#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c5h s SER 2 N 0.00 6.98 0.46 0.00 0.01 -1.26 -4.52 113.70 115.37 1c5h s SER 2 Ca 0.00 1.19 -0.21 0.00 1.31 0.00 0.00 55.95 58.24 1c5h s SER 2 Cb 0.00 -2.43 -0.09 0.00 0.21 0.00 0.00 66.02 63.71 1c5h s SER 2 CO 0.00 -0.24 1.03 0.42 0.41 0.00 0.00 173.24 174.85 1c5h s THR 3 N 1.40 3.86 0.00 1.44 -4.23 -1.26 -4.96 115.64 111.90 1c5h s THR 3 Ca 0.38 1.20 0.00 0.00 -1.18 0.00 0.00 61.69 62.09 1c5h s THR 3 Cb -0.17 -3.51 0.00 0.00 1.34 0.00 0.00 72.50 70.16 1c5h s THR 3 CO 0.16 -0.21 0.62 -0.90 -0.54 0.00 0.00 174.62 173.75 1c5h n ASP 4 N -0.78 0.80 -4.08 3.99 5.68 0.01 -4.97 116.55 117.20 1c5h n ASP 4 Ca 0.08 -1.36 -0.23 0.00 -0.50 0.00 0.00 54.79 52.79 1c5h n ASP 4 Cb 0.52 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.35 1c5h n ASP 4 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1c5h s TYR 5 N -0.36 1.32 -0.22 2.11 5.04 -0.65 -4.66 117.35 119.93 1c5h s TYR 5 Ca 0.00 -0.34 0.02 0.00 -2.44 0.00 0.00 57.07 54.31 1c5h s TYR 5 Cb 0.00 -0.90 0.04 0.00 0.35 0.00 0.00 41.96 41.45 1c5h s TYR 5 CO 0.00 -0.11 -0.15 -0.46 -1.34 0.00 0.00 175.55 173.49 1c5h s TRP 6 N 0.02 3.01 -0.25 4.97 -0.11 -1.26 -1.74 118.94 123.58 1c5h s TRP 6 Ca -0.02 -1.94 -0.10 0.00 1.22 0.00 0.00 56.10 55.27 1c5h s TRP 6 Cb -0.09 -1.93 -0.04 0.00 -1.50 0.00 0.00 33.47 29.90 1c5h s TRP 6 CO 0.01 -0.83 0.14 -1.14 -4.62 0.00 0.00 176.95 170.50 1c5h s GLN 7 N 1.21 3.93 -0.42 5.86 2.00 0.51 -4.99 119.66 127.76 1c5h s GLN 7 Ca -0.01 -0.34 0.04 0.00 -2.00 0.00 0.00 55.36 53.05 1c5h s GLN 7 Cb -0.16 -3.49 0.17 0.00 0.80 0.00 0.00 33.01 30.32 1c5h s GLN 7 CO -0.09 -0.05 0.43 1.21 -0.50 0.00 0.00 175.29 176.29 1c5h s ASN 8 N 1.33 0.78 -0.03 6.67 3.04 -1.25 -0.94 114.94 124.53 1c5h s ASN 8 Ca 0.06 -2.24 0.07 0.00 0.04 0.00 0.00 52.86 50.79 1c5h s ASN 8 Cb -0.15 0.41 -0.02 0.00 -1.54 0.00 0.00 41.25 39.95 1c5h s ASN 8 CO 0.06 -0.18 -0.24 0.86 -3.04 0.00 0.00 177.10 174.56 1c5h s TRP 9 N 0.74 2.42 -0.02 0.43 -0.00 -0.35 -5.01 118.94 117.15 1c5h s TRP 9 Ca 0.26 -0.46 -0.07 0.00 -0.00 0.00 0.00 56.10 55.84 1c5h s TRP 9 Cb -0.05 -1.55 0.01 0.00 -0.00 0.00 0.00 33.47 31.88 1c5h s TRP 9 CO -0.10 -0.05 0.14 -0.08 -0.00 0.00 0.00 176.95 176.87 1c5h s THR 10 N -0.51 0.05 -2.05 5.86 -1.32 -1.26 -0.55 115.64 115.86 1c5h s THR 10 Ca 0.07 -0.45 0.18 0.00 -1.21 0.00 0.00 61.69 60.28 1c5h s THR 10 Cb -0.11 -0.36 0.49 0.00 -1.51 0.00 0.00 72.50 71.01 1c5h s THR 10 CO 0.00 -0.25 1.65 -0.90 -2.21 0.00 0.00 174.62 172.92 1c5h n ASP 11 N 1.99 0.32 0.00 8.08 5.68 -0.55 -4.88 116.55 127.19 1c5h n ASP 11 Ca -0.19 -1.50 0.00 0.00 -0.50 0.00 0.00 54.79 52.60 1c5h n ASP 11 Cb 0.57 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.53 1c5h n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1c5h n GLY 12 N 0.84 0.46 3.74 6.12 0.00 -1.26 -4.99 105.19 110.09 1c5h n GLY 12 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1c5h n GLY 12 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c5h s GLY 13 N -1.75 2.83 0.00 -0.02 0.00 -1.26 -4.93 107.32 102.18 1c5h s GLY 13 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.06 1c5h s GLY 13 CO 0.00 1.20 0.00 0.61 0.00 0.00 0.00 173.10 174.91 1c5h n GLY 14 N 2.42 0.46 3.47 0.20 0.00 -1.17 -2.92 105.19 107.65 1c5h n GLY 14 Ca -0.01 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 1c5h n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c5h s ILE 15 N 0.00 3.89 -0.35 -0.61 -1.09 -0.71 -4.93 121.20 117.41 1c5h s ILE 15 Ca 0.00 -0.35 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 1c5h s ILE 15 Cb 0.00 -2.73 0.11 0.00 -1.58 0.00 0.00 42.46 38.26 1c5h s ILE 15 CO 0.00 0.46 0.14 -0.69 -1.23 0.00 0.00 174.94 173.62 1c5h s VAL 16 N 0.67 1.12 -0.90 2.92 1.01 -1.26 -1.35 120.40 122.61 1c5h s VAL 16 Ca -0.01 -1.82 -0.16 0.00 0.00 0.00 0.00 61.98 59.99 1c5h s VAL 16 Cb -0.14 -1.83 0.18 0.00 0.00 0.00 0.00 36.38 34.59 1c5h s VAL 16 CO 0.02 -0.74 0.98 0.21 0.00 0.00 0.00 175.10 175.57 1c5h s ASN 17 N 1.18 6.73 -0.17 3.32 3.04 0.66 -4.97 114.94 124.73 1c5h s ASN 17 Ca 0.12 -2.42 -0.14 0.00 0.04 0.00 0.00 52.86 50.46 1c5h s ASN 17 Cb -0.20 -2.31 -0.05 0.00 -1.54 0.00 0.00 41.25 37.16 1c5h s ASN 17 CO -0.16 -0.81 0.30 0.00 -3.04 0.00 0.00 177.10 173.40 1c5h s ALA 18 N 1.39 3.58 -0.20 1.71 0.00 -1.26 -1.55 121.76 125.43 1c5h s ALA 18 Ca 0.26 -0.50 -0.02 0.00 0.00 0.00 0.00 51.96 51.71 1c5h s ALA 18 Cb -0.07 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.62 1c5h s ALA 18 CO -0.09 -0.00 -0.11 0.08 0.00 0.00 0.00 175.76 175.64 1c5h s VAL 19 N 0.67 2.87 -0.82 0.00 1.01 0.18 -4.99 120.40 119.32 1c5h s VAL 19 Ca 0.16 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.22 1c5h s VAL 19 Cb -0.13 -2.27 0.05 0.00 0.00 0.00 0.00 36.38 34.03 1c5h s VAL 19 CO 0.05 0.47 1.28 0.21 0.00 0.00 0.00 175.10 177.11 1c5h s ASN 20 N 1.32 6.29 0.98 3.32 3.84 -1.26 -2.16 114.94 127.26 1c5h s ASN 20 Ca 0.04 -0.90 -0.06 0.00 0.21 0.00 0.00 52.86 52.14 1c5h s ASN 20 Cb -0.14 -2.54 0.09 0.00 -0.55 0.00 0.00 41.25 38.11 1c5h s ASN 20 CO -0.06 -1.65 0.52 0.61 -2.79 0.00 0.00 177.10 173.74 1c5h n GLY 21 N 5.83 -1.19 3.77 1.21 0.00 -0.19 -5.00 105.19 109.62 1c5h n GLY 21 Ca 0.12 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 1c5h n GLY 21 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1c5h s SER 22 N -2.92 6.45 1.59 1.61 1.04 -1.26 -4.56 113.70 115.66 1c5h s SER 22 Ca 0.30 2.34 0.00 0.00 0.48 0.00 0.00 55.95 59.06 1c5h s SER 22 Cb -0.01 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1c5h s SER 22 CO 0.21 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.32 1c5h n GLY 23 N 0.58 3.57 1.70 7.32 0.00 -1.26 -1.46 105.19 115.65 1c5h n GLY 23 Ca 0.05 0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.14 1c5h n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c5h n GLY 24 N 0.00 2.76 3.87 -0.02 0.00 -1.26 -4.87 105.19 105.67 1c5h n GLY 24 Ca 0.00 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 1c5h n GLY 24 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1c5h s ASN 25 N -0.73 6.59 0.08 1.61 3.84 -0.53 -0.02 114.94 125.78 1c5h s ASN 25 Ca 0.49 0.71 -0.19 0.00 0.21 0.00 0.00 52.86 54.07 1c5h s ASN 25 Cb 0.36 -2.15 0.04 0.00 -0.55 0.00 0.00 41.25 38.95 1c5h s ASN 25 CO 0.16 0.22 0.45 -0.72 -2.79 0.00 0.00 177.10 174.42 1c5h s TYR 26 N -1.32 -0.31 0.06 0.43 -0.85 -0.08 -1.02 117.35 114.26 1c5h s TYR 26 Ca 0.29 0.20 0.01 0.00 -0.52 0.00 0.00 57.07 57.05 1c5h s TYR 26 Cb -0.14 0.29 -0.03 0.00 0.38 0.00 0.00 41.96 42.45 1c5h s TYR 26 CO 0.16 -0.65 -0.05 -1.54 -1.52 0.00 0.00 175.55 171.96 1c5h s SER 27 N -2.28 0.70 -0.07 -0.18 1.04 -0.92 -1.24 113.70 110.76 1c5h s SER 27 Ca -0.02 -0.82 -0.03 0.00 0.48 0.00 0.00 55.95 55.56 1c5h s SER 27 Cb 0.00 0.12 0.04 0.00 0.10 0.00 0.00 66.02 66.27 1c5h s SER 27 CO -0.06 -0.42 0.15 -0.69 0.98 0.00 0.00 173.24 173.20 1c5h s VAL 28 N -2.85 -0.04 -0.18 5.02 1.01 0.03 -0.64 120.40 122.75 1c5h s VAL 28 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1c5h s VAL 28 Cb 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 36.38 36.15 1c5h s VAL 28 CO -0.05 0.06 -0.18 0.20 0.00 0.00 0.00 175.10 175.14 1c5h s ASN 29 N 1.00 3.31 0.10 3.32 0.01 -0.60 -1.41 114.94 120.67 1c5h s ASN 29 Ca -0.08 -0.60 0.03 0.00 -0.71 0.00 0.00 52.86 51.50 1c5h s ASN 29 Cb -0.10 -1.52 -0.04 0.00 0.41 0.00 0.00 41.25 40.01 1c5h s ASN 29 CO -0.05 0.01 -0.08 -1.66 -1.51 0.00 0.00 177.10 173.80 1c5h s TRP 30 N 1.26 0.97 -0.27 2.20 -2.14 -0.50 -0.25 118.94 120.21 1c5h s TRP 30 Ca 0.04 -0.75 -0.20 0.00 2.66 0.00 0.00 56.10 57.85 1c5h s TRP 30 Cb -0.13 -0.54 0.07 0.00 -3.10 0.00 0.00 33.47 29.77 1c5h s TRP 30 CO -0.10 -0.06 0.69 -1.54 -2.66 0.00 0.00 176.95 173.28 1c5h s SER 31 N -2.66 -0.85 -1.32 -2.66 1.04 -0.45 -0.99 113.70 105.81 1c5h s SER 31 Ca 0.07 1.46 -0.12 0.00 0.48 0.00 0.00 55.95 57.85 1c5h s SER 31 Cb 0.00 1.40 0.01 0.00 0.10 0.00 0.00 66.02 67.53 1c5h s SER 31 CO -0.02 -0.24 0.50 0.59 0.98 0.00 0.00 173.24 175.05 1c5h n ASN 32 N 3.60 -2.09 -4.75 7.02 3.02 -0.53 -1.73 115.26 119.80 1c5h n ASN 32 Ca -0.17 -1.11 -0.23 0.00 -0.03 0.00 0.00 54.58 53.04 1c5h n ASN 32 Cb 0.57 -2.65 0.09 0.00 -0.61 0.00 0.00 39.78 37.19 1c5h n ASN 32 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1c5h s THR 33 N -3.82 2.19 0.00 3.41 -4.23 -1.11 -3.02 115.64 109.06 1c5h s THR 33 Ca 0.21 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 1c5h s THR 33 Cb -0.09 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.21 1c5h s THR 33 CO 0.92 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.61 1c5h n GLY 34 N -2.70 0.68 3.80 3.99 0.00 -1.15 -2.76 105.19 107.05 1c5h n GLY 34 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1c5h n GLY 34 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c5h s ASP 35 N -0.73 5.85 0.02 1.61 2.15 -1.26 -1.39 116.67 122.92 1c5h s ASP 35 Ca 0.00 0.24 -0.22 0.00 0.43 0.00 0.00 52.55 53.00 1c5h s ASP 35 Cb 0.00 -1.75 0.05 0.00 -0.30 0.00 0.00 42.92 40.92 1c5h s ASP 35 CO 0.00 0.32 0.49 0.72 -0.17 0.00 0.00 175.17 176.53 1c5h s PHE 36 N -1.13 -0.39 -0.04 -5.34 -0.12 -1.02 -1.49 117.98 108.45 1c5h s PHE 36 Ca 0.20 0.50 -0.02 0.00 -0.05 0.00 0.00 56.93 57.57 1c5h s PHE 36 Cb -0.12 0.29 0.03 0.00 -0.63 0.00 0.00 43.02 42.59 1c5h s PHE 36 CO 0.11 -0.58 0.05 0.08 -0.05 0.00 0.00 175.22 174.83 1c5h s VAL 37 N -2.03 -0.06 -0.01 -2.49 1.01 0.29 -2.21 120.40 114.90 1c5h s VAL 37 Ca -0.08 0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.31 1c5h s VAL 37 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 1c5h s VAL 37 CO 0.01 0.17 -0.12 -0.69 0.00 0.00 0.00 175.10 174.48 1c5h s VAL 38 N 1.97 0.96 0.00 2.92 1.01 -0.71 -1.21 120.40 125.34 1c5h s VAL 38 Ca 0.03 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1c5h s VAL 38 Cb -0.12 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.45 1c5h s VAL 38 CO -0.03 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1c5h n GLY 39 N 2.88 0.13 3.29 4.51 0.00 -0.12 -0.39 105.19 115.50 1c5h n GLY 39 Ca -0.15 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.68 1c5h n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c5h s LYS 40 N -2.00 1.43 0.00 1.61 1.02 -1.22 -0.36 119.74 120.23 1c5h s LYS 40 Ca 0.00 -1.05 0.00 0.00 0.02 0.00 0.00 55.97 54.94 1c5h s LYS 40 Cb 0.00 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.69 1c5h s LYS 40 CO 0.00 0.41 0.00 0.41 -0.92 0.00 0.00 175.35 175.25 1c5h n GLY 41 N 1.62 0.75 3.24 -3.33 0.00 -0.71 -1.64 105.19 105.12 1c5h n GLY 41 Ca -0.18 0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1c5h n GLY 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1c5h s TRP 42 N 1.62 1.85 0.34 1.61 0.51 0.48 -0.81 118.94 124.53 1c5h s TRP 42 Ca 0.00 -0.37 0.02 0.00 -2.12 0.00 0.00 56.10 53.64 1c5h s TRP 42 Cb 0.00 -1.14 0.59 0.00 -0.81 0.00 0.00 33.47 32.11 1c5h s TRP 42 CO 0.00 0.04 1.93 1.15 -0.51 0.00 0.00 176.95 179.56 1c5h h THR 43 N 4.46 1.18 -3.41 2.01 2.02 -1.86 -0.65 112.91 116.66 1c5h h THR 43 Ca -0.41 -0.56 -0.65 0.00 0.77 0.00 0.00 66.41 65.56 1c5h h THR 43 Cb 1.15 0.58 -0.36 0.00 -1.74 0.00 0.00 68.15 67.78 1c5h h THR 43 CO 0.45 0.22 -0.82 -0.89 0.37 0.00 0.00 175.52 174.85 1c5h s THR 44 N -5.35 1.93 0.79 3.16 2.01 -1.26 -2.68 115.64 114.24 1c5h s THR 44 Ca -0.09 -1.14 -0.11 0.00 0.31 0.00 0.00 61.69 60.66 1c5h s THR 44 Cb 0.16 -1.91 0.07 0.00 0.01 0.00 0.00 72.50 70.83 1c5h s THR 44 CO 0.77 0.25 1.09 -0.83 -0.69 0.00 0.00 174.62 175.21 1c5h s GLY 45 N 1.28 1.65 -0.05 4.40 0.00 0.70 -4.82 107.32 110.48 1c5h s GLY 45 Ca -0.01 0.06 -0.04 0.00 0.00 0.00 0.00 44.72 44.72 1c5h s GLY 45 CO -0.09 0.44 0.13 -0.45 0.00 0.00 0.00 173.10 173.13 1c5h s SER 46 N -3.59 -0.13 0.00 1.64 0.15 -1.26 -4.86 113.70 105.65 1c5h s SER 46 Ca 0.61 0.27 0.21 0.00 0.70 0.00 0.00 55.95 57.74 1c5h s SER 46 Cb -0.16 0.26 0.98 0.00 -1.71 0.00 0.00 66.02 65.39 1c5h s SER 46 CO 0.56 -0.05 1.69 -0.81 1.20 0.00 0.00 173.24 175.82 1c5h n PRO 47 N 3.10 0.13 -0.09 5.44 -0.04 -1.26 -2.89 135.00 139.38 1c5h n PRO 47 Ca -0.13 0.11 0.08 0.00 -0.04 0.00 0.00 63.50 63.52 1c5h n PRO 47 Cb 0.59 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.67 1c5h n PRO 47 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1c5h n PHE 48 N -1.41 0.23 -2.52 0.54 3.72 -1.26 -3.24 117.46 113.53 1c5h n PHE 48 Ca 0.07 -0.17 -0.37 0.00 -0.05 0.00 0.00 57.45 56.94 1c5h n PHE 48 Cb 0.22 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.71 1c5h n PHE 48 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1c5h s ARG 49 N -1.27 4.19 -0.27 -1.08 3.52 -1.14 -4.81 118.95 118.09 1c5h s ARG 49 Ca 0.25 1.56 -0.04 0.00 -0.13 0.00 0.00 55.73 57.37 1c5h s ARG 49 Cb 0.15 -2.60 0.02 0.00 -1.56 0.00 0.00 34.95 30.96 1c5h s ARG 49 CO 0.22 -0.13 0.01 0.99 -0.81 0.00 0.00 175.30 175.57 1c5h s THR 50 N -1.60 3.35 -0.15 4.11 2.01 -1.26 -2.94 115.64 119.16 1c5h s THR 50 Ca 0.57 -0.93 -0.12 0.00 0.31 0.00 0.00 61.69 61.52 1c5h s THR 50 Cb -0.24 -2.74 -0.05 0.00 0.01 0.00 0.00 72.50 69.49 1c5h s THR 50 CO 0.29 0.11 0.25 -0.63 -0.69 0.00 0.00 174.62 173.95 1c5h s ILE 51 N 1.39 5.33 -0.01 1.82 1.09 -0.55 -4.94 121.20 125.33 1c5h s ILE 51 Ca 0.01 0.45 0.04 0.00 -1.10 0.00 0.00 60.65 60.05 1c5h s ILE 51 Cb -0.17 -3.57 -0.03 0.00 -1.06 0.00 0.00 42.46 37.62 1c5h s ILE 51 CO -0.01 0.45 -0.13 0.20 -0.10 0.00 0.00 174.94 175.34 1c5h s ASN 52 N 0.11 4.12 0.16 3.58 0.01 -0.34 -0.32 114.94 122.26 1c5h s ASN 52 Ca 0.15 -0.25 -0.20 0.00 -0.71 0.00 0.00 52.86 51.86 1c5h s ASN 52 Cb -0.13 -0.84 0.05 0.00 0.41 0.00 0.00 41.25 40.74 1c5h s ASN 52 CO 0.03 0.30 0.53 -0.72 -1.51 0.00 0.00 177.10 175.74 1c5h s TYR 53 N -0.85 -0.35 -0.19 2.20 1.13 -0.17 -1.41 117.35 117.70 1c5h s TYR 53 Ca 0.14 0.08 -0.05 0.00 -1.41 0.00 0.00 57.07 55.83 1c5h s TYR 53 Cb -0.11 0.45 0.07 0.00 -1.10 0.00 0.00 41.96 41.27 1c5h s TYR 53 CO 0.04 -0.83 0.13 1.21 -2.51 0.00 0.00 175.55 173.58 1c5h s ASN 54 N -2.79 2.15 -0.79 -0.18 3.04 -0.36 -0.04 114.94 115.96 1c5h s ASN 54 Ca 0.03 -0.55 -0.21 0.00 0.04 0.00 0.00 52.86 52.17 1c5h s ASN 54 Cb -0.00 -0.07 0.09 0.00 -1.54 0.00 0.00 41.25 39.73 1c5h s ASN 54 CO -0.10 -0.35 1.05 0.00 -3.04 0.00 0.00 177.10 174.66 1c5h s ALA 55 N 2.19 3.20 0.38 1.71 0.00 -1.26 -1.59 121.76 126.39 1c5h s ALA 55 Ca 0.04 -2.26 0.08 0.00 0.00 0.00 0.00 51.96 49.83 1c5h s ALA 55 Cb -0.16 -3.97 0.75 0.00 0.00 0.00 0.00 23.12 19.74 1c5h s ALA 55 CO -0.12 -2.90 1.91 0.78 0.00 0.00 0.00 175.76 175.43 1c5h h GLY 56 N 11.02 0.32 -6.70 0.00 0.00 -1.18 -0.40 103.07 106.13 1c5h h GLY 56 Ca -0.08 -0.20 -0.40 0.00 0.00 0.00 0.00 47.33 46.66 1c5h h GLY 56 CO 1.16 0.18 -0.76 0.14 0.00 0.00 0.00 176.54 177.27 1c5h s VAL 57 N -4.79 0.31 -0.34 4.60 1.01 -0.95 -4.76 120.40 115.48 1c5h s VAL 57 Ca -0.06 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1c5h s VAL 57 Cb 0.15 -0.43 0.13 0.00 0.00 0.00 0.00 36.38 36.23 1c5h s VAL 57 CO 0.74 0.21 0.19 0.86 0.00 0.00 0.00 175.10 177.10 1c5h s TRP 58 N 1.48 0.75 -0.47 5.22 -0.00 -1.26 -0.54 118.94 124.12 1c5h s TRP 58 Ca -0.03 -1.50 0.08 0.00 -0.00 0.00 0.00 56.10 54.65 1c5h s TRP 58 Cb -0.13 -1.01 0.27 0.00 -0.00 0.00 0.00 33.47 32.59 1c5h s TRP 58 CO -0.03 -0.83 0.64 0.00 -0.00 0.00 0.00 176.95 176.73 1c5h n ALA 59 N 4.34 3.02 -1.80 5.86 0.00 0.00 -5.03 120.51 126.90 1c5h n ALA 59 Ca 0.07 -3.89 -0.39 0.00 0.00 0.00 0.00 53.44 49.22 1c5h n ALA 59 Cb 0.38 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 18.93 1c5h n ALA 59 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1c5h s PRO 60 N -1.85 4.77 -0.83 0.00 0.04 -1.26 -1.96 135.00 133.90 1c5h s PRO 60 Ca 0.38 1.40 0.01 0.00 0.04 0.00 0.00 61.00 62.83 1c5h s PRO 60 Cb 0.19 -3.21 0.34 0.00 0.04 0.00 0.00 34.50 31.86 1c5h s PRO 60 CO -0.08 0.50 1.57 0.09 0.04 0.00 0.00 177.00 179.11 1c5h n ASN 61 N 1.38 6.41 0.00 6.66 3.02 0.12 -4.87 115.26 127.98 1c5h n ASN 61 Ca -0.02 -3.71 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 1c5h n ASN 61 Cb 0.48 -0.93 0.00 0.00 -0.61 0.00 0.00 39.78 38.71 1c5h n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1c5h n GLY 62 N -0.22 0.42 3.62 7.41 0.00 -1.26 -3.82 105.19 111.35 1c5h n GLY 62 Ca 0.43 -1.38 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1c5h n GLY 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1c5h s ASN 63 N -4.00 6.64 -0.12 1.61 3.04 -1.26 -1.50 114.94 119.34 1c5h s ASN 63 Ca 0.00 0.97 -0.26 0.00 0.04 0.00 0.00 52.86 53.61 1c5h s ASN 63 Cb 0.00 -2.54 0.06 0.00 -1.54 0.00 0.00 41.25 37.23 1c5h s ASN 63 CO 0.00 -1.15 0.63 -0.83 -3.04 0.00 0.00 177.10 172.71 1c5h s GLY 64 N 2.79 -0.50 -0.03 1.21 0.00 -1.26 -2.22 107.32 107.31 1c5h s GLY 64 Ca 0.54 1.40 0.06 0.00 0.00 0.00 0.00 44.72 46.72 1c5h s GLY 64 CO 0.25 1.09 -0.20 -0.19 0.00 0.00 0.00 173.10 174.06 1c5h s TYR 65 N -0.64 1.84 -0.47 1.90 2.02 0.13 -0.78 117.35 121.34 1c5h s TYR 65 Ca -0.07 -0.41 -0.14 0.00 -0.37 0.00 0.00 57.07 56.07 1c5h s TYR 65 Cb -0.02 -1.20 0.08 0.00 -0.40 0.00 0.00 41.96 40.42 1c5h s TYR 65 CO 0.06 -0.08 0.39 -1.17 -1.57 0.00 0.00 175.55 173.18 1c5h s LEU 66 N -0.33 5.63 -0.03 -1.29 2.96 -0.48 -1.31 118.68 123.84 1c5h s LEU 66 Ca 0.04 -1.43 -0.20 0.00 -0.22 0.00 0.00 54.13 52.32 1c5h s LEU 66 Cb -0.09 -2.15 0.04 0.00 0.50 0.00 0.00 46.19 44.49 1c5h s LEU 66 CO 0.00 -0.66 0.44 0.28 -1.32 0.00 0.00 176.35 175.09 1c5h s THR 67 N 1.60 0.04 0.26 3.68 -1.32 -0.36 -1.81 115.64 117.72 1c5h s THR 67 Ca 0.04 -0.31 -0.30 0.00 -1.21 0.00 0.00 61.69 59.91 1c5h s THR 67 Cb -0.25 -0.74 -0.10 0.00 -1.51 0.00 0.00 72.50 69.90 1c5h s THR 67 CO 0.05 -0.17 1.30 -0.22 -2.21 0.00 0.00 174.62 173.37 1c5h s LEU 68 N -1.26 4.43 -0.03 9.08 2.96 -0.09 -0.44 118.68 133.33 1c5h s LEU 68 Ca -0.13 2.52 -0.02 0.00 -0.22 0.00 0.00 54.13 56.28 1c5h s LEU 68 Cb -0.03 -3.63 0.01 0.00 0.50 0.00 0.00 46.19 43.04 1c5h s LEU 68 CO 0.06 -0.51 0.08 -0.47 -1.32 0.00 0.00 176.35 174.19 1c5h s TYR 69 N -0.46 -0.08 0.23 5.38 5.04 0.14 -1.84 117.35 125.76 1c5h s TYR 69 Ca 0.53 0.23 -0.21 0.00 -2.44 0.00 0.00 57.07 55.18 1c5h s TYR 69 Cb -0.38 -0.02 0.07 0.00 0.35 0.00 0.00 41.96 41.98 1c5h s TYR 69 CO 0.44 -0.06 0.95 0.20 -1.34 0.00 0.00 175.55 175.74 1c5h s GLY 70 N 0.32 0.10 0.06 8.97 0.00 -1.02 -0.49 107.32 115.25 1c5h s GLY 70 Ca -0.02 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.36 1c5h s GLY 70 CO -0.01 1.21 -0.05 -0.98 0.00 0.00 0.00 173.10 173.27 1c5h s TRP 71 N -2.48 0.61 0.08 1.90 0.52 -1.13 -1.17 118.94 117.26 1c5h s TRP 71 Ca 0.18 -0.79 0.03 0.00 0.02 0.00 0.00 56.10 55.54 1c5h s TRP 71 Cb -0.03 -0.39 -0.03 0.00 -1.15 0.00 0.00 33.47 31.87 1c5h s TRP 71 CO 0.06 -0.21 -0.09 0.95 0.02 0.00 0.00 176.95 177.68 1c5h s THR 72 N -2.78 0.79 0.30 2.01 -4.23 -0.67 -1.46 115.64 109.60 1c5h s THR 72 Ca 0.00 -1.51 0.09 0.00 -1.18 0.00 0.00 61.69 59.09 1c5h s THR 72 Cb -0.00 -1.19 -0.05 0.00 1.34 0.00 0.00 72.50 72.60 1c5h s THR 72 CO -0.04 -0.55 0.01 -0.13 -0.54 0.00 0.00 174.62 173.37 1c5h s ARG 73 N -2.58 2.19 -0.90 3.99 0.52 0.16 -1.50 118.95 120.84 1c5h s ARG 73 Ca 0.02 -1.57 -0.07 0.00 -0.52 0.00 0.00 55.73 53.58 1c5h s ARG 73 Cb -0.04 -2.06 -0.01 0.00 0.52 0.00 0.00 34.95 33.37 1c5h s ARG 73 CO -0.01 0.24 0.72 0.43 0.02 0.00 0.00 175.30 176.70 1c5h n SER 74 N -0.94 -6.19 -4.95 0.23 7.64 -1.26 -2.16 113.62 105.99 1c5h n SER 74 Ca -0.05 -0.64 -0.22 0.00 1.01 0.00 0.00 58.87 58.97 1c5h n SER 74 Cb 0.61 -3.73 0.04 0.00 -1.01 0.00 0.00 64.21 60.12 1c5h n SER 74 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1c5h s PRO 75 N -4.53 2.45 -0.21 1.43 0.04 -1.26 -1.89 135.00 131.04 1c5h s PRO 75 Ca 0.18 -0.74 -0.29 0.00 0.04 0.00 0.00 61.00 60.18 1c5h s PRO 75 Cb -0.06 -2.44 -0.02 0.00 0.04 0.00 0.00 34.50 32.02 1c5h s PRO 75 CO 0.82 -0.82 1.43 -1.17 0.04 0.00 0.00 177.00 177.30 1c5h s LEU 76 N -4.84 4.02 -0.02 -3.56 2.96 -1.25 -4.14 118.68 111.85 1c5h s LEU 76 Ca 0.58 1.59 -0.00 0.00 -0.22 0.00 0.00 54.13 56.08 1c5h s LEU 76 Cb -0.10 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.08 1c5h s LEU 76 CO 0.39 -1.03 0.03 -0.63 -1.32 0.00 0.00 176.35 173.80 1c5h s ILE 77 N 4.34 -0.05 -0.27 6.68 1.01 -0.56 -4.02 121.20 128.32 1c5h s ILE 77 Ca 0.62 0.18 -0.10 0.00 0.00 0.00 0.00 60.65 61.36 1c5h s ILE 77 Cb -0.23 -0.08 -0.04 0.00 0.01 0.00 0.00 42.46 42.13 1c5h s ILE 77 CO 0.23 0.07 0.15 -0.70 0.00 0.00 0.00 174.94 174.70 1c5h s GLU 78 N 0.90 3.80 0.27 2.79 2.12 -0.99 -1.67 118.70 125.93 1c5h s GLU 78 Ca -0.07 -0.41 0.12 0.00 0.36 0.00 0.00 54.97 54.97 1c5h s GLU 78 Cb -0.11 -3.55 -0.05 0.00 0.26 0.00 0.00 34.13 30.69 1c5h s GLU 78 CO -0.03 -0.21 -0.17 1.52 -0.54 0.00 0.00 175.26 175.84 1c5h s TYR 79 N 1.70 2.35 -0.01 5.30 -0.85 -0.32 -1.46 117.35 124.07 1c5h s TYR 79 Ca 0.07 -0.31 -0.07 0.00 -0.52 0.00 0.00 57.07 56.23 1c5h s TYR 79 Cb -0.16 -1.03 0.00 0.00 0.38 0.00 0.00 41.96 41.16 1c5h s TYR 79 CO 0.08 0.69 0.14 0.71 -1.52 0.00 0.00 175.55 175.66 1c5h s TYR 80 N -2.43 -0.00 -0.39 -3.49 1.51 -0.08 -2.44 117.35 110.02 1c5h s TYR 80 Ca 0.30 -0.02 0.01 0.00 -1.01 0.00 0.00 57.07 56.35 1c5h s TYR 80 Cb -0.05 -0.03 0.13 0.00 -0.11 0.00 0.00 41.96 41.89 1c5h s TYR 80 CO 0.15 -0.24 0.19 0.08 -1.11 0.00 0.00 175.55 174.63 1c5h s VAL 81 N -1.06 1.14 -0.26 0.71 1.01 -0.77 -1.67 120.40 119.50 1c5h s VAL 81 Ca -0.12 -2.14 -0.23 0.00 0.00 0.00 0.00 61.98 59.50 1c5h s VAL 81 Cb -0.06 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 1c5h s VAL 81 CO 0.01 -0.84 0.75 -0.69 0.00 0.00 0.00 175.10 174.34 1c5h s VAL 82 N 0.79 4.88 -0.16 2.92 1.01 0.71 -0.92 120.40 129.63 1c5h s VAL 82 Ca 0.15 1.34 0.16 0.00 0.00 0.00 0.00 61.98 63.63 1c5h s VAL 82 Cb -0.22 -4.06 -0.24 0.00 0.00 0.00 0.00 36.38 31.85 1c5h s VAL 82 CO -0.07 -0.08 0.21 0.47 0.00 0.00 0.00 175.10 175.64 1c5h n ASP 83 N 5.95 0.25 -3.85 3.32 8.00 -0.75 -1.40 116.55 128.08 1c5h n ASP 83 Ca 0.03 0.10 -0.10 0.00 0.71 0.00 0.00 54.79 55.54 1c5h n ASP 83 Cb 0.48 0.71 -0.05 0.00 -0.02 0.00 0.00 41.12 42.24 1c5h n ASP 83 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1c5h s SER 84 N -5.66 -0.10 0.33 -2.24 0.15 -1.17 -0.49 113.70 104.54 1c5h s SER 84 Ca -0.09 -0.67 -0.05 0.00 0.70 0.00 0.00 55.95 55.84 1c5h s SER 84 Cb 0.07 0.50 0.02 0.00 -1.71 0.00 0.00 66.02 64.89 1c5h s SER 84 CO 0.83 -0.95 0.53 -2.67 1.20 0.00 0.00 173.24 172.17 1c5h n TRP 85 N -0.26 -1.63 0.00 3.44 2.14 -1.26 -1.38 117.44 118.49 1c5h n TRP 85 Ca -0.09 -2.03 0.00 0.00 2.07 0.00 0.00 57.50 57.45 1c5h n TRP 85 Cb 0.63 0.61 0.00 0.00 -0.81 0.00 0.00 31.31 31.73 1c5h n TRP 85 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1c5h n GLY 86 N -0.52 0.45 0.03 -1.67 0.00 0.04 -4.92 105.19 98.59 1c5h n GLY 86 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 1c5h n GLY 86 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1c5h n THR 87 N 0.00 0.17 -4.07 2.61 -2.24 -0.57 -4.82 114.28 105.36 1c5h n THR 87 Ca 0.00 -0.13 -0.28 0.00 -2.27 0.00 0.00 64.05 61.37 1c5h n THR 87 Cb 0.00 0.03 -0.17 0.00 -2.10 0.00 0.00 70.33 68.09 1c5h n THR 87 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1c5h s TYR 88 N -3.08 1.71 -0.29 4.78 5.04 -1.26 -5.00 117.35 119.25 1c5h s TYR 88 Ca 0.09 -0.86 -0.23 0.00 -2.44 0.00 0.00 57.07 53.63 1c5h s TYR 88 Cb 0.16 -1.33 -0.00 0.00 0.35 0.00 0.00 41.96 41.14 1c5h s TYR 88 CO 0.70 -0.52 0.79 0.50 -1.34 0.00 0.00 175.55 175.68 1c5h s ARG 89 N 1.45 4.02 0.29 4.97 3.52 -1.26 -4.83 118.95 127.11 1c5h s ARG 89 Ca 0.01 0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 55.98 1c5h s ARG 89 Cb -0.13 -3.70 -0.10 0.00 -1.56 0.00 0.00 34.95 29.45 1c5h s ARG 89 CO -0.07 -0.62 1.42 -1.25 -0.81 0.00 0.00 175.30 173.97 1c5h s PRO 90 N 2.90 4.26 0.25 5.12 0.04 -1.26 -5.02 135.00 141.29 1c5h s PRO 90 Ca 0.32 2.33 -0.04 0.00 0.04 0.00 0.00 61.00 63.66 1c5h s PRO 90 Cb -0.14 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.30 1c5h s PRO 90 CO 0.11 -0.39 0.30 0.95 0.04 0.00 0.00 177.00 178.01 1c5h s THR 91 N -0.43 0.00 0.00 1.26 -4.23 -1.26 -4.93 115.64 106.05 1c5h s THR 91 Ca 0.56 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1c5h s THR 91 Cb -0.42 -2.43 0.00 0.00 1.34 0.00 0.00 72.50 70.99 1c5h s THR 91 CO 0.48 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.17 1c5h n GLY 92 N -0.38 2.66 3.60 3.99 0.00 -1.26 -4.99 105.19 108.80 1c5h n GLY 92 Ca 0.01 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1c5h n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c5h s THR 93 N 0.31 4.22 0.22 2.61 2.01 -0.62 -4.85 115.64 119.55 1c5h s THR 93 Ca 0.00 1.26 -0.31 0.00 0.31 0.00 0.00 61.69 62.95 1c5h s THR 93 Cb 0.00 -4.58 -0.11 0.00 0.01 0.00 0.00 72.50 67.82 1c5h s THR 93 CO 0.00 -0.97 1.58 -0.47 -0.69 0.00 0.00 174.62 174.08 1c5h s TYR 94 N 4.41 2.95 -0.04 4.92 5.04 -1.26 -2.19 117.35 131.18 1c5h s TYR 94 Ca 0.48 0.68 0.01 0.00 -2.44 0.00 0.00 57.07 55.81 1c5h s TYR 94 Cb -0.08 -3.99 -0.03 0.00 0.35 0.00 0.00 41.96 38.22 1c5h s TYR 94 CO 0.30 -3.50 -0.02 1.63 -1.34 0.00 0.00 175.55 172.62 1c5h n LYS 95 N 3.20 1.26 -3.79 4.97 4.76 0.33 -4.98 118.16 123.92 1c5h n LYS 95 Ca 0.11 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 1c5h n LYS 95 Cb 0.38 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 32.48 1c5h n LYS 95 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1c5h n GLY 96 N 3.12 -0.54 3.27 0.72 0.00 -1.24 -4.99 105.19 105.54 1c5h n GLY 96 Ca -0.07 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 44.79 1c5h n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1c5h s THR 97 N -3.00 0.79 -0.10 2.61 -4.23 -1.26 0.13 115.64 110.58 1c5h s THR 97 Ca 0.00 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.45 1c5h s THR 97 Cb 0.00 -2.19 0.04 0.00 1.34 0.00 0.00 72.50 71.69 1c5h s THR 97 CO 0.00 -0.43 0.24 0.54 -0.54 0.00 0.00 174.62 174.43 1c5h s VAL 98 N -3.58 -0.03 -0.18 2.29 0.11 -0.11 -4.92 120.40 113.97 1c5h s VAL 98 Ca 0.25 0.10 -0.14 0.00 -2.93 0.00 0.00 61.98 59.26 1c5h s VAL 98 Cb 0.06 -0.35 -0.04 0.00 -1.53 0.00 0.00 36.38 34.51 1c5h s VAL 98 CO 0.05 0.04 0.30 -0.54 -3.33 0.00 0.00 175.10 171.63 1c5h s LYS 99 N 0.87 4.22 -0.25 1.54 3.01 -1.26 -0.58 119.74 127.29 1c5h s LYS 99 Ca -0.06 0.08 -0.21 0.00 -1.01 0.00 0.00 55.97 54.77 1c5h s LYS 99 Cb -0.07 -3.47 0.07 0.00 -1.01 0.00 0.00 37.83 33.35 1c5h s LYS 99 CO -0.05 0.15 0.65 0.45 0.51 0.00 0.00 175.35 177.05 1c5h s SER 100 N 0.68 -0.72 -1.45 2.83 0.15 -0.22 -4.96 113.70 110.01 1c5h s SER 100 Ca 0.16 1.33 -0.07 0.00 0.70 0.00 0.00 55.95 58.07 1c5h s SER 100 Cb -0.13 1.32 0.05 0.00 -1.71 0.00 0.00 66.02 65.54 1c5h s SER 100 CO 0.05 -0.23 0.78 0.47 1.20 0.00 0.00 173.24 175.51 1c5h n ASP 101 N 3.06 -2.71 0.00 5.45 8.00 -1.26 -1.80 116.55 127.30 1c5h n ASP 101 Ca -0.15 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1c5h n ASP 101 Cb 0.56 -3.74 0.00 0.00 -0.02 0.00 0.00 41.12 37.92 1c5h n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1c5h n GLY 102 N -1.67 1.54 3.44 0.44 0.00 -1.26 -4.94 105.19 102.73 1c5h n GLY 102 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 1c5h n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c5h s GLY 103 N -2.00 1.95 -0.13 -0.02 0.00 -0.74 -5.14 107.32 101.23 1c5h s GLY 103 Ca 0.00 -1.98 -0.01 0.00 0.00 0.00 0.00 44.72 42.73 1c5h s GLY 103 CO 0.00 -1.82 -0.10 -1.59 0.00 0.00 0.00 173.10 169.58 1c5h s THR 104 N -3.18 3.30 -0.00 0.90 2.01 -1.26 -1.06 115.64 116.34 1c5h s THR 104 Ca 0.33 -0.58 0.08 0.00 0.31 0.00 0.00 61.69 61.83 1c5h s THR 104 Cb 0.07 -2.40 -0.02 0.00 0.01 0.00 0.00 72.50 70.16 1c5h s THR 104 CO 0.13 0.52 -0.24 -0.31 -0.69 0.00 0.00 174.62 174.04 1c5h s TYR 105 N 0.26 2.40 0.15 4.92 1.51 0.25 -0.96 117.35 125.89 1c5h s TYR 105 Ca -0.07 -0.38 -0.19 0.00 -1.01 0.00 0.00 57.07 55.42 1c5h s TYR 105 Cb -0.15 -1.49 -0.07 0.00 -0.11 0.00 0.00 41.96 40.13 1c5h s TYR 105 CO 0.05 0.05 0.65 -0.51 -1.11 0.00 0.00 175.55 174.68 1c5h s ASP 106 N -0.84 7.06 -0.19 2.29 1.01 0.35 -0.94 116.67 125.41 1c5h s ASP 106 Ca 0.11 1.33 -0.07 0.00 0.71 0.00 0.00 52.55 54.63 1c5h s ASP 106 Cb -0.10 -2.39 -0.04 0.00 1.01 0.00 0.00 42.92 41.41 1c5h s ASP 106 CO 0.00 0.15 0.05 -0.63 0.21 0.00 0.00 175.17 174.95 1c5h s ILE 107 N -1.33 4.59 0.09 0.77 1.01 0.12 -0.94 121.20 125.52 1c5h s ILE 107 Ca 0.36 -0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.94 1c5h s ILE 107 Cb -0.18 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1c5h s ILE 107 CO 0.21 0.44 -0.08 -0.31 0.00 0.00 0.00 174.94 175.20 1c5h s TYR 108 N 0.59 0.95 0.02 3.97 2.02 -0.35 -0.51 117.35 124.05 1c5h s TYR 108 Ca 0.02 -0.76 0.06 0.00 -0.37 0.00 0.00 57.07 56.03 1c5h s TYR 108 Cb -0.13 -0.53 -0.02 0.00 -0.40 0.00 0.00 41.96 40.88 1c5h s TYR 108 CO 0.01 -0.07 -0.18 0.95 -1.57 0.00 0.00 175.55 174.70 1c5h s THR 109 N -2.89 1.40 0.21 -0.71 -4.23 -0.93 -0.75 115.64 107.73 1c5h s THR 109 Ca 0.07 -0.97 -0.05 0.00 -1.18 0.00 0.00 61.69 59.56 1c5h s THR 109 Cb 0.00 -1.21 -0.03 0.00 1.34 0.00 0.00 72.50 72.61 1c5h s THR 109 CO -0.02 0.21 0.23 0.42 -0.54 0.00 0.00 174.62 174.92 1c5h s THR 110 N -0.66 0.01 -0.00 3.99 -4.23 -0.92 -1.58 115.64 112.24 1c5h s THR 110 Ca 0.06 -1.80 0.04 0.00 -1.18 0.00 0.00 61.69 58.80 1c5h s THR 110 Cb -0.08 -2.36 -0.01 0.00 1.34 0.00 0.00 72.50 71.39 1c5h s THR 110 CO 0.01 -0.04 -0.13 -0.89 -0.54 0.00 0.00 174.62 173.03 1c5h s THR 111 N -4.11 1.00 -0.14 3.99 2.01 -1.26 -0.67 115.64 116.47 1c5h s THR 111 Ca 0.33 -0.58 -0.04 0.00 0.31 0.00 0.00 61.69 61.71 1c5h s THR 111 Cb 0.05 -0.85 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1c5h s THR 111 CO 0.10 0.25 -0.01 -0.13 -0.69 0.00 0.00 174.62 174.14 1c5h s ARG 112 N -0.38 3.48 -0.15 4.92 1.81 0.34 -4.98 118.95 123.99 1c5h s ARG 112 Ca 0.04 -0.45 -0.01 0.00 -1.72 0.00 0.00 55.73 53.59 1c5h s ARG 112 Cb -0.05 -2.92 -0.01 0.00 -0.45 0.00 0.00 34.95 31.52 1c5h s ARG 112 CO -0.00 0.41 -0.10 0.71 -0.68 0.00 0.00 175.30 175.63 1c5h s TYR 113 N -0.07 2.87 -1.42 -0.53 2.02 -1.26 -1.51 117.35 117.45 1c5h s TYR 113 Ca 0.03 -0.68 -0.01 0.00 -0.37 0.00 0.00 57.07 56.04 1c5h s TYR 113 Cb -0.13 -1.91 0.01 0.00 -0.40 0.00 0.00 41.96 39.53 1c5h s TYR 113 CO 0.02 -0.27 0.45 -1.71 -1.57 0.00 0.00 175.55 172.47 1c5h n ASN 114 N 3.80 -0.53 -4.60 2.29 5.15 -0.94 -4.94 115.26 115.49 1c5h n ASN 114 Ca -0.18 -1.00 -0.25 0.00 -0.60 0.00 0.00 54.58 52.55 1c5h n ASN 114 Cb 0.52 -3.09 -0.08 0.00 -0.53 0.00 0.00 39.78 36.60 1c5h n ASN 114 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1c5h s ALA 115 N -3.91 3.05 0.30 5.20 0.00 -0.18 -4.64 121.76 121.57 1c5h s ALA 115 Ca 0.05 -1.58 -0.29 0.00 0.00 0.00 0.00 51.96 50.14 1c5h s ALA 115 Cb -0.03 -0.74 -0.10 0.00 0.00 0.00 0.00 23.12 22.26 1c5h s ALA 115 CO 0.89 0.36 1.34 -2.14 0.00 0.00 0.00 175.76 176.21 1c5h s PRO 116 N -3.26 4.34 0.40 0.00 0.02 -1.26 -1.08 135.00 134.15 1c5h s PRO 116 Ca 0.28 2.22 0.01 0.00 0.02 0.00 0.00 61.00 63.54 1c5h s PRO 116 Cb -0.07 -3.09 0.01 0.00 0.02 0.00 0.00 34.50 31.36 1c5h s PRO 116 CO 0.17 -0.26 0.11 -1.13 -0.33 0.00 0.00 177.00 175.57 1c5h n SER 117 N 1.39 2.84 0.26 2.53 3.41 -1.17 -4.91 113.62 117.97 1c5h n SER 117 Ca 0.02 -2.63 0.08 0.00 -0.26 0.00 0.00 58.87 56.08 1c5h n SER 117 Cb 0.41 0.17 0.64 0.00 -0.26 0.00 0.00 64.21 65.18 1c5h n SER 117 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1c5h h ILE 118 N 1.01 0.99 -0.24 -1.33 2.10 -1.95 -1.98 117.51 116.11 1c5h h ILE 118 Ca -0.31 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 65.60 1c5h h ILE 118 Cb 0.98 1.02 0.00 0.00 -1.09 0.00 0.00 36.82 37.73 1c5h h ILE 118 CO 0.50 0.01 0.00 0.47 -1.08 0.00 0.00 178.15 178.05 1c5h n ASP 119 N -4.51 1.47 0.00 2.19 8.00 -1.26 -5.03 116.55 117.41 1c5h n ASP 119 Ca -0.03 -1.89 0.00 0.00 0.71 0.00 0.00 54.79 53.58 1c5h n ASP 119 Cb 0.10 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 1c5h n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1c5h n GLY 120 N 0.99 -0.95 7.00 0.44 0.00 -0.75 -5.04 105.19 106.88 1c5h n GLY 120 Ca 0.12 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1c5h n GLY 120 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c5h n ASP 121 N -1.00 -4.33 -4.32 1.61 8.00 -1.26 -4.20 116.55 111.04 1c5h n ASP 121 Ca 0.00 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.26 1c5h n ASP 121 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 1c5h n ASP 121 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1c5h s ARG 122 N 0.00 1.22 0.32 -1.24 0.52 -1.26 -3.03 118.95 115.48 1c5h s ARG 122 Ca 0.00 -1.28 -0.18 0.00 -0.52 0.00 0.00 55.73 53.75 1c5h s ARG 122 Cb 0.00 -1.45 0.07 0.00 0.52 0.00 0.00 34.95 34.09 1c5h s ARG 122 CO 0.00 0.32 0.89 -0.08 0.02 0.00 0.00 175.30 176.45 1c5h s THR 123 N -1.46 0.00 -0.19 0.02 -1.32 -0.24 -4.82 115.64 107.62 1c5h s THR 123 Ca 0.11 -0.85 -0.06 0.00 -1.21 0.00 0.00 61.69 59.69 1c5h s THR 123 Cb -0.09 -2.99 -0.03 0.00 -1.51 0.00 0.00 72.50 67.89 1c5h s THR 123 CO 0.06 0.00 0.01 -0.89 -2.21 0.00 0.00 174.62 171.59 1c5h s THR 124 N -2.09 4.17 0.12 5.08 2.01 -1.26 -1.01 115.64 122.66 1c5h s THR 124 Ca 0.19 -0.24 -0.09 0.00 0.31 0.00 0.00 61.69 61.85 1c5h s THR 124 Cb -0.04 -2.88 -0.00 0.00 0.01 0.00 0.00 72.50 69.59 1c5h s THR 124 CO 0.10 0.44 0.25 0.72 -0.69 0.00 0.00 174.62 175.43 1c5h s PHE 125 N 0.79 0.23 0.20 4.92 -0.12 -0.57 -4.98 117.98 118.45 1c5h s PHE 125 Ca 0.01 -0.62 -0.09 0.00 -0.05 0.00 0.00 56.93 56.18 1c5h s PHE 125 Cb -0.14 -0.03 -0.07 0.00 -0.63 0.00 0.00 43.02 42.15 1c5h s PHE 125 CO 0.02 -0.63 0.51 0.99 -0.05 0.00 0.00 175.22 176.05 1c5h s THR 126 N -3.90 4.98 -0.05 -4.49 2.01 -1.26 -0.50 115.64 112.43 1c5h s THR 126 Ca 0.10 0.41 0.06 0.00 0.31 0.00 0.00 61.69 62.57 1c5h s THR 126 Cb 0.04 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.91 1c5h s THR 126 CO -0.06 -0.00 -0.24 -1.10 -0.69 0.00 0.00 174.62 172.52 1c5h s GLN 127 N -2.67 2.45 -0.13 4.92 -0.21 0.15 -2.34 119.66 121.84 1c5h s GLN 127 Ca 0.45 -0.88 -0.04 0.00 0.02 0.00 0.00 55.36 54.91 1c5h s GLN 127 Cb -0.12 -2.09 -0.03 0.00 1.00 0.00 0.00 33.01 31.76 1c5h s GLN 127 CO 0.21 0.37 0.01 0.71 -2.12 0.00 0.00 175.29 174.48 1c5h s TYR 128 N -0.16 3.16 0.02 0.91 2.02 -0.54 -2.15 117.35 120.61 1c5h s TYR 128 Ca -0.03 0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.73 1c5h s TYR 128 Cb -0.13 -1.91 -0.01 0.00 -0.40 0.00 0.00 41.96 39.50 1c5h s TYR 128 CO 0.03 0.27 -0.06 -1.58 -1.57 0.00 0.00 175.55 172.64 1c5h s TRP 129 N -0.25 0.55 -0.24 2.71 0.52 0.07 -0.90 118.94 121.40 1c5h s TRP 129 Ca 0.06 -0.31 -0.00 0.00 0.02 0.00 0.00 56.10 55.86 1c5h s TRP 129 Cb -0.12 -0.34 0.07 0.00 -1.15 0.00 0.00 33.47 31.92 1c5h s TRP 129 CO 0.02 -0.05 -0.00 -1.12 0.02 0.00 0.00 176.95 175.82 1c5h s SER 130 N -0.92 3.66 -0.17 2.95 0.01 -0.67 -1.21 113.70 117.35 1c5h s SER 130 Ca -0.05 -1.19 0.01 0.00 1.31 0.00 0.00 55.95 56.03 1c5h s SER 130 Cb -0.06 -0.99 0.02 0.00 0.21 0.00 0.00 66.02 65.20 1c5h s SER 130 CO 0.00 -0.29 -0.20 -0.69 0.41 0.00 0.00 173.24 172.47 1c5h s VAL 131 N 1.53 2.01 0.41 3.43 1.01 -0.12 -0.21 120.40 128.47 1c5h s VAL 131 Ca -0.01 -0.92 -0.26 0.00 0.00 0.00 0.00 61.98 60.79 1c5h s VAL 131 Cb -0.18 -1.81 -0.10 0.00 0.00 0.00 0.00 36.38 34.29 1c5h s VAL 131 CO -0.10 0.53 1.28 -1.14 0.00 0.00 0.00 175.10 175.68 1c5h n ARG 132 N 4.49 1.97 0.04 2.72 0.63 -0.49 -0.50 116.66 125.52 1c5h n ARG 132 Ca -0.20 0.70 -0.03 0.00 -0.92 0.00 0.00 57.85 57.40 1c5h n ARG 132 Cb 0.50 -2.38 0.21 0.00 0.45 0.00 0.00 32.46 31.24 1c5h n ARG 132 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1c5h h GLN 133 N 2.16 0.41 -5.11 -0.14 4.20 -1.41 -3.44 115.11 111.79 1c5h h GLN 133 Ca -0.48 -0.16 -0.37 0.00 0.06 0.00 0.00 58.65 57.70 1c5h h GLN 133 Cb 1.29 -0.02 -0.21 0.00 0.30 0.00 0.00 27.48 28.84 1c5h h GLN 133 CO 0.60 0.67 -0.76 -1.54 -0.67 0.00 0.00 178.83 177.13 1c5h s SER 134 N -6.84 1.44 0.27 1.46 1.04 -1.26 -5.10 113.70 104.71 1c5h s SER 134 Ca -0.06 -0.61 -0.31 0.00 0.48 0.00 0.00 55.95 55.45 1c5h s SER 134 Cb 0.14 -0.02 -0.12 0.00 0.10 0.00 0.00 66.02 66.11 1c5h s SER 134 CO 0.78 -0.12 1.60 0.29 0.98 0.00 0.00 173.24 176.77 1c5h n LYS 135 N 1.27 2.63 -2.58 4.02 5.02 -1.26 -4.93 118.16 122.32 1c5h n LYS 135 Ca -0.21 0.94 -0.42 0.00 -2.02 0.00 0.00 58.31 56.60 1c5h n LYS 135 Cb 0.54 -2.72 -0.03 0.00 -0.02 0.00 0.00 35.03 32.80 1c5h n LYS 135 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1c5h s ARG 136 N -0.14 4.52 0.56 1.97 3.52 0.36 -5.00 118.95 124.74 1c5h s ARG 136 Ca 0.67 1.58 -0.21 0.00 -0.13 0.00 0.00 55.73 57.64 1c5h s ARG 136 Cb -0.52 -3.39 -0.05 0.00 -1.56 0.00 0.00 34.95 29.42 1c5h s ARG 136 CO 0.45 -0.10 1.24 -2.30 -0.81 0.00 0.00 175.30 173.78 1c5h n PRO 137 N 3.70 1.45 -3.83 5.12 -0.02 -1.26 -4.80 135.00 135.36 1c5h n PRO 137 Ca 0.07 0.54 -0.24 0.00 -2.02 0.00 0.00 63.50 61.85 1c5h n PRO 137 Cb 0.49 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 1c5h n PRO 137 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1c5h s THR 138 N -1.34 2.21 0.00 3.45 -4.23 -1.26 -4.65 115.64 109.82 1c5h s THR 138 Ca 0.73 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 1c5h s THR 138 Cb -0.43 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 70.71 1c5h s THR 138 CO 0.49 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.18 1c5h n GLY 139 N -1.54 0.81 3.59 3.99 0.00 -0.16 -4.99 105.19 106.89 1c5h n GLY 139 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1c5h n GLY 139 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c5h s SER 140 N -2.90 4.04 -0.34 1.61 0.01 -1.26 -4.91 113.70 109.94 1c5h s SER 140 Ca 0.00 -1.01 -0.29 0.00 1.31 0.00 0.00 55.95 55.96 1c5h s SER 140 Cb 0.00 -0.49 -0.00 0.00 0.21 0.00 0.00 66.02 65.74 1c5h s SER 140 CO 0.00 -0.18 1.45 0.20 0.41 0.00 0.00 173.24 175.12 1c5h s ASN 141 N -3.67 6.39 0.15 2.44 0.01 -1.26 -4.36 114.94 114.65 1c5h s ASN 141 Ca 0.33 1.10 0.07 0.00 -0.71 0.00 0.00 52.86 53.65 1c5h s ASN 141 Cb -0.01 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.08 1c5h s ASN 141 CO 0.18 -1.33 -0.03 0.00 -1.51 0.00 0.00 177.10 174.41 1c5h s ALA 142 N 5.24 3.14 -0.01 0.60 0.00 0.94 -4.97 121.76 126.71 1c5h s ALA 142 Ca 0.63 -1.33 0.05 0.00 0.00 0.00 0.00 51.96 51.31 1c5h s ALA 142 Cb -0.17 -0.97 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 1c5h s ALA 142 CO 0.30 0.54 -0.16 0.99 0.00 0.00 0.00 175.76 177.43 1c5h s THR 143 N -1.58 1.23 -0.30 0.00 2.01 -1.26 -1.00 115.64 114.74 1c5h s THR 143 Ca 0.26 -0.68 0.02 0.00 0.31 0.00 0.00 61.69 61.60 1c5h s THR 143 Cb -0.10 -1.03 0.09 0.00 0.01 0.00 0.00 72.50 71.47 1c5h s THR 143 CO 0.17 0.34 0.01 -0.63 -0.69 0.00 0.00 174.62 173.82 1c5h s ILE 144 N -0.38 1.86 -1.04 1.82 1.01 0.56 -4.78 121.20 120.26 1c5h s ILE 144 Ca 0.06 -1.83 -0.21 0.00 0.00 0.00 0.00 60.65 58.66 1c5h s ILE 144 Cb -0.06 -2.26 0.08 0.00 0.01 0.00 0.00 42.46 40.23 1c5h s ILE 144 CO -0.01 -0.42 1.40 -0.89 0.00 0.00 0.00 174.94 175.03 1c5h s THR 145 N 1.16 4.18 0.43 2.92 2.01 -1.26 -1.48 115.64 123.60 1c5h s THR 145 Ca 0.04 -1.16 0.15 0.00 0.31 0.00 0.00 61.69 61.03 1c5h s THR 145 Cb -0.19 -5.00 0.35 0.00 0.01 0.00 0.00 72.50 67.67 1c5h s THR 145 CO -0.10 -1.83 1.94 0.15 -0.69 0.00 0.00 174.62 174.08 1c5h h PHE 146 N 9.22 0.48 -0.43 4.92 3.57 -1.85 -1.86 116.94 130.99 1c5h h PHE 146 Ca 0.22 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.77 1c5h h PHE 146 Cb 0.99 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.56 1c5h h PHE 146 CO 1.26 0.20 0.28 1.79 -2.23 0.00 0.00 178.31 179.61 1c5h h THR 147 N 0.43 1.02 -0.84 4.41 1.35 -1.73 -0.86 112.91 116.69 1c5h h THR 147 Ca 0.35 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 66.04 1c5h h THR 147 Cb 0.75 0.54 -0.04 0.00 -1.73 0.00 0.00 68.15 67.68 1c5h h THR 147 CO -0.11 0.08 0.47 0.78 -0.25 0.00 0.00 175.52 176.50 1c5h h ASN 148 N 0.44 1.03 -0.11 5.36 -0.26 -1.66 -0.46 115.58 119.92 1c5h h ASN 148 Ca 0.17 -0.09 -0.10 0.00 -0.56 0.00 0.00 56.30 55.73 1c5h h ASN 148 Cb 0.14 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.14 1c5h h ASN 148 CO -0.04 0.82 -0.31 0.45 -1.06 0.00 0.00 177.43 177.30 1c5h h HIS 149 N 1.16 0.52 -0.67 1.19 3.86 -1.38 -2.08 115.15 117.75 1c5h h HIS 149 Ca 0.30 -0.20 0.05 0.00 -1.16 0.00 0.00 60.37 59.35 1c5h h HIS 149 Cb 0.01 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.34 1c5h h HIS 149 CO 0.00 0.92 0.39 0.28 0.86 0.00 0.00 177.93 180.38 1c5h h VAL 150 N -0.03 1.00 -0.48 2.45 2.07 -1.03 0.13 116.25 120.37 1c5h h VAL 150 Ca -0.01 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 1c5h h VAL 150 Cb 0.92 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1c5h h VAL 150 CO 0.07 0.13 -0.14 0.78 0.02 0.00 0.00 177.57 178.43 1c5h h ASN 151 N 0.73 0.96 -0.46 0.57 2.35 -1.11 -1.29 115.58 117.33 1c5h h ASN 151 Ca 0.29 -0.37 -0.05 0.00 -0.55 0.00 0.00 56.30 55.62 1c5h h ASN 151 Cb 0.14 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1c5h h ASN 151 CO -0.16 1.11 0.10 0.00 -1.65 0.00 0.00 177.43 176.84 1c5h h ALA 152 N 0.88 0.60 -0.91 -0.83 0.00 -0.87 -2.45 119.26 115.68 1c5h h ALA 152 Ca 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1c5h h ALA 152 Cb 0.71 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1c5h h ALA 152 CO 0.05 0.30 0.55 -1.49 0.00 0.00 0.00 179.25 178.66 1c5h h TRP 153 N 0.61 1.20 -0.81 0.00 6.55 -0.64 -2.48 115.95 120.39 1c5h h TRP 153 Ca 0.14 -0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.99 1c5h h TRP 153 Cb 0.33 -0.39 -0.04 0.00 -0.86 0.00 0.00 29.16 28.20 1c5h h TRP 153 CO 0.02 0.80 0.53 -0.22 -1.05 0.00 0.00 178.44 178.52 1c5h h LYS 154 N 1.26 1.04 0.00 0.49 3.64 -0.96 0.17 116.57 122.21 1c5h h LYS 154 Ca 0.33 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1c5h h LYS 154 Cb -0.05 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.53 1c5h h LYS 154 CO -0.06 0.69 0.00 -1.13 -2.27 0.00 0.00 179.45 176.68 1c5h n SER 155 N -4.54 0.11 -1.29 4.20 3.41 -0.94 -1.54 113.62 113.04 1c5h n SER 155 Ca 0.09 0.53 0.08 0.00 -0.26 0.00 0.00 58.87 59.31 1c5h n SER 155 Cb 0.03 -0.55 0.32 0.00 -0.26 0.00 0.00 64.21 63.75 1c5h n SER 155 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1c5h n HIS 156 N -1.63 1.39 -1.07 7.33 8.25 -0.58 -4.92 115.22 124.00 1c5h n HIS 156 Ca 0.03 -0.82 -0.02 0.00 -0.26 0.00 0.00 57.72 56.65 1c5h n HIS 156 Cb 0.17 -0.39 -0.01 0.00 1.12 0.00 0.00 29.99 30.88 1c5h n HIS 156 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1c5h n GLY 157 N -0.05 0.52 3.38 -1.41 0.00 -0.59 -4.96 105.19 102.08 1c5h n GLY 157 Ca 0.24 -0.24 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1c5h n GLY 157 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1c5h s MET 158 N -1.29 3.80 -0.13 1.61 -1.94 0.50 -4.99 119.30 116.87 1c5h s MET 158 Ca 0.00 -2.48 -0.10 0.00 -1.71 0.00 0.00 55.69 51.40 1c5h s MET 158 Cb 0.00 -4.66 -0.05 0.00 2.01 0.00 0.00 34.83 32.13 1c5h s MET 158 CO 0.00 -1.46 0.20 -0.80 -0.01 0.00 0.00 175.02 172.95 1c5h s ASN 159 N 2.42 6.40 0.68 3.03 -0.87 -1.26 -3.41 114.94 121.93 1c5h s ASN 159 Ca 0.28 0.47 -0.11 0.00 -1.57 0.00 0.00 52.86 51.93 1c5h s ASN 159 Cb -0.08 -2.12 0.01 0.00 -0.02 0.00 0.00 41.25 39.04 1c5h s ASN 159 CO -0.08 0.28 1.06 -0.76 -2.57 0.00 0.00 177.10 175.04 1c5h s LEU 160 N -0.40 2.98 1.08 0.60 1.43 -1.26 -4.95 118.68 118.16 1c5h s LEU 160 Ca 0.14 1.09 -0.15 0.00 -1.03 0.00 0.00 54.13 54.18 1c5h s LEU 160 Cb -0.12 -3.91 0.23 0.00 0.03 0.00 0.00 46.19 42.41 1c5h s LEU 160 CO 0.04 -1.26 1.11 -0.83 0.23 0.00 0.00 176.35 175.64 1c5h s GLY 161 N -4.34 1.58 0.06 -3.19 0.00 -1.26 -4.77 107.32 95.40 1c5h s GLY 161 Ca 0.57 -0.67 0.18 0.00 0.00 0.00 0.00 44.72 44.80 1c5h s GLY 161 CO 0.51 0.06 0.78 -1.14 0.00 0.00 0.00 173.10 173.31 1c5h n SER 162 N -4.37 0.74 -4.45 1.64 3.41 -0.79 -4.74 113.62 105.06 1c5h n SER 162 Ca 0.09 0.32 -0.43 0.00 -0.26 0.00 0.00 58.87 58.59 1c5h n SER 162 Cb 0.59 0.38 -0.09 0.00 -0.26 0.00 0.00 64.21 64.82 1c5h n SER 162 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1c5h s ASN 163 N -5.62 6.15 -0.07 4.04 3.84 -1.01 -4.97 114.94 117.30 1c5h s ASN 163 Ca -0.03 -0.94 -0.24 0.00 0.21 0.00 0.00 52.86 51.85 1c5h s ASN 163 Cb 0.09 -2.19 -0.03 0.00 -0.55 0.00 0.00 41.25 38.56 1c5h s ASN 163 CO 0.82 -0.56 0.74 0.26 -2.79 0.00 0.00 177.10 175.56 1c5h s TRP 164 N 1.86 3.57 0.00 0.43 0.52 -1.26 0.40 118.94 124.46 1c5h s TRP 164 Ca 0.07 1.28 0.00 0.00 0.02 0.00 0.00 56.10 57.48 1c5h s TRP 164 Cb -0.20 -2.85 0.00 0.00 -1.15 0.00 0.00 33.47 29.27 1c5h s TRP 164 CO 0.10 0.04 0.00 0.00 0.02 0.00 0.00 176.95 177.12 1c5h n ALA 165 N 3.95 0.00 -1.07 0.98 0.00 -0.53 -4.46 120.51 119.38 1c5h n ALA 165 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1c5h n ALA 165 Cb 0.51 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.10 1c5h n ALA 165 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1c5h s TYR 166 N 2.16 2.16 -0.15 0.00 -0.85 -1.09 -0.21 117.35 119.37 1c5h s TYR 166 Ca 0.00 1.41 -0.04 0.00 -0.52 0.00 0.00 57.07 57.92 1c5h s TYR 166 Cb 0.00 -3.16 0.07 0.00 0.38 0.00 0.00 41.96 39.25 1c5h s TYR 166 CO 0.00 -2.47 0.19 -1.14 -1.52 0.00 0.00 175.55 170.61 1c5h s GLN 167 N -4.83 0.12 0.05 -3.49 0.74 -0.25 -2.83 119.66 109.16 1c5h s GLN 167 Ca 0.64 0.34 -0.01 0.00 0.05 0.00 0.00 55.36 56.38 1c5h s GLN 167 Cb -0.19 -0.87 -0.04 0.00 1.10 0.00 0.00 33.01 33.01 1c5h s GLN 167 CO 0.58 -0.51 -0.03 0.14 -0.55 0.00 0.00 175.29 174.92 1c5h s VAL 168 N 2.30 0.22 -0.53 1.34 -7.23 0.35 -0.39 120.40 116.46 1c5h s VAL 168 Ca 0.05 -1.70 -0.22 0.00 -1.81 0.00 0.00 61.98 58.30 1c5h s VAL 168 Cb -0.14 -1.37 0.05 0.00 0.56 0.00 0.00 36.38 35.48 1c5h s VAL 168 CO -0.09 -0.93 0.79 -0.32 -0.31 0.00 0.00 175.10 174.24 1c5h s MET 169 N -3.61 3.23 0.41 4.82 1.75 -0.65 0.24 119.30 125.49 1c5h s MET 169 Ca 0.04 -0.57 0.07 0.00 -1.25 0.00 0.00 55.69 53.98 1c5h s MET 169 Cb 0.06 -4.08 -0.07 0.00 2.84 0.00 0.00 34.83 33.58 1c5h s MET 169 CO -0.09 -1.37 0.07 0.00 -0.65 0.00 0.00 175.02 172.98 1c5h s ALA 170 N 3.33 3.33 -0.27 4.11 0.00 0.41 -3.39 121.76 129.29 1c5h s ALA 170 Ca 0.23 -2.19 -0.01 0.00 0.00 0.00 0.00 51.96 49.99 1c5h s ALA 170 Cb -0.16 -0.01 0.04 0.00 0.00 0.00 0.00 23.12 22.99 1c5h s ALA 170 CO 0.16 -0.13 -0.06 0.99 0.00 0.00 0.00 175.76 176.71 1c5h s THR 171 N -2.68 2.75 -0.07 0.00 2.01 0.48 -1.23 115.64 116.91 1c5h s THR 171 Ca 0.36 -1.26 0.03 0.00 0.31 0.00 0.00 61.69 61.14 1c5h s THR 171 Cb 0.08 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 70.08 1c5h s THR 171 CO 0.19 0.07 -0.15 -0.70 -0.69 0.00 0.00 174.62 173.34 1c5h s GLU 172 N 1.26 2.68 0.08 4.92 2.12 -0.42 -1.73 118.70 127.60 1c5h s GLU 172 Ca -0.03 -0.71 0.03 0.00 0.36 0.00 0.00 54.97 54.62 1c5h s GLU 172 Cb -0.18 -2.41 -0.03 0.00 0.26 0.00 0.00 34.13 31.77 1c5h s GLU 172 CO -0.04 0.52 -0.10 0.20 -0.54 0.00 0.00 175.26 175.31 1c5h s GLY 173 N -0.47 0.77 -0.10 -1.50 0.00 -0.94 0.19 107.32 105.27 1c5h s GLY 173 Ca 0.06 -1.11 -0.03 0.00 0.00 0.00 0.00 44.72 43.64 1c5h s GLY 173 CO 0.02 -1.18 0.07 -0.47 0.00 0.00 0.00 173.10 171.54 1c5h s TYR 174 N -2.28 0.15 -1.20 1.90 5.04 -0.94 -2.43 117.35 117.59 1c5h s TYR 174 Ca 0.03 -0.02 -0.33 0.00 -2.44 0.00 0.00 57.07 54.30 1c5h s TYR 174 Cb -0.04 -0.59 0.04 0.00 0.35 0.00 0.00 41.96 41.72 1c5h s TYR 174 CO -0.00 -0.34 0.70 1.04 -1.34 0.00 0.00 175.55 175.61 1c5h n GLN 175 N 5.28 -0.39 -1.89 4.97 6.02 -0.48 -4.43 117.38 126.46 1c5h n GLN 175 Ca -0.05 0.13 -0.02 0.00 -0.01 0.00 0.00 57.00 57.05 1c5h n GLN 175 Cb 0.50 -2.75 -0.00 0.00 1.02 0.00 0.00 30.24 29.00 1c5h n GLN 175 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1c5h n SER 176 N -2.23 -0.30 -4.11 1.08 3.41 -1.26 -4.72 113.62 105.50 1c5h n SER 176 Ca -0.11 -1.34 -0.08 0.00 -0.26 0.00 0.00 58.87 57.08 1c5h n SER 176 Cb 0.57 0.54 -0.10 0.00 -0.26 0.00 0.00 64.21 64.96 1c5h n SER 176 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1c5h s SER 177 N -1.40 0.59 0.00 4.04 0.01 -1.25 -1.45 113.70 114.24 1c5h s SER 177 Ca 0.05 -1.02 0.00 0.00 1.31 0.00 0.00 55.95 56.29 1c5h s SER 177 Cb -0.00 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1c5h s SER 177 CO 0.03 -0.59 0.00 0.61 0.41 0.00 0.00 173.24 173.71 1c5h n GLY 178 N 0.07 -1.52 3.14 3.44 0.00 -0.16 0.14 105.19 110.30 1c5h n GLY 178 Ca -0.13 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.48 1c5h n GLY 178 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c5h s SER 179 N -3.22 -0.02 -0.04 1.61 0.01 -0.83 -1.41 113.70 109.79 1c5h s SER 179 Ca 0.00 -0.14 -0.23 0.00 1.31 0.00 0.00 55.95 56.89 1c5h s SER 179 Cb 0.00 0.23 0.05 0.00 0.21 0.00 0.00 66.02 66.51 1c5h s SER 179 CO 0.00 -0.39 0.50 -0.94 0.41 0.00 0.00 173.24 172.82 1c5h s SER 180 N -1.38 -0.44 -0.11 2.44 1.04 -0.50 -0.82 113.70 113.93 1c5h s SER 180 Ca -0.15 0.45 -0.04 0.00 0.48 0.00 0.00 55.95 56.70 1c5h s SER 180 Cb -0.07 0.47 0.05 0.00 0.10 0.00 0.00 66.02 66.57 1c5h s SER 180 CO 0.02 -0.51 0.08 0.21 0.98 0.00 0.00 173.24 174.02 1c5h s ASN 181 N -1.16 1.82 0.02 7.02 3.84 0.30 -0.79 114.94 125.99 1c5h s ASN 181 Ca -0.12 -0.31 0.03 0.00 0.21 0.00 0.00 52.86 52.68 1c5h s ASN 181 Cb -0.03 -0.20 -0.01 0.00 -0.55 0.00 0.00 41.25 40.46 1c5h s ASN 181 CO 0.07 -0.31 -0.11 -0.69 -2.79 0.00 0.00 177.10 173.28 1c5h s VAL 182 N 2.15 0.82 -0.13 -5.21 1.01 -0.37 -0.55 120.40 118.12 1c5h s VAL 182 Ca 0.03 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1c5h s VAL 182 Cb -0.14 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.50 1c5h s VAL 182 CO -0.06 0.04 -0.21 -0.89 0.00 0.00 0.00 175.10 173.98 1c5h s THR 183 N -0.61 2.14 0.01 3.92 2.01 -0.62 -0.90 115.64 121.60 1c5h s THR 183 Ca 0.01 -0.96 0.08 0.00 0.31 0.00 0.00 61.69 61.12 1c5h s THR 183 Cb -0.06 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.57 1c5h s THR 183 CO 0.00 0.55 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.57 1c5h s VAL 184 N 0.72 2.42 0.00 3.82 1.01 0.98 -1.23 120.40 128.12 1c5h s VAL 184 Ca -0.09 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 60.72 1c5h s VAL 184 Cb -0.16 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1c5h s VAL 184 CO 0.00 0.44 0.00 -2.67 0.00 0.00 0.00 175.10 172.88