#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2whg s TYR 33 N 0.00 2.88 0.34 -1.84 5.04 -1.26 -4.94 117.35 117.58 2whg s TYR 33 Ca 0.00 0.32 -0.28 0.00 -2.44 0.00 0.00 57.07 54.67 2whg s TYR 33 Cb 0.00 -4.15 -0.12 0.00 0.35 0.00 0.00 41.96 38.04 2whg s TYR 33 CO 0.00 -4.37 1.41 -2.30 -1.34 0.00 0.00 175.55 168.95 2whg n PRO 34 N 4.03 2.41 -4.60 4.97 -0.02 -1.26 -5.03 135.00 135.50 2whg n PRO 34 Ca 0.16 0.85 -0.27 0.00 -2.02 0.00 0.00 63.50 62.22 2whg n PRO 34 Cb 0.35 -2.52 -0.11 0.00 -0.02 0.00 0.00 33.50 31.20 2whg n PRO 34 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2whg s THR 35 N -0.91 1.85 0.42 3.45 -4.23 -1.26 -4.98 115.64 109.98 2whg s THR 35 Ca 0.56 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.16 2whg s THR 35 Cb -0.53 -2.94 0.24 0.00 1.34 0.00 0.00 72.50 70.61 2whg s THR 35 CO 0.60 0.00 2.04 1.62 -0.54 0.00 0.00 174.62 178.35 2whg h VAL 36 N 1.81 1.10 0.00 2.29 3.04 -1.96 -1.56 116.25 120.97 2whg h VAL 36 Ca -0.43 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 64.97 2whg h VAL 36 Cb 1.24 0.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.26 2whg h VAL 36 CO 0.79 0.11 0.00 0.78 -1.01 0.00 0.00 177.57 178.24 2whg h ASN 37 N 0.39 0.00 -0.00 3.17 4.21 -1.99 -1.69 115.58 119.67 2whg h ASN 37 Ca 0.10 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.61 2whg h ASN 37 Cb 0.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 2whg h ASN 37 CO -0.01 0.00 -0.92 -0.62 -1.29 0.00 0.00 177.43 174.58 2whg n GLU 38 N -2.54 0.18 -3.84 0.81 1.02 -0.60 -4.88 120.64 110.79 2whg n GLU 38 Ca 0.01 -0.15 -0.36 0.00 -0.02 0.00 0.00 57.16 56.64 2whg n GLU 38 Cb 0.23 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.02 2whg n GLU 38 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2whg s ILE 39 N -2.92 3.42 0.66 -3.67 1.01 -0.64 -4.96 121.20 114.10 2whg s ILE 39 Ca 0.10 -1.08 -0.16 0.00 0.00 0.00 0.00 60.65 59.50 2whg s ILE 39 Cb 0.16 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.77 2whg s ILE 39 CO 0.83 -0.03 1.16 -2.84 0.00 0.00 0.00 174.94 174.06 2whg s PRO 40 N 1.37 2.68 -0.11 2.79 0.02 -1.26 -4.88 135.00 135.61 2whg s PRO 40 Ca -0.01 1.61 -0.38 0.00 0.02 0.00 0.00 61.00 62.24 2whg s PRO 40 Cb -0.18 -1.92 -0.16 0.00 0.02 0.00 0.00 34.50 32.26 2whg s PRO 40 CO 0.00 -1.39 1.60 0.28 -0.33 0.00 0.00 177.00 177.17 2whg n VAL 41 N -2.24 0.21 -0.99 3.83 0.31 -1.26 -1.51 118.33 116.68 2whg n VAL 41 Ca 0.12 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 2whg n VAL 41 Cb 0.51 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 2whg n VAL 41 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2whg n GLY 42 N 3.58 0.70 3.91 2.92 0.00 -1.26 -5.04 105.19 109.99 2whg n GLY 42 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 2whg n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2whg s GLU 43 N -0.01 3.07 -0.01 1.61 2.02 -0.57 -4.54 118.70 120.27 2whg s GLU 43 Ca 0.00 -1.02 0.05 0.00 0.02 0.00 0.00 54.97 54.02 2whg s GLU 43 Cb 0.00 -2.70 -0.01 0.00 0.10 0.00 0.00 34.13 31.52 2whg s GLU 43 CO 0.00 0.25 -0.17 0.08 0.02 0.00 0.00 175.26 175.44 2whg s VAL 44 N -2.14 1.37 0.11 2.63 1.01 -1.26 -4.41 120.40 117.70 2whg s VAL 44 Ca 0.38 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.67 2whg s VAL 44 Cb -0.08 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 2whg s VAL 44 CO 0.28 0.39 0.00 -0.13 0.00 0.00 0.00 175.10 175.64 2whg s ARG 45 N -0.38 2.54 -0.07 2.72 1.81 -0.26 -4.98 118.95 120.32 2whg s ARG 45 Ca 0.06 -0.88 0.02 0.00 -1.72 0.00 0.00 55.73 53.21 2whg s ARG 45 Cb -0.07 -2.52 -0.03 0.00 -0.45 0.00 0.00 34.95 31.89 2whg s ARG 45 CO -0.01 0.53 -0.10 -0.51 -0.68 0.00 0.00 175.30 174.53 2whg s LEU 46 N -2.43 2.97 -0.11 2.53 1.43 -1.26 -1.17 118.68 120.64 2whg s LEU 46 Ca 0.26 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 2whg s LEU 46 Cb -0.11 -1.64 0.02 0.00 0.03 0.00 0.00 46.19 44.49 2whg s LEU 46 CO 0.19 0.33 -0.12 -0.47 0.23 0.00 0.00 176.35 176.50 2whg s TYR 47 N -0.62 1.78 -0.22 0.29 5.04 0.07 -4.98 117.35 118.71 2whg s TYR 47 Ca 0.09 -0.87 -0.29 0.00 -2.44 0.00 0.00 57.07 53.56 2whg s TYR 47 Cb -0.11 -1.34 -0.01 0.00 0.35 0.00 0.00 41.96 40.84 2whg s TYR 47 CO 0.01 -0.50 1.27 -1.14 -1.34 0.00 0.00 175.55 173.86 2whg s GLN 48 N 1.27 4.11 -0.20 4.97 2.00 -1.26 0.21 119.66 130.77 2whg s GLN 48 Ca -0.02 1.50 -0.11 0.00 -2.00 0.00 0.00 55.36 54.73 2whg s GLN 48 Cb -0.14 -3.80 -0.20 0.00 0.80 0.00 0.00 33.01 29.67 2whg s GLN 48 CO -0.05 -0.86 0.08 -0.89 -0.50 0.00 0.00 175.29 173.08 2whg n ILE 49 N 5.69 1.61 -3.92 -2.34 2.08 0.56 -4.93 119.36 118.11 2whg n ILE 49 Ca 0.14 -0.40 -0.09 0.00 0.56 0.00 0.00 62.75 62.96 2whg n ILE 49 Cb 0.45 -1.80 -0.02 0.00 -0.75 0.00 0.00 39.64 37.52 2whg n ILE 49 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2whg s ALA 50 N -2.48 -0.58 -0.08 -1.39 0.00 -0.91 -5.02 121.76 111.29 2whg s ALA 50 Ca -0.30 -0.73 -0.36 0.00 0.00 0.00 0.00 51.96 50.58 2whg s ALA 50 Cb 0.08 0.92 -0.14 0.00 0.00 0.00 0.00 23.12 23.98 2whg s ALA 50 CO 0.64 -0.94 1.74 -0.25 0.00 0.00 0.00 175.76 176.95 2whg n ASP 51 N -0.75 2.93 -0.68 0.00 10.43 -1.26 -1.63 116.55 125.60 2whg n ASP 51 Ca -0.04 1.03 -0.09 0.00 2.57 0.00 0.00 54.79 58.27 2whg n ASP 51 Cb 0.60 -1.30 -0.04 0.00 1.84 0.00 0.00 41.12 42.22 2whg n ASP 51 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2whg n GLY 52 N 4.00 1.01 2.78 0.44 0.00 -1.26 -4.99 105.19 107.18 2whg n GLY 52 Ca 0.22 -0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 2whg n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2whg s VAL 53 N -2.17 0.32 0.10 1.61 1.01 -0.64 -0.87 120.40 119.76 2whg s VAL 53 Ca 0.00 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.17 2whg s VAL 53 Cb 0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 2whg s VAL 53 CO 0.00 0.23 -0.20 0.26 0.00 0.00 0.00 175.10 175.39 2whg s TRP 54 N 1.71 1.72 0.26 5.22 0.51 -0.48 -0.32 118.94 127.56 2whg s TRP 54 Ca 0.01 -0.42 0.02 0.00 -2.12 0.00 0.00 56.10 53.58 2whg s TRP 54 Cb -0.13 -0.94 -0.03 0.00 -0.81 0.00 0.00 33.47 31.56 2whg s TRP 54 CO -0.04 0.19 0.43 -1.54 -0.51 0.00 0.00 176.95 175.48 2whg s SER 55 N -1.89 6.33 0.05 2.95 1.04 0.13 -0.76 113.70 121.55 2whg s SER 55 Ca 0.05 0.30 0.07 0.00 0.48 0.00 0.00 55.95 56.86 2whg s SER 55 Cb -0.10 -1.96 -0.03 0.00 0.10 0.00 0.00 66.02 64.02 2whg s SER 55 CO 0.04 -0.14 -0.19 -1.38 0.98 0.00 0.00 173.24 172.56 2whg s HIS 56 N -2.06 2.54 -0.04 5.02 -3.43 -0.37 -0.75 115.29 116.20 2whg s HIS 56 Ca 0.37 -0.27 0.01 0.00 -0.80 0.00 0.00 55.06 54.37 2whg s HIS 56 Cb -0.10 -1.45 0.02 0.00 -1.43 0.00 0.00 32.58 29.63 2whg s HIS 56 CO 0.31 0.26 -0.02 0.42 -2.00 0.00 0.00 174.74 173.71 2whg s ILE 57 N -0.93 0.34 0.27 -5.38 1.09 -0.32 -1.20 121.20 115.07 2whg s ILE 57 Ca 0.15 -0.00 0.01 0.00 -1.10 0.00 0.00 60.65 59.71 2whg s ILE 57 Cb -0.10 -0.41 -0.03 0.00 -1.06 0.00 0.00 42.46 40.85 2whg s ILE 57 CO 0.05 0.19 0.25 0.00 -0.10 0.00 0.00 174.94 175.33 2whg s ALA 58 N 1.04 1.27 0.22 9.38 0.00 -1.05 -1.10 121.76 131.51 2whg s ALA 58 Ca -0.09 -1.75 0.10 0.00 0.00 0.00 0.00 51.96 50.21 2whg s ALA 58 Cb -0.14 1.37 -0.05 0.00 0.00 0.00 0.00 23.12 24.31 2whg s ALA 58 CO -0.01 -0.66 -0.18 0.95 0.00 0.00 0.00 175.76 175.85 2whg s THR 59 N -3.76 2.08 -0.02 0.00 -4.23 -1.26 -1.29 115.64 107.16 2whg s THR 59 Ca 0.37 -2.18 -0.21 0.00 -1.18 0.00 0.00 61.69 58.50 2whg s THR 59 Cb 0.04 -2.09 0.04 0.00 1.34 0.00 0.00 72.50 71.83 2whg s THR 59 CO 0.18 -0.40 0.45 -1.58 -0.54 0.00 0.00 174.62 172.74 2whg s GLN 60 N -3.25 0.84 0.09 3.99 2.00 -0.48 -4.67 119.66 118.18 2whg s GLN 60 Ca 0.23 -0.05 -0.31 0.00 -2.00 0.00 0.00 55.36 53.23 2whg s GLN 60 Cb -0.04 0.38 -0.06 0.00 0.80 0.00 0.00 33.01 34.08 2whg s GLN 60 CO 0.10 -0.25 1.23 -1.12 -0.50 0.00 0.00 175.29 174.75 2whg s SER 61 N -1.36 7.03 -0.22 6.67 0.01 -1.26 -1.04 113.70 123.53 2whg s SER 61 Ca -0.12 2.10 -0.10 0.00 1.31 0.00 0.00 55.95 59.14 2whg s SER 61 Cb -0.03 -2.58 0.08 0.00 0.21 0.00 0.00 66.02 63.70 2whg s SER 61 CO 0.06 -0.49 0.51 0.12 0.41 0.00 0.00 173.24 173.85 2whg s PHE 62 N 0.91 -0.87 -1.40 2.43 2.19 0.18 -4.96 117.98 116.46 2whg s PHE 62 Ca 0.59 1.70 -0.08 0.00 0.33 0.00 0.00 56.93 59.47 2whg s PHE 62 Cb -0.31 0.44 0.05 0.00 -1.31 0.00 0.00 43.02 41.89 2whg s PHE 62 CO 0.30 -0.47 0.57 -3.47 1.83 0.00 0.00 175.22 173.99 2whg n ASP 63 N 4.72 -4.69 0.00 6.13 4.64 -1.26 -1.36 116.55 124.73 2whg n ASP 63 Ca -0.17 -0.38 0.00 0.00 -1.38 0.00 0.00 54.79 52.86 2whg n ASP 63 Cb 0.54 -3.82 0.00 0.00 -1.04 0.00 0.00 41.12 36.79 2whg n ASP 63 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2whg n GLY 64 N -1.34 0.73 3.30 0.27 0.00 -1.26 -5.05 105.19 101.84 2whg n GLY 64 Ca -0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 2whg n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whg s ALA 65 N -2.81 1.66 -0.21 4.61 0.00 -0.46 -5.15 121.76 119.41 2whg s ALA 65 Ca 0.00 -1.84 -0.06 0.00 0.00 0.00 0.00 51.96 50.06 2whg s ALA 65 Cb 0.00 1.10 -0.03 0.00 0.00 0.00 0.00 23.12 24.19 2whg s ALA 65 CO 0.00 -0.48 0.04 0.08 0.00 0.00 0.00 175.76 175.39 2whg s VAL 66 N -3.80 4.29 -0.05 0.00 1.01 -1.26 -0.65 120.40 119.94 2whg s VAL 66 Ca 0.38 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.20 2whg s VAL 66 Cb 0.08 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 2whg s VAL 66 CO 0.14 0.41 -0.16 -0.31 0.00 0.00 0.00 175.10 175.18 2whg s TYR 67 N 0.96 2.65 0.59 5.22 1.51 -0.21 -4.94 117.35 123.13 2whg s TYR 67 Ca 0.03 -0.24 -0.06 0.00 -1.01 0.00 0.00 57.07 55.79 2whg s TYR 67 Cb -0.14 -1.62 0.01 0.00 -0.11 0.00 0.00 41.96 40.09 2whg s TYR 67 CO 0.02 0.12 0.90 -1.25 -1.11 0.00 0.00 175.55 174.24 2whg s PRO 68 N -0.64 2.97 0.11 -1.71 0.04 -1.26 -1.38 135.00 133.12 2whg s PRO 68 Ca 0.10 0.04 -0.14 0.00 0.04 0.00 0.00 61.00 61.04 2whg s PRO 68 Cb -0.11 -2.26 0.02 0.00 0.04 0.00 0.00 34.50 32.19 2whg s PRO 68 CO 0.01 -0.68 0.34 -1.54 0.04 0.00 0.00 177.00 175.16 2whg s SER 69 N -4.29 -0.13 0.21 6.66 1.04 -0.41 -4.58 113.70 112.19 2whg s SER 69 Ca 0.54 -0.38 0.08 0.00 0.48 0.00 0.00 55.95 56.67 2whg s SER 69 Cb -0.11 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.40 2whg s SER 69 CO 0.46 -0.79 0.00 0.20 0.98 0.00 0.00 173.24 174.09 2whg s ASN 70 N -2.73 4.70 0.30 7.02 0.01 -0.50 -2.53 114.94 121.21 2whg s ASN 70 Ca 0.03 -0.49 -0.02 0.00 -0.71 0.00 0.00 52.86 51.67 2whg s ASN 70 Cb 0.02 -0.96 -0.01 0.00 0.41 0.00 0.00 41.25 40.71 2whg s ASN 70 CO -0.11 0.05 0.37 -0.83 -1.51 0.00 0.00 177.10 175.08 2whg s GLY 71 N -3.24 1.50 0.15 0.66 0.00 -0.34 -4.92 107.32 101.12 2whg s GLY 71 Ca 0.29 -1.56 0.10 0.00 0.00 0.00 0.00 44.72 43.55 2whg s GLY 71 CO 0.19 -1.11 -0.23 -2.27 0.00 0.00 0.00 173.10 169.69 2whg s LEU 72 N -3.21 2.37 -0.06 0.66 2.96 -0.44 -1.24 118.68 119.72 2whg s LEU 72 Ca 0.33 -0.79 0.02 0.00 -0.22 0.00 0.00 54.13 53.47 2whg s LEU 72 Cb 0.01 -1.03 0.02 0.00 0.50 0.00 0.00 46.19 45.69 2whg s LEU 72 CO 0.18 0.09 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.58 2whg s ILE 73 N -1.46 0.86 -0.06 6.68 1.01 0.06 -0.82 121.20 127.47 2whg s ILE 73 Ca 0.14 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.50 2whg s ILE 73 Cb -0.09 -0.82 0.02 0.00 0.01 0.00 0.00 42.46 41.58 2whg s ILE 73 CO 0.07 0.30 -0.08 -0.69 0.00 0.00 0.00 174.94 174.53 2whg s VAL 74 N 0.82 0.85 0.12 2.92 1.01 -0.21 -1.38 120.40 124.53 2whg s VAL 74 Ca -0.12 -0.29 -0.33 0.00 0.00 0.00 0.00 61.98 61.23 2whg s VAL 74 Cb -0.15 -0.82 -0.13 0.00 0.00 0.00 0.00 36.38 35.28 2whg s VAL 74 CO 0.02 0.30 1.69 -1.14 0.00 0.00 0.00 175.10 175.97 2whg n ARG 75 N 4.05 2.36 -3.66 2.72 0.63 -0.05 -0.54 116.66 122.17 2whg n ARG 75 Ca -0.22 0.85 -0.27 0.00 -0.92 0.00 0.00 57.85 57.29 2whg n ARG 75 Cb 0.51 -2.67 -0.10 0.00 0.45 0.00 0.00 32.46 30.65 2whg n ARG 75 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2whg n ASP 76 N 4.40 2.63 0.00 6.15 2.03 0.28 -4.77 116.55 127.27 2whg n ASP 76 Ca 0.18 -3.14 0.00 0.00 0.52 0.00 0.00 54.79 52.35 2whg n ASP 76 Cb 0.31 -0.70 0.00 0.00 -0.72 0.00 0.00 41.12 40.01 2whg n ASP 76 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2whg n GLY 77 N 1.72 2.75 0.88 0.27 0.00 -1.26 -1.48 105.19 108.06 2whg n GLY 77 Ca 0.24 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.37 2whg n GLY 77 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2whg n ASP 78 N 9.83 2.66 -4.70 1.61 3.85 -1.26 -4.95 116.55 123.58 2whg n ASP 78 Ca 0.00 -1.86 -0.33 0.00 -0.71 0.00 0.00 54.79 51.89 2whg n ASP 78 Cb 0.00 -0.12 -0.07 0.00 -1.35 0.00 0.00 41.12 39.57 2whg n ASP 78 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 2whg s GLU 79 N -1.75 2.20 -0.01 0.11 2.02 -0.55 -4.43 118.70 116.29 2whg s GLU 79 Ca 0.34 -2.42 0.07 0.00 0.02 0.00 0.00 54.97 52.99 2whg s GLU 79 Cb 0.21 -1.42 -0.02 0.00 0.10 0.00 0.00 34.13 33.00 2whg s GLU 79 CO 0.30 -0.42 -0.23 -0.51 0.02 0.00 0.00 175.26 174.42 2whg s LEU 80 N -3.87 2.06 -0.20 1.80 1.43 -0.16 -0.55 118.68 119.19 2whg s LEU 80 Ca 0.04 -0.44 -0.09 0.00 -1.03 0.00 0.00 54.13 52.61 2whg s LEU 80 Cb 0.01 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.98 2whg s LEU 80 CO 0.02 0.28 0.10 -0.22 0.23 0.00 0.00 176.35 176.77 2whg s LEU 81 N -0.62 4.01 -0.15 1.79 2.96 0.30 -2.53 118.68 124.46 2whg s LEU 81 Ca 0.09 0.15 -0.07 0.00 -0.22 0.00 0.00 54.13 54.08 2whg s LEU 81 Cb -0.09 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 2whg s LEU 81 CO -0.01 0.16 0.09 -0.22 -1.32 0.00 0.00 176.35 175.06 2whg s LEU 82 N 0.45 4.04 -0.25 -0.68 2.96 -0.36 -1.05 118.68 123.79 2whg s LEU 82 Ca 0.06 0.25 -0.02 0.00 -0.22 0.00 0.00 54.13 54.20 2whg s LEU 82 Cb -0.12 -2.00 0.02 0.00 0.50 0.00 0.00 46.19 44.60 2whg s LEU 82 CO -0.00 0.29 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.65 2whg s ILE 83 N -0.34 3.05 0.10 6.68 -1.09 -0.00 -0.89 121.20 128.69 2whg s ILE 83 Ca 0.10 -0.93 0.00 0.00 -2.23 0.00 0.00 60.65 57.59 2whg s ILE 83 Cb -0.12 -2.53 0.00 0.00 -1.58 0.00 0.00 42.46 38.23 2whg s ILE 83 CO 0.01 0.21 0.00 0.47 -1.23 0.00 0.00 174.94 174.41 2whg n ASP 84 N 4.71 -1.89 -3.94 3.58 8.00 0.76 -1.33 116.55 126.44 2whg n ASP 84 Ca -0.16 0.26 -0.30 0.00 0.71 0.00 0.00 54.79 55.30 2whg n ASP 84 Cb 0.48 -0.02 0.23 0.00 -0.02 0.00 0.00 41.12 41.79 2whg n ASP 84 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2whg s THR 85 N -3.21 1.66 -0.37 -3.53 -4.23 -1.01 -4.76 115.64 100.20 2whg s THR 85 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.57 2whg s THR 85 Cb 0.00 -2.50 0.59 0.00 1.34 0.00 0.00 72.50 71.93 2whg s THR 85 CO 0.00 0.00 1.70 0.00 -0.54 0.00 0.00 174.62 175.78 2whg n ALA 86 N -4.66 4.66 -2.45 3.99 0.00 -1.26 -4.68 120.51 116.11 2whg n ALA 86 Ca 0.12 -2.16 -0.01 0.00 0.00 0.00 0.00 53.44 51.39 2whg n ALA 86 Cb 0.59 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2whg n ALA 86 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2whg n TRP 87 N -0.46 -1.76 0.00 0.00 -0.00 -1.25 -4.57 117.44 109.40 2whg n TRP 87 Ca 0.42 0.67 0.00 0.00 -0.00 0.00 0.00 57.50 58.58 2whg n TRP 87 Cb 1.35 -3.11 0.00 0.00 -0.00 0.00 0.00 31.31 29.55 2whg n TRP 87 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2whg n GLY 88 N -1.45 2.80 0.10 5.87 0.00 -0.13 -4.72 105.19 107.65 2whg n GLY 88 Ca -0.00 -2.05 -0.12 0.00 0.00 0.00 0.00 46.02 43.84 2whg n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whg h ALA 89 N 0.00 0.14 -0.03 4.61 0.00 -1.91 -1.81 119.26 120.26 2whg h ALA 89 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.73 2whg h ALA 89 Cb 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2whg h ALA 89 CO 0.00 -0.14 -0.28 0.87 0.00 0.00 0.00 179.25 179.70 2whg h LYS 90 N -0.12 -0.39 -0.42 0.00 1.79 -1.96 -0.20 116.57 115.27 2whg h LYS 90 Ca 0.03 0.03 0.03 0.00 -2.18 0.00 0.00 60.65 58.55 2whg h LYS 90 Cb 0.42 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.12 2whg h LYS 90 CO 0.01 -0.26 0.21 -0.91 -1.08 0.00 0.00 179.45 177.42 2whg h ASN 91 N -0.41 0.31 -0.77 0.86 2.35 -1.79 -1.01 115.58 115.12 2whg h ASN 91 Ca 0.07 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2whg h ASN 91 Cb 0.51 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 2whg h ASN 91 CO -0.26 0.23 0.43 0.74 -1.65 0.00 0.00 177.43 176.91 2whg h THR 92 N 0.43 1.23 -0.41 2.81 2.02 -1.18 0.31 112.91 118.12 2whg h THR 92 Ca 0.18 -0.56 0.01 0.00 0.77 0.00 0.00 66.41 66.81 2whg h THR 92 Cb 0.07 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.66 2whg h THR 92 CO -0.12 0.25 0.25 0.00 0.37 0.00 0.00 175.52 176.27 2whg h ALA 93 N 1.22 0.51 -0.66 6.16 0.00 -0.83 -1.78 119.26 123.89 2whg h ALA 93 Ca 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2whg h ALA 93 Cb 0.02 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2whg h ALA 93 CO -0.04 -0.07 0.34 0.00 0.00 0.00 0.00 179.25 179.48 2whg h ALA 94 N 1.17 1.37 -0.45 0.00 0.00 -0.14 -2.72 119.26 118.49 2whg h ALA 94 Ca 0.16 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2whg h ALA 94 Cb -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 2whg h ALA 94 CO -0.06 0.51 0.24 1.25 0.00 0.00 0.00 179.25 181.19 2whg h LEU 95 N 0.92 0.37 -0.94 0.00 5.85 0.05 -1.12 115.31 120.44 2whg h LEU 95 Ca 0.23 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2whg h LEU 95 Cb 0.05 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2whg h LEU 95 CO -0.03 0.26 0.50 -0.07 -0.34 0.00 0.00 178.44 178.76 2whg h LEU 96 N 0.48 1.11 -0.61 2.25 3.38 -1.04 -1.42 115.31 119.47 2whg h LEU 96 Ca 0.19 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 2whg h LEU 96 Cb 0.06 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2whg h LEU 96 CO -0.11 0.89 -0.37 0.00 0.09 0.00 0.00 178.44 178.93 2whg h ALA 97 N 1.29 0.79 -0.39 1.53 0.00 -1.27 -1.93 119.26 119.28 2whg h ALA 97 Ca 0.32 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2whg h ALA 97 Cb 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2whg h ALA 97 CO -0.05 0.65 -0.33 1.49 0.00 0.00 0.00 179.25 181.01 2whg h GLU 98 N 0.56 0.89 -0.38 0.00 4.57 -0.92 -1.68 114.58 117.63 2whg h GLU 98 Ca 0.05 -0.44 -0.00 0.00 -1.18 0.00 0.00 59.36 57.79 2whg h GLU 98 Cb 0.90 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.47 2whg h GLU 98 CO 0.08 1.09 0.22 0.82 -1.18 0.00 0.00 179.01 180.04 2whg h ILE 99 N 0.75 1.13 -0.41 2.32 2.04 -1.12 0.14 117.51 122.36 2whg h ILE 99 Ca 0.07 -0.32 -0.13 0.00 1.00 0.00 0.00 64.86 65.49 2whg h ILE 99 Cb 0.91 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 2whg h ILE 99 CO 0.08 0.13 -0.25 -0.08 0.00 0.00 0.00 178.15 178.04 2whg h GLU 100 N 0.49 0.85 -0.14 2.37 4.57 -1.21 0.19 114.58 121.71 2whg h GLU 100 Ca 0.13 -0.36 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 2whg h GLU 100 Cb 0.02 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 2whg h GLU 100 CO -0.02 1.00 0.05 -0.22 -1.18 0.00 0.00 179.01 178.63 2whg h LYS 101 N 0.73 0.21 0.01 1.92 3.64 -1.13 -2.97 116.57 118.99 2whg h LYS 101 Ca 0.09 -0.04 -0.29 0.00 -1.27 0.00 0.00 60.65 59.14 2whg h LYS 101 Cb 0.79 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.53 2whg h LYS 101 CO 0.07 0.33 -1.66 1.96 -2.27 0.00 0.00 179.45 177.88 2whg h GLN 102 N 0.05 0.02 0.00 1.90 4.20 -0.56 -3.43 115.11 117.29 2whg h GLN 102 Ca 0.04 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2whg h GLN 102 Cb 0.21 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 2whg h GLN 102 CO -0.00 0.59 -1.18 -0.89 -0.67 0.00 0.00 178.83 176.68 2whg n ILE 103 N -3.11 0.62 -1.04 2.54 5.41 0.59 -5.07 119.36 119.31 2whg n ILE 103 Ca -0.16 -0.01 -0.01 0.00 1.00 0.00 0.00 62.75 63.56 2whg n ILE 103 Cb 1.04 -1.65 -0.01 0.00 -0.71 0.00 0.00 39.64 38.32 2whg n ILE 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2whg n GLY 104 N 2.60 0.48 3.61 7.39 0.00 -0.76 -5.01 105.19 113.50 2whg n GLY 104 Ca -0.13 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.69 2whg n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2whg s LEU 105 N -0.28 3.16 0.15 0.99 1.43 -1.26 -5.04 118.68 117.83 2whg s LEU 105 Ca 0.00 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 52.43 2whg s LEU 105 Cb 0.00 -1.91 -0.07 0.00 0.03 0.00 0.00 46.19 44.24 2whg s LEU 105 CO 0.00 0.16 1.08 -2.16 0.23 0.00 0.00 176.35 175.66 2whg s PRO 106 N -2.40 4.60 -0.35 1.29 0.04 -1.26 -4.73 135.00 132.18 2whg s PRO 106 Ca 0.23 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 62.65 2whg s PRO 106 Cb -0.11 -3.30 0.01 0.00 0.04 0.00 0.00 34.50 31.14 2whg s PRO 106 CO 0.16 0.07 1.23 0.08 0.04 0.00 0.00 177.00 178.58 2whg s VAL 107 N -0.07 4.21 -0.11 -0.36 1.01 -1.26 -0.99 120.40 122.83 2whg s VAL 107 Ca 0.50 1.34 0.15 0.00 0.00 0.00 0.00 61.98 63.97 2whg s VAL 107 Cb -0.28 -4.31 -0.22 0.00 0.00 0.00 0.00 36.38 31.56 2whg s VAL 107 CO 0.33 -0.61 0.17 0.35 0.00 0.00 0.00 175.10 175.34 2whg n THR 108 N 6.36 0.73 -3.84 3.92 -2.24 -1.05 -4.49 114.28 113.67 2whg n THR 108 Ca 0.14 -0.59 -0.12 0.00 -2.27 0.00 0.00 64.05 61.21 2whg n THR 108 Cb 0.47 -0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 68.26 2whg n THR 108 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2whg s ARG 109 N -2.67 0.51 0.01 -0.78 0.52 -1.25 -2.06 118.95 113.23 2whg s ARG 109 Ca -0.07 -0.32 0.00 0.00 -0.52 0.00 0.00 55.73 54.82 2whg s ARG 109 Cb 0.07 0.22 -0.01 0.00 0.52 0.00 0.00 34.95 35.75 2whg s ARG 109 CO 0.68 -0.12 -0.02 0.00 0.02 0.00 0.00 175.30 175.86 2whg s ALA 110 N -1.29 0.14 -0.07 2.13 0.00 -0.25 -1.22 121.76 121.20 2whg s ALA 110 Ca -0.14 -0.30 0.04 0.00 0.00 0.00 0.00 51.96 51.56 2whg s ALA 110 Cb -0.07 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2whg s ALA 110 CO 0.02 -0.05 -0.20 0.08 0.00 0.00 0.00 175.76 175.61 2whg s VAL 111 N -0.66 1.72 -0.14 0.00 1.01 -0.07 -1.00 120.40 121.26 2whg s VAL 111 Ca -0.06 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.03 2whg s VAL 111 Cb -0.05 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 2whg s VAL 111 CO -0.00 0.48 0.02 -0.44 0.00 0.00 0.00 175.10 175.16 2whg s SER 112 N 0.26 5.32 0.00 3.32 0.01 -0.76 -0.17 113.70 121.67 2whg s SER 112 Ca -0.12 0.06 0.22 0.00 1.31 0.00 0.00 55.95 57.42 2whg s SER 112 Cb -0.15 -1.77 -0.02 0.00 0.21 0.00 0.00 66.02 64.29 2whg s SER 112 CO 0.05 0.25 1.05 0.35 0.41 0.00 0.00 173.24 175.35 2whg n THR 113 N 3.03 0.00 -3.86 1.44 -2.24 -1.26 -4.62 114.28 106.76 2whg n THR 113 Ca -0.18 -0.02 -0.05 0.00 -2.27 0.00 0.00 64.05 61.53 2whg n THR 113 Cb 0.53 0.83 0.02 0.00 -2.10 0.00 0.00 70.33 69.61 2whg n THR 113 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2whg s HIS 114 N -2.95 0.10 -1.70 4.78 -3.43 -1.26 -0.35 115.29 110.48 2whg s HIS 114 Ca 0.10 -0.60 0.29 0.00 -0.80 0.00 0.00 55.06 54.05 2whg s HIS 114 Cb 0.17 0.75 1.25 0.00 -1.43 0.00 0.00 32.58 33.32 2whg s HIS 114 CO 0.80 -1.16 1.87 1.97 -2.00 0.00 0.00 174.74 176.22 2whg n PHE 115 N -0.65 0.00 -1.60 0.38 -1.74 -1.26 -4.32 117.46 108.27 2whg n PHE 115 Ca -0.05 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.54 2whg n PHE 115 Cb 0.60 -0.17 0.08 0.00 1.52 0.00 0.00 39.48 41.51 2whg n PHE 115 CO 0.00 0.00 0.00 -1.01 -0.56 0.00 0.00 176.76 175.19 2whg s HIS 116 N -2.43 2.91 0.49 2.97 3.76 -1.26 -4.64 115.29 117.08 2whg s HIS 116 Ca 0.30 1.14 0.24 0.00 -0.15 0.00 0.00 55.06 56.59 2whg s HIS 116 Cb 0.20 -3.11 1.43 0.00 1.11 0.00 0.00 32.58 32.21 2whg s HIS 116 CO 0.46 -1.67 2.11 -0.44 -0.85 0.00 0.00 174.74 174.36 2whg h ASP 117 N -1.02 0.00 0.00 1.40 3.45 -1.94 -1.55 116.42 116.76 2whg h ASP 117 Ca -0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 2whg h ASP 117 Cb 1.26 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.03 2whg h ASP 117 CO 0.60 0.09 0.00 -0.90 -1.57 0.00 0.00 179.24 177.46 2whg n ASP 118 N -3.96 0.00 0.00 6.45 5.75 -1.26 -1.21 116.55 122.32 2whg n ASP 118 Ca -0.02 -1.04 0.00 0.00 -0.01 0.00 0.00 54.79 53.72 2whg n ASP 118 Cb 0.18 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 2whg n ASP 118 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2whg n ARG 119 N -0.54 0.10 0.00 0.11 5.12 -0.78 -4.33 116.66 116.35 2whg n ARG 119 Ca 0.01 0.00 0.04 0.00 -1.93 0.00 0.00 57.85 55.98 2whg n ARG 119 Cb 0.00 -0.52 -0.05 0.00 -1.16 0.00 0.00 32.46 30.74 2whg n ARG 119 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 2whg n VAL 120 N -0.90 0.00 -2.69 1.55 0.24 -0.66 -2.42 118.33 113.46 2whg n VAL 120 Ca 0.00 -0.29 -0.43 0.00 -2.04 0.00 0.00 64.34 61.59 2whg n VAL 120 Cb 0.02 1.01 -0.02 0.00 -1.47 0.00 0.00 33.84 33.37 2whg n VAL 120 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2whg s GLY 121 N -1.85 1.59 0.00 7.63 0.00 -0.35 -1.96 107.32 112.37 2whg s GLY 121 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 44.72 44.67 2whg s GLY 121 CO 0.38 2.19 0.00 0.61 0.00 0.00 0.00 173.10 176.27 2whg n GLY 122 N 3.87 0.92 0.24 0.20 0.00 -1.26 -0.96 105.19 108.21 2whg n GLY 122 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 2whg n GLY 122 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2whg h VAL 123 N 0.00 1.25 -0.57 1.61 2.07 -1.76 -1.91 116.25 116.94 2whg h VAL 123 Ca 0.00 -1.15 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 2whg h VAL 123 Cb 0.00 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2whg h VAL 123 CO 0.00 0.37 0.26 0.44 0.02 0.00 0.00 177.57 178.66 2whg h ASP 124 N 0.43 0.76 -0.43 0.57 5.19 -1.94 -0.66 116.42 120.34 2whg h ASP 124 Ca 0.07 -0.15 0.01 0.00 -0.62 0.00 0.00 57.03 56.34 2whg h ASP 124 Cb 0.59 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.88 2whg h ASP 124 CO 0.04 0.69 0.28 0.58 -3.12 0.00 0.00 179.24 177.71 2whg h VAL 125 N 0.77 1.10 -0.49 -1.35 2.07 -1.84 -1.83 116.25 114.69 2whg h VAL 125 Ca 0.19 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2whg h VAL 125 Cb 0.15 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 2whg h VAL 125 CO -0.02 0.10 0.28 -0.07 0.02 0.00 0.00 177.57 177.89 2whg h LEU 126 N 0.57 0.45 -0.71 2.57 3.38 -1.09 -1.98 115.31 118.50 2whg h LEU 126 Ca 0.16 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2whg h LEU 126 Cb -0.05 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2whg h LEU 126 CO -0.04 0.32 0.45 -0.09 0.09 0.00 0.00 178.44 179.17 2whg h ARG 127 N 0.57 0.86 0.00 1.13 2.43 -1.02 -0.58 114.38 117.77 2whg h ARG 127 Ca 0.20 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.29 2whg h ARG 127 Cb 0.03 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 2whg h ARG 127 CO -0.10 0.57 -0.12 0.00 -1.51 0.00 0.00 179.97 178.82 2whg h ALA 128 N 1.30 1.53 -0.03 2.80 0.00 -0.94 -2.17 119.26 121.75 2whg h ALA 128 Ca 0.28 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2whg h ALA 128 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2whg h ALA 128 CO -0.10 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2whg n ALA 129 N -2.39 2.62 -0.66 0.00 0.00 -0.77 -4.91 120.51 114.39 2whg n ALA 129 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2whg n ALA 129 Cb 0.21 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2whg n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2whg n GLY 130 N 1.04 0.65 3.69 0.00 0.00 -0.81 -5.06 105.19 104.71 2whg n GLY 130 Ca 0.20 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2whg n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2whg s VAL 131 N -2.00 5.00 -0.15 1.61 1.01 -0.30 -4.88 120.40 120.69 2whg s VAL 131 Ca 0.00 1.46 -0.27 0.00 0.00 0.00 0.00 61.98 63.17 2whg s VAL 131 Cb 0.00 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 2whg s VAL 131 CO 0.00 0.17 0.89 0.00 0.00 0.00 0.00 175.10 176.16 2whg s ALA 132 N 1.33 3.48 -0.06 5.51 0.00 -0.87 -3.85 121.76 127.31 2whg s ALA 132 Ca 0.36 0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.45 2whg s ALA 132 Cb -0.17 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 2whg s ALA 132 CO 0.15 -0.63 0.03 0.95 0.00 0.00 0.00 175.76 176.26 2whg s THR 133 N 2.10 4.49 0.04 0.00 -4.23 -1.26 -1.09 115.64 115.69 2whg s THR 133 Ca 0.41 -0.30 0.02 0.00 -1.18 0.00 0.00 61.69 60.65 2whg s THR 133 Cb -0.17 -2.95 -0.02 0.00 1.34 0.00 0.00 72.50 70.70 2whg s THR 133 CO 0.14 0.52 -0.08 -0.31 -0.54 0.00 0.00 174.62 174.35 2whg s TYR 134 N -1.00 0.66 0.06 3.99 1.51 -0.17 -0.17 117.35 122.23 2whg s TYR 134 Ca 0.16 -0.48 -0.27 0.00 -1.01 0.00 0.00 57.07 55.47 2whg s TYR 134 Cb -0.12 -0.40 0.09 0.00 -0.11 0.00 0.00 41.96 41.43 2whg s TYR 134 CO 0.06 -0.08 0.95 0.00 -1.11 0.00 0.00 175.55 175.37 2whg s ALA 135 N -1.32 -1.78 0.77 3.71 0.00 -0.53 -1.84 121.76 120.77 2whg s ALA 135 Ca -0.09 0.63 -0.13 0.00 0.00 0.00 0.00 51.96 52.36 2whg s ALA 135 Cb -0.10 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.58 2whg s ALA 135 CO 0.00 -0.86 1.14 -1.54 0.00 0.00 0.00 175.76 174.50 2whg s SER 136 N -2.70 4.22 0.50 0.00 1.04 -1.26 -0.62 113.70 114.87 2whg s SER 136 Ca 0.09 2.08 0.19 0.00 0.48 0.00 0.00 55.95 58.79 2whg s SER 136 Cb -0.01 -2.56 1.26 0.00 0.10 0.00 0.00 66.02 64.81 2whg s SER 136 CO -0.04 -2.24 2.04 1.55 0.98 0.00 0.00 173.24 175.54 2whg h PRO 137 N -0.81 0.11 -0.08 4.02 0.13 -1.93 -1.79 132.00 131.65 2whg h PRO 137 Ca -0.45 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.65 2whg h PRO 137 Cb 1.26 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2whg h PRO 137 CO 0.49 0.07 -0.05 1.03 -0.23 0.00 0.00 178.00 179.32 2whg h SER 138 N 0.11 0.18 -0.78 1.44 0.87 -1.94 -1.85 113.55 111.59 2whg h SER 138 Ca 0.18 -0.43 0.11 0.00 -1.23 0.00 0.00 61.79 60.43 2whg h SER 138 Cb 0.58 -0.05 -0.08 0.00 -0.44 0.00 0.00 62.40 62.40 2whg h SER 138 CO -0.02 0.57 0.40 0.74 -0.53 0.00 0.00 176.83 177.98 2whg h THR 139 N -0.20 0.80 -0.42 2.23 2.02 -1.82 -1.06 112.91 114.45 2whg h THR 139 Ca 0.02 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2whg h THR 139 Cb 0.50 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 2whg h THR 139 CO 0.01 0.11 0.18 0.03 0.37 0.00 0.00 175.52 176.23 2whg h ARG 140 N 0.63 0.62 0.14 6.66 3.08 -1.20 -0.85 114.38 123.47 2whg h ARG 140 Ca 0.40 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.34 2whg h ARG 140 Cb 0.48 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2whg h ARG 140 CO -0.31 0.56 -0.07 -0.09 -1.07 0.00 0.00 179.97 179.00 2whg h ARG 141 N 0.54 -0.19 -0.76 0.04 2.43 -0.98 -1.67 114.38 113.80 2whg h ARG 141 Ca 0.14 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2whg h ARG 141 Cb 0.16 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 2whg h ARG 141 CO -0.01 -0.01 0.47 -0.07 -1.51 0.00 0.00 179.97 178.83 2whg h LEU 142 N -0.33 0.90 -0.28 3.80 3.38 -1.18 -1.48 115.31 120.12 2whg h LEU 142 Ca -0.02 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2whg h LEU 142 Cb 0.26 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2whg h LEU 142 CO 0.03 0.69 0.16 0.00 0.09 0.00 0.00 178.44 179.42 2whg h ALA 143 N 1.25 0.36 -0.47 1.53 0.00 -1.12 -1.84 119.26 118.97 2whg h ALA 143 Ca 0.27 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.18 2whg h ALA 143 Cb -0.05 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 2whg h ALA 143 CO -0.05 -0.13 0.21 1.49 0.00 0.00 0.00 179.25 180.77 2whg h GLU 144 N 0.35 0.40 0.00 0.00 4.81 -1.06 -0.27 114.58 118.81 2whg h GLU 144 Ca 0.10 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 2whg h GLU 144 Cb 0.03 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2whg h GLU 144 CO -0.02 0.27 -0.29 0.00 -0.73 0.00 0.00 179.01 178.24 2whg h ALA 145 N 1.28 1.26 0.00 2.92 0.00 -1.16 -2.55 119.26 121.00 2whg h ALA 145 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2whg h ALA 145 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2whg h ALA 145 CO -0.18 0.36 -0.35 1.49 0.00 0.00 0.00 179.25 180.57 2whg h GLU 146 N 0.00 0.00 -0.64 0.00 4.57 -0.86 -3.48 114.58 114.16 2whg h GLU 146 Ca -0.00 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 2whg h GLU 146 Cb 0.62 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 2whg h GLU 146 CO 0.04 0.00 -0.07 0.41 -1.18 0.00 0.00 179.01 178.21 2whg n GLY 147 N 1.24 0.37 4.00 1.92 0.00 -0.73 -5.08 105.19 106.91 2whg n GLY 147 Ca 0.03 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.14 2whg n GLY 147 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2whg s ASN 148 N -2.92 5.63 0.53 1.61 0.01 -0.19 -5.04 114.94 114.57 2whg s ASN 148 Ca 0.02 -0.29 -0.19 0.00 -0.71 0.00 0.00 52.86 51.69 2whg s ASN 148 Cb -0.01 -0.80 -0.07 0.00 0.41 0.00 0.00 41.25 40.78 2whg s ASN 148 CO 0.02 -0.79 1.09 -1.61 -1.51 0.00 0.00 177.10 174.30 2whg s GLU 149 N -4.42 3.51 -0.25 -0.60 2.02 -1.26 -4.48 118.70 113.22 2whg s GLU 149 Ca 0.54 1.47 0.03 0.00 0.02 0.00 0.00 54.97 57.03 2whg s GLU 149 Cb -0.10 -2.04 0.06 0.00 0.10 0.00 0.00 34.13 32.15 2whg s GLU 149 CO 0.34 -0.69 -0.11 0.42 0.02 0.00 0.00 175.26 175.23 2whg s ILE 150 N -1.92 2.10 0.28 -1.63 1.01 -1.26 -4.84 121.20 114.94 2whg s ILE 150 Ca 0.70 -1.53 -0.28 0.00 0.00 0.00 0.00 60.65 59.54 2whg s ILE 150 Cb -0.20 -2.19 -0.14 0.00 0.01 0.00 0.00 42.46 39.94 2whg s ILE 150 CO 0.25 0.03 1.07 -2.65 0.00 0.00 0.00 174.94 173.64 2whg n PRO 151 N 4.47 1.45 -0.11 2.79 -0.02 -1.26 -4.92 135.00 137.40 2whg n PRO 151 Ca -0.15 0.51 -0.09 0.00 -2.02 0.00 0.00 63.50 61.75 2whg n PRO 151 Cb 0.43 -1.92 -0.02 0.00 -0.02 0.00 0.00 33.50 31.97 2whg n PRO 151 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2whg h THR 152 N 2.14 1.16 -3.47 3.45 2.02 -1.86 -3.46 112.91 112.89 2whg h THR 152 Ca -0.41 -0.45 -0.67 0.00 0.77 0.00 0.00 66.41 65.66 2whg h THR 152 Cb 1.33 0.84 -0.16 0.00 -1.74 0.00 0.00 68.15 68.43 2whg h THR 152 CO 0.62 0.16 -0.67 -1.00 0.37 0.00 0.00 175.52 175.01 2whg s HIS 153 N -5.73 3.01 -0.04 3.16 3.76 0.76 -5.00 115.29 115.20 2whg s HIS 153 Ca -0.13 0.05 -0.20 0.00 -0.15 0.00 0.00 55.06 54.62 2whg s HIS 153 Cb 0.09 -1.67 -0.05 0.00 1.11 0.00 0.00 32.58 32.07 2whg s HIS 153 CO 0.73 0.42 0.59 -1.12 -0.85 0.00 0.00 174.74 174.50 2whg s SER 154 N -1.34 6.91 -0.31 1.40 0.01 -1.26 -1.45 113.70 117.66 2whg s SER 154 Ca 0.17 1.08 -0.20 0.00 1.31 0.00 0.00 55.95 58.32 2whg s SER 154 Cb -0.11 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.75 2whg s SER 154 CO 0.07 0.04 0.60 -0.76 0.41 0.00 0.00 173.24 173.60 2whg s LEU 155 N 0.19 4.17 0.49 2.44 1.43 0.21 -4.91 118.68 122.69 2whg s LEU 155 Ca 0.31 0.35 -0.08 0.00 -1.03 0.00 0.00 54.13 53.68 2whg s LEU 155 Cb -0.17 -2.76 -0.04 0.00 0.03 0.00 0.00 46.19 43.24 2whg s LEU 155 CO 0.16 -0.46 0.83 -1.61 0.23 0.00 0.00 176.35 175.49 2whg s GLU 156 N 2.55 3.62 0.00 1.70 0.41 -1.26 -4.19 118.70 121.53 2whg s GLU 156 Ca 0.24 0.38 0.00 0.00 -0.41 0.00 0.00 54.97 55.17 2whg s GLU 156 Cb -0.15 -2.32 0.00 0.00 -1.78 0.00 0.00 34.13 29.88 2whg s GLU 156 CO 0.12 -0.23 0.00 0.41 -0.49 0.00 0.00 175.26 175.07 2whg n GLY 157 N -2.10 0.77 0.05 -1.39 0.00 -1.26 -4.95 105.19 96.31 2whg n GLY 157 Ca 0.02 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 45.92 2whg n GLY 157 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2whg n LEU 158 N 0.00 1.48 0.20 0.99 4.77 -1.26 -4.10 117.00 119.07 2whg n LEU 158 Ca 0.00 -1.70 0.12 0.00 -0.03 0.00 0.00 56.01 54.41 2whg n LEU 158 Cb 0.00 -0.08 0.18 0.00 -2.33 0.00 0.00 43.42 41.19 2whg n LEU 158 CO 0.00 0.41 0.76 0.77 -1.33 0.00 0.00 177.39 178.00 2whg h SER 159 N 0.00 0.00 -3.67 -1.43 4.64 -1.93 -3.44 113.55 107.72 2whg h SER 159 Ca 0.00 -0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 2whg h SER 159 Cb 0.77 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.68 2whg h SER 159 CO 0.00 0.00 -0.75 -0.94 -0.87 0.00 0.00 176.83 174.27 2whg s SER 160 N -5.95 4.26 0.33 4.97 1.04 -1.26 -5.08 113.70 112.01 2whg s SER 160 Ca 0.07 -0.37 -0.29 0.00 0.48 0.00 0.00 55.95 55.84 2whg s SER 160 Cb 0.06 -0.80 -0.11 0.00 0.10 0.00 0.00 66.02 65.27 2whg s SER 160 CO 0.67 0.21 1.52 -0.94 0.98 0.00 0.00 173.24 175.68 2whg s SER 161 N -1.91 6.41 0.00 7.02 1.04 -1.26 -1.03 113.70 123.96 2whg s SER 161 Ca 0.19 2.95 0.00 0.00 0.48 0.00 0.00 55.95 59.57 2whg s SER 161 Cb -0.11 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.36 2whg s SER 161 CO 0.11 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.08 2whg n GLY 162 N 1.35 1.14 3.77 7.32 0.00 0.42 -4.94 105.19 114.25 2whg n GLY 162 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2whg n GLY 162 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2whg s ASP 163 N -3.01 6.98 -0.01 1.61 1.01 -0.20 -4.87 116.67 118.19 2whg s ASP 163 Ca 0.00 2.29 0.00 0.00 0.71 0.00 0.00 52.55 55.55 2whg s ASP 163 Cb 0.00 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.32 2whg s ASP 163 CO 0.00 -0.35 -0.00 0.00 0.21 0.00 0.00 175.17 175.03 2whg s ALA 164 N -1.29 0.10 0.06 5.23 0.00 -1.26 -1.35 121.76 123.26 2whg s ALA 164 Ca 0.50 0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.53 2whg s ALA 164 Cb -0.31 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 2whg s ALA 164 CO 0.40 -0.01 -0.12 0.14 0.00 0.00 0.00 175.76 176.17 2whg s VAL 165 N 0.25 0.92 0.01 0.00 -7.23 -0.18 -4.98 120.40 109.19 2whg s VAL 165 Ca -0.02 -1.24 -0.17 0.00 -1.81 0.00 0.00 61.98 58.73 2whg s VAL 165 Cb -0.04 -0.93 -0.06 0.00 0.56 0.00 0.00 36.38 35.92 2whg s VAL 165 CO -0.01 -0.29 0.49 -0.13 -0.31 0.00 0.00 175.10 174.86 2whg s ARG 166 N -1.72 4.12 -0.44 4.82 1.81 -1.26 0.10 118.95 126.39 2whg s ARG 166 Ca -0.04 0.56 0.02 0.00 -1.72 0.00 0.00 55.73 54.55 2whg s ARG 166 Cb -0.10 -3.27 0.15 0.00 -0.45 0.00 0.00 34.95 31.28 2whg s ARG 166 CO 0.02 0.56 0.29 0.12 -0.68 0.00 0.00 175.30 175.60 2whg s PHE 167 N -0.73 1.55 0.00 -0.53 5.36 -0.10 -4.94 117.98 118.59 2whg s PHE 167 Ca 0.27 -2.27 0.00 0.00 -0.96 0.00 0.00 56.93 53.96 2whg s PHE 167 Cb -0.18 -1.43 0.00 0.00 -0.34 0.00 0.00 43.02 41.07 2whg s PHE 167 CO 0.15 -0.78 0.00 0.41 -1.46 0.00 0.00 175.22 173.54 2whg n GLY 168 N 3.31 3.83 0.03 13.12 0.00 -1.26 -2.58 105.19 121.64 2whg n GLY 168 Ca 0.17 0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.29 2whg n GLY 168 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2whg n PRO 169 N 14.00 1.04 -4.29 1.61 -0.04 -1.26 -4.83 135.00 141.22 2whg n PRO 169 Ca 0.00 -0.06 -0.17 0.00 -0.04 0.00 0.00 63.50 63.23 2whg n PRO 169 Cb 0.00 -1.22 -0.10 0.00 -0.04 0.00 0.00 33.50 32.14 2whg n PRO 169 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2whg s VAL 170 N -1.99 1.47 -0.17 0.52 -7.23 -1.07 -4.25 120.40 107.68 2whg s VAL 170 Ca 0.21 -2.06 -0.07 0.00 -1.81 0.00 0.00 61.98 58.24 2whg s VAL 170 Cb 0.10 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.12 2whg s VAL 170 CO 0.16 -0.61 0.08 -0.70 -0.31 0.00 0.00 175.10 173.73 2whg s GLU 171 N -3.48 3.85 -0.15 4.82 2.12 -0.11 -0.93 118.70 124.82 2whg s GLU 171 Ca 0.18 -0.29 -0.09 0.00 0.36 0.00 0.00 54.97 55.13 2whg s GLU 171 Cb -0.00 -3.22 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 2whg s GLU 171 CO 0.04 0.40 0.16 -0.51 -0.54 0.00 0.00 175.26 174.80 2whg s LEU 172 N 0.03 4.31 -0.05 2.70 1.43 0.12 -1.42 118.68 125.79 2whg s LEU 172 Ca 0.07 0.39 0.02 0.00 -1.03 0.00 0.00 54.13 53.58 2whg s LEU 172 Cb -0.12 -2.12 0.01 0.00 0.03 0.00 0.00 46.19 44.00 2whg s LEU 172 CO 0.00 0.29 -0.09 0.12 0.23 0.00 0.00 176.35 176.90 2whg s PHE 173 N -0.33 1.13 -0.36 0.29 5.36 -0.49 -1.01 117.98 122.57 2whg s PHE 173 Ca 0.12 -0.37 -0.10 0.00 -0.96 0.00 0.00 56.93 55.63 2whg s PHE 173 Cb -0.12 -0.86 0.03 0.00 -0.34 0.00 0.00 43.02 41.73 2whg s PHE 173 CO 0.02 -0.21 0.18 -0.47 -1.46 0.00 0.00 175.22 173.29 2whg s TYR 174 N 0.62 3.24 -2.29 10.12 5.04 -0.46 -1.48 117.35 132.14 2whg s TYR 174 Ca -0.11 -1.01 0.28 0.00 -2.44 0.00 0.00 57.07 53.79 2whg s TYR 174 Cb -0.14 -2.41 1.06 0.00 0.35 0.00 0.00 41.96 40.83 2whg s TYR 174 CO 0.02 -0.65 1.75 -0.35 -1.34 0.00 0.00 175.55 174.98 2whg n PRO 175 N 4.96 1.43 0.00 4.97 -0.04 -1.26 -0.43 135.00 144.63 2whg n PRO 175 Ca -0.12 -0.78 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 2whg n PRO 175 Cb 0.46 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2whg n PRO 175 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2whg n GLY 176 N 1.20 1.86 3.75 0.55 0.00 -1.26 -4.37 105.19 106.92 2whg n GLY 176 Ca 0.18 -2.04 -0.37 0.00 0.00 0.00 0.00 46.02 43.79 2whg n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whg s ALA 177 N -2.12 2.68 0.00 4.61 0.00 -1.26 -4.71 121.76 120.96 2whg s ALA 177 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2whg s ALA 177 Cb 0.00 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2whg s ALA 177 CO 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 175.76 174.54 2whg n ALA 178 N -1.28 0.00 -0.33 0.00 0.00 -1.26 -3.30 120.51 114.34 2whg n ALA 178 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 2whg n ALA 178 Cb 0.48 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.03 2whg n ALA 178 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2whg h HIS 179 N 0.00 1.12 -4.64 0.00 -0.00 -1.88 0.18 115.15 109.92 2whg h HIS 179 Ca 0.00 0.03 -0.34 0.00 -0.00 0.00 0.00 60.37 60.06 2whg h HIS 179 Cb 0.00 -0.37 -0.13 0.00 -0.00 0.00 0.00 27.41 26.90 2whg h HIS 179 CO 0.00 0.67 -0.50 -1.54 -0.00 0.00 0.00 177.93 176.55 2whg s SER 180 N -5.96 0.88 0.30 3.26 1.04 -1.26 -2.85 113.70 109.10 2whg s SER 180 Ca -0.13 -1.54 0.17 0.00 0.48 0.00 0.00 55.95 54.93 2whg s SER 180 Cb 0.17 0.49 0.11 0.00 0.10 0.00 0.00 66.02 66.89 2whg s SER 180 CO 0.80 -0.99 1.42 0.71 0.98 0.00 0.00 173.24 176.16 2whg h THR 181 N 2.35 0.61 -0.01 2.02 1.35 -1.86 -3.26 112.91 114.10 2whg h THR 181 Ca -0.30 -1.89 0.00 0.00 -0.55 0.00 0.00 66.41 63.67 2whg h THR 181 Cb 1.24 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.93 2whg h THR 181 CO 0.44 0.35 -0.28 -0.90 -0.25 0.00 0.00 175.52 174.88 2whg n ASP 182 N -3.15 1.73 -4.66 5.36 5.75 -1.26 -4.26 116.55 116.06 2whg n ASP 182 Ca 0.02 -1.36 -0.47 0.00 -0.01 0.00 0.00 54.79 52.97 2whg n ASP 182 Cb 0.69 0.23 -0.05 0.00 -1.03 0.00 0.00 41.12 40.97 2whg n ASP 182 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2whg n ASN 183 N -0.04 2.85 -4.72 -1.12 2.04 -1.23 -4.76 115.26 108.28 2whg n ASN 183 Ca 0.12 1.08 -0.25 0.00 -0.44 0.00 0.00 54.58 55.09 2whg n ASN 183 Cb 0.43 -1.38 -0.06 0.00 -2.53 0.00 0.00 39.78 36.23 2whg n ASN 183 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 2whg s LEU 184 N 0.99 3.50 0.25 -4.53 1.43 0.53 -4.32 118.68 116.53 2whg s LEU 184 Ca 0.81 -0.34 0.10 0.00 -1.03 0.00 0.00 54.13 53.67 2whg s LEU 184 Cb -0.73 -2.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.33 2whg s LEU 184 CO 0.40 0.05 -0.18 0.68 0.23 0.00 0.00 176.35 177.53 2whg s VAL 185 N -1.89 2.19 -0.04 -1.59 -7.23 -0.55 -4.61 120.40 106.68 2whg s VAL 185 Ca 0.30 -2.31 0.02 0.00 -1.81 0.00 0.00 61.98 58.17 2whg s VAL 185 Cb -0.09 -2.19 0.01 0.00 0.56 0.00 0.00 36.38 34.67 2whg s VAL 185 CO 0.21 -0.46 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.77 2whg s VAL 186 N -2.64 0.75 -0.07 1.32 1.01 -0.45 -1.39 120.40 118.92 2whg s VAL 186 Ca 0.27 -0.30 0.05 0.00 0.00 0.00 0.00 61.98 61.99 2whg s VAL 186 Cb -0.04 -0.70 -0.01 0.00 0.00 0.00 0.00 36.38 35.63 2whg s VAL 186 CO 0.12 0.25 -0.22 -0.47 0.00 0.00 0.00 175.10 174.78 2whg s TYR 187 N 0.49 2.54 -0.56 5.22 5.04 -0.51 0.57 117.35 130.15 2whg s TYR 187 Ca -0.08 -0.67 -0.09 0.00 -2.44 0.00 0.00 57.07 53.79 2whg s TYR 187 Cb -0.12 -1.65 0.14 0.00 0.35 0.00 0.00 41.96 40.69 2whg s TYR 187 CO 0.01 -0.18 0.44 0.08 -1.34 0.00 0.00 175.55 174.55 2whg s VAL 188 N -0.11 4.41 0.40 3.14 1.01 0.85 -0.93 120.40 129.17 2whg s VAL 188 Ca -0.04 -2.07 0.10 0.00 0.00 0.00 0.00 61.98 59.97 2whg s VAL 188 Cb -0.14 -3.86 0.18 0.00 0.00 0.00 0.00 36.38 32.56 2whg s VAL 188 CO 0.04 -0.84 1.96 1.55 0.00 0.00 0.00 175.10 177.81 2whg h PRO 189 N 8.14 0.24 0.00 2.72 0.13 -1.86 -0.70 132.00 140.68 2whg h PRO 189 Ca -0.14 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2whg h PRO 189 Cb 1.05 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2whg h PRO 189 CO 0.83 0.33 0.00 0.66 -0.23 0.00 0.00 178.00 179.59 2whg h SER 190 N 0.24 0.00 0.00 1.44 4.64 -1.94 -3.18 113.55 114.76 2whg h SER 190 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2whg h SER 190 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2whg h SER 190 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 2whg n ALA 191 N -2.06 1.68 -3.99 5.18 0.00 -0.76 -5.02 120.51 115.54 2whg n ALA 191 Ca -0.02 -0.32 -0.30 0.00 0.00 0.00 0.00 53.44 52.81 2whg n ALA 191 Cb 0.14 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.59 2whg n ALA 191 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2whg n ASN 192 N -0.05 -2.78 -4.59 0.00 4.13 -0.34 -4.77 115.26 106.86 2whg n ASN 192 Ca 0.00 -0.91 -0.37 0.00 1.68 0.00 0.00 54.58 54.98 2whg n ASN 192 Cb 0.07 -3.36 -0.11 0.00 -1.54 0.00 0.00 39.78 34.85 2whg n ASN 192 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2whg s VAL 193 N -3.51 5.07 -0.24 2.41 1.01 -1.13 -0.73 120.40 123.28 2whg s VAL 193 Ca 0.44 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 62.42 2whg s VAL 193 Cb -0.23 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2whg s VAL 193 CO 0.87 0.32 0.10 -0.22 0.00 0.00 0.00 175.10 176.17 2whg s LEU 194 N 1.36 3.68 -0.32 3.92 2.96 0.22 -0.11 118.68 130.40 2whg s LEU 194 Ca 0.07 -0.09 -0.08 0.00 -0.22 0.00 0.00 54.13 53.80 2whg s LEU 194 Cb -0.15 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.57 2whg s LEU 194 CO 0.06 0.00 0.12 -0.47 -1.32 0.00 0.00 176.35 174.75 2whg s TYR 195 N 1.40 3.19 -0.83 5.38 5.04 0.19 -0.85 117.35 130.88 2whg s TYR 195 Ca 0.06 -0.99 0.23 0.00 -2.44 0.00 0.00 57.07 53.93 2whg s TYR 195 Cb -0.15 -2.31 0.19 0.00 0.35 0.00 0.00 41.96 40.04 2whg s TYR 195 CO 0.05 -0.60 1.17 0.41 -1.34 0.00 0.00 175.55 175.24 2whg n GLY 196 N 4.90 -1.20 7.00 8.97 0.00 0.43 -1.34 105.19 123.94 2whg n GLY 196 Ca -0.13 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2whg n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whg n GLY 197 N 1.44 0.76 0.00 -0.02 0.00 -1.25 -3.32 105.19 102.80 2whg n GLY 197 Ca 0.04 -0.76 0.09 0.00 0.00 0.00 0.00 46.02 45.39 2whg n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2whg h ALA 199 N 2.82 1.00 -3.39 0.00 0.00 -1.92 -3.44 119.26 114.33 2whg h ALA 199 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 2whg h ALA 199 Cb 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 17.63 2whg h ALA 199 CO 0.00 0.00 -0.86 0.08 0.00 0.00 0.00 179.25 178.47 2whg s VAL 200 N -3.32 1.71 0.03 0.00 1.01 -0.73 -4.82 120.40 114.28 2whg s VAL 200 Ca 0.05 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 2whg s VAL 200 Cb 0.10 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 2whg s VAL 200 CO 0.43 0.48 0.22 -1.00 0.00 0.00 0.00 175.10 175.23 2whg s HIS 201 N 0.45 3.54 0.65 5.22 0.09 -1.26 -2.91 115.29 121.06 2whg s HIS 201 Ca -0.17 0.36 -0.14 0.00 -0.00 0.00 0.00 55.06 55.11 2whg s HIS 201 Cb -0.17 -1.84 -0.01 0.00 -0.00 0.00 0.00 32.58 30.56 2whg s HIS 201 CO 0.07 0.60 1.07 -1.83 -0.00 0.00 0.00 174.74 174.66 2whg s GLU 202 N -2.19 3.00 0.33 1.40 -1.05 -1.26 -4.65 118.70 114.27 2whg s GLU 202 Ca 0.31 1.18 0.07 0.00 -0.15 0.00 0.00 54.97 56.38 2whg s GLU 202 Cb -0.13 -1.99 0.77 0.00 -0.44 0.00 0.00 34.13 32.34 2whg s GLU 202 CO 0.22 -1.07 1.82 -0.07 0.95 0.00 0.00 175.26 177.11 2whg h LEU 203 N -0.10 0.74 -0.05 1.83 3.38 -1.94 -2.02 115.31 117.15 2whg h LEU 203 Ca -0.46 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2whg h LEU 203 Cb 1.22 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2whg h LEU 203 CO 0.56 0.32 0.00 -1.54 0.09 0.00 0.00 178.44 177.87 2whg n SER 204 N -4.66 0.25 -4.72 -0.43 3.41 -1.26 -4.66 113.62 101.56 2whg n SER 204 Ca 0.21 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.93 2whg n SER 204 Cb 0.53 -0.60 -0.03 0.00 -0.26 0.00 0.00 64.21 63.85 2whg n SER 204 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2whg s ARG 205 N -3.05 4.50 -0.08 4.33 3.52 -0.76 -4.91 118.95 122.51 2whg s ARG 205 Ca 0.11 1.71 0.09 0.00 -0.13 0.00 0.00 55.73 57.51 2whg s ARG 205 Cb 0.15 -3.34 -0.14 0.00 -1.56 0.00 0.00 34.95 30.07 2whg s ARG 205 CO 0.50 -0.12 0.09 2.41 -0.81 0.00 0.00 175.30 177.37 2whg n THR 206 N 3.42 0.49 -2.51 4.11 -1.04 -1.26 -4.89 114.28 112.59 2whg n THR 206 Ca 0.06 -0.38 -0.16 0.00 -2.04 0.00 0.00 64.05 61.54 2whg n THR 206 Cb 0.47 -0.45 0.08 0.00 -1.82 0.00 0.00 70.33 68.61 2whg n THR 206 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2whg n SER 207 N -2.23 0.94 -1.61 8.00 3.41 -1.26 -4.91 113.62 115.96 2whg n SER 207 Ca -0.12 -1.79 0.08 0.00 -0.26 0.00 0.00 58.87 56.78 2whg n SER 207 Cb 0.67 -0.44 0.35 0.00 -0.26 0.00 0.00 64.21 64.53 2whg n SER 207 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2whg n ALA 208 N -2.92 3.32 -0.32 7.33 0.00 -1.26 -4.89 120.51 121.77 2whg n ALA 208 Ca -0.11 -1.57 0.00 0.00 0.00 0.00 0.00 53.44 51.76 2whg n ALA 208 Cb 0.41 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2whg n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2whg n GLY 209 N 0.91 -0.48 3.60 0.00 0.00 -1.26 -4.51 105.19 103.45 2whg n GLY 209 Ca 0.25 -1.09 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 2whg n GLY 209 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2whg s ASN 210 N -4.00 6.23 -0.04 1.61 2.47 -1.26 -4.88 114.94 115.07 2whg s ASN 210 Ca 0.00 0.92 0.20 0.00 0.42 0.00 0.00 52.86 54.40 2whg s ASN 210 Cb 0.00 -2.54 0.64 0.00 -1.45 0.00 0.00 41.25 37.90 2whg s ASN 210 CO 0.00 -1.50 1.54 1.33 -3.72 0.00 0.00 177.10 174.75 2whg n VAL 211 N 7.16 1.28 -0.30 -5.21 0.24 -1.26 -4.62 118.33 115.62 2whg n VAL 211 Ca 0.18 -1.08 0.09 0.00 -2.04 0.00 0.00 64.34 61.49 2whg n VAL 211 Cb 0.48 0.37 0.31 0.00 -1.47 0.00 0.00 33.84 33.53 2whg n VAL 211 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2whg h ALA 212 N 3.97 1.67 -0.30 2.33 0.00 -1.91 -1.93 119.26 123.09 2whg h ALA 212 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2whg h ALA 212 Cb 1.12 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2whg h ALA 212 CO 0.08 0.12 0.00 -0.25 0.00 0.00 0.00 179.25 179.20 2whg n ASP 213 N -4.56 3.76 -4.86 0.00 8.00 -1.26 -5.04 116.55 112.59 2whg n ASP 213 Ca 0.17 -2.79 -0.31 0.00 0.71 0.00 0.00 54.79 52.57 2whg n ASP 213 Cb 0.36 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 2whg n ASP 213 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2whg s ALA 214 N -2.41 3.18 -0.76 2.24 0.00 -0.73 -4.19 121.76 119.08 2whg s ALA 214 Ca 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 51.96 52.30 2whg s ALA 214 Cb 0.30 -2.95 0.19 0.00 0.00 0.00 0.00 23.12 20.66 2whg s ALA 214 CO 0.11 -0.20 0.63 0.34 0.00 0.00 0.00 175.76 176.64 2whg s ASP 215 N -3.22 5.80 0.40 0.00 -1.08 0.61 -4.94 116.67 114.24 2whg s ASP 215 Ca 0.56 -3.14 0.07 0.00 -0.52 0.00 0.00 52.55 49.51 2whg s ASP 215 Cb -0.10 -1.94 0.83 0.00 -1.46 0.00 0.00 42.92 40.25 2whg s ASP 215 CO 0.34 -0.34 2.03 -0.07 0.52 0.00 0.00 175.17 177.65 2whg h LEU 216 N 6.80 0.45 -0.60 -1.34 3.38 -1.94 -1.04 115.31 121.02 2whg h LEU 216 Ca 0.07 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2whg h LEU 216 Cb 0.92 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2whg h LEU 216 CO 0.77 0.36 0.32 0.00 0.09 0.00 0.00 178.44 179.99 2whg h ALA 217 N 1.71 0.77 0.00 1.53 0.00 -1.96 -3.28 119.26 118.03 2whg h ALA 217 Ca 0.13 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 2whg h ALA 217 Cb 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2whg h ALA 217 CO -0.02 0.30 -1.54 -1.91 0.00 0.00 0.00 179.25 176.07 2whg n GLU 218 N -4.56 0.63 -0.32 0.00 4.07 -0.91 -4.38 120.64 115.17 2whg n GLU 218 Ca 0.04 0.19 0.05 0.00 -0.06 0.00 0.00 57.16 57.37 2whg n GLU 218 Cb 0.10 -1.77 0.12 0.00 -0.06 0.00 0.00 31.44 29.83 2whg n GLU 218 CO 0.00 0.00 0.00 2.35 -0.06 0.00 0.00 177.13 179.42 2whg h TRP 219 N 0.00 -0.46 -0.34 4.31 2.91 -1.20 0.28 115.95 121.46 2whg h TRP 219 Ca -0.19 0.08 0.02 0.00 1.13 0.00 0.00 58.89 59.93 2whg h TRP 219 Cb 1.63 0.34 -0.02 0.00 -0.51 0.00 0.00 29.16 30.60 2whg h TRP 219 CO 0.00 -0.39 0.23 -1.00 -1.03 0.00 0.00 178.44 176.25 2whg h PRO 220 N 0.00 0.39 -0.05 2.65 0.13 -1.76 -0.23 132.00 133.13 2whg h PRO 220 Ca 0.44 -0.02 -0.24 0.00 -0.87 0.00 0.00 66.00 65.30 2whg h PRO 220 Cb 0.68 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.73 2whg h PRO 220 CO -0.92 0.26 -0.92 1.15 -0.23 0.00 0.00 178.00 177.33 2whg h THR 221 N 0.40 1.31 -0.47 1.56 2.02 -0.75 -2.54 112.91 114.44 2whg h THR 221 Ca 0.13 -2.19 -0.05 0.00 0.77 0.00 0.00 66.41 65.07 2whg h THR 221 Cb 0.04 2.24 -0.02 0.00 -1.74 0.00 0.00 68.15 68.68 2whg h THR 221 CO -0.03 0.68 0.09 0.28 0.37 0.00 0.00 175.52 176.90 2whg h SER 222 N 0.40 0.74 -0.47 4.18 0.02 -0.61 -1.24 113.55 116.57 2whg h SER 222 Ca -0.09 -0.25 0.01 0.00 -0.84 0.00 0.00 61.79 60.61 2whg h SER 222 Cb 1.56 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.87 2whg h SER 222 CO 0.18 0.81 0.30 0.58 -1.14 0.00 0.00 176.83 177.56 2whg h VAL 223 N 0.65 1.11 -0.10 2.27 2.07 -1.09 -1.73 116.25 119.43 2whg h VAL 223 Ca 0.14 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 2whg h VAL 223 Cb 0.37 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2whg h VAL 223 CO 0.01 0.11 -0.17 -0.08 0.02 0.00 0.00 177.57 177.46 2whg h GLU 224 N 0.62 0.16 -0.66 1.57 4.57 -1.18 -1.43 114.58 118.23 2whg h GLU 224 Ca 0.17 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.24 2whg h GLU 224 Cb -0.06 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 2whg h GLU 224 CO -0.05 0.34 0.10 -0.09 -1.18 0.00 0.00 179.01 178.13 2whg h ARG 225 N 0.15 1.09 -0.28 1.92 2.43 -0.74 -1.25 114.38 117.70 2whg h ARG 225 Ca 0.03 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 2whg h ARG 225 Cb 0.40 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 2whg h ARG 225 CO 0.03 1.00 0.18 0.82 -1.51 0.00 0.00 179.97 180.49 2whg h ILE 226 N 1.02 1.09 -0.54 1.20 2.04 -0.81 -1.97 117.51 119.53 2whg h ILE 226 Ca 0.20 -0.18 0.05 0.00 1.00 0.00 0.00 64.86 65.93 2whg h ILE 226 Cb 0.45 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 2whg h ILE 226 CO 0.01 0.08 0.27 1.56 0.00 0.00 0.00 178.15 180.07 2whg h GLN 227 N 0.37 0.49 -0.28 2.37 4.20 -0.95 -1.82 115.11 119.48 2whg h GLN 227 Ca 0.10 -0.03 -0.12 0.00 0.06 0.00 0.00 58.65 58.66 2whg h GLN 227 Cb -0.02 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 2whg h GLN 227 CO -0.02 0.33 -0.32 -0.22 -0.67 0.00 0.00 178.83 177.93 2whg h LYS 228 N 0.51 0.60 0.00 1.46 3.11 -1.19 -3.14 116.57 117.91 2whg h LYS 228 Ca 0.25 -0.27 -0.15 0.00 -2.81 0.00 0.00 60.65 57.67 2whg h LYS 228 Cb 0.18 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.37 2whg h LYS 228 CO -0.18 0.84 -0.74 1.25 -2.81 0.00 0.00 179.45 177.82 2whg h HIS 229 N 0.51 0.00 -2.23 1.91 2.76 -1.09 -3.39 115.15 113.63 2whg h HIS 229 Ca 0.06 0.00 -0.57 0.00 -2.20 0.00 0.00 60.37 57.66 2whg h HIS 229 Cb 0.80 0.00 -0.42 0.00 1.55 0.00 0.00 27.41 29.35 2whg h HIS 229 CO 0.03 0.70 -0.74 0.66 -1.30 0.00 0.00 177.93 177.29 2whg n TYR 230 N -3.26 3.34 0.32 5.26 4.01 -0.71 -4.90 117.16 121.21 2whg n TYR 230 Ca 0.01 -3.97 0.15 0.00 -0.16 0.00 0.00 57.90 53.93 2whg n TYR 230 Cb 0.82 -0.48 0.54 0.00 -0.31 0.00 0.00 39.34 39.91 2whg n TYR 230 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2whg h PRO 231 N 3.03 0.00 -0.01 -0.72 0.13 -1.75 -2.90 132.00 129.78 2whg h PRO 231 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2whg h PRO 231 Cb 0.59 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 2whg h PRO 231 CO 0.76 0.00 -0.16 -0.85 -0.23 0.00 0.00 178.00 177.52 2whg n GLU 232 N -2.87 1.18 -1.64 0.86 -0.00 -1.26 -4.96 120.64 111.96 2whg n GLU 232 Ca 0.02 -0.71 -0.48 0.00 -0.00 0.00 0.00 57.16 55.98 2whg n GLU 232 Cb 0.34 -1.49 -0.05 0.00 -0.00 0.00 0.00 31.44 30.24 2whg n GLU 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2whg n ALA 233 N -0.29 0.44 -0.12 -1.84 0.00 -1.10 -4.91 120.51 112.70 2whg n ALA 233 Ca 0.15 0.47 -0.22 0.00 0.00 0.00 0.00 53.44 53.84 2whg n ALA 233 Cb 0.36 -2.24 -0.12 0.00 0.00 0.00 0.00 19.45 17.45 2whg n ALA 233 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2whg n GLU 234 N 3.03 0.64 -4.72 0.00 1.02 0.09 -4.66 120.64 116.04 2whg n GLU 234 Ca 0.17 0.22 -0.33 0.00 -0.02 0.00 0.00 57.16 57.20 2whg n GLU 234 Cb 0.25 -1.54 -0.13 0.00 -0.02 0.00 0.00 31.44 30.00 2whg n GLU 234 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2whg s VAL 235 N -2.51 3.38 -0.13 2.62 1.01 -1.11 -4.44 120.40 119.21 2whg s VAL 235 Ca -0.35 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.06 2whg s VAL 235 Cb 0.10 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 34.12 2whg s VAL 235 CO 0.58 0.57 -0.16 -0.69 0.00 0.00 0.00 175.10 175.40 2whg s VAL 236 N -0.46 1.65 -0.22 2.92 1.01 0.40 -0.61 120.40 125.10 2whg s VAL 236 Ca 0.06 -0.71 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 2whg s VAL 236 Cb -0.12 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 2whg s VAL 236 CO 0.02 0.47 0.00 -0.63 0.00 0.00 0.00 175.10 174.97 2whg s ILE 237 N 1.18 3.88 0.71 2.22 1.01 -0.03 -1.02 121.20 129.15 2whg s ILE 237 Ca -0.01 -0.33 -0.10 0.00 0.00 0.00 0.00 60.65 60.21 2whg s ILE 237 Cb -0.14 -2.77 0.03 0.00 0.01 0.00 0.00 42.46 39.59 2whg s ILE 237 CO -0.06 0.41 1.07 -2.16 0.00 0.00 0.00 174.94 174.20 2whg s PRO 238 N 1.25 2.60 0.36 2.79 0.04 -1.26 -0.43 135.00 140.35 2whg s PRO 238 Ca 0.04 0.22 0.03 0.00 0.04 0.00 0.00 61.00 61.33 2whg s PRO 238 Cb -0.15 -2.07 0.68 0.00 0.04 0.00 0.00 34.50 33.00 2whg s PRO 238 CO 0.01 -1.12 2.00 0.78 0.04 0.00 0.00 177.00 178.71 2whg h GLY 239 N -0.65 0.88 -6.26 0.56 0.00 -0.65 -3.42 103.07 93.53 2whg h GLY 239 Ca -0.45 -0.32 -0.47 0.00 0.00 0.00 0.00 47.33 46.10 2whg h GLY 239 CO 0.63 0.29 -0.79 0.30 0.00 0.00 0.00 176.54 176.98 2whg s HIS 240 N -5.70 1.10 0.00 5.60 3.76 -1.26 -1.42 115.29 117.37 2whg s HIS 240 Ca -0.10 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 54.41 2whg s HIS 240 Cb 0.18 -0.91 0.00 0.00 1.11 0.00 0.00 32.58 32.96 2whg s HIS 240 CO 0.76 -0.29 0.00 0.41 -0.85 0.00 0.00 174.74 174.77 2whg n GLY 241 N 4.24 -1.67 3.73 -2.22 0.00 -1.26 -4.09 105.19 103.92 2whg n GLY 241 Ca -0.20 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.50 2whg n GLY 241 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2whg s LEU 242 N 0.00 4.47 0.90 0.99 1.02 -1.26 -4.70 118.68 120.11 2whg s LEU 242 Ca 0.00 2.00 -0.11 0.00 0.02 0.00 0.00 54.13 56.04 2whg s LEU 242 Cb 0.00 -3.60 0.13 0.00 0.02 0.00 0.00 46.19 42.75 2whg s LEU 242 CO 0.00 -0.21 1.11 -2.84 0.02 0.00 0.00 176.35 174.43 2whg s PRO 243 N -0.08 1.19 0.00 1.29 0.02 -1.26 -4.64 135.00 131.52 2whg s PRO 243 Ca 0.50 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.79 2whg s PRO 243 Cb -0.28 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.48 2whg s PRO 243 CO 0.33 -2.42 0.00 0.41 -0.33 0.00 0.00 177.00 174.99 2whg n GLY 244 N -0.31 3.90 0.00 0.52 0.00 -0.19 -4.99 105.19 104.12 2whg n GLY 244 Ca 0.09 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2whg n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2whg n GLY 245 N 0.00 5.31 0.33 -0.02 0.00 -1.26 -0.45 105.19 109.10 2whg n GLY 245 Ca 0.00 -1.93 0.18 0.00 0.00 0.00 0.00 46.02 44.28 2whg n GLY 245 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2whg h LEU 246 N 0.00 0.00 -2.00 0.99 3.38 -1.83 -2.57 115.31 113.28 2whg h LEU 246 Ca 0.00 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.14 2whg h LEU 246 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2whg h LEU 246 CO 0.00 0.00 0.46 -2.24 0.09 0.00 0.00 178.44 176.75 2whg h ASP 247 N 0.00 0.00 -0.40 -0.43 -0.00 -1.99 -1.97 116.42 111.63 2whg h ASP 247 Ca 0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 57.04 2whg h ASP 247 Cb 0.32 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.63 2whg h ASP 247 CO -0.00 0.00 0.20 -0.07 -0.00 0.00 0.00 179.24 179.37 2whg h LEU 248 N 0.00 0.56 -0.31 0.15 3.38 -1.78 0.49 115.31 117.80 2whg h LEU 248 Ca 0.29 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 2whg h LEU 248 Cb 1.20 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2whg h LEU 248 CO -0.00 0.50 0.01 -0.07 0.09 0.00 0.00 178.44 178.97 2whg h LEU 249 N 0.63 0.52 -0.38 1.67 3.38 -1.58 -0.56 115.31 119.00 2whg h LEU 249 Ca 0.16 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 2whg h LEU 249 Cb 0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2whg h LEU 249 CO -0.02 0.69 0.03 -0.61 0.09 0.00 0.00 178.44 178.62 2whg h GLN 250 N 0.34 0.65 -0.53 1.13 5.75 -1.53 -1.70 115.11 119.21 2whg h GLN 250 Ca 0.09 -0.19 0.10 0.00 -0.15 0.00 0.00 58.65 58.50 2whg h GLN 250 Cb 0.41 -0.07 -0.09 0.00 1.07 0.00 0.00 27.48 28.81 2whg h GLN 250 CO 0.01 0.73 0.01 1.25 -2.65 0.00 0.00 178.83 178.18 2whg h HIS 251 N 0.48 -0.02 0.00 3.99 2.76 -0.92 -0.84 115.15 120.60 2whg h HIS 251 Ca 0.11 0.04 0.02 0.00 -2.20 0.00 0.00 60.37 58.34 2whg h HIS 251 Cb 0.42 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.45 2whg h HIS 251 CO 0.03 -0.12 -0.11 1.15 -1.30 0.00 0.00 177.93 177.58 2whg h THR 252 N 0.12 0.72 -0.51 6.26 2.02 -0.90 0.13 112.91 120.76 2whg h THR 252 Ca 0.27 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.55 2whg h THR 252 Cb 0.41 0.72 -0.09 0.00 -1.74 0.00 0.00 68.15 67.45 2whg h THR 252 CO -0.44 0.00 -0.08 0.00 0.37 0.00 0.00 175.52 175.36 2whg h ALA 253 N 0.77 0.39 -0.23 6.16 0.00 -0.92 -1.42 119.26 124.00 2whg h ALA 253 Ca 0.04 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2whg h ALA 253 Cb 0.24 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2whg h ALA 253 CO -0.11 -0.43 0.13 -0.91 0.00 0.00 0.00 179.25 177.93 2whg h ASN 254 N 0.04 0.29 -0.55 0.00 -0.26 -0.63 -2.11 115.58 112.35 2whg h ASN 254 Ca 0.25 -0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.89 2whg h ASN 254 Cb 0.38 -0.07 -0.03 0.00 -1.06 0.00 0.00 38.32 37.54 2whg h ASN 254 CO -0.49 0.29 0.29 0.58 -1.06 0.00 0.00 177.43 177.05 2whg h VAL 255 N 0.27 1.18 -0.08 2.81 2.07 -0.48 -1.36 116.25 120.66 2whg h VAL 255 Ca 0.08 -0.49 -0.24 0.00 0.82 0.00 0.00 66.70 66.87 2whg h VAL 255 Cb 0.07 0.43 0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2whg h VAL 255 CO -0.01 0.21 -0.89 0.58 0.02 0.00 0.00 177.57 177.48 2whg h VAL 256 N 0.80 1.30 -0.12 2.57 2.07 -1.11 -2.75 116.25 119.01 2whg h VAL 256 Ca 0.20 -2.13 -0.00 0.00 0.82 0.00 0.00 66.70 65.60 2whg h VAL 256 Cb 0.06 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 2whg h VAL 256 CO -0.03 0.66 0.07 0.11 0.02 0.00 0.00 177.57 178.41 2whg h LYS 257 N 0.44 0.16 -0.90 1.57 1.79 -1.09 -2.99 116.57 115.56 2whg h LYS 257 Ca -0.08 -0.01 0.18 0.00 -2.18 0.00 0.00 60.65 58.56 2whg h LYS 257 Cb 1.52 -0.03 -0.07 0.00 -1.58 0.00 0.00 32.23 32.07 2whg h LYS 257 CO 0.17 0.14 0.58 0.00 -1.08 0.00 0.00 179.45 179.27 2whg h ALA 258 N 1.01 2.06 -0.29 3.86 0.00 -1.24 -0.77 119.26 123.89 2whg h ALA 258 Ca 0.04 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 2whg h ALA 258 Cb 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2whg h ALA 258 CO -0.01 -0.34 -0.25 1.25 0.00 0.00 0.00 179.25 179.90 2whg h HIS 259 N 0.51 0.65 0.00 0.00 -0.00 -1.35 -3.26 115.15 111.70 2whg h HIS 259 Ca 0.47 -0.14 0.00 0.00 -0.00 0.00 0.00 60.37 60.69 2whg h HIS 259 Cb 1.01 -0.16 0.00 0.00 -0.00 0.00 0.00 27.41 28.27 2whg h HIS 259 CO -0.00 0.77 0.00 1.63 -0.00 0.00 0.00 177.93 180.33 2whg n LYS 260 N -4.11 0.50 0.00 5.26 4.01 -0.29 -5.13 118.16 118.39 2whg n LYS 260 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2whg n LYS 260 Cb 0.42 -1.09 0.00 0.00 -0.51 0.00 0.00 35.03 33.85 2whg n LYS 260 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56