#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b9m n ARG 12 N 0.00 0.00 -2.60 1.97 0.63 -1.26 -5.11 116.66 110.28 2b9m n ARG 12 Ca 0.00 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.90 2b9m n ARG 12 Cb 0.00 -0.49 -0.03 0.00 0.45 0.00 0.00 32.46 32.39 2b9m n ARG 12 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2b9m n GLN 13 N -2.69 -4.01 -0.01 -0.14 1.13 -1.13 -5.05 117.38 105.46 2b9m n GLN 13 Ca 0.00 3.10 -0.03 0.00 -1.94 0.00 0.00 57.00 58.13 2b9m n GLN 13 Cb 0.36 -5.07 -0.01 0.00 0.11 0.00 0.00 30.24 25.63 2b9m n GLN 13 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2b9m n VAL 14 N 1.23 0.16 0.00 5.09 0.31 -0.96 -5.00 118.33 119.16 2b9m n VAL 14 Ca -0.24 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 2b9m n VAL 14 Cb 0.37 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 31.88 2b9m n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b9m n ALA 15 N -3.06 0.00 -2.54 3.52 0.00 -0.11 -4.95 120.51 113.38 2b9m n ALA 15 Ca -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.30 2b9m n ALA 15 Cb 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.91 2b9m n ALA 15 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2b9m s SER 16 N -0.40 0.21 0.00 0.00 0.15 -1.26 -2.33 113.70 110.07 2b9m s SER 16 Ca 0.00 -0.66 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2b9m s SER 16 Cb 0.00 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 2b9m s SER 16 CO 0.00 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.43 2b9m n GLY 17 N 0.30 -0.62 3.11 9.45 0.00 -0.50 -4.08 105.19 112.85 2b9m n GLY 17 Ca -0.16 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 2b9m n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b9m s ARG 18 N -1.34 0.66 -0.17 1.61 3.00 -1.05 -2.45 118.95 119.21 2b9m s ARG 18 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 55.73 54.58 2b9m s ARG 18 Cb 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 34.95 34.97 2b9m s ARG 18 CO 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 175.30 175.14 2b9m s ALA 19 N -3.31 1.86 -0.10 2.13 0.00 0.70 -1.61 121.76 121.43 2b9m s ALA 19 Ca 0.05 -1.02 -0.21 0.00 0.00 0.00 0.00 51.96 50.78 2b9m s ALA 19 Cb 0.03 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.96 2b9m s ALA 19 CO -0.06 -0.63 0.62 0.71 0.00 0.00 0.00 175.76 176.40 2b9m s TYR 20 N 1.47 3.53 -0.25 0.00 1.51 0.20 -2.28 117.35 121.54 2b9m s TYR 20 Ca 0.02 1.10 -0.02 0.00 -1.01 0.00 0.00 57.07 57.15 2b9m s TYR 20 Cb -0.15 -2.72 0.02 0.00 -0.11 0.00 0.00 41.96 39.00 2b9m s TYR 20 CO -0.09 0.08 -0.05 0.42 -1.11 0.00 0.00 175.55 174.80 2b9m s ILE 21 N 0.88 3.03 -0.02 2.71 1.01 -0.80 -1.46 121.20 126.54 2b9m s ILE 21 Ca 0.33 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 60.11 2b9m s ILE 21 Cb -0.17 -2.51 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 2b9m s ILE 21 CO 0.15 0.23 -0.15 -2.28 0.00 0.00 0.00 174.94 172.89 2b9m s HIS 22 N 1.36 1.36 -0.15 3.97 2.46 -0.74 -1.71 115.29 121.84 2b9m s HIS 22 Ca 0.01 -0.30 -0.13 0.00 0.47 0.00 0.00 55.06 55.11 2b9m s HIS 22 Cb -0.16 -0.90 0.04 0.00 -0.13 0.00 0.00 32.58 31.43 2b9m s HIS 22 CO -0.04 -0.07 0.40 0.00 -2.47 0.00 0.00 174.74 172.56 2b9m s ALA 23 N -0.18 -0.98 0.34 1.58 0.00 -1.24 0.21 121.76 121.49 2b9m s ALA 23 Ca 0.02 1.16 0.08 0.00 0.00 0.00 0.00 51.96 53.22 2b9m s ALA 23 Cb -0.08 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 2b9m s ALA 23 CO 0.00 -0.20 0.27 -1.54 0.00 0.00 0.00 175.76 174.30 2b9m s SER 24 N 0.36 5.20 0.00 0.00 1.04 0.81 -4.36 113.70 116.76 2b9m s SER 24 Ca -0.01 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2b9m s SER 24 Cb -0.04 -0.93 0.00 0.00 0.10 0.00 0.00 66.02 65.15 2b9m s SER 24 CO -0.01 -0.35 0.76 -1.22 0.98 0.00 0.00 173.24 173.39 2b9m n TYR 25 N -1.35 0.00 -0.68 5.02 4.01 -1.26 -2.33 117.16 120.57 2b9m n TYR 25 Ca -0.02 -0.38 0.00 0.00 -0.16 0.00 0.00 57.90 57.34 2b9m n TYR 25 Cb 0.60 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 2b9m n TYR 25 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2b9m n ASN 26 N 0.71 0.00 -3.64 7.72 2.85 -1.26 -4.87 115.26 116.77 2b9m n ASN 26 Ca 0.00 -0.13 -0.07 0.00 -0.11 0.00 0.00 54.58 54.26 2b9m n ASN 26 Cb 0.35 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.30 2b9m n ASN 26 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2b9m s ASN 27 N 0.00 -0.35 -0.11 1.20 2.47 -0.99 -2.83 114.94 114.33 2b9m s ASN 27 Ca 0.00 0.68 0.02 0.00 0.42 0.00 0.00 52.86 53.98 2b9m s ASN 27 Cb 0.00 0.70 -0.00 0.00 -1.45 0.00 0.00 41.25 40.50 2b9m s ASN 27 CO 0.00 -0.12 -0.20 -0.89 -3.72 0.00 0.00 177.10 172.17 2b9m s THR 28 N 0.21 2.40 0.08 -5.21 2.01 -0.95 -0.13 115.64 114.05 2b9m s THR 28 Ca 0.04 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.23 2b9m s THR 28 Cb -0.05 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 2b9m s THR 28 CO -0.09 0.55 -0.21 0.27 -0.69 0.00 0.00 174.62 174.45 2b9m s ILE 29 N 0.39 1.74 -0.04 1.82 -4.36 0.13 -2.12 121.20 118.77 2b9m s ILE 29 Ca -0.15 -1.45 0.03 0.00 -0.26 0.00 0.00 60.65 58.82 2b9m s ILE 29 Cb -0.17 -1.55 0.00 0.00 1.25 0.00 0.00 42.46 41.99 2b9m s ILE 29 CO 0.07 0.04 -0.12 -0.69 0.24 0.00 0.00 174.94 174.48 2b9m s VAL 30 N -1.04 1.01 -0.05 8.37 1.01 0.35 -1.79 120.40 128.26 2b9m s VAL 30 Ca 0.07 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 2b9m s VAL 30 Cb -0.10 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.42 2b9m s VAL 30 CO 0.04 0.31 0.08 -0.89 0.00 0.00 0.00 175.10 174.64 2b9m s THR 31 N 0.24 -0.12 0.25 3.92 2.01 -0.54 -1.81 115.64 119.60 2b9m s THR 31 Ca -0.05 0.32 -0.25 0.00 0.31 0.00 0.00 61.69 62.02 2b9m s THR 31 Cb -0.11 -0.17 -0.09 0.00 0.01 0.00 0.00 72.50 72.14 2b9m s THR 31 CO 0.01 0.13 0.85 -0.63 -0.69 0.00 0.00 174.62 174.30 2b9m s ILE 32 N 1.75 4.31 0.17 1.82 -1.09 0.40 -0.63 121.20 127.93 2b9m s ILE 32 Ca -0.01 1.72 0.04 0.00 -2.23 0.00 0.00 60.65 60.16 2b9m s ILE 32 Cb -0.12 -4.06 -0.05 0.00 -1.58 0.00 0.00 42.46 36.65 2b9m s ILE 32 CO -0.04 0.31 -0.07 0.42 -1.23 0.00 0.00 174.94 174.34 2b9m s THR 33 N -1.41 1.09 0.91 2.92 -4.23 -0.64 0.41 115.64 114.69 2b9m s THR 33 Ca 0.43 -2.05 -0.12 0.00 -1.18 0.00 0.00 61.69 58.78 2b9m s THR 33 Cb -0.21 -2.00 0.14 0.00 1.34 0.00 0.00 72.50 71.77 2b9m s THR 33 CO 0.25 -0.61 1.13 1.51 -0.54 0.00 0.00 174.62 176.36 2b9m s ASP 34 N -3.20 3.47 0.00 3.99 -4.77 0.33 -2.53 116.67 113.96 2b9m s ASP 34 Ca 0.20 1.04 0.00 0.00 -3.30 0.00 0.00 52.55 50.49 2b9m s ASP 34 Cb 0.04 -1.64 0.00 0.00 -1.09 0.00 0.00 42.92 40.22 2b9m s ASP 34 CO 0.03 -2.58 0.74 -2.65 0.70 0.00 0.00 175.17 171.41 2b9m n PRO 35 N -3.79 0.00 -0.08 2.11 -0.02 -1.26 -2.22 135.00 129.74 2b9m n PRO 35 Ca 0.06 0.27 -0.17 0.00 -2.02 0.00 0.00 63.50 61.65 2b9m n PRO 35 Cb 0.59 -1.65 -0.06 0.00 -0.02 0.00 0.00 33.50 32.36 2b9m n PRO 35 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2b9m n ASP 36 N -1.24 1.46 0.00 2.55 10.43 -1.26 -4.94 116.55 123.55 2b9m n ASP 36 Ca 0.00 0.25 0.00 0.00 2.57 0.00 0.00 54.79 57.61 2b9m n ASP 36 Cb 0.15 -0.59 0.00 0.00 1.84 0.00 0.00 41.12 42.52 2b9m n ASP 36 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2b9m n GLY 37 N 1.87 0.00 3.70 0.44 0.00 -0.94 -5.13 105.19 105.13 2b9m n GLY 37 Ca -0.30 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2b9m n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b9m s ASN 38 N 0.00 6.91 1.27 1.61 -0.87 -1.26 -4.63 114.94 117.97 2b9m s ASN 38 Ca 0.00 2.09 -0.16 0.00 -1.57 0.00 0.00 52.86 53.23 2b9m s ASN 38 Cb 0.00 -2.57 0.33 0.00 -0.02 0.00 0.00 41.25 38.99 2b9m s ASN 38 CO 0.00 -0.65 0.97 -0.81 -2.57 0.00 0.00 177.10 174.05 2b9m n PRO 39 N 4.85 -3.21 0.04 -0.60 -0.04 -1.26 0.12 135.00 134.90 2b9m n PRO 39 Ca 0.12 -0.92 0.00 0.00 -0.04 0.00 0.00 63.50 62.66 2b9m n PRO 39 Cb 0.44 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 2b9m n PRO 39 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2b9m n ILE 40 N -5.26 0.15 -3.65 0.52 5.41 0.16 -4.42 119.36 112.27 2b9m n ILE 40 Ca 0.05 0.05 -0.10 0.00 1.00 0.00 0.00 62.75 63.74 2b9m n ILE 40 Cb 0.56 -0.52 -0.04 0.00 -0.71 0.00 0.00 39.64 38.93 2b9m n ILE 40 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2b9m s THR 41 N -1.36 0.03 0.18 1.39 -4.23 -1.24 -5.00 115.64 105.41 2b9m s THR 41 Ca 0.00 -0.57 -0.17 0.00 -1.18 0.00 0.00 61.69 59.77 2b9m s THR 41 Cb 0.00 -1.36 0.03 0.00 1.34 0.00 0.00 72.50 72.51 2b9m s THR 41 CO 0.00 -0.15 0.48 -1.66 -0.54 0.00 0.00 174.62 172.75 2b9m s TRP 42 N -3.83 -0.11 0.22 3.99 1.48 -1.26 -0.46 118.94 118.97 2b9m s TRP 42 Ca 0.06 -0.22 -0.18 0.00 -1.06 0.00 0.00 56.10 54.70 2b9m s TRP 42 Cb -0.00 0.33 0.02 0.00 -1.16 0.00 0.00 33.47 32.66 2b9m s TRP 42 CO -0.07 -0.85 0.57 0.45 -4.06 0.00 0.00 176.95 172.99 2b9m s SER 43 N -2.86 -0.25 0.01 -2.66 0.15 -0.75 -4.87 113.70 102.46 2b9m s SER 43 Ca 0.08 -0.55 -0.00 0.00 0.70 0.00 0.00 55.95 56.18 2b9m s SER 43 Cb 0.00 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 64.93 2b9m s SER 43 CO -0.05 -1.13 0.01 -1.54 1.20 0.00 0.00 173.24 171.73 2b9m n SER 44 N -0.38 -0.04 0.10 5.45 3.41 -1.26 -0.50 113.62 120.39 2b9m n SER 44 Ca -0.08 -1.03 -0.16 0.00 -0.26 0.00 0.00 58.87 57.35 2b9m n SER 44 Cb 0.62 0.07 -0.09 0.00 -0.26 0.00 0.00 64.21 64.54 2b9m n SER 44 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2b9m h GLY 45 N 0.04 -1.17 1.21 5.00 0.00 -1.64 -2.34 103.07 104.18 2b9m h GLY 45 Ca -0.01 0.65 0.00 0.00 0.00 0.00 0.00 47.33 47.97 2b9m h GLY 45 CO 0.01 -0.27 -0.00 0.61 0.00 0.00 0.00 176.54 176.88 2b9m n GLY 46 N -1.46 -1.10 0.12 4.60 0.00 -1.25 -2.85 105.19 103.25 2b9m n GLY 46 Ca -0.08 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 45.89 2b9m n GLY 46 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2b9m h VAL 47 N 0.04 0.00 -1.44 1.61 2.07 -1.74 -3.09 116.25 113.70 2b9m h VAL 47 Ca 0.00 -0.53 -0.59 0.00 0.82 0.00 0.00 66.70 66.40 2b9m h VAL 47 Cb 0.13 1.52 -0.42 0.00 -1.52 0.00 0.00 31.29 31.01 2b9m h VAL 47 CO 0.00 0.00 -0.69 -0.38 0.02 0.00 0.00 177.57 176.52 2b9m n ILE 48 N -2.38 2.42 -1.18 4.57 5.41 -1.13 -4.87 119.36 122.19 2b9m n ILE 48 Ca 0.05 -4.84 -0.06 0.00 1.00 0.00 0.00 62.75 58.90 2b9m n ILE 48 Cb 0.43 -1.25 -0.03 0.00 -0.71 0.00 0.00 39.64 38.08 2b9m n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2b9m n GLY 49 N -0.51 0.68 3.60 7.39 0.00 -1.17 -4.96 105.19 110.23 2b9m n GLY 49 Ca 0.40 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 2b9m n GLY 49 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b9m s TYR 50 N -1.71 3.03 0.03 1.61 4.12 -1.14 -4.99 117.35 118.29 2b9m s TYR 50 Ca 0.00 0.70 -0.26 0.00 0.02 0.00 0.00 57.07 57.54 2b9m s TYR 50 Cb 0.00 -3.77 -0.05 0.00 -1.52 0.00 0.00 41.96 36.62 2b9m s TYR 50 CO 0.00 -0.91 0.79 0.15 0.02 0.00 0.00 175.55 175.60 2b9m s LYS 51 N 3.60 4.51 6.68 -0.62 -0.14 -1.26 -3.82 119.74 128.70 2b9m s LYS 51 Ca 0.39 1.10 0.00 0.00 -1.36 0.00 0.00 55.97 56.10 2b9m s LYS 51 Cb -0.11 -3.38 0.00 0.00 -1.68 0.00 0.00 37.83 32.65 2b9m s LYS 51 CO 0.21 0.22 0.00 0.41 -0.76 0.00 0.00 175.35 175.43 2b9m n GLY 52 N 2.52 3.29 0.23 -3.33 0.00 -1.26 -2.70 105.19 103.94 2b9m n GLY 52 Ca -0.01 0.26 0.07 0.00 0.00 0.00 0.00 46.02 46.34 2b9m n GLY 52 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2b9m h SER 53 N 0.00 0.00 0.13 1.61 4.64 -1.91 -2.69 113.55 115.34 2b9m h SER 53 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b9m h SER 53 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2b9m h SER 53 CO 0.00 0.19 0.00 0.54 -0.87 0.00 0.00 176.83 176.69 2b9m n ARG 54 N -4.05 0.01 0.12 4.77 5.12 -1.10 -1.52 116.66 120.01 2b9m n ARG 54 Ca -0.02 0.44 -0.01 0.00 -1.93 0.00 0.00 57.85 56.32 2b9m n ARG 54 Cb 0.27 -1.52 0.09 0.00 -1.16 0.00 0.00 32.46 30.14 2b9m n ARG 54 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 2b9m h LYS 55 N 0.00 0.00 -2.18 5.56 1.57 -1.68 -3.37 116.57 116.47 2b9m h LYS 55 Ca 0.00 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.05 2b9m h LYS 55 Cb 0.07 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.05 2b9m h LYS 55 CO 0.00 0.68 0.45 0.41 -0.57 0.00 0.00 179.45 180.43 2b9m n GLY 56 N 0.70 5.91 3.09 3.86 0.00 -0.58 -2.23 105.19 115.95 2b9m n GLY 56 Ca -0.00 -2.64 -0.18 0.00 0.00 0.00 0.00 46.02 43.20 2b9m n GLY 56 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2b9m s THR 57 N -4.55 0.86 0.25 2.61 -1.32 -1.25 -4.74 115.64 107.51 2b9m s THR 57 Ca 0.44 -0.90 -0.03 0.00 -1.21 0.00 0.00 61.69 60.00 2b9m s THR 57 Cb 0.26 -0.81 0.24 0.00 -1.51 0.00 0.00 72.50 70.68 2b9m s THR 57 CO -0.17 -0.07 1.71 1.55 -2.21 0.00 0.00 174.62 175.43 2b9m h PRO 58 N 5.00 0.38 -0.72 7.08 0.13 -1.70 0.44 132.00 142.61 2b9m h PRO 58 Ca -0.36 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2b9m h PRO 58 Cb 1.19 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2b9m h PRO 58 CO 0.44 0.25 0.45 -0.92 -0.23 0.00 0.00 178.00 177.99 2b9m h TYR 59 N 0.40 0.94 0.05 1.56 3.20 -1.90 0.39 116.97 121.60 2b9m h TYR 59 Ca 0.44 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.32 2b9m h TYR 59 Cb 0.73 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.69 2b9m h TYR 59 CO -0.18 0.62 -0.02 0.00 -1.64 0.00 0.00 178.16 176.94 2b9m h ALA 60 N 1.24 -0.06 -1.06 1.82 0.00 -1.51 -2.19 119.26 117.51 2b9m h ALA 60 Ca 0.26 -0.13 0.28 0.00 0.00 0.00 0.00 54.91 55.32 2b9m h ALA 60 Cb -0.06 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.65 2b9m h ALA 60 CO -0.05 -0.41 0.67 0.00 0.00 0.00 0.00 179.25 179.46 2b9m h ALA 61 N 0.63 2.20 0.48 0.00 0.00 0.56 -0.71 119.26 122.42 2b9m h ALA 61 Ca -0.01 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2b9m h ALA 61 Cb 0.28 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2b9m h ALA 61 CO 0.01 -0.65 -0.23 0.37 0.00 0.00 0.00 179.25 178.76 2b9m h GLN 62 N 0.39 -0.62 -0.78 0.00 -0.00 0.01 -2.71 115.11 111.41 2b9m h GLN 62 Ca 0.63 0.04 0.11 0.00 -0.00 0.00 0.00 58.65 59.44 2b9m h GLN 62 Cb 1.57 0.14 -0.08 0.00 0.00 0.00 0.00 27.48 29.11 2b9m h GLN 62 CO -0.35 -0.31 0.39 -0.07 0.00 0.00 0.00 178.83 178.49 2b9m h LEU 63 N -0.92 0.49 -0.22 -2.39 3.38 -0.51 -0.38 115.31 114.75 2b9m h LEU 63 Ca -0.07 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2b9m h LEU 63 Cb 0.59 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2b9m h LEU 63 CO 0.11 0.25 0.07 0.00 0.09 0.00 0.00 178.44 178.96 2b9m h ALA 64 N 1.49 0.29 -0.49 1.53 0.00 -1.47 0.29 119.26 120.90 2b9m h ALA 64 Ca 0.40 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.27 2b9m h ALA 64 Cb 0.48 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.11 2b9m h ALA 64 CO -0.31 -0.09 0.01 0.00 0.00 0.00 0.00 179.25 178.85 2b9m h ALA 65 N 0.90 0.47 0.87 0.00 0.00 -0.94 0.40 119.26 120.96 2b9m h ALA 65 Ca 0.07 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2b9m h ALA 65 Cb 0.22 0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.26 2b9m h ALA 65 CO -0.00 -0.38 -0.43 -0.07 0.00 0.00 0.00 179.25 178.36 2b9m h LEU 66 N 0.12 -1.03 -1.00 0.00 3.38 -0.77 -2.33 115.31 113.68 2b9m h LEU 66 Ca 0.25 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.34 2b9m h LEU 66 Cb 0.37 0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.31 2b9m h LEU 66 CO -0.40 -0.72 0.64 -0.78 0.09 0.00 0.00 178.44 177.26 2b9m h ASP 67 N -1.19 0.98 -0.44 -0.43 -0.00 0.00 0.46 116.42 115.81 2b9m h ASP 67 Ca -0.12 0.03 -0.06 0.00 -0.00 0.00 0.00 57.03 56.88 2b9m h ASP 67 Cb 0.92 -0.18 -0.02 0.00 -0.00 0.00 0.00 39.33 40.05 2b9m h ASP 67 CO 0.19 0.58 0.06 0.00 -0.00 0.00 0.00 179.24 180.07 2b9m h ALA 68 N 1.49 1.16 0.00 -0.78 0.00 -0.22 -1.89 119.26 119.03 2b9m h ALA 68 Ca 0.46 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 2b9m h ALA 68 Cb 0.30 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2b9m h ALA 68 CO -0.21 0.55 -0.69 0.00 0.00 0.00 0.00 179.25 178.90 2b9m h ALA 69 N 1.31 0.71 -0.41 0.00 0.00 -0.50 -2.00 119.26 118.36 2b9m h ALA 69 Ca 0.16 -0.63 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 2b9m h ALA 69 Cb 0.37 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2b9m h ALA 69 CO 0.01 0.86 0.12 0.87 0.00 0.00 0.00 179.25 181.11 2b9m h LYS 70 N 0.00 0.65 -0.00 0.00 1.57 0.47 -2.21 116.57 117.05 2b9m h LYS 70 Ca -0.01 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2b9m h LYS 70 Cb 1.34 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.56 2b9m h LYS 70 CO 0.09 0.66 -0.30 1.63 -0.57 0.00 0.00 179.45 180.95 2b9m n LYS 71 N -4.57 0.18 -0.03 3.15 5.02 -0.77 -3.28 118.16 117.87 2b9m n LYS 71 Ca -0.00 -0.08 -0.12 0.00 -2.02 0.00 0.00 58.31 56.09 2b9m n LYS 71 Cb 0.19 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.72 2b9m n LYS 71 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b9m h ALA 72 N 3.15 0.61 -0.32 7.82 0.00 -1.02 -3.10 119.26 126.39 2b9m h ALA 72 Ca 0.00 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2b9m h ALA 72 Cb 0.48 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2b9m h ALA 72 CO 0.00 0.69 0.18 0.52 0.00 0.00 0.00 179.25 180.64 2b9m h MET 73 N 0.52 0.43 -1.00 0.00 2.86 -1.39 -2.49 114.93 113.86 2b9m h MET 73 Ca 0.01 -0.03 0.05 0.00 -2.06 0.00 0.00 59.70 57.66 2b9m h MET 73 Cb 1.12 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.63 2b9m h MET 73 CO 0.11 0.31 0.65 0.00 1.06 0.00 0.00 176.91 179.04 2b9m h ALA 74 N 1.76 1.37 -0.68 6.32 0.00 -1.62 -0.32 119.26 126.09 2b9m h ALA 74 Ca 0.12 -0.04 -0.40 0.00 0.00 0.00 0.00 54.91 54.59 2b9m h ALA 74 Cb -0.00 -0.34 -0.21 0.00 0.00 0.00 0.00 17.79 17.24 2b9m h ALA 74 CO -0.02 0.51 0.51 0.66 0.00 0.00 0.00 179.25 180.92 2b9m n TYR 75 N -4.46 2.15 -3.75 0.00 4.01 -1.16 -3.67 117.16 110.28 2b9m n TYR 75 Ca 0.14 -1.81 -0.27 0.00 -0.16 0.00 0.00 57.90 55.79 2b9m n TYR 75 Cb 0.13 -0.90 0.02 0.00 -0.31 0.00 0.00 39.34 38.28 2b9m n TYR 75 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2b9m n GLY 76 N -0.44 -0.64 3.56 2.72 0.00 -0.13 -2.26 105.19 108.00 2b9m n GLY 76 Ca 0.42 0.31 -0.34 0.00 0.00 0.00 0.00 46.02 46.41 2b9m n GLY 76 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2b9m s MET 77 N -6.11 3.06 0.06 1.61 -1.94 -0.95 -0.93 119.30 114.10 2b9m s MET 77 Ca 0.25 -0.53 0.00 0.00 -1.71 0.00 0.00 55.69 53.70 2b9m s MET 77 Cb -0.09 -2.70 0.00 0.00 2.01 0.00 0.00 34.83 34.05 2b9m s MET 77 CO 0.86 0.53 0.00 1.04 -0.01 0.00 0.00 175.02 177.44 2b9m n GLN 78 N 2.63 0.00 -2.20 2.03 3.00 -1.22 -4.26 117.38 117.36 2b9m n GLN 78 Ca -0.18 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.39 2b9m n GLN 78 Cb 0.53 -0.22 -0.02 0.00 0.00 0.00 0.00 30.24 30.53 2b9m n GLN 78 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2b9m s SER 79 N -5.13 6.80 -0.12 1.08 0.15 -0.98 -1.88 113.70 113.61 2b9m s SER 79 Ca 0.00 1.98 -0.03 0.00 0.70 0.00 0.00 55.95 58.60 2b9m s SER 79 Cb 0.00 -2.54 0.05 0.00 -1.71 0.00 0.00 66.02 61.82 2b9m s SER 79 CO 0.00 -0.85 0.06 -0.69 1.20 0.00 0.00 173.24 172.96 2b9m s VAL 80 N 3.78 0.08 0.15 4.45 1.01 -0.23 -1.42 120.40 128.22 2b9m s VAL 80 Ca 0.65 -0.01 -0.13 0.00 0.00 0.00 0.00 61.98 62.48 2b9m s VAL 80 Cb -0.28 -0.52 -0.07 0.00 0.00 0.00 0.00 36.38 35.51 2b9m s VAL 80 CO 0.23 -0.05 0.53 -1.81 0.00 0.00 0.00 175.10 173.99 2b9m s ASP 81 N 2.08 6.76 0.04 3.32 1.11 -1.02 -0.55 116.67 128.41 2b9m s ASP 81 Ca 0.03 1.01 0.07 0.00 0.18 0.00 0.00 52.55 53.84 2b9m s ASP 81 Cb -0.14 -2.26 -0.03 0.00 1.07 0.00 0.00 42.92 41.55 2b9m s ASP 81 CO -0.07 0.08 -0.19 -0.69 1.18 0.00 0.00 175.17 175.48 2b9m s VAL 82 N -1.52 2.69 -0.08 -1.27 1.01 0.13 -0.22 120.40 121.15 2b9m s VAL 82 Ca 0.39 -1.23 0.04 0.00 0.00 0.00 0.00 61.98 61.18 2b9m s VAL 82 Cb -0.14 -2.13 -0.00 0.00 0.00 0.00 0.00 36.38 34.11 2b9m s VAL 82 CO 0.19 0.33 -0.23 -0.63 0.00 0.00 0.00 175.10 174.77 2b9m s ILE 83 N -0.92 1.93 -0.12 2.22 1.09 -0.97 0.53 121.20 124.97 2b9m s ILE 83 Ca 0.14 -0.96 -0.08 0.00 -1.10 0.00 0.00 60.65 58.65 2b9m s ILE 83 Cb -0.10 -1.67 -0.04 0.00 -1.06 0.00 0.00 42.46 39.59 2b9m s ILE 83 CO 0.05 0.53 0.17 0.68 -0.10 0.00 0.00 174.94 176.27 2b9m s VAL 84 N 0.24 5.44 -0.03 2.92 -7.23 -0.26 -1.90 120.40 119.59 2b9m s VAL 84 Ca -0.14 0.28 0.01 0.00 -1.81 0.00 0.00 61.98 60.31 2b9m s VAL 84 Cb -0.16 -3.45 0.02 0.00 0.56 0.00 0.00 36.38 33.35 2b9m s VAL 84 CO 0.07 0.58 -0.01 -0.13 -0.31 0.00 0.00 175.10 175.31 2b9m s ARG 85 N -0.80 0.33 0.34 4.82 1.81 -0.70 -1.81 118.95 122.94 2b9m s ARG 85 Ca 0.15 0.04 0.00 0.00 -1.72 0.00 0.00 55.73 54.20 2b9m s ARG 85 Cb -0.12 -0.47 0.00 0.00 -0.45 0.00 0.00 34.95 33.91 2b9m s ARG 85 CO 0.04 -0.10 0.00 0.41 -0.68 0.00 0.00 175.30 174.97 2b9m n GLY 86 N 3.98 -2.30 3.76 -3.53 0.00 -1.26 -3.62 105.19 102.23 2b9m n GLY 86 Ca -0.25 -1.21 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 2b9m n GLY 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b9m s THR 87 N -2.70 5.01 0.11 2.61 -4.23 -1.26 -4.85 115.64 110.33 2b9m s THR 87 Ca 0.00 0.03 0.10 0.00 -1.18 0.00 0.00 61.69 60.64 2b9m s THR 87 Cb 0.00 -3.19 -0.04 0.00 1.34 0.00 0.00 72.50 70.62 2b9m s THR 87 CO 0.00 0.57 -0.26 -0.83 -0.54 0.00 0.00 174.62 173.57 2b9m s GLY 88 N -0.62 1.48 -1.25 3.99 0.00 -1.26 -4.36 107.32 105.29 2b9m s GLY 88 Ca 0.12 -1.39 -0.15 0.00 0.00 0.00 0.00 44.72 43.30 2b9m s GLY 88 CO 0.02 -1.36 1.58 0.00 0.00 0.00 0.00 173.10 173.34 2b9m n ALA 89 N 1.09 3.91 0.00 3.20 0.00 -1.26 -3.67 120.51 123.78 2b9m n ALA 89 Ca -0.18 -4.12 0.00 0.00 0.00 0.00 0.00 53.44 49.14 2b9m n ALA 89 Cb 0.53 -3.23 0.00 0.00 0.00 0.00 0.00 19.45 16.75 2b9m n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b9m n GLY 90 N 4.40 0.85 0.40 0.00 0.00 -1.26 -2.33 105.19 107.25 2b9m n GLY 90 Ca 0.41 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.64 2b9m n GLY 90 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2b9m h ARG 91 N 0.00 0.15 0.05 1.61 2.43 -1.92 -2.46 114.38 114.25 2b9m h ARG 91 Ca 0.00 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.00 2b9m h ARG 91 Cb 0.00 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 2b9m h ARG 91 CO 0.00 0.10 -0.81 1.49 -1.51 0.00 0.00 179.97 179.24 2b9m h GLU 92 N 0.16 0.11 -0.40 0.20 4.57 -1.95 -1.89 114.58 115.38 2b9m h GLU 92 Ca 0.35 -0.18 0.11 0.00 -1.18 0.00 0.00 59.36 58.46 2b9m h GLU 92 Cb 1.15 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.80 2b9m h GLU 92 CO -0.06 1.09 0.46 1.96 -1.18 0.00 0.00 179.01 181.28 2b9m h GLN 93 N -0.73 0.00 0.35 1.92 1.08 -1.82 0.86 115.11 116.76 2b9m h GLN 93 Ca -0.19 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.99 2b9m h GLN 93 Cb 1.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 2b9m h GLN 93 CO -0.02 0.00 -0.17 0.00 -0.95 0.00 0.00 178.83 177.70 2b9m h ALA 94 N 1.45 -0.47 -0.51 3.87 0.00 -1.45 -2.56 119.26 119.59 2b9m h ALA 94 Ca 0.19 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.01 2b9m h ALA 94 Cb 1.11 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 19.02 2b9m h ALA 94 CO -0.00 -0.47 0.18 0.82 0.00 0.00 0.00 179.25 179.78 2b9m h ILE 95 N -1.05 0.83 0.00 0.00 2.04 0.10 0.07 117.51 119.49 2b9m h ILE 95 Ca -0.05 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 2b9m h ILE 95 Cb 0.46 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 2b9m h ILE 95 CO 0.08 0.07 -0.14 0.03 0.00 0.00 0.00 178.15 178.18 2b9m h ARG 96 N 0.36 0.00 -0.05 2.37 3.08 0.45 -0.89 114.38 119.70 2b9m h ARG 96 Ca 0.24 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.11 2b9m h ARG 96 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2b9m h ARG 96 CO -0.25 0.14 -0.78 0.00 -1.07 0.00 0.00 179.97 178.02 2b9m h ALA 97 N 1.86 0.57 -0.08 0.04 0.00 -0.61 -1.27 119.26 119.77 2b9m h ALA 97 Ca -0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 54.91 54.17 2b9m h ALA 97 Cb 0.33 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2b9m h ALA 97 CO 0.02 0.80 -0.39 -0.07 0.00 0.00 0.00 179.25 179.60 2b9m h LEU 98 N 0.22 0.17 -0.18 0.00 3.38 -0.18 -2.12 115.31 116.60 2b9m h LEU 98 Ca -0.04 -0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.64 2b9m h LEU 98 Cb 1.36 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 42.07 2b9m h LEU 98 CO 0.13 0.55 -0.87 1.56 0.09 0.00 0.00 178.44 179.90 2b9m h GLN 99 N 0.14 0.58 0.00 1.13 4.20 -1.14 -3.34 115.11 116.69 2b9m h GLN 99 Ca 0.01 -0.55 -0.13 0.00 0.06 0.00 0.00 58.65 58.05 2b9m h GLN 99 Cb 0.76 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 2b9m h GLN 99 CO 0.06 1.17 -0.63 0.00 -0.67 0.00 0.00 178.83 178.75 2b9m h ALA 100 N 0.66 0.77 0.00 3.87 0.00 -1.03 -3.27 119.26 120.26 2b9m h ALA 100 Ca -0.07 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2b9m h ALA 100 Cb 1.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2b9m h ALA 100 CO 0.16 0.79 0.00 0.45 0.00 0.00 0.00 179.25 180.65 2b9m n SER 101 N -3.52 1.59 0.00 0.00 2.88 -0.81 -4.93 113.62 108.82 2b9m n SER 101 Ca -0.00 -1.60 0.00 0.00 -1.33 0.00 0.00 58.87 55.94 2b9m n SER 101 Cb 0.69 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 2b9m n SER 101 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b9m n GLY 102 N 0.35 2.59 3.22 0.46 0.00 -1.24 -4.95 105.19 105.61 2b9m n GLY 102 Ca 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2b9m n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b9m n LEU 103 N 0.00 -4.04 0.00 0.99 7.99 -1.26 -4.14 117.00 116.54 2b9m n LEU 103 Ca 0.00 0.35 0.00 0.00 -0.01 0.00 0.00 56.01 56.35 2b9m n LEU 103 Cb 0.00 -1.91 0.00 0.00 -0.11 0.00 0.00 43.42 41.40 2b9m n LEU 103 CO 0.00 -1.24 0.00 1.67 -1.51 0.00 0.00 177.39 176.31 2b9m n GLN 104 N 0.64 0.00 -2.43 3.23 -0.06 -0.79 -4.68 117.38 113.30 2b9m n GLN 104 Ca -0.02 0.00 -0.37 0.00 -2.00 0.00 0.00 57.00 54.61 2b9m n GLN 104 Cb 0.50 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.65 2b9m n GLN 104 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 2b9m s VAL 105 N 0.00 3.81 0.00 1.69 1.01 -1.26 -1.07 120.40 124.58 2b9m s VAL 105 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2b9m s VAL 105 Cb 0.00 -4.80 0.00 0.00 0.00 0.00 0.00 36.38 31.58 2b9m s VAL 105 CO 0.00 -1.69 0.50 0.29 0.00 0.00 0.00 175.10 174.20 2b9m n LYS 106 N 8.86 0.00 -4.05 2.72 4.76 0.29 -4.98 118.16 125.76 2b9m n LYS 106 Ca 0.35 0.29 -0.12 0.00 -2.87 0.00 0.00 58.31 55.96 2b9m n LYS 106 Cb 0.50 -1.10 -0.04 0.00 -1.84 0.00 0.00 35.03 32.54 2b9m n LYS 106 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2b9m s SER 107 N -2.05 0.46 0.20 4.39 1.04 -1.23 -5.00 113.70 111.51 2b9m s SER 107 Ca 0.00 -1.27 0.11 0.00 0.48 0.00 0.00 55.95 55.27 2b9m s SER 107 Cb 0.00 0.63 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 2b9m s SER 107 CO 0.00 -1.24 -0.21 -0.63 0.98 0.00 0.00 173.24 172.14 2b9m s ILE 108 N -3.41 2.50 -0.03 -1.02 1.01 -1.26 0.20 121.20 119.20 2b9m s ILE 108 Ca 0.27 -1.99 0.01 0.00 0.00 0.00 0.00 60.65 58.94 2b9m s ILE 108 Cb -0.00 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 40.27 2b9m s ILE 108 CO 0.15 -0.13 -0.03 -0.69 0.00 0.00 0.00 174.94 174.24 2b9m s VAL 109 N -1.73 0.40 0.14 2.92 1.01 0.19 -4.84 120.40 118.48 2b9m s VAL 109 Ca 0.22 -0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 2b9m s VAL 109 Cb -0.08 -0.42 -0.06 0.00 0.00 0.00 0.00 36.38 35.81 2b9m s VAL 109 CO 0.11 0.17 1.00 -0.62 0.00 0.00 0.00 175.10 175.77 2b9m s ASP 110 N 0.66 7.44 0.00 3.32 -1.08 -1.26 -1.11 116.67 124.65 2b9m s ASP 110 Ca -0.08 1.89 0.00 0.00 -0.52 0.00 0.00 52.55 53.84 2b9m s ASP 110 Cb -0.11 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 2b9m s ASP 110 CO -0.00 -0.10 0.00 -0.67 0.52 0.00 0.00 175.17 174.92 2b9m n ASP 111 N 2.61 0.00 -0.56 -0.34 4.64 -1.16 -4.88 116.55 116.85 2b9m n ASP 111 Ca 0.02 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.43 2b9m n ASP 111 Cb 0.48 0.03 0.00 0.00 -1.04 0.00 0.00 41.12 40.59 2b9m n ASP 111 CO 0.00 0.00 0.00 0.41 -0.82 0.00 0.00 177.20 176.79 2b9m n THR 112 N -2.21 -0.17 -3.93 5.18 -1.04 -0.75 -4.77 114.28 106.59 2b9m n THR 112 Ca 0.00 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.66 2b9m n THR 112 Cb 0.00 -0.45 -0.14 0.00 -1.82 0.00 0.00 70.33 67.92 2b9m n THR 112 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2b9m s PRO 113 N 0.00 3.46 -0.06 -2.82 0.04 -1.26 -4.82 135.00 129.54 2b9m s PRO 113 Ca 0.00 -0.58 -0.04 0.00 0.04 0.00 0.00 61.00 60.42 2b9m s PRO 113 Cb 0.00 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.44 2b9m s PRO 113 CO 0.00 -0.15 0.13 0.54 0.04 0.00 0.00 177.00 177.56 2b9m s VAL 114 N 1.40 5.24 0.84 -0.36 0.11 -1.26 -5.03 120.40 121.33 2b9m s VAL 114 Ca 0.05 -0.07 -0.11 0.00 -2.93 0.00 0.00 61.98 58.91 2b9m s VAL 114 Cb -0.14 -3.36 0.09 0.00 -1.53 0.00 0.00 36.38 31.44 2b9m s VAL 114 CO -0.01 0.47 1.09 -2.84 -3.33 0.00 0.00 175.10 170.48 2b9m s PRO 115 N -1.46 1.76 -0.06 1.54 0.02 -1.26 -4.91 135.00 130.63 2b9m s PRO 115 Ca 0.21 0.75 0.00 0.00 0.02 0.00 0.00 61.00 61.98 2b9m s PRO 115 Cb -0.12 -1.87 0.08 0.00 0.02 0.00 0.00 34.50 32.60 2b9m s PRO 115 CO 0.11 -1.87 1.26 0.72 -0.33 0.00 0.00 177.00 176.88 2b9m n HIS 116 N -3.62 0.37 -2.60 6.54 8.25 -1.26 -4.86 115.22 118.03 2b9m n HIS 116 Ca 0.07 -0.76 -0.01 0.00 -0.26 0.00 0.00 57.72 56.76 2b9m n HIS 116 Cb 0.56 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 31.29 2b9m n HIS 116 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2b9m n ASN 117 N 0.45 -7.38 0.00 0.41 3.02 -1.26 -5.04 115.26 105.47 2b9m n ASN 117 Ca 0.07 1.15 0.00 0.00 -0.03 0.00 0.00 54.58 55.77 2b9m n ASN 117 Cb 0.62 -4.89 0.00 0.00 -0.61 0.00 0.00 39.78 34.90 2b9m n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b9m n GLY 118 N 0.47 0.92 2.78 7.41 0.00 -1.26 -5.04 105.19 110.46 2b9m n GLY 118 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2b9m n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b9m n ARG 120 N 4.02 2.25 -0.99 0.00 1.74 -1.26 -4.98 116.66 117.44 2b9m n ARG 120 Ca 0.04 0.81 -0.03 0.00 -0.77 0.00 0.00 57.85 57.90 2b9m n ARG 120 Cb 0.38 -2.55 0.01 0.00 -1.02 0.00 0.00 32.46 29.28 2b9m n ARG 120 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2b9m n PRO 121 N 2.96 0.65 -1.78 5.56 -0.04 -1.26 -5.10 135.00 135.98 2b9m n PRO 121 Ca 0.14 -0.37 -0.31 0.00 -0.04 0.00 0.00 63.50 62.91 2b9m n PRO 121 Cb 0.31 -0.07 0.03 0.00 -0.04 0.00 0.00 33.50 33.73 2b9m n PRO 121 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2b9m s LYS 122 N -2.62 3.18 0.49 0.54 1.02 -1.26 -4.69 119.74 116.40 2b9m s LYS 122 Ca 0.09 0.99 0.37 0.00 0.02 0.00 0.00 55.97 57.44 2b9m s LYS 122 Cb -0.01 -2.02 1.52 0.00 -0.52 0.00 0.00 37.83 36.81 2b9m s LYS 122 CO 0.06 -0.90 1.66 -0.22 -0.92 0.00 0.00 175.35 175.02 2b9m h LYS 123 N -0.26 0.06 -0.20 1.68 3.64 -1.98 0.37 116.57 119.88 2b9m h LYS 123 Ca -0.45 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2b9m h LYS 123 Cb 1.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2b9m h LYS 123 CO 0.58 0.04 0.04 -0.22 -2.27 0.00 0.00 179.45 177.62 2b9m h LYS 124 N 0.07 0.32 -0.09 1.90 3.64 -2.05 -3.24 116.57 117.12 2b9m h LYS 124 Ca 0.79 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 60.08 2b9m h LYS 124 Cb 2.80 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 34.58 2b9m h LYS 124 CO -0.20 0.47 0.00 1.19 -2.27 0.00 0.00 179.45 178.64 2b9m n PHE 125 N -4.75 0.09 0.00 1.91 3.01 0.97 -4.78 117.46 113.90 2b9m n PHE 125 Ca -0.04 -0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.37 2b9m n PHE 125 Cb 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 2b9m n PHE 125 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2b9m n ARG 126 N 1.05 0.00 -1.21 -1.08 1.74 0.64 -4.64 116.66 113.16 2b9m n ARG 126 Ca 0.16 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.14 2b9m n ARG 126 Cb 0.53 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.93 2b9m n ARG 126 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2b9m n LYS 127 N 0.00 -1.36 0.00 5.56 4.76 -1.26 -4.89 118.16 120.97 2b9m n LYS 127 Ca 0.00 0.61 0.00 0.00 -2.87 0.00 0.00 58.31 56.05 2b9m n LYS 127 Cb 0.00 -4.72 0.00 0.00 -1.84 0.00 0.00 35.03 28.47 2b9m n LYS 127 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2b9m n ALA 128 N 0.33 0.00 -0.42 7.82 0.00 -1.26 -5.23 120.51 121.75 2b9m n ALA 128 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2b9m n ALA 128 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2b9m n ALA 128 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93