#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bru h GLU 21 N 0.00 0.00 0.23 0.00 9.09 -1.94 0.35 114.58 122.32 2bru h GLU 21 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 2bru h GLU 21 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2bru h GLU 21 CO 0.00 0.00 -0.11 0.93 0.05 0.00 0.00 179.01 179.88 2bru h GLU 22 N 0.00 -0.30 -0.63 1.06 3.07 -1.99 -2.77 114.58 113.02 2bru h GLU 22 Ca 0.07 0.02 0.10 0.00 -0.50 0.00 0.00 59.36 59.05 2bru h GLU 22 Cb 0.33 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.27 2bru h GLU 22 CO -0.00 0.01 0.42 1.15 -1.40 0.00 0.00 179.01 179.19 2bru h THR 23 N -0.61 0.90 -0.59 1.13 2.02 -1.37 0.11 112.91 114.50 2bru h THR 23 Ca -0.03 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 2bru h THR 23 Cb 0.44 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 2bru h THR 23 CO 0.05 0.08 0.25 0.00 0.37 0.00 0.00 175.52 176.28 2bru h ALA 24 N 1.68 1.33 0.00 6.16 0.00 -1.24 0.93 119.26 128.13 2bru h ALA 24 Ca 0.29 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2bru h ALA 24 Cb 0.53 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2bru h ALA 24 CO -0.09 0.50 -0.00 0.93 0.00 0.00 0.00 179.25 180.60 2bru h GLU 25 N 0.84 -0.00 -0.78 0.00 3.07 -0.59 -3.36 114.58 113.75 2bru h GLU 25 Ca 0.20 0.00 0.14 0.00 -0.50 0.00 0.00 59.36 59.20 2bru h GLU 25 Cb 0.14 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 27.96 2bru h GLU 25 CO -0.02 0.78 0.36 -0.07 -1.40 0.00 0.00 179.01 178.66 2bru h LEU 26 N -0.79 0.40 0.12 1.33 4.07 -0.73 -2.59 115.31 117.12 2bru h LEU 26 Ca -0.00 0.09 -0.01 0.00 0.08 0.00 0.00 57.88 58.05 2bru h LEU 26 Cb 0.78 0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.56 2bru h LEU 26 CO 0.00 0.18 -0.06 -0.07 -1.08 0.00 0.00 178.44 177.41 2bru h LEU 27 N 0.54 -0.14 -1.37 1.67 3.38 -0.98 0.27 115.31 118.68 2bru h LEU 27 Ca 0.42 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2bru h LEU 27 Cb 0.59 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2bru h LEU 27 CO -0.36 -0.09 0.00 0.07 0.09 0.00 0.00 178.44 178.14 2bru h LYS 28 N -0.17 0.00 -0.01 1.13 2.10 -1.67 0.07 116.57 118.01 2bru h LYS 28 Ca -0.02 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.55 2bru h LYS 28 Cb 0.13 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.47 2bru h LYS 28 CO 0.03 0.00 -0.31 -0.97 -2.00 0.00 0.00 179.45 176.20 2bru h ASN 29 N 0.00 0.29 -0.99 7.07 -1.24 -0.97 -3.42 115.58 116.32 2bru h ASN 29 Ca 0.00 -0.74 0.24 0.00 0.71 0.00 0.00 56.30 56.51 2bru h ASN 29 Cb 0.33 -0.09 -0.08 0.00 0.73 0.00 0.00 38.32 39.21 2bru h ASN 29 CO 0.00 1.00 0.65 0.28 -1.29 0.00 0.00 177.43 178.07 2bru h SER 30 N -0.38 0.41 0.00 1.15 0.02 0.16 -3.46 113.55 111.45 2bru h SER 30 Ca -0.03 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2bru h SER 30 Cb 1.03 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2bru h SER 30 CO 0.06 0.12 0.00 0.00 -1.14 0.00 0.00 176.83 175.87 2bru n HIS 31 N -4.55 0.00 -4.96 3.45 1.44 -1.25 -3.95 115.22 105.39 2bru n HIS 31 Ca 0.23 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.66 2bru n HIS 31 Cb 0.81 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.76 2bru n HIS 31 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2bru s SER 32 N 0.00 2.47 -0.07 4.39 0.01 -1.26 -1.22 113.70 118.01 2bru s SER 32 Ca 0.00 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2bru s SER 32 Cb 0.00 -0.83 0.02 0.00 0.21 0.00 0.00 66.02 65.42 2bru s SER 32 CO 0.00 0.16 -0.07 -0.69 0.41 0.00 0.00 173.24 173.05 2bru s VAL 33 N 0.14 0.81 -0.19 3.43 1.01 -0.41 -2.10 120.40 123.07 2bru s VAL 33 Ca -0.08 -0.22 -0.08 0.00 0.00 0.00 0.00 61.98 61.60 2bru s VAL 33 Cb -0.14 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2bru s VAL 33 CO 0.04 0.31 0.08 -0.63 0.00 0.00 0.00 175.10 174.90 2bru s ILE 34 N 1.27 4.90 -0.29 2.22 -1.09 -1.21 -1.52 121.20 125.49 2bru s ILE 34 Ca -0.04 0.01 -0.10 0.00 -2.23 0.00 0.00 60.65 58.29 2bru s ILE 34 Cb -0.14 -3.23 -0.02 0.00 -1.58 0.00 0.00 42.46 37.50 2bru s ILE 34 CO -0.02 0.44 0.15 -0.63 -1.23 0.00 0.00 174.94 173.64 2bru s ILE 35 N 0.50 4.72 -0.60 2.92 1.01 -0.22 -0.04 121.20 129.49 2bru s ILE 35 Ca 0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 2bru s ILE 35 Cb -0.12 -3.33 0.16 0.00 0.01 0.00 0.00 42.46 39.17 2bru s ILE 35 CO 0.00 0.16 0.43 -0.89 0.00 0.00 0.00 174.94 174.64 2bru s THR 36 N 1.65 3.83 0.54 2.92 2.01 0.37 -0.17 115.64 126.79 2bru s THR 36 Ca 0.06 -2.72 -0.16 0.00 0.31 0.00 0.00 61.69 59.18 2bru s THR 36 Cb -0.16 -3.50 -0.07 0.00 0.01 0.00 0.00 72.50 68.78 2bru s THR 36 CO 0.07 -0.86 1.00 -2.84 -0.69 0.00 0.00 174.62 171.31 2bru s PRO 37 N 0.21 3.78 0.00 4.92 0.02 -1.26 -0.29 135.00 142.39 2bru s PRO 37 Ca 0.15 1.00 0.00 0.00 0.02 0.00 0.00 61.00 62.17 2bru s PRO 37 Cb -0.20 -2.11 0.00 0.00 0.02 0.00 0.00 34.50 32.21 2bru s PRO 37 CO -0.04 -0.41 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 2bru n GLY 38 N -1.52 4.53 0.30 0.52 0.00 0.53 -2.08 105.19 107.46 2bru n GLY 38 Ca 0.07 -0.60 0.02 0.00 0.00 0.00 0.00 46.02 45.51 2bru n GLY 38 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2bru h TYR 39 N 0.00 0.56 -0.47 1.61 3.20 -0.78 -1.36 116.97 119.73 2bru h TYR 39 Ca 0.00 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.94 2bru h TYR 39 Cb 0.00 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.06 2bru h TYR 39 CO 0.00 0.42 0.32 0.78 -1.64 0.00 0.00 178.16 178.04 2bru h GLY 40 N 0.69 0.39 2.00 1.82 0.00 -1.51 -1.22 103.07 105.25 2bru h GLY 40 Ca 0.15 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 47.25 2bru h GLY 40 CO -0.02 0.08 -0.48 1.98 0.00 0.00 0.00 176.54 178.10 2bru h MET 41 N 0.30 0.00 -0.01 4.80 1.85 -1.37 0.26 114.93 120.76 2bru h MET 41 Ca 0.22 0.00 -0.25 0.00 -0.61 0.00 0.00 59.70 59.05 2bru h MET 41 Cb 0.47 0.00 0.02 0.00 0.43 0.00 0.00 31.60 32.51 2bru h MET 41 CO -0.05 0.48 -1.00 0.00 -0.40 0.00 0.00 176.91 175.95 2bru h ALA 42 N 1.52 0.21 0.10 0.39 0.00 -1.33 -3.32 119.26 116.82 2bru h ALA 42 Ca -0.00 -0.69 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 2bru h ALA 42 Cb 1.16 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2bru h ALA 42 CO 0.06 0.72 -0.05 0.28 0.00 0.00 0.00 179.25 180.27 2bru h VAL 43 N 0.36 0.00 -3.58 0.00 2.07 -1.16 -3.42 116.25 110.53 2bru h VAL 43 Ca -0.11 -0.29 -0.64 0.00 0.82 0.00 0.00 66.70 66.48 2bru h VAL 43 Cb 1.64 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 31.27 2bru h VAL 43 CO 0.19 0.00 0.14 0.00 0.02 0.00 0.00 177.57 177.92 2bru s ALA 44 N -3.16 3.43 -1.20 1.67 0.00 0.07 -4.96 121.76 117.60 2bru s ALA 44 Ca -0.02 -0.94 -0.22 0.00 0.00 0.00 0.00 51.96 50.79 2bru s ALA 44 Cb 0.00 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 2bru s ALA 44 CO 0.06 -1.45 1.90 0.00 0.00 0.00 0.00 175.76 176.26 2bru n GLN 45 N 6.11 1.94 0.00 0.00 10.64 -1.25 -4.05 117.38 130.77 2bru n GLN 45 Ca -0.01 -2.62 0.06 0.00 -1.83 0.00 0.00 57.00 52.60 2bru n GLN 45 Cb 0.48 -3.65 0.31 0.00 -0.86 0.00 0.00 30.24 26.53 2bru n GLN 45 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2bru n ALA 46 N 12.81 1.73 0.03 2.61 0.00 -1.25 -4.20 120.51 132.24 2bru n ALA 46 Ca 0.46 -0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.65 2bru n ALA 46 Cb 0.46 -1.21 -0.11 0.00 0.00 0.00 0.00 19.45 18.59 2bru n ALA 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2bru h GLN 47 N 0.00 0.57 -0.58 0.00 -0.00 -1.85 -0.83 115.11 112.42 2bru h GLN 47 Ca 0.00 -0.64 -0.01 0.00 -0.00 0.00 0.00 58.65 58.01 2bru h GLN 47 Cb 0.13 0.19 -0.03 0.00 -0.00 0.00 0.00 27.48 27.77 2bru h GLN 47 CO 0.00 1.25 0.33 1.88 -0.00 0.00 0.00 178.83 182.28 2bru h TYR 48 N 0.17 0.78 -0.90 0.06 0.05 -1.89 -0.79 116.97 114.45 2bru h TYR 48 Ca -0.12 -0.01 0.12 0.00 0.05 0.00 0.00 58.73 58.77 2bru h TYR 48 Cb 1.57 -0.25 -0.08 0.00 1.01 0.00 0.00 36.73 38.97 2bru h TYR 48 CO 0.12 0.56 0.53 -1.35 -1.05 0.00 0.00 178.16 176.97 2bru h PRO 49 N 0.78 0.82 -0.80 4.88 0.11 -1.77 -0.53 132.00 135.48 2bru h PRO 49 Ca 0.21 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 2bru h PRO 49 Cb 0.02 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 30.91 2bru h PRO 49 CO -0.04 0.54 0.48 0.28 -0.21 0.00 0.00 178.00 179.06 2bru h VAL 50 N 0.84 1.23 -0.30 3.15 2.07 -0.72 0.21 116.25 122.73 2bru h VAL 50 Ca 0.45 -0.49 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 2bru h VAL 50 Cb 0.48 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2bru h VAL 50 CO -0.28 0.24 0.03 0.00 0.02 0.00 0.00 177.57 177.58 2bru h ALA 51 N 1.26 1.49 -0.53 1.67 0.00 -0.80 -0.44 119.26 121.91 2bru h ALA 51 Ca 0.29 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 2bru h ALA 51 Cb -0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2bru h ALA 51 CO -0.05 0.37 -0.11 0.93 0.00 0.00 0.00 179.25 180.39 2bru h GLU 52 N 0.44 0.99 0.01 0.00 4.39 0.67 -0.66 114.58 120.42 2bru h GLU 52 Ca 0.10 -0.36 -0.24 0.00 0.34 0.00 0.00 59.36 59.20 2bru h GLU 52 Cb 0.25 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2bru h GLU 52 CO 0.00 1.04 -0.99 0.97 -1.16 0.00 0.00 179.01 178.87 2bru h ILE 53 N 0.88 1.36 -0.53 3.13 6.09 -0.49 -3.33 117.51 124.62 2bru h ILE 53 Ca 0.14 -2.39 -0.07 0.00 -1.37 0.00 0.00 64.86 61.17 2bru h ILE 53 Cb 0.67 2.42 -0.02 0.00 0.47 0.00 0.00 36.82 40.36 2bru h ILE 53 CO 0.05 0.72 0.06 0.74 -3.07 0.00 0.00 178.15 176.65 2bru h THR 54 N 0.28 1.24 -0.71 2.19 2.02 -0.76 0.24 112.91 117.42 2bru h THR 54 Ca -0.10 -0.96 0.24 0.00 0.77 0.00 0.00 66.41 66.37 2bru h THR 54 Cb 1.64 0.77 -0.13 0.00 -1.74 0.00 0.00 68.15 68.69 2bru h THR 54 CO 0.18 0.35 0.19 1.21 0.37 0.00 0.00 175.52 177.82 2bru n GLU 55 N -4.23 -0.05 -0.02 6.66 4.07 -0.28 -1.40 120.64 125.39 2bru n GLU 55 Ca 0.03 1.02 -0.21 0.00 -0.06 0.00 0.00 57.16 57.94 2bru n GLU 55 Cb 0.28 -1.71 -0.13 0.00 -0.06 0.00 0.00 31.44 29.81 2bru n GLU 55 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2bru h LYS 56 N 0.00 0.18 -0.10 5.31 6.56 -0.75 -3.39 116.57 124.38 2bru h LYS 56 Ca 0.51 -0.31 -0.01 0.00 -1.06 0.00 0.00 60.65 59.79 2bru h LYS 56 Cb 1.23 0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 33.00 2bru h LYS 56 CO -0.61 1.15 0.04 -0.07 -2.06 0.00 0.00 179.45 177.91 2bru h LEU 57 N -0.41 0.14 -0.52 2.94 3.38 0.11 -1.49 115.31 119.47 2bru h LEU 57 Ca -0.34 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.32 2bru h LEU 57 Cb 1.69 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.40 2bru h LEU 57 CO -0.01 0.25 -0.64 -0.09 0.09 0.00 0.00 178.44 178.04 2bru h ARG 58 N 0.02 0.38 0.00 1.13 9.65 -1.46 0.47 114.38 124.57 2bru h ARG 58 Ca 0.04 -0.28 0.00 0.00 -1.10 0.00 0.00 59.98 58.64 2bru h ARG 58 Cb 0.15 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 2bru h ARG 58 CO -0.00 0.90 0.00 0.00 2.80 0.00 0.00 179.97 183.66 2bru h ALA 59 N 1.04 1.00 -0.49 2.80 0.00 -1.71 -0.96 119.26 120.93 2bru h ALA 59 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bru h ALA 59 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2bru h ALA 59 CO 0.11 0.00 0.00 -2.13 0.00 0.00 0.00 179.25 177.23 2bru n ARG 60 N -2.99 2.90 -1.74 0.00 0.63 0.11 -4.91 116.66 110.66 2bru n ARG 60 Ca -0.03 -2.07 -0.17 0.00 -0.92 0.00 0.00 57.85 54.65 2bru n ARG 60 Cb 0.07 -1.68 -0.06 0.00 0.45 0.00 0.00 32.46 31.24 2bru n ARG 60 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2bru n GLY 61 N 0.98 1.12 3.66 5.14 0.00 -0.36 -4.95 105.19 110.77 2bru n GLY 61 Ca 0.19 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2bru n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bru s ILE 62 N -2.71 4.40 -0.99 -0.61 1.01 -0.90 -4.91 121.20 116.49 2bru s ILE 62 Ca 0.00 1.69 -0.26 0.00 0.00 0.00 0.00 60.65 62.08 2bru s ILE 62 Cb 0.00 -4.09 -0.15 0.00 0.01 0.00 0.00 42.46 38.22 2bru s ILE 62 CO 0.00 -0.15 2.15 0.21 0.00 0.00 0.00 174.94 177.15 2bru s ASN 63 N 1.76 4.06 -0.16 3.58 2.47 -0.36 -4.52 114.94 121.77 2bru s ASN 63 Ca 0.52 -0.73 -0.08 0.00 0.42 0.00 0.00 52.86 52.98 2bru s ASN 63 Cb -0.20 -2.58 -0.04 0.00 -1.45 0.00 0.00 41.25 36.98 2bru s ASN 63 CO 0.12 -3.95 0.13 0.54 -3.72 0.00 0.00 177.10 170.21 2bru s VAL 64 N 14.45 5.37 -0.00 -5.21 0.11 -1.26 -1.29 120.40 132.56 2bru s VAL 64 Ca 0.81 0.17 0.01 0.00 -2.93 0.00 0.00 61.98 60.04 2bru s VAL 64 Cb -0.07 -3.39 -0.00 0.00 -1.53 0.00 0.00 36.38 31.39 2bru s VAL 64 CO 0.12 0.53 -0.03 -0.13 -3.33 0.00 0.00 175.10 172.26 2bru s ARG 65 N -0.34 0.23 -0.98 1.54 1.81 -0.57 -4.90 118.95 115.74 2bru s ARG 65 Ca 0.11 -0.10 -0.10 0.00 -1.72 0.00 0.00 55.73 53.92 2bru s ARG 65 Cb -0.12 -0.22 0.25 0.00 -0.45 0.00 0.00 34.95 34.41 2bru s ARG 65 CO 0.01 0.06 0.94 -0.06 -0.68 0.00 0.00 175.30 175.57 2bru s PHE 66 N -0.07 4.03 -1.32 -0.53 0.40 -0.38 -1.06 117.98 119.05 2bru s PHE 66 Ca 0.01 -2.48 -0.15 0.00 -0.60 0.00 0.00 56.93 53.70 2bru s PHE 66 Cb -0.01 -3.75 -0.01 0.00 0.51 0.00 0.00 43.02 39.76 2bru s PHE 66 CO -0.00 -0.94 2.20 0.41 0.70 0.00 0.00 175.22 177.59 2bru n GLY 67 N 3.14 4.02 3.77 4.36 0.00 0.77 -0.47 105.19 120.77 2bru n GLY 67 Ca 0.20 -1.51 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 2bru n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bru s ILE 68 N 3.52 3.08 -0.61 -0.61 1.01 -0.99 -4.04 121.20 122.56 2bru s ILE 68 Ca 0.50 0.98 -0.01 0.00 0.00 0.00 0.00 60.65 62.13 2bru s ILE 68 Cb 0.14 -3.58 0.16 0.00 0.01 0.00 0.00 42.46 39.18 2bru s ILE 68 CO -0.05 0.16 0.41 -2.28 0.00 0.00 0.00 174.94 173.18 2bru s HIS 69 N -1.30 3.36 0.06 3.97 5.65 -0.88 -1.03 115.29 125.12 2bru s HIS 69 Ca 0.53 -2.88 -0.27 0.00 0.25 0.00 0.00 55.06 52.69 2bru s HIS 69 Cb -0.33 -3.08 -0.17 0.00 -1.18 0.00 0.00 32.58 27.81 2bru s HIS 69 CO 0.43 -0.80 1.58 -1.35 -0.65 0.00 0.00 174.74 173.95 2bru h PRO 70 N 6.79 -0.37 -6.06 2.88 0.11 -1.95 -3.35 132.00 130.06 2bru h PRO 70 Ca -0.02 0.03 -0.53 0.00 0.11 0.00 0.00 66.00 65.58 2bru h PRO 70 Cb 0.92 0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 2bru h PRO 70 CO 0.71 -0.18 1.36 0.08 -0.21 0.00 0.00 178.00 179.76 2bru s VAL 71 N -5.75 3.34 -0.30 3.15 1.01 -1.26 -3.11 120.40 117.48 2bru s VAL 71 Ca -0.15 0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.96 2bru s VAL 71 Cb 0.04 -3.64 0.17 0.00 0.00 0.00 0.00 36.38 32.95 2bru s VAL 71 CO 0.63 -0.53 1.05 0.00 0.00 0.00 0.00 175.10 176.25 2bru s ALA 72 N 8.51 -2.87 0.00 5.51 0.00 -1.26 -5.01 121.76 126.64 2bru s ALA 72 Ca 0.78 1.96 0.00 0.00 0.00 0.00 0.00 51.96 54.70 2bru s ALA 72 Cb -0.18 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.80 2bru s ALA 72 CO 0.28 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.45 2bru n GLY 73 N 4.93 1.89 3.51 0.00 0.00 -1.26 -3.94 105.19 110.30 2bru n GLY 73 Ca -0.08 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 2bru n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bru s ARG 74 N 0.00 1.54 -0.11 1.61 3.00 -1.26 -5.09 118.95 118.64 2bru s ARG 74 Ca 0.00 -1.39 -0.08 0.00 0.00 0.00 0.00 55.73 54.26 2bru s ARG 74 Cb 0.00 0.43 0.03 0.00 0.00 0.00 0.00 34.95 35.41 2bru s ARG 74 CO 0.00 -0.62 0.16 1.28 0.00 0.00 0.00 175.30 176.12 2bru n LEU 75 N -0.39 -6.28 -4.56 2.53 4.77 -1.26 -4.78 117.00 107.04 2bru n LEU 75 Ca -0.01 2.50 -0.18 0.00 -0.03 0.00 0.00 56.01 58.29 2bru n LEU 75 Cb 0.63 -3.26 -0.06 0.00 -2.33 0.00 0.00 43.42 38.39 2bru n LEU 75 CO 0.25 -3.63 1.27 -2.16 -1.33 0.00 0.00 177.39 171.79 2bru s PRO 76 N -0.66 1.93 0.00 3.23 0.04 -1.26 -3.34 135.00 134.93 2bru s PRO 76 Ca -0.19 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.08 2bru s PRO 76 Cb 0.01 -4.88 0.00 0.00 0.04 0.00 0.00 34.50 29.68 2bru s PRO 76 CO 0.51 -4.07 0.00 0.41 0.04 0.00 0.00 177.00 173.89 2bru n GLY 77 N 6.82 2.28 0.44 0.56 0.00 -1.18 -4.94 105.19 109.16 2bru n GLY 77 Ca 0.44 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.71 2bru n GLY 77 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2bru h HIS 78 N 0.00 0.00 -0.34 1.61 6.17 -1.86 0.19 115.15 120.91 2bru h HIS 78 Ca 0.00 0.00 0.04 0.00 0.71 0.00 0.00 60.37 61.12 2bru h HIS 78 Cb 0.00 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 29.91 2bru h HIS 78 CO 0.00 0.00 0.23 0.00 0.71 0.00 0.00 177.93 178.87 2bru h MET 79 N 0.00 0.28 -0.45 5.26 -0.00 -1.91 -0.35 114.93 117.77 2bru h MET 79 Ca 0.33 -0.02 -0.10 0.00 -0.00 0.00 0.00 59.70 59.91 2bru h MET 79 Cb 1.51 -0.06 -0.02 0.00 -0.00 0.00 0.00 31.60 33.03 2bru h MET 79 CO -0.00 0.19 -0.13 -0.97 -0.00 0.00 0.00 176.91 175.99 2bru h ASN 80 N 0.29 0.82 -0.33 -0.10 -1.24 -1.02 -2.45 115.58 111.55 2bru h ASN 80 Ca 0.15 -0.26 -0.10 0.00 0.71 0.00 0.00 56.30 56.79 2bru h ASN 80 Cb 0.22 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 2bru h ASN 80 CO -0.03 0.97 -0.20 0.58 -1.29 0.00 0.00 177.43 177.46 2bru h VAL 81 N 0.74 1.29 -0.90 2.57 2.07 -1.04 0.55 116.25 121.54 2bru h VAL 81 Ca 0.12 -1.33 0.13 0.00 0.82 0.00 0.00 66.70 66.44 2bru h VAL 81 Cb 0.64 1.44 -0.09 0.00 -1.52 0.00 0.00 31.29 31.76 2bru h VAL 81 CO 0.04 0.43 0.52 -0.07 0.02 0.00 0.00 177.57 178.51 2bru h LEU 82 N 0.49 0.71 -0.24 2.57 3.38 -1.16 0.63 115.31 121.68 2bru h LEU 82 Ca 0.07 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2bru h LEU 82 Cb 0.75 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2bru h LEU 82 CO 0.06 0.35 0.04 0.25 0.09 0.00 0.00 178.44 179.22 2bru h LEU 83 N 0.79 0.39 -1.36 1.67 5.85 -0.84 -1.80 115.31 120.01 2bru h LEU 83 Ca 0.47 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2bru h LEU 83 Cb 0.56 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2bru h LEU 83 CO -0.31 0.55 0.24 0.00 -0.34 0.00 0.00 178.44 178.58 2bru h ALA 84 N 0.85 1.51 -0.44 1.25 0.00 -0.35 -2.00 119.26 120.07 2bru h ALA 84 Ca 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2bru h ALA 84 Cb 0.33 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2bru h ALA 84 CO 0.01 0.40 0.11 0.93 0.00 0.00 0.00 179.25 180.69 2bru h GLU 85 N 0.67 0.71 0.00 0.00 5.08 -0.74 -3.24 114.58 117.06 2bru h GLU 85 Ca 0.17 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bru h GLU 85 Cb 0.07 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2bru h GLU 85 CO -0.02 0.70 0.05 0.00 -1.00 0.00 0.00 179.01 178.74 2bru n ALA 86 N -2.36 0.96 -3.11 3.43 0.00 -0.69 -4.78 120.51 113.95 2bru n ALA 86 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 2bru n ALA 86 Cb 0.21 -0.72 0.03 0.00 0.00 0.00 0.00 19.45 18.97 2bru n ALA 86 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2bru n LYS 87 N -1.02 -1.68 -4.28 0.00 4.76 -1.22 -4.85 118.16 109.86 2bru n LYS 87 Ca 0.00 1.23 -0.29 0.00 -2.87 0.00 0.00 58.31 56.37 2bru n LYS 87 Cb 0.05 -5.73 -0.11 0.00 -1.84 0.00 0.00 35.03 27.39 2bru n LYS 87 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2bru s VAL 88 N -3.16 3.00 -0.53 -0.18 1.01 -1.25 -4.87 120.40 114.42 2bru s VAL 88 Ca 0.19 -1.44 -0.23 0.00 0.00 0.00 0.00 61.98 60.50 2bru s VAL 88 Cb -0.02 -2.38 -0.23 0.00 0.00 0.00 0.00 36.38 33.74 2bru s VAL 88 CO 0.73 0.10 1.69 -0.81 0.00 0.00 0.00 175.10 176.82 2bru n PRO 89 N 0.77 0.04 0.24 2.72 -0.04 -1.26 -4.68 135.00 132.80 2bru n PRO 89 Ca -0.15 -1.14 0.07 0.00 -0.04 0.00 0.00 63.50 62.24 2bru n PRO 89 Cb 0.53 -2.90 0.61 0.00 -0.04 0.00 0.00 33.50 31.70 2bru n PRO 89 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2bru h TYR 90 N 10.46 0.03 -0.97 0.54 3.20 -1.94 -1.73 116.97 126.56 2bru h TYR 90 Ca 0.08 0.00 0.40 0.00 3.14 0.00 0.00 58.73 62.35 2bru h TYR 90 Cb 0.87 -0.01 -0.17 0.00 1.54 0.00 0.00 36.73 38.96 2bru h TYR 90 CO 1.08 0.04 0.53 -3.47 -1.64 0.00 0.00 178.16 174.70 2bru n ASP 91 N -4.51 0.32 -1.41 -2.11 2.03 -1.26 -1.12 116.55 108.49 2bru n ASP 91 Ca -0.03 1.56 -0.02 0.00 0.52 0.00 0.00 54.79 56.83 2bru n ASP 91 Cb 0.11 -0.76 0.25 0.00 -0.72 0.00 0.00 41.12 39.99 2bru n ASP 91 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2bru n ILE 92 N -5.12 2.64 -3.08 5.18 -5.35 -0.65 -4.92 119.36 108.06 2bru n ILE 92 Ca 0.36 -2.07 -0.40 0.00 -0.27 0.00 0.00 62.75 60.38 2bru n ILE 92 Cb 1.24 -0.32 -0.05 0.00 -1.74 0.00 0.00 39.64 38.77 2bru n ILE 92 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2bru s VAL 93 N -3.04 5.05 -0.69 7.28 1.01 -0.27 -1.25 120.40 128.48 2bru s VAL 93 Ca 0.48 1.35 0.03 0.00 0.00 0.00 0.00 61.98 63.84 2bru s VAL 93 Cb 0.40 -4.00 0.17 0.00 0.00 0.00 0.00 36.38 32.95 2bru s VAL 93 CO 0.08 0.23 0.49 -0.76 0.00 0.00 0.00 175.10 175.14 2bru s LEU 94 N 1.02 4.90 -0.38 3.92 1.02 0.38 -4.90 118.68 124.64 2bru s LEU 94 Ca 0.35 -3.55 -0.29 0.00 0.02 0.00 0.00 54.13 50.66 2bru s LEU 94 Cb -0.17 -1.72 0.01 0.00 0.02 0.00 0.00 46.19 44.33 2bru s LEU 94 CO 0.16 -0.16 1.34 -1.61 0.02 0.00 0.00 176.35 176.09 2bru s GLU 95 N -1.04 3.71 0.00 1.70 8.01 -1.26 -2.33 118.70 127.49 2bru s GLU 95 Ca 0.23 1.00 0.00 0.00 0.01 0.00 0.00 54.97 56.20 2bru s GLU 95 Cb -0.11 -3.96 0.00 0.00 -4.31 0.00 0.00 34.13 25.75 2bru s GLU 95 CO -0.11 -1.39 0.00 -0.12 0.01 0.00 0.00 175.26 173.65 2bru n MET 96 N 7.78 0.00 -0.64 1.61 0.00 -0.20 -4.94 117.12 120.73 2bru n MET 96 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 57.70 57.64 2bru n MET 96 Cb 0.48 -3.02 0.18 0.00 0.00 0.00 0.00 33.22 30.86 2bru n MET 96 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2bru n ASP 97 N 0.00 -2.10 -3.01 6.12 -0.08 -1.25 -4.85 116.55 111.38 2bru n ASP 97 Ca 0.00 -0.92 -0.29 0.00 -1.51 0.00 0.00 54.79 52.08 2bru n ASP 97 Cb 0.00 -0.72 -0.05 0.00 2.34 0.00 0.00 41.12 42.69 2bru n ASP 97 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2bru n GLU 98 N -4.04 2.88 0.00 -0.67 1.02 -1.26 -4.47 120.64 114.09 2bru n GLU 98 Ca 0.11 -1.73 0.14 0.00 -0.02 0.00 0.00 57.16 55.66 2bru n GLU 98 Cb 0.42 -2.53 0.77 0.00 -0.02 0.00 0.00 31.44 30.09 2bru n GLU 98 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 2bru n ILE 99 N 3.52 0.06 -0.18 -3.67 0.13 -1.26 -3.99 119.36 113.97 2bru n ILE 99 Ca 0.61 0.01 -0.05 0.00 -1.10 0.00 0.00 62.75 62.23 2bru n ILE 99 Cb 0.33 -0.57 0.05 0.00 -0.84 0.00 0.00 39.64 38.61 2bru n ILE 99 CO 0.00 0.00 0.00 -1.13 2.80 0.00 0.00 176.55 178.22 2bru h ASN 100 N 0.00 0.44 -0.73 9.51 -0.73 -1.87 -1.73 115.58 120.46 2bru h ASN 100 Ca 0.00 0.02 0.06 0.00 1.87 0.00 0.00 56.30 58.25 2bru h ASN 100 Cb 0.11 -0.07 -0.06 0.00 0.27 0.00 0.00 38.32 38.58 2bru h ASN 100 CO 0.00 0.31 0.43 -0.78 -0.37 0.00 0.00 177.43 177.02 2bru h ASP 101 N 0.57 0.66 0.66 1.15 3.58 -1.96 -2.51 116.42 118.57 2bru h ASP 101 Ca 0.23 0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.66 2bru h ASP 101 Cb 0.09 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 2bru h ASP 101 CO -0.13 0.43 -0.18 0.44 -2.88 0.00 0.00 179.24 176.91 2bru h ASP 102 N 0.80 0.00 -0.77 2.28 3.32 -1.63 -0.51 116.42 119.91 2bru h ASP 102 Ca 0.32 0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.49 2bru h ASP 102 Cb 0.17 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.64 2bru h ASP 102 CO -0.17 0.18 0.38 -0.26 -1.72 0.00 0.00 179.24 177.65 2bru h PHE 103 N 0.00 0.68 -0.33 4.55 0.04 -0.87 0.99 116.94 122.00 2bru h PHE 103 Ca -0.00 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 2bru h PHE 103 Cb 0.56 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 2bru h PHE 103 CO 0.00 0.21 0.12 0.00 -0.60 0.00 0.00 178.31 178.04 2bru h ALA 104 N 1.48 0.43 -0.38 2.45 0.00 -1.16 -3.03 119.26 119.05 2bru h ALA 104 Ca 0.39 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.24 2bru h ALA 104 Cb 0.47 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2bru h ALA 104 CO -0.31 0.05 0.26 0.22 0.00 0.00 0.00 179.25 179.48 2bru h ASP 105 N 0.38 0.15 -4.34 0.00 3.58 -1.23 -3.44 116.42 111.53 2bru h ASP 105 Ca 0.11 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 57.05 2bru h ASP 105 Cb 0.22 -0.03 0.06 0.00 1.72 0.00 0.00 39.33 41.30 2bru h ASP 105 CO -0.01 0.09 0.41 -0.89 -2.88 0.00 0.00 179.24 175.97 2bru s THR 106 N -5.18 4.57 0.00 2.25 2.01 0.30 -4.54 115.64 115.04 2bru s THR 106 Ca -0.06 0.88 0.00 0.00 0.31 0.00 0.00 61.69 62.82 2bru s THR 106 Cb 0.19 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.92 2bru s THR 106 CO 0.72 -1.05 0.00 -0.67 -0.69 0.00 0.00 174.62 172.93 2bru n ASP 107 N -2.68 0.00 -4.61 3.53 -0.08 -0.89 -4.42 116.55 107.40 2bru n ASP 107 Ca 0.06 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.91 2bru n ASP 107 Cb 0.54 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.98 2bru n ASP 107 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2bru s THR 108 N 0.00 4.21 -0.53 5.18 2.01 -1.25 -0.66 115.64 124.59 2bru s THR 108 Ca 0.00 1.27 -0.22 0.00 0.31 0.00 0.00 61.69 63.05 2bru s THR 108 Cb 0.00 -4.49 0.05 0.00 0.01 0.00 0.00 72.50 68.07 2bru s THR 108 CO 0.00 -0.85 0.78 -0.69 -0.69 0.00 0.00 174.62 173.17 2bru s VAL 109 N 4.46 4.63 -0.99 3.82 1.01 0.41 -3.29 120.40 130.46 2bru s VAL 109 Ca 0.50 -0.11 -0.24 0.00 0.00 0.00 0.00 61.98 62.13 2bru s VAL 109 Cb -0.09 -4.42 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 2bru s VAL 109 CO 0.29 -0.96 1.87 -0.76 0.00 0.00 0.00 175.10 175.54 2bru s LEU 110 N 3.28 3.22 -1.19 3.92 1.43 0.95 -0.85 118.68 129.44 2bru s LEU 110 Ca 0.23 -1.04 -0.19 0.00 -1.03 0.00 0.00 54.13 52.11 2bru s LEU 110 Cb -0.16 -2.57 0.09 0.00 0.03 0.00 0.00 46.19 43.58 2bru s LEU 110 CO 0.15 -2.58 1.58 -0.69 0.23 0.00 0.00 176.35 175.04 2bru s VAL 111 N 9.34 4.27 -0.92 -1.59 1.01 -0.23 -0.48 120.40 131.80 2bru s VAL 111 Ca 0.66 -1.75 -0.23 0.00 0.00 0.00 0.00 61.98 60.66 2bru s VAL 111 Cb -0.04 -5.09 0.06 0.00 0.00 0.00 0.00 36.38 31.31 2bru s VAL 111 CO 0.01 -1.90 1.32 -0.63 0.00 0.00 0.00 175.10 173.89 2bru s ILE 112 N 3.85 4.08 -1.63 2.22 1.01 0.61 0.03 121.20 131.37 2bru s ILE 112 Ca 0.49 -0.69 0.00 0.00 0.00 0.00 0.00 60.65 60.45 2bru s ILE 112 Cb 0.01 -4.95 0.00 0.00 0.01 0.00 0.00 42.46 37.53 2bru s ILE 112 CO 0.01 -1.80 0.00 0.61 0.00 0.00 0.00 174.94 173.76 2bru n GLY 113 N 6.23 -0.41 0.08 6.18 0.00 -0.58 -0.35 105.19 116.33 2bru n GLY 113 Ca 0.23 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.20 2bru n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bru h ALA 114 N 0.97 0.51 -1.00 4.61 0.00 -1.74 0.19 119.26 122.80 2bru h ALA 114 Ca -0.45 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 53.53 2bru h ALA 114 Cb 1.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2bru h ALA 114 CO 0.53 1.18 0.00 -1.71 0.00 0.00 0.00 179.25 179.26 2bru n ASN 115 N -3.24 -3.00 0.15 0.00 5.15 -1.26 -3.19 115.26 109.88 2bru n ASN 115 Ca -0.04 0.00 0.06 0.00 -0.60 0.00 0.00 54.58 54.01 2bru n ASN 115 Cb 0.92 0.00 0.33 0.00 -0.53 0.00 0.00 39.78 40.50 2bru n ASN 115 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2bru n ASP 116 N -2.18 0.31 0.13 1.20 5.68 -1.26 -1.09 116.55 119.34 2bru n ASP 116 Ca 0.00 0.54 0.10 0.00 -0.50 0.00 0.00 54.79 54.93 2bru n ASP 116 Cb 0.00 -0.49 0.49 0.00 -1.14 0.00 0.00 41.12 39.98 2bru n ASP 116 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 2bru n THR 117 N -1.99 1.06 -0.46 2.12 -1.04 -1.19 -1.07 114.28 111.70 2bru n THR 117 Ca -0.01 0.53 0.08 0.00 -2.04 0.00 0.00 64.05 62.61 2bru n THR 117 Cb 0.31 -1.50 0.25 0.00 -1.82 0.00 0.00 70.33 67.57 2bru n THR 117 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2bru n VAL 118 N -2.14 1.44 -3.92 12.58 0.24 -0.25 -4.91 118.33 121.37 2bru n VAL 118 Ca 0.00 -1.20 -0.35 0.00 -2.04 0.00 0.00 64.34 60.75 2bru n VAL 118 Cb 0.10 0.27 -0.09 0.00 -1.47 0.00 0.00 33.84 32.66 2bru n VAL 118 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2bru s ASN 119 N -1.14 5.90 0.30 -1.34 2.47 -0.23 -1.93 114.94 118.98 2bru s ASN 119 Ca 0.38 0.19 0.06 0.00 0.42 0.00 0.00 52.86 53.91 2bru s ASN 119 Cb 0.23 -1.99 0.76 0.00 -1.45 0.00 0.00 41.25 38.80 2bru s ASN 119 CO 0.20 0.22 1.77 1.55 -3.72 0.00 0.00 177.10 177.11 2bru h PRO 120 N 6.38 0.72 0.00 0.43 0.13 -1.90 -3.06 132.00 134.71 2bru h PRO 120 Ca -0.41 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2bru h PRO 120 Cb 1.17 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2bru h PRO 120 CO 0.70 0.48 0.04 0.00 -0.23 0.00 0.00 178.00 178.99 2bru n ALA 121 N -2.33 0.98 -0.26 -0.56 0.00 -1.26 -0.37 120.51 116.71 2bru n ALA 121 Ca 0.24 0.17 0.02 0.00 0.00 0.00 0.00 53.44 53.87 2bru n ALA 121 Cb 0.59 -1.21 0.24 0.00 0.00 0.00 0.00 19.45 19.07 2bru n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bru h ALA 122 N 1.89 1.48 0.06 0.00 0.00 -1.75 0.20 119.26 121.14 2bru h ALA 122 Ca 0.00 -0.04 -0.37 0.00 0.00 0.00 0.00 54.91 54.49 2bru h ALA 122 Cb 0.08 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2bru h ALA 122 CO 0.00 0.44 -2.19 0.00 0.00 0.00 0.00 179.25 177.50 2bru n GLN 123 N -4.44 0.69 -0.06 0.00 10.64 0.50 -0.75 117.38 123.96 2bru n GLN 123 Ca 0.11 0.24 -0.12 0.00 -1.83 0.00 0.00 57.00 55.39 2bru n GLN 123 Cb 0.10 -1.62 -0.06 0.00 -0.86 0.00 0.00 30.24 27.80 2bru n GLN 123 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.06 175.45 2bru h ASP 124 N -0.11 0.33 -3.72 2.61 3.58 -1.07 -3.34 116.42 114.70 2bru h ASP 124 Ca -0.50 -0.38 -0.72 0.00 0.42 0.00 0.00 57.03 55.84 2bru h ASP 124 Cb 1.90 -0.09 -0.32 0.00 1.72 0.00 0.00 39.33 42.54 2bru h ASP 124 CO -0.04 0.64 -0.32 -0.62 -2.88 0.00 0.00 179.24 176.01 2bru s ASP 125 N -5.94 5.65 0.36 2.28 2.15 0.05 -4.95 116.67 116.28 2bru s ASP 125 Ca -0.14 -2.41 0.12 0.00 0.43 0.00 0.00 52.55 50.55 2bru s ASP 125 Cb 0.06 -1.96 0.64 0.00 -0.30 0.00 0.00 42.92 41.35 2bru s ASP 125 CO 0.73 -0.54 1.24 -0.65 -0.17 0.00 0.00 175.17 175.79 2bru h PRO 126 N 7.77 0.00 -0.13 4.34 0.11 -1.74 -0.01 132.00 142.33 2bru h PRO 126 Ca -0.08 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.94 2bru h PRO 126 Cb 1.02 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2bru h PRO 126 CO 0.77 0.00 -0.35 -0.22 -0.21 0.00 0.00 178.00 177.99 2bru h LYS 127 N 0.00 0.27 -6.30 1.05 3.64 -1.92 -3.43 116.57 109.87 2bru h LYS 127 Ca 0.00 -0.11 -0.63 0.00 -1.27 0.00 0.00 60.65 58.63 2bru h LYS 127 Cb 0.80 -0.01 0.03 0.00 -0.41 0.00 0.00 32.23 32.64 2bru h LYS 127 CO 0.00 0.59 0.95 0.43 -2.27 0.00 0.00 179.45 179.15 2bru n SER 128 N -4.07 3.06 -0.35 4.20 7.64 -0.02 -4.88 113.62 119.20 2bru n SER 128 Ca -0.01 1.02 0.12 0.00 1.01 0.00 0.00 58.87 61.01 2bru n SER 128 Cb 0.44 -1.33 0.31 0.00 -1.01 0.00 0.00 64.21 62.62 2bru n SER 128 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2bru h PRO 129 N 7.81 0.79 -6.45 1.43 0.13 -1.83 -3.39 132.00 130.49 2bru h PRO 129 Ca -0.47 -0.05 -0.54 0.00 -0.87 0.00 0.00 66.00 64.07 2bru h PRO 129 Cb 1.28 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 2bru h PRO 129 CO 0.92 0.52 0.43 0.96 -0.23 0.00 0.00 178.00 180.60 2bru s ILE 130 N -5.86 4.56 -0.20 -3.56 -4.36 -1.26 -5.03 121.20 105.49 2bru s ILE 130 Ca -0.11 1.87 -0.05 0.00 -0.26 0.00 0.00 60.65 62.10 2bru s ILE 130 Cb 0.24 -4.20 -0.02 0.00 1.25 0.00 0.00 42.46 39.73 2bru s ILE 130 CO 0.80 0.16 -0.01 0.00 0.24 0.00 0.00 174.94 176.14 2bru s ALA 131 N 0.89 3.01 0.00 2.27 0.00 -1.26 -4.45 121.76 122.23 2bru s ALA 131 Ca 0.53 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2bru s ALA 131 Cb -0.24 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2bru s ALA 131 CO 0.29 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.33 2bru n GLY 132 N 4.20 -2.16 3.03 0.00 0.00 0.07 -4.91 105.19 105.42 2bru n GLY 132 Ca -0.17 -1.14 -0.24 0.00 0.00 0.00 0.00 46.02 44.47 2bru n GLY 132 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2bru s MET 133 N -4.86 1.54 0.63 1.61 1.75 -1.26 -4.58 119.30 114.12 2bru s MET 133 Ca 0.00 -0.40 -0.18 0.00 -1.25 0.00 0.00 55.69 53.85 2bru s MET 133 Cb 0.00 -1.31 -0.03 0.00 2.84 0.00 0.00 34.83 36.33 2bru s MET 133 CO 0.00 0.07 1.13 -0.35 -0.65 0.00 0.00 175.02 175.21 2bru n PRO 134 N 3.64 0.99 0.00 4.11 -0.04 -1.26 -4.87 135.00 137.57 2bru n PRO 134 Ca -0.22 0.39 0.01 0.00 -0.04 0.00 0.00 63.50 63.65 2bru n PRO 134 Cb 0.52 -2.35 0.08 0.00 -0.04 0.00 0.00 33.50 31.71 2bru n PRO 134 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2bru n VAL 135 N -1.85 0.00 -1.12 0.52 0.24 -1.26 -3.71 118.33 111.15 2bru n VAL 135 Ca 0.15 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 62.25 2bru n VAL 135 Cb 0.48 -0.60 -0.13 0.00 -1.47 0.00 0.00 33.84 32.12 2bru n VAL 135 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2bru n LEU 136 N -0.70 6.18 -4.53 1.34 4.77 -1.26 -4.81 117.00 117.99 2bru n LEU 136 Ca 0.02 -3.53 -0.42 0.00 -0.03 0.00 0.00 56.01 52.05 2bru n LEU 136 Cb 0.01 -1.44 -0.03 0.00 -2.33 0.00 0.00 43.42 39.63 2bru n LEU 136 CO 0.01 1.80 1.17 -1.61 -1.33 0.00 0.00 177.39 177.43 2bru s GLU 137 N 1.08 3.32 -1.18 3.23 2.02 -1.24 -4.75 118.70 121.18 2bru s GLU 137 Ca 0.67 -0.72 -0.11 0.00 0.02 0.00 0.00 54.97 54.84 2bru s GLU 137 Cb 0.29 -4.58 0.22 0.00 0.10 0.00 0.00 34.13 30.16 2bru s GLU 137 CO -0.03 -2.08 1.39 1.55 0.02 0.00 0.00 175.26 176.11 2bru n VAL 138 N 6.37 4.48 -4.32 2.63 3.14 -0.81 -4.88 118.33 124.93 2bru n VAL 138 Ca 0.12 -5.03 -0.17 0.00 -2.96 0.00 0.00 64.34 56.30 2bru n VAL 138 Cb 0.49 -2.46 -0.10 0.00 -1.06 0.00 0.00 33.84 30.71 2bru n VAL 138 CO 0.00 0.00 0.00 -1.66 -6.46 0.00 0.00 176.83 168.71 2bru s TRP 139 N 0.04 1.52 0.00 1.45 -2.14 -1.26 -4.90 118.94 113.64 2bru s TRP 139 Ca 0.37 -0.95 0.00 0.00 2.66 0.00 0.00 56.10 58.18 2bru s TRP 139 Cb -0.03 -0.88 0.00 0.00 -3.10 0.00 0.00 33.47 29.46 2bru s TRP 139 CO -0.02 -0.08 0.00 0.36 -2.66 0.00 0.00 176.95 174.55 2bru n LYS 140 N -0.40 0.00 -1.25 3.25 2.85 -1.26 -4.96 118.16 116.38 2bru n LYS 140 Ca -0.05 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.85 2bru n LYS 140 Cb 0.64 -2.68 0.08 0.00 -0.65 0.00 0.00 35.03 32.41 2bru n LYS 140 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2bru n ALA 141 N 0.54 -1.26 -0.27 0.58 0.00 -1.26 -4.89 120.51 113.96 2bru n ALA 141 Ca 0.00 -0.25 0.16 0.00 0.00 0.00 0.00 53.44 53.35 2bru n ALA 141 Cb 0.00 -1.91 0.30 0.00 0.00 0.00 0.00 19.45 17.83 2bru n ALA 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2bru n GLN 142 N -1.07 -0.06 -3.22 0.00 1.13 -1.26 -3.23 117.38 109.67 2bru n GLN 142 Ca 0.11 1.15 -0.02 0.00 -1.94 0.00 0.00 57.00 56.30 2bru n GLN 142 Cb 0.50 -1.89 -0.02 0.00 0.11 0.00 0.00 30.24 28.94 2bru n GLN 142 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2bru s ASN 143 N -4.90 -1.00 -0.57 1.08 3.84 0.16 -4.78 114.94 108.77 2bru s ASN 143 Ca -0.09 -0.59 -0.23 0.00 0.21 0.00 0.00 52.86 52.16 2bru s ASN 143 Cb 0.24 1.71 0.05 0.00 -0.55 0.00 0.00 41.25 42.70 2bru s ASN 143 CO 0.61 -0.24 0.91 -0.69 -2.79 0.00 0.00 177.10 174.91 2bru s VAL 144 N 2.13 4.43 -0.46 -5.21 1.01 0.56 -0.44 120.40 122.41 2bru s VAL 144 Ca 0.14 0.03 -0.14 0.00 0.00 0.00 0.00 61.98 62.01 2bru s VAL 144 Cb -0.08 -4.55 0.08 0.00 0.00 0.00 0.00 36.38 31.83 2bru s VAL 144 CO -0.14 -1.17 0.37 -0.51 0.00 0.00 0.00 175.10 173.65 2bru s ILE 145 N 3.83 4.97 -0.66 2.22 1.10 -0.03 -0.89 121.20 131.75 2bru s ILE 145 Ca 0.26 -1.17 -0.20 0.00 -0.51 0.00 0.00 60.65 59.03 2bru s ILE 145 Cb -0.14 -4.00 0.09 0.00 0.15 0.00 0.00 42.46 38.56 2bru s ILE 145 CO 0.16 -0.58 0.86 -0.69 -2.11 0.00 0.00 174.94 172.58 2bru s VAL 146 N 1.58 4.62 -0.19 4.00 1.01 -0.21 -1.07 120.40 130.14 2bru s VAL 146 Ca 0.04 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 2bru s VAL 146 Cb -0.24 -4.60 -0.04 0.00 0.00 0.00 0.00 36.38 31.50 2bru s VAL 146 CO 0.05 -1.30 1.70 -0.36 0.00 0.00 0.00 175.10 175.18 2bru s PHE 147 N 3.22 1.95 -0.21 5.22 0.40 0.10 -0.39 117.98 128.27 2bru s PHE 147 Ca 0.18 0.44 -0.17 0.00 -0.60 0.00 0.00 56.93 56.78 2bru s PHE 147 Cb -0.19 -3.99 0.06 0.00 0.51 0.00 0.00 43.02 39.41 2bru s PHE 147 CO 0.06 -3.30 0.55 0.21 0.70 0.00 0.00 175.22 173.44 2bru s LYS 148 N 4.75 0.62 0.11 0.44 2.20 -0.61 -1.53 119.74 125.72 2bru s LYS 148 Ca 0.75 0.84 -0.32 0.00 -0.36 0.00 0.00 55.97 56.88 2bru s LYS 148 Cb -0.28 0.24 -0.12 0.00 -1.51 0.00 0.00 37.83 36.16 2bru s LYS 148 CO 0.31 -0.10 1.52 -0.09 -0.36 0.00 0.00 175.35 176.62 2bru h ARG 149 N 5.79 -0.52 -4.86 4.03 9.65 -1.74 -0.61 114.38 126.12 2bru h ARG 149 Ca -0.30 0.04 -0.28 0.00 -1.10 0.00 0.00 59.98 58.34 2bru h ARG 149 Cb 1.18 0.12 -0.15 0.00 -1.39 0.00 0.00 29.97 29.73 2bru h ARG 149 CO 0.18 -0.35 -0.71 -1.12 2.80 0.00 0.00 179.97 180.77 2bru s SER 150 N -4.72 1.46 -0.76 -3.80 0.01 -1.26 -2.72 113.70 101.90 2bru s SER 150 Ca -0.14 -1.00 -0.25 0.00 1.31 0.00 0.00 55.95 55.86 2bru s SER 150 Cb 0.07 0.04 -0.05 0.00 0.21 0.00 0.00 66.02 66.28 2bru s SER 150 CO 0.57 -0.39 2.03 -0.32 0.41 0.00 0.00 173.24 175.54 2bru s MET 151 N -3.74 2.39 0.14 12.44 -2.45 -1.26 -4.86 119.30 121.96 2bru s MET 151 Ca 0.14 0.24 -0.19 0.00 -1.25 0.00 0.00 55.69 54.63 2bru s MET 151 Cb 0.04 -4.78 0.05 0.00 1.25 0.00 0.00 34.83 31.38 2bru s MET 151 CO -0.02 -3.34 0.48 1.21 1.05 0.00 0.00 175.02 174.40 2bru s ASN 152 N 8.85 -0.35 0.91 1.11 3.84 -1.26 -5.17 114.94 122.87 2bru s ASN 152 Ca 0.75 -0.22 -0.11 0.00 0.21 0.00 0.00 52.86 53.49 2bru s ASN 152 Cb -0.10 0.53 0.14 0.00 -0.55 0.00 0.00 41.25 41.27 2bru s ASN 152 CO 0.09 -0.91 1.12 -0.89 -2.79 0.00 0.00 177.10 173.72 2bru s THR 153 N -3.79 2.34 0.00 -5.21 2.01 -1.26 -4.98 115.64 104.75 2bru s THR 153 Ca 0.03 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.14 2bru s THR 153 Cb 0.01 -2.25 0.00 0.00 0.01 0.00 0.00 72.50 70.27 2bru s THR 153 CO -0.12 -0.14 0.00 0.61 -0.69 0.00 0.00 174.62 174.28 2bru n GLY 154 N -0.08 0.11 0.00 4.40 0.00 -1.26 -4.98 105.19 103.39 2bru n GLY 154 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.15 2bru n GLY 154 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bru n TYR 155 N 0.00 0.00 0.00 1.61 4.02 -1.26 -4.91 117.16 116.62 2bru n TYR 155 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2bru n TYR 155 Cb 0.00 -0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.19 2bru n TYR 155 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2bru n ALA 156 N -1.70 0.31 0.00 -0.72 0.00 -1.26 -4.20 120.51 112.94 2bru n ALA 156 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2bru n ALA 156 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 2bru n ALA 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bru n GLY 157 N 2.81 2.03 3.03 0.00 0.00 -1.26 -4.74 105.19 107.06 2bru n GLY 157 Ca 0.00 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 2bru n GLY 157 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bru n VAL 158 N 0.00 0.00 -2.92 1.61 0.24 -1.26 -1.63 118.33 114.37 2bru n VAL 158 Ca 0.00 -0.04 -0.16 0.00 -2.04 0.00 0.00 64.34 62.10 2bru n VAL 158 Cb 0.00 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 31.95 2bru n VAL 158 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bru n GLN 159 N 7.10 -1.74 -2.19 7.34 -0.00 -1.26 -4.85 117.38 121.78 2bru n GLN 159 Ca 0.57 0.05 -0.43 0.00 -0.00 0.00 0.00 57.00 57.20 2bru n GLN 159 Cb 0.04 -3.62 -0.02 0.00 -0.00 0.00 0.00 30.24 26.63 2bru n GLN 159 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2bru s ASN 160 N -2.12 6.70 0.59 2.61 0.02 -0.65 -4.86 114.94 117.23 2bru s ASN 160 Ca 0.31 1.87 0.29 0.00 -1.02 0.00 0.00 52.86 54.31 2bru s ASN 160 Cb -0.18 -2.53 1.28 0.00 0.02 0.00 0.00 41.25 39.83 2bru s ASN 160 CO 0.37 -0.95 1.64 1.55 0.02 0.00 0.00 177.10 179.73 2bru h PRO 161 N 9.34 0.00 -1.00 -0.60 0.13 -1.92 -1.97 132.00 135.98 2bru h PRO 161 Ca -0.33 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 65.00 2bru h PRO 161 Cb 1.14 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.17 2bru h PRO 161 CO 0.97 0.00 0.61 1.25 -0.23 0.00 0.00 178.00 180.61 2bru h LEU 162 N 0.00 0.74 0.00 1.56 5.85 -1.89 -0.98 115.31 120.59 2bru h LEU 162 Ca 0.38 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 59.12 2bru h LEU 162 Cb 2.06 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 43.05 2bru h LEU 162 CO -0.00 0.24 -0.73 -0.26 -0.34 0.00 0.00 178.44 177.35 2bru h PHE 163 N 0.71 0.00 0.00 1.25 0.04 -1.54 -3.26 116.94 114.14 2bru h PHE 163 Ca 0.59 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 61.03 2bru h PHE 163 Cb 0.99 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.08 2bru h PHE 163 CO -0.00 0.31 -2.24 1.19 -0.60 0.00 0.00 178.31 176.97 2bru n PHE 164 N -3.00 0.00 -0.95 -0.55 3.72 -0.43 -2.64 117.46 113.61 2bru n PHE 164 Ca -0.01 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.06 2bru n PHE 164 Cb 0.68 -0.87 0.13 0.00 -0.94 0.00 0.00 39.48 38.48 2bru n PHE 164 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2bru n LYS 165 N -2.86 -0.07 -0.28 -1.08 4.76 -0.02 -4.86 118.16 113.74 2bru n LYS 165 Ca -0.33 0.05 -0.06 0.00 -2.87 0.00 0.00 58.31 55.09 2bru n LYS 165 Cb 1.01 -2.22 0.06 0.00 -1.84 0.00 0.00 35.03 32.04 2bru n LYS 165 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2bru h GLU 166 N -1.24 1.18 0.00 1.97 3.07 -1.96 -3.20 114.58 114.40 2bru h GLU 166 Ca -0.45 -0.23 -0.11 0.00 -0.50 0.00 0.00 59.36 58.08 2bru h GLU 166 Cb 1.29 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 29.00 2bru h GLU 166 CO 0.42 0.97 -2.04 0.27 -1.40 0.00 0.00 179.01 177.22 2bru n ASN 167 N -4.28 0.07 -4.30 1.42 6.94 -1.26 -4.72 115.26 109.13 2bru n ASN 167 Ca 0.07 0.03 -0.46 0.00 -0.02 0.00 0.00 54.58 54.20 2bru n ASN 167 Cb 0.20 1.59 -0.04 0.00 -2.36 0.00 0.00 39.78 39.17 2bru n ASN 167 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2bru s THR 168 N -3.21 5.27 0.00 5.53 2.01 -1.21 -0.32 115.64 123.72 2bru s THR 168 Ca -0.08 -2.15 -0.03 0.00 0.31 0.00 0.00 61.69 59.74 2bru s THR 168 Cb 0.11 -4.32 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 2bru s THR 168 CO 0.88 -0.95 0.05 -2.28 -0.69 0.00 0.00 174.62 171.62 2bru s HIS 169 N 0.68 0.09 0.20 4.92 2.46 -0.07 -0.84 115.29 122.73 2bru s HIS 169 Ca 0.12 -0.20 -0.32 0.00 0.47 0.00 0.00 55.06 55.14 2bru s HIS 169 Cb -0.18 -0.08 -0.11 0.00 -0.13 0.00 0.00 32.58 32.08 2bru s HIS 169 CO -0.04 -0.17 1.64 -1.64 -2.47 0.00 0.00 174.74 172.06 2bru s MET 170 N -0.97 4.17 -0.54 2.88 -1.94 -1.08 -1.05 119.30 120.77 2bru s MET 170 Ca -0.11 2.49 -0.20 0.00 -1.71 0.00 0.00 55.69 56.16 2bru s MET 170 Cb -0.06 -3.11 0.06 0.00 2.01 0.00 0.00 34.83 33.73 2bru s MET 170 CO 0.00 -0.67 0.70 -1.17 -0.01 0.00 0.00 175.02 173.87 2bru s LEU 171 N 1.01 4.90 0.21 -0.03 2.96 0.47 -4.79 118.68 123.41 2bru s LEU 171 Ca 0.71 -0.94 -0.30 0.00 -0.22 0.00 0.00 54.13 53.39 2bru s LEU 171 Cb -0.47 -2.47 -0.09 0.00 0.50 0.00 0.00 46.19 43.67 2bru s LEU 171 CO 0.33 -1.01 1.19 -0.36 -1.32 0.00 0.00 176.35 175.19 2bru s PHE 172 N 2.89 3.42 0.00 5.38 0.40 -1.25 -1.57 117.98 127.25 2bru s PHE 172 Ca 0.17 1.46 0.00 0.00 -0.60 0.00 0.00 56.93 57.96 2bru s PHE 172 Cb -0.19 -3.43 0.00 0.00 0.51 0.00 0.00 43.02 39.91 2bru s PHE 172 CO 0.12 -1.16 0.00 0.41 0.70 0.00 0.00 175.22 175.28 2bru n GLY 173 N 1.91 3.15 3.75 4.36 0.00 -0.24 -4.68 105.19 113.43 2bru n GLY 173 Ca 0.03 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.78 2bru n GLY 173 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bru s ASP 174 N 0.00 5.02 0.07 1.61 -1.08 -1.26 -2.34 116.67 118.70 2bru s ASP 174 Ca 0.00 2.54 -0.28 0.00 -0.52 0.00 0.00 52.55 54.30 2bru s ASP 174 Cb 0.00 -2.61 -0.17 0.00 -1.46 0.00 0.00 42.92 38.68 2bru s ASP 174 CO 0.00 -1.72 1.63 0.00 0.52 0.00 0.00 175.17 175.60 2bru h ALA 175 N 0.91 -0.45 0.63 3.66 0.00 -1.87 -0.18 119.26 121.96 2bru h ALA 175 Ca -0.51 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.26 2bru h ALA 175 Cb 1.31 0.17 0.01 0.00 0.00 0.00 0.00 17.79 19.28 2bru h ALA 175 CO 0.55 -0.73 -0.30 -0.22 0.00 0.00 0.00 179.25 178.55 2bru h LYS 176 N -0.50 -0.82 -0.95 0.00 3.11 -1.86 -2.82 116.57 112.74 2bru h LYS 176 Ca -0.05 0.06 0.21 0.00 -2.81 0.00 0.00 60.65 58.06 2bru h LYS 176 Cb 0.37 0.19 -0.08 0.00 -1.00 0.00 0.00 32.23 31.71 2bru h LYS 176 CO 0.08 -0.54 0.62 0.00 -2.81 0.00 0.00 179.45 176.79 2bru h ALA 177 N -1.52 2.08 -0.42 5.00 0.00 -1.95 0.24 119.26 122.68 2bru h ALA 177 Ca -0.09 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 2bru h ALA 177 Cb 0.65 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2bru h ALA 177 CO 0.14 -0.40 -0.27 0.77 0.00 0.00 0.00 179.25 179.49 2bru h SER 178 N 0.50 0.94 0.13 0.00 0.02 -1.02 -0.62 113.55 113.51 2bru h SER 178 Ca 0.51 -0.38 -0.22 0.00 -0.84 0.00 0.00 61.79 60.87 2bru h SER 178 Cb 1.15 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.43 2bru h SER 178 CO -0.24 1.15 -0.85 0.58 -1.14 0.00 0.00 176.83 176.34 2bru h VAL 179 N 0.77 1.34 -0.94 2.27 2.07 -0.76 -2.97 116.25 118.04 2bru h VAL 179 Ca 0.09 -2.19 0.03 0.00 0.82 0.00 0.00 66.70 65.45 2bru h VAL 179 Cb 0.84 2.20 -0.05 0.00 -1.52 0.00 0.00 31.29 32.75 2bru h VAL 179 CO 0.07 0.67 0.61 -0.78 0.02 0.00 0.00 177.57 178.16 2bru h ASP 180 N 0.35 1.02 0.06 0.57 3.58 -0.61 0.26 116.42 121.65 2bru h ASP 180 Ca -0.06 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 2bru h ASP 180 Cb 1.46 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 42.27 2bru h ASP 180 CO 0.16 0.71 -0.05 0.00 -2.88 0.00 0.00 179.24 177.18 2bru h ALA 181 N 1.38 1.85 0.00 -0.78 0.00 -0.98 -3.10 119.26 117.64 2bru h ALA 181 Ca 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2bru h ALA 181 Cb -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2bru h ALA 181 CO -0.11 0.06 -1.57 0.44 0.00 0.00 0.00 179.25 178.07 2bru n ILE 182 N -4.39 0.00 -0.33 0.00 -5.35 -0.17 -4.10 119.36 105.02 2bru n ILE 182 Ca -0.03 -0.30 0.26 0.00 -0.27 0.00 0.00 62.75 62.41 2bru n ILE 182 Cb 0.13 0.40 0.56 0.00 -1.74 0.00 0.00 39.64 38.99 2bru n ILE 182 CO 0.00 0.00 0.00 0.17 -1.76 0.00 0.00 176.55 174.96 2bru h LEU 183 N 0.00 0.35 0.00 7.28 8.10 -0.49 -3.04 115.31 127.51 2bru h LEU 183 Ca 0.00 0.07 0.00 0.00 0.11 0.00 0.00 57.88 58.06 2bru h LEU 183 Cb 0.77 0.02 0.00 0.00 -0.44 0.00 0.00 40.66 41.01 2bru h LEU 183 CO 0.00 0.05 -0.41 0.29 -4.11 0.00 0.00 178.44 174.26 2bru n LYS 184 N -4.55 3.32 -1.87 0.17 5.02 -1.26 -4.27 118.16 114.72 2bru n LYS 184 Ca 0.26 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.15 2bru n LYS 184 Cb 0.98 -0.70 -0.01 0.00 -0.02 0.00 0.00 35.03 35.28 2bru n LYS 184 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bru n ALA 185 N -0.67 6.93 1.35 7.82 0.00 -1.15 -5.21 120.51 129.58 2bru n ALA 185 Ca 0.00 -3.98 0.13 0.00 0.00 0.00 0.00 53.44 49.59 2bru n ALA 185 Cb 0.02 -2.89 0.40 0.00 0.00 0.00 0.00 19.45 16.98 2bru n ALA 185 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97