#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w2u s ARG 3 N 0.00 0.22 -0.26 0.38 1.81 -1.12 -5.01 118.95 114.97 1w2u s ARG 3 Ca 0.00 -0.09 -0.01 0.00 -1.72 0.00 0.00 55.73 53.91 1w2u s ARG 3 Cb 0.00 -0.21 0.04 0.00 -0.45 0.00 0.00 34.95 34.32 1w2u s ARG 3 CO 0.00 0.05 -0.06 -1.12 -0.68 0.00 0.00 175.30 173.49 1w2u s SER 4 N -0.04 4.39 -0.99 0.23 0.01 -1.26 -1.36 113.70 114.68 1w2u s SER 4 Ca 0.01 -1.03 -0.06 0.00 1.31 0.00 0.00 55.95 56.18 1w2u s SER 4 Cb -0.01 -1.64 0.25 0.00 0.21 0.00 0.00 66.02 64.82 1w2u s SER 4 CO -0.00 -0.16 0.93 -0.76 0.41 0.00 0.00 173.24 173.66 1w2u s LEU 5 N 1.27 5.98 0.00 2.44 1.43 0.86 -4.82 118.68 125.84 1w2u s LEU 5 Ca -0.02 -3.60 0.21 0.00 -1.03 0.00 0.00 54.13 49.68 1w2u s LEU 5 Cb -0.18 -2.06 -0.17 0.00 0.03 0.00 0.00 46.19 43.81 1w2u s LEU 5 CO -0.04 -0.25 0.92 0.00 0.23 0.00 0.00 176.35 177.20 1w2u s GLU 7 N -2.80 3.32 0.06 0.00 0.41 -1.26 -4.81 118.70 113.61 1w2u s GLU 7 Ca 0.10 1.15 -0.31 0.00 -0.41 0.00 0.00 54.97 55.50 1w2u s GLU 7 Cb 0.16 -2.04 -0.10 0.00 -1.78 0.00 0.00 34.13 30.37 1w2u s GLU 7 CO 0.77 -0.80 1.89 -0.11 -0.49 0.00 0.00 175.26 176.51 1w2u n LEU 8 N -2.13 3.94 -2.36 1.80 7.94 -1.26 -1.21 117.00 123.71 1w2u n LEU 8 Ca 0.08 0.96 -0.21 0.00 -1.11 0.00 0.00 56.01 55.73 1w2u n LEU 8 Cb 0.53 -1.50 -0.01 0.00 0.53 0.00 0.00 43.42 42.97 1w2u n LEU 8 CO 0.48 0.12 -0.27 -1.22 -1.11 0.00 0.00 177.39 175.40 1w2u n TYR 9 N 6.42 -0.97 -1.71 1.96 4.01 -0.40 -4.97 117.16 121.49 1w2u n TYR 9 Ca 0.20 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.51 1w2u n TYR 9 Cb 0.37 -3.97 -0.02 0.00 -0.31 0.00 0.00 39.34 35.42 1w2u n TYR 9 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1w2u n GLY 10 N -1.00 0.95 2.92 2.72 0.00 -0.35 -4.71 105.19 105.71 1w2u n GLY 10 Ca -0.25 0.42 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1w2u n GLY 10 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1w2u s TYR 11 N -0.41 0.22 0.05 1.61 5.04 -1.26 -0.84 117.35 121.75 1w2u s TYR 11 Ca 0.62 -0.08 0.03 0.00 -2.44 0.00 0.00 57.07 55.20 1w2u s TYR 11 Cb -0.56 -0.14 -0.02 0.00 0.35 0.00 0.00 41.96 41.58 1w2u s TYR 11 CO 0.54 -0.02 -0.10 -0.46 -1.34 0.00 0.00 175.55 174.18 1w2u s TRP 12 N -0.17 0.82 0.01 4.97 -0.00 -0.66 -5.00 118.94 118.92 1w2u s TRP 12 Ca -0.00 -0.47 -0.07 0.00 -0.00 0.00 0.00 56.10 55.55 1w2u s TRP 12 Cb -0.02 -0.48 -0.00 0.00 -0.00 0.00 0.00 33.47 32.97 1w2u s TRP 12 CO -0.00 -0.04 0.14 -1.54 -0.00 0.00 0.00 176.95 175.51 1w2u s SER 13 N -1.57 0.05 0.00 5.86 1.04 -1.26 -0.82 113.70 117.00 1w2u s SER 13 Ca -0.07 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1w2u s SER 13 Cb -0.10 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1w2u s SER 13 CO 0.01 -0.43 0.00 0.61 0.98 0.00 0.00 173.24 174.41 1w2u n GLY 14 N 1.20 1.94 2.43 7.32 0.00 -0.50 -5.00 105.19 112.57 1w2u n GLY 14 Ca -0.22 -0.50 -0.19 0.00 0.00 0.00 0.00 46.02 45.12 1w2u n GLY 14 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1w2u n ASN 15 N 0.00 -5.28 0.00 1.61 3.02 -1.26 -1.35 115.26 112.00 1w2u n ASN 15 Ca 0.00 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 1w2u n ASN 15 Cb 0.00 -4.54 0.00 0.00 -0.61 0.00 0.00 39.78 34.63 1w2u n ASN 15 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1w2u n GLY 16 N -0.68 0.55 3.55 7.41 0.00 -1.26 -5.04 105.19 109.71 1w2u n GLY 16 Ca -0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 1w2u n GLY 16 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1w2u s TYR 17 N -2.02 2.39 0.06 1.61 2.02 -0.46 -0.99 117.35 119.96 1w2u s TYR 17 Ca 0.00 -0.56 -0.04 0.00 -0.37 0.00 0.00 57.07 56.10 1w2u s TYR 17 Cb 0.00 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 40.09 1w2u s TYR 17 CO 0.00 0.52 0.06 -1.83 -1.57 0.00 0.00 175.55 172.73 1w2u s GLU 18 N -3.65 0.67 -0.02 -0.62 -1.05 -0.17 -1.42 118.70 112.45 1w2u s GLU 18 Ca 0.33 -1.05 0.01 0.00 -0.15 0.00 0.00 54.97 54.11 1w2u s GLU 18 Cb 0.04 0.25 0.01 0.00 -0.44 0.00 0.00 34.13 33.99 1w2u s GLU 18 CO 0.16 -0.16 -0.03 -1.17 0.95 0.00 0.00 175.26 175.01 1w2u s LEU 19 N -2.73 1.66 -0.03 1.83 2.96 -0.00 -0.62 118.68 121.75 1w2u s LEU 19 Ca 0.04 -0.07 -0.00 0.00 -0.22 0.00 0.00 54.13 53.88 1w2u s LEU 19 Cb 0.05 -0.26 0.03 0.00 0.50 0.00 0.00 46.19 46.51 1w2u s LEU 19 CO -0.09 -0.01 0.02 -0.22 -1.32 0.00 0.00 176.35 174.73 1w2u s LEU 20 N 0.38 0.99 -1.32 -0.68 2.96 -0.79 -1.65 118.68 118.58 1w2u s LEU 20 Ca -0.04 0.01 -0.18 0.00 -0.22 0.00 0.00 54.13 53.71 1w2u s LEU 20 Cb -0.07 -0.15 0.05 0.00 0.50 0.00 0.00 46.19 46.52 1w2u s LEU 20 CO -0.01 -0.13 1.84 -3.20 -1.32 0.00 0.00 176.35 173.53 1w2u n ASN 21 N 4.32 4.62 -4.02 3.68 4.05 -0.02 -2.90 115.26 125.00 1w2u n ASN 21 Ca -0.24 -2.89 -0.43 0.00 0.45 0.00 0.00 54.58 51.47 1w2u n ASN 21 Cb 0.50 -1.73 0.00 0.00 1.23 0.00 0.00 39.78 39.79 1w2u n ASN 21 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1w2u n ASN 22 N 8.30 5.21 -3.23 1.20 4.05 -1.26 -1.28 115.26 128.24 1w2u n ASN 22 Ca 0.49 -3.10 -0.37 0.00 0.45 0.00 0.00 54.58 52.06 1w2u n ASN 22 Cb 0.45 -1.48 -0.02 0.00 1.23 0.00 0.00 39.78 39.95 1w2u n ASN 22 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1w2u n LEU 23 N 4.08 7.71 0.26 1.20 4.77 -1.26 -1.33 117.00 132.44 1w2u n LEU 23 Ca 0.38 -4.65 0.13 0.00 -0.03 0.00 0.00 56.01 51.85 1w2u n LEU 23 Cb 0.38 -1.35 0.69 0.00 -2.33 0.00 0.00 43.42 40.80 1w2u n LEU 23 CO 0.76 1.99 0.95 4.11 -1.33 0.00 0.00 177.39 183.87 1w2u h TRP 24 N 4.26 0.00 -0.30 -1.77 5.08 -1.86 -2.67 115.95 118.69 1w2u h TRP 24 Ca 0.64 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.61 1w2u h TRP 24 Cb 0.42 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.58 1w2u h TRP 24 CO 1.60 0.12 0.00 0.41 -1.28 0.00 0.00 178.44 179.29 1w2u n GLY 25 N -0.38 3.54 0.29 11.11 0.00 -0.17 -4.78 105.19 114.82 1w2u n GLY 25 Ca -0.01 -0.79 0.18 0.00 0.00 0.00 0.00 46.02 45.39 1w2u n GLY 25 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1w2u h LYS 26 N 1.94 0.00 0.00 1.61 5.09 -1.09 -2.21 116.57 121.91 1w2u h LYS 26 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1w2u h LYS 26 Cb 1.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.52 1w2u h LYS 26 CO 0.15 0.04 0.00 -0.25 -2.09 0.00 0.00 179.45 177.30 1w2u n ASP 27 N -3.26 0.71 0.00 7.07 8.00 -1.26 -1.63 116.55 126.18 1w2u n ASP 27 Ca -0.01 0.66 0.14 0.00 0.71 0.00 0.00 54.79 56.28 1w2u n ASP 27 Cb 0.21 -0.82 0.57 0.00 -0.02 0.00 0.00 41.12 41.07 1w2u n ASP 27 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1w2u n THR 28 N -2.27 0.01 -2.63 -3.53 -2.24 -0.83 -4.86 114.28 97.93 1w2u n THR 28 Ca 0.02 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.42 1w2u n THR 28 Cb 0.26 -0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 68.02 1w2u n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1w2u s ALA 29 N -3.00 3.22 -0.24 6.98 0.00 -0.65 -4.31 121.76 123.77 1w2u s ALA 29 Ca 0.14 0.67 0.20 0.00 0.00 0.00 0.00 51.96 52.97 1w2u s ALA 29 Cb 0.19 -3.25 0.04 0.00 0.00 0.00 0.00 23.12 20.10 1w2u s ALA 29 CO 0.55 -0.02 1.15 1.79 0.00 0.00 0.00 175.76 179.23 1w2u h THR 30 N 2.63 0.23 -2.92 0.00 1.35 -1.28 -3.48 112.91 109.43 1w2u h THR 30 Ca -0.47 -1.40 -0.00 0.00 -0.55 0.00 0.00 66.41 63.99 1w2u h THR 30 Cb 1.20 1.84 -0.12 0.00 -1.73 0.00 0.00 68.15 69.35 1w2u h THR 30 CO 0.65 0.13 0.24 -0.94 -0.25 0.00 0.00 175.52 175.35 1w2u s SER 31 N -5.77 -0.53 0.00 5.36 1.04 -1.23 -4.99 113.70 107.58 1w2u s SER 31 Ca 0.01 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1w2u s SER 31 Cb 0.08 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.79 1w2u s SER 31 CO 0.77 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1w2u n GLY 32 N -0.37 1.44 3.84 7.32 0.00 -1.26 -1.68 105.19 114.47 1w2u n GLY 32 Ca -0.15 -2.26 -0.07 0.00 0.00 0.00 0.00 46.02 43.54 1w2u n GLY 32 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1w2u s TRP 33 N -1.33 0.12 -0.24 1.61 -0.11 -0.68 -4.98 118.94 113.33 1w2u s TRP 33 Ca 0.00 -0.70 -0.26 0.00 1.22 0.00 0.00 56.10 56.36 1w2u s TRP 33 Cb 0.00 0.79 0.07 0.00 -1.50 0.00 0.00 33.47 32.84 1w2u s TRP 33 CO 0.00 -1.34 0.72 -1.14 -4.62 0.00 0.00 176.95 170.57 1w2u s GLN 34 N -2.15 0.87 0.08 5.86 0.74 -1.26 -1.85 119.66 121.95 1w2u s GLN 34 Ca 0.18 0.88 0.06 0.00 0.05 0.00 0.00 55.36 56.53 1w2u s GLN 34 Cb -0.04 0.42 -0.03 0.00 1.10 0.00 0.00 33.01 34.46 1w2u s GLN 34 CO 0.09 -0.13 -0.17 0.00 -0.55 0.00 0.00 175.29 174.53 1w2u s THR 36 N -1.19 2.22 -0.09 0.00 2.01 -0.80 -1.85 115.64 115.93 1w2u s THR 36 Ca 0.02 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.07 1w2u s THR 36 Cb -0.10 -1.83 -0.00 0.00 0.01 0.00 0.00 72.50 70.58 1w2u s THR 36 CO 0.03 0.56 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.98 1w2u s TYR 37 N -0.01 2.48 -0.40 4.92 2.02 0.59 -0.10 117.35 126.86 1w2u s TYR 37 Ca -0.08 -0.97 -0.24 0.00 -0.37 0.00 0.00 57.07 55.42 1w2u s TYR 37 Cb -0.15 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 1w2u s TYR 37 CO 0.05 -0.38 0.82 -1.17 -1.57 0.00 0.00 175.55 173.30 1w2u s LEU 38 N 0.27 4.13 -0.05 -1.29 2.96 -0.46 -1.40 118.68 122.83 1w2u s LEU 38 Ca -0.16 0.23 0.15 0.00 -0.22 0.00 0.00 54.13 54.13 1w2u s LEU 38 Cb -0.17 -3.05 -0.22 0.00 0.50 0.00 0.00 46.19 43.25 1w2u s LEU 38 CO 0.08 -0.83 0.56 0.47 -1.32 0.00 0.00 176.35 175.30 1w2u n ASP 39 N 6.63 0.63 -3.60 3.68 8.00 0.23 -0.33 116.55 131.79 1w2u n ASP 39 Ca 0.04 0.29 -0.04 0.00 0.71 0.00 0.00 54.79 55.79 1w2u n ASP 39 Cb 0.48 0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 41.89 1w2u n ASP 39 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1w2u s GLY 40 N -5.10 -0.30 -0.37 0.44 0.00 -0.63 -4.42 107.32 96.95 1w2u s GLY 40 Ca -0.06 1.52 0.12 0.00 0.00 0.00 0.00 44.72 46.31 1w2u s GLY 40 CO 0.83 0.50 1.05 -1.30 0.00 0.00 0.00 173.10 174.17 1w2u n THR 41 N -0.13 1.71 -3.12 0.90 -2.24 -1.26 -1.11 114.28 109.03 1w2u n THR 41 Ca -0.00 -3.94 -0.34 0.00 -2.27 0.00 0.00 64.05 57.50 1w2u n THR 41 Cb 0.59 -0.25 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 1w2u n THR 41 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1w2u s ASN 42 N -3.38 6.91 -1.46 3.42 0.01 -1.22 -4.47 114.94 114.75 1w2u s ASN 42 Ca 0.38 1.34 -0.11 0.00 -0.71 0.00 0.00 52.86 53.76 1w2u s ASN 42 Cb 0.42 -2.39 0.05 0.00 0.41 0.00 0.00 41.25 39.74 1w2u s ASN 42 CO -0.07 -0.09 0.96 0.59 -1.51 0.00 0.00 177.10 176.98 1w2u n ASN 43 N 0.15 -5.43 0.00 -1.22 4.13 -1.26 -1.71 115.26 109.91 1w2u n ASN 43 Ca 0.01 -0.61 0.00 0.00 1.68 0.00 0.00 54.58 55.66 1w2u n ASN 43 Cb 0.52 -4.33 0.00 0.00 -1.54 0.00 0.00 39.78 34.43 1w2u n ASN 43 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1w2u n GLY 44 N -1.73 0.47 1.19 7.41 0.00 -1.26 -5.00 105.19 106.26 1w2u n GLY 44 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1w2u n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w2u n GLY 45 N -1.93 3.90 3.15 -0.02 0.00 -0.70 -4.77 105.19 104.81 1w2u n GLY 45 Ca 0.00 -2.12 -0.26 0.00 0.00 0.00 0.00 46.02 43.63 1w2u n GLY 45 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1w2u s ILE 46 N -1.84 1.48 -0.13 -0.61 -1.09 -0.06 -3.39 121.20 115.55 1w2u s ILE 46 Ca 0.04 -0.75 -0.00 0.00 -2.23 0.00 0.00 60.65 57.71 1w2u s ILE 46 Cb 0.00 -1.27 -0.01 0.00 -1.58 0.00 0.00 42.46 39.60 1w2u s ILE 46 CO 0.03 0.42 -0.13 -1.10 -1.23 0.00 0.00 174.94 172.93 1w2u s GLN 47 N 0.01 3.38 0.27 2.79 1.11 -0.26 -1.00 119.66 125.96 1w2u s GLN 47 Ca -0.04 -0.69 -0.19 0.00 0.01 0.00 0.00 55.36 54.46 1w2u s GLN 47 Cb -0.12 -2.63 0.02 0.00 -1.01 0.00 0.00 33.01 29.27 1w2u s GLN 47 CO 0.02 0.21 0.67 1.67 0.01 0.00 0.00 175.29 177.87 1w2u s TRP 48 N 0.37 -0.06 0.16 0.91 1.48 -0.80 -0.60 118.94 120.40 1w2u s TRP 48 Ca -0.11 -0.38 -0.14 0.00 -1.06 0.00 0.00 56.10 54.41 1w2u s TRP 48 Cb -0.16 0.60 0.02 0.00 -1.16 0.00 0.00 33.47 32.76 1w2u s TRP 48 CO 0.06 -1.19 0.40 -1.12 -4.06 0.00 0.00 176.95 171.04 1w2u s SER 49 N -2.95 -0.14 -0.10 -2.66 0.01 -0.50 0.01 113.70 107.37 1w2u s SER 49 Ca 0.14 -0.55 -0.07 0.00 1.31 0.00 0.00 55.95 56.78 1w2u s SER 49 Cb -0.05 0.49 0.04 0.00 0.21 0.00 0.00 66.02 66.71 1w2u s SER 49 CO 0.08 -0.93 0.26 0.28 0.41 0.00 0.00 173.24 173.33 1w2u s THR 50 N -3.88 -0.02 -0.02 1.44 -1.32 0.01 -0.30 115.64 111.54 1w2u s THR 50 Ca 0.09 0.09 0.04 0.00 -1.21 0.00 0.00 61.69 60.70 1w2u s THR 50 Cb 0.01 -0.38 -0.03 0.00 -1.51 0.00 0.00 72.50 70.59 1w2u s THR 50 CO -0.05 0.04 -0.13 0.00 -2.21 0.00 0.00 174.62 172.26 1w2u s ALA 51 N 0.82 2.75 0.11 11.08 0.00 -0.77 -1.01 121.76 134.74 1w2u s ALA 51 Ca -0.06 -1.02 -0.25 0.00 0.00 0.00 0.00 51.96 50.63 1w2u s ALA 51 Cb -0.07 -0.98 0.07 0.00 0.00 0.00 0.00 23.12 22.15 1w2u s ALA 51 CO -0.05 0.57 0.65 1.67 0.00 0.00 0.00 175.76 178.60 1w2u s TRP 52 N -0.83 -0.53 -0.12 0.00 1.48 -0.50 -1.56 118.94 116.88 1w2u s TRP 52 Ca 0.13 0.40 -0.07 0.00 -1.06 0.00 0.00 56.10 55.51 1w2u s TRP 52 Cb -0.11 0.54 0.04 0.00 -1.16 0.00 0.00 33.47 32.79 1w2u s TRP 52 CO 0.03 -0.78 0.29 -1.83 -4.06 0.00 0.00 176.95 170.60 1w2u s GLU 53 N -3.36 0.27 0.01 3.25 -1.05 -0.77 -1.02 118.70 116.03 1w2u s GLU 53 Ca 0.00 0.54 0.01 0.00 -0.15 0.00 0.00 54.97 55.37 1w2u s GLU 53 Cb -0.01 -0.03 -0.01 0.00 -0.44 0.00 0.00 34.13 33.65 1w2u s GLU 53 CO -0.10 -0.13 -0.02 -1.58 0.95 0.00 0.00 175.26 174.38 1w2u s TRP 54 N 0.98 0.21 0.15 4.83 0.52 -0.52 -1.69 118.94 123.43 1w2u s TRP 54 Ca -0.07 -0.17 0.07 0.00 0.02 0.00 0.00 56.10 55.95 1w2u s TRP 54 Cb -0.08 -0.14 -0.04 0.00 -1.15 0.00 0.00 33.47 32.06 1w2u s TRP 54 CO -0.07 -0.05 -0.16 -0.65 0.02 0.00 0.00 176.95 176.04 1w2u s GLN 55 N -0.47 1.18 0.00 4.98 -0.21 -0.68 -1.02 119.66 123.45 1w2u s GLN 55 Ca -0.04 -1.38 0.00 0.00 0.02 0.00 0.00 55.36 53.97 1w2u s GLN 55 Cb -0.03 -1.12 0.00 0.00 1.00 0.00 0.00 33.01 32.86 1w2u s GLN 55 CO -0.00 0.21 0.00 0.41 -2.12 0.00 0.00 175.29 173.79 1w2u n GLY 56 N 0.26 1.10 3.45 3.09 0.00 -1.26 -0.85 105.19 110.98 1w2u n GLY 56 Ca -0.13 -1.62 -0.15 0.00 0.00 0.00 0.00 46.02 44.12 1w2u n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w2u n ALA 57 N 1.27 -2.62 0.29 4.61 0.00 -1.26 -4.74 120.51 118.06 1w2u n ALA 57 Ca 0.00 -0.14 0.12 0.00 0.00 0.00 0.00 53.44 53.42 1w2u n ALA 57 Cb 0.00 -1.83 0.56 0.00 0.00 0.00 0.00 19.45 18.18 1w2u n ALA 57 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1w2u h PRO 58 N -0.30 0.00 -0.02 0.00 0.13 -1.95 -1.06 132.00 128.80 1w2u h PRO 58 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1w2u h PRO 58 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1w2u h PRO 58 CO 0.36 0.00 -0.16 -0.25 -0.23 0.00 0.00 178.00 177.73 1w2u n ASP 59 N -2.31 1.87 -4.63 1.44 8.00 -1.26 -4.80 116.55 114.87 1w2u n ASP 59 Ca 0.00 -1.49 -0.37 0.00 0.71 0.00 0.00 54.79 53.65 1w2u n ASP 59 Cb 0.15 0.13 -0.10 0.00 -0.02 0.00 0.00 41.12 41.27 1w2u n ASP 59 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1w2u s ASN 60 N -2.21 5.98 0.16 -2.24 -0.87 -0.40 -5.07 114.94 110.29 1w2u s ASN 60 Ca 0.28 0.06 -0.31 0.00 -1.57 0.00 0.00 52.86 51.32 1w2u s ASN 60 Cb 0.20 -2.08 -0.10 0.00 -0.02 0.00 0.00 41.25 39.25 1w2u s ASN 60 CO 0.42 0.04 1.54 -0.69 -2.57 0.00 0.00 177.10 175.84 1w2u s VAL 61 N 1.19 2.71 -0.04 1.60 1.01 -1.26 -4.60 120.40 121.01 1w2u s VAL 61 Ca 0.07 0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.64 1w2u s VAL 61 Cb -0.14 -3.33 -0.24 0.00 0.00 0.00 0.00 36.38 32.68 1w2u s VAL 61 CO 0.05 0.04 0.69 0.11 0.00 0.00 0.00 175.10 175.99 1w2u h LYS 62 N 6.74 0.05 -3.02 2.72 1.79 -1.13 -3.36 116.57 120.37 1w2u h LYS 62 Ca -0.43 -0.09 -0.03 0.00 -2.18 0.00 0.00 60.65 57.93 1w2u h LYS 62 Cb 1.21 0.03 -0.12 0.00 -1.58 0.00 0.00 32.23 31.76 1w2u h LYS 62 CO 0.90 0.67 0.17 -1.54 -1.08 0.00 0.00 179.45 178.57 1w2u s SER 63 N -6.33 -0.52 -0.41 0.86 1.04 -1.18 -1.00 113.70 106.16 1w2u s SER 63 Ca -0.07 -0.02 0.07 0.00 0.48 0.00 0.00 55.95 56.41 1w2u s SER 63 Cb 0.08 0.58 0.24 0.00 0.10 0.00 0.00 66.02 67.01 1w2u s SER 63 CO 0.82 -0.94 0.57 0.00 0.98 0.00 0.00 173.24 174.67 1w2u n TYR 64 N -0.30 -1.07 -1.77 5.02 9.36 -0.44 -1.46 117.16 126.49 1w2u n TYR 64 Ca -0.17 -3.14 -0.41 0.00 3.32 0.00 0.00 57.90 57.49 1w2u n TYR 64 Cb 0.64 0.12 -0.00 0.00 -0.63 0.00 0.00 39.34 39.47 1w2u n TYR 64 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1w2u n PRO 65 N 1.69 2.70 -3.88 2.98 -0.02 -1.24 -4.47 135.00 132.75 1w2u n PRO 65 Ca 0.20 0.95 -0.09 0.00 -2.02 0.00 0.00 63.50 62.54 1w2u n PRO 65 Cb 0.54 -2.70 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 1w2u n PRO 65 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1w2u s TYR 66 N -0.84 0.17 -0.14 6.00 -0.85 -1.14 -2.52 117.35 118.03 1w2u s TYR 66 Ca 0.56 -0.55 -0.05 0.00 -0.52 0.00 0.00 57.07 56.50 1w2u s TYR 66 Cb -0.48 -0.09 -0.04 0.00 0.38 0.00 0.00 41.96 41.73 1w2u s TYR 66 CO 0.60 -0.49 0.06 0.54 -1.52 0.00 0.00 175.55 174.74 1w2u s VAL 67 N -3.46 4.79 0.05 -3.49 0.11 -0.44 -1.88 120.40 116.08 1w2u s VAL 67 Ca 0.02 -0.05 0.08 0.00 -2.93 0.00 0.00 61.98 59.10 1w2u s VAL 67 Cb 0.03 -3.09 -0.03 0.00 -1.53 0.00 0.00 36.38 31.76 1w2u s VAL 67 CO -0.09 0.54 -0.23 -0.83 -3.33 0.00 0.00 175.10 171.17 1w2u s GLY 68 N -0.36 1.23 -0.23 6.54 0.00 0.21 -1.38 107.32 113.34 1w2u s GLY 68 Ca 0.09 -1.15 -0.25 0.00 0.00 0.00 0.00 44.72 43.41 1w2u s GLY 68 CO 0.02 -1.08 0.84 1.25 0.00 0.00 0.00 173.10 174.13 1w2u s LYS 69 N -1.31 4.21 0.30 2.90 2.47 -0.17 -1.00 119.74 127.14 1w2u s LYS 69 Ca 0.09 0.98 -0.29 0.00 -1.56 0.00 0.00 55.97 55.18 1w2u s LYS 69 Cb -0.09 -3.63 -0.10 0.00 -1.46 0.00 0.00 37.83 32.55 1w2u s LYS 69 CO 0.02 -0.48 1.31 -0.65 0.16 0.00 0.00 175.35 175.71 1w2u s GLN 70 N 2.71 4.37 0.06 4.03 -0.21 -0.16 -4.46 119.66 126.01 1w2u s GLN 70 Ca 0.36 2.17 0.02 0.00 0.02 0.00 0.00 55.36 57.93 1w2u s GLN 70 Cb -0.15 -3.10 -0.03 0.00 1.00 0.00 0.00 33.01 30.72 1w2u s GLN 70 CO 0.08 -0.20 -0.07 0.96 -2.12 0.00 0.00 175.29 173.94 1w2u s ILE 71 N -0.80 0.57 0.13 1.08 -5.25 -1.26 -4.95 121.20 110.72 1w2u s ILE 71 Ca 0.51 -1.44 -0.24 0.00 -0.99 0.00 0.00 60.65 58.48 1w2u s ILE 71 Cb -0.39 -1.06 -0.07 0.00 2.95 0.00 0.00 42.46 43.89 1w2u s ILE 71 CO 0.48 -0.61 0.75 -1.58 -1.79 0.00 0.00 174.94 172.20 1w2u s GLN 72 N -2.56 4.51 0.66 0.37 0.74 -1.26 -5.05 119.66 117.07 1w2u s GLN 72 Ca -0.01 1.09 -0.15 0.00 0.05 0.00 0.00 55.36 56.34 1w2u s GLN 72 Cb -0.03 -3.28 -0.00 0.00 1.10 0.00 0.00 33.01 30.79 1w2u s GLN 72 CO -0.02 0.52 1.10 1.03 -0.55 0.00 0.00 175.29 177.37 1w2u s ARG 73 N -0.90 2.84 0.00 1.67 0.52 -1.26 -4.19 118.95 117.62 1w2u s ARG 73 Ca 0.35 1.35 0.00 0.00 -0.52 0.00 0.00 55.73 56.91 1w2u s ARG 73 Cb -0.22 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.29 1w2u s ARG 73 CO 0.25 -1.21 0.00 0.41 0.02 0.00 0.00 175.30 174.77 1w2u n GLY 74 N -0.65 0.74 3.50 -3.53 0.00 -1.26 -5.05 105.19 98.94 1w2u n GLY 74 Ca 0.10 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1w2u n GLY 74 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w2u s ARG 75 N -0.77 3.21 0.38 1.61 0.52 -1.26 -5.00 118.95 117.64 1w2u s ARG 75 Ca 0.00 -0.63 -0.27 0.00 -0.52 0.00 0.00 55.73 54.31 1w2u s ARG 75 Cb 0.00 -3.94 -0.09 0.00 0.52 0.00 0.00 34.95 31.44 1w2u s ARG 75 CO 0.00 -0.83 1.29 0.15 0.02 0.00 0.00 175.30 175.93 1w2u s LYS 76 N 2.24 4.13 0.36 3.54 -0.14 -1.26 -1.26 119.74 127.36 1w2u s LYS 76 Ca 0.14 2.14 0.03 0.00 -1.36 0.00 0.00 55.97 56.92 1w2u s LYS 76 Cb -0.16 -2.87 0.68 0.00 -1.68 0.00 0.00 37.83 33.79 1w2u s LYS 76 CO 0.14 -0.35 2.01 0.82 -0.76 0.00 0.00 175.35 177.22 1w2u h ILE 77 N 2.67 1.14 0.00 2.17 1.08 -0.80 0.21 117.51 123.99 1w2u h ILE 77 Ca -0.49 -0.28 -0.02 0.00 -0.39 0.00 0.00 64.86 63.68 1w2u h ILE 77 Cb 1.24 0.27 -0.00 0.00 -3.07 0.00 0.00 36.82 35.25 1w2u h ILE 77 CO 0.64 0.15 -0.09 0.77 -0.69 0.00 0.00 178.15 178.92 1w2u h SER 78 N 0.80 0.00 -0.27 1.72 4.64 -1.69 -2.26 113.55 116.50 1w2u h SER 78 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1w2u h SER 78 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1w2u h SER 78 CO -0.05 0.09 0.00 0.47 -0.87 0.00 0.00 176.83 176.47 1w2u n ASP 79 N -3.61 2.71 -4.56 4.97 8.00 0.04 -4.79 116.55 119.31 1w2u n ASP 79 Ca -0.02 -1.88 -0.39 0.00 0.71 0.00 0.00 54.79 53.21 1w2u n ASP 79 Cb 0.21 -0.17 -0.11 0.00 -0.02 0.00 0.00 41.12 41.03 1w2u n ASP 79 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1w2u s ILE 80 N -1.66 5.26 0.10 0.53 1.01 -0.85 -4.92 121.20 120.67 1w2u s ILE 80 Ca 0.35 0.01 -0.07 0.00 0.00 0.00 0.00 60.65 60.94 1w2u s ILE 80 Cb 0.20 -3.58 -0.23 0.00 0.01 0.00 0.00 42.46 38.86 1w2u s ILE 80 CO 0.29 0.16 1.22 -1.13 0.00 0.00 0.00 174.94 175.48 1w2u h ASN 81 N 8.41 0.62 -4.22 3.58 -0.73 -1.85 -3.48 115.58 117.92 1w2u h ASN 81 Ca -0.34 -0.54 -0.11 0.00 1.87 0.00 0.00 56.30 57.18 1w2u h ASN 81 Cb 1.18 -0.19 -0.22 0.00 0.27 0.00 0.00 38.32 39.35 1w2u h ASN 81 CO 0.58 1.36 -0.17 -0.94 -0.37 0.00 0.00 177.43 177.89 1w2u s SER 82 N -7.19 -0.43 -0.50 1.15 1.04 -1.26 -4.88 113.70 101.63 1w2u s SER 82 Ca -0.07 0.73 0.06 0.00 0.48 0.00 0.00 55.95 57.15 1w2u s SER 82 Cb 0.08 0.77 0.21 0.00 0.10 0.00 0.00 66.02 67.17 1w2u s SER 82 CO 0.89 -0.26 0.49 0.23 0.98 0.00 0.00 173.24 175.58 1w2u n MET 83 N 2.35 1.05 -2.95 4.02 2.81 -1.26 -1.52 117.12 121.62 1w2u n MET 83 Ca -0.15 -3.68 -0.40 0.00 -1.81 0.00 0.00 57.70 51.65 1w2u n MET 83 Cb 0.57 -1.74 -0.04 0.00 -0.71 0.00 0.00 33.22 31.30 1w2u n MET 83 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1w2u s ARG 84 N -1.04 4.45 -0.00 0.03 0.52 -1.10 -0.99 118.95 120.82 1w2u s ARG 84 Ca 0.33 1.01 -0.13 0.00 -0.52 0.00 0.00 55.73 56.43 1w2u s ARG 84 Cb 0.08 -3.47 0.02 0.00 0.52 0.00 0.00 34.95 32.11 1w2u s ARG 84 CO -0.13 -0.01 0.27 -0.08 0.02 0.00 0.00 175.30 175.36 1w2u s THR 85 N 1.02 0.07 0.03 0.02 -1.32 -0.35 -1.07 115.64 114.03 1w2u s THR 85 Ca 0.41 -0.56 0.00 0.00 -1.21 0.00 0.00 61.69 60.33 1w2u s THR 85 Cb -0.18 -0.62 -0.02 0.00 -1.51 0.00 0.00 72.50 70.16 1w2u s THR 85 CO 0.20 -0.31 -0.04 -0.94 -2.21 0.00 0.00 174.62 171.32 1w2u s SER 86 N -1.44 0.36 -0.08 8.08 1.04 -0.61 -1.39 113.70 119.65 1w2u s SER 86 Ca -0.13 -0.61 -0.09 0.00 0.48 0.00 0.00 55.95 55.60 1w2u s SER 86 Cb -0.05 0.11 0.02 0.00 0.10 0.00 0.00 66.02 66.20 1w2u s SER 86 CO 0.03 -0.35 0.25 0.54 0.98 0.00 0.00 173.24 174.69 1w2u s VAL 87 N -1.95 0.01 -0.09 5.02 0.11 0.05 -1.51 120.40 122.05 1w2u s VAL 87 Ca -0.11 -0.10 0.01 0.00 -2.93 0.00 0.00 61.98 58.86 1w2u s VAL 87 Cb -0.06 -0.39 0.02 0.00 -1.53 0.00 0.00 36.38 34.41 1w2u s VAL 87 CO -0.03 -0.05 -0.12 -0.55 -3.33 0.00 0.00 175.10 171.03 1w2u s SER 88 N -0.11 2.05 0.15 3.54 0.15 -0.30 -1.26 113.70 117.92 1w2u s SER 88 Ca -0.02 -0.33 -0.11 0.00 0.70 0.00 0.00 55.95 56.19 1w2u s SER 88 Cb -0.03 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.39 1w2u s SER 88 CO 0.01 -0.02 0.30 -1.66 1.20 0.00 0.00 173.24 173.08 1w2u s TRP 89 N 1.05 0.23 0.03 3.44 1.48 -0.03 -0.29 118.94 124.86 1w2u s TRP 89 Ca -0.07 -0.60 -0.00 0.00 -1.06 0.00 0.00 56.10 54.37 1w2u s TRP 89 Cb -0.15 0.03 -0.03 0.00 -1.16 0.00 0.00 33.47 32.16 1w2u s TRP 89 CO -0.01 -0.71 -0.03 0.95 -4.06 0.00 0.00 176.95 173.09 1w2u s THR 90 N -3.92 0.20 -0.02 0.66 -4.23 0.16 -4.72 115.64 103.77 1w2u s THR 90 Ca 0.12 -1.26 0.04 0.00 -1.18 0.00 0.00 61.69 59.41 1w2u s THR 90 Cb 0.03 -0.76 -0.03 0.00 1.34 0.00 0.00 72.50 73.08 1w2u s THR 90 CO -0.04 -0.67 -0.13 -0.31 -0.54 0.00 0.00 174.62 172.93 1w2u s TYR 91 N -2.36 2.72 -0.93 3.99 2.02 -1.26 -0.73 117.35 120.79 1w2u s TYR 91 Ca -0.07 -0.15 0.26 0.00 -0.37 0.00 0.00 57.07 56.75 1w2u s TYR 91 Cb -0.03 -1.59 1.07 0.00 -0.40 0.00 0.00 41.96 41.01 1w2u s TYR 91 CO -0.04 0.24 1.83 -0.40 -1.57 0.00 0.00 175.55 175.62 1w2u n ASP 92 N 1.99 0.17 -3.51 2.29 5.75 -0.81 -4.83 116.55 117.60 1w2u n ASP 92 Ca -0.17 0.52 -0.13 0.00 -0.01 0.00 0.00 54.79 55.01 1w2u n ASP 92 Cb 0.52 -0.56 -0.04 0.00 -1.03 0.00 0.00 41.12 40.01 1w2u n ASP 92 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w2u s ARG 93 N -3.03 1.16 0.00 0.11 1.70 -1.26 -5.01 118.95 112.62 1w2u s ARG 93 Ca 0.12 -0.41 0.00 0.00 -0.47 0.00 0.00 55.73 54.97 1w2u s ARG 93 Cb 0.16 0.53 0.00 0.00 -0.57 0.00 0.00 34.95 35.07 1w2u s ARG 93 CO 0.50 -0.47 0.57 0.25 -1.08 0.00 0.00 175.30 175.07 1w2u n THR 94 N -0.06 0.20 -1.67 4.99 -2.24 -1.26 -4.80 114.28 109.44 1w2u n THR 94 Ca -0.17 -0.56 -0.40 0.00 -2.27 0.00 0.00 64.05 60.65 1w2u n THR 94 Cb 0.63 0.97 -0.02 0.00 -2.10 0.00 0.00 70.33 69.81 1w2u n THR 94 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1w2u n ASP 95 N -0.10 8.10 -3.91 3.42 5.75 -1.26 -4.30 116.55 124.25 1w2u n ASP 95 Ca 0.00 -2.85 -0.09 0.00 -0.01 0.00 0.00 54.79 51.84 1w2u n ASP 95 Cb 0.08 -1.48 -0.08 0.00 -1.03 0.00 0.00 41.12 38.61 1w2u n ASP 95 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1w2u s ILE 96 N 0.71 0.15 -0.49 2.12 -4.36 -1.26 -4.69 121.20 113.38 1w2u s ILE 96 Ca 0.61 -1.24 -0.16 0.00 -0.26 0.00 0.00 60.65 59.60 1w2u s ILE 96 Cb 0.18 -1.22 0.08 0.00 1.25 0.00 0.00 42.46 42.75 1w2u s ILE 96 CO -0.07 -0.68 0.45 -0.13 0.24 0.00 0.00 174.94 174.74 1w2u s ARG 97 N -3.44 3.00 -0.01 0.37 0.52 -0.37 -1.97 118.95 117.04 1w2u s ARG 97 Ca 0.02 -1.39 -0.29 0.00 -0.52 0.00 0.00 55.73 53.55 1w2u s ARG 97 Cb 0.03 -4.17 0.10 0.00 0.52 0.00 0.00 34.95 31.44 1w2u s ARG 97 CO -0.09 -1.12 0.89 0.00 0.02 0.00 0.00 175.30 175.01 1w2u s ALA 98 N 1.74 -1.83 0.43 2.13 0.00 -1.12 -0.95 121.76 122.16 1w2u s ALA 98 Ca 0.05 1.04 0.03 0.00 0.00 0.00 0.00 51.96 53.08 1w2u s ALA 98 Cb -0.25 0.38 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 1w2u s ALA 98 CO 0.06 -0.68 0.08 0.54 0.00 0.00 0.00 175.76 175.76 1w2u s ASN 99 N -2.44 3.18 -0.04 0.00 2.20 -0.51 -0.95 114.94 116.37 1w2u s ASN 99 Ca 0.05 -1.62 0.06 0.00 -0.94 0.00 0.00 52.86 50.41 1w2u s ASN 99 Cb -0.01 0.40 -0.01 0.00 -2.00 0.00 0.00 41.25 39.63 1w2u s ASN 99 CO -0.09 -0.85 -0.22 -0.69 -2.94 0.00 0.00 177.10 172.32 1w2u s VAL 100 N -3.10 1.77 -0.19 3.54 1.01 -1.20 -3.17 120.40 119.06 1w2u s VAL 100 Ca 0.21 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 1w2u s VAL 100 Cb 0.03 -1.50 0.07 0.00 0.00 0.00 0.00 36.38 34.99 1w2u s VAL 100 CO 0.11 0.50 0.71 0.00 0.00 0.00 0.00 175.10 176.42 1w2u s ALA 101 N -0.17 -1.78 0.35 5.51 0.00 -0.18 -0.19 121.76 125.31 1w2u s ALA 101 Ca -0.01 1.77 -0.26 0.00 0.00 0.00 0.00 51.96 53.46 1w2u s ALA 101 Cb -0.12 -0.75 -0.09 0.00 0.00 0.00 0.00 23.12 22.16 1w2u s ALA 101 CO 0.02 -0.35 1.10 0.71 0.00 0.00 0.00 175.76 177.24 1w2u s TYR 102 N -0.19 3.35 -0.06 0.00 1.51 0.06 -1.41 117.35 120.61 1w2u s TYR 102 Ca -0.04 1.65 0.01 0.00 -1.01 0.00 0.00 57.07 57.68 1w2u s TYR 102 Cb -0.03 -3.25 0.02 0.00 -0.11 0.00 0.00 41.96 38.59 1w2u s TYR 102 CO 0.04 -0.75 -0.06 0.34 -1.11 0.00 0.00 175.55 174.02 1w2u s ASP 103 N -1.20 1.29 -0.05 2.29 2.15 -0.06 -1.94 116.67 119.16 1w2u s ASP 103 Ca 0.52 -0.18 0.01 0.00 0.43 0.00 0.00 52.55 53.33 1w2u s ASP 103 Cb -0.28 -0.57 0.02 0.00 -0.30 0.00 0.00 42.92 41.80 1w2u s ASP 103 CO 0.35 -0.05 -0.05 -0.69 -0.17 0.00 0.00 175.17 174.57 1w2u s VAL 104 N 1.01 0.57 0.01 1.11 1.01 -0.22 -1.32 120.40 122.56 1w2u s VAL 104 Ca -0.09 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 61.80 1w2u s VAL 104 Cb -0.14 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 1w2u s VAL 104 CO -0.00 0.24 -0.07 -0.36 0.00 0.00 0.00 175.10 174.91 1w2u s PHE 105 N 1.05 2.89 0.11 5.22 0.08 -1.14 -0.79 117.98 125.40 1w2u s PHE 105 Ca -0.09 -0.04 0.04 0.00 0.12 0.00 0.00 56.93 56.96 1w2u s PHE 105 Cb -0.14 -1.60 -0.04 0.00 -0.57 0.00 0.00 43.02 40.67 1w2u s PHE 105 CO -0.01 0.38 -0.10 0.95 -0.10 0.00 0.00 175.22 176.34 1w2u s THR 106 N -1.00 1.01 -0.06 0.64 -4.23 -0.59 -0.89 115.64 110.51 1w2u s THR 106 Ca 0.17 -1.80 -0.21 0.00 -1.18 0.00 0.00 61.69 58.67 1w2u s THR 106 Cb -0.11 -1.55 0.05 0.00 1.34 0.00 0.00 72.50 72.23 1w2u s THR 106 CO 0.08 -0.64 0.49 0.00 -0.54 0.00 0.00 174.62 174.01 1w2u s ALA 107 N -2.81 -1.24 0.30 3.99 0.00 -0.49 -0.43 121.76 121.07 1w2u s ALA 107 Ca 0.10 0.92 0.03 0.00 0.00 0.00 0.00 51.96 53.01 1w2u s ALA 107 Cb -0.01 -0.14 0.46 0.00 0.00 0.00 0.00 23.12 23.44 1w2u s ALA 107 CO -0.00 -0.30 1.75 -0.09 0.00 0.00 0.00 175.76 177.13 1w2u h ARG 108 N 3.84 0.46 -6.47 0.00 2.43 -1.87 0.57 114.38 113.33 1w2u h ARG 108 Ca -0.28 -0.16 -0.57 0.00 -0.81 0.00 0.00 59.98 58.15 1w2u h ARG 108 Cb 1.16 -0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.60 1w2u h ARG 108 CO 0.35 0.65 0.81 0.34 -1.51 0.00 0.00 179.97 180.61 1w2u s ASP 109 N -6.81 6.65 0.43 -3.80 -1.08 -1.26 -4.72 116.67 106.08 1w2u s ASP 109 Ca -0.07 0.48 0.30 0.00 -0.52 0.00 0.00 52.55 52.75 1w2u s ASP 109 Cb 0.14 -2.52 1.42 0.00 -1.46 0.00 0.00 42.92 40.51 1w2u s ASP 109 CO 0.78 -1.12 1.91 1.55 0.52 0.00 0.00 175.17 178.81 1w2u h PRO 110 N 8.96 0.00 -0.64 4.34 0.13 -1.94 -1.74 132.00 141.10 1w2u h PRO 110 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1w2u h PRO 110 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1w2u h PRO 110 CO 1.08 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.60 1w2u n ASP 111 N -2.64 4.65 -4.66 1.44 8.00 -1.26 -4.43 116.55 117.64 1w2u n ASP 111 Ca -0.00 -2.50 -0.45 0.00 0.71 0.00 0.00 54.79 52.54 1w2u n ASP 111 Cb 0.18 -0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 40.66 1w2u n ASP 111 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 1w2u n HIS 112 N 0.95 2.10 -0.96 1.24 -0.00 -0.66 -4.94 115.22 112.95 1w2u n HIS 112 Ca 0.24 0.45 -0.33 0.00 0.46 0.00 0.00 57.72 58.54 1w2u n HIS 112 Cb 0.90 -2.45 0.13 0.00 -0.12 0.00 0.00 29.99 28.45 1w2u n HIS 112 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1w2u n PRO 113 N 2.05 -0.05 0.00 1.57 -0.02 -1.26 -4.90 135.00 132.38 1w2u n PRO 113 Ca 0.12 0.05 0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1w2u n PRO 113 Cb 0.31 -2.25 0.66 0.00 -0.02 0.00 0.00 33.50 32.20 1w2u n PRO 113 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1w2u n ASN 114 N -2.82 0.00 0.00 2.55 6.94 -1.26 -3.16 115.26 117.50 1w2u n ASN 114 Ca 0.12 -0.26 0.12 0.00 -0.02 0.00 0.00 54.58 54.54 1w2u n ASN 114 Cb 0.51 -0.21 0.58 0.00 -2.36 0.00 0.00 39.78 38.30 1w2u n ASN 114 CO 0.00 0.00 0.00 -2.67 -1.03 0.00 0.00 177.26 173.56 1w2u n TRP 115 N -1.21 0.00 -3.06 -2.53 4.27 -1.26 -4.90 117.44 108.75 1w2u n TRP 115 Ca 0.14 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.75 1w2u n TRP 115 Cb 0.17 -0.35 0.00 0.00 -1.36 0.00 0.00 31.31 29.77 1w2u n TRP 115 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1w2u n GLY 116 N 0.81 0.85 0.00 -1.67 0.00 -1.19 -5.16 105.19 98.83 1w2u n GLY 116 Ca 0.10 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1w2u n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w2u n GLY 117 N 0.00 0.60 0.19 -0.02 0.00 -1.26 -4.75 105.19 99.95 1w2u n GLY 117 Ca 0.00 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 1w2u n GLY 117 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1w2u h ASP 118 N 0.00 0.47 -4.82 1.61 3.32 -1.12 -3.42 116.42 112.47 1w2u h ASP 118 Ca 0.00 -0.27 -0.24 0.00 0.02 0.00 0.00 57.03 56.54 1w2u h ASP 118 Cb 0.00 -0.14 -0.20 0.00 0.22 0.00 0.00 39.33 39.21 1w2u h ASP 118 CO 0.00 0.97 -0.72 -0.31 -1.72 0.00 0.00 179.24 177.46 1w2u s TYR 119 N -3.84 0.59 -0.05 4.55 1.51 -0.91 -2.12 117.35 117.08 1w2u s TYR 119 Ca -0.06 -0.57 0.02 0.00 -1.01 0.00 0.00 57.07 55.46 1w2u s TYR 119 Cb 0.11 -0.37 0.01 0.00 -0.11 0.00 0.00 41.96 41.61 1w2u s TYR 119 CO 0.83 -0.12 -0.10 -2.00 -1.11 0.00 0.00 175.55 173.04 1w2u s GLU 120 N -1.85 1.31 -0.20 -0.62 2.12 -0.05 -1.54 118.70 117.87 1w2u s GLU 120 Ca -0.09 -0.34 -0.01 0.00 0.36 0.00 0.00 54.97 54.89 1w2u s GLU 120 Cb -0.08 -1.15 0.01 0.00 0.26 0.00 0.00 34.13 33.17 1w2u s GLU 120 CO -0.01 0.06 -0.13 -1.17 -0.54 0.00 0.00 175.26 173.47 1w2u s LEU 121 N 0.49 2.54 0.04 2.70 0.20 0.03 -0.74 118.68 123.94 1w2u s LEU 121 Ca -0.09 -0.61 0.07 0.00 0.69 0.00 0.00 54.13 54.19 1w2u s LEU 121 Cb -0.13 -1.59 -0.03 0.00 -0.43 0.00 0.00 46.19 44.01 1w2u s LEU 121 CO 0.02 -0.03 -0.18 -0.04 -0.29 0.00 0.00 176.35 175.83 1w2u s MET 122 N 1.35 2.07 -0.28 1.98 -1.94 0.19 -1.05 119.30 121.63 1w2u s MET 122 Ca 0.04 -0.98 0.01 0.00 -1.71 0.00 0.00 55.69 53.06 1w2u s MET 122 Cb -0.14 -2.19 0.08 0.00 2.01 0.00 0.00 34.83 34.59 1w2u s MET 122 CO -0.09 0.54 -0.00 0.42 -0.01 0.00 0.00 175.02 175.88 1w2u s ILE 123 N -0.92 1.63 0.01 2.53 1.01 -0.82 -0.93 121.20 123.72 1w2u s ILE 123 Ca 0.14 -1.57 -0.24 0.00 0.00 0.00 0.00 60.65 58.99 1w2u s ILE 123 Cb -0.10 -2.03 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 1w2u s ILE 123 CO 0.05 -0.33 0.73 0.26 0.00 0.00 0.00 174.94 175.65 1w2u s TRP 124 N 1.29 3.70 -1.00 3.97 0.52 0.01 -0.76 118.94 126.68 1w2u s TRP 124 Ca 0.01 1.40 0.12 0.00 0.02 0.00 0.00 56.10 57.65 1w2u s TRP 124 Cb -0.19 -2.79 -0.03 0.00 -1.15 0.00 0.00 33.47 29.30 1w2u s TRP 124 CO -0.10 0.24 0.67 1.28 0.02 0.00 0.00 176.95 179.06 1w2u n LEU 125 N 3.01 1.17 -3.62 2.99 4.77 0.74 -3.98 117.00 122.09 1w2u n LEU 125 Ca -0.03 -0.70 -0.15 0.00 -0.03 0.00 0.00 56.01 55.10 1w2u n LEU 125 Cb 0.51 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 1w2u n LEU 125 CO 0.47 0.24 0.25 0.00 -1.33 0.00 0.00 177.39 177.02 1w2u s ALA 126 N -1.71 -1.30 -0.36 -1.18 0.00 -1.17 -0.41 121.76 115.64 1w2u s ALA 126 Ca 0.09 0.77 0.03 0.00 0.00 0.00 0.00 51.96 52.85 1w2u s ALA 126 Cb 0.10 0.13 0.16 0.00 0.00 0.00 0.00 23.12 23.50 1w2u s ALA 126 CO 0.36 -0.37 0.39 0.50 0.00 0.00 0.00 175.76 176.64 1w2u s ARG 127 N -1.58 0.59 0.02 0.00 3.52 -1.26 -3.22 118.95 117.01 1w2u s ARG 127 Ca -0.10 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 54.89 1w2u s ARG 127 Cb -0.02 -0.62 -0.04 0.00 -1.56 0.00 0.00 34.95 32.72 1w2u s ARG 127 CO 0.05 -1.16 0.02 0.71 -0.81 0.00 0.00 175.30 174.11 1w2u s TYR 128 N 1.69 3.10 0.00 5.12 2.02 -0.12 -4.66 117.35 124.49 1w2u s TYR 128 Ca 0.15 0.08 0.00 0.00 -0.37 0.00 0.00 57.07 56.93 1w2u s TYR 128 Cb -0.14 -1.65 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 1w2u s TYR 128 CO -0.10 0.48 0.00 0.41 -1.57 0.00 0.00 175.55 174.77 1w2u n GLY 129 N 1.15 0.48 1.57 0.71 0.00 -0.83 -2.80 105.19 105.46 1w2u n GLY 129 Ca -0.13 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1w2u n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w2u n GLY 130 N -2.98 0.55 3.76 -0.02 0.00 -1.26 -4.78 105.19 100.45 1w2u n GLY 130 Ca 0.00 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 1w2u n GLY 130 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1w2u s ILE 131 N -2.00 3.18 0.16 -0.61 -4.36 -1.23 -5.07 121.20 111.26 1w2u s ILE 131 Ca 0.00 0.38 0.11 0.00 -0.26 0.00 0.00 60.65 60.88 1w2u s ILE 131 Cb 0.00 -2.86 -0.04 0.00 1.25 0.00 0.00 42.46 40.81 1w2u s ILE 131 CO 0.00 -0.50 -0.24 -0.31 0.24 0.00 0.00 174.94 174.12 1w2u s TYR 132 N -2.91 2.21 0.99 1.37 2.02 -1.26 -4.93 117.35 114.84 1w2u s TYR 132 Ca 0.62 -0.38 -0.16 0.00 -0.37 0.00 0.00 57.07 56.77 1w2u s TYR 132 Cb -0.17 -1.15 0.21 0.00 -0.40 0.00 0.00 41.96 40.45 1w2u s TYR 132 CO 0.56 0.39 1.30 -1.25 -1.57 0.00 0.00 175.55 174.98 1w2u s PRO 133 N -2.35 0.39 0.32 -1.71 0.04 -1.26 -5.01 135.00 125.42 1w2u s PRO 133 Ca 0.16 -0.38 -0.29 0.00 0.04 0.00 0.00 61.00 60.52 1w2u s PRO 133 Cb -0.09 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.53 1w2u s PRO 133 CO 0.07 -2.58 1.53 0.42 0.04 0.00 0.00 177.00 176.48 1w2u s ILE 134 N -3.80 2.16 0.00 0.56 -1.09 -1.26 -4.84 121.20 112.93 1w2u s ILE 134 Ca 0.74 0.14 0.00 0.00 -2.23 0.00 0.00 60.65 59.30 1w2u s ILE 134 Cb -0.04 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.75 1w2u s ILE 134 CO 0.53 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 1w2u n GLY 135 N 1.53 0.34 3.13 6.18 0.00 -1.26 -4.18 105.19 110.93 1w2u n GLY 135 Ca 0.05 -1.34 -0.11 0.00 0.00 0.00 0.00 46.02 44.63 1w2u n GLY 135 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1w2u s THR 136 N 0.00 0.59 0.26 2.61 -4.23 -0.46 -4.91 115.64 109.50 1w2u s THR 136 Ca 0.00 -1.68 -0.30 0.00 -1.18 0.00 0.00 61.69 58.53 1w2u s THR 136 Cb 0.00 -1.36 -0.11 0.00 1.34 0.00 0.00 72.50 72.37 1w2u s THR 136 CO 0.00 -0.75 1.61 0.12 -0.54 0.00 0.00 174.62 175.06 1w2u s PHE 137 N -3.03 2.82 -0.13 3.99 5.36 -1.26 -1.30 117.98 124.43 1w2u s PHE 137 Ca 0.05 0.69 -0.12 0.00 -0.96 0.00 0.00 56.93 56.59 1w2u s PHE 137 Cb 0.01 -4.06 -0.06 0.00 -0.34 0.00 0.00 43.02 38.57 1w2u s PHE 137 CO -0.04 -3.69 -0.25 1.58 -1.46 0.00 0.00 175.22 171.36 1w2u n HIS 138 N 2.68 0.00 -3.60 10.12 -0.00 0.76 -4.89 115.22 120.29 1w2u n HIS 138 Ca 0.10 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.83 1w2u n HIS 138 Cb 0.37 -0.48 -0.01 0.00 -0.00 0.00 0.00 29.99 29.88 1w2u n HIS 138 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1w2u s SER 139 N -6.23 -0.04 0.11 0.26 1.04 -1.17 -5.03 113.70 102.64 1w2u s SER 139 Ca -0.23 -0.05 -0.05 0.00 0.48 0.00 0.00 55.95 56.10 1w2u s SER 139 Cb 0.06 0.08 -0.05 0.00 0.10 0.00 0.00 66.02 66.20 1w2u s SER 139 CO 0.32 -0.14 0.35 -1.10 0.98 0.00 0.00 173.24 173.65 1w2u s GLN 140 N -2.22 3.62 -0.06 4.02 -0.21 -1.26 -0.65 119.66 122.91 1w2u s GLN 140 Ca 0.13 -0.08 -0.06 0.00 0.02 0.00 0.00 55.36 55.38 1w2u s GLN 140 Cb 0.04 -2.91 0.01 0.00 1.00 0.00 0.00 33.01 31.16 1w2u s GLN 140 CO -0.05 0.51 0.16 0.54 -2.12 0.00 0.00 175.29 174.33 1w2u s VAL 141 N -1.57 0.00 -0.40 1.09 0.11 -0.54 -4.93 120.40 114.17 1w2u s VAL 141 Ca 0.38 -0.04 -0.15 0.00 -2.93 0.00 0.00 61.98 59.24 1w2u s VAL 141 Cb -0.13 -0.24 0.01 0.00 -1.53 0.00 0.00 36.38 34.50 1w2u s VAL 141 CO 0.23 -0.02 0.31 0.20 -3.33 0.00 0.00 175.10 172.49 1w2u s ASN 142 N 0.01 6.11 -0.01 3.54 0.01 -1.26 -0.72 114.94 122.63 1w2u s ASN 142 Ca -0.01 -0.79 -0.12 0.00 -0.71 0.00 0.00 52.86 51.23 1w2u s ASN 142 Cb -0.01 -2.17 0.01 0.00 0.41 0.00 0.00 41.25 39.49 1w2u s ASN 142 CO 0.00 -0.43 0.24 -0.76 -1.51 0.00 0.00 177.10 174.64 1w2u s LEU 143 N 1.75 1.16 -1.64 0.60 1.43 -0.72 -4.94 118.68 116.32 1w2u s LEU 143 Ca 0.06 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.11 1w2u s LEU 143 Cb -0.18 1.01 0.00 0.00 0.03 0.00 0.00 46.19 47.05 1w2u s LEU 143 CO 0.11 -0.42 0.00 0.00 0.23 0.00 0.00 176.35 176.27 1w2u n ALA 144 N 1.33 -0.64 -0.88 4.21 0.00 -1.26 -1.48 120.51 121.79 1w2u n ALA 144 Ca -0.22 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1w2u n ALA 144 Cb 0.56 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.98 1w2u n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w2u n GLY 145 N -0.93 0.72 3.28 0.00 0.00 -1.26 -4.99 105.19 102.01 1w2u n GLY 145 Ca -0.22 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 1w2u n GLY 145 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w2u s ARG 146 N -0.12 1.27 -0.15 1.61 0.52 -0.55 -5.14 118.95 116.38 1w2u s ARG 146 Ca 0.00 -1.65 -0.07 0.00 -0.52 0.00 0.00 55.73 53.49 1w2u s ARG 146 Cb 0.00 -0.28 -0.04 0.00 0.52 0.00 0.00 34.95 35.15 1w2u s ARG 146 CO 0.00 -0.21 0.09 0.99 0.02 0.00 0.00 175.30 176.19 1w2u s THR 147 N -3.69 5.09 0.04 0.02 2.01 -1.26 -1.76 115.64 116.10 1w2u s THR 147 Ca 0.31 0.06 0.09 0.00 0.31 0.00 0.00 61.69 62.46 1w2u s THR 147 Cb 0.07 -3.25 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 1w2u s THR 147 CO 0.09 0.54 -0.26 0.26 -0.69 0.00 0.00 174.62 174.56 1w2u s TRP 148 N -0.35 2.29 -0.39 4.92 0.52 0.10 -4.40 118.94 121.62 1w2u s TRP 148 Ca 0.10 -0.41 -0.23 0.00 0.02 0.00 0.00 56.10 55.58 1w2u s TRP 148 Cb -0.12 -1.37 0.01 0.00 -1.15 0.00 0.00 33.47 30.84 1w2u s TRP 148 CO 0.01 0.12 0.76 -0.51 0.02 0.00 0.00 176.95 177.35 1w2u s ASP 149 N -1.23 6.48 -0.13 2.95 1.01 0.00 -1.46 116.67 124.29 1w2u s ASP 149 Ca 0.11 0.14 -0.24 0.00 0.71 0.00 0.00 52.55 53.27 1w2u s ASP 149 Cb -0.10 -2.38 -0.02 0.00 1.01 0.00 0.00 42.92 41.43 1w2u s ASP 149 CO 0.02 -0.78 0.77 -0.22 0.21 0.00 0.00 175.17 175.17 1w2u s LEU 150 N 3.10 4.23 0.01 1.23 2.96 0.18 -0.74 118.68 129.65 1w2u s LEU 150 Ca 0.30 1.16 0.04 0.00 -0.22 0.00 0.00 54.13 55.40 1w2u s LEU 150 Cb -0.13 -3.15 -0.03 0.00 0.50 0.00 0.00 46.19 43.37 1w2u s LEU 150 CO 0.19 -0.27 -0.08 0.26 -1.32 0.00 0.00 176.35 175.13 1w2u s TRP 151 N 1.57 2.85 0.03 5.38 0.52 0.25 -0.17 118.94 129.36 1w2u s TRP 151 Ca 0.37 -0.06 0.01 0.00 0.02 0.00 0.00 56.10 56.44 1w2u s TRP 151 Cb -0.17 -1.58 -0.02 0.00 -1.15 0.00 0.00 33.47 30.54 1w2u s TRP 151 CO 0.15 0.37 -0.05 0.95 0.02 0.00 0.00 176.95 178.39 1w2u s THR 152 N -1.01 0.30 0.00 2.01 -4.23 -0.42 -0.87 115.64 111.42 1w2u s THR 152 Ca 0.17 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.81 1w2u s THR 152 Cb -0.11 -0.39 0.00 0.00 1.34 0.00 0.00 72.50 73.34 1w2u s THR 152 CO 0.08 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.40 1w2u n GLY 153 N 1.74 0.93 3.15 3.99 0.00 -0.84 -1.36 105.19 112.81 1w2u n GLY 153 Ca -0.22 -0.57 -0.24 0.00 0.00 0.00 0.00 46.02 44.99 1w2u n GLY 153 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1w2u s TYR 154 N -1.97 1.49 -0.38 1.61 2.02 -1.26 -0.76 117.35 118.09 1w2u s TYR 154 Ca 0.00 -0.28 -0.01 0.00 -0.37 0.00 0.00 57.07 56.41 1w2u s TYR 154 Cb 0.00 -0.95 0.10 0.00 -0.40 0.00 0.00 41.96 40.71 1w2u s TYR 154 CO 0.00 -0.02 0.15 1.21 -1.57 0.00 0.00 175.55 175.31 1w2u s ASN 155 N -0.43 5.08 1.72 2.29 3.04 -0.14 -4.81 114.94 121.70 1w2u s ASN 155 Ca 0.06 -2.04 0.00 0.00 0.04 0.00 0.00 52.86 50.92 1w2u s ASN 155 Cb -0.06 -1.76 0.00 0.00 -1.54 0.00 0.00 41.25 37.89 1w2u s ASN 155 CO -0.01 -0.48 0.00 0.61 -3.04 0.00 0.00 177.10 174.19 1w2u n GLY 156 N 4.48 3.03 0.34 1.21 0.00 -1.26 -1.87 105.19 111.12 1w2u n GLY 156 Ca -0.01 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 45.95 1w2u n GLY 156 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1w2u n ASN 157 N 6.63 1.27 -4.67 1.61 6.94 -1.26 -4.90 115.26 120.89 1w2u n ASN 157 Ca 0.00 -1.11 -0.40 0.00 -0.02 0.00 0.00 54.58 53.05 1w2u n ASN 157 Cb 0.00 0.13 -0.05 0.00 -2.36 0.00 0.00 39.78 37.50 1w2u n ASN 157 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 1w2u s MET 158 N -2.37 4.24 -0.02 -3.83 1.75 -0.78 -4.96 119.30 113.32 1w2u s MET 158 Ca 0.27 0.73 -0.27 0.00 -1.25 0.00 0.00 55.69 55.17 1w2u s MET 158 Cb 0.20 -3.57 -0.04 0.00 2.84 0.00 0.00 34.83 34.26 1w2u s MET 158 CO 0.48 -0.24 0.83 0.50 -0.65 0.00 0.00 175.02 175.93 1w2u s ARG 159 N 1.91 4.50 -0.19 4.11 3.52 -0.90 -0.96 118.95 130.94 1w2u s ARG 159 Ca 0.31 1.14 -0.01 0.00 -0.13 0.00 0.00 55.73 57.04 1w2u s ARG 159 Cb -0.16 -3.44 0.00 0.00 -1.56 0.00 0.00 34.95 29.79 1w2u s ARG 159 CO 0.11 0.05 -0.12 0.08 -0.81 0.00 0.00 175.30 174.61 1w2u s VAL 160 N 0.75 2.82 -0.30 7.11 1.01 0.06 -0.87 120.40 130.98 1w2u s VAL 160 Ca 0.44 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 1w2u s VAL 160 Cb -0.20 -2.23 0.02 0.00 0.00 0.00 0.00 36.38 33.97 1w2u s VAL 160 CO 0.23 0.49 0.07 -0.31 0.00 0.00 0.00 175.10 175.58 1w2u s TYR 161 N 1.17 3.17 -0.17 5.22 2.02 0.08 -1.98 117.35 126.86 1w2u s TYR 161 Ca 0.02 -1.17 -0.00 0.00 -0.37 0.00 0.00 57.07 55.54 1w2u s TYR 161 Cb -0.14 -2.23 0.00 0.00 -0.40 0.00 0.00 41.96 39.18 1w2u s TYR 161 CO -0.04 -0.64 -0.14 -1.12 -1.57 0.00 0.00 175.55 172.04 1w2u s SER 162 N 1.45 3.69 -0.30 2.29 0.01 -0.05 -0.63 113.70 120.16 1w2u s SER 162 Ca 0.01 -0.49 -0.11 0.00 1.31 0.00 0.00 55.95 56.67 1w2u s SER 162 Cb -0.18 -1.58 -0.03 0.00 0.21 0.00 0.00 66.02 64.43 1w2u s SER 162 CO 0.02 0.05 0.20 -0.36 0.41 0.00 0.00 173.24 173.55 1w2u s PHE 163 N 1.04 3.21 0.10 2.43 0.40 -0.11 -0.58 117.98 124.47 1w2u s PHE 163 Ca -0.01 -0.08 0.08 0.00 -0.60 0.00 0.00 56.93 56.31 1w2u s PHE 163 Cb -0.15 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.94 1w2u s PHE 163 CO -0.03 -0.26 -0.15 -0.51 0.70 0.00 0.00 175.22 174.97 1w2u s LEU 164 N 1.73 2.84 0.08 -0.37 1.02 0.08 -0.81 118.68 123.24 1w2u s LEU 164 Ca 0.06 -0.47 -0.31 0.00 0.02 0.00 0.00 54.13 53.44 1w2u s LEU 164 Cb -0.16 -1.66 -0.06 0.00 0.02 0.00 0.00 46.19 44.32 1w2u s LEU 164 CO 0.10 0.19 1.27 -2.84 0.02 0.00 0.00 176.35 175.08 1w2u s PRO 165 N -2.07 4.39 0.48 1.29 0.02 -1.26 -0.82 135.00 137.04 1w2u s PRO 165 Ca 0.19 1.87 0.15 0.00 0.02 0.00 0.00 61.00 63.23 1w2u s PRO 165 Cb -0.11 -3.32 1.13 0.00 0.02 0.00 0.00 34.50 32.22 1w2u s PRO 165 CO 0.11 -0.32 2.08 -1.35 -0.33 0.00 0.00 177.00 177.18 1w2u h PRO 166 N 6.82 0.05 -2.51 5.54 0.11 -1.94 -3.44 132.00 136.63 1w2u h PRO 166 Ca -0.42 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.59 1w2u h PRO 166 Cb 1.21 -0.01 -0.23 0.00 0.11 0.00 0.00 31.00 32.08 1w2u h PRO 166 CO 0.83 0.10 -0.11 -1.54 -0.21 0.00 0.00 178.00 177.07 1w2u s SER 167 N -7.01 -0.52 0.33 -2.05 1.04 -1.26 -5.10 113.70 99.12 1w2u s SER 167 Ca -0.05 0.98 0.00 0.00 0.48 0.00 0.00 55.95 57.36 1w2u s SER 167 Cb 0.17 0.99 0.00 0.00 0.10 0.00 0.00 66.02 67.28 1w2u s SER 167 CO 0.69 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.31 1w2u n GLY 168 N 2.67 -0.96 3.64 7.32 0.00 -1.26 -4.96 105.19 111.64 1w2u n GLY 168 Ca -0.14 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1w2u n GLY 168 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1w2u s ASP 169 N -4.00 3.56 -0.41 1.61 1.47 -1.26 -4.63 116.67 113.01 1w2u s ASP 169 Ca 0.00 -1.59 0.02 0.00 1.18 0.00 0.00 52.55 52.16 1w2u s ASP 169 Cb 0.00 0.32 0.14 0.00 -0.34 0.00 0.00 42.92 43.04 1w2u s ASP 169 CO 0.00 -0.79 0.24 -0.63 0.68 0.00 0.00 175.17 174.68 1w2u s ILE 170 N -2.98 0.87 -0.94 2.11 1.01 0.45 -4.99 121.20 116.73 1w2u s ILE 170 Ca 0.18 -2.29 0.27 0.00 0.00 0.00 0.00 60.65 58.81 1w2u s ILE 170 Cb 0.04 -1.61 0.17 0.00 0.01 0.00 0.00 42.46 41.06 1w2u s ILE 170 CO 0.10 -0.97 1.73 0.54 0.00 0.00 0.00 174.94 176.34 1w2u n ARG 171 N 3.63 0.05 -3.77 2.79 1.74 -1.26 -4.57 116.66 115.27 1w2u n ARG 171 Ca 0.12 0.03 -0.24 0.00 -0.77 0.00 0.00 57.85 57.00 1w2u n ARG 171 Cb 0.37 -1.55 -0.17 0.00 -1.02 0.00 0.00 32.46 30.08 1w2u n ARG 171 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1w2u s ASP 172 N -3.28 1.74 -0.04 0.55 1.01 -1.26 -0.85 116.67 114.54 1w2u s ASP 172 Ca 0.12 -0.17 -0.05 0.00 0.71 0.00 0.00 52.55 53.16 1w2u s ASP 172 Cb 0.17 -0.46 0.01 0.00 1.01 0.00 0.00 42.92 43.65 1w2u s ASP 172 CO 0.60 -0.21 0.12 0.12 0.21 0.00 0.00 175.17 176.01 1w2u s PHE 173 N 1.96 -0.10 0.06 4.23 5.36 -0.39 -5.02 117.98 124.08 1w2u s PHE 173 Ca 0.04 0.25 0.03 0.00 -0.96 0.00 0.00 56.93 56.30 1w2u s PHE 173 Cb -0.13 0.03 -0.03 0.00 -0.34 0.00 0.00 43.02 42.55 1w2u s PHE 173 CO -0.06 -0.10 -0.10 -1.12 -1.46 0.00 0.00 175.22 172.39 1w2u s SER 174 N -0.17 1.20 0.16 6.13 0.01 -1.26 -0.77 113.70 119.00 1w2u s SER 174 Ca -0.02 -0.64 -0.24 0.00 1.31 0.00 0.00 55.95 56.35 1w2u s SER 174 Cb -0.02 0.01 0.07 0.00 0.21 0.00 0.00 66.02 66.30 1w2u s SER 174 CO 0.00 -0.20 1.02 0.00 0.41 0.00 0.00 173.24 174.47 1w2u s ASP 176 N -3.17 4.71 0.56 0.00 -1.08 -1.26 -1.22 116.67 115.22 1w2u s ASP 176 Ca 0.17 -1.29 0.31 0.00 -0.52 0.00 0.00 52.55 51.22 1w2u s ASP 176 Cb -0.02 -1.66 1.68 0.00 -1.46 0.00 0.00 42.92 41.47 1w2u s ASP 176 CO 0.03 -0.23 2.16 0.40 0.52 0.00 0.00 175.17 178.05 1w2u h ILE 177 N 6.55 0.43 0.00 4.11 2.04 -1.45 -0.35 117.51 128.84 1w2u h ILE 177 Ca -0.21 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 1w2u h ILE 177 Cb 1.06 1.22 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1w2u h ILE 177 CO 0.51 0.06 -0.03 0.11 0.00 0.00 0.00 178.15 178.80 1w2u h LYS 178 N 0.00 0.00 -0.53 2.37 1.79 -1.90 -0.94 116.57 117.36 1w2u h LYS 178 Ca -0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1w2u h LYS 178 Cb 0.22 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.84 1w2u h LYS 178 CO 0.01 0.03 0.20 -0.44 -1.08 0.00 0.00 179.45 178.17 1w2u h ASP 179 N 0.00 0.70 -0.06 0.86 3.32 -1.42 0.14 116.42 119.95 1w2u h ASP 179 Ca -0.00 -0.09 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 1w2u h ASP 179 Cb 0.09 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1w2u h ASP 179 CO 0.00 0.64 -0.21 -0.26 -1.72 0.00 0.00 179.24 177.69 1w2u h PHE 180 N 0.75 0.32 -0.88 4.55 -1.00 -1.32 -2.18 116.94 117.18 1w2u h PHE 180 Ca 0.18 -0.13 0.02 0.00 2.81 0.00 0.00 57.97 60.85 1w2u h PHE 180 Cb 0.17 -0.05 -0.05 0.00 3.61 0.00 0.00 35.95 39.63 1w2u h PHE 180 CO 0.01 0.83 0.58 0.74 -1.61 0.00 0.00 178.31 178.86 1w2u h PHE 181 N -0.29 1.09 -0.73 -0.55 0.04 -1.22 -1.82 116.94 113.47 1w2u h PHE 181 Ca -0.01 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.72 1w2u h PHE 181 Cb 0.84 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.60 1w2u h PHE 181 CO 0.13 0.66 0.19 -0.91 -0.60 0.00 0.00 178.31 177.79 1w2u h ASN 182 N 1.16 1.09 -0.52 2.17 2.35 -0.72 0.91 115.58 122.02 1w2u h ASN 182 Ca 0.34 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1w2u h ASN 182 Cb -0.08 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 37.98 1w2u h ASN 182 CO -0.09 1.03 0.34 0.22 -1.65 0.00 0.00 177.43 177.28 1w2u h TYR 183 N 1.10 0.66 -0.47 1.19 3.20 -1.11 -1.21 116.97 120.32 1w2u h TYR 183 Ca 0.23 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.02 1w2u h TYR 183 Cb 0.36 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 1w2u h TYR 183 CO 0.03 0.42 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.80 1w2u h LEU 184 N 0.71 0.84 -0.49 2.82 3.38 -0.75 -1.02 115.31 120.79 1w2u h LEU 184 Ca 0.19 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1w2u h LEU 184 Cb -0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1w2u h LEU 184 CO -0.04 0.96 0.20 -0.08 0.09 0.00 0.00 178.44 179.58 1w2u h GLU 185 N 0.76 0.72 0.15 1.13 4.81 -0.48 -0.58 114.58 121.09 1w2u h GLU 185 Ca 0.13 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1w2u h GLU 185 Cb 0.61 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1w2u h GLU 185 CO 0.04 0.64 -0.07 0.00 -0.73 0.00 0.00 179.01 178.89 1w2u h ARG 186 N 0.64 -0.19 0.00 1.92 3.08 -1.10 -3.27 114.38 115.47 1w2u h ARG 186 Ca 0.16 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1w2u h ARG 186 Cb 0.18 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1w2u h ARG 186 CO -0.02 0.23 -0.91 0.09 -1.07 0.00 0.00 179.97 178.29 1w2u n ASN 187 N -4.95 0.87 0.00 7.04 3.02 -0.40 -4.40 115.26 116.43 1w2u n ASN 187 Ca -0.08 -0.90 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 1w2u n ASN 187 Cb 0.26 1.03 0.00 0.00 -0.61 0.00 0.00 39.78 40.47 1w2u n ASN 187 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1w2u n HIS 188 N -1.47 0.00 -1.77 3.10 8.25 -0.28 -5.01 115.22 118.05 1w2u n HIS 188 Ca 0.03 -0.21 -0.16 0.00 -0.26 0.00 0.00 57.72 57.12 1w2u n HIS 188 Cb 0.30 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.34 1w2u n HIS 188 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w2u n GLY 189 N -0.21 0.94 3.68 -1.41 0.00 -0.98 -4.93 105.19 102.28 1w2u n GLY 189 Ca 0.00 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 1w2u n GLY 189 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1w2u s TYR 190 N -2.67 1.95 -1.44 1.61 5.04 -0.87 -4.85 117.35 116.11 1w2u s TYR 190 Ca 0.00 -0.02 -0.12 0.00 -2.44 0.00 0.00 57.07 54.48 1w2u s TYR 190 Cb 0.00 -4.10 0.05 0.00 0.35 0.00 0.00 41.96 38.26 1w2u s TYR 190 CO 0.00 -4.65 2.26 -0.35 -1.34 0.00 0.00 175.55 171.47 1w2u n PRO 191 N 6.39 3.18 0.18 4.97 -0.04 -1.26 -4.37 135.00 144.04 1w2u n PRO 191 Ca 0.18 -2.77 0.14 0.00 -0.04 0.00 0.00 63.50 61.01 1w2u n PRO 191 Cb 0.40 -3.13 0.72 0.00 -0.04 0.00 0.00 33.50 31.46 1w2u n PRO 191 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1w2u h ALA 192 N 5.77 2.05 0.00 0.55 0.00 -1.91 -1.19 119.26 124.53 1w2u h ALA 192 Ca 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1w2u h ALA 192 Cb 0.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1w2u h ALA 192 CO 1.81 -0.25 0.00 0.54 0.00 0.00 0.00 179.25 181.35 1w2u n ARG 193 N -4.26 0.17 -0.00 0.00 1.74 -1.26 -2.12 116.66 110.93 1w2u n ARG 193 Ca 0.02 0.24 0.06 0.00 -0.77 0.00 0.00 57.85 57.39 1w2u n ARG 193 Cb 0.29 -1.74 -0.07 0.00 -1.02 0.00 0.00 32.46 29.91 1w2u n ARG 193 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1w2u n GLU 194 N -2.05 2.32 -3.86 5.56 1.02 -0.49 -4.94 120.64 118.20 1w2u n GLU 194 Ca 0.05 -0.03 -0.35 0.00 -0.02 0.00 0.00 57.16 56.80 1w2u n GLU 194 Cb 0.33 -1.12 -0.08 0.00 -0.02 0.00 0.00 31.44 30.55 1w2u n GLU 194 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1w2u s GLN 195 N -2.32 4.00 -0.05 3.49 -1.52 -0.99 -4.22 119.66 118.04 1w2u s GLN 195 Ca 0.02 -0.26 -0.05 0.00 -1.95 0.00 0.00 55.36 53.13 1w2u s GLN 195 Cb 0.09 -3.30 -0.04 0.00 -0.22 0.00 0.00 33.01 29.53 1w2u s GLN 195 CO 0.49 0.36 0.17 -0.80 -0.25 0.00 0.00 175.29 175.25 1w2u s ASN 196 N 0.16 6.38 0.16 5.90 0.01 0.19 -0.74 114.94 127.00 1w2u s ASN 196 Ca 0.07 0.40 -0.31 0.00 -0.71 0.00 0.00 52.86 52.32 1w2u s ASN 196 Cb -0.12 -2.03 -0.08 0.00 0.41 0.00 0.00 41.25 39.43 1w2u s ASN 196 CO -0.00 0.32 1.36 -0.22 -1.51 0.00 0.00 177.10 177.05 1w2u s LEU 197 N -1.56 4.39 -0.11 0.60 2.96 -0.39 -1.40 118.68 123.17 1w2u s LEU 197 Ca 0.22 2.39 -0.07 0.00 -0.22 0.00 0.00 54.13 56.46 1w2u s LEU 197 Cb -0.12 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 42.92 1w2u s LEU 197 CO 0.13 -0.60 -0.16 -0.38 -1.32 0.00 0.00 176.35 174.01 1w2u n ILE 198 N 3.24 0.78 -4.13 6.68 2.08 -0.07 -4.59 119.36 123.35 1w2u n ILE 198 Ca 0.09 -0.12 -0.09 0.00 0.56 0.00 0.00 62.75 63.19 1w2u n ILE 198 Cb 0.42 -1.71 -0.10 0.00 -0.75 0.00 0.00 39.64 37.51 1w2u n ILE 198 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 1w2u s VAL 199 N -2.25 0.42 -0.31 1.39 -7.23 -1.16 -4.93 120.40 106.33 1w2u s VAL 199 Ca -0.17 -1.87 0.01 0.00 -1.81 0.00 0.00 61.98 58.13 1w2u s VAL 199 Cb 0.06 -1.65 0.14 0.00 0.56 0.00 0.00 36.38 35.50 1w2u s VAL 199 CO 0.22 -0.89 0.33 -0.47 -0.31 0.00 0.00 175.10 173.98 1w2u s TYR 200 N -3.80 -0.52 0.07 2.82 5.04 -1.26 -2.88 117.35 116.82 1w2u s TYR 200 Ca 0.11 -0.24 0.01 0.00 -2.44 0.00 0.00 57.07 54.51 1w2u s TYR 200 Cb 0.07 -0.40 -0.04 0.00 0.35 0.00 0.00 41.96 41.94 1w2u s TYR 200 CO -0.06 -0.94 -0.05 -0.65 -1.34 0.00 0.00 175.55 172.50 1w2u s GLN 201 N 2.19 0.67 0.05 4.97 -0.21 -0.44 -1.00 119.66 125.89 1w2u s GLN 201 Ca 0.11 -1.18 0.04 0.00 0.02 0.00 0.00 55.36 54.35 1w2u s GLN 201 Cb -0.14 -0.02 -0.02 0.00 1.00 0.00 0.00 33.01 33.83 1w2u s GLN 201 CO -0.26 -0.05 -0.12 0.54 -2.12 0.00 0.00 175.29 173.28 1w2u s VAL 202 N -3.37 0.93 0.00 1.09 0.11 -0.48 -0.88 120.40 117.80 1w2u s VAL 202 Ca 0.06 -1.09 0.00 0.00 -2.93 0.00 0.00 61.98 58.01 1w2u s VAL 202 Cb 0.04 -0.90 0.00 0.00 -1.53 0.00 0.00 36.38 33.99 1w2u s VAL 202 CO -0.06 -0.17 0.00 0.61 -3.33 0.00 0.00 175.10 172.15 1w2u n GLY 203 N 1.61 1.08 2.78 6.54 0.00 -0.50 -1.33 105.19 115.38 1w2u n GLY 203 Ca -0.20 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.96 1w2u n GLY 203 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1w2u s THR 204 N -2.17 0.43 -0.16 2.61 -1.32 -1.05 -1.01 115.64 112.98 1w2u s THR 204 Ca 0.00 0.09 -0.28 0.00 -1.21 0.00 0.00 61.69 60.29 1w2u s THR 204 Cb 0.00 -0.58 -0.01 0.00 -1.51 0.00 0.00 72.50 70.40 1w2u s THR 204 CO 0.00 0.27 0.95 -1.61 -2.21 0.00 0.00 174.62 172.02 1w2u s GLU 205 N 1.94 4.34 -0.17 7.08 2.02 -1.19 -3.62 118.70 129.10 1w2u s GLU 205 Ca 0.05 1.24 -0.01 0.00 0.02 0.00 0.00 54.97 56.27 1w2u s GLU 205 Cb -0.12 -3.58 -0.01 0.00 0.10 0.00 0.00 34.13 30.53 1w2u s GLU 205 CO -0.05 -0.39 -0.12 0.00 0.02 0.00 0.00 175.26 174.71 1w2u n PHE 207 N 4.13 0.00 -3.74 0.00 3.01 -0.13 -0.69 117.46 120.04 1w2u n PHE 207 Ca -0.19 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.18 1w2u n PHE 207 Cb 0.52 -0.20 -0.05 0.00 -0.01 0.00 0.00 39.48 39.74 1w2u n PHE 207 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1w2u s THR 208 N -1.95 0.08 0.00 4.37 -4.23 -1.09 -4.57 115.64 108.25 1w2u s THR 208 Ca -0.11 -0.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1w2u s THR 208 Cb 0.02 -1.34 0.00 0.00 1.34 0.00 0.00 72.50 72.52 1w2u s THR 208 CO 0.17 -0.38 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 1w2u n GLY 209 N -0.19 -0.03 0.01 3.99 0.00 -0.19 -1.24 105.19 107.54 1w2u n GLY 209 Ca -0.14 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.61 1w2u n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w2u n GLY 210 N 0.00 -3.81 3.69 -0.02 0.00 -1.26 -1.44 105.19 102.34 1w2u n GLY 210 Ca 0.00 -2.10 -0.45 0.00 0.00 0.00 0.00 46.02 43.47 1w2u n GLY 210 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1w2u n PRO 211 N -0.00 2.34 -4.20 1.61 -0.02 -1.26 -4.92 135.00 128.55 1w2u n PRO 211 Ca 0.00 0.84 -0.16 0.00 -2.02 0.00 0.00 63.50 62.17 1w2u n PRO 211 Cb 0.00 -2.62 -0.11 0.00 -0.02 0.00 0.00 33.50 30.75 1w2u n PRO 211 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1w2u s ALA 212 N 0.80 1.24 -0.04 3.55 0.00 -0.19 -4.97 121.76 122.15 1w2u s ALA 212 Ca 0.76 -1.21 -0.01 0.00 0.00 0.00 0.00 51.96 51.49 1w2u s ALA 212 Cb -0.62 -0.01 0.03 0.00 0.00 0.00 0.00 23.12 22.52 1w2u s ALA 212 CO 0.38 0.02 0.03 0.50 0.00 0.00 0.00 175.76 176.69 1w2u s ARG 213 N -2.70 0.14 -0.21 0.00 3.52 -1.26 -1.41 118.95 117.02 1w2u s ARG 213 Ca 0.06 0.22 -0.13 0.00 -0.13 0.00 0.00 55.73 55.75 1w2u s ARG 213 Cb -0.04 -0.52 -0.05 0.00 -1.56 0.00 0.00 34.95 32.78 1w2u s ARG 213 CO 0.01 -0.24 0.26 0.12 -0.81 0.00 0.00 175.30 174.64 1w2u s PHE 214 N 1.60 3.36 -0.19 5.12 5.36 -0.18 -1.92 117.98 131.13 1w2u s PHE 214 Ca -0.02 0.41 -0.01 0.00 -0.96 0.00 0.00 56.93 56.35 1w2u s PHE 214 Cb -0.13 -2.36 0.00 0.00 -0.34 0.00 0.00 43.02 40.20 1w2u s PHE 214 CO -0.03 0.08 -0.12 0.99 -1.46 0.00 0.00 175.22 174.67 1w2u s THR 215 N 1.03 2.75 -0.56 0.12 2.01 0.09 -0.81 115.64 120.26 1w2u s THR 215 Ca 0.13 -0.71 -0.18 0.00 0.31 0.00 0.00 61.69 61.23 1w2u s THR 215 Cb -0.14 -2.21 0.09 0.00 0.01 0.00 0.00 72.50 70.26 1w2u s THR 215 CO 0.05 0.48 0.64 0.00 -0.69 0.00 0.00 174.62 175.11 1w2u h ARG 217 N 9.08 0.27 -1.71 0.00 3.08 -0.89 -2.12 114.38 122.10 1w2u h ARG 217 Ca -0.29 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 59.72 1w2u h ARG 217 Cb 1.09 -0.03 -0.25 0.00 0.08 0.00 0.00 29.97 30.86 1w2u h ARG 217 CO 1.05 0.43 0.36 0.34 -1.07 0.00 0.00 179.97 181.09 1w2u s ASP 218 N -6.86 -0.53 -0.03 7.04 2.15 -1.07 -4.72 116.67 112.65 1w2u s ASP 218 Ca -0.06 1.03 0.02 0.00 0.43 0.00 0.00 52.55 53.97 1w2u s ASP 218 Cb 0.15 1.05 0.01 0.00 -0.30 0.00 0.00 42.92 43.83 1w2u s ASP 218 CO 0.74 -0.18 -0.06 0.12 -0.17 0.00 0.00 175.17 175.63 1w2u s PHE 219 N 0.28 0.73 0.02 -5.34 5.36 -0.17 -1.15 117.98 117.70 1w2u s PHE 219 Ca 0.02 -0.18 0.02 0.00 -0.96 0.00 0.00 56.93 55.83 1w2u s PHE 219 Cb -0.05 -0.59 -0.01 0.00 -0.34 0.00 0.00 43.02 42.03 1w2u s PHE 219 CO -0.04 -0.13 -0.07 1.03 -1.46 0.00 0.00 175.22 174.54 1w2u s ARG 220 N 0.53 0.54 -0.14 10.12 0.52 -0.57 -0.88 118.95 129.06 1w2u s ARG 220 Ca -0.07 -0.47 -0.12 0.00 -0.52 0.00 0.00 55.73 54.55 1w2u s ARG 220 Cb -0.11 -0.45 0.04 0.00 0.52 0.00 0.00 34.95 34.96 1w2u s ARG 220 CO 0.00 0.11 0.37 0.00 0.02 0.00 0.00 175.30 175.81 1w2u s ALA 221 N -0.67 -0.93 0.18 2.13 0.00 -1.26 -1.58 121.76 119.63 1w2u s ALA 221 Ca -0.02 1.13 0.02 0.00 0.00 0.00 0.00 51.96 53.09 1w2u s ALA 221 Cb -0.06 -0.67 -0.05 0.00 0.00 0.00 0.00 23.12 22.35 1w2u s ALA 221 CO 0.00 -0.19 0.01 -0.51 0.00 0.00 0.00 175.76 175.06 1w2u s ASP 222 N 0.45 1.22 0.03 0.00 1.11 -0.24 -5.00 116.67 114.24 1w2u s ASP 222 Ca -0.02 -1.18 -0.15 0.00 0.18 0.00 0.00 52.55 51.38 1w2u s ASP 222 Cb -0.04 0.12 0.02 0.00 1.07 0.00 0.00 42.92 44.09 1w2u s ASP 222 CO -0.02 -0.57 0.33 -1.48 1.18 0.00 0.00 175.17 174.60 1w2u s LEU 223 N -3.18 0.77 0.00 1.23 2.34 -1.26 -2.72 118.68 115.86 1w2u s LEU 223 Ca 0.25 -0.11 0.00 0.00 0.06 0.00 0.00 54.13 54.33 1w2u s LEU 223 Cb 0.06 1.42 0.00 0.00 -0.56 0.00 0.00 46.19 47.11 1w2u s LEU 223 CO 0.04 -0.60 0.00 -2.67 -1.06 0.00 0.00 176.35 172.06