#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2sgf s SER 17 N 0.00 1.50 0.22 9.51 1.04 -1.26 -2.28 113.70 122.42 2sgf s SER 17 Ca 0.00 -1.69 -0.32 0.00 0.48 0.00 0.00 55.95 54.42 2sgf s SER 17 Cb 0.00 0.60 -0.13 0.00 0.10 0.00 0.00 66.02 66.59 2sgf s SER 17 CO 0.00 -1.16 1.54 0.61 0.98 0.00 0.00 173.24 175.21 2sgf n GLY 18 N -0.62 1.10 0.11 7.32 0.00 -0.20 -2.12 105.19 110.78 2sgf n GLY 18 Ca 0.05 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.63 2sgf n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sgf n GLY 19 N 2.83 2.50 3.79 -0.02 0.00 0.94 -2.61 105.19 112.61 2sgf n GLY 19 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2sgf n GLY 19 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2sgf s ASP 29 N -1.31 5.30 0.44 1.61 1.01 -0.90 -2.52 116.67 120.30 2sgf s ASP 29 Ca 0.00 1.87 -0.24 0.00 0.71 0.00 0.00 52.55 54.89 2sgf s ASP 29 Cb 0.00 -2.53 -0.08 0.00 1.01 0.00 0.00 42.92 41.32 2sgf s ASP 29 CO 0.00 -1.49 1.24 0.00 0.21 0.00 0.00 175.17 175.13 2sgf s ALA 30 N -2.53 3.10 0.01 5.23 0.00 -1.26 -0.60 121.76 125.71 2sgf s ALA 30 Ca 0.64 1.10 0.04 0.00 0.00 0.00 0.00 51.96 53.74 2sgf s ALA 30 Cb -0.18 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.48 2sgf s ALA 30 CO 0.43 -0.78 -0.12 0.96 0.00 0.00 0.00 175.76 176.25 2sgf s ILE 31 N -1.38 0.91 -0.06 0.00 -4.36 -0.53 -4.78 121.20 111.01 2sgf s ILE 31 Ca 0.61 -0.71 0.03 0.00 -0.26 0.00 0.00 60.65 60.32 2sgf s ILE 31 Cb -0.34 -0.81 0.00 0.00 1.25 0.00 0.00 42.46 42.57 2sgf s ILE 31 CO 0.43 0.10 -0.16 -0.31 0.24 0.00 0.00 174.94 175.23 2sgf s TYR 32 N -0.57 1.73 0.00 1.37 1.51 -0.27 -0.17 117.35 120.95 2sgf s TYR 32 Ca 0.02 -0.58 0.00 0.00 -1.01 0.00 0.00 57.07 55.50 2sgf s TYR 32 Cb -0.06 -1.19 0.00 0.00 -0.11 0.00 0.00 41.96 40.60 2sgf s TYR 32 CO 0.00 -0.24 0.00 -1.13 -1.11 0.00 0.00 175.55 173.07 2sgf n SER 33 N 3.45 1.25 0.18 2.29 3.41 -0.74 -0.05 113.62 123.40 2sgf n SER 33 Ca -0.20 -0.42 0.05 0.00 -0.26 0.00 0.00 58.87 58.04 2sgf n SER 33 Cb 0.53 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.72 2sgf n SER 33 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2sgf h SER 34 N 0.00 0.00 0.14 4.04 4.64 -1.94 -3.31 113.55 117.12 2sgf h SER 34 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 2sgf h SER 34 Cb 0.00 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.03 2sgf h SER 34 CO 0.00 0.39 -2.18 0.35 -0.87 0.00 0.00 176.83 174.52 2sgf n THR 39 N -3.39 1.51 -2.41 2.95 -2.24 -1.26 -5.11 114.28 104.33 2sgf n THR 39 Ca 0.01 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 2sgf n THR 39 Cb 0.58 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 2sgf n THR 39 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2sgf n GLY 40 N 1.82 1.41 3.17 3.38 0.00 -1.25 -5.16 105.19 108.56 2sgf n GLY 40 Ca -0.31 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 44.91 2sgf n GLY 40 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2sgf s ARG 41 N 1.33 1.94 0.00 1.61 3.52 -1.26 -1.79 118.95 124.30 2sgf s ARG 41 Ca 0.00 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 54.92 2sgf s ARG 41 Cb 0.00 -1.68 0.00 0.00 -1.56 0.00 0.00 34.95 31.71 2sgf s ARG 41 CO 0.00 0.29 0.00 0.00 -0.81 0.00 0.00 175.30 174.78 2sgf s SER 43 N -0.11 2.93 0.16 0.00 0.01 0.02 -1.46 113.70 115.25 2sgf s SER 43 Ca 0.00 -0.79 -0.30 0.00 1.31 0.00 0.00 55.95 56.17 2sgf s SER 43 Cb 0.00 -0.19 -0.07 0.00 0.21 0.00 0.00 66.02 65.97 2sgf s SER 43 CO 0.00 0.07 1.08 -0.22 0.41 0.00 0.00 173.24 174.58 2sgf s LEU 44 N -2.33 4.49 0.00 2.44 0.20 0.23 -3.88 118.68 119.83 2sgf s LEU 44 Ca 0.14 2.03 0.00 0.00 0.69 0.00 0.00 54.13 56.99 2sgf s LEU 44 Cb -0.08 -3.60 0.00 0.00 -0.43 0.00 0.00 46.19 42.08 2sgf s LEU 44 CO 0.07 -0.20 0.00 0.61 -0.29 0.00 0.00 176.35 176.54 2sgf n GLY 45 N 2.13 1.30 2.97 7.98 0.00 0.13 -0.04 105.19 119.65 2sgf n GLY 45 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 2sgf n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2sgf s PHE 46 N -0.04 0.36 0.07 1.61 0.08 -1.19 -3.93 117.98 114.95 2sgf s PHE 46 Ca 0.00 -0.30 -0.29 0.00 0.12 0.00 0.00 56.93 56.46 2sgf s PHE 46 Cb 0.00 -0.23 -0.05 0.00 -0.57 0.00 0.00 43.02 42.17 2sgf s PHE 46 CO 0.00 -0.07 0.93 -0.80 -0.10 0.00 0.00 175.22 175.17 2sgf s ASN 47 N -0.84 7.42 0.13 1.36 0.01 -1.26 -1.28 114.94 120.47 2sgf s ASN 47 Ca -0.06 1.70 -0.01 0.00 -0.71 0.00 0.00 52.86 53.77 2sgf s ASN 47 Cb -0.06 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.00 2sgf s ASN 47 CO -0.00 -0.09 0.06 0.68 -1.51 0.00 0.00 177.10 176.24 2sgf s VAL 48 N 0.20 0.11 0.15 1.60 -7.23 -0.17 -4.30 120.40 110.76 2sgf s VAL 48 Ca 0.46 -1.89 -0.13 0.00 -1.81 0.00 0.00 61.98 58.62 2sgf s VAL 48 Cb -0.22 -2.02 0.01 0.00 0.56 0.00 0.00 36.38 34.71 2sgf s VAL 48 CO 0.28 -0.48 0.35 0.00 -0.31 0.00 0.00 175.10 174.94 2sgf s ARG 48 N -4.04 1.14 -0.10 4.82 1.70 -0.38 -1.04 118.95 121.04 2sgf s ARG 48 Ca 0.23 -0.96 -0.03 0.00 -0.47 0.00 0.00 55.73 54.50 2sgf s ARG 48 Cb 0.07 0.43 0.04 0.00 -0.57 0.00 0.00 34.95 34.93 2sgf s ARG 48 CO 0.01 -0.44 0.08 0.45 -1.08 0.00 0.00 175.30 174.32 2sgf s SER 48 N -2.89 1.68 1.88 -2.89 0.15 0.45 -1.40 113.70 110.67 2sgf s SER 48 Ca 0.10 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.52 2sgf s SER 48 Cb 0.02 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 2sgf s SER 48 CO -0.05 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.70 2sgf n GLY 48 N 5.29 4.03 1.32 9.45 0.00 -1.26 -0.16 105.19 123.86 2sgf n GLY 48 Ca -0.05 0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2sgf n GLY 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2sgf n SER 48 N 9.11 3.88 -4.52 1.61 3.41 -1.26 -4.92 113.62 120.94 2sgf n SER 48 Ca 0.00 -2.00 -0.35 0.00 -0.26 0.00 0.00 58.87 56.26 2sgf n SER 48 Cb 0.00 -0.45 -0.11 0.00 -0.26 0.00 0.00 64.21 63.38 2sgf n SER 48 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2sgf s THR 49 N -1.07 4.40 -0.08 6.66 2.01 0.77 -5.07 115.64 123.27 2sgf s THR 49 Ca 0.47 -0.16 -0.08 0.00 0.31 0.00 0.00 61.69 62.24 2sgf s THR 49 Cb 0.25 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 2sgf s THR 49 CO 0.33 0.41 0.20 -0.31 -0.69 0.00 0.00 174.62 174.56 2sgf s TYR 50 N 0.95 3.62 0.25 4.92 1.51 -1.26 -0.41 117.35 126.92 2sgf s TYR 50 Ca 0.03 0.60 -0.01 0.00 -1.01 0.00 0.00 57.07 56.68 2sgf s TYR 50 Cb -0.14 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.69 2sgf s TYR 50 CO 0.03 0.70 0.25 0.71 -1.11 0.00 0.00 175.55 176.13 2sgf s TYR 51 N -1.09 1.16 0.05 2.71 1.51 -0.21 -1.35 117.35 120.13 2sgf s TYR 51 Ca 0.19 -1.34 0.04 0.00 -1.01 0.00 0.00 57.07 54.95 2sgf s TYR 51 Cb -0.13 -0.43 -0.02 0.00 -0.11 0.00 0.00 41.96 41.26 2sgf s TYR 51 CO 0.08 -0.80 -0.12 -0.59 -1.11 0.00 0.00 175.55 173.01 2sgf s PHE 52 N -3.86 1.04 0.14 2.71 -0.12 -0.41 -0.99 117.98 116.48 2sgf s PHE 52 Ca 0.36 -0.40 -0.03 0.00 -0.05 0.00 0.00 56.93 56.82 2sgf s PHE 52 Cb 0.04 -0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 41.77 2sgf s PHE 52 CO 0.16 0.01 0.34 -0.51 -0.05 0.00 0.00 175.22 175.17 2sgf s LEU 53 N -1.34 4.28 0.00 -1.99 1.43 -0.41 -1.12 118.68 119.53 2sgf s LEU 53 Ca -0.02 0.46 -0.01 0.00 -1.03 0.00 0.00 54.13 53.53 2sgf s LEU 53 Cb -0.09 -3.19 0.01 0.00 0.03 0.00 0.00 46.19 42.95 2sgf s LEU 53 CO 0.01 0.05 0.11 1.07 0.23 0.00 0.00 176.35 177.83 2sgf n THR 54 N -0.08 0.00 -2.48 5.49 5.66 -0.78 0.19 114.28 122.28 2sgf n THR 54 Ca -0.04 -0.25 -0.36 0.00 -3.05 0.00 0.00 64.05 60.35 2sgf n THR 54 Cb 0.52 0.19 -0.03 0.00 -1.55 0.00 0.00 70.33 69.45 2sgf n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2sgf s ALA 55 N -1.50 3.05 0.30 1.79 0.00 -1.26 -1.33 121.76 122.82 2sgf s ALA 55 Ca 0.04 0.75 0.02 0.00 0.00 0.00 0.00 51.96 52.77 2sgf s ALA 55 Cb -0.01 -3.29 0.49 0.00 0.00 0.00 0.00 23.12 20.31 2sgf s ALA 55 CO 0.03 -0.31 1.82 0.78 0.00 0.00 0.00 175.76 178.08 2sgf h GLY 56 N 2.35 0.66 2.00 0.00 0.00 -1.62 -1.79 103.07 104.67 2sgf h GLY 56 Ca -0.49 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.43 2sgf h GLY 56 CO 0.62 0.39 0.00 1.12 0.00 0.00 0.00 176.54 178.67 2sgf h HIS 57 N 0.58 0.00 0.13 5.60 2.07 -1.87 -0.15 115.15 121.52 2sgf h HIS 57 Ca 0.12 0.00 -0.35 0.00 -2.85 0.00 0.00 60.37 57.28 2sgf h HIS 57 Cb 0.40 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.37 2sgf h HIS 57 CO 0.02 0.00 -1.88 0.00 -3.07 0.00 0.00 177.93 172.99 2sgf h THR 59 N 0.08 0.28 -2.23 0.00 1.35 -0.82 -3.41 112.91 108.16 2sgf h THR 59 Ca -0.38 -1.10 -0.55 0.00 -0.55 0.00 0.00 66.41 63.82 2sgf h THR 59 Cb 2.05 1.89 0.01 0.00 -1.73 0.00 0.00 68.15 70.37 2sgf h THR 59 CO 0.12 0.14 1.33 -0.67 -0.25 0.00 0.00 175.52 176.18 2sgf n ASP 60 N -3.19 3.87 -0.15 5.36 2.03 -0.11 -1.55 116.55 122.81 2sgf n ASP 60 Ca 0.02 0.66 -0.02 0.00 0.52 0.00 0.00 54.79 55.97 2sgf n ASP 60 Cb 0.48 -1.54 -0.01 0.00 -0.72 0.00 0.00 41.12 39.33 2sgf n ASP 60 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2sgf n GLY 62 N 4.97 0.49 3.63 0.27 0.00 -1.26 -5.00 105.19 108.28 2sgf n GLY 62 Ca 0.23 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2sgf n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2sgf s ALA 63 N -1.82 3.11 -0.05 4.61 0.00 -0.59 -4.98 121.76 122.04 2sgf s ALA 63 Ca 0.00 -0.94 -0.09 0.00 0.00 0.00 0.00 51.96 50.93 2sgf s ALA 63 Cb 0.00 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 2sgf s ALA 63 CO 0.00 0.61 -0.17 0.25 0.00 0.00 0.00 175.76 176.45 2sgf n THR 64 N 1.75 1.29 -3.89 0.00 -2.24 -1.26 -4.55 114.28 105.38 2sgf n THR 64 Ca -0.16 0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.51 2sgf n THR 64 Cb 0.53 -1.93 -0.05 0.00 -2.10 0.00 0.00 70.33 66.78 2sgf n THR 64 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2sgf s THR 65 N -2.43 5.41 0.05 4.28 2.01 -1.26 -0.63 115.64 123.07 2sgf s THR 65 Ca -0.15 -0.18 0.08 0.00 0.31 0.00 0.00 61.69 61.76 2sgf s THR 65 Cb 0.03 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 2sgf s THR 65 CO 0.22 0.29 -0.23 0.26 -0.69 0.00 0.00 174.62 174.46 2sgf s TRP 66 N -1.37 2.01 0.26 4.92 0.52 -0.32 -4.23 118.94 120.73 2sgf s TRP 66 Ca 0.29 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 56.08 2sgf s TRP 66 Cb -0.13 -1.19 -0.06 0.00 -1.15 0.00 0.00 33.47 30.95 2sgf s TRP 66 CO 0.20 0.12 -0.06 -1.58 0.02 0.00 0.00 176.95 175.65 2sgf s TRP 67 N -0.84 1.86 -0.66 -1.98 0.51 0.92 -0.23 118.94 118.53 2sgf s TRP 67 Ca 0.09 -0.71 0.24 0.00 -2.12 0.00 0.00 56.10 53.61 2sgf s TRP 67 Cb -0.09 -1.03 0.40 0.00 -0.81 0.00 0.00 33.47 31.94 2sgf s TRP 67 CO 0.02 0.25 1.37 0.00 -0.51 0.00 0.00 176.95 178.08 2sgf n ALA 68 N -0.53 2.87 -2.18 0.98 0.00 0.75 -1.12 120.51 121.29 2sgf n ALA 68 Ca -0.06 -0.23 -0.08 0.00 0.00 0.00 0.00 53.44 53.07 2sgf n ALA 68 Cb 0.63 -1.20 -0.10 0.00 0.00 0.00 0.00 19.45 18.78 2sgf n ALA 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2sgf s ASN 78 N -4.21 0.69 0.60 0.00 4.22 -1.26 -4.81 114.94 110.18 2sgf s ASN 78 Ca 0.07 -0.96 0.37 0.00 -2.14 0.00 0.00 52.86 50.20 2sgf s ASN 78 Cb 0.13 0.16 1.93 0.00 1.28 0.00 0.00 41.25 44.75 2sgf s ASN 78 CO 0.71 -0.53 2.21 0.77 -2.04 0.00 0.00 177.10 178.22 2sgf h SER 79 N 3.21 0.00 1.01 3.54 4.64 -1.98 0.13 113.55 124.09 2sgf h SER 79 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2sgf h SER 79 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2sgf h SER 79 CO 0.64 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.62 2sgf n ALA 80 N -2.14 2.32 -3.50 5.18 0.00 -1.26 -4.90 120.51 116.21 2sgf n ALA 80 Ca -0.02 -0.10 -0.20 0.00 0.00 0.00 0.00 53.44 53.12 2sgf n ALA 80 Cb 0.16 -1.47 0.09 0.00 0.00 0.00 0.00 19.45 18.23 2sgf n ALA 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2sgf n ARG 81 N -1.53 -7.21 -0.04 0.00 3.00 0.44 -4.90 116.66 106.41 2sgf n ARG 81 Ca 0.07 0.84 -0.00 0.00 -0.01 0.00 0.00 57.85 58.74 2sgf n ARG 81 Cb 0.34 -5.86 -0.12 0.00 0.00 0.00 0.00 32.46 26.82 2sgf n ARG 81 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2sgf n THR 82 N -4.51 0.57 -3.60 0.55 -2.24 -1.26 -4.85 114.28 98.93 2sgf n THR 82 Ca -0.16 -0.52 -0.40 0.00 -2.27 0.00 0.00 64.05 60.71 2sgf n THR 82 Cb 0.62 -0.27 -0.11 0.00 -2.10 0.00 0.00 70.33 68.47 2sgf n THR 82 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2sgf s THR 83 N -2.70 4.62 0.42 4.28 2.01 -1.26 -5.05 115.64 117.96 2sgf s THR 83 Ca -0.07 -0.73 -0.22 0.00 0.31 0.00 0.00 61.69 60.98 2sgf s THR 83 Cb 0.07 -3.52 -0.10 0.00 0.01 0.00 0.00 72.50 68.96 2sgf s THR 83 CO 0.64 -0.16 0.99 -0.69 -0.69 0.00 0.00 174.62 174.71 2sgf s VAL 84 N 1.58 4.12 -0.11 3.82 1.01 -1.26 -0.18 120.40 129.38 2sgf s VAL 84 Ca 0.03 1.42 -0.08 0.00 0.00 0.00 0.00 61.98 63.35 2sgf s VAL 84 Cb -0.19 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 2sgf s VAL 84 CO 0.07 -0.19 -0.18 0.18 0.00 0.00 0.00 175.10 174.98 2sgf n LEU 85 N -0.47 1.20 0.00 3.92 4.77 0.69 -4.60 117.00 122.50 2sgf n LEU 85 Ca 0.07 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 2sgf n LEU 85 Cb 0.52 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2sgf n LEU 85 CO 0.40 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2sgf n GLY 86 N 2.22 -0.68 3.22 -0.72 0.00 -1.16 -0.70 105.19 107.37 2sgf n GLY 86 Ca -0.21 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 44.72 2sgf n GLY 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2sgf s THR 87 N -3.00 1.52 0.21 2.61 -4.23 -0.87 -1.18 115.64 110.70 2sgf s THR 87 Ca 0.00 -1.10 -0.32 0.00 -1.18 0.00 0.00 61.69 59.09 2sgf s THR 87 Cb 0.00 -1.32 -0.14 0.00 1.34 0.00 0.00 72.50 72.38 2sgf s THR 87 CO 0.00 0.19 1.46 0.41 -0.54 0.00 0.00 174.62 176.14 2sgf n THR 88 N 1.97 0.62 0.04 3.99 -1.04 0.20 -0.76 114.28 119.31 2sgf n THR 88 Ca -0.17 -0.16 0.02 0.00 -2.04 0.00 0.00 64.05 61.71 2sgf n THR 88 Cb 0.54 -1.47 -0.04 0.00 -1.82 0.00 0.00 70.33 67.54 2sgf n THR 88 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2sgf n SER 89 N 2.56 3.12 -3.53 8.00 7.64 -0.26 -4.80 113.62 126.34 2sgf n SER 89 Ca 0.13 -0.13 -0.13 0.00 1.01 0.00 0.00 58.87 59.76 2sgf n SER 89 Cb 0.30 1.18 -0.05 0.00 -1.01 0.00 0.00 64.21 64.64 2sgf n SER 89 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2sgf s GLY 90 N -2.34 -0.45 -0.23 0.23 0.00 -1.01 -4.97 107.32 98.56 2sgf s GLY 90 Ca -0.01 1.45 -0.13 0.00 0.00 0.00 0.00 44.72 46.03 2sgf s GLY 90 CO 0.20 0.80 0.57 -0.45 0.00 0.00 0.00 173.10 174.22 2sgf s SER 91 N -1.54 -0.76 -0.31 1.64 0.15 -1.26 -1.14 113.70 110.47 2sgf s SER 91 Ca -0.03 1.25 -0.02 0.00 0.70 0.00 0.00 55.95 57.85 2sgf s SER 91 Cb -0.00 1.13 0.10 0.00 -1.71 0.00 0.00 66.02 65.54 2sgf s SER 91 CO 0.01 -0.22 0.11 -0.55 1.20 0.00 0.00 173.24 173.79 2sgf s SER 93 N 1.55 3.86 -0.28 5.45 0.15 0.97 -4.99 113.70 120.41 2sgf s SER 93 Ca -0.10 -1.57 -0.23 0.00 0.70 0.00 0.00 55.95 54.76 2sgf s SER 93 Cb -0.07 -0.71 0.11 0.00 -1.71 0.00 0.00 66.02 63.65 2sgf s SER 93 CO -0.17 -0.42 0.91 0.12 1.20 0.00 0.00 173.24 174.89 2sgf s PHE 94 N 1.72 -0.62 0.00 3.44 5.36 -1.26 -1.83 117.98 124.80 2sgf s PHE 94 Ca 0.10 1.44 0.00 0.00 -0.96 0.00 0.00 56.93 57.51 2sgf s PHE 94 Cb -0.17 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.87 2sgf s PHE 94 CO -0.28 -0.30 0.00 -0.35 -1.46 0.00 0.00 175.22 172.83 2sgf n PRO 99 N 2.71 0.87 0.00 10.12 -0.04 -1.26 -4.96 135.00 142.44 2sgf n PRO 99 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2sgf n PRO 99 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 2sgf n PRO 99 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2sgf n ASN 100 N -0.37 0.00 -3.64 3.54 3.02 0.72 -4.77 115.26 113.77 2sgf n ASN 100 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.42 2sgf n ASN 100 Cb 0.00 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2sgf n ASN 100 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2sgf n ASN 101 N 3.95 1.60 -2.99 6.41 3.02 -1.26 -1.05 115.26 124.95 2sgf n ASN 101 Ca 0.00 -1.98 -0.16 0.00 -0.03 0.00 0.00 54.58 52.41 2sgf n ASN 101 Cb 0.00 -0.13 -0.02 0.00 -0.61 0.00 0.00 39.78 39.02 2sgf n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2sgf n ASP 102 N -2.26 -1.47 -3.88 6.41 2.03 -1.14 -4.01 116.55 112.23 2sgf n ASP 102 Ca 0.04 -2.94 -0.10 0.00 0.52 0.00 0.00 54.79 52.31 2sgf n ASP 102 Cb 0.35 0.59 -0.09 0.00 -0.72 0.00 0.00 41.12 41.25 2sgf n ASP 102 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2sgf s TYR 103 N -0.12 0.11 0.19 -0.67 -0.85 -0.76 -3.64 117.35 111.61 2sgf s TYR 103 Ca 0.33 -0.36 -0.13 0.00 -0.52 0.00 0.00 57.07 56.39 2sgf s TYR 103 Cb 0.17 -0.07 0.01 0.00 0.38 0.00 0.00 41.96 42.44 2sgf s TYR 103 CO -0.17 -0.40 0.42 0.20 -1.52 0.00 0.00 175.55 174.08 2sgf s GLY 104 N -2.08 0.26 -0.01 5.49 0.00 -0.44 -0.02 107.32 110.52 2sgf s GLY 104 Ca -0.05 -0.62 -0.01 0.00 0.00 0.00 0.00 44.72 44.04 2sgf s GLY 104 CO -0.04 -0.57 0.02 -1.50 0.00 0.00 0.00 173.10 171.01 2sgf s ILE 105 N -3.94 0.01 -0.10 0.90 2.07 -0.30 -1.86 121.20 117.99 2sgf s ILE 105 Ca 0.15 -0.05 0.04 0.00 -1.41 0.00 0.00 60.65 59.38 2sgf s ILE 105 Cb 0.01 -0.05 -0.00 0.00 0.13 0.00 0.00 42.46 42.54 2sgf s ILE 105 CO 0.01 -0.03 -0.24 -0.69 -1.91 0.00 0.00 174.94 172.08 2sgf s VAL 106 N -0.08 2.11 -0.10 4.00 1.01 -0.28 -1.10 120.40 125.96 2sgf s VAL 106 Ca -0.01 -1.01 -0.18 0.00 0.00 0.00 0.00 61.98 60.78 2sgf s VAL 106 Cb -0.01 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2sgf s VAL 106 CO -0.00 0.56 0.48 -0.60 0.00 0.00 0.00 175.10 175.54 2sgf s ARG 107 N 0.29 4.31 0.23 2.72 3.52 0.06 -1.29 118.95 128.79 2sgf s ARG 107 Ca -0.17 0.47 -0.30 0.00 -0.13 0.00 0.00 55.73 55.60 2sgf s ARG 107 Cb -0.17 -3.42 -0.09 0.00 -1.56 0.00 0.00 34.95 29.71 2sgf s ARG 107 CO 0.08 0.20 1.28 0.71 -0.81 0.00 0.00 175.30 176.77 2sgf s TYR 108 N 0.46 3.27 -0.00 5.12 2.02 -0.46 -2.04 117.35 125.72 2sgf s TYR 108 Ca 0.26 1.32 0.00 0.00 -0.37 0.00 0.00 57.07 58.28 2sgf s TYR 108 Cb -0.15 -3.57 -0.00 0.00 -0.40 0.00 0.00 41.96 37.84 2sgf s TYR 108 CO 0.11 -1.69 0.00 0.25 -1.57 0.00 0.00 175.55 172.66 2sgf n THR 109 N 2.18 0.00 -3.02 -0.71 -2.24 0.12 -4.89 114.28 105.73 2sgf n THR 109 Ca 0.04 -0.50 -0.41 0.00 -2.27 0.00 0.00 64.05 60.91 2sgf n THR 109 Cb 0.43 1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 2sgf n THR 109 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2sgf s ASN 110 N -0.99 6.64 0.17 3.42 3.04 -0.88 -4.95 114.94 121.39 2sgf s ASN 110 Ca 0.00 0.71 0.10 0.00 0.04 0.00 0.00 52.86 53.71 2sgf s ASN 110 Cb 0.00 -2.38 -0.11 0.00 -1.54 0.00 0.00 41.25 37.22 2sgf s ASN 110 CO 0.00 -0.49 1.31 0.71 -3.04 0.00 0.00 177.10 175.59 2sgf h THR 111 N 5.49 1.35 0.00 -5.21 1.35 -1.93 -3.36 112.91 110.60 2sgf h THR 111 Ca -0.25 -2.93 -0.10 0.00 -0.55 0.00 0.00 66.41 62.57 2sgf h THR 111 Cb 1.11 2.66 -0.02 0.00 -1.73 0.00 0.00 68.15 70.17 2sgf h THR 111 CO 0.83 0.77 -1.81 0.35 -0.25 0.00 0.00 175.52 175.41 2sgf n THR 112 N -3.28 0.59 -1.78 6.82 -2.24 -1.26 -4.94 114.28 108.19 2sgf n THR 112 Ca -0.00 -0.61 -0.42 0.00 -2.27 0.00 0.00 64.05 60.75 2sgf n THR 112 Cb 0.87 -0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.79 2sgf n THR 112 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2sgf s ILE 113 N -3.18 2.13 0.21 2.28 2.07 -1.26 -4.91 121.20 118.53 2sgf s ILE 113 Ca -0.06 0.10 -0.31 0.00 -1.41 0.00 0.00 60.65 58.97 2sgf s ILE 113 Cb 0.11 -3.06 -0.10 0.00 0.13 0.00 0.00 42.46 39.54 2sgf s ILE 113 CO 0.86 0.01 1.50 -2.16 -1.91 0.00 0.00 174.94 173.24 2sgf s PRO 114 N 0.55 4.24 -0.83 3.50 0.05 -1.26 -4.90 135.00 136.35 2sgf s PRO 114 Ca 0.70 2.33 -0.00 0.00 0.05 0.00 0.00 61.00 64.08 2sgf s PRO 114 Cb -0.48 -3.13 0.20 0.00 0.05 0.00 0.00 34.50 31.14 2sgf s PRO 114 CO 0.38 -0.51 0.69 0.15 0.05 0.00 0.00 177.00 177.75 2sgf s LYS 115 N 0.30 3.03 0.20 4.56 1.02 -1.26 -0.48 119.74 127.11 2sgf s LYS 115 Ca 0.64 -3.23 -0.30 0.00 0.02 0.00 0.00 55.97 53.10 2sgf s LYS 115 Cb -0.43 -3.82 -0.09 0.00 -0.52 0.00 0.00 37.83 32.98 2sgf s LYS 115 CO 0.38 -1.26 1.26 -0.51 -0.92 0.00 0.00 175.35 174.31 2sgf s ASP 116 N -0.36 6.97 -0.28 2.83 1.01 -0.97 -4.90 116.67 120.97 2sgf s ASP 116 Ca 0.26 2.35 -0.06 0.00 0.71 0.00 0.00 52.55 55.81 2sgf s ASP 116 Cb -0.08 -2.61 -0.19 0.00 1.01 0.00 0.00 42.92 41.05 2sgf s ASP 116 CO -0.12 -0.46 3.39 0.61 0.21 0.00 0.00 175.17 178.79 2sgf n GLY 117 N 2.20 3.41 3.23 0.21 0.00 -1.26 -4.61 105.19 108.37 2sgf n GLY 117 Ca 0.05 -1.37 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 2sgf n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2sgf n THR 118 N 2.32 0.00 -3.93 2.61 -2.24 -1.26 -2.71 114.28 109.07 2sgf n THR 118 Ca 0.48 -2.45 -0.31 0.00 -2.27 0.00 0.00 64.05 59.51 2sgf n THR 118 Cb 0.77 1.20 -0.15 0.00 -2.10 0.00 0.00 70.33 70.05 2sgf n THR 118 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2sgf s VAL 119 N -3.34 1.81 0.00 2.28 1.01 0.26 -1.04 120.40 121.39 2sgf s VAL 119 Ca 0.39 -1.96 0.00 0.00 0.00 0.00 0.00 61.98 60.40 2sgf s VAL 119 Cb 0.02 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 34.09 2sgf s VAL 119 CO 0.27 -0.56 0.00 0.61 0.00 0.00 0.00 175.10 175.42 2sgf n GLY 120 N 4.46 2.84 0.22 4.51 0.00 -1.07 -0.72 105.19 115.43 2sgf n GLY 120 Ca 0.00 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.84 2sgf n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sgf n GLY 121 N 0.00 -0.61 3.69 -0.02 0.00 -1.26 -4.85 105.19 102.13 2sgf n GLY 121 Ca 0.00 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2sgf n GLY 121 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2sgf s GLN 122 N -2.20 4.35 0.39 1.61 2.00 0.10 -4.99 119.66 120.92 2sgf s GLN 122 Ca 0.36 1.73 -0.25 0.00 -2.00 0.00 0.00 55.36 55.21 2sgf s GLN 122 Cb 0.21 -3.53 -0.09 0.00 0.80 0.00 0.00 33.01 30.40 2sgf s GLN 122 CO 0.40 -0.44 1.09 0.34 -0.50 0.00 0.00 175.29 176.18 2sgf s ASP 123 N 1.49 6.71 -0.08 6.67 2.15 -1.26 -0.57 116.67 131.77 2sgf s ASP 123 Ca 0.58 2.14 0.05 0.00 0.43 0.00 0.00 52.55 55.74 2sgf s ASP 123 Cb -0.26 -2.60 -0.01 0.00 -0.30 0.00 0.00 42.92 39.75 2sgf s ASP 123 CO 0.24 -0.53 -0.24 -0.63 -0.17 0.00 0.00 175.17 173.84 2sgf s ILE 124 N -1.55 2.10 0.00 4.11 -1.09 -1.10 -4.36 121.20 119.30 2sgf s ILE 124 Ca 0.57 -1.03 0.00 0.00 -2.23 0.00 0.00 60.65 57.96 2sgf s ILE 124 Cb -0.25 -1.78 0.00 0.00 -1.58 0.00 0.00 42.46 38.85 2sgf s ILE 124 CO 0.31 0.56 0.00 0.35 -1.23 0.00 0.00 174.94 174.94 2sgf n THR 125 N 3.26 0.00 -3.83 2.92 -2.24 0.11 -4.61 114.28 109.90 2sgf n THR 125 Ca -0.18 -0.22 -0.07 0.00 -2.27 0.00 0.00 64.05 61.31 2sgf n THR 125 Cb 0.53 0.73 0.01 0.00 -2.10 0.00 0.00 70.33 69.49 2sgf n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2sgf s SER 126 N -1.10 -0.10 0.15 3.42 1.04 -1.14 -4.86 113.70 111.10 2sgf s SER 126 Ca 0.00 -0.88 0.10 0.00 0.48 0.00 0.00 55.95 55.65 2sgf s SER 126 Cb 0.00 0.77 -0.04 0.00 0.10 0.00 0.00 66.02 66.84 2sgf s SER 126 CO 0.00 -1.48 -0.20 0.00 0.98 0.00 0.00 173.24 172.54 2sgf s ALA 127 N -2.92 2.63 0.17 5.32 0.00 -1.26 -0.06 121.76 125.64 2sgf s ALA 127 Ca 0.14 -1.48 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 2sgf s ALA 127 Cb -0.05 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.55 2sgf s ALA 127 CO 0.09 0.52 0.38 0.00 0.00 0.00 0.00 175.76 176.74 2sgf s ALA 128 N -1.37 -0.38 0.14 0.00 0.00 -0.44 -4.83 121.76 114.88 2sgf s ALA 128 Ca 0.19 -0.61 -0.20 0.00 0.00 0.00 0.00 51.96 51.35 2sgf s ALA 128 Cb -0.09 0.84 -0.07 0.00 0.00 0.00 0.00 23.12 23.80 2sgf s ALA 128 CO 0.10 -0.71 0.64 -0.80 0.00 0.00 0.00 175.76 175.00 2sgf s ASN 129 N -2.93 7.08 0.61 0.00 0.01 -1.26 -4.54 114.94 113.91 2sgf s ASN 129 Ca 0.13 1.34 -0.17 0.00 -0.71 0.00 0.00 52.86 53.46 2sgf s ASN 129 Cb 0.02 -2.39 -0.02 0.00 0.41 0.00 0.00 41.25 39.27 2sgf s ASN 129 CO -0.02 0.17 1.11 0.00 -1.51 0.00 0.00 177.10 176.85 2sgf s ALA 130 N -1.29 2.58 0.06 0.60 0.00 -1.26 -5.06 121.76 117.38 2sgf s ALA 130 Ca 0.36 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.95 2sgf s ALA 130 Cb -0.19 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 2sgf s ALA 130 CO 0.21 -1.05 -0.07 0.95 0.00 0.00 0.00 175.76 175.80 2sgf s THR 131 N -2.18 0.56 0.22 0.00 -4.23 -1.26 -5.08 115.64 103.67 2sgf s THR 131 Ca 0.68 -1.43 -0.32 0.00 -1.18 0.00 0.00 61.69 59.45 2sgf s THR 131 Cb -0.21 -1.04 -0.12 0.00 1.34 0.00 0.00 72.50 72.48 2sgf s THR 131 CO 0.36 -0.60 1.70 -0.69 -0.54 0.00 0.00 174.62 174.85 2sgf s VAL 132 N -2.34 2.06 0.00 2.29 1.01 -1.26 -2.17 120.40 119.99 2sgf s VAL 132 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.01 2sgf s VAL 132 Cb -0.03 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.32 2sgf s VAL 132 CO -0.02 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.69 2sgf n GLY 133 N 3.71 0.64 3.73 4.51 0.00 0.17 -5.00 105.19 112.95 2sgf n GLY 133 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2sgf n GLY 133 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2sgf s MET 134 N -0.78 4.43 0.05 1.61 0.00 -0.92 -4.71 119.30 118.97 2sgf s MET 134 Ca 0.00 1.96 -0.30 0.00 0.00 0.00 0.00 55.69 57.35 2sgf s MET 134 Cb 0.00 -3.23 -0.04 0.00 0.00 0.00 0.00 34.83 31.56 2sgf s MET 134 CO 0.00 -0.20 0.98 0.00 0.00 0.00 0.00 175.02 175.80 2sgf s ALA 135 N 0.21 3.20 0.20 4.11 0.00 -1.26 -0.96 121.76 127.26 2sgf s ALA 135 Ca 0.56 0.57 0.01 0.00 0.00 0.00 0.00 51.96 53.10 2sgf s ALA 135 Cb -0.34 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.41 2sgf s ALA 135 CO 0.36 -0.16 0.07 0.14 0.00 0.00 0.00 175.76 176.17 2sgf s VAL 136 N 0.60 0.43 -0.00 0.00 -7.23 -0.40 -4.71 120.40 109.09 2sgf s VAL 136 Ca 0.50 -1.98 -0.01 0.00 -1.81 0.00 0.00 61.98 58.68 2sgf s VAL 136 Cb -0.22 -2.38 -0.00 0.00 0.56 0.00 0.00 36.38 34.34 2sgf s VAL 136 CO 0.29 -0.21 0.01 -0.89 -0.31 0.00 0.00 175.10 173.99 2sgf s THR 137 N -3.84 0.03 0.11 5.32 2.01 0.27 -1.53 115.64 118.01 2sgf s THR 137 Ca 0.32 -0.22 0.10 0.00 0.31 0.00 0.00 61.69 62.20 2sgf s THR 137 Cb 0.07 -0.10 -0.04 0.00 0.01 0.00 0.00 72.50 72.44 2sgf s THR 137 CO 0.09 -0.12 -0.26 -0.60 -0.69 0.00 0.00 174.62 173.03 2sgf s ARG 138 N -0.36 1.45 -0.02 4.92 3.52 0.10 0.15 118.95 128.71 2sgf s ARG 138 Ca -0.04 -1.28 0.03 0.00 -0.13 0.00 0.00 55.73 54.31 2sgf s ARG 138 Cb -0.03 -1.86 -0.00 0.00 -1.56 0.00 0.00 34.95 31.50 2sgf s ARG 138 CO -0.00 0.45 -0.10 0.50 -0.81 0.00 0.00 175.30 175.33 2sgf s ARG 139 N -1.88 0.99 0.17 5.12 3.52 -0.95 -0.81 118.95 125.10 2sgf s ARG 139 Ca 0.13 -0.36 -0.05 0.00 -0.13 0.00 0.00 55.73 55.32 2sgf s ARG 139 Cb -0.10 -0.93 -0.02 0.00 -1.56 0.00 0.00 34.95 32.34 2sgf s ARG 139 CO 0.05 0.17 0.20 0.20 -0.81 0.00 0.00 175.30 175.11 2sgf s GLY 140 N 0.00 0.82 0.21 8.12 0.00 -0.53 -3.57 107.32 112.38 2sgf s GLY 140 Ca -0.00 -1.22 0.26 0.00 0.00 0.00 0.00 44.72 43.76 2sgf s GLY 140 CO 0.00 -1.09 1.78 -1.14 0.00 0.00 0.00 173.10 172.65 2sgf n SER 141 N -0.20 0.78 -0.12 1.64 3.41 -1.05 -1.31 113.62 116.77 2sgf n SER 141 Ca -0.05 0.58 -0.21 0.00 -0.26 0.00 0.00 58.87 58.94 2sgf n SER 141 Cb 0.64 -0.79 -0.08 0.00 -0.26 0.00 0.00 64.21 63.72 2sgf n SER 141 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2sgf n THR 142 N -2.24 1.51 1.09 6.66 -1.04 -1.26 -4.71 114.28 114.30 2sgf n THR 142 Ca 0.05 -0.14 0.12 0.00 -2.04 0.00 0.00 64.05 62.04 2sgf n THR 142 Cb 0.41 -2.08 0.15 0.00 -1.82 0.00 0.00 70.33 66.99 2sgf n THR 142 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2sgf n THR 143 N -4.36 0.00 -3.91 12.58 -2.24 -1.25 -5.06 114.28 110.04 2sgf n THR 143 Ca -0.37 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 2sgf n THR 143 Cb 0.71 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 2sgf n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2sgf n GLY 156 N 1.41 0.43 3.63 3.38 0.00 -0.43 -4.82 105.19 108.78 2sgf n GLY 156 Ca 0.09 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 2sgf n GLY 156 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2sgf s THR 157 N 0.00 5.00 0.03 2.61 2.01 -1.26 -1.45 115.64 122.59 2sgf s THR 157 Ca 0.00 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.06 2sgf s THR 157 Cb 0.00 -3.30 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 2sgf s THR 157 CO 0.00 0.40 -0.05 -1.00 -0.69 0.00 0.00 174.62 173.28 2sgf s HIS 158 N 0.76 0.44 0.39 4.92 3.76 0.01 -4.98 115.29 120.60 2sgf s HIS 158 Ca 0.05 -0.48 0.08 0.00 -0.15 0.00 0.00 55.06 54.56 2sgf s HIS 158 Cb -0.13 -0.28 -0.06 0.00 1.11 0.00 0.00 32.58 33.21 2sgf s HIS 158 CO 0.02 -0.13 0.07 -1.12 -0.85 0.00 0.00 174.74 172.73 2sgf s SER 159 N -1.41 4.12 0.00 1.40 0.01 -1.26 -0.72 113.70 115.84 2sgf s SER 159 Ca -0.12 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 55.96 2sgf s SER 159 Cb -0.09 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.69 2sgf s SER 159 CO -0.00 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 173.83 2sgf n GLY 160 N -1.05 -0.69 3.19 3.44 0.00 -0.58 -4.70 105.19 104.80 2sgf n GLY 160 Ca -0.03 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.44 2sgf n GLY 160 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2sgf s SER 161 N -4.00 0.21 -0.10 1.61 1.04 -1.26 -1.27 113.70 109.92 2sgf s SER 161 Ca 0.00 -0.82 -0.30 0.00 0.48 0.00 0.00 55.95 55.32 2sgf s SER 161 Cb 0.00 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 2sgf s SER 161 CO 0.00 -0.73 1.03 -0.69 0.98 0.00 0.00 173.24 173.83 2sgf s VAL 162 N -3.91 4.72 -0.04 5.02 1.01 -0.13 -2.40 120.40 124.67 2sgf s VAL 162 Ca 0.09 1.99 0.15 0.00 0.00 0.00 0.00 61.98 64.21 2sgf s VAL 162 Cb 0.06 -4.28 -0.23 0.00 0.00 0.00 0.00 36.38 31.93 2sgf s VAL 162 CO -0.08 -0.00 0.33 0.35 0.00 0.00 0.00 175.10 175.70 2sgf n THR 163 N 4.58 0.00 -3.46 3.92 -2.24 0.09 -0.66 114.28 116.51 2sgf n THR 163 Ca 0.09 -0.33 -0.12 0.00 -2.27 0.00 0.00 64.05 61.42 2sgf n THR 163 Cb 0.48 0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 2sgf n THR 163 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2sgf s ALA 164 N -3.01 -1.70 0.32 6.98 0.00 -1.13 -4.90 121.76 118.32 2sgf s ALA 164 Ca -0.05 0.79 0.10 0.00 0.00 0.00 0.00 51.96 52.80 2sgf s ALA 164 Cb 0.10 0.58 -0.06 0.00 0.00 0.00 0.00 23.12 23.73 2sgf s ALA 164 CO 0.62 -0.68 -0.11 -0.51 0.00 0.00 0.00 175.76 175.08 2sgf s LEU 165 N -2.42 2.74 -1.51 0.00 1.43 -1.26 -0.75 118.68 116.91 2sgf s LEU 165 Ca 0.01 -1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 51.87 2sgf s LEU 165 Cb -0.01 -1.09 0.08 0.00 0.03 0.00 0.00 46.19 45.20 2sgf s LEU 165 CO -0.09 -0.14 0.98 -3.20 0.23 0.00 0.00 176.35 174.14 2sgf n ASN 166 N -0.77 -4.70 -4.84 2.29 4.05 -0.90 -4.90 115.26 105.49 2sgf n ASN 166 Ca -0.05 -0.76 -0.33 0.00 0.45 0.00 0.00 54.58 53.89 2sgf n ASN 166 Cb 0.62 -3.98 -0.06 0.00 1.23 0.00 0.00 39.78 37.59 2sgf n ASN 166 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2sgf s ALA 167 N -3.33 3.24 -0.19 5.20 0.00 -0.32 -4.36 121.76 122.00 2sgf s ALA 167 Ca 0.62 0.17 -0.07 0.00 0.00 0.00 0.00 51.96 52.69 2sgf s ALA 167 Cb -0.31 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 2sgf s ALA 167 CO 0.82 0.27 0.04 0.99 0.00 0.00 0.00 175.76 177.88 2sgf s THR 168 N -2.00 4.49 -0.13 0.00 2.01 -1.26 -1.10 115.64 117.64 2sgf s THR 168 Ca 0.56 -0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.44 2sgf s THR 168 Cb -0.11 -3.03 0.01 0.00 0.01 0.00 0.00 72.50 69.39 2sgf s THR 168 CO 0.16 0.44 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.67 2sgf s VAL 169 N 0.62 1.76 -0.35 3.82 1.01 -0.15 -5.00 120.40 122.11 2sgf s VAL 169 Ca 0.02 -0.79 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 2sgf s VAL 169 Cb -0.13 -1.59 0.03 0.00 0.00 0.00 0.00 36.38 34.69 2sgf s VAL 169 CO 0.02 0.49 0.14 0.21 0.00 0.00 0.00 175.10 175.96 2sgf s ASN 170 N 0.99 5.47 0.00 3.32 3.84 -1.26 -0.58 114.94 126.72 2sgf s ASN 170 Ca -0.05 -1.08 0.26 0.00 0.21 0.00 0.00 52.86 52.20 2sgf s ASN 170 Cb -0.15 -1.93 1.00 0.00 -0.55 0.00 0.00 41.25 39.62 2sgf s ASN 170 CO -0.03 -0.35 1.71 -1.22 -2.79 0.00 0.00 177.10 174.42 2sgf n TYR 171 N 4.88 0.05 0.00 0.43 4.01 -0.14 -5.02 117.16 121.37 2sgf n TYR 171 Ca -0.12 -0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 2sgf n TYR 171 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 2sgf n TYR 171 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2sgf n GLY 172 N 1.16 -0.73 2.42 2.72 0.00 -1.24 -4.83 105.19 104.69 2sgf n GLY 172 Ca 0.18 -1.66 -0.20 0.00 0.00 0.00 0.00 46.02 44.34 2sgf n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sgf n GLY 173 N -0.67 -0.02 1.94 -0.02 0.00 -1.26 -0.30 105.19 104.86 2sgf n GLY 173 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2sgf n GLY 173 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sgf n GLY 174 N -0.93 0.74 3.45 -0.02 0.00 -1.26 -4.97 105.19 102.20 2sgf n GLY 174 Ca -0.23 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.35 2sgf n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2sgf s ASP 175 N -2.45 6.75 -0.05 1.61 1.01 0.59 -4.92 116.67 119.21 2sgf s ASP 175 Ca 0.00 -2.31 0.04 0.00 0.71 0.00 0.00 52.55 50.98 2sgf s ASP 175 Cb 0.00 -2.39 -0.03 0.00 1.01 0.00 0.00 42.92 41.51 2sgf s ASP 175 CO 0.00 -0.97 -0.14 -0.69 0.21 0.00 0.00 175.17 173.58 2sgf s VAL 176 N 2.32 3.05 0.03 -1.27 1.01 -1.26 -0.96 120.40 123.32 2sgf s VAL 176 Ca 0.35 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 61.68 2sgf s VAL 176 Cb -0.04 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 2sgf s VAL 176 CO -0.07 0.58 -0.26 0.68 0.00 0.00 0.00 175.10 176.04 2sgf s VAL 177 N -0.74 2.20 0.30 2.92 -7.23 0.25 -0.20 120.40 117.90 2sgf s VAL 177 Ca 0.12 -1.33 0.11 0.00 -1.81 0.00 0.00 61.98 59.06 2sgf s VAL 177 Cb -0.11 -1.85 -0.05 0.00 0.56 0.00 0.00 36.38 34.93 2sgf s VAL 177 CO 0.01 0.40 -0.12 -0.31 -0.31 0.00 0.00 175.10 174.77 2sgf s TYR 178 N -0.79 2.42 -0.77 2.82 2.02 -0.21 -0.98 117.35 121.86 2sgf s TYR 178 Ca 0.12 -0.36 0.00 0.00 -0.37 0.00 0.00 57.07 56.46 2sgf s TYR 178 Cb -0.10 -1.18 0.00 0.00 -0.40 0.00 0.00 41.96 40.28 2sgf s TYR 178 CO 0.02 0.64 0.00 0.41 -1.57 0.00 0.00 175.55 175.05 2sgf n GLY 179 N -0.75 0.43 3.87 0.71 0.00 -0.94 -4.82 105.19 103.70 2sgf n GLY 179 Ca -0.05 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 2sgf n GLY 179 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2sgf s MET 180 N -3.70 3.84 -0.05 1.61 -1.94 -0.26 -4.40 119.30 114.39 2sgf s MET 180 Ca 0.00 0.40 -0.23 0.00 -1.71 0.00 0.00 55.69 54.15 2sgf s MET 180 Cb 0.00 -2.53 -0.04 0.00 2.01 0.00 0.00 34.83 34.27 2sgf s MET 180 CO 0.00 0.19 0.69 0.42 -0.01 0.00 0.00 175.02 176.31 2sgf s ILE 181 N -2.00 5.02 -0.10 2.53 1.01 0.46 -1.18 121.20 126.94 2sgf s ILE 181 Ca 0.50 1.43 -0.05 0.00 0.00 0.00 0.00 60.65 62.52 2sgf s ILE 181 Cb -0.11 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 2sgf s ILE 181 CO 0.23 0.27 0.11 -0.60 0.00 0.00 0.00 174.94 174.95 2sgf s ARG 182 N 0.66 3.33 0.26 2.79 3.52 0.07 -1.00 118.95 128.59 2sgf s ARG 182 Ca 0.37 -0.21 -0.02 0.00 -0.13 0.00 0.00 55.73 55.74 2sgf s ARG 182 Cb -0.18 -3.09 -0.02 0.00 -1.56 0.00 0.00 34.95 30.10 2sgf s ARG 182 CO 0.18 0.75 0.29 0.95 -0.81 0.00 0.00 175.30 176.67 2sgf s THR 183 N -1.02 0.00 -0.37 4.11 -4.23 -0.54 -0.73 115.64 112.87 2sgf s THR 183 Ca 0.16 -1.81 0.08 0.00 -1.18 0.00 0.00 61.69 58.93 2sgf s THR 183 Cb -0.12 -2.47 0.71 0.00 1.34 0.00 0.00 72.50 71.96 2sgf s THR 183 CO 0.05 0.00 1.84 -0.46 -0.54 0.00 0.00 174.62 175.50 2sgf n ASN 184 N -0.78 4.34 -4.83 3.99 0.23 -1.01 -2.68 115.26 114.53 2sgf n ASN 184 Ca 0.02 -3.39 -0.37 0.00 -0.53 0.00 0.00 54.58 50.31 2sgf n ASN 184 Cb 0.64 -0.78 -0.06 0.00 -2.08 0.00 0.00 39.78 37.50 2sgf n ASN 184 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2sgf s VAL 190 N -3.12 4.83 0.64 3.53 1.01 -1.26 -4.60 120.40 121.43 2sgf s VAL 190 Ca 0.55 1.01 -0.09 0.00 0.00 0.00 0.00 61.98 63.46 2sgf s VAL 190 Cb 0.45 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 33.03 2sgf s VAL 190 CO 0.12 0.45 0.99 0.00 0.00 0.00 0.00 175.10 176.66 2sgf s ALA 192 N -3.16 -1.66 0.16 0.00 0.00 -1.26 -4.94 121.76 110.90 2sgf s ALA 192 Ca 0.56 0.69 -0.02 0.00 0.00 0.00 0.00 51.96 53.18 2sgf s ALA 192 Cb -0.11 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 2sgf s ALA 192 CO 0.48 -0.70 0.12 -1.21 0.00 0.00 0.00 175.76 174.45 2sgf s GLU 192 N -3.31 1.05 0.18 0.00 2.02 -1.26 -4.56 118.70 112.81 2sgf s GLU 192 Ca 0.00 -1.46 -0.33 0.00 0.02 0.00 0.00 54.97 53.20 2sgf s GLU 192 Cb -0.01 0.27 -0.14 0.00 0.10 0.00 0.00 34.13 34.35 2sgf s GLU 192 CO -0.10 -0.33 1.49 -2.30 0.02 0.00 0.00 175.26 174.05 2sgf n PRO 192 N -0.17 1.98 0.00 0.39 -0.02 -1.26 -0.68 135.00 135.24 2sgf n PRO 192 Ca -0.03 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2sgf n PRO 192 Cb 0.64 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2sgf n PRO 192 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2sgf n GLY 193 N 2.90 2.63 0.03 -1.23 0.00 -1.26 -4.73 105.19 103.53 2sgf n GLY 193 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2sgf n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2sgf n ASP 194 N 0.00 0.34 -4.55 1.61 8.00 0.14 -3.44 116.55 118.65 2sgf n ASP 194 Ca 0.00 0.32 -0.47 0.00 0.71 0.00 0.00 54.79 55.35 2sgf n ASP 194 Cb 0.00 -0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 40.74 2sgf n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2sgf n SER 195 N -1.72 0.86 0.00 -2.24 7.64 -1.26 -1.35 113.62 115.55 2sgf n SER 195 Ca 0.06 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2sgf n SER 195 Cb 0.37 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2sgf n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2sgf n GLY 196 N 1.68 2.48 3.78 0.23 0.00 0.59 -0.80 105.19 113.14 2sgf n GLY 196 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2sgf n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2sgf s GLY 197 N -1.99 1.59 0.38 -0.02 0.00 -0.46 -2.35 107.32 104.47 2sgf s GLY 197 Ca 0.00 -0.40 -0.25 0.00 0.00 0.00 0.00 44.72 44.07 2sgf s GLY 197 CO 0.00 0.13 1.02 2.56 0.00 0.00 0.00 173.10 176.81 2sgf s PRO 198 N -5.20 4.29 -0.18 2.90 0.04 -1.23 -0.03 135.00 135.59 2sgf s PRO 198 Ca 0.63 1.46 -0.01 0.00 0.04 0.00 0.00 61.00 63.11 2sgf s PRO 198 Cb -0.15 -2.61 -0.00 0.00 0.04 0.00 0.00 34.50 31.77 2sgf s PRO 198 CO 0.54 -0.02 -0.11 -1.17 0.04 0.00 0.00 177.00 176.29 2sgf s LEU 199 N -2.48 2.66 0.24 -3.56 2.96 0.32 -2.25 118.68 116.58 2sgf s LEU 199 Ca 0.56 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 2sgf s LEU 199 Cb -0.21 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 2sgf s LEU 199 CO 0.26 0.05 0.12 -0.72 -1.32 0.00 0.00 176.35 174.74 2sgf s TYR 200 N 1.02 1.40 -0.32 5.38 1.13 0.12 -0.51 117.35 125.57 2sgf s TYR 200 Ca -0.01 -1.29 -0.02 0.00 -1.41 0.00 0.00 57.07 54.35 2sgf s TYR 200 Cb -0.15 -0.76 0.12 0.00 -1.10 0.00 0.00 41.96 40.08 2sgf s TYR 200 CO -0.02 -0.48 0.17 0.45 -2.51 0.00 0.00 175.55 173.16 2sgf s SER 201 N -3.26 3.29 1.16 -0.18 0.15 0.12 -0.57 113.70 114.42 2sgf s SER 201 Ca 0.38 -1.76 0.00 0.00 0.70 0.00 0.00 55.95 55.27 2sgf s SER 201 Cb 0.07 -0.41 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 2sgf s SER 201 CO 0.14 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.81 2sgf n GLY 202 N 4.62 1.09 1.33 9.45 0.00 -1.26 -2.23 105.19 118.19 2sgf n GLY 202 Ca 0.03 -0.57 0.09 0.00 0.00 0.00 0.00 46.02 45.56 2sgf n GLY 202 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2sgf n THR 207 N 0.00 1.33 -3.50 2.61 -2.24 -1.26 -4.88 114.28 106.34 2sgf n THR 207 Ca 0.00 -0.95 -0.38 0.00 -2.27 0.00 0.00 64.05 60.45 2sgf n THR 207 Cb 0.00 0.18 -0.09 0.00 -2.10 0.00 0.00 70.33 68.32 2sgf n THR 207 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2sgf s ARG 208 N -1.59 4.10 0.03 -0.78 0.52 -0.95 0.08 118.95 120.36 2sgf s ARG 208 Ca 0.43 -0.03 -0.30 0.00 -0.52 0.00 0.00 55.73 55.31 2sgf s ARG 208 Cb 0.26 -3.56 -0.05 0.00 0.52 0.00 0.00 34.95 32.12 2sgf s ARG 208 CO 0.24 -0.05 1.19 0.00 0.02 0.00 0.00 175.30 176.70 2sgf s ALA 209 N 1.36 3.40 -0.01 2.13 0.00 0.91 0.15 121.76 129.70 2sgf s ALA 209 Ca 0.13 0.79 -0.00 0.00 0.00 0.00 0.00 51.96 52.88 2sgf s ALA 209 Cb -0.14 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 2sgf s ALA 209 CO 0.07 -0.50 -0.01 -0.89 0.00 0.00 0.00 175.76 174.43 2sgf n ILE 210 N 4.07 0.07 -3.85 0.00 2.08 0.34 -1.32 119.36 120.75 2sgf n ILE 210 Ca 0.09 -0.02 -0.09 0.00 0.56 0.00 0.00 62.75 63.29 2sgf n ILE 210 Cb 0.47 -1.06 0.01 0.00 -0.75 0.00 0.00 39.64 38.31 2sgf n ILE 210 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 2sgf s GLY 211 N -4.60 0.46 -0.06 7.39 0.00 -0.62 -0.84 107.32 109.05 2sgf s GLY 211 Ca -0.02 -0.80 0.05 0.00 0.00 0.00 0.00 44.72 43.95 2sgf s GLY 211 CO 0.03 -0.37 -0.23 1.08 0.00 0.00 0.00 173.10 173.60 2sgf s LEU 212 N -3.07 2.04 0.14 0.66 1.43 -0.21 -0.52 118.68 119.14 2sgf s LEU 212 Ca 0.17 -0.49 -0.31 0.00 -1.03 0.00 0.00 54.13 52.46 2sgf s LEU 212 Cb -0.05 -1.30 -0.09 0.00 0.03 0.00 0.00 46.19 44.78 2sgf s LEU 212 CO 0.12 0.21 1.52 -0.89 0.23 0.00 0.00 176.35 177.54 2sgf s THR 213 N 0.00 2.87 -0.11 5.49 2.01 0.95 -0.87 115.64 125.99 2sgf s THR 213 Ca -0.07 0.60 -0.06 0.00 0.31 0.00 0.00 61.69 62.46 2sgf s THR 213 Cb -0.14 -3.38 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 2sgf s THR 213 CO 0.05 0.04 -0.16 -0.24 -0.69 0.00 0.00 174.62 173.62 2sgf n SER 214 N 4.13 0.96 -3.48 3.53 2.88 -0.39 -0.30 113.62 120.95 2sgf n SER 214 Ca 0.13 0.16 0.04 0.00 -1.33 0.00 0.00 58.87 57.87 2sgf n SER 214 Cb 0.40 -0.38 0.01 0.00 -0.75 0.00 0.00 64.21 63.48 2sgf n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2sgf n GLY 215 N 2.29 0.16 0.00 0.46 0.00 -1.13 -4.88 105.19 102.09 2sgf n GLY 215 Ca -0.21 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2sgf n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sgf n GLY 216 N -0.81 -0.58 3.57 -0.02 0.00 -1.26 -0.36 105.19 105.74 2sgf n GLY 216 Ca 0.05 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 2sgf n GLY 216 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2sgf s SER 217 N -4.00 0.31 0.10 1.61 1.04 -0.36 -5.01 113.70 107.40 2sgf s SER 217 Ca 0.00 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.25 2sgf s SER 217 Cb 0.00 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.77 2sgf s SER 217 CO 0.00 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 173.56 2sgf n GLY 218 N -0.47 -1.53 3.83 7.32 0.00 -1.26 -2.13 105.19 110.95 2sgf n GLY 218 Ca -0.01 -1.31 -0.07 0.00 0.00 0.00 0.00 46.02 44.63 2sgf n GLY 218 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sgf s ASN 219 N -4.00 -0.01 0.30 1.61 2.20 -0.90 -4.84 114.94 109.29 2sgf s ASN 219 Ca 0.00 -0.94 0.24 0.00 -0.94 0.00 0.00 52.86 51.23 2sgf s ASN 219 Cb 0.00 0.71 0.51 0.00 -2.00 0.00 0.00 41.25 40.48 2sgf s ASN 219 CO 0.00 -1.41 1.61 0.00 -2.94 0.00 0.00 177.10 174.36 2sgf h SER 221 N 0.00 0.10 0.62 0.00 0.87 -1.99 -3.35 113.55 109.81 2sgf h SER 221 Ca 0.00 -0.89 0.00 0.00 -1.23 0.00 0.00 61.79 59.67 2sgf h SER 221 Cb 0.87 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2sgf h SER 221 CO 0.00 0.98 -0.97 -1.20 -0.53 0.00 0.00 176.83 175.11 2sgf n SER 222 N -4.56 0.65 0.00 6.23 7.64 -1.25 -5.08 113.62 117.25 2sgf n SER 222 Ca -0.10 -0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.76 2sgf n SER 222 Cb 0.50 0.63 0.00 0.00 -1.01 0.00 0.00 64.21 64.32 2sgf n SER 222 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2sgf n GLY 223 N 1.32 2.75 2.08 0.23 0.00 0.42 -4.91 105.19 107.08 2sgf n GLY 223 Ca 0.02 -1.75 -0.05 0.00 0.00 0.00 0.00 46.02 44.24 2sgf n GLY 223 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2sgf n GLY 224 N 0.60 1.47 3.03 -0.02 0.00 -1.22 -2.12 105.19 106.93 2sgf n GLY 224 Ca 0.00 -1.16 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 2sgf n GLY 224 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2sgf s THR 225 N -2.51 1.17 0.02 2.61 2.01 -0.91 -4.16 115.64 113.88 2sgf s THR 225 Ca 0.09 -0.49 0.06 0.00 0.31 0.00 0.00 61.69 61.66 2sgf s THR 225 Cb -0.03 -1.07 -0.02 0.00 0.01 0.00 0.00 72.50 71.39 2sgf s THR 225 CO 0.07 0.36 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.29 2sgf s THR 226 N 0.69 1.42 -0.02 -0.82 2.01 -1.09 -1.22 115.64 116.62 2sgf s THR 226 Ca -0.14 -0.98 0.03 0.00 0.31 0.00 0.00 61.69 60.91 2sgf s THR 226 Cb -0.16 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.09 2sgf s THR 226 CO 0.03 0.23 -0.08 -0.36 -0.69 0.00 0.00 174.62 173.75 2sgf s PHE 227 N -0.66 2.87 0.05 4.92 0.08 0.52 -1.46 117.98 124.29 2sgf s PHE 227 Ca 0.06 -0.05 0.04 0.00 0.12 0.00 0.00 56.93 57.10 2sgf s PHE 227 Cb -0.08 -1.63 -0.02 0.00 -0.57 0.00 0.00 43.02 40.72 2sgf s PHE 227 CO 0.01 0.34 -0.11 -0.06 -0.10 0.00 0.00 175.22 175.30 2sgf s PHE 228 N -0.92 0.94 -0.01 0.36 0.40 -0.17 -1.27 117.98 117.31 2sgf s PHE 228 Ca 0.15 -0.43 -0.27 0.00 -0.60 0.00 0.00 56.93 55.79 2sgf s PHE 228 Cb -0.11 -0.55 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 2sgf s PHE 228 CO 0.05 -0.01 0.84 -1.14 0.70 0.00 0.00 175.22 175.67 2sgf s GLN 229 N -1.43 4.52 0.14 0.44 2.00 -0.05 -0.40 119.66 124.88 2sgf s GLN 229 Ca -0.04 1.17 -0.31 0.00 -2.00 0.00 0.00 55.36 54.18 2sgf s GLN 229 Cb -0.09 -3.43 -0.11 0.00 0.80 0.00 0.00 33.01 30.18 2sgf s GLN 229 CO 0.01 0.06 1.79 -2.14 -0.50 0.00 0.00 175.29 174.51 2sgf s PRO 230 N 0.69 4.14 0.47 1.67 0.02 -1.26 -1.04 135.00 139.68 2sgf s PRO 230 Ca 0.44 2.57 0.25 0.00 0.02 0.00 0.00 61.00 64.29 2sgf s PRO 230 Cb -0.20 -3.48 1.09 0.00 0.02 0.00 0.00 34.50 31.93 2sgf s PRO 230 CO 0.24 -0.81 1.90 -0.24 -0.33 0.00 0.00 177.00 177.76 2sgf h VAL 231 N 4.50 0.56 -0.35 3.83 3.04 -1.30 -3.15 116.25 123.38 2sgf h VAL 231 Ca -0.45 -0.95 -0.01 0.00 -1.01 0.00 0.00 66.70 64.28 2sgf h VAL 231 Cb 1.21 1.64 -0.02 0.00 -2.01 0.00 0.00 31.29 32.11 2sgf h VAL 231 CO 0.95 0.19 0.19 0.71 -1.01 0.00 0.00 177.57 178.60 2sgf h THR 232 N 0.00 1.11 -0.44 3.17 1.35 -1.86 -1.53 112.91 114.71 2sgf h THR 232 Ca -0.00 -0.29 -0.09 0.00 -0.55 0.00 0.00 66.41 65.48 2sgf h THR 232 Cb 0.62 0.65 -0.02 0.00 -1.73 0.00 0.00 68.15 67.67 2sgf h THR 232 CO 0.03 0.12 -0.09 -0.33 -0.25 0.00 0.00 175.52 174.99 2sgf h GLU 233 N 0.48 0.79 -0.39 4.72 4.39 -1.95 -2.33 114.58 120.29 2sgf h GLU 233 Ca 0.13 -0.25 -0.16 0.00 0.34 0.00 0.00 59.36 59.41 2sgf h GLU 233 Cb 0.02 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2sgf h GLU 233 CO -0.02 0.85 -0.38 0.00 -1.16 0.00 0.00 179.01 178.30 2sgf h ALA 234 N 1.18 0.57 -0.93 3.43 0.00 -1.44 -1.41 119.26 120.66 2sgf h ALA 234 Ca 0.12 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2sgf h ALA 234 Cb 0.57 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2sgf h ALA 234 CO 0.04 0.67 0.54 -0.07 0.00 0.00 0.00 179.25 180.43 2sgf h LEU 235 N 0.76 1.13 -0.06 0.00 3.38 -1.14 -1.27 115.31 118.12 2sgf h LEU 235 Ca 0.06 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2sgf h LEU 235 Cb 0.98 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 2sgf h LEU 235 CO 0.09 0.88 -0.04 -1.28 0.09 0.00 0.00 178.44 178.19 2sgf h SER 235 N 1.28 0.13 -0.84 -0.43 0.87 -1.40 0.09 113.55 113.26 2sgf h SER 235 Ca 0.33 -0.45 0.09 0.00 -1.23 0.00 0.00 61.79 60.53 2sgf h SER 235 Cb -0.03 -0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 61.83 2sgf h SER 235 CO -0.06 0.55 0.49 0.00 -0.53 0.00 0.00 176.83 177.28 2sgf h ALA 236 N 0.58 1.20 -0.02 6.23 0.00 -0.98 -2.44 119.26 123.84 2sgf h ALA 236 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2sgf h ALA 236 Cb 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2sgf h ALA 236 CO 0.01 0.12 -0.13 0.66 0.00 0.00 0.00 179.25 179.92 2sgf n TYR 237 N -4.72 0.00 -3.54 0.00 4.01 -0.50 -4.96 117.16 107.44 2sgf n TYR 237 Ca 0.14 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.65 2sgf n TYR 237 Cb 0.28 -0.02 0.08 0.00 -0.31 0.00 0.00 39.34 39.36 2sgf n TYR 237 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2sgf n GLY 238 N 1.30 -0.47 3.59 2.72 0.00 -0.12 -5.01 105.19 107.20 2sgf n GLY 238 Ca 0.15 0.21 -0.27 0.00 0.00 0.00 0.00 46.02 46.11 2sgf n GLY 238 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2sgf s VAL 239 N -3.30 1.77 0.05 1.61 -7.23 -0.38 -4.74 120.40 108.18 2sgf s VAL 239 Ca 0.55 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.67 2sgf s VAL 239 Cb -0.24 -2.91 -0.02 0.00 0.56 0.00 0.00 36.38 33.78 2sgf s VAL 239 CO 0.69 0.00 0.09 -0.94 -0.31 0.00 0.00 175.10 174.63 2sgf s SER 240 N -3.67 0.24 0.80 4.85 1.04 -0.49 -4.64 113.70 111.82 2sgf s SER 240 Ca 0.34 -0.67 -0.11 0.00 0.48 0.00 0.00 55.95 55.99 2sgf s SER 240 Cb 0.09 0.25 0.07 0.00 0.10 0.00 0.00 66.02 66.53 2sgf s SER 240 CO 0.17 -0.58 1.09 0.68 0.98 0.00 0.00 173.24 175.58 2sgf s VAL 241 N -3.20 3.11 0.00 5.02 -7.23 -1.26 -1.25 120.40 115.59 2sgf s VAL 241 Ca 0.00 0.36 0.00 0.00 -1.81 0.00 0.00 61.98 60.53 2sgf s VAL 241 Cb 0.02 -3.07 0.00 0.00 0.56 0.00 0.00 36.38 33.90 2sgf s VAL 241 CO -0.07 -0.47 0.00 0.00 -0.31 0.00 0.00 175.10 174.24