#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1til s ARG 2 N 0.00 0.05 0.00 2.12 6.06 -1.26 -4.30 118.95 121.62 1til s ARG 2 Ca 0.00 0.06 0.00 0.00 -2.50 0.00 0.00 55.73 53.29 1til s ARG 2 Cb 0.00 0.02 0.00 0.00 0.06 0.00 0.00 34.95 35.03 1til s ARG 2 CO 0.00 -0.01 0.00 -1.71 -2.50 0.00 0.00 175.30 171.08 1til n ASN 3 N 1.63 0.00 -3.86 -2.12 2.85 -1.08 -5.00 115.26 107.69 1til n ASN 3 Ca -0.11 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.25 1til n ASN 3 Cb 0.57 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.50 1til n ASN 3 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 1til s GLU 4 N -1.00 0.57 0.01 1.20 -1.05 -1.26 -2.09 118.70 115.08 1til s GLU 4 Ca 0.00 -0.46 -0.06 0.00 -0.15 0.00 0.00 54.97 54.29 1til s GLU 4 Cb 0.00 0.24 -0.00 0.00 -0.44 0.00 0.00 34.13 33.92 1til s GLU 4 CO 0.00 -0.15 0.12 1.41 0.95 0.00 0.00 175.26 177.59 1til s MET 5 N -1.78 0.51 -0.03 -4.83 -2.45 -0.87 -5.02 119.30 104.82 1til s MET 5 Ca -0.11 -0.51 0.01 0.00 -1.25 0.00 0.00 55.69 53.83 1til s MET 5 Cb -0.05 0.21 0.02 0.00 1.25 0.00 0.00 34.83 36.25 1til s MET 5 CO 0.00 -0.12 -0.04 -1.01 1.05 0.00 0.00 175.02 174.90 1til s HIS 6 N -1.73 0.65 0.04 4.11 3.76 -1.26 -1.18 115.29 119.68 1til s HIS 6 Ca -0.12 -0.16 0.06 0.00 -0.15 0.00 0.00 55.06 54.69 1til s HIS 6 Cb -0.06 -0.57 -0.02 0.00 1.11 0.00 0.00 32.58 33.04 1til s HIS 6 CO -0.00 -0.14 -0.17 -1.17 -0.85 0.00 0.00 174.74 172.40 1til s LEU 7 N 0.72 2.17 -0.00 0.89 2.96 -0.43 -4.98 118.68 120.00 1til s LEU 7 Ca -0.09 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.35 1til s LEU 7 Cb -0.12 -0.78 -0.00 0.00 0.50 0.00 0.00 46.19 45.79 1til s LEU 7 CO -0.00 0.10 -0.04 -1.10 -1.32 0.00 0.00 176.35 173.99 1til s GLN 8 N -1.13 0.32 -0.03 1.98 1.11 -1.26 -0.06 119.66 120.59 1til s GLN 8 Ca 0.04 -0.16 -0.29 0.00 0.01 0.00 0.00 55.36 54.97 1til s GLN 8 Cb -0.08 -0.30 0.08 0.00 -1.01 0.00 0.00 33.01 31.70 1til s GLN 8 CO 0.01 0.08 0.72 -0.59 0.01 0.00 0.00 175.29 175.53 1til s PHE 9 N -0.13 -0.58 0.56 0.91 -0.12 -1.08 -5.02 117.98 112.53 1til s PHE 9 Ca 0.01 0.86 -0.19 0.00 -0.05 0.00 0.00 56.93 57.56 1til s PHE 9 Cb -0.02 0.45 -0.07 0.00 -0.63 0.00 0.00 43.02 42.75 1til s PHE 9 CO -0.00 -0.61 0.79 0.43 -0.05 0.00 0.00 175.22 175.78 1til n SER 10 N 0.58 0.09 -3.60 1.98 7.64 -1.26 -2.26 113.62 116.80 1til n SER 10 Ca -0.17 0.81 -0.41 0.00 1.01 0.00 0.00 58.87 60.11 1til n SER 10 Cb 0.59 -1.29 -0.01 0.00 -1.01 0.00 0.00 64.21 62.49 1til n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1til n ALA 11 N -1.53 6.23 -2.43 -0.43 0.00 -0.63 -4.73 120.51 116.99 1til n ALA 11 Ca 0.12 -3.80 -0.29 0.00 0.00 0.00 0.00 53.44 49.47 1til n ALA 11 Cb 0.46 -3.44 -0.12 0.00 0.00 0.00 0.00 19.45 16.35 1til n ALA 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1til s ARG 12 N 2.59 1.63 0.43 0.00 6.06 -1.26 -3.92 118.95 124.48 1til s ARG 12 Ca 0.54 -1.24 0.09 0.00 -2.50 0.00 0.00 55.73 52.63 1til s ARG 12 Cb 0.15 -2.01 0.94 0.00 0.06 0.00 0.00 34.95 34.09 1til s ARG 12 CO -0.08 0.47 2.05 0.66 -2.50 0.00 0.00 175.30 175.91 1til h SER 13 N 3.95 0.40 -0.28 -2.12 4.64 -1.97 -2.84 113.55 115.33 1til h SER 13 Ca -0.50 -0.01 0.06 0.00 -0.47 0.00 0.00 61.79 60.87 1til h SER 13 Cb 1.17 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 63.10 1til h SER 13 CO 0.43 0.28 -0.09 -0.33 -0.87 0.00 0.00 176.83 176.25 1til h GLU 14 N 0.47 -0.03 0.00 4.77 3.07 -1.96 -1.43 114.58 119.47 1til h GLU 14 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 1til h GLU 14 Cb 0.07 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1til h GLU 14 CO -0.04 -0.02 0.00 0.09 -1.40 0.00 0.00 179.01 177.64 1til n ASN 15 N -5.26 0.00 -0.01 1.42 3.02 -1.07 -2.31 115.26 111.03 1til n ASN 15 Ca -0.00 -0.23 -0.17 0.00 -0.03 0.00 0.00 54.58 54.15 1til n ASN 15 Cb 0.18 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.22 1til n ASN 15 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1til h GLU 16 N 0.00 0.14 -0.19 3.52 5.08 -1.41 -1.96 114.58 119.77 1til h GLU 16 Ca 0.00 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1til h GLU 16 Cb 0.00 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1til h GLU 16 CO 0.00 1.10 0.05 0.66 -1.00 0.00 0.00 179.01 179.83 1til h SER 17 N -0.69 0.28 -0.72 1.42 4.64 -1.66 -2.24 113.55 114.58 1til h SER 17 Ca -0.06 -0.22 0.16 0.00 -0.47 0.00 0.00 61.79 61.19 1til h SER 17 Cb 1.28 -0.07 -0.11 0.00 -0.31 0.00 0.00 62.40 63.19 1til h SER 17 CO 0.07 0.43 0.14 0.15 -0.87 0.00 0.00 176.83 176.75 1til h PHE 18 N 0.13 0.21 -0.92 4.77 3.57 -1.65 0.35 116.94 123.39 1til h PHE 18 Ca 0.06 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1til h PHE 18 Cb 0.25 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 1til h PHE 18 CO 0.01 -0.11 0.55 0.00 -2.23 0.00 0.00 178.31 176.53 1til h ALA 19 N 1.61 1.18 0.15 2.41 0.00 -1.04 -1.12 119.26 122.45 1til h ALA 19 Ca 0.40 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1til h ALA 19 Cb 0.68 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1til h ALA 19 CO -0.52 0.64 -0.07 0.00 0.00 0.00 0.00 179.25 179.29 1til h ARG 20 N 1.27 -0.19 -0.45 0.00 3.08 0.06 -1.96 114.38 116.19 1til h ARG 20 Ca 0.33 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.48 1til h ARG 20 Cb -0.05 0.04 -0.08 0.00 0.08 0.00 0.00 29.97 29.97 1til h ARG 20 CO -0.06 0.13 -0.05 0.28 -1.07 0.00 0.00 179.97 179.20 1til h VAL 21 N -0.53 0.60 0.20 2.04 2.07 -0.33 0.07 116.25 120.38 1til h VAL 21 Ca -0.02 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1til h VAL 21 Cb 0.41 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1til h VAL 21 CO 0.03 0.01 -0.10 0.74 0.02 0.00 0.00 177.57 178.28 1til h THR 22 N 0.06 0.00 -0.95 2.57 2.02 -1.19 0.07 112.91 115.48 1til h THR 22 Ca 0.22 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.64 1til h THR 22 Cb 0.33 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.68 1til h THR 22 CO -0.42 0.00 0.64 0.58 0.37 0.00 0.00 175.52 176.69 1til h VAL 23 N -0.27 0.61 0.34 3.16 2.07 -1.32 0.93 116.25 121.77 1til h VAL 23 Ca -0.03 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1til h VAL 23 Cb 0.20 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1til h VAL 23 CO 0.04 0.06 -0.16 0.00 0.02 0.00 0.00 177.57 177.53 1til h ALA 24 N 1.59 -0.45 -0.23 1.67 0.00 -0.79 -1.09 119.26 119.97 1til h ALA 24 Ca 0.50 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.35 1til h ALA 24 Cb 1.39 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.31 1til h ALA 24 CO -0.17 -0.74 -0.07 0.00 0.00 0.00 0.00 179.25 178.27 1til h ALA 25 N 0.17 0.14 -0.19 0.00 0.00 0.12 -0.32 119.26 119.19 1til h ALA 25 Ca -0.05 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1til h ALA 25 Cb 0.37 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1til h ALA 25 CO 0.08 -0.48 0.00 0.35 0.00 0.00 0.00 179.25 179.19 1til h PHE 26 N -0.02 0.27 0.00 0.00 3.57 -1.06 -2.49 116.94 117.21 1til h PHE 26 Ca 0.11 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1til h PHE 26 Cb 0.19 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.85 1til h PHE 26 CO -0.25 0.28 -0.63 0.28 -2.23 0.00 0.00 178.31 175.76 1til h VAL 27 N 0.27 0.00 -0.38 1.41 2.07 -0.75 -3.31 116.25 115.55 1til h VAL 27 Ca 0.06 -0.86 0.11 0.00 0.82 0.00 0.00 66.70 66.83 1til h VAL 27 Cb 0.18 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1til h VAL 27 CO 0.00 0.00 0.33 0.00 0.02 0.00 0.00 177.57 177.92 1til h ALA 28 N 2.14 2.19 0.00 1.67 0.00 -0.58 -1.22 119.26 123.46 1til h ALA 28 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1til h ALA 28 Cb 0.93 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1til h ALA 28 CO 0.00 -0.53 0.00 1.04 0.00 0.00 0.00 179.25 179.76 1til n GLN 29 N -4.06 0.00 0.00 0.00 6.02 -1.25 -0.36 117.38 117.73 1til n GLN 29 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 1til n GLN 29 Cb 0.51 -1.10 0.00 0.00 1.02 0.00 0.00 30.24 30.67 1til n GLN 29 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1til n LEU 30 N -0.59 1.53 -4.01 1.08 4.77 -0.46 -5.04 117.00 114.29 1til n LEU 30 Ca 0.00 -1.53 -0.43 0.00 -0.03 0.00 0.00 56.01 54.01 1til n LEU 30 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1til n LEU 30 CO 0.00 0.38 -0.16 0.47 -1.33 0.00 0.00 177.39 176.75 1til n ASP 31 N -0.30 -4.36 -4.93 -1.43 8.00 0.51 -4.89 116.55 109.15 1til n ASP 31 Ca 0.00 -1.24 -0.26 0.00 0.71 0.00 0.00 54.79 54.01 1til n ASP 31 Cb 0.18 -1.85 0.06 0.00 -0.02 0.00 0.00 41.12 39.49 1til n ASP 31 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1til s PRO 32 N -7.02 2.29 1.11 -0.24 0.04 -1.26 -4.91 135.00 125.00 1til s PRO 32 Ca 0.44 -0.25 -0.13 0.00 0.04 0.00 0.00 61.00 61.10 1til s PRO 32 Cb -0.23 -2.19 0.25 0.00 0.04 0.00 0.00 34.50 32.37 1til s PRO 32 CO 0.95 -1.16 1.06 0.99 0.04 0.00 0.00 177.00 178.88 1til s THR 33 N -3.20 1.96 0.24 1.26 2.01 -1.26 -4.81 115.64 111.85 1til s THR 33 Ca 0.59 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.65 1til s THR 33 Cb -0.11 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1til s THR 33 CO 0.45 0.00 1.57 0.24 -0.69 0.00 0.00 174.62 176.18 1til h MET 34 N -2.35 0.19 0.28 4.92 0.00 -1.98 -1.94 114.93 114.05 1til h MET 34 Ca -0.58 -0.13 -0.01 0.00 0.00 0.00 0.00 59.70 58.97 1til h MET 34 Cb 1.34 0.02 0.00 0.00 0.00 0.00 0.00 31.60 32.96 1til h MET 34 CO 0.53 0.74 -0.13 -0.44 0.00 0.00 0.00 176.91 177.61 1til h ASP 35 N 0.14 -0.32 -0.99 1.22 3.32 -1.98 0.68 116.42 118.50 1til h ASP 35 Ca -0.01 -0.17 0.18 0.00 0.02 0.00 0.00 57.03 57.05 1til h ASP 35 Cb 1.11 0.08 -0.10 0.00 0.22 0.00 0.00 39.33 40.65 1til h ASP 35 CO 0.09 0.01 0.61 -0.33 -1.72 0.00 0.00 179.24 177.91 1til h GLU 36 N -0.66 0.74 -0.21 3.56 5.08 -1.91 0.86 114.58 122.03 1til h GLU 36 Ca -0.04 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.12 1til h GLU 36 Cb 0.47 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1til h GLU 36 CO 0.06 0.49 -0.48 1.25 -1.00 0.00 0.00 179.01 179.33 1til h LEU 37 N 0.76 0.78 -0.05 1.33 6.46 -0.99 -2.33 115.31 121.27 1til h LEU 37 Ca 0.54 -0.56 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1til h LEU 37 Cb 0.85 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.56 1til h LEU 37 CO -0.32 1.20 0.02 0.74 -0.62 0.00 0.00 178.44 179.46 1til h THR 38 N 0.40 1.15 -0.43 1.05 2.02 0.28 -0.02 112.91 117.35 1til h THR 38 Ca -0.00 -0.46 0.09 0.00 0.77 0.00 0.00 66.41 66.81 1til h THR 38 Cb 1.09 1.37 -0.09 0.00 -1.74 0.00 0.00 68.15 68.77 1til h THR 38 CO 0.11 0.13 -0.26 -0.33 0.37 0.00 0.00 175.52 175.53 1til h GLU 39 N -0.10 -0.17 -0.43 6.66 5.08 0.60 0.14 114.58 126.37 1til h GLU 39 Ca 0.02 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1til h GLU 39 Cb 0.19 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1til h GLU 39 CO -0.00 -0.11 0.24 0.82 -1.00 0.00 0.00 179.01 178.95 1til h ILE 40 N -0.18 1.16 -0.97 3.13 2.04 -1.19 0.12 117.51 121.63 1til h ILE 40 Ca 0.20 -0.41 0.09 0.00 1.00 0.00 0.00 64.86 65.74 1til h ILE 40 Cb 0.50 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 37.14 1til h ILE 40 CO -0.54 0.17 0.61 0.11 0.00 0.00 0.00 178.15 178.50 1til h LYS 41 N 0.56 1.01 0.74 2.37 1.57 0.05 -1.10 116.57 121.77 1til h LYS 41 Ca 0.15 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1til h LYS 41 Cb 0.05 -0.23 0.01 0.00 0.08 0.00 0.00 32.23 32.14 1til h LYS 41 CO -0.02 0.67 -0.35 1.15 -0.57 0.00 0.00 179.45 180.32 1til h THR 42 N 1.04 0.00 -1.00 -0.16 2.02 0.12 -1.86 112.91 113.07 1til h THR 42 Ca 0.45 -0.16 0.26 0.00 0.77 0.00 0.00 66.41 67.73 1til h THR 42 Cb 0.31 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.59 1til h THR 42 CO -0.22 0.00 0.58 0.58 0.37 0.00 0.00 175.52 176.83 1til h VAL 43 N -1.15 0.47 -0.35 3.16 2.07 -0.60 0.27 116.25 120.13 1til h VAL 43 Ca -0.10 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1til h VAL 43 Cb 0.76 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1til h VAL 43 CO 0.17 0.09 0.11 0.58 0.02 0.00 0.00 177.57 178.54 1til h VAL 44 N 0.51 1.21 -0.60 2.57 2.07 -1.10 -2.37 116.25 118.54 1til h VAL 44 Ca 0.66 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1til h VAL 44 Cb 1.33 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 1til h VAL 44 CO -0.51 0.23 0.30 -1.28 0.02 0.00 0.00 177.57 176.33 1til h SER 45 N 0.42 0.76 0.15 0.57 0.87 0.27 -1.62 113.55 114.97 1til h SER 45 Ca 0.11 -0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 1til h SER 45 Cb 0.24 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1til h SER 45 CO -0.00 0.66 -0.22 -0.33 -0.53 0.00 0.00 176.83 176.41 1til h GLU 46 N 0.81 -0.41 -0.30 2.24 4.39 -0.71 0.90 114.58 121.49 1til h GLU 46 Ca 0.21 0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.92 1til h GLU 46 Cb 0.09 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 1til h GLU 46 CO -0.03 -0.28 0.11 0.00 -1.16 0.00 0.00 179.01 177.66 1til h ALA 47 N 0.33 0.39 -0.75 3.43 0.00 -1.38 -0.41 119.26 120.86 1til h ALA 47 Ca 0.02 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1til h ALA 47 Cb 0.43 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1til h ALA 47 CO -0.09 -0.00 0.28 0.28 0.00 0.00 0.00 179.25 179.72 1til h VAL 48 N 0.33 1.26 -0.39 0.00 2.07 -1.22 -0.09 116.25 118.21 1til h VAL 48 Ca 0.10 -0.84 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 1til h VAL 48 Cb 0.20 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1til h VAL 48 CO -0.01 0.34 0.03 0.74 0.02 0.00 0.00 177.57 178.69 1til h THR 49 N 1.10 1.25 0.04 2.57 2.02 -0.68 -0.52 112.91 118.68 1til h THR 49 Ca 0.25 -0.95 0.03 0.00 0.77 0.00 0.00 66.41 66.51 1til h THR 49 Cb 0.25 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.71 1til h THR 49 CO -0.02 0.32 -0.27 0.78 0.37 0.00 0.00 175.52 176.70 1til h ASN 50 N 0.51 -0.80 -0.85 4.18 2.35 -0.66 -0.94 115.58 119.37 1til h ASN 50 Ca 0.12 0.10 0.15 0.00 -0.55 0.00 0.00 56.30 56.12 1til h ASN 50 Cb 0.43 0.32 -0.10 0.00 0.05 0.00 0.00 38.32 39.02 1til h ASN 50 CO 0.01 -0.35 0.43 0.00 -1.65 0.00 0.00 177.43 175.87 1til h ALA 51 N 0.33 1.28 0.50 -0.83 0.00 -0.78 0.37 119.26 120.14 1til h ALA 51 Ca 0.05 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1til h ALA 51 Cb 0.51 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1til h ALA 51 CO -0.21 -0.11 -0.24 0.82 0.00 0.00 0.00 179.25 179.51 1til h ILE 52 N 0.60 0.04 0.01 0.00 2.04 -0.23 -1.67 117.51 118.30 1til h ILE 52 Ca 0.47 -0.51 -0.20 0.00 1.00 0.00 0.00 64.86 65.62 1til h ILE 52 Cb 0.68 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1til h ILE 52 CO -0.37 0.01 -0.90 0.16 0.00 0.00 0.00 178.15 177.05 1til h ILE 53 N -1.17 1.53 0.00 -0.67 3.07 -1.16 0.80 117.51 119.91 1til h ILE 53 Ca -0.07 -2.73 0.00 0.00 1.55 0.00 0.00 64.86 63.61 1til h ILE 53 Cb 0.53 2.53 0.00 0.00 -0.27 0.00 0.00 36.82 39.61 1til h ILE 53 CO 0.11 0.79 -0.24 1.41 -1.05 0.00 0.00 178.15 179.18 1til n HIS 54 N -3.61 0.35 -0.20 0.16 8.25 0.13 -2.48 115.22 117.81 1til n HIS 54 Ca -0.03 0.15 -0.06 0.00 -0.26 0.00 0.00 57.72 57.52 1til n HIS 54 Cb 0.83 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 31.50 1til n HIS 54 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1til h GLY 55 N -0.42 -0.16 -1.49 -1.41 0.00 -1.01 -2.76 103.07 95.81 1til h GLY 55 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.79 1til h GLY 55 CO 0.00 -0.20 0.00 -1.72 0.00 0.00 0.00 176.54 174.62 1til n TYR 56 N -5.43 0.66 -4.13 5.60 4.02 -0.67 -1.30 117.16 115.90 1til n TYR 56 Ca 0.04 -0.61 -0.39 0.00 -0.01 0.00 0.00 57.90 56.93 1til n TYR 56 Cb 0.36 -0.12 -0.02 0.00 -0.02 0.00 0.00 39.34 39.53 1til n TYR 56 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1til n ASN 57 N 0.29 -2.14 -1.30 7.72 3.02 -1.04 -0.69 115.26 121.13 1til n ASN 57 Ca 0.15 -1.26 -0.16 0.00 -0.03 0.00 0.00 54.58 53.28 1til n ASN 57 Cb 0.58 -1.83 -0.07 0.00 -0.61 0.00 0.00 39.78 37.86 1til n ASN 57 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1til n ASN 58 N -2.50 -5.27 -4.63 6.41 3.02 0.25 -4.94 115.26 107.61 1til n ASN 58 Ca -0.20 0.40 -0.43 0.00 -0.03 0.00 0.00 54.58 54.32 1til n ASN 58 Cb 0.62 -4.39 -0.02 0.00 -0.61 0.00 0.00 39.78 35.39 1til n ASN 58 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1til s ASP 59 N -2.53 6.85 0.61 6.41 2.15 0.14 -4.91 116.67 125.40 1til s ASP 59 Ca 0.00 0.95 0.30 0.00 0.43 0.00 0.00 52.55 54.22 1til s ASP 59 Cb 0.00 -2.54 1.61 0.00 -0.30 0.00 0.00 42.92 41.68 1til s ASP 59 CO 0.00 -0.97 1.98 1.55 -0.17 0.00 0.00 175.17 177.56 1til h PRO 60 N 8.41 0.00 0.00 4.34 0.13 -1.89 -1.97 132.00 141.01 1til h PRO 60 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1til h PRO 60 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1til h PRO 60 CO 1.05 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.91 1til n ASN 61 N -3.48 0.00 -4.49 1.44 3.02 -1.26 -3.00 115.26 107.49 1til n ASN 61 Ca 0.03 -0.84 -0.29 0.00 -0.03 0.00 0.00 54.58 53.45 1til n ASN 61 Cb 0.47 -0.04 0.20 0.00 -0.61 0.00 0.00 39.78 39.80 1til n ASN 61 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1til s GLY 62 N -2.08 1.56 -0.28 7.41 0.00 -0.74 -4.79 107.32 108.38 1til s GLY 62 Ca 0.43 -0.46 -0.03 0.00 0.00 0.00 0.00 44.72 44.67 1til s GLY 62 CO 0.37 0.23 0.11 -0.42 0.00 0.00 0.00 173.10 173.39 1til s ILE 63 N -2.88 0.34 0.20 0.90 -1.09 -1.26 -1.61 121.20 115.80 1til s ILE 63 Ca 0.67 -0.96 -0.26 0.00 -2.23 0.00 0.00 60.65 57.87 1til s ILE 63 Cb -0.18 -1.23 -0.08 0.00 -1.58 0.00 0.00 42.46 39.39 1til s ILE 63 CO 0.58 -0.64 0.82 -0.69 -1.23 0.00 0.00 174.94 173.78 1til s VAL 64 N 1.89 4.30 -0.25 2.92 1.01 -0.96 -4.49 120.40 124.83 1til s VAL 64 Ca 0.08 1.77 0.01 0.00 0.00 0.00 0.00 61.98 63.84 1til s VAL 64 Cb -0.17 -4.15 0.07 0.00 0.00 0.00 0.00 36.38 32.13 1til s VAL 64 CO -0.29 0.46 -0.04 -0.44 0.00 0.00 0.00 175.10 174.80 1til s SER 65 N -1.24 3.99 0.40 3.32 0.01 0.07 -2.62 113.70 117.63 1til s SER 65 Ca 0.39 -1.32 0.03 0.00 1.31 0.00 0.00 55.95 56.36 1til s SER 65 Cb -0.23 -1.22 -0.00 0.00 0.21 0.00 0.00 66.02 64.78 1til s SER 65 CO 0.27 -0.26 0.58 -0.63 0.41 0.00 0.00 173.24 173.61 1til s ILE 66 N 1.35 3.95 -0.30 1.44 1.01 0.91 -1.51 121.20 128.05 1til s ILE 66 Ca -0.03 -0.75 -0.15 0.00 0.00 0.00 0.00 60.65 59.72 1til s ILE 66 Cb -0.19 -3.41 0.15 0.00 0.01 0.00 0.00 42.46 39.02 1til s ILE 66 CO -0.08 -0.23 0.93 -0.94 0.00 0.00 0.00 174.94 174.62 1til s SER 67 N -4.21 -0.65 0.12 3.58 1.04 -0.78 -1.31 113.70 111.49 1til s SER 67 Ca 0.47 0.93 0.09 0.00 0.48 0.00 0.00 55.95 57.92 1til s SER 67 Cb -0.10 1.59 -0.04 0.00 0.10 0.00 0.00 66.02 67.57 1til s SER 67 CO 0.35 -0.14 -0.16 -0.69 0.98 0.00 0.00 173.24 173.58 1til s VAL 68 N 2.14 2.97 -0.31 5.02 1.01 -0.32 -1.96 120.40 128.94 1til s VAL 68 Ca -0.05 -1.49 -0.03 0.00 0.00 0.00 0.00 61.98 60.41 1til s VAL 68 Cb -0.06 -2.38 0.11 0.00 0.00 0.00 0.00 36.38 34.05 1til s VAL 68 CO -0.17 0.07 0.16 -0.63 0.00 0.00 0.00 175.10 174.54 1til s ILE 69 N -1.24 -0.04 -0.05 2.22 1.01 -0.84 -2.05 121.20 120.21 1til s ILE 69 Ca 0.19 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.56 1til s ILE 69 Cb -0.10 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 1til s ILE 69 CO 0.11 -0.78 0.98 -0.63 0.00 0.00 0.00 174.94 174.62 1til s ILE 70 N 1.84 4.84 -0.30 2.92 -1.09 -0.89 -2.77 121.20 125.75 1til s ILE 70 Ca 0.11 2.02 -0.15 0.00 -2.23 0.00 0.00 60.65 60.41 1til s ILE 70 Cb -0.18 -4.30 0.18 0.00 -1.58 0.00 0.00 42.46 36.58 1til s ILE 70 CO -0.26 0.10 1.08 -0.70 -1.23 0.00 0.00 174.94 173.92 1til s GLU 71 N 1.44 0.20 0.00 2.79 2.12 -1.07 -2.63 118.70 121.54 1til s GLU 71 Ca 0.50 0.44 0.00 0.00 0.36 0.00 0.00 54.97 56.27 1til s GLU 71 Cb -0.20 0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.45 1til s GLU 71 CO 0.23 -0.12 0.00 -0.25 -0.54 0.00 0.00 175.26 174.58 1til n ASP 72 N 5.06 -2.56 0.00 -1.70 8.00 -1.26 -2.97 116.55 121.12 1til n ASP 72 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 1til n ASP 72 Cb 0.54 -0.99 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 1til n ASP 72 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1til n GLY 73 N -2.06 0.87 3.46 0.44 0.00 -1.26 -4.86 105.19 101.77 1til n GLY 73 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1til n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1til s VAL 74 N -2.01 2.61 -0.07 1.61 -7.23 -1.16 -0.50 120.40 113.66 1til s VAL 74 Ca 0.00 -1.85 0.01 0.00 -1.81 0.00 0.00 61.98 58.33 1til s VAL 74 Cb 0.00 -2.25 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 1til s VAL 74 CO 0.00 -0.07 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.95 1til s VAL 75 N -1.55 3.56 -0.38 1.32 1.01 0.23 -2.61 120.40 121.98 1til s VAL 75 Ca 0.21 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.69 1til s VAL 75 Cb -0.09 -2.45 0.11 0.00 0.00 0.00 0.00 36.38 33.95 1til s VAL 75 CO 0.11 0.59 0.11 -1.00 0.00 0.00 0.00 175.10 174.91 1til s HIS 76 N -0.67 3.18 0.19 5.22 3.76 -1.11 -0.77 115.29 125.09 1til s HIS 76 Ca 0.10 -2.79 -0.05 0.00 -0.15 0.00 0.00 55.06 52.17 1til s HIS 76 Cb -0.11 -2.63 -0.06 0.00 1.11 0.00 0.00 32.58 30.89 1til s HIS 76 CO 0.02 -0.89 0.44 -1.17 -0.85 0.00 0.00 174.74 172.29 1til s LEU 77 N 0.75 4.21 -0.19 0.89 2.96 0.12 -1.99 118.68 125.42 1til s LEU 77 Ca 0.12 0.64 -0.08 0.00 -0.22 0.00 0.00 54.13 54.60 1til s LEU 77 Cb -0.20 -3.39 0.08 0.00 0.50 0.00 0.00 46.19 43.17 1til s LEU 77 CO -0.09 -0.02 0.43 -0.89 -1.32 0.00 0.00 176.35 174.46 1til s THR 78 N -1.78 -0.44 -0.13 3.68 2.01 -0.83 -1.38 115.64 116.77 1til s THR 78 Ca 0.42 0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.57 1til s THR 78 Cb -0.12 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.74 1til s THR 78 CO 0.25 0.06 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.38 1til s VAL 79 N 2.22 1.72 0.03 3.82 1.01 -0.87 -1.87 120.40 126.46 1til s VAL 79 Ca -0.04 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.22 1til s VAL 79 Cb -0.11 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 1til s VAL 79 CO -0.13 0.48 -0.12 -0.60 0.00 0.00 0.00 175.10 174.73 1til s ARG 80 N 1.08 0.82 0.04 2.72 3.52 -0.57 -0.68 118.95 125.89 1til s ARG 80 Ca -0.03 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 54.87 1til s ARG 80 Cb -0.14 -0.78 -0.03 0.00 -1.56 0.00 0.00 34.95 32.44 1til s ARG 80 CO -0.05 0.19 0.01 0.16 -0.81 0.00 0.00 175.30 174.80 1til s ASP 81 N -1.06 0.32 -0.63 -2.12 1.47 -0.16 -0.75 116.67 113.74 1til s ASP 81 Ca -0.00 -0.73 -0.01 0.00 1.18 0.00 0.00 52.55 52.99 1til s ASP 81 Cb -0.07 0.19 0.45 0.00 -0.34 0.00 0.00 42.92 43.14 1til s ASP 81 CO 0.01 -0.50 1.94 -0.62 0.68 0.00 0.00 175.17 176.68 1til n GLU 82 N 0.69 2.80 -0.27 2.11 -0.58 -1.26 -1.81 120.64 122.31 1til n GLU 82 Ca -0.18 -3.40 0.00 0.00 -0.42 0.00 0.00 57.16 53.16 1til n GLU 82 Cb 0.59 -2.29 0.00 0.00 -0.57 0.00 0.00 31.44 29.17 1til n GLU 82 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1til n GLY 83 N -0.88 0.12 0.43 0.62 0.00 -1.25 -4.69 105.19 99.53 1til n GLY 83 Ca 0.60 -1.83 0.24 0.00 0.00 0.00 0.00 46.02 45.04 1til n GLY 83 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1til h VAL 84 N -0.43 0.64 0.00 1.61 2.07 -1.47 -3.01 116.25 115.66 1til h VAL 84 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1til h VAL 84 Cb 0.00 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1til h VAL 84 CO 0.00 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.21 1til n GLY 85 N -1.66 -1.46 3.32 2.17 0.00 -1.26 -0.03 105.19 106.27 1til n GLY 85 Ca 0.15 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.24 1til n GLY 85 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1til s ILE 86 N -2.26 3.73 0.11 -0.61 1.01 -1.26 -4.80 121.20 117.12 1til s ILE 86 Ca 0.00 -0.68 -0.26 0.00 0.00 0.00 0.00 60.65 59.71 1til s ILE 86 Cb 0.00 -2.87 -0.10 0.00 0.01 0.00 0.00 42.46 39.50 1til s ILE 86 CO 0.00 0.17 1.66 -0.65 0.00 0.00 0.00 174.94 176.12 1til h PRO 87 N 8.18 -0.38 -3.67 2.79 0.11 -1.95 -3.38 132.00 133.70 1til h PRO 87 Ca -0.34 0.03 -0.62 0.00 0.11 0.00 0.00 66.00 65.18 1til h PRO 87 Cb 1.13 0.09 -0.40 0.00 0.11 0.00 0.00 31.00 31.93 1til h PRO 87 CO 0.60 -0.25 -0.73 0.34 -0.21 0.00 0.00 178.00 177.75 1til s ASP 88 N -4.87 4.15 0.16 -2.05 -1.08 -1.26 -4.98 116.67 106.74 1til s ASP 88 Ca -0.15 -2.22 -0.15 0.00 -0.52 0.00 0.00 52.55 49.51 1til s ASP 88 Cb 0.07 -1.21 0.07 0.00 -1.46 0.00 0.00 42.92 40.40 1til s ASP 88 CO 0.65 -0.34 1.78 0.40 0.52 0.00 0.00 175.17 178.18 1til h ILE 89 N 6.05 0.98 -0.54 4.11 2.04 -1.97 -2.04 117.51 126.15 1til h ILE 89 Ca -0.07 -0.15 0.10 0.00 1.00 0.00 0.00 64.86 65.75 1til h ILE 89 Cb 0.98 0.52 -0.11 0.00 -0.74 0.00 0.00 36.82 37.47 1til h ILE 89 CO 0.51 0.08 -0.30 -0.33 0.00 0.00 0.00 178.15 178.11 1til h GLU 90 N 0.43 -0.16 -0.35 2.37 4.39 -1.97 -1.62 114.58 117.67 1til h GLU 90 Ca 0.17 0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.82 1til h GLU 90 Cb 0.07 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1til h GLU 90 CO -0.12 -0.10 -0.04 1.49 -1.16 0.00 0.00 179.01 179.08 1til h GLU 91 N -0.16 0.64 -0.91 2.33 4.81 -1.96 -3.02 114.58 116.30 1til h GLU 91 Ca 0.23 -0.22 0.22 0.00 -0.13 0.00 0.00 59.36 59.45 1til h GLU 91 Cb 0.53 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.80 1til h GLU 91 CO -0.63 0.78 0.61 0.00 -0.73 0.00 0.00 179.01 179.04 1til h ALA 92 N 0.84 2.34 -0.00 2.92 0.00 -0.57 0.20 119.26 124.98 1til h ALA 92 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1til h ALA 92 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1til h ALA 92 CO 0.03 -0.63 -0.05 0.54 0.00 0.00 0.00 179.25 179.14 1til n ARG 93 N -4.47 0.55 -2.26 0.00 1.74 -0.71 -4.82 116.66 106.69 1til n ARG 93 Ca 0.20 -0.08 -0.41 0.00 -0.77 0.00 0.00 57.85 56.78 1til n ARG 93 Cb 0.77 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.68 1til n ARG 93 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1til s GLN 94 N -2.51 4.40 0.16 5.56 -0.21 0.71 -4.49 119.66 123.28 1til s GLN 94 Ca 0.30 2.00 -0.34 0.00 0.02 0.00 0.00 55.36 57.34 1til s GLN 94 Cb 0.20 -3.22 -0.14 0.00 1.00 0.00 0.00 33.01 30.85 1til s GLN 94 CO 0.46 -0.25 1.57 -0.35 -2.12 0.00 0.00 175.29 174.60 1til n PRO 95 N 2.88 2.10 -0.43 2.91 -0.04 -1.26 -1.55 135.00 139.61 1til n PRO 95 Ca 0.07 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.28 1til n PRO 95 Cb 0.43 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 1til n PRO 95 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1til n LEU 96 N 3.37 0.00 -4.71 1.53 4.77 -0.37 -5.01 117.00 116.58 1til n LEU 96 Ca 0.17 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.73 1til n LEU 96 Cb 0.28 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 1til n LEU 96 CO 0.63 0.00 0.81 0.12 -1.33 0.00 0.00 177.39 177.62 1til s PHE 97 N -3.37 3.50 -0.00 -1.77 5.36 -0.59 -4.64 117.98 116.47 1til s PHE 97 Ca 0.00 1.45 -0.18 0.00 -0.96 0.00 0.00 56.93 57.24 1til s PHE 97 Cb 0.00 -3.30 0.03 0.00 -0.34 0.00 0.00 43.02 39.41 1til s PHE 97 CO 0.00 -0.77 0.38 -0.08 -1.46 0.00 0.00 175.22 173.29 1til s THR 98 N 1.19 0.05 -0.76 0.12 -1.32 -1.26 -4.60 115.64 109.06 1til s THR 98 Ca 0.56 -0.42 0.13 0.00 -1.21 0.00 0.00 61.69 60.75 1til s THR 98 Cb -0.25 -0.76 0.40 0.00 -1.51 0.00 0.00 72.50 70.37 1til s THR 98 CO 0.28 -0.23 1.33 0.35 -2.21 0.00 0.00 174.62 174.13 1til n THR 99 N 1.02 1.40 -2.56 5.08 -2.24 -1.26 -4.54 114.28 111.18 1til n THR 99 Ca -0.20 -1.25 -0.15 0.00 -2.27 0.00 0.00 64.05 60.18 1til n THR 99 Cb 0.57 0.27 0.02 0.00 -2.10 0.00 0.00 70.33 69.10 1til n THR 99 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1til n LYS 100 N 0.30 2.23 0.10 -0.78 4.76 -1.26 -4.90 118.16 118.60 1til n LYS 100 Ca 0.15 -3.78 0.16 0.00 -2.87 0.00 0.00 58.31 51.97 1til n LYS 100 Cb 0.58 -1.73 0.69 0.00 -1.84 0.00 0.00 35.03 32.73 1til n LYS 100 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1til h PRO 101 N 2.70 0.00 0.00 1.97 0.13 -1.86 -0.84 132.00 134.11 1til h PRO 101 Ca 0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.17 1til h PRO 101 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1til h PRO 101 CO 0.58 0.00 -0.17 0.93 -0.23 0.00 0.00 178.00 179.11 1til h GLU 102 N 0.00 0.00 -1.95 0.86 3.07 -1.96 -2.99 114.58 111.61 1til h GLU 102 Ca 0.16 0.00 -0.75 0.00 -0.50 0.00 0.00 59.36 58.27 1til h GLU 102 Cb 0.67 0.00 -0.29 0.00 -0.84 0.00 0.00 28.75 28.30 1til h GLU 102 CO -0.00 0.17 0.89 1.28 -1.40 0.00 0.00 179.01 179.95 1til n LEU 103 N -3.53 7.26 -3.38 1.33 4.77 -0.32 -4.92 117.00 118.20 1til n LEU 103 Ca -0.01 -4.88 -0.14 0.00 -0.03 0.00 0.00 56.01 50.95 1til n LEU 103 Cb 0.32 -1.01 -0.03 0.00 -2.33 0.00 0.00 43.42 40.37 1til n LEU 103 CO 0.31 1.81 -0.17 -0.62 -1.33 0.00 0.00 177.39 177.39 1til n GLU 104 N -0.53 -0.92 -3.12 3.23 1.02 -1.13 -4.85 120.64 114.34 1til n GLU 104 Ca 0.53 -0.03 -0.44 0.00 -0.02 0.00 0.00 57.16 57.20 1til n GLU 104 Cb 0.27 -1.25 -0.06 0.00 -0.02 0.00 0.00 31.44 30.38 1til n GLU 104 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1til s ARG 105 N -5.07 3.15 0.50 3.49 3.00 -1.24 -4.92 118.95 117.86 1til s ARG 105 Ca 0.04 -0.81 0.26 0.00 0.00 0.00 0.00 55.73 55.22 1til s ARG 105 Cb -0.02 -4.09 1.33 0.00 0.00 0.00 0.00 34.95 32.16 1til s ARG 105 CO 0.41 -1.26 1.90 0.66 0.00 0.00 0.00 175.30 177.02 1til h SER 106 N 9.04 0.13 0.00 0.23 4.64 -1.93 -3.45 113.55 122.21 1til h SER 106 Ca -0.27 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1til h SER 106 Cb 1.09 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1til h SER 106 CO 0.98 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 177.61 1til n GLY 107 N -1.63 0.67 0.04 -0.77 0.00 -1.26 -4.37 105.19 97.87 1til n GLY 107 Ca 0.17 -0.73 0.10 0.00 0.00 0.00 0.00 46.02 45.55 1til n GLY 107 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1til n MET 108 N -1.21 0.39 0.00 1.61 2.81 -1.26 -1.24 117.12 118.21 1til n MET 108 Ca 0.00 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.81 1til n MET 108 Cb 0.35 -1.46 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 1til n MET 108 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1til n GLY 109 N 1.47 -2.65 0.25 3.03 0.00 -1.26 -1.38 105.19 104.64 1til n GLY 109 Ca 0.04 0.52 -0.01 0.00 0.00 0.00 0.00 46.02 46.58 1til n GLY 109 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1til h PHE 110 N 0.00 0.60 -0.71 1.61 0.05 -1.89 -1.81 116.94 114.79 1til h PHE 110 Ca 0.00 0.03 0.10 0.00 3.82 0.00 0.00 57.97 61.91 1til h PHE 110 Cb 0.00 -0.17 -0.05 0.00 2.00 0.00 0.00 35.95 37.73 1til h PHE 110 CO -0.52 0.25 0.47 1.15 -0.18 0.00 0.00 178.31 179.48 1til h THR 111 N 0.59 0.93 0.19 -1.55 2.02 -1.66 0.20 112.91 113.63 1til h THR 111 Ca 0.30 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 1til h THR 111 Cb 0.26 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1til h THR 111 CO -0.22 0.11 -0.09 0.40 0.37 0.00 0.00 175.52 176.09 1til h ILE 112 N 0.60 0.90 -0.53 3.11 2.04 -0.37 -2.54 117.51 120.72 1til h ILE 112 Ca 0.33 -0.49 0.07 0.00 1.00 0.00 0.00 64.86 65.76 1til h ILE 112 Cb 0.48 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.70 1til h ILE 112 CO -0.11 0.11 0.22 0.24 0.00 0.00 0.00 178.15 178.60 1til h MET 113 N -0.50 0.40 -0.61 2.37 2.86 -0.84 0.22 114.93 118.82 1til h MET 113 Ca -0.03 -0.02 0.12 0.00 -2.06 0.00 0.00 59.70 57.71 1til h MET 113 Cb 0.38 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 1til h MET 113 CO 0.04 0.27 0.41 0.93 1.06 0.00 0.00 176.91 179.62 1til h GLU 114 N 0.41 0.32 0.08 1.72 5.08 -0.58 -1.62 114.58 120.01 1til h GLU 114 Ca 0.25 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.41 1til h GLU 114 Cb 0.25 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1til h GLU 114 CO -0.23 0.21 -0.90 -0.91 -1.00 0.00 0.00 179.01 176.18 1til h ASN 115 N 0.33 0.27 0.81 1.42 -0.26 -0.73 -3.37 115.58 114.05 1til h ASN 115 Ca 0.29 -0.87 0.00 0.00 -0.56 0.00 0.00 56.30 55.16 1til h ASN 115 Cb 0.69 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.86 1til h ASN 115 CO -0.07 1.40 0.00 0.49 -1.06 0.00 0.00 177.43 178.19 1til n PHE 116 N -4.20 0.00 -4.43 1.19 0.99 -0.08 -4.84 117.46 106.09 1til n PHE 116 Ca -0.19 0.00 -0.23 0.00 -0.00 0.00 0.00 57.45 57.03 1til n PHE 116 Cb 0.76 -0.49 -0.10 0.00 -1.00 0.00 0.00 39.48 38.65 1til n PHE 116 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.76 175.12 1til s MET 117 N -2.98 1.57 0.00 -1.08 -1.94 -0.63 -4.80 119.30 109.44 1til s MET 117 Ca 0.12 -1.70 0.28 0.00 -1.71 0.00 0.00 55.69 52.68 1til s MET 117 Cb 0.16 -1.59 1.11 0.00 2.01 0.00 0.00 34.83 36.52 1til s MET 117 CO 0.44 0.29 1.80 -0.25 -0.01 0.00 0.00 175.02 177.29 1til n ASP 118 N -0.51 0.32 -3.57 3.03 8.00 -0.72 -4.83 116.55 118.28 1til n ASP 118 Ca -0.06 -0.21 0.01 0.00 0.71 0.00 0.00 54.79 55.24 1til n ASP 118 Cb 0.60 -0.14 -0.06 0.00 -0.02 0.00 0.00 41.12 41.51 1til n ASP 118 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1til s GLU 119 N -2.72 0.14 -0.11 -1.24 2.12 -1.18 -4.96 118.70 110.76 1til s GLU 119 Ca 0.22 0.26 0.02 0.00 0.36 0.00 0.00 54.97 55.83 1til s GLU 119 Cb 0.19 0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.65 1til s GLU 119 CO 0.53 -0.03 -0.18 0.08 -0.54 0.00 0.00 175.26 175.12 1til s VAL 120 N 1.34 1.69 -0.18 3.70 1.01 -1.26 -1.57 120.40 125.13 1til s VAL 120 Ca -0.07 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1til s VAL 120 Cb -0.03 -1.51 0.04 0.00 0.00 0.00 0.00 36.38 34.89 1til s VAL 120 CO -0.12 0.48 -0.09 -0.63 0.00 0.00 0.00 175.10 174.74 1til s ILE 121 N 0.75 1.46 -0.20 2.22 -1.09 -0.20 -4.97 121.20 119.18 1til s ILE 121 Ca -0.11 -0.85 -0.08 0.00 -2.23 0.00 0.00 60.65 57.38 1til s ILE 121 Cb -0.16 -1.56 -0.04 0.00 -1.58 0.00 0.00 42.46 39.13 1til s ILE 121 CO 0.02 0.18 0.07 -0.69 -1.23 0.00 0.00 174.94 173.29 1til s VAL 122 N 1.48 4.80 -0.11 2.92 1.01 -1.26 -0.58 120.40 128.65 1til s VAL 122 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1til s VAL 122 Cb -0.16 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.07 1til s VAL 122 CO -0.08 0.43 -0.09 -1.61 0.00 0.00 0.00 175.10 173.75 1til s GLU 123 N 0.58 1.65 0.07 2.72 2.02 -0.61 -5.02 118.70 120.11 1til s GLU 123 Ca 0.04 -0.32 -0.08 0.00 0.02 0.00 0.00 54.97 54.63 1til s GLU 123 Cb -0.13 -1.62 -0.00 0.00 0.10 0.00 0.00 34.13 32.47 1til s GLU 123 CO 0.01 -0.22 0.17 0.45 0.02 0.00 0.00 175.26 175.69 1til s SER 124 N 1.52 0.13 -0.15 -0.19 0.15 -1.26 -0.31 113.70 113.59 1til s SER 124 Ca 0.02 -0.60 -0.06 0.00 0.70 0.00 0.00 55.95 56.01 1til s SER 124 Cb -0.13 0.31 0.07 0.00 -1.71 0.00 0.00 66.02 64.56 1til s SER 124 CO -0.07 -0.67 0.33 -0.70 1.20 0.00 0.00 173.24 173.33 1til s GLU 125 N -3.48 0.25 -0.19 5.44 2.12 -0.83 -4.78 118.70 117.21 1til s GLU 125 Ca 0.02 0.80 -0.41 0.00 0.36 0.00 0.00 54.97 55.74 1til s GLU 125 Cb 0.03 0.05 -0.18 0.00 0.26 0.00 0.00 34.13 34.30 1til s GLU 125 CO -0.09 -0.23 1.47 0.28 -0.54 0.00 0.00 175.26 176.14 1til n VAL 126 N 4.99 0.09 0.00 3.70 0.31 -1.26 -0.29 118.33 125.86 1til n VAL 126 Ca -0.13 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1til n VAL 126 Cb 0.51 -0.67 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 1til n VAL 126 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1til n ASN 127 N 3.51 0.00 0.00 4.52 3.02 0.96 -4.79 115.26 122.48 1til n ASN 127 Ca 0.24 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.79 1til n ASN 127 Cb 0.08 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 1til n ASN 127 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1til n LYS 128 N -1.95 0.00 -3.49 3.52 4.81 0.60 -4.82 118.16 116.83 1til n LYS 128 Ca 0.00 0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 1til n LYS 128 Cb 0.00 -0.81 0.00 0.00 0.02 0.00 0.00 35.03 34.24 1til n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1til n GLY 129 N 2.01 -1.87 3.10 3.14 0.00 -1.01 -3.94 105.19 106.61 1til n GLY 129 Ca 0.00 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.66 1til n GLY 129 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1til s THR 130 N -2.19 1.06 -0.09 2.61 2.01 -0.75 -1.97 115.64 116.32 1til s THR 130 Ca 0.00 -0.57 -0.03 0.00 0.31 0.00 0.00 61.69 61.40 1til s THR 130 Cb 0.00 -0.89 0.04 0.00 0.01 0.00 0.00 72.50 71.66 1til s THR 130 CO 0.00 0.30 0.05 -0.89 -0.69 0.00 0.00 174.62 173.39 1til s THR 131 N -0.31 0.04 -0.22 -0.82 2.01 0.58 -0.99 115.64 115.94 1til s THR 131 Ca 0.05 0.15 -0.10 0.00 0.31 0.00 0.00 61.69 62.11 1til s THR 131 Cb -0.05 -0.39 -0.05 0.00 0.01 0.00 0.00 72.50 72.02 1til s THR 131 CO -0.00 0.06 0.13 -0.69 -0.69 0.00 0.00 174.62 173.42 1til s VAL 132 N 2.10 5.23 -0.29 3.82 1.01 0.15 -1.57 120.40 130.86 1til s VAL 132 Ca 0.04 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.09 1til s VAL 132 Cb -0.13 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.85 1til s VAL 132 CO -0.05 0.40 0.06 -0.31 0.00 0.00 0.00 175.10 175.19 1til s TYR 133 N 0.72 3.13 -0.22 5.22 1.51 0.25 -2.04 117.35 125.91 1til s TYR 133 Ca 0.07 -1.03 -0.02 0.00 -1.01 0.00 0.00 57.07 55.09 1til s TYR 133 Cb -0.12 -2.22 0.01 0.00 -0.11 0.00 0.00 41.96 39.51 1til s TYR 133 CO 0.01 -0.58 -0.09 -0.51 -1.11 0.00 0.00 175.55 173.27 1til s LEU 134 N 1.48 2.82 -0.00 -1.29 1.43 -0.48 -1.03 118.68 121.61 1til s LEU 134 Ca 0.03 -0.65 -0.00 0.00 -1.03 0.00 0.00 54.13 52.47 1til s LEU 134 Cb -0.17 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1til s LEU 134 CO 0.01 -0.06 0.09 -0.75 0.23 0.00 0.00 176.35 175.88 1til s LYS 135 N 1.37 3.09 -0.28 1.70 2.20 -0.61 0.12 119.74 127.33 1til s LYS 135 Ca 0.03 -0.48 -0.04 0.00 -0.36 0.00 0.00 55.97 55.12 1til s LYS 135 Cb -0.15 -2.87 0.16 0.00 -1.51 0.00 0.00 37.83 33.45 1til s LYS 135 CO -0.06 0.65 0.57 0.21 -0.36 0.00 0.00 175.35 176.35 1til s LYS 136 N -1.77 0.52 0.38 4.03 2.47 0.05 -1.76 119.74 123.66 1til s LYS 136 Ca 0.23 1.06 -0.24 0.00 -1.56 0.00 0.00 55.97 55.46 1til s LYS 136 Cb -0.12 0.48 -0.09 0.00 -1.46 0.00 0.00 37.83 36.63 1til s LYS 136 CO 0.15 -0.48 1.01 -1.58 0.16 0.00 0.00 175.35 174.60 1til s HIS 137 N 2.81 3.41 -0.02 4.03 5.65 -1.26 0.76 115.29 130.65 1til s HIS 137 Ca 0.11 1.68 0.05 0.00 0.25 0.00 0.00 55.06 57.15 1til s HIS 137 Cb -0.14 -3.04 -0.03 0.00 -1.18 0.00 0.00 32.58 28.19 1til s HIS 137 CO -0.19 -0.32 -0.17 0.42 -0.65 0.00 0.00 174.74 173.83 1til s ILE 138 N -1.68 2.87 -0.28 0.89 -1.09 0.35 -4.89 121.20 117.38 1til s ILE 138 Ca 0.55 -0.88 -0.15 0.00 -2.23 0.00 0.00 60.65 57.95 1til s ILE 138 Cb -0.20 -2.13 -0.03 0.00 -1.58 0.00 0.00 42.46 38.51 1til s ILE 138 CO 0.25 0.53 0.37 -0.69 -1.23 0.00 0.00 174.94 174.17 1til s VAL 139 N -0.76 5.17 -2.49 2.92 1.01 -1.26 -4.81 120.40 120.18 1til s VAL 139 Ca 0.12 0.52 0.28 0.00 0.00 0.00 0.00 61.98 62.90 1til s VAL 139 Cb -0.10 -3.71 0.56 0.00 0.00 0.00 0.00 36.38 33.13 1til s VAL 139 CO 0.01 0.13 1.76 0.29 0.00 0.00 0.00 175.10 177.30