.06 1wtd h PHE 144 CO 0.02 1.08 0.34 0.45 -0.18 0.00 0.00 178.31 180.02 1wtd h HIS 145 N 0.57 0.63 0.00 -0.55 -0.00 -1.02 -1.68 115.15 113.11 1wtd h HIS 145 Ca 0.05 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.40 1wtd h HIS 145 Cb 0.94 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 28.13 1wtd h HIS 145 CO 0.07 0.38 -0.17 1.05 -0.00 0.00 0.00 177.93 179.26 1wtd h GLU 146 N 0.68 0.00 0.12 2.45 4.11 -1.06 0.48 114.58 121.35 1wtd h GLU 146 Ca 0.20 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.63 1wtd h GLU 146 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1wtd h GLU 146 CO -0.07 0.17 -0.06 0.82 0.07 0.00 0.00 179.01 179.94 1wtd h ILE 147 N 0.00 0.57 -0.09 -1.06 2.04 -0.98 -3.36 117.51 114.62 1wtd h ILE 147 Ca -0.00 -1.20 -0.09 0.00 1.00 0.00 0.00 64.86 64.57 1wtd h ILE 147 Cb 0.58 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1wtd h ILE 147 CO 0.02 0.17 -0.34 0.40 0.00 0.00 0.00 178.15 178.41 1wtd h ILE 148 N -0.98 1.27 -0.90 -0.67 2.04 -1.30 -2.94 117.51 114.02 1wtd h ILE 148 Ca -0.02 -1.30 0.11 0.00 1.00 0.00 0.00 64.86 64.66 1wtd h ILE 148 Cb 0.40 1.58 -0.13 0.00 -0.74 0.00 0.00 36.82 37.93 1wtd h ILE 148 CO 0.03 0.39 -0.43 -0.46 0.00 0.00 0.00 178.15 177.67 1wtd n ASN 149 N -4.10 -0.74 -3.49 1.72 0.23 0.15 -4.44 115.26 104.59 1wtd n ASN 149 Ca -0.01 1.59 -0.10 0.00 -0.53 0.00 0.00 54.58 55.52 1wtd n ASN 149 Cb 0.41 -0.30 0.04 0.00 -2.08 0.00 0.00 39.78 37.85 1wtd n ASN 149 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1wtd n ASN 150 N -5.24 1.04 -2.98 0.53 4.13 -1.11 -4.76 115.26 106.87 1wtd n ASN 150 Ca 0.06 -1.77 -0.08 0.00 1.68 0.00 0.00 54.58 54.48 1wtd n ASN 150 Cb 0.31 -0.23 0.00 0.00 -1.54 0.00 0.00 39.78 38.32 1wtd n ASN 150 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1wtd n TYR 151 N -1.70 -0.53 0.94 3.10 4.02 -1.26 -4.81 117.16 116.92 1wtd n TYR 151 Ca 0.08 0.20 -0.00 0.00 -0.01 0.00 0.00 57.90 58.17 1wtd n TYR 151 Cb 0.31 -0.75 0.01 0.00 -0.02 0.00 0.00 39.34 38.89 1wtd n TYR 151 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1wtd n PRO 152 N -1.21 1.06 -0.07 -0.72 -0.04 -1.26 -3.88 135.00 128.88 1wtd n PRO 152 Ca -0.08 -0.09 -0.22 0.00 -0.04 0.00 0.00 63.50 63.07 1wtd n PRO 152 Cb 0.19 -1.19 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1wtd n PRO 152 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wtd n GLY 153 N 0.31 -0.63 2.54 0.55 0.00 -1.26 -4.52 105.19 102.18 1wtd n GLY 153 Ca 0.01 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1wtd n GLY 153 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wtd n VAL 154 N -3.93 1.97 -2.78 1.61 0.24 -1.25 -4.79 118.33 109.39 1wtd n VAL 154 Ca -0.37 -4.42 -0.10 0.00 -2.04 0.00 0.00 64.34 57.41 1wtd n VAL 154 Cb 0.88 -0.71 0.07 0.00 -1.47 0.00 0.00 33.84 32.61 1wtd n VAL 154 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1wtd n ALA 155 N -0.34 -0.58 0.05 2.33 0.00 -1.25 -4.88 120.51 115.83 1wtd n ALA 155 Ca 0.30 -1.65 0.02 0.00 0.00 0.00 0.00 53.44 52.11 1wtd n ALA 155 Cb 0.70 -1.16 0.37 0.00 0.00 0.00 0.00 19.45 19.36 1wtd n ALA 155 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1wtd h ASP 156 N 3.14 0.39 -3.71 0.00 5.19 -1.27 -3.45 116.42 116.70 1wtd h ASP 156 Ca -0.09 -0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.24 1wtd h ASP 156 Cb 1.08 -0.10 -0.21 0.00 0.18 0.00 0.00 39.33 40.27 1wtd h ASP 156 CO 0.19 0.43 0.08 0.21 -3.12 0.00 0.00 179.24 177.03 1wtd s ASN 157 N -6.78 -0.79 0.01 6.45 3.84 -1.12 -4.85 114.94 111.71 1wtd s ASN 157 Ca -0.07 1.43 0.01 0.00 0.21 0.00 0.00 52.86 54.44 1wtd s ASN 157 Cb 0.16 1.41 -0.04 0.00 -0.55 0.00 0.00 41.25 42.23 1wtd s ASN 157 CO 0.74 -0.24 0.05 -0.63 -2.79 0.00 0.00 177.10 174.24 1wtd s ILE 158 N 0.73 4.52 -0.02 -5.21 1.01 0.10 -0.39 121.20 121.94 1wtd s ILE 158 Ca -0.03 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1wtd s ILE 158 Cb -0.05 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.37 1wtd s ILE 158 CO -0.05 0.33 -0.01 -0.69 0.00 0.00 0.00 174.94 174.52 1wtd s VAL 159 N -1.18 0.19 -0.53 2.92 1.01 0.90 -1.95 120.40 121.76 1wtd s VAL 159 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 61.98 62.01 1wtd s VAL 159 Cb -0.12 -0.24 0.06 0.00 0.00 0.00 0.00 36.38 36.09 1wtd s VAL 159 CO 0.14 0.11 0.68 -0.69 0.00 0.00 0.00 175.10 175.34 1wtd s VAL 160 N 0.58 4.80 -0.40 2.92 1.01 0.17 -0.98 120.40 128.50 1wtd s VAL 160 Ca -0.06 -0.48 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 1wtd s VAL 160 Cb -0.09 -4.36 0.01 0.00 0.00 0.00 0.00 36.38 31.94 1wtd s VAL 160 CO -0.01 -0.90 0.48 -0.83 0.00 0.00 0.00 175.10 173.84 1wtd s GLY 161 N 2.87 1.85 -0.60 4.51 0.00 -0.79 -1.90 107.32 113.26 1wtd s GLY 161 Ca 0.16 -1.34 -0.17 0.00 0.00 0.00 0.00 44.72 43.38 1wtd s GLY 161 CO 0.12 1.23 0.61 0.14 0.00 0.00 0.00 173.10 175.21 1wtd s VAL 162 N 2.30 5.10 -0.80 1.40 1.01 -0.49 -0.79 120.40 128.13 1wtd s VAL 162 Ca 0.15 -1.42 0.20 0.00 0.00 0.00 0.00 61.98 60.92 1wtd s VAL 162 Cb -0.16 -4.42 0.19 0.00 0.00 0.00 0.00 36.38 31.99 1wtd s VAL 162 CO 0.14 -0.99 1.63 2.22 0.00 0.00 0.00 175.10 178.10 1wtd n PHE 163 N 5.54 0.36 -3.78 5.22 1.16 -0.85 -0.39 117.46 124.72 1wtd n PHE 163 Ca -0.09 0.13 -0.11 0.00 -1.87 0.00 0.00 57.45 55.52 1wtd n PHE 163 Cb 0.42 -0.72 -0.07 0.00 -1.61 0.00 0.00 39.48 37.50 1wtd n PHE 163 CO 0.00 0.00 0.00 1.52 -1.87 0.00 0.00 176.76 176.41 1wtd s TYR 164 N -3.12 -0.05 0.00 2.97 1.13 -1.21 -4.55 117.35 112.52 1wtd s TYR 164 Ca 0.07 -0.14 0.00 0.00 -1.41 0.00 0.00 57.07 55.59 1wtd s TYR 164 Cb 0.11 0.06 0.00 0.00 -1.10 0.00 0.00 41.96 41.02 1wtd s TYR 164 CO 0.37 -0.50 0.00 0.41 -2.51 0.00 0.00 175.55 173.32 1wtd n GLY 165 N 0.51 0.95 3.90 5.49 0.00 -1.26 -4.20 105.19 110.58 1wtd n GLY 165 Ca -0.18 -1.80 -0.25 0.00 0.00 0.00 0.00 46.02 43.78 1wtd n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wtd s ASN 166 N -1.04 4.68 -0.08 1.61 2.20 -1.26 -1.93 114.94 119.11 1wtd s ASN 166 Ca 0.00 -1.18 0.15 0.00 -0.94 0.00 0.00 52.86 50.88 1wtd s ASN 166 Cb 0.00 0.31 0.49 0.00 -2.00 0.00 0.00 41.25 40.05 1wtd s ASN 166 CO 0.00 -1.07 1.41 -1.54 -2.94 0.00 0.00 177.10 172.96 1wtd n SER 167 N -1.76 3.71 -4.68 3.54 3.41 -1.26 -4.88 113.62 111.70 1wtd n SER 167 Ca -0.00 -2.42 -0.45 0.00 -0.26 0.00 0.00 58.87 55.74 1wtd n SER 167 Cb 0.64 -0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 64.13 1wtd n SER 167 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1wtd n HIS 168 N 0.39 2.34 0.00 7.33 8.25 -1.26 -3.34 115.22 128.94 1wtd n HIS 168 Ca 0.18 0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.92 1wtd n HIS 168 Cb 0.69 -2.54 0.00 0.00 1.12 0.00 0.00 29.99 29.26 1wtd n HIS 168 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wtd n GLY 169 N 3.18 2.16 1.78 -1.41 0.00 -1.26 -4.76 105.19 104.88 1wtd n GLY 169 Ca 0.15 -0.16 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 1wtd n GLY 169 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wtd n LEU 170 N 0.00 4.48 -0.01 0.99 -0.00 -1.21 -3.97 117.00 117.28 1wtd n LEU 170 Ca 0.00 -2.33 0.08 0.00 -0.00 0.00 0.00 56.01 53.76 1wtd n LEU 170 Cb 0.00 -1.05 -0.11 0.00 -0.00 0.00 0.00 43.42 42.25 1wtd n LEU 170 CO 0.00 1.06 -0.55 1.07 -0.00 0.00 0.00 177.39 178.97 1wtd n THR 171 N 1.98 0.00 -0.13 1.47 5.66 -1.23 -4.03 114.28 118.01 1wtd n THR 171 Ca 0.15 -0.31 -0.02 0.00 -3.05 0.00 0.00 64.05 60.81 1wtd n THR 171 Cb 0.57 0.33 0.21 0.00 -1.55 0.00 0.00 70.33 69.88 1wtd n THR 171 CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 175.07 169.78 1wtd h ASP 172 N 0.00 0.75 0.74 1.09 2.03 -1.92 -2.21 116.42 116.90 1wtd h ASP 172 Ca 0.00 -0.12 -0.12 0.00 -0.73 0.00 0.00 57.03 56.06 1wtd h ASP 172 Cb 0.64 -0.20 -0.02 0.00 -0.83 0.00 0.00 39.33 38.93 1wtd h ASP 172 CO 0.00 0.72 -0.59 0.11 -1.03 0.00 0.00 179.24 178.45 1wtd h LYS 173 N 0.80 0.00 -0.24 4.15 1.57 -1.89 -3.04 116.57 117.91 1wtd h LYS 173 Ca 0.18 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.76 1wtd h LYS 173 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1wtd h LYS 173 CO -0.01 0.59 -0.63 1.88 -0.57 0.00 0.00 179.45 180.71 1wtd h TYR 174 N 0.00 1.10 -0.66 -1.35 0.99 -1.62 -2.61 116.97 112.82 1wtd h TYR 174 Ca -0.01 -0.43 0.01 0.00 2.00 0.00 0.00 58.73 60.31 1wtd h TYR 174 Cb 1.12 -0.19 -0.03 0.00 1.00 0.00 0.00 36.73 38.62 1wtd h TYR 174 CO 0.00 1.26 0.44 0.00 -0.00 0.00 0.00 178.16 179.86 1wtd h ARG 175 N 0.63 0.86 -0.13 4.88 3.08 -1.37 -2.32 114.38 120.01 1wtd h ARG 175 Ca -0.01 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1wtd h ARG 175 Cb 1.25 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 31.11 1wtd h ARG 175 CO 0.14 0.57 -0.19 0.82 -1.07 0.00 0.00 179.97 180.23 1wtd h ILE 176 N 0.88 1.37 -0.64 2.04 2.04 -1.50 0.20 117.51 121.90 1wtd h ILE 176 Ca 0.25 -1.42 0.19 0.00 1.00 0.00 0.00 64.86 64.87 1wtd h ILE 176 Cb -0.07 2.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 1wtd h ILE 176 CO -0.06 0.41 0.52 0.25 0.00 0.00 0.00 178.15 179.27 1wtd h LEU 177 N -0.05 0.00 0.02 1.44 6.46 -1.23 -0.61 115.31 121.33 1wtd h LEU 177 Ca 0.01 0.00 -0.30 0.00 -0.12 0.00 0.00 57.88 57.47 1wtd h LEU 177 Cb 0.75 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.64 1wtd h LEU 177 CO 0.04 0.00 -1.72 0.03 -0.62 0.00 0.00 178.44 176.18 1wtd h ARG 178 N 0.00 0.04 0.00 1.25 3.08 -1.17 -3.40 114.38 114.19 1wtd h ARG 178 Ca 0.31 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1wtd h ARG 178 Cb 1.33 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.41 1wtd h ARG 178 CO -0.00 0.63 0.00 0.41 -1.07 0.00 0.00 179.97 179.93 1wtd n GLY 179 N 1.61 3.00 2.67 0.04 0.00 0.69 -1.03 105.19 112.17 1wtd n GLY 179 Ca -0.18 -0.86 -0.06 0.00 0.00 0.00 0.00 46.02 44.92 1wtd n GLY 179 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wtd n ILE 180 N 0.00 0.00 -1.96 -0.61 5.41 -1.22 -4.71 119.36 116.27 1wtd n ILE 180 Ca 0.00 -1.30 -0.40 0.00 1.00 0.00 0.00 62.75 62.05 1wtd n ILE 180 Cb 0.00 0.93 -0.03 0.00 -0.71 0.00 0.00 39.64 39.83 1wtd n ILE 180 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1wtd s ASN 181 N -1.03 5.40 0.00 4.38 0.02 -1.26 -4.92 114.94 117.53 1wtd s ASN 181 Ca 0.18 0.82 0.00 0.00 -1.02 0.00 0.00 52.86 52.84 1wtd s ASN 181 Cb 0.35 -2.52 0.00 0.00 0.02 0.00 0.00 41.25 39.10 1wtd s ASN 181 CO -0.08 -2.18 0.00 0.35 0.02 0.00 0.00 177.10 175.20 1wtd n THR 182 N 7.40 0.00 0.22 1.60 -2.24 -1.26 -4.73 114.28 115.26 1wtd n THR 182 Ca 0.24 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 62.12 1wtd n THR 182 Cb 0.50 0.00 0.43 0.00 -2.10 0.00 0.00 70.33 69.16 1wtd n THR 182 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1wtd h GLY 183 N 0.00 0.00 2.00 3.38 0.00 -2.04 -2.74 103.07 103.67 1wtd h GLY 183 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wtd h GLY 183 CO 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.53 1wtd h ALA 184 N 1.79 1.01 -6.70 3.60 0.00 -1.97 -3.47 119.26 113.53 1wtd h ALA 184 Ca -0.00 -0.01 -0.54 0.00 0.00 0.00 0.00 54.91 54.36 1wtd h ALA 184 Cb 0.79 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.48 1wtd h ALA 184 CO 0.03 0.01 -0.92 0.09 0.00 0.00 0.00 179.25 178.46 1wtd n ASN 185 N -3.12 -0.13 -4.62 0.00 3.02 -1.04 -4.83 115.26 104.55 1wtd n ASN 185 Ca -0.01 -1.11 -0.40 0.00 -0.03 0.00 0.00 54.58 53.03 1wtd n ASN 185 Cb 0.21 -2.53 0.03 0.00 -0.61 0.00 0.00 39.78 36.88 1wtd n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1wtd n HIS 186 N -4.48 1.11 -0.84 3.10 8.25 -1.26 -4.76 115.22 116.34 1wtd n HIS 186 Ca -0.31 0.50 -0.33 0.00 -0.26 0.00 0.00 57.72 57.32 1wtd n HIS 186 Cb 0.69 -2.21 -0.05 0.00 1.12 0.00 0.00 29.99 29.54 1wtd n HIS 186 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1wtd n ASN 187 N 0.01 2.82 -4.01 0.41 0.23 -1.26 -4.83 115.26 108.64 1wtd n ASN 187 Ca 0.11 -2.49 -0.12 0.00 -0.53 0.00 0.00 54.58 51.55 1wtd n ASN 187 Cb 0.42 -0.98 -0.12 0.00 -2.08 0.00 0.00 39.78 37.03 1wtd n ASN 187 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1wtd s VAL 188 N 4.76 0.34 -0.05 3.53 -7.23 -1.26 -4.87 120.40 115.62 1wtd s VAL 188 Ca 0.48 -0.82 -0.03 0.00 -1.81 0.00 0.00 61.98 59.80 1wtd s VAL 188 Cb 0.12 -0.41 -0.04 0.00 0.56 0.00 0.00 36.38 36.61 1wtd s VAL 188 CO 0.09 -0.32 0.10 -0.63 -0.31 0.00 0.00 175.10 174.02 1wtd s ILE 189 N -1.13 4.98 -0.75 -0.62 1.01 -1.26 -4.90 121.20 118.53 1wtd s ILE 189 Ca -0.10 -0.18 -0.26 0.00 0.00 0.00 0.00 60.65 60.11 1wtd s ILE 189 Cb -0.08 -3.23 -0.00 0.00 0.01 0.00 0.00 42.46 39.16 1wtd s ILE 189 CO -0.00 0.46 1.66 -1.81 0.00 0.00 0.00 174.94 175.24 1wtd s ASP 190 N -1.45 5.66 -0.10 3.58 -0.00 -1.26 -4.28 116.67 118.82 1wtd s ASP 190 Ca 0.20 -0.30 0.14 0.00 -0.00 0.00 0.00 52.55 52.59 1wtd s ASP 190 Cb -0.12 -2.55 0.42 0.00 -0.00 0.00 0.00 42.92 40.67 1wtd s ASP 190 CO 0.10 -2.18 1.34 2.30 -0.00 0.00 0.00 175.17 176.73 1wtd n ILE 191 N 7.05 1.73 -0.41 0.77 -5.35 -0.52 -4.82 119.36 117.81 1wtd n ILE 191 Ca 0.20 -1.51 0.36 0.00 -0.27 0.00 0.00 62.75 61.53 1wtd n ILE 191 Cb 0.50 0.07 0.62 0.00 -1.74 0.00 0.00 39.64 39.09 1wtd n ILE 191 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1wtd n ARG 192 N -0.12 -0.04 0.09 6.28 5.12 -0.19 -0.65 116.66 127.14 1wtd n ARG 192 Ca 0.17 1.21 -0.03 0.00 -1.93 0.00 0.00 57.85 57.27 1wtd n ARG 192 Cb 0.68 -2.33 -0.06 0.00 -1.16 0.00 0.00 32.46 29.59 1wtd n ARG 192 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1wtd h ASP 193 N 0.00 0.00 -0.01 0.55 3.45 -1.87 -3.35 116.42 115.18 1wtd h ASP 193 Ca 0.82 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.28 1wtd h ASP 193 Cb 2.54 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 41.31 1wtd h ASP 193 CO -0.51 0.78 -0.10 0.29 -1.57 0.00 0.00 179.24 178.13 1wtd n LYS 194 N -3.29 1.27 -4.06 3.56 5.02 0.17 -4.97 118.16 115.86 1wtd n LYS 194 Ca 0.00 -1.05 -0.21 0.00 -2.02 0.00 0.00 58.31 55.03 1wtd n LYS 194 Cb 0.85 -1.22 -0.17 0.00 -0.02 0.00 0.00 35.03 34.48 1wtd n LYS 194 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1wtd s VAL 195 N -1.30 0.53 -0.04 -0.18 1.01 -0.99 0.02 120.40 119.46 1wtd s VAL 195 Ca 0.13 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 1wtd s VAL 195 Cb 0.11 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.91 1wtd s VAL 195 CO 0.23 0.24 0.14 -1.00 0.00 0.00 0.00 175.10 174.71 1wtd s HIS 196 N 1.19 -0.09 -0.42 5.22 0.09 -0.82 -4.70 115.29 115.76 1wtd s HIS 196 Ca -0.07 0.20 -0.13 0.00 -0.00 0.00 0.00 55.06 55.06 1wtd s HIS 196 Cb -0.14 0.01 0.04 0.00 -0.00 0.00 0.00 32.58 32.50 1wtd s HIS 196 CO -0.01 -0.16 0.29 0.08 -0.00 0.00 0.00 174.74 174.94 1wtd s VAL 197 N -0.47 4.92 -0.23 -0.90 1.01 -1.26 -0.65 120.40 122.81 1wtd s VAL 197 Ca -0.06 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 60.92 1wtd s VAL 197 Cb -0.04 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1wtd s VAL 197 CO 0.01 -0.39 0.06 -0.31 0.00 0.00 0.00 175.10 174.47 1wtd s TYR 198 N 1.60 3.10 0.18 5.22 4.12 -0.80 -4.98 117.35 125.79 1wtd s TYR 198 Ca 0.04 -0.36 0.10 0.00 0.02 0.00 0.00 57.07 56.86 1wtd s TYR 198 Cb -0.21 -2.20 -0.04 0.00 -1.52 0.00 0.00 41.96 37.99 1wtd s TYR 198 CO 0.07 -0.28 -0.15 0.00 0.02 0.00 0.00 175.55 175.21 1wtd s ALA 199 N 1.38 2.78 0.00 3.71 0.00 -1.26 -1.40 121.76 126.97 1wtd s ALA 199 Ca 0.05 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.48 1wtd s ALA 199 Cb -0.15 -0.58 0.00 0.00 0.00 0.00 0.00 23.12 22.40 1wtd s ALA 199 CO 0.03 0.46 0.00 0.41 0.00 0.00 0.00 175.76 176.66 1wtd n GLY 200 N 0.15 4.06 0.36 0.00 0.00 0.48 -2.20 105.19 108.05 1wtd n GLY 200 Ca -0.12 0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.00 1wtd n GLY 200 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1wtd h LYS 201 N 0.00 0.92 -0.42 1.61 3.64 -1.90 -2.58 116.57 117.85 1wtd h LYS 201 Ca 0.00 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 1wtd h LYS 201 Cb 0.00 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 1wtd h LYS 201 CO 0.00 0.61 -0.08 0.93 -2.27 0.00 0.00 179.45 178.64 1wtd h GLU 202 N 0.95 0.79 -0.26 1.90 4.39 -1.80 -0.47 114.58 120.08 1wtd h GLU 202 Ca 0.37 -0.29 0.06 0.00 0.34 0.00 0.00 59.36 59.85 1wtd h GLU 202 Cb 0.24 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.77 1wtd h GLU 202 CO -0.14 0.90 -0.23 0.35 -1.16 0.00 0.00 179.01 178.73 1wtd h PHE 203 N 0.61 -0.62 -0.17 4.33 3.57 -1.49 0.71 116.94 123.87 1wtd h PHE 203 Ca 0.11 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.50 1wtd h PHE 203 Cb 0.60 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 1wtd h PHE 203 CO 0.05 -0.31 -0.52 -1.49 -2.23 0.00 0.00 178.31 173.80 1wtd h TRP 204 N -0.23 0.61 0.71 0.41 4.06 -1.36 0.48 115.95 120.64 1wtd h TRP 204 Ca 0.14 -0.21 -0.03 0.00 2.06 0.00 0.00 58.89 60.85 1wtd h TRP 204 Cb 0.45 -0.12 0.01 0.00 -1.00 0.00 0.00 29.16 28.50 1wtd h TRP 204 CO -0.40 0.91 -0.34 1.03 -3.56 0.00 0.00 178.44 176.09 1wtd h SER 205 N 0.39 -0.80 -0.38 -3.49 0.87 -0.88 -0.61 113.55 108.65 1wtd h SER 205 Ca 0.01 0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.68 1wtd h SER 205 Cb 1.05 0.21 -0.08 0.00 -0.44 0.00 0.00 62.40 63.13 1wtd h SER 205 CO 0.10 -0.57 -0.18 -0.25 -0.53 0.00 0.00 176.83 175.40 1wtd h TRP 206 N -0.96 -0.44 -0.71 2.24 7.01 0.68 -1.29 115.95 122.48 1wtd h TRP 206 Ca -0.10 0.04 0.02 0.00 2.11 0.00 0.00 58.89 60.96 1wtd h TRP 206 Cb 0.73 0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 28.01 1wtd h TRP 206 CO -0.02 -0.26 0.47 1.25 -2.79 0.00 0.00 178.44 177.09 1wtd h LEU 207 N -0.11 0.79 -3.94 0.65 5.85 0.01 -2.59 115.31 115.96 1wtd h LEU 207 Ca 0.19 -0.02 -0.55 0.00 0.84 0.00 0.00 57.88 58.34 1wtd h LEU 207 Cb 0.40 -0.19 -0.29 0.00 0.37 0.00 0.00 40.66 40.95 1wtd h LEU 207 CO -0.45 0.56 0.63 -3.20 -0.34 0.00 0.00 178.44 175.65 1wtd n ASN 208 N -4.44 5.01 -3.65 1.25 5.15 -0.24 -4.95 115.26 113.39 1wtd n ASN 208 Ca 0.08 -3.69 -0.27 0.00 -0.60 0.00 0.00 54.58 50.10 1wtd n ASN 208 Cb 0.06 -0.86 0.04 0.00 -0.53 0.00 0.00 39.78 38.50 1wtd n ASN 208 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1wtd n ASN 209 N -1.06 -4.37 0.00 1.20 6.94 -0.75 -2.83 115.26 114.39 1wtd n ASN 209 Ca 0.59 -0.94 0.00 0.00 -0.02 0.00 0.00 54.58 54.20 1wtd n ASN 209 Cb 1.27 -3.71 0.00 0.00 -2.36 0.00 0.00 39.78 34.98 1wtd n ASN 209 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1wtd n GLY 210 N -1.63 2.82 3.54 4.83 0.00 -0.58 -4.99 105.19 109.17 1wtd n GLY 210 Ca -0.14 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 1wtd n GLY 210 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wtd n GLU 211 N 0.00 0.69 -0.06 1.61 -0.58 -1.13 -4.81 120.64 116.36 1wtd n GLU 211 Ca 0.00 -0.08 0.10 0.00 -0.42 0.00 0.00 57.16 56.76 1wtd n GLU 211 Cb 0.00 -2.88 0.49 0.00 -0.57 0.00 0.00 31.44 28.48 1wtd n GLU 211 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wtd h ALA 212 N 16.77 1.96 -0.31 0.62 0.00 -1.92 -2.93 119.26 133.46 1wtd h ALA 212 Ca -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1wtd h ALA 212 Cb 1.25 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1wtd h ALA 212 CO 1.22 -0.06 0.00 0.39 0.00 0.00 0.00 179.25 180.80 1wtd n GLU 213 N -4.47 1.99 -0.15 0.00 -0.58 -1.26 -4.44 120.64 111.73 1wtd n GLU 213 Ca 0.08 -1.22 -0.05 0.00 -0.42 0.00 0.00 57.16 55.55 1wtd n GLU 213 Cb 0.30 -1.40 0.04 0.00 -0.57 0.00 0.00 31.44 29.82 1wtd n GLU 213 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1wtd h THR 214 N 1.86 0.92 -1.00 2.62 2.02 -1.82 -2.07 112.91 115.44 1wtd h THR 214 Ca 0.00 -0.14 0.14 0.00 0.77 0.00 0.00 66.41 67.18 1wtd h THR 214 Cb 0.61 0.47 -0.09 0.00 -1.74 0.00 0.00 68.15 67.40 1wtd h THR 214 CO 0.05 0.08 0.63 0.06 0.37 0.00 0.00 175.52 176.71 1wtd h GLN 215 N 0.42 0.90 -0.18 6.66 3.07 -1.87 -0.79 115.11 123.31 1wtd h GLN 215 Ca 0.21 -0.05 -0.15 0.00 0.09 0.00 0.00 58.65 58.75 1wtd h GLN 215 Cb 0.16 -0.20 -0.01 0.00 0.08 0.00 0.00 27.48 27.51 1wtd h GLN 215 CO -0.18 0.59 -0.52 0.45 0.09 0.00 0.00 178.83 179.27 1wtd h HIS 216 N 0.92 0.63 -0.58 0.06 3.86 -1.72 -0.37 115.15 117.95 1wtd h HIS 216 Ca 0.52 -0.22 -0.06 0.00 -1.16 0.00 0.00 60.37 59.46 1wtd h HIS 216 Cb 0.62 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 1wtd h HIS 216 CO -0.00 0.92 0.15 -1.49 0.86 0.00 0.00 177.93 178.37 1wtd h TRP 217 N 0.40 0.97 0.13 2.45 6.55 -0.73 -0.51 115.95 125.21 1wtd h TRP 217 Ca 0.01 -0.11 -0.01 0.00 0.95 0.00 0.00 58.89 59.73 1wtd h TRP 217 Cb 1.04 -0.27 0.00 0.00 -0.86 0.00 0.00 29.16 29.07 1wtd h TRP 217 CO 0.04 0.83 -0.06 0.28 -1.05 0.00 0.00 178.44 178.47 1wtd h VAL 218 N 0.83 0.90 -0.51 1.49 2.07 -1.12 -2.03 116.25 117.88 1wtd h VAL 218 Ca 0.18 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.62 1wtd h VAL 218 Cb 0.34 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1wtd h VAL 218 CO 0.00 0.03 0.27 0.25 0.02 0.00 0.00 177.57 178.14 1wtd h LEU 219 N -0.24 0.39 -0.87 2.57 5.85 -0.96 -2.43 115.31 119.63 1wtd h LEU 219 Ca -0.02 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1wtd h LEU 219 Cb 0.19 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1wtd h LEU 219 CO 0.03 0.27 0.51 -0.08 -0.34 0.00 0.00 178.44 178.83 1wtd h GLU 220 N 0.52 1.19 -0.89 1.25 4.81 -1.02 0.13 114.58 120.58 1wtd h GLU 220 Ca 0.22 -0.12 0.09 0.00 -0.13 0.00 0.00 59.36 59.42 1wtd h GLU 220 Cb 0.12 -0.24 -0.07 0.00 0.63 0.00 0.00 28.75 29.18 1wtd h GLU 220 CO -0.15 0.85 0.54 0.78 -0.73 0.00 0.00 179.01 180.30 1wtd h GLY 221 N 1.20 1.38 0.65 1.92 0.00 -1.02 -1.73 103.07 105.48 1wtd h GLY 221 Ca 0.31 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 1wtd h GLY 221 CO -0.06 0.19 -0.01 -2.22 0.00 0.00 0.00 176.54 174.45 1wtd h ILE 222 N 0.92 1.26 -0.87 2.60 2.04 -0.75 -2.14 117.51 120.58 1wtd h ILE 222 Ca 0.41 -0.82 0.14 0.00 1.00 0.00 0.00 64.86 65.59 1wtd h ILE 222 Cb 0.32 1.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.14 1wtd h ILE 222 CO -0.22 0.21 0.56 -0.33 0.00 0.00 0.00 178.15 178.37 1wtd h GLU 223 N -0.37 0.66 0.08 2.37 5.08 -0.63 -1.78 114.58 119.99 1wtd h GLU 223 Ca -0.00 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 58.04 1wtd h GLU 223 Cb 0.36 -0.15 0.03 0.00 0.50 0.00 0.00 28.75 29.48 1wtd h GLU 223 CO 0.00 0.44 -1.14 0.00 -1.00 0.00 0.00 179.01 177.31 1wtd h ARG 224 N 0.68 0.63 -0.89 2.33 3.08 -1.21 -1.36 114.38 117.63 1wtd h ARG 224 Ca 0.43 -0.79 0.08 0.00 0.07 0.00 0.00 59.98 59.78 1wtd h ARG 224 Cb 0.68 0.25 -0.07 0.00 0.08 0.00 0.00 29.97 30.91 1wtd h ARG 224 CO -0.19 1.35 0.54 0.00 -1.07 0.00 0.00 179.97 180.61 1wtd h ALA 225 N 0.31 1.27 -0.31 0.04 0.00 -1.17 -0.60 119.26 118.80 1wtd h ALA 225 Ca -0.17 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1wtd h ALA 225 Cb 1.82 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 1wtd h ALA 225 CO 0.22 0.23 -0.06 0.28 0.00 0.00 0.00 179.25 179.91 1wtd h VAL 226 N 0.94 1.28 -0.44 0.00 2.07 -1.31 -2.05 116.25 116.74 1wtd h VAL 226 Ca 0.41 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1wtd h VAL 226 Cb 0.30 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1wtd h VAL 226 CO -0.22 0.35 0.25 0.50 0.02 0.00 0.00 177.57 178.47 1wtd h LYS 227 N 0.37 0.61 0.00 1.57 3.11 -0.67 -2.90 116.57 118.66 1wtd h LYS 227 Ca 0.08 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.85 1wtd h LYS 227 Cb 0.55 -0.12 -0.00 0.00 -1.00 0.00 0.00 32.23 31.66 1wtd h LYS 227 CO 0.03 0.48 -0.03 0.93 -2.81 0.00 0.00 179.45 178.05 1wtd h GLU 228 N 0.58 0.00 0.00 1.90 5.08 -1.12 -2.56 114.58 118.47 1wtd h GLU 228 Ca 0.16 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.42 1wtd h GLU 228 Cb 0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1wtd h GLU 228 CO -0.03 0.03 -0.45 0.00 -1.00 0.00 0.00 179.01 177.57 1wtd h ALA 229 N 1.97 0.96 -6.42 3.43 0.00 -1.21 -3.48 119.26 114.50 1wtd h ALA 229 Ca -0.00 -0.41 -0.44 0.00 0.00 0.00 0.00 54.91 54.06 1wtd h ALA 229 Cb 0.81 -0.07 0.04 0.00 0.00 0.00 0.00 17.79 18.57 1wtd h ALA 229 CO 0.00 0.56 -0.90 -3.47 0.00 0.00 0.00 179.25 175.45 1wtd n ASP 230 N -3.57 -5.20 -0.63 0.00 4.64 -0.96 -4.91 116.55 105.91 1wtd n ASP 230 Ca -0.00 -0.98 0.09 0.00 -1.38 0.00 0.00 54.79 52.51 1wtd n ASP 230 Cb 0.55 -2.79 0.05 0.00 -1.04 0.00 0.00 41.12 37.89 1wtd n ASP 230 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 1wtd n ILE 231 N -3.83 0.00 0.03 5.18 -5.35 -1.26 -4.70 119.36 109.43 1wtd n ILE 231 Ca -0.14 -0.45 -0.06 0.00 -0.27 0.00 0.00 62.75 61.83 1wtd n ILE 231 Cb 0.60 1.33 0.12 0.00 -1.74 0.00 0.00 39.64 39.95 1wtd n ILE 231 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1wtd h LYS 232 N 3.10 0.44 0.08 6.28 3.64 -1.93 -2.68 116.57 125.50 1wtd h LYS 232 Ca 0.00 -0.24 -0.35 0.00 -1.27 0.00 0.00 60.65 58.79 1wtd h LYS 232 Cb 0.71 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.51 1wtd h LYS 232 CO 0.00 0.82 -1.92 0.39 -2.27 0.00 0.00 179.45 176.46 1wtd n GLU 233 N -3.99 0.70 0.27 1.90 1.02 -1.26 -4.36 120.64 114.92 1wtd n GLU 233 Ca -0.02 0.32 0.18 0.00 -0.02 0.00 0.00 57.16 57.61 1wtd n GLU 233 Cb 0.54 -1.69 0.77 0.00 -0.02 0.00 0.00 31.44 31.04 1wtd n GLU 233 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1wtd h LYS 234 N -0.20 0.00 0.19 3.49 2.10 -1.84 -3.23 116.57 117.08 1wtd h LYS 234 Ca -0.44 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 57.90 1wtd h LYS 234 Cb 1.85 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 33.20 1wtd h LYS 234 CO -0.01 0.00 -1.44 -0.91 -2.00 0.00 0.00 179.45 175.09 1wtd h ASN 235 N 0.00 0.63 -0.40 7.07 4.21 -1.67 -2.98 115.58 122.44 1wtd h ASN 235 Ca 0.00 -0.72 0.08 0.00 1.21 0.00 0.00 56.30 56.88 1wtd h ASN 235 Cb 0.39 -0.21 -0.09 0.00 -1.12 0.00 0.00 38.32 37.30 1wtd h ASN 235 CO 0.00 1.57 -0.27 0.50 -1.29 0.00 0.00 177.43 177.94 1wtd h LYS 236 N 0.11 -0.19 -0.54 0.81 3.64 -1.75 0.42 116.57 119.07 1wtd h LYS 236 Ca -0.22 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.11 1wtd h LYS 236 Cb 2.08 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.92 1wtd h LYS 236 CO 0.23 -0.13 0.12 -0.44 -2.27 0.00 0.00 179.45 176.96 1wtd h ASP 237 N -0.20 0.83 -0.54 4.20 5.19 -1.73 -1.88 116.42 122.30 1wtd h ASP 237 Ca 0.19 -0.24 -0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1wtd h ASP 237 Cb 0.50 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.76 1wtd h ASP 237 CO -0.52 0.86 0.33 -0.07 -3.12 0.00 0.00 179.24 176.72 1wtd h LEU 238 N 0.77 0.64 -0.76 1.55 3.38 -1.04 0.08 115.31 119.94 1wtd h LEU 238 Ca 0.17 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 1wtd h LEU 238 Cb 0.36 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1wtd h LEU 238 CO 0.00 0.50 -0.54 0.40 0.09 0.00 0.00 178.44 178.90 1wtd h ILE 239 N 0.73 1.36 -0.04 1.22 2.04 -0.13 0.13 117.51 122.81 1wtd h ILE 239 Ca 0.19 -1.82 -0.00 0.00 1.00 0.00 0.00 64.86 64.23 1wtd h ILE 239 Cb -0.03 1.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1wtd h ILE 239 CO -0.04 0.54 0.02 -0.08 0.00 0.00 0.00 178.15 178.59 1wtd h GLU 240 N 0.18 0.06 -0.56 2.37 4.57 -1.10 -2.20 114.58 117.90 1wtd h GLU 240 Ca 0.00 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.23 1wtd h GLU 240 Cb 1.00 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.53 1wtd h GLU 240 CO 0.08 0.19 0.26 0.87 -1.18 0.00 0.00 179.01 179.23 1wtd h LYS 241 N -0.08 0.47 -0.88 1.92 1.57 -0.82 -2.54 116.57 116.21 1wtd h LYS 241 Ca 0.01 -0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.90 1wtd h LYS 241 Cb 0.15 -0.11 -0.09 0.00 0.08 0.00 0.00 32.23 32.27 1wtd h LYS 241 CO -0.00 0.31 0.49 0.35 -0.57 0.00 0.00 179.45 180.03 1wtd h PHE 242 N 0.48 0.88 0.01 -1.35 3.57 -0.55 0.58 116.94 120.55 1wtd h PHE 242 Ca 0.26 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.79 1wtd h PHE 242 Cb 0.22 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.71 1wtd h PHE 242 CO -0.12 0.27 -0.00 -0.22 -2.23 0.00 0.00 178.31 176.00 1wtd h LYS 243 N 0.73 -0.01 -0.01 1.11 3.64 -1.01 -2.09 116.57 118.94 1wtd h LYS 243 Ca 0.47 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.88 1wtd h LYS 243 Cb 0.59 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.36 1wtd h LYS 243 CO -0.32 0.16 -0.32 0.93 -2.27 0.00 0.00 179.45 177.63 1wtd h GLU 244 N -0.17 -0.45 -0.66 1.90 5.08 -1.00 0.23 114.58 119.51 1wtd h GLU 244 Ca -0.00 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.51 1wtd h GLU 244 Cb 0.17 0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.40 1wtd h GLU 244 CO 0.00 -0.30 -0.32 0.45 -1.00 0.00 0.00 179.01 177.84 1wtd h HIS 245 N -0.46 -0.87 -0.63 4.33 3.86 -0.85 0.17 115.15 120.69 1wtd h HIS 245 Ca 0.06 0.08 -0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1wtd h HIS 245 Cb 0.55 0.48 -0.03 0.00 1.06 0.00 0.00 27.41 29.48 1wtd h HIS 245 CO -0.35 -0.38 0.10 0.28 0.86 0.00 0.00 177.93 178.44 1wtd h VAL 246 N -0.12 1.26 -0.13 2.45 2.07 -0.97 -3.18 116.25 117.63 1wtd h VAL 246 Ca 0.26 -1.01 -0.22 0.00 0.82 0.00 0.00 66.70 66.55 1wtd h VAL 246 Cb 0.55 0.67 0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1wtd h VAL 246 CO -0.73 0.38 -0.79 0.00 0.02 0.00 0.00 177.57 176.45 1wtd h ALA 247 N 1.12 0.36 -0.97 1.67 0.00 0.67 -3.14 119.26 118.97 1wtd h ALA 247 Ca 0.19 -0.61 0.21 0.00 0.00 0.00 0.00 54.91 54.70 1wtd h ALA 247 Cb 0.43 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.09 1wtd h ALA 247 CO 0.01 0.70 0.55 1.57 0.00 0.00 0.00 179.25 182.08 1wtd h LYS 248 N 0.48 0.61 -0.96 0.00 -0.00 -0.70 0.32 116.57 116.32 1wtd h LYS 248 Ca -0.05 -0.04 0.23 0.00 -0.00 0.00 0.00 60.65 60.79 1wtd h LYS 248 Cb 1.41 -0.14 -0.07 0.00 -0.00 0.00 0.00 32.23 33.43 1wtd h LYS 248 CO 0.16 0.41 0.64 -0.22 -0.00 0.00 0.00 179.45 180.43 1wtd h LYS 249 N 0.63 0.35 0.00 0.07 3.64 -1.57 -3.20 116.57 116.49 1wtd h LYS 249 Ca 0.58 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.90 1wtd h LYS 249 Cb 0.99 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1wtd h LYS 249 CO -0.43 0.23 -1.43 0.66 -2.27 0.00 0.00 179.45 176.21 1wtd n TYR 250 N -4.52 0.00 -0.21 1.91 4.02 -0.14 -4.87 117.16 113.35 1wtd n TYR 250 Ca 0.21 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 58.02 1wtd n TYR 250 Cb 0.79 -0.25 -0.07 0.00 -0.02 0.00 0.00 39.34 39.79 1wtd n TYR 250 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1wtd h ASN 251 N 0.00 -1.46 -0.57 7.72 2.35 -0.45 -2.10 115.58 121.08 1wtd h ASN 251 Ca -0.06 0.21 0.09 0.00 -0.55 0.00 0.00 56.30 55.98 1wtd h ASN 251 Cb 0.71 0.63 -0.11 0.00 0.05 0.00 0.00 38.32 39.60 1wtd h ASN 251 CO 0.00 -0.22 -0.43 -0.08 -1.65 0.00 0.00 177.43 175.05 1wtd h GLU 252 N -0.13 -0.22 0.00 0.81 4.57 -1.87 0.64 114.58 118.37 1wtd h GLU 252 Ca 0.09 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1wtd h GLU 252 Cb 0.36 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1wtd h GLU 252 CO -0.56 -0.15 0.00 1.96 -1.18 0.00 0.00 179.01 179.08 1wtd h GLN 253 N -0.23 0.00 0.00 1.92 1.08 -1.79 -3.36 115.11 112.73 1wtd h GLN 253 Ca 0.18 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.38 1wtd h GLN 253 Cb 0.56 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1wtd h GLN 253 CO -0.68 0.00 -1.01 1.33 -0.95 0.00 0.00 178.83 177.52 1wtd n VAL 254 N -3.01 0.00 -2.15 -0.54 0.24 -0.83 -4.84 118.33 107.20 1wtd n VAL 254 Ca 0.02 -0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.89 1wtd n VAL 254 Cb 0.37 0.14 -0.03 0.00 -1.47 0.00 0.00 33.84 32.86 1wtd n VAL 254 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1wtd s LEU 255 N -3.25 4.34 0.68 1.34 1.43 0.18 -0.91 118.68 122.49 1wtd s LEU 255 Ca -0.00 2.23 -0.10 0.00 -1.03 0.00 0.00 54.13 55.23 1wtd s LEU 255 Cb 0.00 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.67 1wtd s LEU 255 CO 0.01 -0.74 1.04 0.20 0.23 0.00 0.00 176.35 177.09 1wtd s ASN 256 N 1.80 5.44 0.52 2.29 0.01 0.11 -4.94 114.94 120.17 1wtd s ASN 256 Ca 0.66 0.98 0.23 0.00 -0.71 0.00 0.00 52.86 54.02 1wtd s ASN 256 Cb -0.34 -1.82 1.39 0.00 0.41 0.00 0.00 41.25 40.89 1wtd s ASN 256 CO 0.28 -1.29 2.10 0.00 -1.51 0.00 0.00 177.10 176.68 1wtd h ALA 257 N -0.53 1.52 -0.00 0.60 0.00 -1.96 -1.87 119.26 117.02 1wtd h ALA 257 Ca -0.45 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1wtd h ALA 257 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1wtd h ALA 257 CO 0.63 0.13 -0.15 -0.40 0.00 0.00 0.00 179.25 179.46 1wtd n ASP 258 N -3.96 0.31 0.00 0.00 5.75 -1.26 -4.93 116.55 112.47 1wtd n ASP 258 Ca -0.02 -0.18 0.00 0.00 -0.01 0.00 0.00 54.79 54.57 1wtd n ASP 258 Cb 0.19 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 1wtd n ASP 258 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1wtd n GLY 259 N 1.38 1.79 3.74 6.12 0.00 -0.70 -4.99 105.19 112.53 1wtd n GLY 259 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1wtd n GLY 259 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wtd s THR 260 N -2.30 1.85 0.02 2.61 -4.23 -1.26 -2.13 115.64 110.20 1wtd s THR 260 Ca 0.00 0.00 0.07 0.00 -1.18 0.00 0.00 61.69 60.58 1wtd s THR 260 Cb 0.00 -2.69 -0.02 0.00 1.34 0.00 0.00 72.50 71.13 1wtd s THR 260 CO 0.00 0.00 -0.22 0.00 -0.54 0.00 0.00 174.62 173.86 1wtd s ALA 261 N -3.30 1.84 -0.68 3.99 0.00 -1.26 0.06 121.76 122.41 1wtd s ALA 261 Ca 0.69 -1.03 -0.25 0.00 0.00 0.00 0.00 51.96 51.37 1wtd s ALA 261 Cb -0.11 -0.41 0.05 0.00 0.00 0.00 0.00 23.12 22.66 1wtd s ALA 261 CO 0.55 0.43 1.10 -0.65 0.00 0.00 0.00 175.76 177.19 1wtd s GLN 262 N -0.91 3.18 0.47 0.00 -0.21 -0.09 -4.90 119.66 117.20 1wtd s GLN 262 Ca 0.08 -0.50 0.17 0.00 0.02 0.00 0.00 55.36 55.14 1wtd s GLN 262 Cb -0.09 -4.19 1.14 0.00 1.00 0.00 0.00 33.01 30.88 1wtd s GLN 262 CO 0.01 -1.93 2.00 -1.49 -2.12 0.00 0.00 175.29 171.76 1wtd h TRP 263 N 9.74 0.29 -0.00 0.91 -0.00 -1.97 -1.50 115.95 123.42 1wtd h TRP 263 Ca -0.28 0.01 -0.17 0.00 -0.00 0.00 0.00 58.89 58.45 1wtd h TRP 263 Cb 1.06 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.16 30.11 1wtd h TRP 263 CO 1.03 0.14 -0.79 0.45 -0.00 0.00 0.00 178.44 179.27 1wtd h HIS 264 N 0.27 0.11 -0.10 0.49 3.86 -1.93 0.55 115.15 118.39 1wtd h HIS 264 Ca 0.25 -0.06 -0.15 0.00 -1.16 0.00 0.00 60.37 59.25 1wtd h HIS 264 Cb 0.61 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.06 1wtd h HIS 264 CO -0.00 0.83 -0.59 0.87 0.86 0.00 0.00 177.93 179.90 1wtd h LYS 265 N 0.05 0.34 -0.32 2.45 6.56 -1.63 -2.03 116.57 121.98 1wtd h LYS 265 Ca -0.02 -0.23 -0.06 0.00 -1.06 0.00 0.00 60.65 59.29 1wtd h LYS 265 Cb 1.38 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 33.06 1wtd h LYS 265 CO 0.11 0.83 -0.02 1.25 -2.06 0.00 0.00 179.45 179.56 1wtd h LEU 266 N 0.25 0.58 0.36 2.94 5.85 -1.28 -2.70 115.31 121.32 1wtd h LEU 266 Ca -0.00 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.39 1wtd h LEU 266 Cb 1.11 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 1wtd h LEU 266 CO 0.10 0.77 -0.45 0.25 -0.34 0.00 0.00 178.44 178.76 1wtd h LEU 267 N 0.38 -1.26 -0.45 2.25 6.46 -0.79 -1.48 115.31 120.42 1wtd h LEU 267 Ca 0.09 0.11 0.06 0.00 -0.12 0.00 0.00 57.88 58.02 1wtd h LEU 267 Cb 0.48 0.43 -0.05 0.00 -0.73 0.00 0.00 40.66 40.80 1wtd h LEU 267 CO 0.02 -0.58 0.16 -0.08 -0.62 0.00 0.00 178.44 177.34 1wtd h GLU 268 N -0.85 0.33 -0.59 1.25 4.81 -1.43 -0.19 114.58 117.91 1wtd h GLU 268 Ca -0.03 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1wtd h GLU 268 Cb 0.78 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 1wtd h GLU 268 CO -0.12 0.22 0.34 1.98 -0.73 0.00 0.00 179.01 180.70 1wtd h MET 269 N 0.34 0.80 0.21 1.92 4.05 -1.44 -1.50 114.93 119.30 1wtd h MET 269 Ca 0.21 -0.07 -0.32 0.00 -0.28 0.00 0.00 59.70 59.24 1wtd h MET 269 Cb 0.20 -0.17 0.02 0.00 -0.80 0.00 0.00 31.60 30.86 1wtd h MET 269 CO -0.21 0.57 -1.47 0.82 0.23 0.00 0.00 176.91 176.85 1wtd h ILE 270 N 0.81 1.28 -0.30 1.77 2.04 -0.60 -3.35 117.51 119.17 1wtd h ILE 270 Ca 0.21 -2.77 0.00 0.00 1.00 0.00 0.00 64.86 63.30 1wtd h ILE 270 Cb -0.01 2.97 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 1wtd h ILE 270 CO -0.04 0.84 0.00 0.59 0.00 0.00 0.00 178.15 179.54 1wtd n ASN 271 N -3.64 2.19 -0.53 1.72 4.13 -0.14 -5.11 115.26 113.87 1wtd n ASN 271 Ca -0.16 -1.86 0.14 0.00 1.68 0.00 0.00 54.58 54.38 1wtd n ASN 271 Cb 1.08 -0.19 0.48 0.00 -1.54 0.00 0.00 39.78 39.60 1wtd n ASN 271 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75