#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 -0.53 -1.16 -2.67 -0.00 -2.05 -1.75 115.31 107.15 1s00 h LEU 12 Ca 0.00 0.01 0.25 0.00 -0.00 0.00 0.00 57.88 58.14 1s00 h LEU 12 Cb 0.00 0.14 -0.11 0.00 -0.00 0.00 0.00 40.66 40.69 1s00 h LEU 12 CO 0.00 -0.37 0.63 0.00 -0.00 0.00 0.00 178.44 178.70 1s00 h ALA 13 N -0.10 1.97 -0.20 1.53 0.00 -2.05 0.48 119.26 120.88 1s00 h ALA 13 Ca -0.06 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1s00 h ALA 13 Cb 0.49 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1s00 h ALA 13 CO 0.11 -0.40 -0.30 0.77 0.00 0.00 0.00 179.25 179.43 1s00 h SER 14 N 0.52 0.60 -0.73 0.00 0.02 -1.94 -0.50 113.55 111.53 1s00 h SER 14 Ca 0.61 -0.52 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1s00 h SER 14 Cb 1.30 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 1s00 h SER 14 CO -0.38 1.01 0.45 0.25 -1.14 0.00 0.00 176.83 177.01 1s00 h LEU 15 N 0.22 0.87 0.20 5.07 5.85 0.09 -0.72 115.31 126.88 1s00 h LEU 15 Ca 0.02 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1s00 h LEU 15 Cb 0.88 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 1s00 h LEU 15 CO 0.07 0.66 -0.11 0.00 -0.34 0.00 0.00 178.44 178.73 1s00 h ALA 16 N 1.24 -0.28 -0.67 1.25 0.00 -0.05 0.13 119.26 120.88 1s00 h ALA 16 Ca 0.26 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1s00 h ALA 16 Cb -0.05 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1s00 h ALA 16 CO -0.05 -0.66 0.18 0.97 0.00 0.00 0.00 179.25 179.69 1s00 h ILE 17 N -0.28 1.25 -0.45 0.00 6.09 -0.91 0.23 117.51 123.45 1s00 h ILE 17 Ca -0.02 -0.91 -0.02 0.00 -1.37 0.00 0.00 64.86 62.54 1s00 h ILE 17 Cb 0.23 0.55 -0.02 0.00 0.47 0.00 0.00 36.82 38.05 1s00 h ILE 17 CO 0.03 0.35 0.20 0.22 -3.07 0.00 0.00 178.15 175.88 1s00 h TYR 18 N 1.00 0.66 -0.63 2.19 3.20 -0.94 -2.60 116.97 119.85 1s00 h TYR 18 Ca 0.21 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 1s00 h TYR 18 Cb 0.33 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1s00 h TYR 18 CO 0.02 0.55 0.09 0.77 -1.64 0.00 0.00 178.16 177.96 1s00 h SER 19 N 0.58 1.00 -0.28 -2.11 0.02 -0.38 -2.88 113.55 109.51 1s00 h SER 19 Ca 0.15 -0.24 0.08 0.00 -0.84 0.00 0.00 61.79 60.95 1s00 h SER 19 Cb 0.15 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1s00 h SER 19 CO -0.02 1.00 0.20 0.15 -1.14 0.00 0.00 176.83 177.03 1s00 h PHE 20 N 0.98 0.00 0.09 3.45 3.57 -0.56 0.62 116.94 125.09 1s00 h PHE 20 Ca 0.19 0.00 -0.29 0.00 3.53 0.00 0.00 57.97 61.41 1s00 h PHE 20 Cb 0.43 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1s00 h PHE 20 CO 0.03 0.00 -1.44 -1.49 -2.23 0.00 0.00 178.31 173.18 1s00 h TRP 21 N 0.00 0.36 0.00 0.41 4.06 -1.37 0.30 115.95 119.72 1s00 h TRP 21 Ca 0.13 -0.26 -0.02 0.00 2.06 0.00 0.00 58.89 60.80 1s00 h TRP 21 Cb 0.53 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.67 1s00 h TRP 21 CO 0.00 1.29 -0.08 0.82 -3.56 0.00 0.00 178.44 176.91 1s00 h ILE 22 N 0.05 0.76 0.00 1.49 1.08 -1.04 -0.09 117.51 119.77 1s00 h ILE 22 Ca -0.20 -0.31 -0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1s00 h ILE 22 Cb 1.98 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 36.91 1s00 h ILE 22 CO 0.16 0.08 -0.15 0.15 -0.69 0.00 0.00 178.15 177.69 1s00 h PHE 23 N 0.00 0.00 -0.88 1.37 3.57 -0.85 -3.06 116.94 117.09 1s00 h PHE 23 Ca -0.00 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.73 1s00 h PHE 23 Cb 0.17 0.00 -0.14 0.00 2.79 0.00 0.00 35.95 38.77 1s00 h PHE 23 CO 0.00 0.05 0.25 1.25 -2.23 0.00 0.00 178.31 177.64 1s00 h LEU 24 N -1.00 0.04 -0.21 0.59 5.85 -0.15 1.08 115.31 121.50 1s00 h LEU 24 Ca -0.00 0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 1s00 h LEU 24 Cb 0.19 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1s00 h LEU 24 CO -0.00 -0.14 -0.08 0.00 -0.34 0.00 0.00 178.44 177.88 1s00 h ALA 25 N 1.77 0.30 -0.74 1.25 0.00 -1.19 0.53 119.26 121.18 1s00 h ALA 25 Ca 0.55 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 55.24 1s00 h ALA 25 Cb 1.10 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 1s00 h ALA 25 CO -0.64 0.11 0.48 0.78 0.00 0.00 0.00 179.25 179.98 1s00 h GLY 26 N 0.14 1.00 0.57 0.00 0.00 -0.45 0.51 103.07 104.85 1s00 h GLY 26 Ca 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1s00 h GLY 26 CO 0.03 0.26 -0.03 -2.00 0.00 0.00 0.00 176.54 174.80 1s00 h LEU 27 N 0.83 0.07 -0.71 3.11 5.85 0.15 -1.20 115.31 123.41 1s00 h LEU 27 Ca 0.31 -0.47 0.04 0.00 0.84 0.00 0.00 57.88 58.59 1s00 h LEU 27 Cb 0.16 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.13 1s00 h LEU 27 CO -0.10 0.53 0.44 0.40 -0.34 0.00 0.00 178.44 179.37 1s00 h ILE 28 N -0.38 1.06 0.13 4.05 2.04 0.78 0.49 117.51 125.68 1s00 h ILE 28 Ca 0.01 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.59 1s00 h ILE 28 Cb 0.51 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 1s00 h ILE 28 CO 0.01 0.15 -0.25 0.22 0.00 0.00 0.00 178.15 178.27 1s00 h TYR 29 N 0.84 -0.68 -0.07 1.37 3.20 0.05 0.10 116.97 121.78 1s00 h TYR 29 Ca 0.30 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.21 1s00 h TYR 29 Cb 0.07 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.59 1s00 h TYR 29 CO -0.05 -0.36 -0.17 -0.92 -1.64 0.00 0.00 178.16 175.03 1s00 h TYR 30 N -0.47 -0.44 -0.45 -3.82 3.20 -0.43 -1.51 116.97 113.05 1s00 h TYR 30 Ca 0.03 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.98 1s00 h TYR 30 Cb 0.49 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.90 1s00 h TYR 30 CO -0.23 -0.24 0.12 -0.07 -1.64 0.00 0.00 178.16 176.10 1s00 h LEU 31 N -0.24 0.08 -0.82 2.82 3.38 0.35 -1.61 115.31 119.27 1s00 h LEU 31 Ca 0.08 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1s00 h LEU 31 Cb 0.35 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1s00 h LEU 31 CO -0.21 0.08 0.35 -0.61 0.09 0.00 0.00 178.44 178.14 1s00 h GLN 32 N 0.27 1.21 -0.14 1.13 5.75 -0.52 -2.69 115.11 120.13 1s00 h GLN 32 Ca 0.22 -0.20 -0.08 0.00 -0.15 0.00 0.00 58.65 58.43 1s00 h GLN 32 Cb 0.25 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 1s00 h GLN 32 CO -0.26 0.96 -0.28 1.79 -2.65 0.00 0.00 178.83 178.39 1s00 h THR 33 N 1.18 1.25 0.00 2.39 1.35 -0.72 -2.34 112.91 116.02 1s00 h THR 33 Ca 0.28 -1.19 -0.04 0.00 -0.55 0.00 0.00 66.41 64.90 1s00 h THR 33 Cb 0.18 1.46 -0.01 0.00 -1.73 0.00 0.00 68.15 68.05 1s00 h THR 33 CO -0.03 0.36 -0.20 -0.33 -0.25 0.00 0.00 175.52 175.07 1s00 h GLU 34 N 0.23 0.00 -0.21 4.72 4.39 -0.98 -0.79 114.58 121.94 1s00 h GLU 34 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1s00 h GLU 34 Cb 0.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1s00 h GLU 34 CO 0.04 0.20 0.00 0.09 -1.16 0.00 0.00 179.01 178.19 1s00 n ASN 35 N -3.61 1.68 0.10 1.42 3.02 -0.89 -3.30 115.26 113.68 1s00 n ASN 35 Ca -0.01 -1.77 0.11 0.00 -0.03 0.00 0.00 54.58 52.87 1s00 n ASN 35 Cb 0.34 -0.14 -0.00 0.00 -0.61 0.00 0.00 39.78 39.37 1s00 n ASN 35 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1s00 h MET 36 N 2.12 0.00 0.00 3.52 2.86 -1.00 -3.37 114.93 119.07 1s00 h MET 36 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1s00 h MET 36 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1s00 h MET 36 CO 0.00 0.01 0.21 0.54 1.06 0.00 0.00 176.91 178.74 1s00 n ARG 37 N -2.69 0.01 -3.72 1.72 1.74 -1.21 -4.07 116.66 108.43 1s00 n ARG 37 Ca -0.00 0.34 -0.13 0.00 -0.77 0.00 0.00 57.85 57.29 1s00 n ARG 37 Cb 0.56 -1.75 -0.10 0.00 -1.02 0.00 0.00 32.46 30.15 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 -2.70 0.46 0.00 5.56 2.02 -1.26 -3.97 118.70 118.82 1s00 s GLU 38 Ca -0.00 0.62 0.00 0.00 0.02 0.00 0.00 54.97 55.61 1s00 s GLU 38 Cb 0.01 0.18 0.00 0.00 0.10 0.00 0.00 34.13 34.41 1s00 s GLU 38 CO 0.02 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.63 1s00 n GLY 39 N 3.17 1.27 3.65 -1.39 0.00 -1.26 -5.05 105.19 105.57 1s00 n GLY 39 Ca -0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.32 2.81 0.76 1.61 1.51 -1.26 -4.39 117.35 116.07 1s00 s TYR 40 Ca 0.00 -0.15 -0.12 0.00 -1.01 0.00 0.00 57.07 55.79 1s00 s TYR 40 Cb 0.00 -1.36 0.06 0.00 -0.11 0.00 0.00 41.96 40.55 1s00 s TYR 40 CO 0.00 0.52 1.12 -2.14 -1.11 0.00 0.00 175.55 173.94 1s00 s PRO 41 N -2.93 2.16 0.15 -1.71 0.02 -1.26 -4.72 135.00 126.70 1s00 s PRO 41 Ca 0.27 1.37 -0.30 0.00 0.02 0.00 0.00 61.00 62.36 1s00 s PRO 41 Cb -0.09 -1.87 -0.07 0.00 0.02 0.00 0.00 34.50 32.49 1s00 s PRO 41 CO 0.18 -1.75 1.15 -0.51 -0.33 0.00 0.00 177.00 175.74 1s00 s LEU 42 N -5.67 4.45 0.28 -5.54 1.43 -1.26 -4.95 118.68 107.41 1s00 s LEU 42 Ca 0.65 2.10 0.08 0.00 -1.03 0.00 0.00 54.13 55.93 1s00 s LEU 42 Cb -0.21 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.38 1s00 s LEU 42 CO 0.51 -0.32 0.16 -1.61 0.23 0.00 0.00 176.35 175.32 1s00 s GLU 43 N 0.03 2.70 0.55 1.70 2.02 -1.26 -0.36 118.70 124.08 1s00 s GLU 43 Ca 0.53 -1.22 -0.07 0.00 0.02 0.00 0.00 54.97 54.23 1s00 s GLU 43 Cb -0.30 -2.43 -0.03 0.00 0.10 0.00 0.00 34.13 31.48 1s00 s GLU 43 CO 0.34 0.32 0.88 -0.80 0.02 0.00 0.00 175.26 176.02 1s00 s ASN 44 N -3.83 6.08 0.00 -0.19 0.01 0.12 -4.60 114.94 112.53 1s00 s ASN 44 Ca 0.34 1.01 0.00 0.00 -0.71 0.00 0.00 52.86 53.50 1s00 s ASN 44 Cb -0.07 -2.18 0.00 0.00 0.41 0.00 0.00 41.25 39.42 1s00 s ASN 44 CO 0.24 -0.78 0.00 -0.62 -1.51 0.00 0.00 177.10 174.42 1s00 n GLU 45 N -2.48 0.00 0.00 -0.60 1.02 -1.26 -0.32 120.64 117.00 1s00 n GLU 45 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1s00 n GLU 45 Cb 0.55 -0.95 0.00 0.00 -0.02 0.00 0.00 31.44 31.03 1s00 n GLU 45 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1s00 n ASP 46 N 0.04 0.21 0.00 1.62 5.75 -1.26 -5.00 116.55 117.91 1s00 n ASP 46 Ca 0.00 -0.55 0.00 0.00 -0.01 0.00 0.00 54.79 54.23 1s00 n ASP 46 Cb 0.00 0.37 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 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 0.37 1.67 3.82 6.12 0.00 0.57 -5.09 105.19 112.64 1s00 n GLY 47 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.27 4.49 -0.27 2.61 -4.23 -1.26 -4.73 115.64 109.98 1s00 s THR 48 Ca 0.00 1.35 -0.31 0.00 -1.18 0.00 0.00 61.69 61.56 1s00 s THR 48 Cb 0.00 -3.80 -0.07 0.00 1.34 0.00 0.00 72.50 69.96 1s00 s THR 48 CO 0.00 0.04 2.22 -2.65 -0.54 0.00 0.00 174.62 173.69 1s00 n PRO 49 N 0.27 1.63 -0.80 3.99 -0.02 -1.26 0.12 135.00 138.93 1s00 n PRO 49 Ca 0.01 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.60 1s00 n PRO 49 Cb 0.52 -2.97 0.12 0.00 -0.02 0.00 0.00 33.50 31.15 1s00 n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s00 n ALA 50 N 11.18 -2.59 0.05 3.55 0.00 0.51 -4.81 120.51 128.40 1s00 n ALA 50 Ca 0.34 -0.61 -0.10 0.00 0.00 0.00 0.00 53.44 53.08 1s00 n ALA 50 Cb 0.37 -1.80 -0.07 0.00 0.00 0.00 0.00 19.45 17.95 1s00 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s00 h ALA 51 N -1.56 -0.21 -1.91 0.00 0.00 -1.91 -3.43 119.26 110.24 1s00 h ALA 51 Ca -0.43 -0.22 -0.57 0.00 0.00 0.00 0.00 54.91 53.69 1s00 h ALA 51 Cb 1.28 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 1s00 h ALA 51 CO 0.34 -0.27 0.98 1.21 0.00 0.00 0.00 179.25 181.51 1s00 s ASN 52 N -5.48 6.62 -0.14 0.00 3.84 -1.26 -4.86 114.94 113.66 1s00 s ASN 52 Ca -0.11 1.09 0.15 0.00 0.21 0.00 0.00 52.86 54.20 1s00 s ASN 52 Cb 0.00 -2.54 0.53 0.00 -0.55 0.00 0.00 41.25 38.69 1s00 s ASN 52 CO 0.42 -1.15 1.44 0.00 -2.79 0.00 0.00 177.10 175.02 1s00 n GLN 53 N 7.46 3.18 -0.54 0.43 1.13 -1.26 -4.84 117.38 122.93 1s00 n GLN 53 Ca 0.15 -2.71 0.07 0.00 -1.94 0.00 0.00 57.00 52.57 1s00 n GLN 53 Cb 0.47 -1.76 -0.04 0.00 0.11 0.00 0.00 30.24 29.02 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 -0.03 -2.83 0.54 1.08 0.00 -1.26 -4.40 105.19 98.29 1s00 n GLY 54 Ca 0.20 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1s00 n GLY 54 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1s00 n PRO 55 N -2.92 0.68 -4.24 1.61 -0.04 -1.26 -4.68 135.00 124.14 1s00 n PRO 55 Ca -0.03 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.17 1s00 n PRO 55 Cb 0.26 -1.32 -0.17 0.00 -0.04 0.00 0.00 33.50 32.23 1s00 n PRO 55 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1s00 s PHE 56 N -0.88 1.47 1.01 0.54 0.08 -1.26 -5.15 117.98 113.79 1s00 s PHE 56 Ca 0.00 -0.64 -0.16 0.00 0.12 0.00 0.00 56.93 56.25 1s00 s PHE 56 Cb 0.00 -1.14 0.21 0.00 -0.57 0.00 0.00 43.02 41.52 1s00 s PHE 56 CO 0.00 -0.39 1.26 -1.25 -0.10 0.00 0.00 175.22 174.74 1s00 s PRO 57 N 1.17 0.28 0.11 0.24 0.04 -1.26 -5.03 135.00 130.55 1s00 s PRO 57 Ca -0.05 -0.28 -0.16 0.00 0.04 0.00 0.00 61.00 60.55 1s00 s PRO 57 Cb -0.14 -1.79 -0.07 0.00 0.04 0.00 0.00 34.50 32.54 1s00 s PRO 57 CO -0.02 -2.67 0.54 -0.51 0.04 0.00 0.00 177.00 174.37 1s00 s LEU 58 N -6.13 4.41 0.68 -3.56 1.43 -1.26 -4.83 118.68 109.43 1s00 s LEU 58 Ca 0.72 1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 54.81 1s00 s LEU 58 Cb -0.06 -3.07 0.01 0.00 0.03 0.00 0.00 46.19 43.10 1s00 s LEU 58 CO 0.54 0.18 1.07 -2.16 0.23 0.00 0.00 176.35 176.21 1s00 s PRO 59 N -1.60 2.86 0.44 1.29 0.04 -1.26 -4.97 135.00 131.80 1s00 s PRO 59 Ca 0.33 1.13 -0.25 0.00 0.04 0.00 0.00 61.00 62.25 1s00 s PRO 59 Cb -0.17 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 1s00 s PRO 59 CO 0.18 -1.17 1.39 0.21 0.04 0.00 0.00 177.00 177.65 1s00 s LYS 60 N -4.62 3.76 0.47 4.56 2.20 -1.26 -4.54 119.74 120.30 1s00 s LYS 60 Ca 0.61 2.33 -0.24 0.00 -0.36 0.00 0.00 55.97 58.31 1s00 s LYS 60 Cb -0.16 -2.68 -0.07 0.00 -1.51 0.00 0.00 37.83 33.41 1s00 s LYS 60 CO 0.49 -0.72 1.35 -1.25 -0.36 0.00 0.00 175.35 174.85 1s00 s PRO 61 N -2.40 3.61 0.21 4.03 0.04 -1.26 -4.66 135.00 134.56 1s00 s PRO 61 Ca 0.60 2.24 0.11 0.00 0.04 0.00 0.00 61.00 63.99 1s00 s PRO 61 Cb -0.42 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 1s00 s PRO 61 CO 0.54 -0.82 -0.19 -1.59 0.04 0.00 0.00 177.00 174.98 1s00 s LYS 62 N -2.55 1.69 -0.14 4.56 -2.85 0.10 -4.93 119.74 115.63 1s00 s LYS 62 Ca 0.63 -1.51 -0.00 0.00 -1.00 0.00 0.00 55.97 54.09 1s00 s LYS 62 Cb -0.40 -1.91 0.03 0.00 -2.06 0.00 0.00 37.83 33.49 1s00 s LYS 62 CO 0.50 0.39 -0.08 0.99 0.10 0.00 0.00 175.35 177.25 1s00 s THR 63 N -1.84 1.18 0.01 3.79 2.01 -1.26 -1.22 115.64 118.31 1s00 s THR 63 Ca 0.24 -0.49 -0.25 0.00 0.31 0.00 0.00 61.69 61.49 1s00 s THR 63 Cb -0.08 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.16 1s00 s THR 63 CO 0.12 0.30 0.77 -0.36 -0.69 0.00 0.00 174.62 174.76 1s00 s PHE 64 N 1.63 3.69 -0.92 4.92 0.08 -0.16 -4.90 117.98 122.32 1s00 s PHE 64 Ca 0.03 1.44 -0.18 0.00 0.12 0.00 0.00 56.93 58.34 1s00 s PHE 64 Cb -0.14 -2.84 0.14 0.00 -0.57 0.00 0.00 43.02 39.61 1s00 s PHE 64 CO -0.08 0.20 1.08 0.42 -0.10 0.00 0.00 175.22 176.74 1s00 s ILE 65 N 0.26 4.85 0.20 0.64 1.01 -1.26 -1.46 121.20 125.44 1s00 s ILE 65 Ca 0.40 -1.71 -0.28 0.00 0.00 0.00 0.00 60.65 59.06 1s00 s ILE 65 Cb -0.20 -4.74 -0.17 0.00 0.01 0.00 0.00 42.46 37.36 1s00 s ILE 65 CO 0.22 -1.45 0.53 0.18 0.00 0.00 0.00 174.94 174.43 1s00 n LEU 66 N 6.20 -1.18 -4.73 2.97 7.99 -0.58 -4.92 117.00 122.74 1s00 n LEU 66 Ca 0.23 1.13 -0.31 0.00 -0.01 0.00 0.00 56.01 57.05 1s00 n LEU 66 Cb 0.49 -0.96 0.12 0.00 -0.11 0.00 0.00 43.42 42.96 1s00 n LEU 66 CO 0.48 -2.95 0.68 -2.84 -1.51 0.00 0.00 177.39 171.26 1s00 s PRO 67 N -1.00 1.74 -1.61 3.23 0.02 -1.26 -3.74 135.00 132.38 1s00 s PRO 67 Ca 0.64 1.15 -0.15 0.00 0.02 0.00 0.00 61.00 62.67 1s00 s PRO 67 Cb -0.93 -1.84 0.12 0.00 0.02 0.00 0.00 34.50 31.87 1s00 s PRO 67 CO 0.56 -2.00 0.81 0.72 -0.33 0.00 0.00 177.00 176.76 1s00 n HIS 68 N -3.76 -1.91 -0.92 6.54 8.25 -1.26 -1.55 115.22 120.61 1s00 n HIS 68 Ca 0.09 0.83 -0.05 0.00 -0.26 0.00 0.00 57.72 58.33 1s00 n HIS 68 Cb 0.53 -3.38 -0.02 0.00 1.12 0.00 0.00 29.99 28.24 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 -1.56 0.47 0.42 -1.41 0.00 -1.25 -4.80 105.19 97.06 1s00 n GLY 69 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.25 0.28 0.00 1.61 1.74 -0.59 -4.92 116.66 114.53 1s00 n ARG 70 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1s00 n ARG 70 Cb 0.37 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 1s00 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s00 n GLY 71 N 0.27 0.18 3.24 -0.13 0.00 -1.26 -4.90 105.19 102.59 1s00 n GLY 71 Ca 0.00 -1.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 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 0.00 0.05 -0.18 2.61 -4.23 -1.26 -1.53 115.64 111.11 1s00 s THR 72 Ca 0.00 -0.45 0.01 0.00 -1.18 0.00 0.00 61.69 60.06 1s00 s THR 72 Cb 0.00 -0.62 0.03 0.00 1.34 0.00 0.00 72.50 73.25 1s00 s THR 72 CO 0.00 -0.25 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.47 1s00 s LEU 73 N -1.29 2.07 -0.19 4.79 1.98 -0.53 -4.91 118.68 120.60 1s00 s LEU 73 Ca -0.13 -0.70 -0.07 0.00 -2.89 0.00 0.00 54.13 50.33 1s00 s LEU 73 Cb -0.05 -1.28 -0.04 0.00 0.66 0.00 0.00 46.19 45.48 1s00 s LEU 73 CO 0.04 -0.08 0.06 -0.89 -1.89 0.00 0.00 176.35 173.59 1s00 s THR 74 N 1.40 4.71 0.02 3.68 2.01 -1.26 -0.99 115.64 125.21 1s00 s THR 74 Ca 0.02 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 61.97 1s00 s THR 74 Cb -0.14 -3.13 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 1s00 s THR 74 CO -0.10 0.45 -0.04 0.68 -0.69 0.00 0.00 174.62 174.92 1s00 s VAL 75 N 0.46 0.21 0.79 3.82 -7.23 -0.36 -4.01 120.40 114.08 1s00 s VAL 75 Ca 0.03 -0.76 -0.11 0.00 -1.81 0.00 0.00 61.98 59.33 1s00 s VAL 75 Cb -0.13 -0.30 0.07 0.00 0.56 0.00 0.00 36.38 36.58 1s00 s VAL 75 CO 0.01 -0.36 1.11 -2.16 -0.31 0.00 0.00 175.10 173.39 1s00 s PRO 76 N -1.17 2.06 0.23 4.82 0.04 -1.25 0.03 135.00 139.75 1s00 s PRO 76 Ca -0.11 1.29 -0.04 0.00 0.04 0.00 0.00 61.00 62.17 1s00 s PRO 76 Cb -0.08 -1.87 0.02 0.00 0.04 0.00 0.00 34.50 32.61 1s00 s PRO 76 CO -0.00 -1.81 0.38 0.41 0.04 0.00 0.00 177.00 176.01 1s00 n GLY 77 N -0.81 2.08 2.29 0.56 0.00 -1.26 -4.81 105.19 103.24 1s00 n GLY 77 Ca 0.10 -1.40 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 1s00 n GLY 77 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s00 n PRO 78 N -0.36 -3.24 -3.00 1.61 -0.02 -1.26 -4.83 135.00 123.90 1s00 n PRO 78 Ca -0.02 -1.10 -0.43 0.00 -2.02 0.00 0.00 63.50 59.93 1s00 n PRO 78 Cb 0.38 -1.21 -0.06 0.00 -0.02 0.00 0.00 33.50 32.59 1s00 n PRO 78 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1s00 s GLU 79 N -4.56 3.40 0.40 -0.52 0.41 -1.26 -4.90 118.70 111.68 1s00 s GLU 79 Ca 0.47 -0.14 0.28 0.00 -0.41 0.00 0.00 54.97 55.18 1s00 s GLU 79 Cb -0.06 -3.93 1.37 0.00 -1.78 0.00 0.00 34.13 29.72 1s00 s GLU 79 CO 0.38 -1.08 1.86 0.66 -0.49 0.00 0.00 175.26 176.59 1s00 h SER 80 N 8.93 0.00 -2.94 -0.19 4.64 -1.98 -3.40 113.55 118.61 1s00 h SER 80 Ca -0.25 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.48 1s00 h SER 80 Cb 1.09 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.07 1s00 h SER 80 CO 0.94 0.00 0.72 -0.70 -0.87 0.00 0.00 176.83 176.92 1s00 s GLU 81 N -3.60 3.29 0.00 4.77 2.12 -1.26 -4.77 118.70 119.25 1s00 s GLU 81 Ca -0.00 -0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.04 1s00 s GLU 81 Cb 0.09 -4.10 0.00 0.00 0.26 0.00 0.00 34.13 30.37 1s00 s GLU 81 CO 0.36 -1.70 0.40 -0.40 -0.54 0.00 0.00 175.26 173.37 1s00 n ASP 82 N 8.01 0.79 -4.75 -1.70 5.68 -1.26 -5.05 116.55 118.27 1s00 n ASP 82 Ca 0.02 -0.93 -0.35 0.00 -0.50 0.00 0.00 54.79 53.03 1s00 n ASP 82 Cb 0.48 0.11 0.05 0.00 -1.14 0.00 0.00 41.12 40.62 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 -0.11 2.74 0.42 0.11 1.70 -1.26 -4.98 118.95 117.57 1s00 s ARG 83 Ca 0.00 1.68 -0.24 0.00 -0.47 0.00 0.00 55.73 56.70 1s00 s ARG 83 Cb 0.00 -1.92 -0.08 0.00 -0.57 0.00 0.00 34.95 32.38 1s00 s ARG 83 CO 0.00 -1.35 1.13 -2.14 -1.08 0.00 0.00 175.30 171.86 1s00 s PRO 84 N -3.67 3.98 -0.32 3.89 0.02 -1.26 -5.03 135.00 132.60 1s00 s PRO 84 Ca 0.74 1.73 -0.05 0.00 0.02 0.00 0.00 61.00 63.44 1s00 s PRO 84 Cb -0.27 -2.54 0.04 0.00 0.02 0.00 0.00 34.50 31.75 1s00 s PRO 84 CO 0.38 -0.36 0.06 0.42 -0.33 0.00 0.00 177.00 177.17 1s00 s ILE 85 N -1.53 3.47 -0.72 2.83 -1.09 -1.26 -5.01 121.20 117.88 1s00 s ILE 85 Ca 0.60 -1.22 -0.05 0.00 -2.23 0.00 0.00 60.65 57.74 1s00 s ILE 85 Cb -0.28 -2.97 -0.08 0.00 -1.58 0.00 0.00 42.46 37.56 1s00 s ILE 85 CO 0.34 -0.14 2.25 0.00 -1.23 0.00 0.00 174.94 176.16 1s00 n ALA 86 N 4.74 4.80 -2.35 9.38 0.00 -1.26 -4.81 120.51 131.01 1s00 n ALA 86 Ca -0.13 -1.87 -0.10 0.00 0.00 0.00 0.00 53.44 51.34 1s00 n ALA 86 Cb 0.44 -2.84 -0.10 0.00 0.00 0.00 0.00 19.45 16.95 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 0.08 2.43 0.02 0.00 1.43 -1.26 -0.20 118.68 121.17 1s00 s LEU 87 Ca 0.42 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1s00 s LEU 87 Cb 0.13 -0.01 -0.01 0.00 0.03 0.00 0.00 46.19 46.32 1s00 s LEU 87 CO -0.03 -0.43 -0.03 0.00 0.23 0.00 0.00 176.35 176.09 1s00 s ALA 88 N -3.07 0.16 1.10 4.21 0.00 -0.64 -4.84 121.76 118.68 1s00 s ALA 88 Ca 0.04 -0.42 -0.20 0.00 0.00 0.00 0.00 51.96 51.38 1s00 s ALA 88 Cb 0.02 0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.29 1s00 s ALA 88 CO -0.05 -0.08 -0.16 0.54 0.00 0.00 0.00 175.76 176.01 1s00 n ARG 89 N 2.08 -1.40 0.00 0.00 1.74 -1.26 -2.42 116.66 115.40 1s00 n ARG 89 Ca -0.20 -0.39 0.00 0.00 -0.77 0.00 0.00 57.85 56.49 1s00 n ARG 89 Cb 0.57 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 1s00 n ARG 89 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1s00 n THR 90 N -4.30 0.08 -3.55 0.55 5.66 -1.22 -4.61 114.28 106.89 1s00 n THR 90 Ca 0.00 -0.10 -0.09 0.00 -3.05 0.00 0.00 64.05 60.81 1s00 n THR 90 Cb 0.64 1.19 -0.04 0.00 -1.55 0.00 0.00 70.33 70.57 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 -0.08 -1.89 0.17 1.79 0.00 -1.26 -5.02 121.76 115.46 1s00 s ALA 91 Ca 0.00 1.34 0.14 0.00 0.00 0.00 0.00 51.96 53.45 1s00 s ALA 91 Cb 0.00 -0.18 0.43 0.00 0.00 0.00 0.00 23.12 23.37 1s00 s ALA 91 CO 0.00 -0.49 1.62 0.28 0.00 0.00 0.00 175.76 177.17 1s00 h VAL 92 N 2.29 1.15 -3.92 0.00 2.07 -2.01 -3.44 116.25 112.38 1s00 h VAL 92 Ca -0.19 -1.97 -0.51 0.00 0.82 0.00 0.00 66.70 64.85 1s00 h VAL 92 Cb 1.20 2.14 0.06 0.00 -1.52 0.00 0.00 31.29 33.16 1s00 h VAL 92 CO 0.31 0.52 0.54 -0.55 0.02 0.00 0.00 177.57 178.41 1s00 s SER 93 N -6.60 6.57 0.75 0.57 0.15 -1.26 -5.02 113.70 108.86 1s00 s SER 93 Ca 0.00 2.45 -0.11 0.00 0.70 0.00 0.00 55.95 59.00 1s00 s SER 93 Cb 0.11 -2.63 0.04 0.00 -1.71 0.00 0.00 66.02 61.84 1s00 s SER 93 CO 0.73 -0.65 1.08 -1.61 1.20 0.00 0.00 173.24 173.99 1s00 s GLU 94 N -2.14 2.48 -0.71 5.44 0.41 -1.26 -4.14 118.70 118.77 1s00 s GLU 94 Ca 0.55 0.87 0.00 0.00 -0.41 0.00 0.00 54.97 55.98 1s00 s GLU 94 Cb -0.34 -1.94 0.00 0.00 -1.78 0.00 0.00 34.13 30.07 1s00 s GLU 94 CO 0.43 -1.40 0.00 0.41 -0.49 0.00 0.00 175.26 174.21 1s00 n GLY 95 N -1.88 0.23 3.63 -1.39 0.00 -1.26 -5.04 105.19 99.48 1s00 n GLY 95 Ca 0.08 -0.58 -0.23 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.38 2.61 1.16 1.61 0.08 -1.26 -5.11 117.98 114.69 1s00 s PHE 96 Ca 0.00 -0.30 -0.16 0.00 0.12 0.00 0.00 56.93 56.59 1s00 s PHE 96 Cb 0.00 -1.28 0.20 0.00 -0.57 0.00 0.00 43.02 41.37 1s00 s PHE 96 CO 0.00 0.57 0.48 -2.30 -0.10 0.00 0.00 175.22 173.87 1s00 n PRO 97 N -0.90 -2.12 -3.59 0.24 -0.02 -1.26 -4.84 135.00 122.51 1s00 n PRO 97 Ca -0.05 -0.60 -0.29 0.00 -2.02 0.00 0.00 63.50 60.54 1s00 n PRO 97 Cb 0.60 -1.92 -0.14 0.00 -0.02 0.00 0.00 33.50 32.03 1s00 n PRO 97 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1s00 s HIS 98 N -2.31 1.02 0.65 6.00 3.76 -1.26 -3.38 115.29 119.77 1s00 s HIS 98 Ca 0.62 -1.52 -0.17 0.00 -0.15 0.00 0.00 55.06 53.84 1s00 s HIS 98 Cb -0.18 -1.26 -0.00 0.00 1.11 0.00 0.00 32.58 32.25 1s00 s HIS 98 CO 0.66 -0.84 1.21 0.00 -0.85 0.00 0.00 174.74 174.92 1s00 s ALA 99 N 1.46 2.37 0.08 -1.40 0.00 -1.01 -4.52 121.76 118.73 1s00 s ALA 99 Ca 0.13 0.95 -0.31 0.00 0.00 0.00 0.00 51.96 52.73 1s00 s ALA 99 Cb -0.19 -3.46 -0.07 0.00 0.00 0.00 0.00 23.12 19.40 1s00 s ALA 99 CO -0.19 -1.47 1.39 -2.14 0.00 0.00 0.00 175.76 173.36 1s00 s PRO 100 N -3.60 4.31 0.13 0.00 0.02 -1.26 -1.62 135.00 132.98 1s00 s PRO 100 Ca 0.76 2.03 -0.12 0.00 0.02 0.00 0.00 61.00 63.70 1s00 s PRO 100 Cb -0.30 -3.36 -0.07 0.00 0.02 0.00 0.00 34.50 30.79 1s00 s PRO 100 CO 0.39 -0.48 1.43 1.79 -0.33 0.00 0.00 177.00 179.80 1s00 h THR 101 N 4.49 1.27 -0.08 0.99 1.35 -0.91 -3.47 112.91 116.55 1s00 h THR 101 Ca -0.41 -1.64 0.00 0.00 -0.55 0.00 0.00 66.41 63.81 1s00 h THR 101 Cb 1.20 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 1s00 h THR 101 CO 0.87 0.54 0.00 0.61 -0.25 0.00 0.00 175.52 177.30 1s00 n GLY 102 N 0.26 5.21 3.54 5.82 0.00 -1.26 -5.05 105.19 113.72 1s00 n GLY 102 Ca -0.03 -1.59 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 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 6.41 0.29 1.61 2.15 -1.26 -4.92 116.67 121.95 1s00 s ASP 103 Ca 0.00 -0.13 0.03 0.00 0.43 0.00 0.00 52.55 52.88 1s00 s ASP 103 Cb 0.00 -2.44 0.63 0.00 -0.30 0.00 0.00 42.92 40.81 1s00 s ASP 103 CO 0.00 -1.14 1.80 1.55 -0.17 0.00 0.00 175.17 177.21 1s00 h PRO 104 N 9.20 0.83 -0.66 4.34 0.13 -1.92 0.19 132.00 144.11 1s00 h PRO 104 Ca -0.25 -0.05 0.14 0.00 -0.87 0.00 0.00 66.00 64.97 1s00 h PRO 104 Cb 1.07 -0.19 -0.11 0.00 0.13 0.00 0.00 31.00 31.91 1s00 h PRO 104 CO 1.06 0.55 0.04 0.52 -0.23 0.00 0.00 178.00 179.94 1s00 h MET 105 N 0.85 0.15 0.00 0.86 2.86 -1.91 0.42 114.93 118.16 1s00 h MET 105 Ca 0.53 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.99 1s00 h MET 105 Cb 0.69 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.29 1s00 h MET 105 CO -0.33 0.10 -1.30 0.87 1.06 0.00 0.00 176.91 177.30 1s00 h LYS 106 N 0.15 0.00 0.00 1.72 1.57 -1.74 -3.32 116.57 114.95 1s00 h LYS 106 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1s00 h LYS 106 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1s00 h LYS 106 CO -0.54 0.35 0.00 -0.25 -0.57 0.00 0.00 179.45 178.44 1s00 n ASP 107 N -2.96 0.38 -2.89 0.86 8.00 0.60 -4.93 116.55 115.60 1s00 n ASP 107 Ca -0.08 0.55 -0.15 0.00 0.71 0.00 0.00 54.79 55.82 1s00 n ASP 107 Cb 0.84 -0.65 0.07 0.00 -0.02 0.00 0.00 41.12 41.36 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 0.88 -0.19 3.30 0.44 0.00 0.06 -4.59 105.19 105.09 1s00 n GLY 108 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.27 1.68 0.00 1.61 -7.23 -1.18 -3.87 120.40 108.14 1s00 s VAL 109 Ca 0.18 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 1s00 s VAL 109 Cb -0.08 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 35.15 1s00 s VAL 109 CO 0.57 -0.29 0.00 0.61 -0.31 0.00 0.00 175.10 175.67 1s00 n GLY 110 N 0.50 1.65 0.22 2.32 0.00 -1.26 -2.68 105.19 105.94 1s00 n GLY 110 Ca -0.15 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.37 1s00 n GLY 110 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1s00 h PRO 111 N 0.00 0.00 -0.61 1.61 0.11 -1.92 0.16 132.00 131.35 1s00 h PRO 111 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1s00 h PRO 111 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1s00 h PRO 111 CO 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 1s00 n ALA 112 N -1.75 2.58 -1.74 -0.75 0.00 -1.09 -2.41 120.51 115.35 1s00 n ALA 112 Ca -0.02 -1.41 -0.37 0.00 0.00 0.00 0.00 53.44 51.65 1s00 n ALA 112 Cb 0.23 -0.84 0.06 0.00 0.00 0.00 0.00 19.45 18.89 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 -1.02 4.77 0.09 0.00 0.01 0.55 -4.07 113.70 114.03 1s00 s SER 113 Ca 0.44 2.57 -0.03 0.00 1.31 0.00 0.00 55.95 60.24 1s00 s SER 113 Cb 0.25 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.84 1s00 s SER 113 CO 0.26 -1.89 0.05 -1.66 0.41 0.00 0.00 173.24 170.42 1s00 s TRP 114 N -1.44 0.57 0.06 2.43 1.48 -1.25 -4.25 118.94 116.53 1s00 s TRP 114 Ca 0.81 -1.03 0.06 0.00 -1.06 0.00 0.00 56.10 54.88 1s00 s TRP 114 Cb -0.36 -0.35 -0.04 0.00 -1.16 0.00 0.00 33.47 31.57 1s00 s TRP 114 CO 0.38 -0.48 -0.12 0.08 -4.06 0.00 0.00 176.95 172.76 1s00 s VAL 115 N -3.96 3.26 -1.16 -0.66 1.01 -1.26 -5.02 120.40 112.61 1s00 s VAL 115 Ca 0.13 -1.12 -0.21 0.00 0.00 0.00 0.00 61.98 60.78 1s00 s VAL 115 Cb 0.07 -2.45 -0.00 0.00 0.00 0.00 0.00 36.38 33.99 1s00 s VAL 115 CO -0.05 0.25 1.79 0.00 0.00 0.00 0.00 175.10 177.08 1s00 s ALA 116 N -1.07 2.49 0.26 5.51 0.00 -1.26 -4.83 121.76 122.86 1s00 s ALA 116 Ca 0.18 -2.37 0.01 0.00 0.00 0.00 0.00 51.96 49.78 1s00 s ALA 116 Cb -0.11 -4.63 -0.04 0.00 0.00 0.00 0.00 23.12 18.35 1s00 s ALA 116 CO 0.09 -4.20 0.44 1.03 0.00 0.00 0.00 175.76 173.12 1s00 s ARG 117 N 5.47 3.49 0.02 0.00 0.52 -1.26 -4.95 118.95 122.24 1s00 s ARG 117 Ca 0.60 -0.45 -0.39 0.00 -0.52 0.00 0.00 55.73 54.97 1s00 s ARG 117 Cb 0.00 -2.79 -0.18 0.00 0.52 0.00 0.00 34.95 32.50 1s00 s ARG 117 CO 0.06 0.32 1.23 -2.13 0.02 0.00 0.00 175.30 174.80 1s00 n ARG 118 N -1.25 0.58 -1.74 3.54 0.63 -1.26 -4.03 116.66 113.13 1s00 n ARG 118 Ca -0.06 0.21 -0.39 0.00 -0.92 0.00 0.00 57.85 56.69 1s00 n ARG 118 Cb 0.55 -1.78 -0.02 0.00 0.45 0.00 0.00 32.46 31.67 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 2.17 8.28 -3.93 6.15 2.03 -1.26 -2.61 116.55 127.37 1s00 n ASP 119 Ca 0.20 -2.94 -0.09 0.00 0.52 0.00 0.00 54.79 52.48 1s00 n ASP 119 Cb 0.13 -1.43 -0.07 0.00 -0.72 0.00 0.00 41.12 39.03 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 -1.31 1.16 0.38 -2.67 1.43 -1.26 -4.94 118.68 111.47 1s00 s LEU 120 Ca 0.60 -0.81 -0.23 0.00 -1.03 0.00 0.00 54.13 52.66 1s00 s LEU 120 Cb 0.19 1.09 -0.10 0.00 0.03 0.00 0.00 46.19 47.40 1s00 s LEU 120 CO -0.08 -0.83 0.94 -2.16 0.23 0.00 0.00 176.35 174.45 1s00 s PRO 121 N -3.93 4.38 0.21 1.29 0.04 -1.26 -1.12 135.00 134.60 1s00 s PRO 121 Ca 0.13 1.20 -0.30 0.00 0.04 0.00 0.00 61.00 62.07 1s00 s PRO 121 Cb 0.04 -2.45 -0.09 0.00 0.04 0.00 0.00 34.50 32.04 1s00 s PRO 121 CO -0.04 0.11 1.31 -2.00 0.04 0.00 0.00 177.00 176.42 1s00 s GLU 122 N -2.69 4.39 -0.31 4.56 2.56 -1.26 -4.88 118.70 121.06 1s00 s GLU 122 Ca 0.57 2.07 -0.12 0.00 0.00 0.00 0.00 54.97 57.49 1s00 s GLU 122 Cb -0.13 -3.18 -0.03 0.00 2.00 0.00 0.00 34.13 32.79 1s00 s GLU 122 CO 0.18 -0.25 0.20 -1.17 -0.56 0.00 0.00 175.26 173.67 1s00 s LEU 123 N -0.26 4.26 0.00 2.70 2.96 -1.26 0.13 118.68 127.22 1s00 s LEU 123 Ca 0.56 -0.31 -0.15 0.00 -0.22 0.00 0.00 54.13 54.01 1s00 s LEU 123 Cb -0.37 -2.10 0.24 0.00 0.50 0.00 0.00 46.19 44.46 1s00 s LEU 123 CO 0.39 -0.16 0.53 -0.90 -1.32 0.00 0.00 176.35 174.89 1s00 n ASP 124 N 5.07 -3.29 -0.00 3.68 5.75 0.30 -4.72 116.55 123.33 1s00 n ASP 124 Ca -0.13 -0.54 0.08 0.00 -0.01 0.00 0.00 54.79 54.19 1s00 n ASP 124 Cb 0.50 -0.66 0.49 0.00 -1.03 0.00 0.00 41.12 40.43 1s00 n ASP 124 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1s00 h GLY 125 N -2.68 0.48 -1.54 6.12 0.00 -1.99 -2.26 103.07 101.21 1s00 h GLY 125 Ca -0.24 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1s00 h GLY 125 CO 0.15 0.13 0.00 1.42 0.00 0.00 0.00 176.54 178.24 1s00 n HIS 126 N -4.48 0.56 -0.76 5.60 8.25 -1.26 -4.91 115.22 118.23 1s00 n HIS 126 Ca 0.05 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.23 1s00 n HIS 126 Cb 0.21 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.32 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 1.16 0.63 3.89 -1.41 0.00 -0.85 -5.05 105.19 103.55 1s00 n GLY 127 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.02 3.36 0.06 1.61 3.76 -1.26 -4.80 115.29 116.00 1s00 s HIS 128 Ca 0.00 0.07 -0.35 0.00 -0.15 0.00 0.00 55.06 54.63 1s00 s HIS 128 Cb 0.00 -1.61 -0.14 0.00 1.11 0.00 0.00 32.58 31.93 1s00 s HIS 128 CO 0.00 0.52 1.59 0.09 -0.85 0.00 0.00 174.74 176.09 1s00 n ASN 129 N -0.42 2.77 -0.15 1.40 4.13 -1.26 0.11 115.26 121.83 1s00 n ASN 129 Ca -0.07 1.07 -0.07 0.00 1.68 0.00 0.00 54.58 57.19 1s00 n ASN 129 Cb 0.54 -1.34 0.02 0.00 -1.54 0.00 0.00 39.78 37.46 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 6.30 0.55 -5.90 3.52 3.64 0.80 -3.42 116.57 122.06 1s00 h LYS 130 Ca -0.46 -0.03 -0.68 0.00 -1.27 0.00 0.00 60.65 58.21 1s00 h LYS 130 Cb 1.28 -0.12 -0.13 0.00 -0.41 0.00 0.00 32.23 32.85 1s00 h LYS 130 CO 0.88 0.36 -0.59 0.42 -2.27 0.00 0.00 179.45 178.26 1s00 s ILE 131 N -6.15 4.62 -0.01 2.00 1.01 -1.26 -0.96 121.20 120.45 1s00 s ILE 131 Ca -0.13 -0.15 -0.15 0.00 0.00 0.00 0.00 60.65 60.22 1s00 s ILE 131 Cb 0.12 -2.97 0.02 0.00 0.01 0.00 0.00 42.46 39.64 1s00 s ILE 131 CO 0.73 0.59 0.31 -0.54 0.00 0.00 0.00 174.94 176.03 1s00 s LYS 132 N -0.98 0.68 0.46 2.79 1.02 -0.47 -4.77 119.74 118.47 1s00 s LYS 132 Ca 0.14 -0.22 -0.22 0.00 0.02 0.00 0.00 55.97 55.69 1s00 s LYS 132 Cb -0.12 0.30 -0.08 0.00 -0.52 0.00 0.00 37.83 37.42 1s00 s LYS 132 CO 0.04 -0.19 1.11 -2.14 -0.92 0.00 0.00 175.35 173.25 1s00 s PRO 133 N -1.44 3.80 0.40 -1.68 0.02 -1.26 -0.07 135.00 134.76 1s00 s PRO 133 Ca -0.13 1.62 0.16 0.00 0.02 0.00 0.00 61.00 62.67 1s00 s PRO 133 Cb -0.05 -2.33 1.04 0.00 0.02 0.00 0.00 34.50 33.19 1s00 s PRO 133 CO 0.04 -0.48 1.84 0.52 -0.33 0.00 0.00 177.00 178.59 1s00 h MET 134 N 1.94 0.44 -0.58 5.54 2.86 -0.60 0.06 114.93 124.59 1s00 h MET 134 Ca -0.49 -0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.18 1s00 h MET 134 Cb 1.24 -0.10 -0.09 0.00 0.06 0.00 0.00 31.60 32.71 1s00 h MET 134 CO 0.60 0.29 -0.57 0.87 1.06 0.00 0.00 176.91 179.16 1s00 h LYS 135 N 0.45 -0.27 -0.01 1.72 1.57 -1.89 -0.14 116.57 118.00 1s00 h LYS 135 Ca 0.49 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 1s00 h LYS 135 Cb 1.16 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1s00 h LYS 135 CO -0.20 -0.18 0.00 0.00 -0.57 0.00 0.00 179.45 178.49 1s00 n ALA 136 N -3.13 2.66 -3.38 3.86 0.00 -0.13 -4.61 120.51 115.78 1s00 n ALA 136 Ca -0.02 -0.27 -0.45 0.00 0.00 0.00 0.00 53.44 52.71 1s00 n ALA 136 Cb 0.32 -1.42 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 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 -2.00 3.75 0.28 0.00 0.00 -0.07 -4.91 121.76 118.81 1s00 s ALA 137 Ca 0.45 -2.84 -0.30 0.00 0.00 0.00 0.00 51.96 49.26 1s00 s ALA 137 Cb 0.21 -3.25 -0.11 0.00 0.00 0.00 0.00 23.12 19.97 1s00 s ALA 137 CO 0.36 -2.09 1.61 0.00 0.00 0.00 0.00 175.76 175.63 1s00 s ALA 138 N 0.99 3.77 0.00 0.00 0.00 -1.26 -2.32 121.76 122.93 1s00 s ALA 138 Ca 0.09 1.56 0.00 0.00 0.00 0.00 0.00 51.96 53.61 1s00 s ALA 138 Cb -0.22 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.25 1s00 s ALA 138 CO -0.02 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.19 1s00 n GLY 139 N 2.46 2.44 3.76 0.00 0.00 -1.26 -5.01 105.19 107.58 1s00 n GLY 139 Ca 0.09 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.04 2.98 0.23 1.61 0.40 -0.98 -5.00 117.98 116.18 1s00 s PHE 140 Ca 0.00 1.24 -0.19 0.00 -0.60 0.00 0.00 56.93 57.37 1s00 s PHE 140 Cb 0.00 -3.77 0.03 0.00 0.51 0.00 0.00 43.02 39.78 1s00 s PHE 140 CO 0.00 -2.30 0.62 -3.38 0.70 0.00 0.00 175.22 170.86 1s00 s HIS 141 N -0.69 -0.16 -0.08 0.36 -3.43 -1.26 -4.96 115.29 105.08 1s00 s HIS 141 Ca 0.53 -0.21 -0.30 0.00 -0.80 0.00 0.00 55.06 54.29 1s00 s HIS 141 Cb -0.41 0.53 -0.02 0.00 -1.43 0.00 0.00 32.58 31.25 1s00 s HIS 141 CO 0.50 -1.05 1.14 0.08 -2.00 0.00 0.00 174.74 173.41 1s00 s VAL 142 N -3.89 4.43 -0.25 -5.38 1.01 -1.26 -4.90 120.40 110.16 1s00 s VAL 142 Ca 0.10 1.74 0.12 0.00 0.00 0.00 0.00 61.98 63.93 1s00 s VAL 142 Cb -0.03 -4.12 -0.16 0.00 0.00 0.00 0.00 36.38 32.08 1s00 s VAL 142 CO 0.01 -0.01 0.36 -1.54 0.00 0.00 0.00 175.10 173.92 1s00 n SER 143 N 5.18 1.52 -3.55 3.32 3.41 -1.26 -5.03 113.62 117.20 1s00 n SER 143 Ca 0.10 -0.35 -0.16 0.00 -0.26 0.00 0.00 58.87 58.21 1s00 n SER 143 Cb 0.47 1.30 -0.06 0.00 -0.26 0.00 0.00 64.21 65.65 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 -2.48 -1.81 0.00 7.33 0.00 -1.26 -5.15 121.76 118.39 1s00 s ALA 144 Ca -0.00 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.46 1s00 s ALA 144 Cb 0.08 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.83 1s00 s ALA 144 CO 0.48 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.30 1s00 n GLY 145 N 1.22 -0.65 3.66 0.00 0.00 -1.26 -4.85 105.19 103.31 1s00 n GLY 145 Ca -0.16 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 1s00 n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s00 s LYS 146 N -2.40 4.12 -0.06 1.61 2.47 -1.26 -4.92 119.74 119.30 1s00 s LYS 146 Ca 0.00 2.32 -0.30 0.00 -1.56 0.00 0.00 55.97 56.43 1s00 s LYS 146 Cb 0.00 -4.06 -0.05 0.00 -1.46 0.00 0.00 37.83 32.26 1s00 s LYS 146 CO 0.00 -0.94 1.60 1.21 0.16 0.00 0.00 175.35 177.38 1s00 s ASN 147 N 3.90 6.70 0.35 1.43 3.84 -1.26 -4.88 114.94 125.03 1s00 s ASN 147 Ca 0.79 2.17 0.14 0.00 0.21 0.00 0.00 52.86 56.18 1s00 s ASN 147 Cb -0.36 -2.54 0.66 0.00 -0.55 0.00 0.00 41.25 38.46 1s00 s ASN 147 CO 0.34 -0.90 1.77 1.55 -2.79 0.00 0.00 177.10 177.07 1s00 h PRO 148 N 9.30 0.00 -6.50 0.43 0.13 -1.97 -3.46 132.00 129.93 1s00 h PRO 148 Ca -0.38 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.16 1s00 h PRO 148 Cb 1.17 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.36 1s00 h PRO 148 CO 0.95 0.42 0.76 -0.89 -0.23 0.00 0.00 178.00 179.02 1s00 n ILE 149 N -3.89 0.07 -0.46 -3.56 5.41 -1.26 -1.74 119.36 113.94 1s00 n ILE 149 Ca -0.01 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.72 1s00 n ILE 149 Cb 0.47 -1.49 0.00 0.00 -0.71 0.00 0.00 39.64 37.91 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 3.26 0.74 3.88 7.39 0.00 0.47 -5.00 105.19 115.94 1s00 n GLY 150 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 4.28 0.29 0.99 1.43 -0.71 -4.80 118.68 120.17 1s00 s LEU 151 Ca 0.00 0.73 -0.29 0.00 -1.03 0.00 0.00 54.13 53.54 1s00 s LEU 151 Cb 0.00 -3.24 -0.09 0.00 0.03 0.00 0.00 46.19 42.89 1s00 s LEU 151 CO 0.00 0.08 1.08 -2.16 0.23 0.00 0.00 176.35 175.58 1s00 s PRO 152 N -2.38 4.59 -0.24 1.29 0.04 -1.26 -0.14 135.00 136.90 1s00 s PRO 152 Ca 0.39 1.73 -0.09 0.00 0.04 0.00 0.00 61.00 63.06 1s00 s PRO 152 Cb -0.13 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 1s00 s PRO 152 CO 0.21 0.19 0.13 0.08 0.04 0.00 0.00 177.00 177.65 1s00 s VAL 153 N -1.24 5.00 -0.02 -0.36 1.01 0.22 -1.04 120.40 123.98 1s00 s VAL 153 Ca 0.46 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.51 1s00 s VAL 153 Cb -0.30 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1s00 s VAL 153 CO 0.38 0.34 -0.02 -0.60 0.00 0.00 0.00 175.10 175.20 1s00 s ARG 154 N 1.25 2.75 0.50 2.72 3.52 0.48 0.89 118.95 131.05 1s00 s ARG 154 Ca 0.06 -0.61 0.07 0.00 -0.13 0.00 0.00 55.73 55.12 1s00 s ARG 154 Cb -0.14 -2.64 0.04 0.00 -1.56 0.00 0.00 34.95 30.65 1s00 s ARG 154 CO 0.05 0.63 0.69 0.20 -0.81 0.00 0.00 175.30 176.06 1s00 s GLY 155 N -1.38 1.87 0.51 8.12 0.00 -0.88 -0.22 107.32 115.33 1s00 s GLY 155 Ca 0.18 -1.71 0.34 0.00 0.00 0.00 0.00 44.72 43.53 1s00 s GLY 155 CO 0.08 -1.43 2.05 0.00 0.00 0.00 0.00 173.10 173.80 1s00 n ASP 157 N -2.70 0.27 0.00 0.00 5.75 -1.22 -1.44 116.55 117.20 1s00 n ASP 157 Ca -0.02 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.06 1s00 n ASP 157 Cb 0.06 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 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 -0.50 0.77 -4.88 -2.12 4.77 0.11 -4.86 117.00 110.28 1s00 n LEU 158 Ca 0.09 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.71 1s00 n LEU 158 Cb 0.08 -1.54 -0.06 0.00 -2.33 0.00 0.00 43.42 39.57 1s00 n LEU 158 CO 0.07 -0.55 -0.09 -1.61 -1.33 0.00 0.00 177.39 173.87 1s00 s GLU 159 N -1.10 3.55 0.22 3.23 0.41 -1.26 -4.83 118.70 118.92 1s00 s GLU 159 Ca 0.00 -0.07 -0.31 0.00 -0.41 0.00 0.00 54.97 54.18 1s00 s GLU 159 Cb 0.00 -3.13 -0.10 0.00 -1.78 0.00 0.00 34.13 29.12 1s00 s GLU 159 CO 0.00 0.70 1.51 0.42 -0.49 0.00 0.00 175.26 177.40 1s00 s ILE 160 N -1.19 2.57 -0.55 -1.63 1.01 -1.26 -2.08 121.20 118.06 1s00 s ILE 160 Ca 0.23 0.45 0.05 0.00 0.00 0.00 0.00 60.65 61.38 1s00 s ILE 160 Cb -0.13 -3.29 0.05 0.00 0.01 0.00 0.00 42.46 39.10 1s00 s ILE 160 CO 0.12 0.06 0.72 0.00 0.00 0.00 0.00 174.94 175.84 1s00 n ALA 161 N 2.92 2.43 0.00 9.38 0.00 0.26 -4.90 120.51 130.59 1s00 n ALA 161 Ca 0.10 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1s00 n ALA 161 Cb 0.39 -0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.68 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 0.21 -0.28 3.12 0.00 0.00 -1.16 -4.49 105.19 102.60 1s00 n GLY 162 Ca 0.03 -1.22 -0.12 0.00 0.00 0.00 0.00 46.02 44.70 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 0.40 -0.31 1.61 -2.85 -0.32 -0.61 119.74 115.66 1s00 s LYS 163 Ca 0.00 -0.02 -0.29 0.00 -1.00 0.00 0.00 55.97 54.66 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 -0.08 1.23 0.08 0.10 0.00 0.00 175.35 176.67 1s00 s VAL 164 N -0.63 4.26 -0.95 1.79 1.01 0.81 0.89 120.40 127.57 1s00 s VAL 164 Ca -0.07 1.43 0.11 0.00 0.00 0.00 0.00 61.98 63.45 1s00 s VAL 164 Cb -0.04 -4.25 0.33 0.00 0.00 0.00 0.00 36.38 32.42 1s00 s VAL 164 CO 0.01 -0.49 1.27 1.33 0.00 0.00 0.00 175.10 177.23 1s00 n VAL 165 N 6.10 1.04 0.00 2.92 0.24 0.12 0.18 118.33 128.93 1s00 n VAL 165 Ca 0.14 -1.02 0.00 0.00 -2.04 0.00 0.00 64.34 61.41 1s00 n VAL 165 Cb 0.47 0.48 0.00 0.00 -1.47 0.00 0.00 33.84 33.32 1s00 n VAL 165 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1s00 n ASP 166 N 0.54 0.00 -4.19 -1.34 2.03 -1.21 -4.93 116.55 107.45 1s00 n ASP 166 Ca 0.12 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.14 1s00 n ASP 166 Cb 0.45 0.00 -0.17 0.00 -0.72 0.00 0.00 41.12 40.68 1s00 n ASP 166 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1s00 s ILE 167 N -2.00 1.79 -0.25 5.18 1.01 -1.26 -0.57 121.20 125.10 1s00 s ILE 167 Ca 0.00 -0.90 -0.12 0.00 0.00 0.00 0.00 60.65 59.64 1s00 s ILE 167 Cb 0.00 -1.54 -0.05 0.00 0.01 0.00 0.00 42.46 40.89 1s00 s ILE 167 CO 0.00 0.50 0.23 0.26 0.00 0.00 0.00 174.94 175.93 1s00 s TRP 168 N 0.12 3.28 -0.04 3.97 0.52 0.03 0.18 118.94 127.00 1s00 s TRP 168 Ca -0.09 0.26 -0.01 0.00 0.02 0.00 0.00 56.10 56.28 1s00 s TRP 168 Cb -0.15 -2.38 -0.04 0.00 -1.15 0.00 0.00 33.47 29.76 1s00 s TRP 168 CO 0.05 -0.06 0.06 0.08 0.02 0.00 0.00 176.95 177.10 1s00 s VAL 169 N 1.46 4.64 -0.57 4.03 1.01 0.89 -0.44 120.40 131.42 1s00 s VAL 169 Ca 0.10 -0.31 -0.22 0.00 0.00 0.00 0.00 61.98 61.54 1s00 s VAL 169 Cb -0.15 -3.05 0.06 0.00 0.00 0.00 0.00 36.38 33.23 1s00 s VAL 169 CO 0.08 0.46 0.86 -0.62 0.00 0.00 0.00 175.10 175.88 1s00 s ASP 170 N -1.39 6.26 0.08 3.32 -1.08 0.23 -1.37 116.67 122.73 1s00 s ASP 170 Ca 0.19 -0.71 -0.36 0.00 -0.52 0.00 0.00 52.55 51.15 1s00 s ASP 170 Cb -0.12 -2.39 -0.18 0.00 -1.46 0.00 0.00 42.92 38.78 1s00 s ASP 170 CO 0.09 -1.20 1.56 0.40 0.52 0.00 0.00 175.17 176.54 1s00 h ILE 171 N 5.97 0.00 -0.82 4.11 1.08 -1.34 1.57 117.51 128.08 1s00 h ILE 171 Ca -0.27 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.39 1s00 h ILE 171 Cb 1.08 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.71 1s00 h ILE 171 CO 1.08 0.00 0.25 -0.65 -0.69 0.00 0.00 178.15 178.15 1s00 h PRO 172 N -1.03 0.29 0.00 2.37 0.11 -1.93 -0.07 132.00 131.75 1s00 h PRO 172 Ca -0.07 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1s00 h PRO 172 Cb 0.89 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1s00 h PRO 172 CO -0.06 0.19 -0.51 0.93 -0.21 0.00 0.00 178.00 178.34 1s00 h GLU 173 N 0.30 0.00 -6.00 1.05 4.39 -1.89 -3.47 114.58 108.97 1s00 h GLU 173 Ca 0.49 0.00 -0.41 0.00 0.34 0.00 0.00 59.36 59.78 1s00 h GLU 173 Cb 0.89 0.00 0.07 0.00 -0.10 0.00 0.00 28.75 29.62 1s00 h GLU 173 CO -0.55 0.00 -0.77 1.04 -1.16 0.00 0.00 179.01 177.57 1s00 n GLN 174 N -2.79 -6.02 -5.27 2.33 6.02 0.53 -4.97 117.38 107.20 1s00 n GLN 174 Ca 0.02 0.71 -0.31 0.00 -0.01 0.00 0.00 57.00 57.40 1s00 n GLN 174 Cb 0.53 -5.54 -0.16 0.00 1.02 0.00 0.00 30.24 26.09 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 -6.06 2.48 -0.18 -1.09 1.75 -0.82 -4.92 119.30 110.46 1s00 s MET 175 Ca 0.27 -0.91 -0.29 0.00 -1.25 0.00 0.00 55.69 53.51 1s00 s MET 175 Cb -0.13 -2.15 -0.01 0.00 2.84 0.00 0.00 34.83 35.38 1s00 s MET 175 CO 0.78 0.41 1.24 0.00 -0.65 0.00 0.00 175.02 176.81 1s00 s ALA 176 N -0.24 3.64 -0.16 4.11 0.00 -1.26 0.77 121.76 128.62 1s00 s ALA 176 Ca -0.01 0.40 0.17 0.00 0.00 0.00 0.00 51.96 52.52 1s00 s ALA 176 Cb -0.13 -3.63 -0.24 0.00 0.00 0.00 0.00 23.12 19.12 1s00 s ALA 176 CO 0.03 -1.21 0.13 0.54 0.00 0.00 0.00 175.76 175.25 1s00 n ARG 177 N 6.64 0.89 -3.90 0.00 5.12 0.42 -4.75 116.66 121.08 1s00 n ARG 177 Ca 0.14 -0.04 -0.09 0.00 -1.93 0.00 0.00 57.85 55.93 1s00 n ARG 177 Cb 0.45 -1.48 -0.08 0.00 -1.16 0.00 0.00 32.46 30.19 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 -2.61 0.20 -0.16 -1.55 0.08 -1.05 -0.71 117.98 112.18 1s00 s PHE 178 Ca -0.09 -0.61 0.00 0.00 0.12 0.00 0.00 56.93 56.36 1s00 s PHE 178 Cb 0.07 -0.11 0.00 0.00 -0.57 0.00 0.00 43.02 42.41 1s00 s PHE 178 CO 0.78 -0.49 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.73 1s00 s LEU 179 N -2.70 2.37 -0.23 -0.37 1.43 -0.78 -0.79 118.68 117.61 1s00 s LEU 179 Ca 0.03 -0.53 -0.24 0.00 -1.03 0.00 0.00 54.13 52.36 1s00 s LEU 179 Cb 0.04 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 1s00 s LEU 179 CO -0.09 0.05 0.80 -0.70 0.23 0.00 0.00 176.35 176.64 1s00 s GLU 180 N 0.99 4.19 -0.13 1.70 2.12 0.27 -1.09 118.70 126.75 1s00 s GLU 180 Ca -0.02 0.90 -0.01 0.00 0.36 0.00 0.00 54.97 56.20 1s00 s GLU 180 Cb -0.15 -3.63 -0.02 0.00 0.26 0.00 0.00 34.13 30.59 1s00 s GLU 180 CO -0.04 -0.47 -0.11 0.08 -0.54 0.00 0.00 175.26 174.19 1s00 s VAL 181 N 2.66 3.28 -0.25 3.70 1.01 0.39 0.14 120.40 131.33 1s00 s VAL 181 Ca 0.34 -0.58 -0.17 0.00 0.00 0.00 0.00 61.98 61.57 1s00 s VAL 181 Cb -0.15 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 1s00 s VAL 181 CO 0.08 0.52 0.47 -0.70 0.00 0.00 0.00 175.10 175.47 1s00 s GLU 182 N 0.25 4.08 0.12 2.72 2.12 0.26 -0.40 118.70 127.85 1s00 s GLU 182 Ca -0.07 0.25 -0.02 0.00 0.36 0.00 0.00 54.97 55.49 1s00 s GLU 182 Cb -0.15 -3.63 0.03 0.00 0.26 0.00 0.00 34.13 30.64 1s00 s GLU 182 CO 0.05 -0.28 0.15 1.28 -0.54 0.00 0.00 175.26 175.92 1s00 n LEU 183 N 5.30 0.00 -0.17 2.70 4.77 0.16 -1.18 117.00 128.59 1s00 n LEU 183 Ca -0.06 -0.17 -0.11 0.00 -0.03 0.00 0.00 56.01 55.65 1s00 n LEU 183 Cb 0.50 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1s00 n LEU 183 CO 0.40 -0.71 0.74 0.50 -1.33 0.00 0.00 177.39 176.99 1s00 h LYS 184 N 0.00 0.93 -0.91 3.23 3.64 -1.85 -3.03 116.57 118.59 1s00 h LYS 184 Ca -0.05 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1s00 h LYS 184 Cb 0.14 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1s00 h LYS 184 CO 0.04 1.01 0.00 -0.40 -2.27 0.00 0.00 179.45 177.82 1s00 n ASP 185 N -4.23 1.21 0.00 4.20 5.75 -1.26 -4.81 116.55 117.41 1s00 n ASP 185 Ca 0.01 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 1s00 n ASP 185 Cb 0.38 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 1s00 n ASP 185 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s00 n GLY 186 N 0.21 1.86 3.90 6.12 0.00 -1.14 -4.98 105.19 111.16 1s00 n GLY 186 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.47 4.97 0.23 1.61 1.04 -1.26 -4.75 113.70 113.07 1s00 s SER 187 Ca 0.00 0.79 0.09 0.00 0.48 0.00 0.00 55.95 57.31 1s00 s SER 187 Cb 0.00 -1.47 -0.05 0.00 0.10 0.00 0.00 66.02 64.61 1s00 s SER 187 CO 0.00 -1.57 -0.15 0.42 0.98 0.00 0.00 173.24 172.92 1s00 s THR 188 N -3.36 1.91 0.02 2.02 -4.23 -1.26 0.39 115.64 111.13 1s00 s THR 188 Ca 0.59 -2.25 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1s00 s THR 188 Cb -0.11 -2.15 -0.02 0.00 1.34 0.00 0.00 72.50 71.56 1s00 s THR 188 CO 0.48 -0.51 -0.03 -0.13 -0.54 0.00 0.00 174.62 173.89 1s00 s ARG 189 N -3.62 0.31 0.05 3.99 1.81 0.47 -4.91 118.95 117.05 1s00 s ARG 189 Ca 0.25 -0.61 -0.15 0.00 -1.72 0.00 0.00 55.73 53.51 1s00 s ARG 189 Cb -0.01 0.09 -0.06 0.00 -0.45 0.00 0.00 34.95 34.52 1s00 s ARG 189 CO 0.09 -0.04 0.46 -0.51 -0.68 0.00 0.00 175.30 174.62 1s00 s LEU 190 N -1.44 4.44 -0.15 2.53 1.43 -1.26 -0.46 118.68 123.77 1s00 s LEU 190 Ca -0.15 1.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.96 1s00 s LEU 190 Cb -0.10 -2.82 0.02 0.00 0.03 0.00 0.00 46.19 43.32 1s00 s LEU 190 CO -0.01 0.26 -0.18 -0.76 0.23 0.00 0.00 176.35 175.89 1s00 s LEU 191 N -1.37 1.92 -0.15 1.79 2.01 -0.25 -4.93 118.68 117.70 1s00 s LEU 191 Ca 0.28 -0.56 -0.40 0.00 0.01 0.00 0.00 54.13 53.46 1s00 s LEU 191 Cb -0.16 -1.32 -0.18 0.00 0.01 0.00 0.00 46.19 44.54 1s00 s LEU 191 CO 0.16 -0.00 1.44 -2.65 1.01 0.00 0.00 176.35 176.31 1s00 n PRO 192 N 4.52 0.66 -0.19 1.29 -0.02 -1.26 -1.87 135.00 138.12 1s00 n PRO 192 Ca -0.19 0.24 0.08 0.00 -2.02 0.00 0.00 63.50 61.61 1s00 n PRO 192 Cb 0.50 -1.83 0.37 0.00 -0.02 0.00 0.00 33.50 32.52 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 5.02 0.69 -0.70 -0.52 4.05 -1.21 -0.07 114.93 122.19 1s00 h MET 193 Ca -0.47 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 58.90 1s00 h MET 193 Cb 1.36 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 32.00 1s00 h MET 193 CO 0.84 0.46 0.00 0.00 0.23 0.00 0.00 176.91 178.44 1s00 n GLN 194 N -4.49 1.26 -0.17 0.39 0.00 -1.26 -3.01 117.38 110.10 1s00 n GLN 194 Ca 0.12 -0.24 0.03 0.00 0.00 0.00 0.00 57.00 56.91 1s00 n GLN 194 Cb 0.30 -1.41 0.05 0.00 0.00 0.00 0.00 30.24 29.17 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 -0.06 1.03 -4.25 2.61 2.81 -0.04 -5.06 117.12 114.16 1s00 n MET 195 Ca 0.02 -1.52 -0.17 0.00 -1.81 0.00 0.00 57.70 54.22 1s00 n MET 195 Cb 0.25 -0.93 -0.11 0.00 -0.71 0.00 0.00 33.22 31.72 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 -1.14 1.35 -0.53 2.03 -7.23 -1.16 -4.35 120.40 109.36 1s00 s VAL 196 Ca 0.10 -1.83 0.03 0.00 -1.81 0.00 0.00 61.98 58.48 1s00 s VAL 196 Cb 0.09 -1.64 0.13 0.00 0.56 0.00 0.00 36.38 35.53 1s00 s VAL 196 CO 0.01 -0.49 0.28 -0.75 -0.31 0.00 0.00 175.10 173.84 1s00 s LYS 197 N -2.95 2.06 -0.28 4.82 2.47 -0.71 -4.94 119.74 120.22 1s00 s LYS 197 Ca 0.12 -2.56 -0.28 0.00 -1.56 0.00 0.00 55.97 51.68 1s00 s LYS 197 Cb -0.03 -3.39 -0.04 0.00 -1.46 0.00 0.00 37.83 32.90 1s00 s LYS 197 CO 0.03 -1.11 2.14 0.08 0.16 0.00 0.00 175.35 176.65 1s00 s VAL 198 N -0.18 3.12 0.58 4.02 1.01 -1.26 -1.39 120.40 126.30 1s00 s VAL 198 Ca 0.17 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.36 1s00 s VAL 198 Cb -0.25 -3.17 0.09 0.00 0.00 0.00 0.00 36.38 33.06 1s00 s VAL 198 CO -0.01 -0.11 0.80 -1.10 0.00 0.00 0.00 175.10 174.67 1s00 s GLN 199 N 6.42 2.27 0.19 2.72 -0.21 0.34 -4.98 119.66 126.41 1s00 s GLN 199 Ca 0.95 -1.68 -0.12 0.00 0.02 0.00 0.00 55.36 54.53 1s00 s GLN 199 Cb -0.29 -2.62 0.22 0.00 1.00 0.00 0.00 33.01 31.32 1s00 s GLN 199 CO 0.33 -0.90 1.73 1.03 -2.12 0.00 0.00 175.29 175.36 1s00 h SER 200 N 0.16 0.08 -0.10 5.90 0.87 -2.02 -3.24 113.55 115.20 1s00 h SER 200 Ca -0.29 0.08 -0.15 0.00 -1.23 0.00 0.00 61.79 60.21 1s00 h SER 200 Cb 1.29 0.10 -0.24 0.00 -0.44 0.00 0.00 62.40 63.11 1s00 h SER 200 CO 0.41 0.06 -0.82 -0.46 -0.53 0.00 0.00 176.83 175.49 1s00 n ASN 201 N -5.07 1.63 0.00 6.23 6.94 -1.26 -5.08 115.26 118.64 1s00 n ASN 201 Ca 0.07 -2.87 0.00 0.00 -0.02 0.00 0.00 54.58 51.76 1s00 n ASN 201 Cb 0.25 -0.41 0.00 0.00 -2.36 0.00 0.00 39.78 37.27 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 -0.31 0.00 -4.02 -3.83 0.63 -1.23 -4.64 116.66 103.26 1s00 n ARG 202 Ca 0.14 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.72 1s00 n ARG 202 Cb 0.93 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 33.71 1s00 n ARG 202 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1s00 s VAL 203 N -2.00 3.84 -0.34 5.15 1.01 -0.20 0.13 120.40 127.98 1s00 s VAL 203 Ca 0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 1s00 s VAL 203 Cb 0.00 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.66 1s00 s VAL 203 CO 0.00 0.42 0.14 -2.28 0.00 0.00 0.00 175.10 173.38 1s00 s HIS 204 N 1.16 3.22 -0.34 5.22 2.46 -0.49 -0.39 115.29 126.14 1s00 s HIS 204 Ca 0.03 -1.11 -0.19 0.00 0.47 0.00 0.00 55.06 54.26 1s00 s HIS 204 Cb -0.14 -2.33 -0.01 0.00 -0.13 0.00 0.00 32.58 29.97 1s00 s HIS 204 CO 0.01 -0.65 0.54 0.08 -2.47 0.00 0.00 174.74 172.25 1s00 s VAL 205 N 1.49 4.99 -0.02 0.89 1.01 0.69 -1.73 120.40 127.72 1s00 s VAL 205 Ca 0.01 0.47 0.05 0.00 0.00 0.00 0.00 61.98 62.51 1s00 s VAL 205 Cb -0.19 -3.97 -0.24 0.00 0.00 0.00 0.00 36.38 31.98 1s00 s VAL 205 CO 0.04 -0.20 0.75 -1.13 0.00 0.00 0.00 175.10 174.56 1s00 h ASN 206 N 8.40 0.15 -0.90 3.32 -0.00 -1.83 -2.40 115.58 122.32 1s00 h ASN 206 Ca -0.28 -0.27 0.03 0.00 -0.00 0.00 0.00 56.30 55.78 1s00 h ASN 206 Cb 1.12 -0.05 -0.05 0.00 -0.00 0.00 0.00 38.32 39.34 1s00 h ASN 206 CO 0.78 1.24 0.59 0.00 -0.00 0.00 0.00 177.43 180.03 1s00 h ALA 207 N 0.74 1.18 -4.17 1.57 0.00 -1.85 -3.39 119.26 113.33 1s00 h ALA 207 Ca -0.26 -0.04 -0.69 0.00 0.00 0.00 0.00 54.91 53.91 1s00 h ALA 207 Cb 1.99 -0.33 -0.25 0.00 0.00 0.00 0.00 17.79 19.20 1s00 h ALA 207 CO 0.11 0.46 -0.86 -0.51 0.00 0.00 0.00 179.25 178.45 1s00 s LEU 208 N -10.15 2.28 0.64 0.00 1.02 -1.26 -3.39 118.68 107.82 1s00 s LEU 208 Ca -0.13 -0.59 -0.05 0.00 0.02 0.00 0.00 54.13 53.39 1s00 s LEU 208 Cb 0.17 -1.32 0.04 0.00 0.02 0.00 0.00 46.19 45.10 1s00 s LEU 208 CO 0.80 0.24 0.94 -0.94 0.02 0.00 0.00 176.35 177.41 1s00 s SER 209 N -1.42 5.11 0.13 2.29 1.04 -1.26 -1.60 113.70 117.98 1s00 s SER 209 Ca 0.13 0.43 -0.30 0.00 0.48 0.00 0.00 55.95 56.69 1s00 s SER 209 Cb -0.10 -1.22 -0.07 0.00 0.10 0.00 0.00 66.02 64.73 1s00 s SER 209 CO 0.03 -1.37 1.57 0.77 0.98 0.00 0.00 173.24 175.23 1s00 h SER 210 N -0.36 -1.42 0.00 7.02 4.64 -1.86 -1.95 113.55 119.62 1s00 h SER 210 Ca -0.44 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1s00 h SER 210 Cb 1.30 0.57 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 1s00 h SER 210 CO 0.59 -0.44 0.10 -0.90 -0.87 0.00 0.00 176.83 175.31 1s00 n ASP 211 N -5.44 0.20 0.01 4.97 5.68 -1.26 -1.86 116.55 118.85 1s00 n ASP 211 Ca -0.05 0.53 0.12 0.00 -0.50 0.00 0.00 54.79 54.89 1s00 n ASP 211 Cb 0.37 -0.53 0.15 0.00 -1.14 0.00 0.00 41.12 39.97 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 -1.73 0.61 -0.14 -2.12 4.77 -0.73 -4.28 117.00 113.36 1s00 n LEU 212 Ca -0.01 -0.02 -0.09 0.00 -0.03 0.00 0.00 56.01 55.86 1s00 n LEU 212 Cb 0.11 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1s00 n LEU 212 CO 0.03 0.09 0.88 -0.26 -1.33 0.00 0.00 177.39 176.80 1s00 h PHE 213 N 0.00 0.67 -0.88 -1.77 -1.00 -1.46 -2.67 116.94 109.83 1s00 h PHE 213 Ca 0.00 -0.07 0.11 0.00 2.81 0.00 0.00 57.97 60.81 1s00 h PHE 213 Cb 0.59 -0.19 -0.06 0.00 3.61 0.00 0.00 35.95 39.89 1s00 h PHE 213 CO 0.00 0.63 0.57 0.00 -1.61 0.00 0.00 178.31 177.90 1s00 h ALA 214 N 0.96 1.70 0.00 2.45 0.00 -1.78 0.25 119.26 122.84 1s00 h ALA 214 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1s00 h ALA 214 Cb 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1s00 h ALA 214 CO -0.00 0.11 0.00 0.41 0.00 0.00 0.00 179.25 179.77 1s00 n GLY 215 N -1.42 -1.09 3.68 0.00 0.00 -1.01 -4.75 105.19 100.61 1s00 n GLY 215 Ca 0.15 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.19 2.68 0.21 -0.61 1.01 0.07 -4.88 121.20 116.50 1s00 s ILE 216 Ca 0.05 0.07 -0.32 0.00 0.00 0.00 0.00 60.65 60.44 1s00 s ILE 216 Cb 0.09 -3.04 -0.15 0.00 0.01 0.00 0.00 42.46 39.37 1s00 s ILE 216 CO 0.30 -0.00 1.28 -2.65 0.00 0.00 0.00 174.94 173.87 1s00 n PRO 217 N 6.14 1.58 -3.02 2.79 -0.02 -1.26 -4.97 135.00 136.23 1s00 n PRO 217 Ca 0.18 0.56 -0.22 0.00 -2.02 0.00 0.00 63.50 62.00 1s00 n PRO 217 Cb 0.39 -2.13 0.01 0.00 -0.02 0.00 0.00 33.50 31.75 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 -0.13 3.83 -0.05 3.45 -4.23 -1.26 -4.73 115.64 112.52 1s00 s THR 218 Ca 0.71 -0.61 -0.03 0.00 -1.18 0.00 0.00 61.69 60.58 1s00 s THR 218 Cb -0.75 -3.40 -0.04 0.00 1.34 0.00 0.00 72.50 69.65 1s00 s THR 218 CO 0.51 -0.26 0.11 0.27 -0.54 0.00 0.00 174.62 174.71 1s00 s ILE 219 N -2.51 5.04 0.00 2.99 -4.36 -1.26 -4.98 121.20 116.12 1s00 s ILE 219 Ca 0.49 -0.15 0.00 0.00 -0.26 0.00 0.00 60.65 60.73 1s00 s ILE 219 Cb -0.10 -3.26 0.00 0.00 1.25 0.00 0.00 42.46 40.35 1s00 s ILE 219 CO 0.37 0.46 0.00 0.29 0.24 0.00 0.00 174.94 176.30 1s00 n LYS 220 N 1.51 0.00 -1.81 0.37 5.02 -1.26 -4.58 118.16 117.40 1s00 n LYS 220 Ca -0.15 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.73 1s00 n LYS 220 Cb 0.53 -0.43 0.00 0.00 -0.02 0.00 0.00 35.03 35.11 1s00 n LYS 220 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1s00 s SER 221 N -2.17 6.25 0.00 4.39 0.15 -1.26 -4.87 113.70 116.18 1s00 s SER 221 Ca 0.00 3.01 0.28 0.00 0.70 0.00 0.00 55.95 59.94 1s00 s SER 221 Cb 0.00 -2.66 1.09 0.00 -1.71 0.00 0.00 66.02 62.74 1s00 s SER 221 CO 0.00 -0.93 1.81 -0.81 1.20 0.00 0.00 173.24 174.51 1s00 n PRO 222 N 0.31 0.13 0.00 5.44 -0.04 -1.26 -3.58 135.00 136.00 1s00 n PRO 222 Ca 0.02 -0.03 0.09 0.00 -0.04 0.00 0.00 63.50 63.54 1s00 n PRO 222 Cb 0.40 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.40 0.00 -3.88 0.52 -2.24 -1.26 -4.99 114.28 101.03 1s00 n THR 223 Ca 0.08 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.62 1s00 n THR 223 Cb 0.32 1.10 -0.09 0.00 -2.10 0.00 0.00 70.33 69.56 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 -2.60 0.65 -0.05 -0.78 -1.05 -1.23 -4.59 118.70 109.04 1s00 s GLU 224 Ca 0.11 -0.68 0.05 0.00 -0.15 0.00 0.00 54.97 54.30 1s00 s GLU 224 Cb 0.15 0.26 -0.00 0.00 -0.44 0.00 0.00 34.13 34.10 1s00 s GLU 224 CO 0.68 -0.18 -0.19 0.54 0.95 0.00 0.00 175.26 177.06 1s00 s VAL 225 N -2.56 1.57 0.45 1.83 0.11 -1.26 -4.40 120.40 116.14 1s00 s VAL 225 Ca -0.05 -0.79 -0.01 0.00 -2.93 0.00 0.00 61.98 58.19 1s00 s VAL 225 Cb -0.01 -1.35 -0.01 0.00 -1.53 0.00 0.00 36.38 33.47 1s00 s VAL 225 CO -0.04 0.45 0.69 0.42 -3.33 0.00 0.00 175.10 173.29 1s00 s THR 226 N 0.03 4.38 0.32 5.04 -4.23 -1.26 -4.26 115.64 115.65 1s00 s THR 226 Ca -0.05 -0.30 0.03 0.00 -1.18 0.00 0.00 61.69 60.20 1s00 s THR 226 Cb -0.12 -3.64 0.29 0.00 1.34 0.00 0.00 72.50 70.37 1s00 s THR 226 CO 0.03 -0.50 1.91 -0.07 -0.54 0.00 0.00 174.62 175.45 1s00 h LEU 227 N 0.37 0.82 -0.06 4.79 3.38 -1.18 0.51 115.31 123.95 1s00 h LEU 227 Ca -0.47 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 1s00 h LEU 227 Cb 1.24 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1s00 h LEU 227 CO 0.59 0.51 -0.03 0.25 0.09 0.00 0.00 178.44 179.85 1s00 h LEU 228 N 0.92 0.12 -0.34 1.67 5.85 -1.64 -0.72 115.31 121.17 1s00 h LEU 228 Ca 0.39 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1s00 h LEU 228 Cb 0.30 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1s00 h LEU 228 CO -0.15 0.51 0.20 -0.33 -0.34 0.00 0.00 178.44 178.32 1s00 h GLU 229 N -0.27 0.47 -0.12 1.25 5.08 -1.69 -1.51 114.58 117.79 1s00 h GLU 229 Ca 0.01 -0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1s00 h GLU 229 Cb 0.46 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.56 1s00 h GLU 229 CO 0.01 0.37 -0.29 1.49 -1.00 0.00 0.00 179.01 179.60 1s00 h GLU 230 N 0.43 -0.35 -0.68 2.33 4.81 0.05 0.26 114.58 121.44 1s00 h GLU 230 Ca 0.12 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.46 1s00 h GLU 230 Cb 0.03 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.43 1s00 h GLU 230 CO -0.02 -0.23 0.34 0.22 -0.73 0.00 0.00 179.01 178.59 1s00 h ASP 231 N -0.37 0.46 -0.72 1.04 3.58 -0.81 0.24 116.42 119.84 1s00 h ASP 231 Ca 0.10 0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.55 1s00 h ASP 231 Cb 0.51 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.50 1s00 h ASP 231 CO -0.33 0.28 0.27 0.11 -2.88 0.00 0.00 179.24 176.69 1s00 h LYS 232 N 0.60 1.10 -0.43 0.28 1.57 -0.39 0.12 116.57 119.41 1s00 h LYS 232 Ca 0.32 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 1s00 h LYS 232 Cb 0.30 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1s00 h LYS 232 CO -0.24 0.92 -0.16 0.82 -0.57 0.00 0.00 179.45 180.21 1s00 h ILE 233 N 1.05 1.28 -0.10 1.86 2.04 0.51 -2.09 117.51 122.04 1s00 h ILE 233 Ca 0.24 -1.30 -0.21 0.00 1.00 0.00 0.00 64.86 64.59 1s00 h ILE 233 Cb 0.24 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1s00 h ILE 233 CO -0.02 0.44 -0.77 0.00 0.00 0.00 0.00 178.15 177.81 1s00 h GLY 235 N 0.96 0.63 0.82 0.00 0.00 -0.79 -2.62 103.07 102.07 1s00 h GLY 235 Ca -0.05 -0.70 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 1s00 h GLY 235 CO 0.14 0.63 -0.03 -1.82 0.00 0.00 0.00 176.54 175.46 1s00 h TYR 236 N 0.45 -0.08 -0.73 5.60 5.03 -1.39 -2.38 116.97 123.47 1s00 h TYR 236 Ca 0.02 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1s00 h TYR 236 Cb 1.04 0.03 -0.04 0.00 1.55 0.00 0.00 36.73 39.31 1s00 h TYR 236 CO 0.04 0.12 0.46 0.28 -1.32 0.00 0.00 178.16 177.74 1s00 h VAL 237 N -0.27 1.20 -0.60 1.81 2.07 -1.50 -2.48 116.25 116.47 1s00 h VAL 237 Ca -0.01 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.05 1s00 h VAL 237 Cb 0.24 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 1s00 h VAL 237 CO 0.02 0.20 0.12 0.00 0.02 0.00 0.00 177.57 177.92 1s00 h ALA 238 N 1.25 1.08 0.00 1.67 0.00 -1.45 -2.54 119.26 119.26 1s00 h ALA 238 Ca 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1s00 h ALA 238 Cb -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.48 1s00 h ALA 238 CO -0.05 0.61 0.05 0.41 0.00 0.00 0.00 179.25 180.26 1s00 n GLY 239 N -0.73 -0.46 0.19 0.00 0.00 -0.90 -1.47 105.19 101.82 1s00 n GLY 239 Ca 0.04 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1s00 n GLY 239 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1s00 h GLY 240 N 0.00 0.00 2.00 -0.02 0.00 -1.49 0.52 103.07 104.08 1s00 h GLY 240 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1s00 h GLY 240 CO 0.00 0.00 -0.01 1.41 0.00 0.00 0.00 176.54 177.94 1s00 h LEU 241 N 0.00 0.00 0.00 3.11 3.38 -1.27 -1.35 115.31 119.18 1s00 h LEU 241 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1s00 h LEU 241 Cb 0.95 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1s00 h LEU 241 CO 0.00 0.01 -1.65 0.80 0.09 0.00 0.00 178.44 177.69 1s00 n MET 242 N -3.15 0.25 0.12 1.13 1.56 -1.15 -4.55 117.12 111.33 1s00 n MET 242 Ca -0.01 0.10 -0.01 0.00 -0.27 0.00 0.00 57.70 57.50 1s00 n MET 242 Cb 0.18 -0.97 0.05 0.00 2.15 0.00 0.00 33.22 34.63 1s00 n MET 242 CO 0.00 0.00 0.00 1.88 -0.73 0.00 0.00 175.97 177.12 1s00 h TYR 243 N -0.34 0.00 -0.08 1.12 0.05 -0.93 -3.13 116.97 113.65 1s00 h TYR 243 Ca -0.29 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.49 1s00 h TYR 243 Cb 1.28 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.02 1s00 h TYR 243 CO -0.03 0.69 0.00 0.00 -1.05 0.00 0.00 178.16 177.77 1s00 n ALA 244 N -2.32 2.53 -0.32 3.88 0.00 -0.51 -4.41 120.51 119.36 1s00 n ALA 244 Ca 0.00 -0.54 0.20 0.00 0.00 0.00 0.00 53.44 53.11 1s00 n ALA 244 Cb 0.76 -1.07 0.41 0.00 0.00 0.00 0.00 19.45 19.54 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 4.33 1.65 -0.12 0.00 0.00 -1.58 0.39 119.26 123.93 1s00 h ALA 245 Ca 0.00 0.24 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1s00 h ALA 245 Cb 0.60 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1s00 h ALA 245 CO 0.00 -0.62 -0.20 -1.35 0.00 0.00 0.00 179.25 177.08 1s00 h PRO 246 N 0.17 0.21 -0.05 0.00 0.11 -1.84 -2.88 132.00 127.72 1s00 h PRO 246 Ca 0.68 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.73 1s00 h PRO 246 Cb 1.54 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.62 1s00 h PRO 246 CO -0.71 0.41 0.00 1.63 -0.21 0.00 0.00 178.00 179.12 1s00 n LYS 247 N -4.22 1.66 -2.96 1.05 5.02 0.13 -4.84 118.16 114.00 1s00 n LYS 247 Ca -0.01 -0.96 -0.43 0.00 -2.02 0.00 0.00 58.31 54.88 1s00 n LYS 247 Cb 0.32 -1.46 -0.05 0.00 -0.02 0.00 0.00 35.03 33.81 1s00 n LYS 247 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1s00 s ARG 248 N -1.96 3.24 1.16 1.97 3.52 -0.89 -3.40 118.95 122.60 1s00 s ARG 248 Ca 0.37 -0.52 -0.17 0.00 -0.13 0.00 0.00 55.73 55.28 1s00 s ARG 248 Cb 0.20 -4.07 0.18 0.00 -1.56 0.00 0.00 34.95 29.70 1s00 s ARG 248 CO 0.32 -1.39 0.34 1.63 -0.81 0.00 0.00 175.30 175.40 1s00 n LYS 249 N 6.96 -2.11 -2.61 5.12 4.76 -0.52 -4.99 118.16 124.76 1s00 n LYS 249 Ca -0.02 -0.60 -0.24 0.00 -2.87 0.00 0.00 58.31 54.58 1s00 n LYS 249 Cb 0.47 -1.83 0.03 0.00 -1.84 0.00 0.00 35.03 31.85 1s00 n LYS 249 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1s00 s SER 250 N -2.05 5.56 0.14 4.39 1.04 -1.26 -4.90 113.70 116.62 1s00 s SER 250 Ca 0.59 0.44 -0.14 0.00 0.48 0.00 0.00 55.95 57.32 1s00 s SER 250 Cb -0.16 -1.47 0.02 0.00 0.10 0.00 0.00 66.02 64.51 1s00 s SER 250 CO 0.64 -1.00 1.66 0.58 0.98 0.00 0.00 173.24 176.11 1s00 h VAL 251 N 0.02 1.23 -0.77 5.02 2.07 -1.98 0.22 116.25 122.05 1s00 h VAL 251 Ca -0.45 -0.76 0.12 0.00 0.82 0.00 0.00 66.70 66.42 1s00 h VAL 251 Cb 1.27 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 1s00 h VAL 251 CO 0.58 0.28 0.51 0.58 0.02 0.00 0.00 177.57 179.54 1s00 h VAL 252 N 0.62 0.88 0.16 2.57 2.07 -1.97 0.63 116.25 121.22 1s00 h VAL 252 Ca 0.15 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1s00 h VAL 252 Cb 0.28 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1s00 h VAL 252 CO -0.00 0.11 -0.08 0.00 0.02 0.00 0.00 177.57 177.62 1s00 h ALA 253 N 1.63 -0.21 -0.99 1.67 0.00 -1.72 -3.23 119.26 116.41 1s00 h ALA 253 Ca 0.37 -0.23 0.13 0.00 0.00 0.00 0.00 54.91 55.17 1s00 h ALA 253 Cb 0.61 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 1s00 h ALA 253 CO -0.14 -0.31 0.62 0.00 0.00 0.00 0.00 179.25 179.42 1s00 h ALA 254 N -0.23 1.57 0.00 0.00 0.00 0.14 -0.07 119.26 120.67 1s00 h ALA 254 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1s00 h ALA 254 Cb 0.53 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1s00 h ALA 254 CO 0.04 0.18 0.00 -1.33 0.00 0.00 0.00 179.25 178.14 1s00 n MET 255 N -4.61 0.03 0.00 0.00 2.81 0.21 -5.08 117.12 110.47 1s00 n MET 255 Ca 0.19 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 56.10 1s00 n MET 255 Cb 0.38 -1.38 0.02 0.00 -0.71 0.00 0.00 33.22 31.52 1s00 n MET 255 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76