#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s00 h LEU 12 N 0.00 -0.69 -0.85 -2.67 -0.00 -2.04 0.54 115.31 109.59 1s00 h LEU 12 Ca 0.00 0.08 0.21 0.00 -0.00 0.00 0.00 57.88 58.17 1s00 h LEU 12 Cb 0.00 0.26 -0.13 0.00 -0.00 0.00 0.00 40.66 40.80 1s00 h LEU 12 CO 0.00 -0.34 0.28 0.00 -0.00 0.00 0.00 178.44 178.39 1s00 h ALA 13 N 0.30 1.25 -0.07 1.53 0.00 -2.05 0.99 119.26 121.21 1s00 h ALA 13 Ca 0.03 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1s00 h ALA 13 Cb 0.47 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1s00 h ALA 13 CO -0.14 -0.38 -0.02 0.77 0.00 0.00 0.00 179.25 179.49 1s00 h SER 14 N 0.31 0.14 -0.56 0.00 0.02 -1.84 -0.44 113.55 111.18 1s00 h SER 14 Ca 0.52 -0.38 0.01 0.00 -0.84 0.00 0.00 61.79 61.11 1s00 h SER 14 Cb 0.97 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.45 1s00 h SER 14 CO -0.56 0.49 0.37 0.25 -1.14 0.00 0.00 176.83 176.24 1s00 h LEU 15 N -0.20 0.61 0.20 5.07 5.85 0.11 -1.16 115.31 125.80 1s00 h LEU 15 Ca 0.02 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1s00 h LEU 15 Cb 0.42 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1s00 h LEU 15 CO 0.01 0.44 -0.10 0.00 -0.34 0.00 0.00 178.44 178.45 1s00 h ALA 16 N 1.66 -0.27 0.00 1.25 0.00 0.12 -1.60 119.26 120.41 1s00 h ALA 16 Ca 0.21 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1s00 h ALA 16 Cb -0.03 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1s00 h ALA 16 CO -0.05 -0.47 -0.17 0.97 0.00 0.00 0.00 179.25 179.53 1s00 h ILE 17 N -0.63 0.72 0.11 0.00 6.09 -0.87 -0.25 117.51 122.68 1s00 h ILE 17 Ca -0.03 -0.69 -0.01 0.00 -1.37 0.00 0.00 64.86 62.76 1s00 h ILE 17 Cb 0.46 1.43 0.00 0.00 0.47 0.00 0.00 36.82 39.17 1s00 h ILE 17 CO 0.05 0.17 -0.05 0.22 -3.07 0.00 0.00 178.15 175.46 1s00 h TYR 18 N 0.00 -0.14 -0.65 2.19 3.20 -1.15 -2.97 116.97 117.45 1s00 h TYR 18 Ca -0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 1s00 h TYR 18 Cb 0.41 0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.68 1s00 h TYR 18 CO 0.00 0.33 0.39 0.77 -1.64 0.00 0.00 178.16 178.01 1s00 h SER 19 N -0.72 0.61 -0.42 -2.11 0.02 -1.01 -2.73 113.55 107.20 1s00 h SER 19 Ca -0.02 0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.02 1s00 h SER 19 Cb 0.54 -0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.90 1s00 h SER 19 CO 0.03 0.41 0.02 0.15 -1.14 0.00 0.00 176.83 176.30 1s00 h PHE 20 N 0.74 0.02 -0.53 3.45 3.57 -1.07 0.16 116.94 123.29 1s00 h PHE 20 Ca 0.28 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 1s00 h PHE 20 Cb 0.09 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 1s00 h PHE 20 CO -0.06 -0.06 0.30 -1.49 -2.23 0.00 0.00 178.31 174.77 1s00 h TRP 21 N 0.14 0.71 0.97 0.41 4.06 -1.32 0.88 115.95 121.79 1s00 h TRP 21 Ca 0.20 -0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.10 1s00 h TRP 21 Cb 0.28 -0.23 0.01 0.00 -1.00 0.00 0.00 29.16 28.22 1s00 h TRP 21 CO -0.26 0.49 -0.47 0.82 -3.56 0.00 0.00 178.44 175.47 1s00 h ILE 22 N 0.74 0.00 -0.65 1.49 1.08 -1.06 -0.01 117.51 119.10 1s00 h ILE 22 Ca 0.19 -0.05 0.13 0.00 -0.39 0.00 0.00 64.86 64.74 1s00 h ILE 22 Cb 0.01 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.64 1s00 h ILE 22 CO -0.03 0.00 -0.23 0.15 -0.69 0.00 0.00 178.15 177.35 1s00 h PHE 23 N -1.35 -0.56 -0.74 1.37 3.57 -0.18 0.26 116.94 119.31 1s00 h PHE 23 Ca -0.13 0.07 0.05 0.00 3.53 0.00 0.00 57.97 61.48 1s00 h PHE 23 Cb 1.00 0.35 -0.05 0.00 2.79 0.00 0.00 35.95 40.03 1s00 h PHE 23 CO -0.00 -0.33 0.44 1.25 -2.23 0.00 0.00 178.31 177.44 1s00 h LEU 24 N -0.06 0.69 -0.76 0.59 5.85 0.98 0.61 115.31 123.21 1s00 h LEU 24 Ca 0.30 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.99 1s00 h LEU 24 Cb 0.52 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 1s00 h LEU 24 CO -0.70 0.45 0.32 0.00 -0.34 0.00 0.00 178.44 178.17 1s00 h ALA 25 N 1.35 0.98 -0.47 1.25 0.00 0.80 0.15 119.26 123.33 1s00 h ALA 25 Ca 0.32 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 1s00 h ALA 25 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1s00 h ALA 25 CO -0.16 0.59 -0.24 0.78 0.00 0.00 0.00 179.25 180.22 1s00 h GLY 26 N 1.09 1.07 0.96 0.00 0.00 0.02 -0.06 103.07 106.16 1s00 h GLY 26 Ca 0.26 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 46.61 1s00 h GLY 26 CO -0.02 0.89 0.05 -2.00 0.00 0.00 0.00 176.54 175.45 1s00 h LEU 27 N 0.84 0.07 -0.84 3.11 5.85 0.80 0.42 115.31 125.56 1s00 h LEU 27 Ca 0.10 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1s00 h LEU 27 Cb 0.83 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.80 1s00 h LEU 27 CO 0.07 0.05 0.56 0.40 -0.34 0.00 0.00 178.44 179.18 1s00 h ILE 28 N 0.10 1.21 0.75 4.05 2.04 -0.62 0.51 117.51 125.55 1s00 h ILE 28 Ca 0.04 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1s00 h ILE 28 Cb 0.00 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.06 1s00 h ILE 28 CO -0.02 0.21 -0.44 0.22 0.00 0.00 0.00 178.15 178.11 1s00 h TYR 29 N 1.13 -1.17 -0.37 1.37 3.20 -0.20 0.43 116.97 121.37 1s00 h TYR 29 Ca 0.31 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.25 1s00 h TYR 29 Cb -0.12 0.41 -0.08 0.00 1.54 0.00 0.00 36.73 38.48 1s00 h TYR 29 CO -0.01 -0.67 -0.22 -0.92 -1.64 0.00 0.00 178.16 174.70 1s00 h TYR 30 N -1.12 -0.56 -0.23 -3.82 3.20 0.20 -0.35 116.97 114.29 1s00 h TYR 30 Ca -0.10 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.86 1s00 h TYR 30 Cb 0.89 0.30 -0.04 0.00 1.54 0.00 0.00 36.73 39.42 1s00 h TYR 30 CO -0.09 -0.30 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.02 1s00 h LEU 31 N -0.16 -0.21 -0.28 2.82 3.38 0.26 -1.10 115.31 120.02 1s00 h LEU 31 Ca 0.18 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.24 1s00 h LEU 31 Cb 0.44 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1s00 h LEU 31 CO -0.46 -0.07 0.12 -0.61 0.09 0.00 0.00 178.44 177.50 1s00 h GLN 32 N 0.01 0.25 -0.20 1.13 5.75 0.65 -1.52 115.11 121.17 1s00 h GLN 32 Ca 0.11 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 1s00 h GLN 32 Cb 0.17 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.65 1s00 h GLN 32 CO -0.24 0.16 0.07 1.79 -2.65 0.00 0.00 178.83 177.97 1s00 h THR 33 N 0.26 1.09 -0.19 2.39 1.35 -0.76 -1.49 112.91 115.55 1s00 h THR 33 Ca 0.12 -0.28 -0.08 0.00 -0.55 0.00 0.00 66.41 65.62 1s00 h THR 33 Cb 0.07 0.86 -0.01 0.00 -1.73 0.00 0.00 68.15 67.34 1s00 h THR 33 CO -0.11 0.10 -0.23 -0.33 -0.25 0.00 0.00 175.52 174.70 1s00 h GLU 34 N 0.28 0.34 -0.92 4.72 4.39 -0.19 -2.49 114.58 120.70 1s00 h GLU 34 Ca 0.07 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1s00 h GLU 34 Cb 0.07 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 1s00 h GLU 34 CO -0.01 0.56 0.01 0.09 -1.16 0.00 0.00 179.01 178.50 1s00 n ASN 35 N -4.16 2.11 -0.10 1.42 3.02 -0.57 -3.10 115.26 113.89 1s00 n ASN 35 Ca -0.01 -2.21 0.07 0.00 -0.03 0.00 0.00 54.58 52.40 1s00 n ASN 35 Cb 0.37 -0.54 0.11 0.00 -0.61 0.00 0.00 39.78 39.10 1s00 n ASN 35 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1s00 n MET 36 N 0.14 1.85 0.00 3.52 2.81 -0.94 -4.59 117.12 119.90 1s00 n MET 36 Ca 0.07 -2.30 0.03 0.00 -1.81 0.00 0.00 57.70 53.69 1s00 n MET 36 Cb 0.48 -1.38 0.15 0.00 -0.71 0.00 0.00 33.22 31.76 1s00 n MET 36 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1s00 n ARG 37 N -1.11 0.92 -3.68 0.03 1.74 -1.18 -4.40 116.66 108.98 1s00 n ARG 37 Ca 0.12 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.06 1s00 n ARG 37 Cb 0.54 -1.09 -0.09 0.00 -1.02 0.00 0.00 32.46 30.81 1s00 n ARG 37 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1s00 s GLU 38 N -2.00 0.67 0.00 5.56 0.41 -1.26 -4.27 118.70 117.81 1s00 s GLU 38 Ca 0.08 0.54 0.00 0.00 -0.41 0.00 0.00 54.97 55.18 1s00 s GLU 38 Cb 0.04 0.32 0.00 0.00 -1.78 0.00 0.00 34.13 32.71 1s00 s GLU 38 CO 0.06 -0.12 0.00 0.41 -0.49 0.00 0.00 175.26 175.12 1s00 n GLY 39 N 2.35 2.47 3.62 -1.39 0.00 -1.26 -5.02 105.19 105.96 1s00 n GLY 39 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 1s00 n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s00 s TYR 40 N -2.99 2.71 0.74 1.61 1.51 -1.26 -4.33 117.35 115.34 1s00 s TYR 40 Ca 0.00 -0.20 -0.14 0.00 -1.01 0.00 0.00 57.07 55.72 1s00 s TYR 40 Cb 0.00 -1.28 0.04 0.00 -0.11 0.00 0.00 41.96 40.62 1s00 s TYR 40 CO 0.00 0.55 1.16 -2.14 -1.11 0.00 0.00 175.55 174.01 1s00 s PRO 41 N -3.15 2.19 0.67 -1.71 0.02 -1.26 -4.83 135.00 126.93 1s00 s PRO 41 Ca 0.28 1.57 -0.14 0.00 0.02 0.00 0.00 61.00 62.72 1s00 s PRO 41 Cb -0.08 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.58 1s00 s PRO 41 CO 0.18 -1.75 1.10 -0.51 -0.33 0.00 0.00 177.00 175.69 1s00 s LEU 42 N -5.34 3.35 0.23 -5.54 1.43 -1.26 -4.94 118.68 106.62 1s00 s LEU 42 Ca 0.70 1.95 0.06 0.00 -1.03 0.00 0.00 54.13 55.80 1s00 s LEU 42 Cb -0.25 -4.54 -0.05 0.00 0.03 0.00 0.00 46.19 41.38 1s00 s LEU 42 CO 0.47 -1.62 -0.07 -1.61 0.23 0.00 0.00 176.35 173.75 1s00 s GLU 43 N -4.21 1.37 0.43 1.70 2.02 -1.26 -1.79 118.70 116.96 1s00 s GLU 43 Ca 0.66 -1.66 -0.12 0.00 0.02 0.00 0.00 54.97 53.86 1s00 s GLU 43 Cb -0.19 -0.93 -0.07 0.00 0.10 0.00 0.00 34.13 33.04 1s00 s GLU 43 CO 0.43 0.04 0.83 -0.80 0.02 0.00 0.00 175.26 175.78 1s00 s ASN 44 N -3.34 6.56 0.63 -0.19 0.01 0.19 -4.57 114.94 114.24 1s00 s ASN 44 Ca 0.26 1.26 0.21 0.00 -0.71 0.00 0.00 52.86 53.88 1s00 s ASN 44 Cb 0.03 -2.38 0.99 0.00 0.41 0.00 0.00 41.25 40.30 1s00 s ASN 44 CO 0.08 -0.44 1.51 -0.33 -1.51 0.00 0.00 177.10 176.41 1s00 h GLU 45 N 1.20 0.00 -0.43 -0.60 5.08 -2.01 1.02 114.58 118.84 1s00 h GLU 45 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1s00 h GLU 45 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1s00 h GLU 45 CO 0.63 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.24 1s00 n ASP 46 N -3.09 2.04 0.00 1.42 5.75 -1.26 -4.91 116.55 116.49 1s00 n ASP 46 Ca 0.08 -2.09 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 1s00 n ASP 46 Cb 0.93 -0.30 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 1s00 n ASP 46 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s00 n GLY 47 N 0.86 0.57 3.87 6.12 0.00 0.35 -5.05 105.19 111.91 1s00 n GLY 47 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 1s00 n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s00 s THR 48 N -2.28 4.45 -0.09 2.61 -4.23 -1.24 -4.81 115.64 110.05 1s00 s THR 48 Ca 0.00 -1.28 -0.36 0.00 -1.18 0.00 0.00 61.69 58.87 1s00 s THR 48 Cb 0.00 -3.47 -0.14 0.00 1.34 0.00 0.00 72.50 70.23 1s00 s THR 48 CO 0.00 -0.30 1.72 -2.65 -0.54 0.00 0.00 174.62 172.84 1s00 n PRO 49 N -1.30 1.70 -2.35 3.99 -0.02 -1.26 0.57 135.00 136.33 1s00 n PRO 49 Ca -0.07 0.62 -0.39 0.00 -2.02 0.00 0.00 63.50 61.65 1s00 n PRO 49 Cb 0.58 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 1s00 n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s00 s ALA 50 N 2.93 3.23 0.10 3.55 0.00 -0.74 -4.59 121.76 126.25 1s00 s ALA 50 Ca 0.91 0.94 -0.33 0.00 0.00 0.00 0.00 51.96 53.49 1s00 s ALA 50 Cb -0.85 -3.36 -0.13 0.00 0.00 0.00 0.00 23.12 18.77 1s00 s ALA 50 CO 0.53 -0.42 1.58 0.00 0.00 0.00 0.00 175.76 177.46 1s00 h ALA 51 N 2.95 -0.91 -2.54 0.00 0.00 -1.91 -3.39 119.26 113.47 1s00 h ALA 51 Ca -0.48 -0.12 -0.58 0.00 0.00 0.00 0.00 54.91 53.73 1s00 h ALA 51 Cb 1.23 0.75 -0.07 0.00 0.00 0.00 0.00 17.79 19.69 1s00 h ALA 51 CO 0.64 -1.07 0.21 1.21 0.00 0.00 0.00 179.25 180.24 1s00 s ASN 52 N -4.61 6.87 0.00 0.00 3.84 -1.26 -4.91 114.94 114.87 1s00 s ASN 52 Ca -0.17 1.06 0.12 0.00 0.21 0.00 0.00 52.86 54.08 1s00 s ASN 52 Cb 0.06 -2.40 -0.01 0.00 -0.55 0.00 0.00 41.25 38.35 1s00 s ASN 52 CO 0.62 -0.27 0.68 0.00 -2.79 0.00 0.00 177.10 175.34 1s00 n GLN 53 N 4.76 2.04 0.00 0.43 1.13 -1.26 -4.85 117.38 119.63 1s00 n GLN 53 Ca 0.01 -0.62 0.00 0.00 -1.94 0.00 0.00 57.00 54.45 1s00 n GLN 53 Cb 0.50 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.72 1s00 n GLN 53 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1s00 n GLY 54 N 0.98 0.63 0.15 1.08 0.00 -1.26 -4.73 105.19 102.05 1s00 n GLY 54 Ca 0.05 -1.95 0.03 0.00 0.00 0.00 0.00 46.02 44.14 1s00 n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s00 h PRO 55 N 0.00 0.00 -5.95 1.61 0.13 -2.04 -3.44 132.00 122.30 1s00 h PRO 55 Ca 0.00 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.55 1s00 h PRO 55 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 1s00 h PRO 55 CO 0.00 0.51 -0.12 -0.06 -0.23 0.00 0.00 178.00 178.11 1s00 s PHE 56 N -3.27 3.65 0.14 1.56 0.08 -1.26 -5.07 117.98 113.80 1s00 s PHE 56 Ca 0.01 1.04 -0.10 0.00 0.12 0.00 0.00 56.93 58.01 1s00 s PHE 56 Cb 0.10 -2.48 -0.06 0.00 -0.57 0.00 0.00 43.02 40.00 1s00 s PHE 56 CO 0.73 0.40 0.46 -1.25 -0.10 0.00 0.00 175.22 175.45 1s00 s PRO 57 N -0.27 3.78 0.29 0.24 0.04 -1.26 -5.03 135.00 132.79 1s00 s PRO 57 Ca 0.27 0.20 -0.27 0.00 0.04 0.00 0.00 61.00 61.23 1s00 s PRO 57 Cb -0.17 -2.88 -0.14 0.00 0.04 0.00 0.00 34.50 31.35 1s00 s PRO 57 CO 0.14 0.47 0.91 1.28 0.04 0.00 0.00 177.00 179.84 1s00 n LEU 58 N 0.49 1.29 -4.81 -3.56 4.77 -1.26 -4.84 117.00 109.07 1s00 n LEU 58 Ca -0.04 1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 56.79 1s00 n LEU 58 Cb 0.52 -1.23 0.10 0.00 -2.33 0.00 0.00 43.42 40.48 1s00 n LEU 58 CO 0.44 -1.72 0.72 -2.16 -1.33 0.00 0.00 177.39 173.34 1s00 s PRO 59 N -1.50 1.76 0.42 3.23 0.04 -1.26 -4.99 135.00 132.70 1s00 s PRO 59 Ca 0.60 0.46 -0.26 0.00 0.04 0.00 0.00 61.00 61.83 1s00 s PRO 59 Cb -0.72 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 31.83 1s00 s PRO 59 CO 0.59 -1.80 1.38 0.21 0.04 0.00 0.00 177.00 177.42 1s00 s LYS 60 N -5.25 3.89 0.63 4.56 2.20 -1.26 -4.60 119.74 119.91 1s00 s LYS 60 Ca 0.62 2.33 -0.17 0.00 -0.36 0.00 0.00 55.97 58.39 1s00 s LYS 60 Cb -0.14 -2.76 -0.02 0.00 -1.51 0.00 0.00 37.83 33.40 1s00 s LYS 60 CO 0.53 -0.62 1.13 -1.25 -0.36 0.00 0.00 175.35 174.79 1s00 s PRO 61 N -2.28 2.90 0.11 4.03 0.04 -1.26 -4.63 135.00 133.91 1s00 s PRO 61 Ca 0.57 1.53 0.07 0.00 0.04 0.00 0.00 61.00 63.22 1s00 s PRO 61 Cb -0.42 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 1s00 s PRO 61 CO 0.54 -1.20 -0.18 -1.59 0.04 0.00 0.00 177.00 174.61 1s00 s LYS 62 N -3.78 1.08 -0.11 4.56 -2.85 -0.36 -4.95 119.74 113.32 1s00 s LYS 62 Ca 0.70 -1.19 0.03 0.00 -1.00 0.00 0.00 55.97 54.52 1s00 s LYS 62 Cb -0.23 -1.19 -0.00 0.00 -2.06 0.00 0.00 37.83 34.35 1s00 s LYS 62 CO 0.37 0.26 -0.22 0.99 0.10 0.00 0.00 175.35 176.85 1s00 s THR 63 N -1.53 2.23 -0.30 3.79 2.01 -1.26 -1.96 115.64 118.62 1s00 s THR 63 Ca 0.07 -0.95 -0.14 0.00 0.31 0.00 0.00 61.69 60.98 1s00 s THR 63 Cb -0.08 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 1s00 s THR 63 CO 0.04 0.55 0.32 -0.36 -0.69 0.00 0.00 174.62 174.49 1s00 s PHE 64 N 0.41 3.23 -0.56 4.92 0.08 0.11 -4.94 117.98 121.23 1s00 s PHE 64 Ca -0.16 0.17 -0.25 0.00 0.12 0.00 0.00 56.93 56.81 1s00 s PHE 64 Cb -0.17 -2.56 0.04 0.00 -0.57 0.00 0.00 43.02 39.76 1s00 s PHE 64 CO 0.07 -0.29 1.00 0.42 -0.10 0.00 0.00 175.22 176.32 1s00 s ILE 65 N 1.97 4.30 0.46 0.64 1.01 -1.26 -1.22 121.20 127.09 1s00 s ILE 65 Ca 0.12 0.40 -0.24 0.00 0.00 0.00 0.00 60.65 60.93 1s00 s ILE 65 Cb -0.16 -4.59 -0.07 0.00 0.01 0.00 0.00 42.46 37.65 1s00 s ILE 65 CO 0.11 -1.18 1.26 -0.76 0.00 0.00 0.00 174.94 174.37 1s00 s LEU 66 N 4.20 4.04 0.27 2.97 2.01 0.47 -4.98 118.68 127.66 1s00 s LEU 66 Ca 0.33 2.54 -0.30 0.00 0.01 0.00 0.00 54.13 56.72 1s00 s LEU 66 Cb -0.11 -4.13 -0.11 0.00 0.01 0.00 0.00 46.19 41.85 1s00 s LEU 66 CO 0.20 -1.06 1.49 -2.84 1.01 0.00 0.00 176.35 175.15 1s00 s PRO 67 N -2.59 4.22 -0.85 1.29 0.02 -1.26 -3.50 135.00 132.32 1s00 s PRO 67 Ca 0.63 2.40 -0.02 0.00 0.02 0.00 0.00 61.00 64.03 1s00 s PRO 67 Cb -0.35 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1s00 s PRO 67 CO 0.43 -0.49 0.72 0.72 -0.33 0.00 0.00 177.00 178.06 1s00 n HIS 68 N 2.21 -1.66 -1.21 6.54 8.25 -1.26 -3.15 115.22 124.93 1s00 n HIS 68 Ca 0.07 0.66 -0.04 0.00 -0.26 0.00 0.00 57.72 58.15 1s00 n HIS 68 Cb 0.39 -3.96 -0.02 0.00 1.12 0.00 0.00 29.99 27.53 1s00 n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s00 n GLY 69 N -1.25 0.30 0.00 -1.41 0.00 -1.23 -4.68 105.19 96.92 1s00 n GLY 69 Ca -0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.91 1s00 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s00 n ARG 70 N -1.36 0.00 0.00 1.61 3.00 -1.19 -4.93 116.66 113.80 1s00 n ARG 70 Ca -0.04 0.43 0.00 0.00 -0.01 0.00 0.00 57.85 58.23 1s00 n ARG 70 Cb 0.16 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.12 1s00 n ARG 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1s00 n GLY 71 N -1.20 0.61 3.06 -0.13 0.00 -1.26 -5.00 105.19 101.27 1s00 n GLY 71 Ca 0.01 -2.15 -0.11 0.00 0.00 0.00 0.00 46.02 43.77 1s00 n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s00 s THR 72 N -0.77 0.42 -0.14 2.61 -4.23 -1.26 -0.40 115.64 111.88 1s00 s THR 72 Ca 0.00 -1.25 0.02 0.00 -1.18 0.00 0.00 61.69 59.27 1s00 s THR 72 Cb 0.00 -0.79 0.02 0.00 1.34 0.00 0.00 72.50 73.06 1s00 s THR 72 CO 0.00 -0.56 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.12 1s00 s LEU 73 N -1.93 1.92 -0.22 4.79 0.20 -0.36 -4.93 118.68 118.14 1s00 s LEU 73 Ca -0.06 -0.54 -0.02 0.00 0.69 0.00 0.00 54.13 54.20 1s00 s LEU 73 Cb -0.06 -1.30 0.01 0.00 -0.43 0.00 0.00 46.19 44.41 1s00 s LEU 73 CO -0.02 0.02 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.09 1s00 s THR 74 N 1.10 2.95 -0.00 3.68 2.01 -1.26 0.08 115.64 124.20 1s00 s THR 74 Ca -0.02 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.27 1s00 s THR 74 Cb -0.14 -2.36 -0.01 0.00 0.01 0.00 0.00 72.50 70.00 1s00 s THR 74 CO -0.06 0.39 -0.06 0.68 -0.69 0.00 0.00 174.62 174.88 1s00 s VAL 75 N 1.40 0.46 0.58 3.82 -7.23 -0.83 -3.68 120.40 114.92 1s00 s VAL 75 Ca 0.04 -0.32 -0.17 0.00 -1.81 0.00 0.00 61.98 59.73 1s00 s VAL 75 Cb -0.15 -0.40 -0.04 0.00 0.56 0.00 0.00 36.38 36.35 1s00 s VAL 75 CO -0.06 0.09 1.06 -2.16 -0.31 0.00 0.00 175.10 173.72 1s00 s PRO 76 N -0.26 3.37 0.12 4.82 0.04 -1.26 -1.23 135.00 140.60 1s00 s PRO 76 Ca 0.01 1.25 -0.02 0.00 0.04 0.00 0.00 61.00 62.29 1s00 s PRO 76 Cb -0.03 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.48 1s00 s PRO 76 CO -0.00 -0.78 0.19 0.41 0.04 0.00 0.00 177.00 176.86 1s00 n GLY 77 N -0.81 2.46 3.77 0.56 0.00 -1.24 -4.78 105.19 105.15 1s00 n GLY 77 Ca 0.09 -1.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 1s00 n GLY 77 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1s00 s PRO 78 N -2.19 4.35 -0.17 1.61 0.02 -1.26 -4.90 135.00 132.45 1s00 s PRO 78 Ca 0.08 2.23 -0.36 0.00 0.02 0.00 0.00 61.00 62.97 1s00 s PRO 78 Cb -0.01 -3.07 -0.13 0.00 0.02 0.00 0.00 34.50 31.31 1s00 s PRO 78 CO 0.06 -0.21 1.86 -1.91 -0.33 0.00 0.00 177.00 176.47 1s00 n GLU 79 N 0.88 1.78 0.28 5.54 4.07 -1.26 -4.85 120.64 127.08 1s00 n GLU 79 Ca 0.00 0.64 0.17 0.00 -0.06 0.00 0.00 57.16 57.92 1s00 n GLU 79 Cb 0.42 -2.46 0.75 0.00 -0.06 0.00 0.00 31.44 30.08 1s00 n GLU 79 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1s00 h SER 80 N 8.83 0.00 -3.35 4.31 4.64 -2.01 -3.42 113.55 122.55 1s00 h SER 80 Ca -0.47 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.28 1s00 h SER 80 Cb 1.29 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.31 1s00 h SER 80 CO 0.96 0.04 0.80 -0.70 -0.87 0.00 0.00 176.83 177.06 1s00 s GLU 81 N -3.80 4.03 0.00 4.77 2.12 -1.26 -4.83 118.70 119.72 1s00 s GLU 81 Ca -0.00 0.98 0.00 0.00 0.36 0.00 0.00 54.97 56.30 1s00 s GLU 81 Cb 0.10 -3.75 0.00 0.00 0.26 0.00 0.00 34.13 30.74 1s00 s GLU 81 CO 0.54 -0.91 0.08 -0.40 -0.54 0.00 0.00 175.26 174.03 1s00 n ASP 82 N 6.85 0.15 -4.59 -1.70 5.68 -1.26 -5.10 116.55 116.58 1s00 n ASP 82 Ca 0.11 -0.68 -0.29 0.00 -0.50 0.00 0.00 54.79 53.43 1s00 n ASP 82 Cb 0.47 0.09 0.20 0.00 -1.14 0.00 0.00 41.12 40.75 1s00 n ASP 82 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s00 s ARG 83 N -0.09 0.03 0.16 0.11 1.70 -1.26 -4.96 118.95 114.64 1s00 s ARG 83 Ca 0.00 0.92 -0.30 0.00 -0.47 0.00 0.00 55.73 55.88 1s00 s ARG 83 Cb 0.00 -1.66 -0.07 0.00 -0.57 0.00 0.00 34.95 32.65 1s00 s ARG 83 CO 0.00 -3.11 1.11 -2.14 -1.08 0.00 0.00 175.30 170.08 1s00 s PRO 84 N -4.66 4.57 -0.32 3.89 0.02 -1.26 -5.03 135.00 132.21 1s00 s PRO 84 Ca 0.67 1.72 -0.09 0.00 0.02 0.00 0.00 61.00 63.32 1s00 s PRO 84 Cb -0.22 -3.29 0.01 0.00 0.02 0.00 0.00 34.50 31.02 1s00 s PRO 84 CO 0.61 0.03 0.15 0.42 -0.33 0.00 0.00 177.00 177.87 1s00 s ILE 85 N -0.06 4.41 -0.70 2.83 -1.09 -1.26 -4.99 121.20 120.34 1s00 s ILE 85 Ca 0.51 -0.63 -0.06 0.00 -2.23 0.00 0.00 60.65 58.24 1s00 s ILE 85 Cb -0.29 -3.32 -0.10 0.00 -1.58 0.00 0.00 42.46 37.17 1s00 s ILE 85 CO 0.34 -0.02 2.40 0.00 -1.23 0.00 0.00 174.94 176.44 1s00 n ALA 86 N 4.95 5.09 -2.76 9.38 0.00 -1.26 -4.82 120.51 131.09 1s00 n ALA 86 Ca -0.13 -1.94 -0.16 0.00 0.00 0.00 0.00 53.44 51.20 1s00 n ALA 86 Cb 0.48 -2.80 -0.12 0.00 0.00 0.00 0.00 19.45 17.01 1s00 n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1s00 s LEU 87 N 0.07 2.25 0.02 0.00 1.43 -1.26 0.10 118.68 121.30 1s00 s LEU 87 Ca 0.46 -0.57 0.07 0.00 -1.03 0.00 0.00 54.13 53.06 1s00 s LEU 87 Cb 0.15 -0.39 -0.02 0.00 0.03 0.00 0.00 46.19 45.97 1s00 s LEU 87 CO -0.03 -0.11 -0.20 0.00 0.23 0.00 0.00 176.35 176.24 1s00 s ALA 88 N -1.25 1.71 0.51 4.21 0.00 0.18 -4.81 121.76 122.31 1s00 s ALA 88 Ca -0.05 -0.97 -0.23 0.00 0.00 0.00 0.00 51.96 50.71 1s00 s ALA 88 Cb -0.10 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.59 1s00 s ALA 88 CO 0.01 0.40 1.40 1.03 0.00 0.00 0.00 175.76 178.61 1s00 s ARG 89 N -0.89 3.34 0.00 0.00 0.52 -1.26 -0.78 118.95 119.89 1s00 s ARG 89 Ca 0.07 2.35 0.11 0.00 -0.52 0.00 0.00 55.73 57.74 1s00 s ARG 89 Cb -0.08 -2.42 0.11 0.00 0.52 0.00 0.00 34.95 33.07 1s00 s ARG 89 CO 0.01 -1.07 0.88 -2.37 0.02 0.00 0.00 175.30 172.77 1s00 n THR 90 N -0.70 0.10 -3.57 0.02 5.66 -1.14 -4.80 114.28 109.86 1s00 n THR 90 Ca 0.08 -0.55 -0.16 0.00 -3.05 0.00 0.00 64.05 60.38 1s00 n THR 90 Cb 0.43 1.15 -0.06 0.00 -1.55 0.00 0.00 70.33 70.30 1s00 n THR 90 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1s00 s ALA 91 N -0.90 -1.80 0.20 1.79 0.00 -1.26 -5.01 121.76 114.78 1s00 s ALA 91 Ca 0.13 1.59 -0.06 0.00 0.00 0.00 0.00 51.96 53.63 1s00 s ALA 91 Cb 0.09 -0.51 0.15 0.00 0.00 0.00 0.00 23.12 22.85 1s00 s ALA 91 CO 0.14 -0.35 1.64 0.28 0.00 0.00 0.00 175.76 177.47 1s00 h VAL 92 N 3.30 1.26 -3.89 0.00 2.07 -2.01 -3.44 116.25 113.55 1s00 h VAL 92 Ca -0.27 -1.23 -0.47 0.00 0.82 0.00 0.00 66.70 65.55 1s00 h VAL 92 Cb 1.15 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1s00 h VAL 92 CO 0.26 0.43 0.26 -0.94 0.02 0.00 0.00 177.57 177.60 1s00 s SER 93 N -6.67 6.99 0.82 0.57 1.04 -1.26 -5.04 113.70 110.14 1s00 s SER 93 Ca -0.10 1.59 -0.11 0.00 0.48 0.00 0.00 55.95 57.81 1s00 s SER 93 Cb 0.13 -2.49 0.09 0.00 0.10 0.00 0.00 66.02 63.85 1s00 s SER 93 CO 0.84 -0.22 1.12 -1.61 0.98 0.00 0.00 173.24 174.35 1s00 s GLU 94 N -2.77 1.81 0.00 4.02 0.41 -1.26 -4.25 118.70 116.65 1s00 s GLU 94 Ca 0.56 1.35 0.00 0.00 -0.41 0.00 0.00 54.97 56.47 1s00 s GLU 94 Cb -0.12 -1.83 0.00 0.00 -1.78 0.00 0.00 34.13 30.40 1s00 s GLU 94 CO 0.17 -2.01 0.00 0.41 -0.49 0.00 0.00 175.26 173.35 1s00 n GLY 95 N -0.56 0.72 3.70 -1.39 0.00 -1.26 -5.10 105.19 101.30 1s00 n GLY 95 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1s00 n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s00 s PHE 96 N -2.00 2.61 0.83 1.61 0.08 -1.26 -5.11 117.98 114.74 1s00 s PHE 96 Ca 0.00 -0.48 -0.11 0.00 0.12 0.00 0.00 56.93 56.46 1s00 s PHE 96 Cb 0.00 -1.71 0.09 0.00 -0.57 0.00 0.00 43.02 40.83 1s00 s PHE 96 CO 0.00 0.33 1.13 -2.14 -0.10 0.00 0.00 175.22 174.44 1s00 s PRO 97 N -3.82 1.71 -0.22 0.24 0.02 -1.26 -4.85 135.00 126.82 1s00 s PRO 97 Ca 0.38 1.41 0.02 0.00 0.02 0.00 0.00 61.00 62.83 1s00 s PRO 97 Cb 0.01 -1.82 0.04 0.00 0.02 0.00 0.00 34.50 32.75 1s00 s PRO 97 CO 0.21 -2.09 -0.15 -1.01 -0.33 0.00 0.00 177.00 173.63 1s00 s HIS 98 N -2.68 3.01 0.42 6.54 3.76 -1.26 -2.87 115.29 122.21 1s00 s HIS 98 Ca 0.65 -1.95 -0.22 0.00 -0.15 0.00 0.00 55.06 53.39 1s00 s HIS 98 Cb -0.21 -1.93 -0.10 0.00 1.11 0.00 0.00 32.58 31.45 1s00 s HIS 98 CO 0.55 -0.84 0.99 0.00 -0.85 0.00 0.00 174.74 174.59 1s00 s ALA 99 N 1.21 3.04 0.19 -1.40 0.00 0.04 -4.58 121.76 120.26 1s00 s ALA 99 Ca -0.01 0.52 -0.31 0.00 0.00 0.00 0.00 51.96 52.15 1s00 s ALA 99 Cb -0.16 -3.20 -0.11 0.00 0.00 0.00 0.00 23.12 19.65 1s00 s ALA 99 CO -0.09 -0.02 1.59 -2.14 0.00 0.00 0.00 175.76 175.10 1s00 s PRO 100 N -2.87 4.19 0.26 0.00 0.02 -1.26 0.51 135.00 135.86 1s00 s PRO 100 Ca 0.60 2.43 0.14 0.00 0.02 0.00 0.00 61.00 64.19 1s00 s PRO 100 Cb -0.15 -3.12 0.18 0.00 0.02 0.00 0.00 34.50 31.42 1s00 s PRO 100 CO 0.19 -0.63 1.49 1.79 -0.33 0.00 0.00 177.00 179.51 1s00 h THR 101 N 3.89 1.12 0.00 0.99 1.35 0.34 -3.46 112.91 117.15 1s00 h THR 101 Ca -0.43 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.10 1s00 h THR 101 Cb 1.21 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 1s00 h THR 101 CO 0.91 0.59 0.00 0.61 -0.25 0.00 0.00 175.52 177.37 1s00 n GLY 102 N 0.93 3.98 3.53 5.82 0.00 -1.26 -5.07 105.19 113.13 1s00 n GLY 102 Ca 0.01 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 1s00 n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s00 s ASP 103 N 1.00 6.25 0.34 1.61 -1.08 -1.26 -4.95 116.67 118.58 1s00 s ASP 103 Ca 0.00 -0.27 0.03 0.00 -0.52 0.00 0.00 52.55 51.80 1s00 s ASP 103 Cb 0.00 -2.24 0.65 0.00 -1.46 0.00 0.00 42.92 39.87 1s00 s ASP 103 CO 0.00 -0.48 1.96 1.55 0.52 0.00 0.00 175.17 178.72 1s00 h PRO 104 N 8.56 0.84 -0.46 4.34 0.13 -1.92 0.51 132.00 144.00 1s00 h PRO 104 Ca -0.28 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 64.83 1s00 h PRO 104 Cb 1.12 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 32.03 1s00 h PRO 104 CO 0.76 0.56 0.26 0.52 -0.23 0.00 0.00 178.00 179.87 1s00 h MET 105 N 0.87 0.50 0.02 0.86 2.86 -1.92 -0.12 114.93 118.00 1s00 h MET 105 Ca 0.31 -0.03 -0.25 0.00 -2.06 0.00 0.00 59.70 57.67 1s00 h MET 105 Cb 0.12 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1s00 h MET 105 CO -0.09 0.33 -1.29 0.87 1.06 0.00 0.00 176.91 177.79 1s00 h LYS 106 N 0.52 0.05 0.00 1.72 1.57 -1.76 -3.29 116.57 115.38 1s00 h LYS 106 Ca 0.19 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1s00 h LYS 106 Cb 0.04 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1s00 h LYS 106 CO -0.10 0.89 0.00 -0.25 -0.57 0.00 0.00 179.45 179.41 1s00 n ASP 107 N -3.29 0.13 -2.70 0.86 8.00 0.17 -4.94 116.55 114.78 1s00 n ASP 107 Ca -0.08 0.52 -0.11 0.00 0.71 0.00 0.00 54.79 55.83 1s00 n ASP 107 Cb 0.99 -0.55 0.05 0.00 -0.02 0.00 0.00 41.12 41.59 1s00 n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s00 n GLY 108 N 1.25 -0.39 3.44 0.44 0.00 -0.10 -4.68 105.19 105.16 1s00 n GLY 108 Ca 0.06 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 46.04 1s00 n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1s00 s VAL 109 N -3.26 0.55 0.00 1.61 -7.23 -0.97 -4.07 120.40 107.03 1s00 s VAL 109 Ca 0.21 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.38 1s00 s VAL 109 Cb -0.03 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.45 1s00 s VAL 109 CO 0.51 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.91 1s00 n GLY 110 N -0.76 1.02 0.00 2.32 0.00 -1.26 -1.62 105.19 104.89 1s00 n GLY 110 Ca -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1s00 n GLY 110 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s00 n PRO 111 N 0.00 0.00 -0.57 1.61 -0.02 -1.26 -0.65 135.00 134.11 1s00 n PRO 111 Ca 0.00 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 61.95 1s00 n PRO 111 Cb 0.00 -1.55 0.29 0.00 -0.02 0.00 0.00 33.50 32.22 1s00 n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s00 n ALA 112 N -1.40 3.29 -1.32 3.55 0.00 -0.64 -2.32 120.51 121.68 1s00 n ALA 112 Ca 0.00 -2.29 -0.32 0.00 0.00 0.00 0.00 53.44 50.84 1s00 n ALA 112 Cb 0.05 -0.82 0.08 0.00 0.00 0.00 0.00 19.45 18.76 1s00 n ALA 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1s00 s SER 113 N -1.72 4.63 0.05 0.00 0.01 0.18 -3.72 113.70 113.14 1s00 s SER 113 Ca 0.45 1.88 -0.08 0.00 1.31 0.00 0.00 55.95 59.51 1s00 s SER 113 Cb 0.36 -2.53 -0.00 0.00 0.21 0.00 0.00 66.02 64.06 1s00 s SER 113 CO 0.10 -1.95 0.15 -1.66 0.41 0.00 0.00 173.24 170.29 1s00 s TRP 114 N -2.75 0.15 0.05 2.43 1.48 -1.26 -4.24 118.94 114.81 1s00 s TRP 114 Ca 0.63 -0.48 0.02 0.00 -1.06 0.00 0.00 56.10 55.20 1s00 s TRP 114 Cb -0.18 -0.09 -0.04 0.00 -1.16 0.00 0.00 33.47 32.00 1s00 s TRP 114 CO 0.52 -0.44 0.08 0.08 -4.06 0.00 0.00 176.95 173.13 1s00 s VAL 115 N -3.07 4.60 -1.56 -0.66 1.01 -1.26 -5.00 120.40 114.46 1s00 s VAL 115 Ca -0.01 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 1s00 s VAL 115 Cb 0.01 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 1s00 s VAL 115 CO -0.07 0.21 2.71 0.00 0.00 0.00 0.00 175.10 177.96 1s00 n ALA 116 N 0.73 6.86 -1.10 5.51 0.00 -1.26 -4.77 120.51 126.48 1s00 n ALA 116 Ca -0.10 -3.61 -0.29 0.00 0.00 0.00 0.00 53.44 49.44 1s00 n ALA 116 Cb 0.52 -3.42 0.16 0.00 0.00 0.00 0.00 19.45 16.70 1s00 n ALA 116 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1s00 s ARG 117 N 2.54 0.87 0.23 0.00 0.52 -1.26 -4.91 118.95 116.94 1s00 s ARG 117 Ca 0.62 0.81 -0.31 0.00 -0.52 0.00 0.00 55.73 56.33 1s00 s ARG 117 Cb 0.17 -1.77 -0.14 0.00 0.52 0.00 0.00 34.95 33.73 1s00 s ARG 117 CO -0.07 -2.50 1.38 -2.13 0.02 0.00 0.00 175.30 172.00 1s00 n ARG 118 N -4.06 1.93 -2.18 3.54 0.63 -1.26 -3.89 116.66 111.37 1s00 n ARG 118 Ca 0.07 0.69 -0.41 0.00 -0.92 0.00 0.00 57.85 57.27 1s00 n ARG 118 Cb 0.55 -2.32 0.00 0.00 0.45 0.00 0.00 32.46 31.14 1s00 n ARG 118 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1s00 n ASP 119 N 2.14 6.82 -3.80 6.15 2.03 -1.26 -1.99 116.55 126.64 1s00 n ASP 119 Ca 0.12 -3.16 -0.12 0.00 0.52 0.00 0.00 54.79 52.16 1s00 n ASP 119 Cb 0.31 -1.40 -0.08 0.00 -0.72 0.00 0.00 41.12 39.23 1s00 n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1s00 s LEU 120 N -1.46 1.12 0.50 -2.67 1.43 -1.26 -4.92 118.68 111.42 1s00 s LEU 120 Ca 0.47 -0.19 -0.18 0.00 -1.03 0.00 0.00 54.13 53.20 1s00 s LEU 120 Cb 0.15 1.11 -0.08 0.00 0.03 0.00 0.00 46.19 47.40 1s00 s LEU 120 CO -0.05 -0.52 0.99 -2.16 0.23 0.00 0.00 176.35 174.84 1s00 s PRO 121 N -2.12 3.92 0.17 1.29 0.04 -1.26 -1.57 135.00 135.48 1s00 s PRO 121 Ca -0.08 1.07 -0.30 0.00 0.04 0.00 0.00 61.00 61.73 1s00 s PRO 121 Cb -0.03 -2.13 -0.07 0.00 0.04 0.00 0.00 34.50 32.31 1s00 s PRO 121 CO -0.01 -0.30 1.00 -2.00 0.04 0.00 0.00 177.00 175.73 1s00 s GLU 122 N -3.75 4.71 0.26 4.56 2.56 -1.26 -4.90 118.70 120.88 1s00 s GLU 122 Ca 0.61 1.54 -0.00 0.00 0.00 0.00 0.00 54.97 57.13 1s00 s GLU 122 Cb -0.11 -3.32 -0.04 0.00 2.00 0.00 0.00 34.13 32.66 1s00 s GLU 122 CO 0.26 0.25 0.45 -0.51 -0.56 0.00 0.00 175.26 175.15 1s00 s LEU 123 N -0.43 4.16 0.00 2.70 1.02 -1.26 0.22 118.68 125.10 1s00 s LEU 123 Ca 0.46 0.40 0.00 0.00 0.02 0.00 0.00 54.13 55.01 1s00 s LEU 123 Cb -0.26 -3.20 0.00 0.00 0.02 0.00 0.00 46.19 42.75 1s00 s LEU 123 CO 0.32 -0.13 0.00 -0.90 0.02 0.00 0.00 176.35 175.66 1s00 n ASP 124 N -1.10 0.00 0.27 2.29 5.68 0.11 -4.58 116.55 119.23 1s00 n ASP 124 Ca -0.05 -0.99 0.09 0.00 -0.50 0.00 0.00 54.79 53.35 1s00 n ASP 124 Cb 0.55 0.00 0.70 0.00 -1.14 0.00 0.00 41.12 41.23 1s00 n ASP 124 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1s00 h GLY 125 N 0.00 0.00 -0.88 6.12 0.00 -2.00 -1.75 103.07 104.56 1s00 h GLY 125 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1s00 h GLY 125 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 176.54 177.96 1s00 n HIS 126 N -4.37 0.16 -0.77 5.60 8.25 -1.26 -4.94 115.22 117.88 1s00 n HIS 126 Ca -0.03 -0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 1s00 n HIS 126 Cb 0.09 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1s00 n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s00 n GLY 127 N 1.19 0.54 3.70 -1.41 0.00 -0.66 -5.06 105.19 103.49 1s00 n GLY 127 Ca 0.17 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 1s00 n GLY 127 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s00 s HIS 128 N -2.00 3.06 -0.15 1.61 3.76 -1.26 -4.77 115.29 115.54 1s00 s HIS 128 Ca 0.00 0.04 -0.40 0.00 -0.15 0.00 0.00 55.06 54.55 1s00 s HIS 128 Cb 0.00 -1.61 -0.17 0.00 1.11 0.00 0.00 32.58 31.91 1s00 s HIS 128 CO 0.00 0.48 1.48 0.09 -0.85 0.00 0.00 174.74 175.94 1s00 n ASN 129 N 0.92 1.59 0.16 1.40 4.13 -1.26 0.09 115.26 122.29 1s00 n ASN 129 Ca -0.12 1.12 0.04 0.00 1.68 0.00 0.00 54.58 57.30 1s00 n ASN 129 Cb 0.52 -1.08 0.45 0.00 -1.54 0.00 0.00 39.78 38.13 1s00 n ASN 129 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 1s00 h LYS 130 N 5.33 0.16 -5.62 3.52 3.64 0.25 -3.42 116.57 120.43 1s00 h LYS 130 Ca -0.47 -0.03 -0.67 0.00 -1.27 0.00 0.00 60.65 58.21 1s00 h LYS 130 Cb 1.35 -0.02 -0.26 0.00 -0.41 0.00 0.00 32.23 32.88 1s00 h LYS 130 CO 0.85 0.28 -0.78 0.42 -2.27 0.00 0.00 179.45 177.96 1s00 s ILE 131 N -4.76 2.98 0.04 2.00 1.01 -1.26 -1.17 121.20 120.03 1s00 s ILE 131 Ca -0.05 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 59.86 1s00 s ILE 131 Cb 0.16 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 1s00 s ILE 131 CO 0.72 0.55 0.02 -0.54 0.00 0.00 0.00 174.94 175.68 1s00 s LYS 132 N 0.04 0.57 0.33 2.79 1.02 -0.76 -4.71 119.74 119.02 1s00 s LYS 132 Ca -0.05 -0.96 -0.25 0.00 0.02 0.00 0.00 55.97 54.73 1s00 s LYS 132 Cb -0.14 0.21 -0.10 0.00 -0.52 0.00 0.00 37.83 37.27 1s00 s LYS 132 CO 0.04 -0.12 0.94 -2.14 -0.92 0.00 0.00 175.35 173.15 1s00 s PRO 133 N -3.09 4.54 0.27 -1.68 0.02 -1.26 -0.07 135.00 133.72 1s00 s PRO 133 Ca -0.01 1.29 -0.01 0.00 0.02 0.00 0.00 61.00 62.29 1s00 s PRO 133 Cb 0.02 -2.74 0.59 0.00 0.02 0.00 0.00 34.50 32.38 1s00 s PRO 133 CO -0.07 0.25 1.69 0.52 -0.33 0.00 0.00 177.00 179.06 1s00 h MET 134 N 3.06 0.32 -0.88 5.54 2.86 -0.87 0.24 114.93 125.20 1s00 h MET 134 Ca -0.47 -0.02 0.28 0.00 -2.06 0.00 0.00 59.70 57.43 1s00 h MET 134 Cb 1.19 -0.07 -0.16 0.00 0.06 0.00 0.00 31.60 32.62 1s00 h MET 134 CO 0.65 0.21 0.15 1.63 1.06 0.00 0.00 176.91 180.60 1s00 n LYS 135 N -5.11 -0.06 -0.15 1.72 5.02 -1.26 0.73 118.16 119.05 1s00 n LYS 135 Ca 0.18 1.28 0.12 0.00 -2.02 0.00 0.00 58.31 57.87 1s00 n LYS 135 Cb 0.55 -2.11 0.24 0.00 -0.02 0.00 0.00 35.03 33.69 1s00 n LYS 135 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1s00 n ALA 136 N -2.97 2.45 -3.03 7.82 0.00 0.79 -4.80 120.51 120.76 1s00 n ALA 136 Ca 0.24 -0.86 -0.45 0.00 0.00 0.00 0.00 53.44 52.37 1s00 n ALA 136 Cb 0.81 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 19.28 1s00 n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s00 s ALA 137 N -1.62 3.54 0.11 0.00 0.00 0.22 -4.90 121.76 119.12 1s00 s ALA 137 Ca 0.36 -2.21 -0.33 0.00 0.00 0.00 0.00 51.96 49.78 1s00 s ALA 137 Cb 0.21 -3.25 -0.13 0.00 0.00 0.00 0.00 23.12 19.96 1s00 s ALA 137 CO 0.31 -1.96 1.69 0.00 0.00 0.00 0.00 175.76 175.79 1s00 n ALA 138 N 5.54 1.50 0.00 0.00 0.00 -1.26 -1.57 120.51 124.72 1s00 n ALA 138 Ca -0.12 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1s00 n ALA 138 Cb 0.43 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1s00 n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s00 n GLY 139 N 3.77 3.00 3.75 0.00 0.00 -1.26 -5.00 105.19 109.45 1s00 n GLY 139 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1s00 n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s00 s PHE 140 N -1.74 3.84 0.21 1.61 0.40 -0.61 -5.02 117.98 116.67 1s00 s PHE 140 Ca 0.00 1.84 -0.22 0.00 -0.60 0.00 0.00 56.93 57.95 1s00 s PHE 140 Cb 0.00 -3.09 0.05 0.00 0.51 0.00 0.00 43.02 40.49 1s00 s PHE 140 CO 0.00 0.09 0.68 -3.38 0.70 0.00 0.00 175.22 173.31 1s00 s HIS 141 N -1.18 -0.36 -0.16 0.36 -3.43 -1.26 -4.93 115.29 104.34 1s00 s HIS 141 Ca 0.42 0.03 -0.29 0.00 -0.80 0.00 0.00 55.06 54.42 1s00 s HIS 141 Cb -0.28 0.63 -0.01 0.00 -1.43 0.00 0.00 32.58 31.49 1s00 s HIS 141 CO 0.35 -1.01 1.20 0.08 -2.00 0.00 0.00 174.74 173.35 1s00 s VAL 142 N -3.78 4.38 -1.49 -5.38 1.01 -1.26 -4.88 120.40 108.99 1s00 s VAL 142 Ca 0.06 1.68 0.20 0.00 0.00 0.00 0.00 61.98 63.92 1s00 s VAL 142 Cb -0.03 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 1s00 s VAL 142 CO -0.03 -0.12 0.95 -1.54 0.00 0.00 0.00 175.10 174.36 1s00 n SER 143 N 6.26 1.51 -3.57 3.32 3.41 -1.26 -5.02 113.62 118.27 1s00 n SER 143 Ca 0.13 -1.26 -0.06 0.00 -0.26 0.00 0.00 58.87 57.42 1s00 n SER 143 Cb 0.45 0.69 -0.03 0.00 -0.26 0.00 0.00 64.21 65.07 1s00 n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1s00 s ALA 144 N -2.54 -1.99 0.09 7.33 0.00 -1.26 -5.16 121.76 118.22 1s00 s ALA 144 Ca 0.13 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.56 1s00 s ALA 144 Cb 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1s00 s ALA 144 CO 0.64 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.26 1s00 n GLY 145 N 0.03 -2.76 3.68 0.00 0.00 -1.26 -4.81 105.19 100.07 1s00 n GLY 145 Ca -0.03 -1.37 -0.48 0.00 0.00 0.00 0.00 46.02 44.13 1s00 n GLY 145 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1s00 n LYS 146 N -2.24 2.12 -2.20 1.61 3.00 -1.26 -4.90 118.16 114.30 1s00 n LYS 146 Ca -0.01 0.77 -0.43 0.00 -0.00 0.00 0.00 58.31 58.65 1s00 n LYS 146 Cb 0.09 -2.59 -0.02 0.00 0.00 0.00 0.00 35.03 32.50 1s00 n LYS 146 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 1s00 s ASN 147 N 3.30 6.57 0.37 3.14 3.84 -1.26 -4.90 114.94 126.00 1s00 s ASN 147 Ca 0.90 1.67 0.13 0.00 0.21 0.00 0.00 52.86 55.77 1s00 s ASN 147 Cb -0.71 -2.53 0.72 0.00 -0.55 0.00 0.00 41.25 38.18 1s00 s ASN 147 CO 0.49 -1.09 1.83 1.55 -2.79 0.00 0.00 177.10 177.09 1s00 h PRO 148 N 9.86 0.00 -6.39 0.43 0.13 -1.96 -3.46 132.00 130.60 1s00 h PRO 148 Ca -0.32 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.17 1s00 h PRO 148 Cb 1.14 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.34 1s00 h PRO 148 CO 0.99 0.37 0.42 -0.89 -0.23 0.00 0.00 178.00 178.66 1s00 n ILE 149 N -4.10 0.70 0.00 -3.56 5.41 -1.26 -1.57 119.36 114.99 1s00 n ILE 149 Ca -0.02 -0.18 0.00 0.00 1.00 0.00 0.00 62.75 63.56 1s00 n ILE 149 Cb 0.40 -1.04 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 1s00 n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1s00 n GLY 150 N 2.23 2.35 3.81 7.39 0.00 0.23 -4.98 105.19 116.21 1s00 n GLY 150 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1s00 n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s00 s LEU 151 N 0.00 3.85 0.17 0.99 1.43 -0.61 -4.65 118.68 119.86 1s00 s LEU 151 Ca 0.00 1.81 -0.28 0.00 -1.03 0.00 0.00 54.13 54.63 1s00 s LEU 151 Cb 0.00 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.60 1s00 s LEU 151 CO 0.00 -0.63 0.88 -2.16 0.23 0.00 0.00 176.35 174.67 1s00 s PRO 152 N -3.31 4.70 -0.22 1.29 0.04 -1.26 0.58 135.00 136.82 1s00 s PRO 152 Ca 0.65 1.34 -0.13 0.00 0.04 0.00 0.00 61.00 62.89 1s00 s PRO 152 Cb -0.13 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.06 1s00 s PRO 152 CO 0.19 0.44 0.27 0.08 0.04 0.00 0.00 177.00 178.01 1s00 s VAL 153 N -0.76 5.29 -0.07 -0.36 1.01 0.20 -1.56 120.40 124.15 1s00 s VAL 153 Ca 0.41 0.43 -0.02 0.00 0.00 0.00 0.00 61.98 62.79 1s00 s VAL 153 Cb -0.24 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1s00 s VAL 153 CO 0.29 0.31 0.02 -0.60 0.00 0.00 0.00 175.10 175.12 1s00 s ARG 154 N 1.11 3.01 0.50 2.72 3.52 0.13 0.04 118.95 129.98 1s00 s ARG 154 Ca 0.13 -0.41 0.04 0.00 -0.13 0.00 0.00 55.73 55.36 1s00 s ARG 154 Cb -0.14 -2.82 0.03 0.00 -1.56 0.00 0.00 34.95 30.46 1s00 s ARG 154 CO 0.06 0.70 0.70 0.20 -0.81 0.00 0.00 175.30 176.14 1s00 s GLY 155 N -1.07 1.87 0.61 8.12 0.00 -0.09 -0.12 107.32 116.64 1s00 s GLY 155 Ca 0.15 -1.52 0.31 0.00 0.00 0.00 0.00 44.72 43.66 1s00 s GLY 155 CO 0.05 -1.26 2.10 0.00 0.00 0.00 0.00 173.10 173.99 1s00 n ASP 157 N -3.59 0.00 -1.77 0.00 5.75 -1.25 -1.33 116.55 114.36 1s00 n ASP 157 Ca 0.01 -0.92 -0.15 0.00 -0.01 0.00 0.00 54.79 53.72 1s00 n ASP 157 Cb 0.31 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.40 1s00 n ASP 157 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1s00 n LEU 158 N -0.93 -1.73 -4.53 -2.12 4.77 0.36 -4.86 117.00 107.95 1s00 n LEU 158 Ca 0.17 -0.02 -0.30 0.00 -0.03 0.00 0.00 56.01 55.83 1s00 n LEU 158 Cb 0.08 -2.29 -0.11 0.00 -2.33 0.00 0.00 43.42 38.77 1s00 n LEU 158 CO 0.13 -0.14 -0.46 -1.61 -1.33 0.00 0.00 177.39 173.98 1s00 s GLU 159 N -4.79 1.98 0.06 3.23 0.41 -1.24 -4.87 118.70 113.48 1s00 s GLU 159 Ca 0.01 -1.08 -0.30 0.00 -0.41 0.00 0.00 54.97 53.19 1s00 s GLU 159 Cb -0.01 -2.22 -0.05 0.00 -1.78 0.00 0.00 34.13 30.08 1s00 s GLU 159 CO 0.01 0.50 1.09 0.42 -0.49 0.00 0.00 175.26 176.79 1s00 s ILE 160 N -1.16 4.34 -0.87 -1.63 1.01 -1.26 -0.92 121.20 120.71 1s00 s ILE 160 Ca 0.19 1.75 0.11 0.00 0.00 0.00 0.00 60.65 62.69 1s00 s ILE 160 Cb -0.11 -4.12 -0.02 0.00 0.01 0.00 0.00 42.46 38.22 1s00 s ILE 160 CO 0.11 0.17 0.61 0.00 0.00 0.00 0.00 174.94 175.84 1s00 n ALA 161 N 3.58 2.96 0.00 9.38 0.00 0.11 -4.89 120.51 131.63 1s00 n ALA 161 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1s00 n ALA 161 Cb 0.48 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1s00 n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s00 n GLY 162 N 0.98 -0.53 3.07 0.00 0.00 -1.17 -4.32 105.19 103.22 1s00 n GLY 162 Ca 0.04 -1.14 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 1s00 n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s00 s LYS 163 N -2.00 0.44 -0.21 1.61 -2.85 -0.65 0.61 119.74 116.68 1s00 s LYS 163 Ca 0.00 -0.51 -0.29 0.00 -1.00 0.00 0.00 55.97 54.17 1s00 s LYS 163 Cb 0.00 0.18 0.01 0.00 -2.06 0.00 0.00 37.83 35.95 1s00 s LYS 163 CO 0.00 -0.10 1.05 0.08 0.10 0.00 0.00 175.35 176.48 1s00 s VAL 164 N -1.56 4.67 -0.60 1.79 1.01 0.20 0.21 120.40 126.12 1s00 s VAL 164 Ca -0.14 2.00 0.16 0.00 0.00 0.00 0.00 61.98 64.01 1s00 s VAL 164 Cb -0.08 -4.29 -0.20 0.00 0.00 0.00 0.00 36.38 31.81 1s00 s VAL 164 CO 0.00 -0.16 0.62 1.33 0.00 0.00 0.00 175.10 176.89 1s00 n VAL 165 N 5.24 0.00 -3.63 2.92 0.24 0.84 0.73 118.33 124.67 1s00 n VAL 165 Ca 0.12 -0.18 -0.02 0.00 -2.04 0.00 0.00 64.34 62.22 1s00 n VAL 165 Cb 0.46 0.79 -0.01 0.00 -1.47 0.00 0.00 33.84 33.61 1s00 n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1s00 s ASP 166 N -2.88 -0.12 -0.11 -1.34 2.15 -1.15 -4.86 116.67 108.36 1s00 s ASP 166 Ca 0.03 -0.14 0.01 0.00 0.43 0.00 0.00 52.55 52.88 1s00 s ASP 166 Cb 0.12 0.23 -0.02 0.00 -0.30 0.00 0.00 42.92 42.96 1s00 s ASP 166 CO 0.68 -0.41 -0.14 -0.63 -0.17 0.00 0.00 175.17 174.50 1s00 s ILE 167 N -2.63 2.98 -0.25 4.11 1.01 -1.26 -0.39 121.20 124.77 1s00 s ILE 167 Ca 0.12 -0.70 -0.14 0.00 0.00 0.00 0.00 60.65 59.93 1s00 s ILE 167 Cb 0.02 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1s00 s ILE 167 CO -0.03 0.54 0.32 0.26 0.00 0.00 0.00 174.94 176.03 1s00 s TRP 168 N 0.09 3.28 -0.08 3.97 0.52 -0.44 -0.10 118.94 126.17 1s00 s TRP 168 Ca -0.06 0.38 -0.04 0.00 0.02 0.00 0.00 56.10 56.40 1s00 s TRP 168 Cb -0.15 -2.49 -0.04 0.00 -1.15 0.00 0.00 33.47 29.65 1s00 s TRP 168 CO 0.05 -0.13 0.09 0.08 0.02 0.00 0.00 176.95 177.06 1s00 s VAL 169 N 1.71 4.99 -0.59 4.03 1.01 0.89 -0.28 120.40 132.17 1s00 s VAL 169 Ca 0.13 -0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.86 1s00 s VAL 169 Cb -0.15 -3.18 0.08 0.00 0.00 0.00 0.00 36.38 33.13 1s00 s VAL 169 CO 0.09 0.56 0.78 -0.62 0.00 0.00 0.00 175.10 175.90 1s00 s ASP 170 N -1.14 6.20 0.08 3.32 -1.08 0.27 -1.83 116.67 122.49 1s00 s ASP 170 Ca 0.16 -1.14 -0.30 0.00 -0.52 0.00 0.00 52.55 50.75 1s00 s ASP 170 Cb -0.12 -2.34 -0.13 0.00 -1.46 0.00 0.00 42.92 38.87 1s00 s ASP 170 CO 0.06 -1.17 1.47 0.40 0.52 0.00 0.00 175.17 176.45 1s00 h ILE 171 N 5.93 0.00 -0.84 4.11 1.08 -1.42 0.37 117.51 126.75 1s00 h ILE 171 Ca -0.29 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.39 1s00 h ILE 171 Cb 1.08 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.70 1s00 h ILE 171 CO 1.10 0.00 0.25 -0.65 -0.69 0.00 0.00 178.15 178.15 1s00 h PRO 172 N -0.73 0.26 -0.00 2.37 0.11 -1.94 0.14 132.00 132.21 1s00 h PRO 172 Ca -0.02 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1s00 h PRO 172 Cb 0.69 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1s00 h PRO 172 CO -0.18 0.17 -0.29 0.39 -0.21 0.00 0.00 178.00 177.88 1s00 n GLU 173 N -5.17 0.48 -4.00 1.05 -0.58 -1.13 -4.94 120.64 106.35 1s00 n GLU 173 Ca 0.19 -0.25 -0.30 0.00 -0.42 0.00 0.00 57.16 56.38 1s00 n GLU 173 Cb 0.61 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.96 1s00 n GLU 173 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1s00 n GLN 174 N -1.04 -2.13 -4.37 3.49 6.02 0.13 -4.94 117.38 114.53 1s00 n GLN 174 Ca 0.10 0.31 -0.21 0.00 -0.01 0.00 0.00 57.00 57.19 1s00 n GLN 174 Cb 0.33 -4.04 -0.13 0.00 1.02 0.00 0.00 30.24 27.42 1s00 n GLN 174 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1s00 s MET 175 N -6.74 0.99 -0.09 -1.09 1.75 -0.79 -4.95 119.30 108.37 1s00 s MET 175 Ca 0.13 -0.81 -0.29 0.00 -1.25 0.00 0.00 55.69 53.47 1s00 s MET 175 Cb -0.06 -1.02 -0.02 0.00 2.84 0.00 0.00 34.83 36.58 1s00 s MET 175 CO 0.92 0.25 0.98 0.00 -0.65 0.00 0.00 175.02 176.51 1s00 s ALA 176 N -0.89 3.35 -0.19 4.11 0.00 -1.26 0.94 121.76 127.83 1s00 s ALA 176 Ca 0.02 0.38 0.02 0.00 0.00 0.00 0.00 51.96 52.38 1s00 s ALA 176 Cb -0.08 -3.38 -0.13 0.00 0.00 0.00 0.00 23.12 19.53 1s00 s ALA 176 CO 0.01 -0.51 -0.17 0.54 0.00 0.00 0.00 175.76 175.64 1s00 n ARG 177 N 4.73 0.51 -4.19 0.00 5.12 0.61 -4.82 116.66 118.62 1s00 n ARG 177 Ca 0.07 0.11 -0.11 0.00 -1.93 0.00 0.00 57.85 55.99 1s00 n ARG 177 Cb 0.49 -1.39 -0.10 0.00 -1.16 0.00 0.00 32.46 30.31 1s00 n ARG 177 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1s00 s PHE 178 N -2.39 1.08 -0.10 -1.55 0.08 -1.06 -0.77 117.98 113.27 1s00 s PHE 178 Ca -0.26 -1.34 0.03 0.00 0.12 0.00 0.00 56.93 55.49 1s00 s PHE 178 Cb 0.07 -0.54 -0.00 0.00 -0.57 0.00 0.00 43.02 41.97 1s00 s PHE 178 CO 0.45 -0.60 -0.22 -0.51 -0.10 0.00 0.00 175.22 174.24 1s00 s LEU 179 N -3.13 2.23 -0.33 -0.37 1.43 0.82 -1.33 118.68 118.01 1s00 s LEU 179 Ca 0.35 -0.51 -0.21 0.00 -1.03 0.00 0.00 54.13 52.73 1s00 s LEU 179 Cb 0.07 -1.45 -0.00 0.00 0.03 0.00 0.00 46.19 44.84 1s00 s LEU 179 CO 0.09 0.17 0.66 -0.70 0.23 0.00 0.00 176.35 176.80 1s00 s GLU 180 N 0.31 3.82 -0.21 1.70 2.12 0.48 -0.19 118.70 126.73 1s00 s GLU 180 Ca -0.16 0.25 -0.04 0.00 0.36 0.00 0.00 54.97 55.37 1s00 s GLU 180 Cb -0.17 -3.76 -0.02 0.00 0.26 0.00 0.00 34.13 30.44 1s00 s GLU 180 CO 0.08 -0.66 -0.02 0.08 -0.54 0.00 0.00 175.26 174.20 1s00 s VAL 181 N 2.72 3.69 0.10 3.70 1.01 0.10 -0.11 120.40 131.61 1s00 s VAL 181 Ca 0.26 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1s00 s VAL 181 Cb -0.15 -2.67 -0.06 0.00 0.00 0.00 0.00 36.38 33.50 1s00 s VAL 181 CO 0.13 0.42 0.91 -0.70 0.00 0.00 0.00 175.10 175.86 1s00 s GLU 182 N 1.23 4.65 0.65 2.72 2.12 0.13 -0.72 118.70 129.48 1s00 s GLU 182 Ca 0.03 1.35 0.04 0.00 0.36 0.00 0.00 54.97 56.74 1s00 s GLU 182 Cb -0.14 -3.36 0.11 0.00 0.26 0.00 0.00 34.13 30.99 1s00 s GLU 182 CO 0.00 0.26 0.90 -0.51 -0.54 0.00 0.00 175.26 175.37 1s00 s LEU 183 N -0.11 3.05 0.35 2.70 1.43 0.14 -1.64 118.68 124.60 1s00 s LEU 183 Ca 0.44 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1s00 s LEU 183 Cb -0.23 -1.87 0.66 0.00 0.03 0.00 0.00 46.19 44.78 1s00 s LEU 183 CO 0.28 -1.62 2.00 0.11 0.23 0.00 0.00 176.35 177.35 1s00 h LYS 184 N -0.21 0.82 0.00 1.70 6.56 -1.86 -1.37 116.57 122.20 1s00 h LYS 184 Ca -0.34 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.20 1s00 h LYS 184 Cb 1.28 -0.18 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1s00 h LYS 184 CO 0.41 0.54 0.00 -0.40 -2.06 0.00 0.00 179.45 177.94 1s00 n ASP 185 N -4.45 0.00 0.00 0.86 5.68 -1.26 -4.88 116.55 112.50 1s00 n ASP 185 Ca 0.07 -0.76 0.00 0.00 -0.50 0.00 0.00 54.79 53.61 1s00 n ASP 185 Cb 0.08 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 1s00 n ASP 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1s00 n GLY 186 N 0.79 2.21 3.91 6.12 0.00 -0.51 -5.05 105.19 112.66 1s00 n GLY 186 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1s00 n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1s00 s SER 187 N -1.78 4.62 0.27 1.61 1.04 -1.26 -4.69 113.70 113.51 1s00 s SER 187 Ca 0.00 0.64 0.07 0.00 0.48 0.00 0.00 55.95 57.14 1s00 s SER 187 Cb 0.00 -1.19 -0.06 0.00 0.10 0.00 0.00 66.02 64.87 1s00 s SER 187 CO 0.00 -1.79 -0.07 0.42 0.98 0.00 0.00 173.24 172.78 1s00 s THR 188 N -3.44 1.66 0.05 2.02 -4.23 -1.26 0.25 115.64 110.68 1s00 s THR 188 Ca 0.61 -2.14 0.01 0.00 -1.18 0.00 0.00 61.69 58.99 1s00 s THR 188 Cb -0.11 -2.39 -0.03 0.00 1.34 0.00 0.00 72.50 71.31 1s00 s THR 188 CO 0.47 -0.34 -0.05 -0.13 -0.54 0.00 0.00 174.62 174.03 1s00 s ARG 189 N -3.72 0.52 -0.12 3.99 1.81 0.10 -4.83 118.95 116.70 1s00 s ARG 189 Ca 0.29 -0.89 -0.12 0.00 -1.72 0.00 0.00 55.73 53.29 1s00 s ARG 189 Cb 0.03 -0.06 -0.05 0.00 -0.45 0.00 0.00 34.95 34.42 1s00 s ARG 189 CO 0.11 -0.02 0.26 -0.51 -0.68 0.00 0.00 175.30 174.46 1s00 s LEU 190 N -2.03 4.32 -0.11 2.53 1.43 -1.26 0.00 118.68 123.56 1s00 s LEU 190 Ca -0.05 0.56 0.02 0.00 -1.03 0.00 0.00 54.13 53.62 1s00 s LEU 190 Cb -0.04 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 43.85 1s00 s LEU 190 CO -0.03 0.22 -0.17 -0.76 0.23 0.00 0.00 176.35 175.85 1s00 s LEU 191 N -0.20 2.51 0.21 1.79 2.01 0.73 -4.90 118.68 120.83 1s00 s LEU 191 Ca 0.17 -0.40 -0.32 0.00 0.01 0.00 0.00 54.13 53.59 1s00 s LEU 191 Cb -0.13 -1.54 -0.13 0.00 0.01 0.00 0.00 46.19 44.40 1s00 s LEU 191 CO 0.05 0.18 1.60 -2.65 1.01 0.00 0.00 176.35 176.54 1s00 n PRO 192 N 3.42 2.44 -0.34 1.29 -0.02 -1.26 -0.12 135.00 140.41 1s00 n PRO 192 Ca -0.18 0.88 0.05 0.00 -2.02 0.00 0.00 63.50 62.22 1s00 n PRO 192 Cb 0.53 -2.66 0.23 0.00 -0.02 0.00 0.00 33.50 31.58 1s00 n PRO 192 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1s00 h MET 193 N 5.70 1.02 0.00 -0.52 4.05 -1.24 -0.58 114.93 123.36 1s00 h MET 193 Ca -0.45 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 58.91 1s00 h MET 193 Cb 1.23 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.80 1s00 h MET 193 CO 0.87 0.68 0.00 0.00 0.23 0.00 0.00 176.91 178.69 1s00 n GLN 194 N -4.53 0.91 -0.09 0.39 0.00 -1.26 -2.73 117.38 110.07 1s00 n GLN 194 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 57.00 57.19 1s00 n GLN 194 Cb 0.25 -1.22 0.08 0.00 0.00 0.00 0.00 30.24 29.35 1s00 n GLN 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1s00 n MET 195 N -0.72 2.75 -4.29 2.61 2.81 -0.23 -4.99 117.12 115.05 1s00 n MET 195 Ca 0.10 -1.75 -0.22 0.00 -1.81 0.00 0.00 57.70 54.01 1s00 n MET 195 Cb 0.04 -1.15 -0.12 0.00 -0.71 0.00 0.00 33.22 31.29 1s00 n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1s00 s VAL 196 N -0.97 1.69 -0.30 2.03 -7.23 -1.11 -4.43 120.40 110.08 1s00 s VAL 196 Ca 0.13 -1.70 0.02 0.00 -1.81 0.00 0.00 61.98 58.61 1s00 s VAL 196 Cb 0.07 -1.65 0.07 0.00 0.56 0.00 0.00 36.38 35.43 1s00 s VAL 196 CO 0.09 -0.21 -0.02 -0.75 -0.31 0.00 0.00 175.10 173.90 1s00 s LYS 197 N -2.34 2.09 -0.35 4.82 2.47 0.25 -4.95 119.74 121.73 1s00 s LYS 197 Ca 0.10 -1.49 -0.29 0.00 -1.56 0.00 0.00 55.97 52.73 1s00 s LYS 197 Cb -0.08 -3.09 0.01 0.00 -1.46 0.00 0.00 37.83 33.21 1s00 s LYS 197 CO 0.05 -0.71 1.21 0.08 0.16 0.00 0.00 175.35 176.14 1s00 s VAL 198 N 1.09 4.25 0.49 4.02 1.01 -1.26 -0.55 120.40 129.45 1s00 s VAL 198 Ca -0.02 1.38 0.07 0.00 0.00 0.00 0.00 61.98 63.41 1s00 s VAL 198 Cb -0.20 -4.33 0.01 0.00 0.00 0.00 0.00 36.38 31.87 1s00 s VAL 198 CO -0.05 -0.61 0.41 -1.10 0.00 0.00 0.00 175.10 173.76 1s00 s GLN 199 N 4.13 2.36 0.24 2.72 -0.21 0.75 -4.99 119.66 124.65 1s00 s GLN 199 Ca 0.52 -1.79 -0.07 0.00 0.02 0.00 0.00 55.36 54.04 1s00 s GLN 199 Cb -0.13 -2.24 0.26 0.00 1.00 0.00 0.00 33.01 31.89 1s00 s GLN 199 CO 0.23 -0.45 1.90 0.66 -2.12 0.00 0.00 175.29 175.52 1s00 h SER 200 N 0.85 1.01 -0.23 5.90 4.64 -2.01 -3.19 113.55 120.54 1s00 h SER 200 Ca -0.38 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1s00 h SER 200 Cb 1.28 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1s00 h SER 200 CO 0.57 0.71 0.00 -0.46 -0.87 0.00 0.00 176.83 176.78 1s00 n ASN 201 N -4.48 2.64 0.00 4.97 6.94 -1.26 -5.05 115.26 119.02 1s00 n ASN 201 Ca 0.11 -2.04 0.00 0.00 -0.02 0.00 0.00 54.58 52.63 1s00 n ASN 201 Cb 0.06 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.31 1s00 n ASN 201 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 1s00 n ARG 202 N 0.13 0.00 -3.79 -3.83 0.00 -1.20 -4.55 116.66 103.42 1s00 n ARG 202 Ca 0.08 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.57 1s00 n ARG 202 Cb 0.38 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.74 1s00 n ARG 202 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1s00 s VAL 203 N -2.00 4.87 -0.14 5.15 1.01 -0.60 -0.18 120.40 128.51 1s00 s VAL 203 Ca 0.00 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 1s00 s VAL 203 Cb 0.00 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1s00 s VAL 203 CO 0.00 0.36 0.07 -2.28 0.00 0.00 0.00 175.10 173.26 1s00 s HIS 204 N 1.10 3.34 -0.41 5.22 2.46 0.29 -0.70 115.29 126.60 1s00 s HIS 204 Ca 0.06 0.25 0.02 0.00 0.47 0.00 0.00 55.06 55.85 1s00 s HIS 204 Cb -0.14 -1.98 0.11 0.00 -0.13 0.00 0.00 32.58 30.45 1s00 s HIS 204 CO 0.04 0.40 0.16 0.08 -2.47 0.00 0.00 174.74 172.96 1s00 s VAL 205 N -0.33 2.71 0.30 0.89 1.01 0.83 -0.58 120.40 125.23 1s00 s VAL 205 Ca 0.09 -2.51 0.06 0.00 0.00 0.00 0.00 61.98 59.62 1s00 s VAL 205 Cb -0.12 -2.92 0.05 0.00 0.00 0.00 0.00 36.38 33.39 1s00 s VAL 205 CO 0.02 -0.68 1.71 -1.13 0.00 0.00 0.00 175.10 175.01 1s00 h ASN 206 N 7.47 0.29 0.14 3.32 -0.73 -1.83 -2.51 115.58 121.72 1s00 h ASN 206 Ca -0.07 -0.11 -0.02 0.00 1.87 0.00 0.00 56.30 57.97 1s00 h ASN 206 Cb 1.00 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 39.50 1s00 h ASN 206 CO 0.61 0.65 -0.10 0.00 -0.37 0.00 0.00 177.43 178.22 1s00 h ALA 207 N 1.37 1.66 -2.96 1.57 0.00 -1.86 -3.39 119.26 115.65 1s00 h ALA 207 Ca 0.03 -0.09 -0.36 0.00 0.00 0.00 0.00 54.91 54.49 1s00 h ALA 207 Cb 0.77 -0.02 -0.19 0.00 0.00 0.00 0.00 17.79 18.35 1s00 h ALA 207 CO 0.06 0.12 -0.75 -0.51 0.00 0.00 0.00 179.25 178.17 1s00 s LEU 208 N -8.32 2.36 0.07 0.00 1.02 -1.19 -3.16 118.68 109.45 1s00 s LEU 208 Ca -0.04 -0.74 0.00 0.00 0.02 0.00 0.00 54.13 53.37 1s00 s LEU 208 Cb 0.15 -0.40 -0.04 0.00 0.02 0.00 0.00 46.19 45.93 1s00 s LEU 208 CO 0.64 -0.19 0.20 -0.94 0.02 0.00 0.00 176.35 176.09 1s00 s SER 209 N -2.21 6.27 0.19 2.29 1.04 -1.26 0.69 113.70 120.71 1s00 s SER 209 Ca 0.03 0.23 -0.16 0.00 0.48 0.00 0.00 55.95 56.54 1s00 s SER 209 Cb -0.06 -1.90 0.19 0.00 0.10 0.00 0.00 66.02 64.35 1s00 s SER 209 CO 0.01 0.16 1.32 -1.54 0.98 0.00 0.00 173.24 174.18 1s00 n SER 210 N 0.25 -0.57 0.00 7.02 3.41 -1.26 0.75 113.62 123.22 1s00 n SER 210 Ca -0.06 1.49 0.00 0.00 -0.26 0.00 0.00 58.87 60.04 1s00 n SER 210 Cb 0.51 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1s00 n SER 210 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1s00 n ASP 211 N -5.24 0.00 -0.00 4.04 5.68 -1.26 -1.84 116.55 117.92 1s00 n ASP 211 Ca 0.08 0.43 0.09 0.00 -0.50 0.00 0.00 54.79 54.89 1s00 n ASP 211 Cb 0.33 -0.43 -0.13 0.00 -1.14 0.00 0.00 41.12 39.76 1s00 n ASP 211 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1s00 n LEU 212 N -1.42 0.40 -0.32 -2.12 4.77 0.23 -4.42 117.00 114.11 1s00 n LEU 212 Ca 0.00 -0.22 0.02 0.00 -0.03 0.00 0.00 56.01 55.78 1s00 n LEU 212 Cb 0.04 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.29 1s00 n LEU 212 CO 0.00 0.10 1.20 -0.26 -1.33 0.00 0.00 177.39 177.10 1s00 h PHE 213 N 0.00 1.02 -1.01 -1.77 -1.00 -1.35 -1.47 116.94 111.35 1s00 h PHE 213 Ca 0.00 0.03 0.16 0.00 2.81 0.00 0.00 57.97 60.97 1s00 h PHE 213 Cb 0.70 -0.33 -0.10 0.00 3.61 0.00 0.00 35.95 39.84 1s00 h PHE 213 CO 0.00 0.49 0.62 0.00 -1.61 0.00 0.00 178.31 177.81 1s00 h ALA 214 N 1.43 1.61 0.00 2.45 0.00 -1.77 -0.74 119.26 122.24 1s00 h ALA 214 Ca 0.40 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1s00 h ALA 214 Cb 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1s00 h ALA 214 CO -0.19 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.53 1s00 n GLY 215 N -1.34 -1.00 3.71 0.00 0.00 -0.56 -4.82 105.19 101.19 1s00 n GLY 215 Ca 0.22 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1s00 n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s00 s ILE 216 N -2.47 2.17 0.28 -0.61 1.01 -0.29 -4.85 121.20 116.45 1s00 s ILE 216 Ca 0.25 0.03 -0.29 0.00 0.00 0.00 0.00 60.65 60.64 1s00 s ILE 216 Cb 0.16 -3.02 -0.14 0.00 0.01 0.00 0.00 42.46 39.47 1s00 s ILE 216 CO 0.34 0.00 1.10 -2.65 0.00 0.00 0.00 174.94 173.73 1s00 n PRO 217 N 4.47 1.52 -2.90 2.79 -0.02 -1.26 -4.96 135.00 134.63 1s00 n PRO 217 Ca 0.16 0.53 -0.23 0.00 -2.02 0.00 0.00 63.50 61.94 1s00 n PRO 217 Cb 0.36 -1.97 0.01 0.00 -0.02 0.00 0.00 33.50 31.88 1s00 n PRO 217 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1s00 s THR 218 N -0.91 3.94 0.10 3.45 -4.23 -1.26 -4.74 115.64 111.99 1s00 s THR 218 Ca 0.60 -0.43 0.02 0.00 -1.18 0.00 0.00 61.69 60.70 1s00 s THR 218 Cb -0.69 -3.47 -0.04 0.00 1.34 0.00 0.00 72.50 69.64 1s00 s THR 218 CO 0.59 -0.35 0.18 0.27 -0.54 0.00 0.00 174.62 174.77 1s00 s ILE 219 N -2.61 5.03 0.01 2.99 -4.36 -1.26 -5.01 121.20 115.98 1s00 s ILE 219 Ca 0.49 -0.65 -0.08 0.00 -0.26 0.00 0.00 60.65 60.15 1s00 s ILE 219 Cb -0.10 -3.49 -0.05 0.00 1.25 0.00 0.00 42.46 40.07 1s00 s ILE 219 CO 0.39 0.05 0.91 0.11 0.24 0.00 0.00 174.94 176.64 1s00 h LYS 220 N 2.83 -0.29 -5.86 0.37 1.57 -1.99 -3.43 116.57 109.77 1s00 h LYS 220 Ca -0.47 0.02 -0.57 0.00 -1.87 0.00 0.00 60.65 57.76 1s00 h LYS 220 Cb 1.17 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 33.48 1s00 h LYS 220 CO 0.70 -0.19 -0.08 0.45 -0.57 0.00 0.00 179.45 179.76 1s00 s SER 221 N -2.79 6.80 0.00 0.86 0.15 -1.26 -4.96 113.70 112.49 1s00 s SER 221 Ca -0.04 0.95 0.11 0.00 0.70 0.00 0.00 55.95 57.66 1s00 s SER 221 Cb 0.00 -2.32 0.50 0.00 -1.71 0.00 0.00 66.02 62.49 1s00 s SER 221 CO 0.13 0.01 1.28 -0.81 1.20 0.00 0.00 173.24 175.05 1s00 n PRO 222 N 3.47 0.08 0.00 5.44 -0.04 -1.26 -3.01 135.00 139.68 1s00 n PRO 222 Ca -0.06 0.25 0.06 0.00 -0.04 0.00 0.00 63.50 63.70 1s00 n PRO 222 Cb 0.51 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.52 1s00 n PRO 222 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1s00 n THR 223 N -1.38 0.00 -3.84 0.52 -2.24 -1.26 -4.98 114.28 101.10 1s00 n THR 223 Ca 0.04 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 1s00 n THR 223 Cb 0.10 1.23 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1s00 n THR 223 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1s00 s GLU 224 N -0.96 1.02 -0.00 -0.78 -1.05 -1.16 -4.49 118.70 111.27 1s00 s GLU 224 Ca 0.13 -0.97 0.02 0.00 -0.15 0.00 0.00 54.97 54.00 1s00 s GLU 224 Cb 0.09 0.39 -0.01 0.00 -0.44 0.00 0.00 34.13 34.17 1s00 s GLU 224 CO 0.15 -0.37 -0.08 0.54 0.95 0.00 0.00 175.26 176.45 1s00 s VAL 225 N -3.88 0.60 0.46 1.83 0.11 -1.26 -4.41 120.40 113.85 1s00 s VAL 225 Ca 0.09 -0.40 0.05 0.00 -2.93 0.00 0.00 61.98 58.79 1s00 s VAL 225 Cb 0.03 -0.52 0.02 0.00 -1.53 0.00 0.00 36.38 34.38 1s00 s VAL 225 CO -0.07 0.12 0.65 0.42 -3.33 0.00 0.00 175.10 172.88 1s00 s THR 226 N -0.29 3.04 0.17 5.04 -4.23 -1.26 -4.10 115.64 114.01 1s00 s THR 226 Ca 0.02 -0.84 -0.13 0.00 -1.18 0.00 0.00 61.69 59.56 1s00 s THR 226 Cb -0.04 -3.07 0.06 0.00 1.34 0.00 0.00 72.50 70.80 1s00 s THR 226 CO -0.00 -0.04 1.76 -0.07 -0.54 0.00 0.00 174.62 175.73 1s00 h LEU 227 N 0.43 0.71 -0.96 4.79 3.38 -1.26 0.24 115.31 122.63 1s00 h LEU 227 Ca -0.42 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.46 1s00 h LEU 227 Cb 1.28 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 1s00 h LEU 227 CO 0.49 0.62 0.63 0.25 0.09 0.00 0.00 178.44 180.53 1s00 h LEU 228 N 0.74 1.08 -0.19 1.67 5.85 -1.51 -0.09 115.31 122.86 1s00 h LEU 228 Ca 0.19 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 1s00 h LEU 228 Cb 0.09 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.86 1s00 h LEU 228 CO -0.03 0.76 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.37 1s00 h GLU 229 N 1.27 0.43 -0.17 1.25 5.08 -1.71 -1.34 114.58 119.38 1s00 h GLU 229 Ca 0.37 -0.21 0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1s00 h GLU 229 Cb -0.09 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.10 1s00 h GLU 229 CO -0.10 0.76 -0.33 0.93 -1.00 0.00 0.00 179.01 179.27 1s00 h GLU 230 N 0.10 -0.37 -0.23 2.33 5.08 -0.13 0.36 114.58 121.72 1s00 h GLU 230 Ca 0.04 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1s00 h GLU 230 Cb 0.66 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 1s00 h GLU 230 CO 0.04 -0.25 -0.03 0.22 -1.00 0.00 0.00 179.01 177.99 1s00 h ASP 231 N -0.38 -0.16 -0.60 1.42 3.58 -0.96 0.32 116.42 119.63 1s00 h ASP 231 Ca 0.10 0.06 0.01 0.00 0.42 0.00 0.00 57.03 57.63 1s00 h ASP 231 Cb 0.55 0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.69 1s00 h ASP 231 CO -0.38 -0.05 0.40 0.11 -2.88 0.00 0.00 179.24 176.44 1s00 h LYS 232 N 0.03 0.76 -0.11 0.28 1.57 -0.38 0.29 116.57 119.01 1s00 h LYS 232 Ca 0.11 -0.05 -0.22 0.00 -1.87 0.00 0.00 60.65 58.63 1s00 h LYS 232 Cb 0.16 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.31 1s00 h LYS 232 CO -0.21 0.50 -0.79 0.82 -0.57 0.00 0.00 179.45 179.20 1s00 h ILE 233 N 0.78 1.30 -0.04 1.86 2.04 0.11 -2.61 117.51 120.95 1s00 h ILE 233 Ca 0.23 -2.01 -0.02 0.00 1.00 0.00 0.00 64.86 64.06 1s00 h ILE 233 Cb -0.04 2.13 -0.00 0.00 -0.74 0.00 0.00 36.82 38.17 1s00 h ILE 233 CO -0.05 0.63 -0.05 0.00 0.00 0.00 0.00 178.15 178.68 1s00 h GLY 235 N -0.36 1.08 0.93 0.00 0.00 -0.53 -1.37 103.07 102.81 1s00 h GLY 235 Ca 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 1s00 h GLY 235 CO 0.01 0.08 0.12 -1.82 0.00 0.00 0.00 176.54 174.93 1s00 h TYR 236 N 0.63 0.58 -0.19 5.60 5.03 -1.44 -0.96 116.97 126.22 1s00 h TYR 236 Ca 0.35 -0.05 -0.08 0.00 2.58 0.00 0.00 58.73 61.52 1s00 h TYR 236 Cb 0.35 -0.17 -0.01 0.00 1.55 0.00 0.00 36.73 38.44 1s00 h TYR 236 CO -0.10 0.55 -0.24 0.28 -1.32 0.00 0.00 178.16 177.33 1s00 h VAL 237 N 0.44 1.25 -0.22 1.81 2.07 -0.90 -2.70 116.25 117.99 1s00 h VAL 237 Ca 0.12 -1.16 -0.18 0.00 0.82 0.00 0.00 66.70 66.30 1s00 h VAL 237 Cb 0.24 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1s00 h VAL 237 CO -0.01 0.36 -0.55 0.00 0.02 0.00 0.00 177.57 177.39 1s00 h ALA 238 N 1.44 0.37 -0.58 1.67 0.00 -1.11 -3.03 119.26 118.01 1s00 h ALA 238 Ca 0.05 -0.52 0.17 0.00 0.00 0.00 0.00 54.91 54.61 1s00 h ALA 238 Cb 0.60 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1s00 h ALA 238 CO 0.04 0.58 0.49 0.78 0.00 0.00 0.00 179.25 181.14 1s00 h GLY 239 N 0.50 0.00 1.63 0.00 0.00 -0.76 -0.92 103.07 103.52 1s00 h GLY 239 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1s00 h GLY 239 CO 0.12 0.00 0.22 -1.33 0.00 0.00 0.00 176.54 175.55 1s00 h GLY 240 N 0.00 0.52 -0.06 4.60 0.00 -1.40 -0.45 103.07 106.28 1s00 h GLY 240 Ca 0.28 -0.21 0.17 0.00 0.00 0.00 0.00 47.33 47.56 1s00 h GLY 240 CO -0.00 0.20 0.23 1.41 0.00 0.00 0.00 176.54 178.38 1s00 h LEU 241 N 0.50 0.10 0.00 3.11 3.38 -1.11 0.14 115.31 121.43 1s00 h LEU 241 Ca 0.13 0.14 -0.10 0.00 0.09 0.00 0.00 57.88 58.15 1s00 h LEU 241 Cb -0.01 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1s00 h LEU 241 CO -0.02 -0.01 -0.63 -0.03 0.09 0.00 0.00 178.44 177.83 1s00 h MET 242 N 0.32 0.00 0.00 1.13 4.05 -1.61 -3.37 114.93 115.45 1s00 h MET 242 Ca 0.44 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.86 1s00 h MET 242 Cb 0.75 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.55 1s00 h MET 242 CO -0.50 0.66 0.00 0.66 0.23 0.00 0.00 176.91 177.97 1s00 n TYR 243 N -4.56 0.00 0.16 1.39 4.01 -0.23 -3.05 117.16 114.88 1s00 n TYR 243 Ca -0.17 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.62 1s00 n TYR 243 Cb 0.46 -0.25 0.08 0.00 -0.31 0.00 0.00 39.34 39.32 1s00 n TYR 243 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1s00 n ALA 244 N -1.25 2.34 -0.30 -0.72 0.00 0.48 -4.70 120.51 116.35 1s00 n ALA 244 Ca 0.14 -0.83 0.13 0.00 0.00 0.00 0.00 53.44 52.88 1s00 n ALA 244 Cb 0.20 -0.36 0.29 0.00 0.00 0.00 0.00 19.45 19.58 1s00 n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s00 h ALA 245 N 1.89 1.25 -0.33 0.00 0.00 -1.65 0.30 119.26 120.73 1s00 h ALA 245 Ca 0.00 0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1s00 h ALA 245 Cb 0.55 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1s00 h ALA 245 CO 0.00 -0.50 -0.02 -1.35 0.00 0.00 0.00 179.25 177.37 1s00 h PRO 246 N 0.16 0.52 0.00 0.00 0.11 -1.86 -2.70 132.00 128.23 1s00 h PRO 246 Ca 0.56 -0.12 -0.08 0.00 0.11 0.00 0.00 66.00 66.47 1s00 h PRO 246 Cb 1.14 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1s00 h PRO 246 CO -0.70 0.56 -0.51 0.87 -0.21 0.00 0.00 178.00 178.02 1s00 h LYS 247 N 0.49 0.00 -6.91 1.05 1.57 -0.88 -3.46 116.57 108.44 1s00 h LYS 247 Ca 0.10 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.37 1s00 h LYS 247 Cb 0.36 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.72 1s00 h LYS 247 CO 0.01 0.33 0.54 0.50 -0.57 0.00 0.00 179.45 180.27 1s00 s ARG 248 N -3.04 4.19 0.47 3.15 3.52 0.22 -3.86 118.95 123.60 1s00 s ARG 248 Ca 0.04 1.96 -0.01 0.00 -0.13 0.00 0.00 55.73 57.59 1s00 s ARG 248 Cb 0.07 -2.85 -0.00 0.00 -1.56 0.00 0.00 34.95 30.61 1s00 s ARG 248 CO 0.74 -0.24 0.70 0.15 -0.81 0.00 0.00 175.30 175.84 1s00 s LYS 249 N -2.06 3.07 0.87 5.12 -0.14 -0.44 -4.91 119.74 121.25 1s00 s LYS 249 Ca 0.53 -0.39 -0.12 0.00 -1.36 0.00 0.00 55.97 54.63 1s00 s LYS 249 Cb -0.34 -2.51 0.11 0.00 -1.68 0.00 0.00 37.83 33.41 1s00 s LYS 249 CO 0.44 -0.32 1.11 -1.54 -0.76 0.00 0.00 175.35 174.28 1s00 s SER 250 N -4.22 3.88 0.43 2.83 1.04 -1.26 -4.88 113.70 111.52 1s00 s SER 250 Ca 0.49 1.17 0.15 0.00 0.48 0.00 0.00 55.95 58.24 1s00 s SER 250 Cb -0.10 -1.83 0.94 0.00 0.10 0.00 0.00 66.02 65.13 1s00 s SER 250 CO 0.39 -2.34 1.93 0.58 0.98 0.00 0.00 173.24 174.79 1s00 h VAL 251 N -1.35 1.11 0.08 5.02 2.07 -1.99 -1.92 116.25 119.27 1s00 h VAL 251 Ca -0.49 -0.88 -0.27 0.00 0.82 0.00 0.00 66.70 65.89 1s00 h VAL 251 Cb 1.30 1.48 0.01 0.00 -1.52 0.00 0.00 31.29 32.57 1s00 h VAL 251 CO 0.60 0.24 -1.14 0.58 0.02 0.00 0.00 177.57 177.88 1s00 h VAL 252 N 0.00 1.37 -0.24 2.57 2.07 -1.97 -3.00 116.25 117.05 1s00 h VAL 252 Ca -0.00 -2.58 -0.09 0.00 0.82 0.00 0.00 66.70 64.85 1s00 h VAL 252 Cb 0.46 2.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 1s00 h VAL 252 CO 0.03 0.77 -0.23 0.00 0.02 0.00 0.00 177.57 178.17 1s00 h ALA 253 N 0.51 1.16 0.00 1.67 0.00 -1.84 -2.45 119.26 118.31 1s00 h ALA 253 Ca -0.14 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1s00 h ALA 253 Cb 1.81 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1s00 h ALA 253 CO 0.20 0.53 -0.25 0.00 0.00 0.00 0.00 179.25 179.74 1s00 h ALA 254 N 1.36 1.06 -0.42 0.00 0.00 -1.37 -2.90 119.26 116.99 1s00 h ALA 254 Ca 0.06 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 1s00 h ALA 254 Cb 0.62 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.26 1s00 h ALA 254 CO 0.04 0.31 0.24 -1.33 0.00 0.00 0.00 179.25 178.51 1s00 n MET 255 N -3.47 1.83 0.00 0.00 2.81 -0.92 -5.11 117.12 112.26 1s00 n MET 255 Ca -0.00 -1.39 0.00 0.00 -1.81 0.00 0.00 57.70 54.50 1s00 n MET 255 Cb 0.42 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 1s00 n MET 255 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76