#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wzp s VAL 2 N 0.00 2.73 0.51 1.61 1.01 -1.26 -4.53 120.40 120.48 2wzp s VAL 2 Ca 0.00 0.44 -0.22 0.00 0.00 0.00 0.00 61.98 62.20 2wzp s VAL 2 Cb 0.00 -3.13 -0.07 0.00 0.00 0.00 0.00 36.38 33.18 2wzp s VAL 2 CO 0.00 -0.12 1.13 -1.14 0.00 0.00 0.00 175.10 174.98 2wzp n ARG 3 N -1.71 1.39 -4.61 2.72 0.00 -1.26 -4.88 116.66 108.31 2wzp n ARG 3 Ca 0.13 0.51 -0.24 0.00 -0.00 0.00 0.00 57.85 58.25 2wzp n ARG 3 Cb 0.50 -2.28 -0.16 0.00 0.00 0.00 0.00 32.46 30.51 2wzp n ARG 3 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2wzp s GLN 4 N -2.52 1.56 -0.04 -0.14 -1.52 0.63 -5.00 119.66 112.63 2wzp s GLN 4 Ca 0.69 -0.44 0.05 0.00 -1.95 0.00 0.00 55.36 53.70 2wzp s GLN 4 Cb -0.46 -1.33 -0.03 0.00 -0.22 0.00 0.00 33.01 30.97 2wzp s GLN 4 CO 0.52 0.11 -0.17 0.71 -0.25 0.00 0.00 175.29 176.21 2wzp s TYR 5 N 0.38 2.63 -0.02 0.91 2.02 -1.26 -1.29 117.35 120.72 2wzp s TYR 5 Ca -0.09 -0.21 -0.03 0.00 -0.37 0.00 0.00 57.07 56.37 2wzp s TYR 5 Cb -0.13 -1.60 0.00 0.00 -0.40 0.00 0.00 41.96 39.84 2wzp s TYR 5 CO 0.03 0.15 0.07 0.15 -1.57 0.00 0.00 175.55 174.37 2wzp s LYS 6 N -0.75 0.16 -0.26 -0.62 1.02 -1.04 -2.28 119.74 115.95 2wzp s LYS 6 Ca 0.11 -0.04 -0.08 0.00 0.02 0.00 0.00 55.97 55.98 2wzp s LYS 6 Cb -0.10 0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.24 2wzp s LYS 6 CO 0.01 -0.03 0.10 0.42 -0.92 0.00 0.00 175.35 174.93 2wzp s ILE 7 N -0.31 4.54 -0.18 2.17 -1.09 -0.27 -0.57 121.20 125.49 2wzp s ILE 7 Ca -0.04 -0.11 -0.07 0.00 -2.23 0.00 0.00 60.65 58.20 2wzp s ILE 7 Cb -0.02 -3.15 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 2wzp s ILE 7 CO 0.00 0.30 0.05 -1.00 -1.23 0.00 0.00 174.94 173.07 2wzp s HIS 8 N 1.65 3.21 -0.19 3.97 3.76 0.39 -1.28 115.29 126.79 2wzp s HIS 8 Ca 0.06 -0.01 0.17 0.00 -0.15 0.00 0.00 55.06 55.13 2wzp s HIS 8 Cb -0.15 -2.08 0.14 0.00 1.11 0.00 0.00 32.58 31.60 2wzp s HIS 8 CO 0.05 0.09 1.49 1.79 -0.85 0.00 0.00 174.74 177.31 2wzp h THR 9 N 4.95 0.72 -1.09 1.30 1.35 -1.57 -0.92 112.91 117.65 2wzp h THR 9 Ca -0.36 -1.98 -0.16 0.00 -0.55 0.00 0.00 66.41 63.35 2wzp h THR 9 Cb 1.17 2.33 -0.18 0.00 -1.73 0.00 0.00 68.15 69.74 2wzp h THR 9 CO 0.68 0.40 -0.51 0.21 -0.25 0.00 0.00 175.52 176.06 2wzp s ASN 10 N -6.41 -1.27 0.25 5.36 2.47 -1.26 -4.83 114.94 109.25 2wzp s ASN 10 Ca 0.04 -1.64 -0.31 0.00 0.42 0.00 0.00 52.86 51.37 2wzp s ASN 10 Cb 0.07 1.76 -0.13 0.00 -1.45 0.00 0.00 41.25 41.51 2wzp s ASN 10 CO 0.73 -0.08 1.48 -0.11 -3.72 0.00 0.00 177.10 175.40 2wzp n LEU 11 N 3.22 3.46 0.00 3.21 0.00 -1.26 -1.87 117.00 123.76 2wzp n LEU 11 Ca 0.17 1.14 0.00 0.00 0.00 0.00 0.00 56.01 57.32 2wzp n LEU 11 Cb 0.56 -1.48 0.00 0.00 0.00 0.00 0.00 43.42 42.50 2wzp n LEU 11 CO -0.01 -0.28 0.00 0.47 0.00 0.00 0.00 177.39 177.57 2wzp n ASP 12 N 2.33 -3.79 -4.93 1.96 8.00 -1.26 -4.97 116.55 113.90 2wzp n ASP 12 Ca 0.11 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.34 2wzp n ASP 12 Cb 0.33 -2.83 -0.03 0.00 -0.02 0.00 0.00 41.12 38.57 2wzp n ASP 12 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2wzp s GLY 13 N -2.00 1.83 0.47 0.44 0.00 -0.78 -5.03 107.32 102.25 2wzp s GLY 13 Ca 0.00 -0.82 0.27 0.00 0.00 0.00 0.00 44.72 44.16 2wzp s GLY 13 CO 0.00 -0.78 1.87 -0.91 0.00 0.00 0.00 173.10 173.28 2wzp h THR 14 N 1.59 0.37 -0.54 0.90 1.35 -1.93 -3.14 112.91 111.51 2wzp h THR 14 Ca -0.48 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 2wzp h THR 14 Cb 1.19 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2wzp h THR 14 CO 0.69 0.15 0.00 -0.90 -0.25 0.00 0.00 175.52 175.20 2wzp n ASP 15 N -3.29 4.61 -4.67 5.36 3.85 -1.26 -5.02 116.55 116.12 2wzp n ASP 15 Ca 0.00 -2.58 -0.49 0.00 -0.71 0.00 0.00 54.79 51.02 2wzp n ASP 15 Cb 0.39 -0.56 -0.05 0.00 -1.35 0.00 0.00 41.12 39.56 2wzp n ASP 15 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 2wzp n ASP 16 N 0.71 3.00 -4.45 -1.12 2.03 -1.19 -4.79 116.55 110.74 2wzp n ASP 16 Ca 0.24 1.04 -0.34 0.00 0.52 0.00 0.00 54.79 56.25 2wzp n ASP 16 Cb 0.90 -1.35 -0.13 0.00 -0.72 0.00 0.00 41.12 39.83 2wzp n ASP 16 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2wzp s LYS 17 N 2.46 3.59 -0.20 -0.67 2.20 -1.26 -4.92 119.74 120.94 2wzp s LYS 17 Ca 0.87 -0.55 -0.04 0.00 -0.36 0.00 0.00 55.97 55.89 2wzp s LYS 17 Cb -0.76 -2.95 -0.02 0.00 -1.51 0.00 0.00 37.83 32.59 2wzp s LYS 17 CO 0.48 0.11 -0.03 0.08 -0.36 0.00 0.00 175.35 175.62 2wzp s VAL 18 N 0.70 3.61 -0.26 4.02 1.01 -1.26 -1.47 120.40 126.75 2wzp s VAL 18 Ca -0.02 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.44 2wzp s VAL 18 Cb -0.14 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 2wzp s VAL 18 CO 0.02 0.44 0.13 0.26 0.00 0.00 0.00 175.10 175.96 2wzp s TRP 19 N 1.08 3.16 -0.71 5.22 0.52 -0.40 -4.96 118.94 122.84 2wzp s TRP 19 Ca 0.01 -0.11 -0.23 0.00 0.02 0.00 0.00 56.10 55.79 2wzp s TRP 19 Cb -0.15 -2.31 0.07 0.00 -1.15 0.00 0.00 33.47 29.94 2wzp s TRP 19 CO 0.00 -0.23 1.04 0.34 0.02 0.00 0.00 176.95 178.12 2wzp s ASP 20 N 1.63 6.23 -0.03 2.95 3.68 -1.26 -1.11 116.67 128.76 2wzp s ASP 20 Ca 0.07 -1.06 0.03 0.00 2.13 0.00 0.00 52.55 53.71 2wzp s ASP 20 Cb -0.15 -2.44 0.15 0.00 -1.45 0.00 0.00 42.92 39.02 2wzp s ASP 20 CO 0.07 -1.45 0.81 1.33 0.13 0.00 0.00 175.17 176.06 2wzp n VAL 21 N 5.97 0.44 -0.03 1.11 0.24 -0.97 -1.03 118.33 124.06 2wzp n VAL 21 Ca 0.01 -0.24 -0.04 0.00 -2.04 0.00 0.00 64.34 62.03 2wzp n VAL 21 Cb 0.46 -0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 32.46 2wzp n VAL 21 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2wzp n THR 22 N 0.07 0.32 -0.09 3.34 -1.04 -1.22 -0.62 114.28 115.05 2wzp n THR 22 Ca 0.05 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2wzp n THR 22 Cb 0.36 -0.73 0.00 0.00 -1.82 0.00 0.00 70.33 68.14 2wzp n THR 22 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2wzp n ASN 23 N -2.59 0.41 -2.61 8.00 3.02 -1.22 -4.98 115.26 115.29 2wzp n ASN 23 Ca -0.10 -0.70 -0.08 0.00 -0.03 0.00 0.00 54.58 53.67 2wzp n ASN 23 Cb 0.61 0.41 0.06 0.00 -0.61 0.00 0.00 39.78 40.25 2wzp n ASN 23 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wzp n GLY 24 N 0.41 -0.79 0.11 7.41 0.00 -0.20 -4.98 105.19 107.14 2wzp n GLY 24 Ca 0.00 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.40 2wzp n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wzp n LYS 25 N -1.77 0.25 -4.05 1.61 4.76 -1.26 -4.50 118.16 113.20 2wzp n LYS 25 Ca 0.05 0.24 -0.32 0.00 -2.87 0.00 0.00 58.31 55.41 2wzp n LYS 25 Cb 0.17 -1.81 -0.16 0.00 -1.84 0.00 0.00 35.03 31.40 2wzp n LYS 25 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wzp s VAL 26 N -3.13 1.90 0.15 -0.18 1.01 -1.26 0.37 120.40 119.25 2wzp s VAL 26 Ca 0.10 -1.15 0.09 0.00 0.00 0.00 0.00 61.98 61.02 2wzp s VAL 26 Cb 0.12 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2wzp s VAL 26 CO 0.57 0.22 -0.21 -0.13 0.00 0.00 0.00 175.10 175.55 2wzp s ARG 27 N 1.29 1.29 -0.11 2.72 0.52 0.23 -3.97 118.95 120.92 2wzp s ARG 27 Ca -0.02 -1.34 -0.01 0.00 -0.52 0.00 0.00 55.73 53.84 2wzp s ARG 27 Cb -0.16 -1.52 -0.03 0.00 0.52 0.00 0.00 34.95 33.76 2wzp s ARG 27 CO -0.09 0.33 -0.07 -0.06 0.02 0.00 0.00 175.30 175.44 2wzp s PHE 28 N -1.57 2.94 0.08 -0.53 2.99 0.21 -1.00 117.98 121.09 2wzp s PHE 28 Ca 0.13 -0.21 0.03 0.00 0.00 0.00 0.00 56.93 56.89 2wzp s PHE 28 Cb -0.08 -1.82 -0.03 0.00 0.00 0.00 0.00 43.02 41.09 2wzp s PHE 28 CO 0.06 0.11 -0.10 0.71 -0.00 0.00 0.00 175.22 176.01 2wzp s TYR 29 N -0.21 0.95 -0.77 0.36 2.02 -0.40 -4.79 117.35 114.51 2wzp s TYR 29 Ca 0.03 -0.61 -0.02 0.00 -0.37 0.00 0.00 57.07 56.10 2wzp s TYR 29 Cb -0.13 -0.53 0.00 0.00 -0.40 0.00 0.00 41.96 40.90 2wzp s TYR 29 CO 0.03 -0.03 0.64 1.04 -1.57 0.00 0.00 175.55 175.66 2wzp n GLN 30 N 0.85 -1.49 -1.70 -0.62 6.02 -1.26 -0.68 117.38 118.50 2wzp n GLN 30 Ca -0.18 1.10 -0.43 0.00 -0.01 0.00 0.00 57.00 57.47 2wzp n GLN 30 Cb 0.57 -3.72 -0.02 0.00 1.02 0.00 0.00 30.24 28.08 2wzp n GLN 30 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2wzp n PRO 31 N -2.16 2.37 -0.13 -1.09 -0.04 -1.26 -4.37 135.00 128.31 2wzp n PRO 31 Ca -0.18 0.85 -0.06 0.00 -0.04 0.00 0.00 63.50 64.07 2wzp n PRO 31 Cb 0.61 -2.58 0.03 0.00 -0.04 0.00 0.00 33.50 31.52 2wzp n PRO 31 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2wzp h SER 32 N 4.88 0.27 -1.75 3.54 4.64 -0.76 -3.44 113.55 120.94 2wzp h SER 32 Ca -0.46 0.03 0.12 0.00 -0.47 0.00 0.00 61.79 61.01 2wzp h SER 32 Cb 1.25 -0.02 -0.23 0.00 -0.31 0.00 0.00 62.40 63.09 2wzp h SER 32 CO 0.81 0.20 0.09 0.21 -0.87 0.00 0.00 176.83 177.27 2wzp s ASN 33 N -5.44 -0.82 0.00 4.97 2.47 -1.26 -5.00 114.94 109.86 2wzp s ASN 33 Ca -0.13 1.16 0.18 0.00 0.42 0.00 0.00 52.86 54.49 2wzp s ASN 33 Cb 0.12 1.82 0.47 0.00 -1.45 0.00 0.00 41.25 42.22 2wzp s ASN 33 CO 0.72 -0.17 1.39 0.18 -3.72 0.00 0.00 177.10 175.51 2wzp n LEU 34 N 4.94 3.45 0.00 3.21 4.77 -1.26 -4.67 117.00 127.44 2wzp n LEU 34 Ca -0.12 -1.85 0.00 0.00 -0.03 0.00 0.00 56.01 54.01 2wzp n LEU 34 Cb 0.52 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2wzp n LEU 34 CO -0.03 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 2wzp n GLY 35 N 1.22 -0.41 3.69 -0.72 0.00 -1.26 -4.82 105.19 102.90 2wzp n GLY 35 Ca 0.19 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.42 2wzp n GLY 35 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wzp s LEU 36 N 0.00 0.25 0.11 0.99 0.05 -1.26 -4.42 118.68 114.39 2wzp s LEU 36 Ca 0.00 -1.06 0.07 0.00 0.05 0.00 0.00 54.13 53.20 2wzp s LEU 36 Cb 0.00 2.25 -0.04 0.00 -2.05 0.00 0.00 46.19 46.36 2wzp s LEU 36 CO 0.00 -1.40 -0.18 -1.10 -0.55 0.00 0.00 176.35 173.12 2wzp s GLN 37 N -3.23 1.06 0.03 1.48 1.11 -0.66 -5.01 119.66 114.44 2wzp s GLN 37 Ca 0.20 -1.17 0.01 0.00 0.01 0.00 0.00 55.36 54.41 2wzp s GLN 37 Cb -0.03 -1.17 -0.02 0.00 -1.01 0.00 0.00 33.01 30.78 2wzp s GLN 37 CO 0.12 0.26 -0.05 0.45 0.01 0.00 0.00 175.29 176.07 2wzp s SER 38 N -2.09 0.56 0.01 5.90 0.15 -1.26 -0.88 113.70 116.09 2wzp s SER 38 Ca 0.06 -0.51 0.02 0.00 0.70 0.00 0.00 55.95 56.23 2wzp s SER 38 Cb -0.08 0.06 -0.01 0.00 -1.71 0.00 0.00 66.02 64.28 2wzp s SER 38 CO 0.04 -0.24 -0.08 0.28 1.20 0.00 0.00 173.24 174.44 2wzp s THR 39 N -1.37 0.58 -0.05 6.45 -1.32 -0.12 -4.99 115.64 114.81 2wzp s THR 39 Ca -0.12 -0.52 0.07 0.00 -1.21 0.00 0.00 61.69 59.91 2wzp s THR 39 Cb -0.10 -0.53 0.11 0.00 -1.51 0.00 0.00 72.50 70.48 2wzp s THR 39 CO -0.00 0.02 1.05 0.59 -2.21 0.00 0.00 174.62 174.07 2wzp n ASN 40 N 2.50 2.12 -3.95 8.08 3.02 -1.26 -0.57 115.26 125.20 2wzp n ASN 40 Ca -0.16 -2.41 -0.29 0.00 -0.03 0.00 0.00 54.58 51.69 2wzp n ASN 40 Cb 0.57 -0.16 0.01 0.00 -0.61 0.00 0.00 39.78 39.58 2wzp n ASN 40 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2wzp n ASN 41 N -0.85 -3.03 -4.73 6.41 3.02 -1.24 0.77 115.26 115.61 2wzp n ASN 41 Ca 0.06 -0.88 -0.41 0.00 -0.03 0.00 0.00 54.58 53.32 2wzp n ASN 41 Cb 0.40 -3.52 -0.04 0.00 -0.61 0.00 0.00 39.78 36.01 2wzp n ASN 41 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wzp s ILE 42 N -3.48 4.21 0.03 2.41 1.01 -1.26 -3.74 121.20 120.37 2wzp s ILE 42 Ca 0.45 1.75 0.06 0.00 0.00 0.00 0.00 60.65 62.90 2wzp s ILE 42 Cb -0.23 -4.12 -0.02 0.00 0.01 0.00 0.00 42.46 38.10 2wzp s ILE 42 CO 0.86 0.23 -0.17 -1.66 0.00 0.00 0.00 174.94 174.20 2wzp s TRP 43 N 0.33 1.50 -0.14 3.97 1.48 -1.00 -4.92 118.94 120.16 2wzp s TRP 43 Ca 0.51 -0.34 -0.14 0.00 -1.06 0.00 0.00 56.10 55.08 2wzp s TRP 43 Cb -0.27 -0.91 -0.05 0.00 -1.16 0.00 0.00 33.47 31.08 2wzp s TRP 43 CO 0.31 0.04 0.30 -0.65 -4.06 0.00 0.00 176.95 172.90 2wzp s GLN 44 N -0.96 4.18 -0.87 3.25 -0.21 -1.26 -0.35 119.66 123.45 2wzp s GLN 44 Ca 0.05 0.13 -0.01 0.00 0.02 0.00 0.00 55.36 55.55 2wzp s GLN 44 Cb -0.08 -3.39 0.21 0.00 1.00 0.00 0.00 33.01 30.75 2wzp s GLN 44 CO 0.01 0.30 0.74 0.45 -2.12 0.00 0.00 175.29 174.67 2wzp s SER 45 N 0.26 5.87 -0.93 5.90 0.15 0.33 -4.65 113.70 120.63 2wzp s SER 45 Ca 0.17 -3.69 -0.01 0.00 0.70 0.00 0.00 55.95 53.12 2wzp s SER 45 Cb -0.13 -1.88 -0.02 0.00 -1.71 0.00 0.00 66.02 62.28 2wzp s SER 45 CO 0.05 -0.18 0.78 -3.20 1.20 0.00 0.00 173.24 171.89 2wzp n ASN 46 N 2.36 -3.15 0.00 5.45 5.15 -1.26 -3.08 115.26 120.73 2wzp n ASN 46 Ca 0.21 -0.52 0.00 0.00 -0.60 0.00 0.00 54.58 53.67 2wzp n ASN 46 Cb 0.37 -4.24 0.00 0.00 -0.53 0.00 0.00 39.78 35.38 2wzp n ASN 46 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wzp n GLY 47 N -1.16 2.56 3.61 8.20 0.00 -1.26 -5.01 105.19 112.13 2wzp n GLY 47 Ca -0.18 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 2wzp n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wzp s ILE 48 N -1.14 3.63 0.10 -0.61 1.01 -1.18 -4.92 121.20 118.10 2wzp s ILE 48 Ca 0.00 0.66 -0.31 0.00 0.00 0.00 0.00 60.65 61.01 2wzp s ILE 48 Cb 0.00 -3.78 -0.07 0.00 0.01 0.00 0.00 42.46 38.62 2wzp s ILE 48 CO 0.00 -0.44 1.28 -0.83 0.00 0.00 0.00 174.94 174.95 2wzp s GLY 49 N 5.07 2.25 -0.30 6.18 0.00 -1.26 -0.51 107.32 118.75 2wzp s GLY 49 Ca 0.74 0.98 -0.04 0.00 0.00 0.00 0.00 44.72 46.40 2wzp s GLY 49 CO 0.32 2.15 0.03 0.14 0.00 0.00 0.00 173.10 175.74 2wzp s VAL 50 N 0.93 3.32 0.31 1.40 1.01 0.53 -4.94 120.40 122.95 2wzp s VAL 50 Ca 0.61 -1.15 -0.26 0.00 0.00 0.00 0.00 61.98 61.18 2wzp s VAL 50 Cb -0.33 -2.83 -0.10 0.00 0.00 0.00 0.00 36.38 33.12 2wzp s VAL 50 CO 0.31 -0.04 0.93 -0.04 0.00 0.00 0.00 175.10 176.25 2wzp s MET 51 N 1.34 4.57 0.00 2.72 -1.94 -1.26 -2.38 119.30 122.35 2wzp s MET 51 Ca -0.02 1.30 0.00 0.00 -1.71 0.00 0.00 55.69 55.26 2wzp s MET 51 Cb -0.19 -2.83 0.00 0.00 2.01 0.00 0.00 34.83 33.83 2wzp s MET 51 CO -0.00 0.30 0.00 0.41 -0.01 0.00 0.00 175.02 175.72 2wzp n GLY 52 N 0.62 5.20 3.75 -0.03 0.00 0.23 -4.95 105.19 110.01 2wzp n GLY 52 Ca 0.01 -1.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.03 2wzp n GLY 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wzp s THR 53 N 3.39 4.25 0.00 2.61 -4.23 -1.25 -4.78 115.64 115.63 2wzp s THR 53 Ca 0.00 1.98 -0.23 0.00 -1.18 0.00 0.00 61.69 62.26 2wzp s THR 53 Cb 0.00 -4.28 -0.05 0.00 1.34 0.00 0.00 72.50 69.51 2wzp s THR 53 CO 0.00 0.47 0.67 -0.60 -0.54 0.00 0.00 174.62 174.62 2wzp s ARG 54 N -0.91 4.40 -0.06 3.99 6.06 -1.26 -3.71 118.95 127.47 2wzp s ARG 54 Ca 0.41 0.88 -0.05 0.00 -2.50 0.00 0.00 55.73 54.46 2wzp s ARG 54 Cb -0.25 -3.37 0.02 0.00 0.06 0.00 0.00 34.95 31.42 2wzp s ARG 54 CO 0.30 0.29 0.16 0.45 -2.50 0.00 0.00 175.30 174.00 2wzp s SER 55 N 0.00 -0.16 -0.04 -2.12 0.15 0.26 -4.99 113.70 106.81 2wzp s SER 55 Ca 0.35 0.32 -0.02 0.00 0.70 0.00 0.00 55.95 57.30 2wzp s SER 55 Cb -0.19 0.29 -0.04 0.00 -1.71 0.00 0.00 66.02 64.38 2wzp s SER 55 CO 0.19 -0.08 0.08 -0.63 1.20 0.00 0.00 173.24 174.01 2wzp s ILE 56 N 0.34 4.82 -0.11 6.45 1.09 -1.26 -0.95 121.20 131.58 2wzp s ILE 56 Ca -0.02 -0.27 0.02 0.00 -1.10 0.00 0.00 60.65 59.27 2wzp s ILE 56 Cb -0.03 -3.16 0.01 0.00 -1.06 0.00 0.00 42.46 38.22 2wzp s ILE 56 CO -0.01 0.43 -0.16 -0.89 -0.10 0.00 0.00 174.94 174.21 2wzp s THR 57 N -1.13 1.56 -0.31 2.92 2.01 -0.06 -4.99 115.64 115.65 2wzp s THR 57 Ca 0.20 -0.68 -0.16 0.00 0.31 0.00 0.00 61.69 61.37 2wzp s THR 57 Cb -0.12 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 2wzp s THR 57 CO 0.11 0.45 0.40 -1.10 -0.69 0.00 0.00 174.62 173.79 2wzp s GLN 58 N 0.97 3.80 0.80 4.92 -1.52 -1.26 -1.66 119.66 125.71 2wzp s GLN 58 Ca -0.07 -0.14 -0.11 0.00 -1.95 0.00 0.00 55.36 53.10 2wzp s GLN 58 Cb -0.15 -3.73 0.07 0.00 -0.22 0.00 0.00 33.01 28.98 2wzp s GLN 58 CO -0.02 -0.42 1.09 -1.25 -0.25 0.00 0.00 175.29 174.44 2wzp s PRO 59 N 2.11 2.07 0.64 2.91 0.04 -1.26 -4.82 135.00 136.69 2wzp s PRO 59 Ca 0.15 0.88 -0.16 0.00 0.04 0.00 0.00 61.00 61.90 2wzp s PRO 59 Cb -0.16 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 2wzp s PRO 59 CO 0.11 -1.69 1.15 -0.65 0.04 0.00 0.00 177.00 175.97 2wzp s GLN 60 N -5.01 2.78 -0.23 4.56 -0.21 -1.26 -4.75 119.66 115.53 2wzp s GLN 60 Ca 0.61 1.60 -0.05 0.00 0.02 0.00 0.00 55.36 57.54 2wzp s GLN 60 Cb -0.16 -1.93 -0.02 0.00 1.00 0.00 0.00 33.01 31.90 2wzp s GLN 60 CO 0.56 -1.31 0.01 0.42 -2.12 0.00 0.00 175.29 172.84 2wzp s ILE 61 N -2.01 3.80 -0.14 1.08 1.01 -0.75 -4.58 121.20 119.61 2wzp s ILE 61 Ca 0.72 -0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.99 2wzp s ILE 61 Cb -0.25 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 2wzp s ILE 61 CO 0.38 0.39 -0.03 -0.70 0.00 0.00 0.00 174.94 174.97 2wzp s GLU 62 N 1.51 3.49 0.22 2.79 2.12 -1.26 -0.66 118.70 126.92 2wzp s GLU 62 Ca 0.06 -0.50 0.10 0.00 0.36 0.00 0.00 54.97 54.98 2wzp s GLU 62 Cb -0.15 -2.87 -0.05 0.00 0.26 0.00 0.00 34.13 31.33 2wzp s GLU 62 CO -0.00 0.35 -0.19 -0.06 -0.54 0.00 0.00 175.26 174.82 2wzp s PHE 63 N 0.07 2.03 -0.17 5.30 0.08 0.04 0.01 117.98 125.34 2wzp s PHE 63 Ca 0.00 -0.43 -0.23 0.00 0.12 0.00 0.00 56.93 56.39 2wzp s PHE 63 Cb -0.13 -0.94 -0.02 0.00 -0.57 0.00 0.00 43.02 41.36 2wzp s PHE 63 CO 0.03 0.50 0.71 0.15 -0.10 0.00 0.00 175.22 176.51 2wzp s LYS 64 N -3.28 4.28 -0.29 0.44 1.02 0.14 -1.61 119.74 120.45 2wzp s LYS 64 Ca 0.24 0.80 -0.09 0.00 0.02 0.00 0.00 55.97 56.93 2wzp s LYS 64 Cb -0.04 -3.56 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 2wzp s LYS 64 CO 0.10 -0.22 0.13 -1.17 -0.92 0.00 0.00 175.35 173.26 2wzp s LEU 65 N 1.82 3.87 -0.05 3.17 2.96 0.07 -1.28 118.68 129.24 2wzp s LEU 65 Ca 0.33 -0.37 0.05 0.00 -0.22 0.00 0.00 54.13 53.93 2wzp s LEU 65 Cb -0.16 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 2wzp s LEU 65 CO 0.12 -0.13 -0.22 -0.70 -1.32 0.00 0.00 176.35 174.11 2wzp s GLU 66 N 1.62 2.24 0.01 1.98 2.12 -0.17 -0.42 118.70 126.09 2wzp s GLU 66 Ca 0.05 -0.79 0.00 0.00 0.36 0.00 0.00 54.97 54.60 2wzp s GLU 66 Cb -0.16 -1.92 -0.04 0.00 0.26 0.00 0.00 34.13 32.27 2wzp s GLU 66 CO 0.06 0.33 0.07 0.95 -0.54 0.00 0.00 175.26 176.12 2wzp s THR 67 N -0.09 4.60 -0.25 -1.70 -4.23 -0.77 -0.60 115.64 112.60 2wzp s THR 67 Ca -0.04 -0.50 0.13 0.00 -1.18 0.00 0.00 61.69 60.11 2wzp s THR 67 Cb -0.13 -3.11 0.47 0.00 1.34 0.00 0.00 72.50 71.07 2wzp s THR 67 CO 0.03 0.32 1.17 0.49 -0.54 0.00 0.00 174.62 176.09 2wzp n PHE 68 N 1.11 1.84 -2.32 3.99 3.01 0.16 -4.16 117.46 121.08 2wzp n PHE 68 Ca -0.13 -2.00 -0.34 0.00 1.01 0.00 0.00 57.45 55.99 2wzp n PHE 68 Cb 0.52 -0.29 -0.01 0.00 -0.01 0.00 0.00 39.48 39.70 2wzp n PHE 68 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2wzp s GLY 69 N -3.52 2.48 0.00 1.37 0.00 -1.26 -4.91 107.32 101.48 2wzp s GLY 69 Ca 0.42 0.66 0.23 0.00 0.00 0.00 0.00 44.72 46.03 2wzp s GLY 69 CO -0.01 0.99 1.63 1.18 0.00 0.00 0.00 173.10 176.90 2wzp n GLU 70 N -1.32 1.64 -3.87 2.90 1.02 -1.26 -4.79 120.64 114.95 2wzp n GLU 70 Ca 0.10 -0.95 -0.09 0.00 -0.02 0.00 0.00 57.16 56.21 2wzp n GLU 70 Cb 0.52 -1.41 -0.04 0.00 -0.02 0.00 0.00 31.44 30.49 2wzp n GLU 70 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2wzp s SER 71 N -1.69 -0.19 0.13 1.62 1.04 -1.24 -4.83 113.70 108.53 2wzp s SER 71 Ca 0.34 -0.69 -0.19 0.00 0.48 0.00 0.00 55.95 55.89 2wzp s SER 71 Cb 0.18 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 2wzp s SER 71 CO 0.28 -1.16 1.78 -0.07 0.98 0.00 0.00 173.24 175.05 2wzp h LEU 72 N 2.17 0.28 -0.04 2.42 -0.00 -1.75 -2.08 115.31 116.31 2wzp h LEU 72 Ca -0.25 -0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.66 2wzp h LEU 72 Cb 1.25 -0.06 -0.04 0.00 -0.00 0.00 0.00 40.66 41.81 2wzp h LEU 72 CO 0.33 0.20 -0.17 -0.08 -0.00 0.00 0.00 178.44 178.72 2wzp h GLU 73 N 0.33 -0.25 -0.67 1.13 4.81 -1.95 -0.73 114.58 117.25 2wzp h GLU 73 Ca 0.10 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2wzp h GLU 73 Cb -0.03 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 2wzp h GLU 73 CO -0.03 -0.17 0.43 1.49 -0.73 0.00 0.00 179.01 180.00 2wzp h GLU 74 N -0.26 0.85 -0.55 1.92 4.81 -1.91 -1.51 114.58 117.92 2wzp h GLU 74 Ca 0.07 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 2wzp h GLU 74 Cb 0.35 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2wzp h GLU 74 CO -0.19 0.56 0.05 -0.91 -0.73 0.00 0.00 179.01 177.79 2wzp h ASN 75 N 0.87 0.91 -0.48 1.04 2.35 -1.07 0.09 115.58 119.30 2wzp h ASN 75 Ca 0.25 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 2wzp h ASN 75 Cb -0.06 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.04 2wzp h ASN 75 CO -0.07 0.96 0.25 1.88 -1.65 0.00 0.00 177.43 178.80 2wzp h TYR 76 N 0.83 0.67 -0.34 1.19 0.05 -0.95 -2.01 116.97 116.41 2wzp h TYR 76 Ca 0.16 -0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.92 2wzp h TYR 76 Cb 0.46 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.98 2wzp h TYR 76 CO 0.03 0.51 0.19 0.37 -1.05 0.00 0.00 178.16 178.22 2wzp h GLN 77 N 0.63 0.46 0.19 4.88 5.75 -1.04 -1.71 115.11 124.26 2wzp h GLN 77 Ca 0.17 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.63 2wzp h GLN 77 Cb 0.07 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.51 2wzp h GLN 77 CO -0.02 0.37 -0.24 -0.07 -2.65 0.00 0.00 178.83 176.21 2wzp h LEU 78 N 0.43 -0.66 0.02 -2.39 3.38 -0.81 0.33 115.31 115.61 2wzp h LEU 78 Ca 0.12 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.19 2wzp h LEU 78 Cb 0.03 0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 2wzp h LEU 78 CO -0.02 -0.34 -0.24 0.24 0.09 0.00 0.00 178.44 178.17 2wzp h MET 79 N -0.48 -0.37 -0.40 1.13 2.86 -1.26 -0.51 114.93 115.89 2wzp h MET 79 Ca 0.01 0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.72 2wzp h MET 79 Cb 0.47 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.18 2wzp h MET 79 CO -0.09 -0.25 0.16 -0.22 1.06 0.00 0.00 176.91 177.57 2wzp h LYS 80 N -0.38 0.32 -0.20 1.72 3.64 -1.22 -1.99 116.57 118.46 2wzp h LYS 80 Ca 0.05 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 2wzp h LYS 80 Cb 0.45 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2wzp h LYS 80 CO -0.20 0.21 -0.10 -0.44 -2.27 0.00 0.00 179.45 176.65 2wzp h ASP 81 N 0.33 0.43 0.14 4.20 3.32 -0.67 -1.97 116.42 122.20 2wzp h ASP 81 Ca 0.18 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 2wzp h ASP 81 Cb 0.14 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 2wzp h ASP 81 CO -0.17 0.75 -0.08 0.15 -1.72 0.00 0.00 179.24 178.17 2wzp h PHE 82 N 0.11 -0.21 -0.30 4.55 3.57 -1.05 -1.54 116.94 122.07 2wzp h PHE 82 Ca 0.04 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2wzp h PHE 82 Cb 0.59 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 2wzp h PHE 82 CO 0.07 -0.13 0.12 0.28 -2.23 0.00 0.00 178.31 176.41 2wzp h VAL 83 N -0.22 1.18 0.00 1.41 2.07 -1.43 -2.61 116.25 116.65 2wzp h VAL 83 Ca -0.02 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 2wzp h VAL 83 Cb 0.18 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2wzp h VAL 83 CO 0.02 0.19 -0.10 0.78 0.02 0.00 0.00 177.57 178.48 2wzp h ASN 84 N 0.33 0.00 -0.03 0.57 2.35 -1.35 -0.02 115.58 117.44 2wzp h ASN 84 Ca 0.10 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.67 2wzp h ASN 84 Cb 0.19 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 2wzp h ASN 84 CO -0.01 0.10 -0.63 0.44 -1.65 0.00 0.00 177.43 175.68 2wzp h ASP 85 N 0.00 0.73 0.07 5.81 5.19 -1.08 -0.87 116.42 126.27 2wzp h ASP 85 Ca -0.00 -0.42 -0.00 0.00 -0.62 0.00 0.00 57.03 55.98 2wzp h ASP 85 Cb 0.66 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.96 2wzp h ASP 85 CO 0.01 1.17 -0.04 0.40 -3.12 0.00 0.00 179.24 177.67 2wzp h ILE 86 N 0.47 1.18 0.00 0.35 2.04 -1.08 -3.23 117.51 117.24 2wzp h ILE 86 Ca -0.01 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.88 2wzp h ILE 86 Cb 1.21 1.80 -0.00 0.00 -0.74 0.00 0.00 36.82 39.08 2wzp h ILE 86 CO 0.12 0.24 -0.02 -0.07 0.00 0.00 0.00 178.15 178.42 2wzp h LEU 87 N -0.54 0.00 -0.00 1.44 3.38 -0.97 -2.59 115.31 116.02 2wzp h LEU 87 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2wzp h LEU 87 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2wzp h LEU 87 CO 0.02 0.02 0.00 -1.54 0.09 0.00 0.00 178.44 177.03 2wzp n SER 88 N -3.55 0.02 -4.57 -0.43 3.41 -0.34 -4.84 113.62 103.32 2wzp n SER 88 Ca -0.03 0.50 -0.27 0.00 -0.26 0.00 0.00 58.87 58.82 2wzp n SER 88 Cb 0.11 -0.51 -0.09 0.00 -0.26 0.00 0.00 64.21 63.46 2wzp n SER 88 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2wzp s LYS 89 N -3.00 2.06 0.39 4.33 -0.14 -0.98 -5.02 119.74 117.37 2wzp s LYS 89 Ca 0.13 -1.27 0.06 0.00 -1.36 0.00 0.00 55.97 53.53 2wzp s LYS 89 Cb 0.18 -2.16 0.79 0.00 -1.68 0.00 0.00 37.83 34.96 2wzp s LYS 89 CO 0.51 0.43 2.02 -0.22 -0.76 0.00 0.00 175.35 177.33 2wzp h LYS 90 N 2.89 0.65 -2.98 1.68 3.64 -1.88 -3.45 116.57 117.11 2wzp h LYS 90 Ca -0.47 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 58.93 2wzp h LYS 90 Cb 1.21 -0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.82 2wzp h LYS 90 CO 0.54 0.43 0.23 -0.59 -2.27 0.00 0.00 179.45 177.79 2wzp s PHE 91 N -5.58 -0.26 0.16 1.91 -0.12 -1.26 -4.88 117.98 107.95 2wzp s PHE 91 Ca -0.09 -0.15 0.05 0.00 -0.05 0.00 0.00 56.93 56.69 2wzp s PHE 91 Cb 0.18 0.68 -0.05 0.00 -0.63 0.00 0.00 43.02 43.20 2wzp s PHE 91 CO 0.75 -1.15 -0.10 0.54 -0.05 0.00 0.00 175.22 175.21 2wzp s VAL 92 N -3.87 1.26 -0.15 -2.49 0.11 -0.17 -4.89 120.40 110.19 2wzp s VAL 92 Ca 0.09 -2.09 0.02 0.00 -2.93 0.00 0.00 61.98 57.07 2wzp s VAL 92 Cb -0.05 -1.93 0.01 0.00 -1.53 0.00 0.00 36.38 32.88 2wzp s VAL 92 CO 0.03 -0.68 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.02 2wzp s THR 93 N -3.27 2.10 -0.16 5.04 2.01 -0.35 -0.19 115.64 120.82 2wzp s THR 93 Ca 0.19 -0.95 -0.18 0.00 0.31 0.00 0.00 61.69 61.05 2wzp s THR 93 Cb 0.02 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 2wzp s THR 93 CO 0.02 0.54 0.51 -0.22 -0.69 0.00 0.00 174.62 174.78 2wzp s LEU 94 N 0.98 4.21 -0.19 4.42 2.96 0.18 -0.46 118.68 130.79 2wzp s LEU 94 Ca -0.03 0.76 -0.13 0.00 -0.22 0.00 0.00 54.13 54.51 2wzp s LEU 94 Cb -0.15 -2.72 -0.05 0.00 0.50 0.00 0.00 46.19 43.78 2wzp s LEU 94 CO -0.06 -0.09 0.25 -0.70 -1.32 0.00 0.00 176.35 174.44 2wzp s GLU 95 N 1.13 4.21 -0.27 1.98 2.12 0.26 -1.18 118.70 126.94 2wzp s GLU 95 Ca 0.25 -0.01 0.03 0.00 0.36 0.00 0.00 54.97 55.60 2wzp s GLU 95 Cb -0.15 -3.46 0.07 0.00 0.26 0.00 0.00 34.13 30.85 2wzp s GLU 95 CO 0.10 0.19 -0.06 -0.47 -0.54 0.00 0.00 175.26 174.48 2wzp s TYR 96 N 0.64 3.14 -0.08 5.30 5.04 0.53 -2.51 117.35 129.41 2wzp s TYR 96 Ca 0.14 -2.33 0.05 0.00 -2.44 0.00 0.00 57.07 52.48 2wzp s TYR 96 Cb -0.13 -2.06 -0.00 0.00 0.35 0.00 0.00 41.96 40.12 2wzp s TYR 96 CO 0.03 -0.87 -0.23 -1.14 -1.34 0.00 0.00 175.55 172.00 2wzp s GLN 97 N 1.14 2.65 0.19 4.97 0.74 -0.41 -1.03 119.66 127.90 2wzp s GLN 97 Ca -0.03 -0.82 0.02 0.00 0.05 0.00 0.00 55.36 54.57 2wzp s GLN 97 Cb -0.19 -2.11 -0.01 0.00 1.10 0.00 0.00 33.01 31.80 2wzp s GLN 97 CO -0.07 0.24 0.07 0.25 -0.55 0.00 0.00 175.29 175.24 2wzp n THR 98 N 3.32 0.00 0.37 -0.34 -2.24 0.11 -0.27 114.28 115.24 2wzp n THR 98 Ca -0.19 -1.10 0.14 0.00 -2.27 0.00 0.00 64.05 60.63 2wzp n THR 98 Cb 0.53 0.40 0.47 0.00 -2.10 0.00 0.00 70.33 69.63 2wzp n THR 98 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2wzp h GLU 99 N 0.00 0.00 0.00 -0.78 5.08 -1.91 -3.26 114.58 113.70 2wzp h GLU 99 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2wzp h GLU 99 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2wzp h GLU 99 CO 0.23 0.00 -0.91 0.44 -1.00 0.00 0.00 179.01 177.77 2wzp n ILE 100 N -2.67 0.00 -3.53 3.13 -5.35 -1.26 -5.05 119.36 104.63 2wzp n ILE 100 Ca 0.03 -0.20 -0.11 0.00 -0.27 0.00 0.00 62.75 62.20 2wzp n ILE 100 Cb 0.35 0.81 -0.03 0.00 -1.74 0.00 0.00 39.64 39.03 2wzp n ILE 100 CO 0.00 0.00 0.00 0.72 -1.76 0.00 0.00 176.55 175.51 2wzp s PHE 101 N -2.52 -0.40 -0.32 4.28 -0.12 -1.23 -5.11 117.98 112.56 2wzp s PHE 101 Ca 0.03 0.13 -0.01 0.00 -0.05 0.00 0.00 56.93 57.03 2wzp s PHE 101 Cb 0.11 0.49 0.13 0.00 -0.63 0.00 0.00 43.02 43.11 2wzp s PHE 101 CO 0.60 -0.86 0.22 -1.14 -0.05 0.00 0.00 175.22 174.00 2wzp s GLN 102 N -3.79 0.38 0.33 1.99 0.74 -1.26 -0.71 119.66 117.34 2wzp s GLN 102 Ca 0.03 -0.70 0.10 0.00 0.05 0.00 0.00 55.36 54.84 2wzp s GLN 102 Cb -0.01 -1.02 -0.06 0.00 1.10 0.00 0.00 33.01 33.02 2wzp s GLN 102 CO -0.10 -1.10 -0.12 0.14 -0.55 0.00 0.00 175.29 173.56 2wzp s VAL 103 N 1.79 2.26 0.16 1.34 -7.23 -0.20 -4.88 120.40 113.64 2wzp s VAL 103 Ca 0.13 -2.25 0.07 0.00 -1.81 0.00 0.00 61.98 58.11 2wzp s VAL 103 Cb -0.17 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.17 2wzp s VAL 103 CO -0.21 -0.25 -0.14 -0.31 -0.31 0.00 0.00 175.10 173.87 2wzp s TYR 104 N -2.61 1.54 -0.04 2.82 2.02 -0.39 -0.35 117.35 120.34 2wzp s TYR 104 Ca 0.32 -0.59 -0.01 0.00 -0.37 0.00 0.00 57.07 56.42 2wzp s TYR 104 Cb 0.01 -0.76 0.03 0.00 -0.40 0.00 0.00 41.96 40.84 2wzp s TYR 104 CO 0.16 0.23 0.06 0.00 -1.57 0.00 0.00 175.55 174.43 2wzp s ALA 105 N -2.64 0.14 -0.27 3.71 0.00 -0.33 -0.65 121.76 121.73 2wzp s ALA 105 Ca 0.16 0.27 -0.25 0.00 0.00 0.00 0.00 51.96 52.14 2wzp s ALA 105 Cb -0.02 -0.50 -0.00 0.00 0.00 0.00 0.00 23.12 22.59 2wzp s ALA 105 CO 0.04 -0.36 0.86 -0.51 0.00 0.00 0.00 175.76 175.79 2wzp s ASP 106 N 1.79 6.81 0.15 0.00 1.01 0.55 -0.64 116.67 126.33 2wzp s ASP 106 Ca -0.00 0.95 0.08 0.00 0.71 0.00 0.00 52.55 54.29 2wzp s ASP 106 Cb -0.12 -2.44 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2wzp s ASP 106 CO -0.03 -0.59 -0.19 -0.76 0.21 0.00 0.00 175.17 173.81 2wzp s LEU 107 N 2.98 2.40 -0.08 1.23 1.43 0.74 -1.14 118.68 126.25 2wzp s LEU 107 Ca 0.36 -0.82 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2wzp s LEU 107 Cb -0.15 -0.83 0.01 0.00 0.03 0.00 0.00 46.19 45.25 2wzp s LEU 107 CO 0.10 -0.02 -0.16 0.00 0.23 0.00 0.00 176.35 176.49 2wzp s ALA 108 N -1.84 1.57 0.13 4.21 0.00 -0.29 -1.00 121.76 124.54 2wzp s ALA 108 Ca 0.13 -0.61 -0.34 0.00 0.00 0.00 0.00 51.96 51.14 2wzp s ALA 108 Cb -0.07 -0.64 -0.14 0.00 0.00 0.00 0.00 23.12 22.27 2wzp s ALA 108 CO 0.06 0.18 1.59 -0.11 0.00 0.00 0.00 175.76 177.48 2wzp n LEU 109 N 3.68 3.05 -0.10 0.00 7.94 -1.26 0.40 117.00 130.71 2wzp n LEU 109 Ca -0.21 1.07 -0.14 0.00 -1.11 0.00 0.00 56.01 55.62 2wzp n LEU 109 Cb 0.52 -1.41 -0.10 0.00 0.53 0.00 0.00 43.42 42.96 2wzp n LEU 109 CO 0.26 -0.30 -1.16 0.00 -1.11 0.00 0.00 177.39 175.07 2wzp n ALA 110 N 3.67 1.56 -3.55 1.96 0.00 0.88 -4.73 120.51 120.31 2wzp n ALA 110 Ca 0.18 -0.90 -0.09 0.00 0.00 0.00 0.00 53.44 52.62 2wzp n ALA 110 Cb 0.28 0.01 -0.04 0.00 0.00 0.00 0.00 19.45 19.71 2wzp n ALA 110 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2wzp s ASP 111 N -5.92 -0.36 -0.09 0.00 1.47 -1.08 -4.98 116.67 105.70 2wzp s ASP 111 Ca -0.26 0.22 -0.07 0.00 1.18 0.00 0.00 52.55 53.62 2wzp s ASP 111 Cb 0.07 0.33 0.03 0.00 -0.34 0.00 0.00 42.92 43.01 2wzp s ASP 111 CO 0.49 -0.46 0.22 0.54 0.68 0.00 0.00 175.17 176.65 2wzp s VAL 112 N -2.04 -0.01 0.16 2.11 0.11 -1.26 -0.71 120.40 118.76 2wzp s VAL 112 Ca 0.01 0.05 0.03 0.00 -2.93 0.00 0.00 61.98 59.15 2wzp s VAL 112 Cb -0.01 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 2wzp s VAL 112 CO -0.03 0.02 0.27 0.42 -3.33 0.00 0.00 175.10 172.45 2wzp s THR 113 N 0.49 5.18 -0.12 5.04 -4.23 -0.89 -5.02 115.64 116.09 2wzp s THR 113 Ca -0.03 -0.79 -0.04 0.00 -1.18 0.00 0.00 61.69 59.65 2wzp s THR 113 Cb -0.05 -3.68 0.06 0.00 1.34 0.00 0.00 72.50 70.17 2wzp s THR 113 CO -0.03 -0.13 0.18 -0.75 -0.54 0.00 0.00 174.62 173.36 2wzp s LYS 114 N -3.31 0.07 0.17 3.99 2.20 -1.26 -4.62 119.74 116.99 2wzp s LYS 114 Ca 0.34 0.48 0.02 0.00 -0.36 0.00 0.00 55.97 56.45 2wzp s LYS 114 Cb -0.11 -0.50 -0.01 0.00 -1.51 0.00 0.00 37.83 35.70 2wzp s LYS 114 CO 0.28 -0.39 0.06 0.25 -0.36 0.00 0.00 175.35 175.19 2wzp n THR 115 N 5.32 0.00 -3.68 3.43 -2.24 -1.26 -5.13 114.28 110.72 2wzp n THR 115 Ca -0.05 -1.00 -0.30 0.00 -2.27 0.00 0.00 64.05 60.44 2wzp n THR 115 Cb 0.50 0.36 -0.14 0.00 -2.10 0.00 0.00 70.33 68.95 2wzp n THR 115 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wzp s GLU 116 N -2.65 0.80 -0.42 -0.78 2.02 -1.26 -4.95 118.70 111.46 2wzp s GLU 116 Ca 0.09 -1.29 0.08 0.00 0.02 0.00 0.00 54.97 53.87 2wzp s GLU 116 Cb 0.00 -1.93 0.36 0.00 0.10 0.00 0.00 34.13 32.66 2wzp s GLU 116 CO 0.06 -1.06 1.20 0.41 0.02 0.00 0.00 175.26 175.90 2wzp n GLY 117 N 4.46 1.16 3.77 -1.39 0.00 -1.26 -5.15 105.19 106.78 2wzp n GLY 117 Ca 0.02 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 2wzp n GLY 117 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wzp s TYR 118 N -0.10 2.90 0.00 1.61 1.51 -1.26 -4.93 117.35 117.08 2wzp s TYR 118 Ca 0.23 1.48 0.00 0.00 -1.01 0.00 0.00 57.07 57.77 2wzp s TYR 118 Cb 0.36 -3.53 0.00 0.00 -0.11 0.00 0.00 41.96 38.67 2wzp s TYR 118 CO -0.07 -1.76 0.00 0.41 -1.11 0.00 0.00 175.55 173.03 2wzp n GLY 119 N 0.64 1.13 3.68 0.71 0.00 -1.25 -4.93 105.19 105.18 2wzp n GLY 119 Ca 0.05 -1.97 -0.45 0.00 0.00 0.00 0.00 46.02 43.65 2wzp n GLY 119 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wzp n LYS 120 N -0.51 2.22 -1.51 1.61 5.02 -1.26 -2.10 118.16 121.63 2wzp n LYS 120 Ca 0.00 0.80 -0.15 0.00 -2.02 0.00 0.00 58.31 56.94 2wzp n LYS 120 Cb 0.00 -2.55 -0.06 0.00 -0.02 0.00 0.00 35.03 32.40 2wzp n LYS 120 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wzp n ASN 121 N 3.04 -4.79 -1.72 4.39 4.13 -1.26 -3.20 115.26 115.86 2wzp n ASN 121 Ca 0.15 0.34 -0.13 0.00 1.68 0.00 0.00 54.58 56.62 2wzp n ASN 121 Cb 0.31 -3.64 0.01 0.00 -1.54 0.00 0.00 39.78 34.92 2wzp n ASN 121 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wzp n GLY 122 N -1.12 -0.08 3.76 7.41 0.00 -0.89 -2.20 105.19 112.07 2wzp n GLY 122 Ca -0.15 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 2wzp n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wzp s THR 123 N -2.81 2.77 0.09 2.61 -4.23 -1.19 -4.80 115.64 108.09 2wzp s THR 123 Ca 0.11 0.55 -0.09 0.00 -1.18 0.00 0.00 61.69 61.09 2wzp s THR 123 Cb -0.05 -3.27 -0.06 0.00 1.34 0.00 0.00 72.50 70.47 2wzp s THR 123 CO 0.14 -0.03 0.40 -0.36 -0.54 0.00 0.00 174.62 174.22 2wzp s PHE 124 N -1.51 3.56 -0.31 3.99 0.08 -1.26 -3.76 117.98 118.76 2wzp s PHE 124 Ca 0.69 0.74 -0.02 0.00 0.12 0.00 0.00 56.93 58.46 2wzp s PHE 124 Cb -0.31 -2.13 0.12 0.00 -0.57 0.00 0.00 43.02 40.12 2wzp s PHE 124 CO 0.37 0.50 0.17 0.45 -0.10 0.00 0.00 175.22 176.60 2wzp s SER 125 N -1.90 3.26 0.33 1.36 0.15 -1.25 -1.84 113.70 113.80 2wzp s SER 125 Ca 0.35 -1.59 0.01 0.00 0.70 0.00 0.00 55.95 55.42 2wzp s SER 125 Cb -0.13 -0.33 -0.00 0.00 -1.71 0.00 0.00 66.02 63.84 2wzp s SER 125 CO 0.19 -0.39 0.04 -0.62 1.20 0.00 0.00 173.24 173.66 2wzp n GLU 126 N 4.82 0.96 -4.96 5.44 -0.58 0.44 -4.94 120.64 121.82 2wzp n GLU 126 Ca 0.01 -2.52 -0.28 0.00 -0.42 0.00 0.00 57.16 53.94 2wzp n GLU 126 Cb 0.40 0.94 -0.17 0.00 -0.57 0.00 0.00 31.44 32.05 2wzp n GLU 126 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2wzp s LYS 127 N -3.20 2.29 -0.08 3.49 2.47 -1.26 -0.75 119.74 122.70 2wzp s LYS 127 Ca 0.06 -0.69 0.03 0.00 -1.56 0.00 0.00 55.97 53.80 2wzp s LYS 127 Cb 0.00 -1.85 0.01 0.00 -1.46 0.00 0.00 37.83 34.53 2wzp s LYS 127 CO 0.04 0.19 -0.15 -1.50 0.16 0.00 0.00 175.35 174.09 2wzp s ILE 128 N 0.26 1.41 -0.02 5.43 2.07 -0.63 -2.09 121.20 127.63 2wzp s ILE 128 Ca -0.11 -0.63 0.07 0.00 -1.41 0.00 0.00 60.65 58.56 2wzp s ILE 128 Cb -0.15 -1.27 -0.02 0.00 0.13 0.00 0.00 42.46 41.15 2wzp s ILE 128 CO 0.05 0.42 -0.22 -0.89 -1.91 0.00 0.00 174.94 172.39 2wzp s THR 129 N 0.65 2.39 -0.01 4.00 2.01 0.11 -0.78 115.64 124.01 2wzp s THR 129 Ca -0.14 -1.04 0.07 0.00 0.31 0.00 0.00 61.69 60.89 2wzp s THR 129 Cb -0.16 -1.89 -0.02 0.00 0.01 0.00 0.00 72.50 70.44 2wzp s THR 129 CO 0.04 0.54 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.93 2wzp s PHE 130 N -0.69 2.00 0.08 4.92 0.08 0.17 -0.08 117.98 124.46 2wzp s PHE 130 Ca 0.11 -0.38 -0.17 0.00 0.12 0.00 0.00 56.93 56.61 2wzp s PHE 130 Cb -0.10 -1.28 -0.07 0.00 -0.57 0.00 0.00 43.02 41.00 2wzp s PHE 130 CO 0.00 -0.03 0.54 -0.51 -0.10 0.00 0.00 175.22 175.12 2wzp s ASP 131 N -0.55 6.95 0.06 1.36 1.01 0.16 -1.81 116.67 123.85 2wzp s ASP 131 Ca 0.09 1.16 -0.28 0.00 0.71 0.00 0.00 52.55 54.22 2wzp s ASP 131 Cb -0.09 -2.32 -0.05 0.00 1.01 0.00 0.00 42.92 41.47 2wzp s ASP 131 CO -0.01 0.24 0.90 -0.63 0.21 0.00 0.00 175.17 175.88 2wzp s ILE 132 N -1.20 4.67 -0.06 0.77 -1.09 -1.26 -1.14 121.20 121.88 2wzp s ILE 132 Ca 0.30 1.93 -0.08 0.00 -2.23 0.00 0.00 60.65 60.57 2wzp s ILE 132 Cb -0.18 -4.26 -0.04 0.00 -1.58 0.00 0.00 42.46 36.41 2wzp s ILE 132 CO 0.18 0.29 -0.17 -0.38 -1.23 0.00 0.00 174.94 173.63 2wzp n ILE 133 N 3.10 1.23 -3.55 2.92 5.41 -0.29 -4.93 119.36 123.24 2wzp n ILE 133 Ca 0.02 0.18 -0.29 0.00 1.00 0.00 0.00 62.75 63.65 2wzp n ILE 133 Cb 0.50 -1.90 -0.15 0.00 -0.71 0.00 0.00 39.64 37.38 2wzp n ILE 133 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2wzp s THR 134 N -2.40 0.05 -0.27 1.39 2.01 -1.02 -4.98 115.64 110.42 2wzp s THR 134 Ca -0.15 -0.94 -0.11 0.00 0.31 0.00 0.00 61.69 60.80 2wzp s THR 134 Cb 0.03 -1.07 -0.05 0.00 0.01 0.00 0.00 72.50 71.43 2wzp s THR 134 CO 0.22 -0.76 0.21 -0.75 -0.69 0.00 0.00 174.62 172.85 2wzp s LYS 135 N 1.93 3.98 -0.15 4.92 2.20 -1.26 -0.33 119.74 131.02 2wzp s LYS 135 Ca 0.10 -0.26 -0.04 0.00 -0.36 0.00 0.00 55.97 55.41 2wzp s LYS 135 Cb -0.17 -3.64 0.01 0.00 -1.51 0.00 0.00 37.83 32.53 2wzp s LYS 135 CO -0.31 -0.15 0.08 0.91 -0.36 0.00 0.00 175.35 175.51 2wzp n TRP 136 N 4.97 -2.59 -4.13 4.03 5.03 -0.08 -4.55 117.44 120.11 2wzp n TRP 136 Ca -0.13 1.34 -0.09 0.00 3.03 0.00 0.00 57.50 61.64 2wzp n TRP 136 Cb 0.52 -3.01 -0.10 0.00 -1.03 0.00 0.00 31.31 27.69 2wzp n TRP 136 CO 0.00 0.00 0.00 1.52 -0.03 0.00 0.00 177.69 179.18 2wzp s TYR 137 N -0.71 0.75 0.07 -5.99 -0.85 0.18 -2.48 117.35 108.31 2wzp s TYR 137 Ca -0.09 -1.16 -0.06 0.00 -0.52 0.00 0.00 57.07 55.24 2wzp s TYR 137 Cb 0.01 -0.46 -0.01 0.00 0.38 0.00 0.00 41.96 41.88 2wzp s TYR 137 CO 0.48 -0.45 0.12 0.95 -1.52 0.00 0.00 175.55 175.14 2wzp s THR 138 N -3.97 0.16 -0.11 -3.49 -4.23 -1.22 -1.27 115.64 101.51 2wzp s THR 138 Ca 0.17 -1.31 -0.05 0.00 -1.18 0.00 0.00 61.69 59.32 2wzp s THR 138 Cb 0.08 -1.30 -0.04 0.00 1.34 0.00 0.00 72.50 72.58 2wzp s THR 138 CO -0.03 -0.72 0.07 -0.31 -0.54 0.00 0.00 174.62 173.09 2wzp s TYR 139 N -3.63 3.38 -0.10 3.99 2.02 -1.26 -0.98 117.35 120.77 2wzp s TYR 139 Ca 0.04 0.34 0.03 0.00 -0.37 0.00 0.00 57.07 57.10 2wzp s TYR 139 Cb 0.05 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.72 2wzp s TYR 139 CO -0.09 0.56 -0.17 -2.00 -1.57 0.00 0.00 175.55 172.27 2wzp s GLU 140 N -0.80 2.35 -0.23 -0.62 2.12 -0.25 -4.96 118.70 116.31 2wzp s GLU 140 Ca 0.13 -0.62 -0.09 0.00 0.36 0.00 0.00 54.97 54.74 2wzp s GLU 140 Cb -0.12 -1.89 -0.04 0.00 0.26 0.00 0.00 34.13 32.33 2wzp s GLU 140 CO 0.03 0.03 0.12 -0.80 -0.54 0.00 0.00 175.26 174.10 2wzp s ASN 141 N 0.70 5.81 0.01 -1.70 0.01 -1.26 -0.53 114.94 117.98 2wzp s ASN 141 Ca -0.12 0.03 0.04 0.00 -0.71 0.00 0.00 52.86 52.09 2wzp s ASN 141 Cb -0.16 -2.04 -0.01 0.00 0.41 0.00 0.00 41.25 39.45 2wzp s ASN 141 CO 0.03 0.06 -0.11 -0.76 -1.51 0.00 0.00 177.10 174.80 2wzp s LEU 142 N 1.09 2.09 -0.08 0.60 1.43 -0.08 -5.01 118.68 118.71 2wzp s LEU 142 Ca 0.06 -0.30 0.05 0.00 -1.03 0.00 0.00 54.13 52.91 2wzp s LEU 142 Cb -0.14 -0.53 -0.01 0.00 0.03 0.00 0.00 46.19 45.55 2wzp s LEU 142 CO 0.04 0.07 -0.23 -0.89 0.23 0.00 0.00 176.35 175.58 2wzp s THR 143 N -0.52 2.22 -0.14 5.49 2.01 -1.26 -0.07 115.64 123.37 2wzp s THR 143 Ca 0.02 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 61.05 2wzp s THR 143 Cb -0.06 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.62 2wzp s THR 143 CO 0.00 0.56 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.94 2wzp s PHE 144 N 0.04 2.69 -0.07 4.92 0.08 0.03 -4.91 117.98 120.75 2wzp s PHE 144 Ca -0.09 -1.14 0.03 0.00 0.12 0.00 0.00 56.93 55.85 2wzp s PHE 144 Cb -0.15 -1.82 0.01 0.00 -0.57 0.00 0.00 43.02 40.48 2wzp s PHE 144 CO 0.06 -0.50 -0.17 -0.51 -0.10 0.00 0.00 175.22 173.99 2wzp s ASP 145 N 0.69 2.28 -0.83 1.36 1.01 -0.01 -1.37 116.67 119.80 2wzp s ASP 145 Ca -0.09 -0.39 -0.23 0.00 0.71 0.00 0.00 52.55 52.55 2wzp s ASP 145 Cb -0.16 -0.96 0.07 0.00 1.01 0.00 0.00 42.92 42.88 2wzp s ASP 145 CO 0.01 0.10 1.21 -0.75 0.21 0.00 0.00 175.17 175.95 2wzp s LYS 146 N 0.43 3.36 -0.14 8.23 2.47 -0.24 -2.76 119.74 131.09 2wzp s LYS 146 Ca -0.14 -0.96 -0.04 0.00 -1.56 0.00 0.00 55.97 53.28 2wzp s LYS 146 Cb -0.16 -4.67 -0.03 0.00 -1.46 0.00 0.00 37.83 31.51 2wzp s LYS 146 CO 0.05 -2.00 0.01 0.42 0.16 0.00 0.00 175.35 173.99 2wzp s ILE 147 N 4.45 4.31 -0.02 5.43 -1.09 -1.26 -4.99 121.20 128.02 2wzp s ILE 147 Ca 0.34 -0.22 0.01 0.00 -2.23 0.00 0.00 60.65 58.55 2wzp s ILE 147 Cb -0.08 -2.88 -0.03 0.00 -1.58 0.00 0.00 42.46 37.89 2wzp s ILE 147 CO 0.02 0.52 -0.03 -1.10 -1.23 0.00 0.00 174.94 173.12 2wzp s GLN 148 N -0.08 2.75 0.64 2.79 -1.52 -1.26 -4.53 119.66 118.45 2wzp s GLN 148 Ca 0.04 -0.60 -0.15 0.00 -1.95 0.00 0.00 55.36 52.70 2wzp s GLN 148 Cb -0.13 -2.63 -0.01 0.00 -0.22 0.00 0.00 33.01 30.03 2wzp s GLN 148 CO 0.02 0.64 1.10 -0.80 -0.25 0.00 0.00 175.29 176.00 2wzp s ASN 149 N -1.29 5.25 1.02 5.90 0.01 -1.26 -5.05 114.94 119.51 2wzp s ASN 149 Ca 0.17 1.96 -0.16 0.00 -0.71 0.00 0.00 52.86 54.12 2wzp s ASN 149 Cb -0.11 -2.55 0.22 0.00 0.41 0.00 0.00 41.25 39.22 2wzp s ASN 149 CO 0.07 -1.53 1.26 0.61 -1.51 0.00 0.00 177.10 176.00 2wzp n GLY 150 N -0.62 -1.59 3.90 0.66 0.00 0.44 -4.99 105.19 102.98 2wzp n GLY 150 Ca 0.10 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.15 2wzp n GLY 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wzp s LYS 151 N -5.76 3.64 -0.36 1.61 -0.14 -1.26 -4.68 119.74 112.79 2wzp s LYS 151 Ca 0.72 0.19 -0.22 0.00 -1.36 0.00 0.00 55.97 55.29 2wzp s LYS 151 Cb -0.02 -2.48 0.01 0.00 -1.68 0.00 0.00 37.83 33.65 2wzp s LYS 151 CO 0.51 0.00 0.74 0.08 -0.76 0.00 0.00 175.35 175.92 2wzp s VAL 152 N -2.39 4.78 -0.26 3.17 1.01 -1.26 -4.72 120.40 120.73 2wzp s VAL 152 Ca 0.47 0.82 -0.01 0.00 0.00 0.00 0.00 61.98 63.26 2wzp s VAL 152 Cb -0.10 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.14 2wzp s VAL 152 CO 0.35 -0.38 -0.05 -0.63 0.00 0.00 0.00 175.10 174.38 2wzp s ILE 153 N 2.98 2.85 -0.01 2.22 1.01 -1.26 -5.01 121.20 123.98 2wzp s ILE 153 Ca 0.29 -1.11 -0.32 0.00 0.00 0.00 0.00 60.65 59.51 2wzp s ILE 153 Cb -0.14 -2.49 -0.11 0.00 0.01 0.00 0.00 42.46 39.74 2wzp s ILE 153 CO 0.16 0.14 1.91 0.00 0.00 0.00 0.00 174.94 177.15 2wzp n ALA 154 N 4.65 1.30 0.00 9.38 0.00 -1.26 -0.90 120.51 133.68 2wzp n ALA 154 Ca -0.16 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2wzp n ALA 154 Cb 0.46 -2.59 0.00 0.00 0.00 0.00 0.00 19.45 17.33 2wzp n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wzp n GLY 155 N 4.44 2.29 1.03 0.00 0.00 -1.26 -4.88 105.19 106.80 2wzp n GLY 155 Ca 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.23 2wzp n GLY 155 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2wzp n MET 156 N -1.26 0.00 -2.25 1.61 2.00 -0.08 -4.74 117.12 112.42 2wzp n MET 156 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 57.70 57.35 2wzp n MET 156 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 33.22 32.72 2wzp n MET 156 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2wzp s SER 157 N -5.68 5.70 -0.47 7.83 0.01 -0.30 -0.89 113.70 119.89 2wzp s SER 157 Ca -0.00 2.18 -0.29 0.00 1.31 0.00 0.00 55.95 59.15 2wzp s SER 157 Cb 0.00 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.67 2wzp s SER 157 CO 0.00 -1.23 1.23 -0.75 0.41 0.00 0.00 173.24 172.90 2wzp s LYS 158 N -3.30 3.65 -0.17 12.44 2.20 0.06 -4.74 119.74 129.87 2wzp s LYS 158 Ca 0.73 0.63 -0.28 0.00 -0.36 0.00 0.00 55.97 56.69 2wzp s LYS 158 Cb -0.24 -3.96 0.08 0.00 -1.51 0.00 0.00 37.83 32.21 2wzp s LYS 158 CO 0.27 -1.48 0.77 -1.50 -0.36 0.00 0.00 175.35 173.06 2wzp s ILE 159 N 4.82 0.00 -1.19 5.43 2.07 -1.26 -4.85 121.20 126.22 2wzp s ILE 159 Ca 0.51 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.66 2wzp s ILE 159 Cb -0.09 -1.00 0.22 0.00 0.13 0.00 0.00 42.46 41.72 2wzp s ILE 159 CO 0.31 0.00 1.54 -1.22 -1.91 0.00 0.00 174.94 173.66 2wzp n TYR 160 N 1.69 3.81 -2.98 3.50 4.01 -1.26 -3.79 117.16 122.15 2wzp n TYR 160 Ca -0.15 -3.11 -0.20 0.00 -0.16 0.00 0.00 57.90 54.27 2wzp n TYR 160 Cb 0.56 -1.83 0.08 0.00 -0.31 0.00 0.00 39.34 37.83 2wzp n TYR 160 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2wzp s GLY 161 N 0.97 1.71 0.00 2.72 0.00 -0.83 -3.92 107.32 107.96 2wzp s GLY 161 Ca 0.37 -2.16 0.00 0.00 0.00 0.00 0.00 44.72 42.93 2wzp s GLY 161 CO 0.01 -1.64 0.00 0.61 0.00 0.00 0.00 173.10 172.08 2wzp n GLY 162 N -2.38 0.04 3.78 0.20 0.00 -1.26 -0.17 105.19 105.39 2wzp n GLY 162 Ca 0.17 -1.43 -0.36 0.00 0.00 0.00 0.00 46.02 44.40 2wzp n GLY 162 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wzp s THR 163 N 0.00 3.55 0.32 2.61 -4.23 -1.26 -4.68 115.64 111.95 2wzp s THR 163 Ca 0.00 1.17 -0.28 0.00 -1.18 0.00 0.00 61.69 61.39 2wzp s THR 163 Cb 0.00 -3.59 -0.13 0.00 1.34 0.00 0.00 72.50 70.12 2wzp s THR 163 CO 0.00 -0.01 1.26 0.00 -0.54 0.00 0.00 174.62 175.32 2wzp n ALA 164 N -0.25 1.04 -0.30 3.99 0.00 -1.26 -1.17 120.51 122.56 2wzp n ALA 164 Ca 0.06 0.37 -0.14 0.00 0.00 0.00 0.00 53.44 53.73 2wzp n ALA 164 Cb 0.49 -2.22 0.10 0.00 0.00 0.00 0.00 19.45 17.82 2wzp n ALA 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wzp n PRO 165 N 0.73 1.73 -0.05 0.00 -0.04 -1.26 -5.06 135.00 131.06 2wzp n PRO 165 Ca 0.06 -1.73 0.00 0.00 -0.04 0.00 0.00 63.50 61.80 2wzp n PRO 165 Cb 0.35 -1.68 -0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2wzp n PRO 165 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wzp n GLY 166 N -0.42 -2.77 3.65 0.55 0.00 -0.31 -4.91 105.19 100.98 2wzp n GLY 166 Ca 0.34 -1.34 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 2wzp n GLY 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wzp s ASN 167 N -3.42 -0.25 0.27 1.61 2.20 0.76 -4.70 114.94 111.41 2wzp s ASN 167 Ca 0.00 -0.59 0.02 0.00 -0.94 0.00 0.00 52.86 51.35 2wzp s ASN 167 Cb 0.00 0.64 -0.04 0.00 -2.00 0.00 0.00 41.25 39.84 2wzp s ASN 167 CO 0.00 -1.18 0.13 -0.72 -2.94 0.00 0.00 177.10 172.39 2wzp s TYR 168 N -3.91 1.51 0.05 1.54 -0.85 -1.25 -1.97 117.35 112.48 2wzp s TYR 168 Ca 0.12 -1.29 0.00 0.00 -0.52 0.00 0.00 57.07 55.38 2wzp s TYR 168 Cb -0.03 -0.84 -0.03 0.00 0.38 0.00 0.00 41.96 41.44 2wzp s TYR 168 CO 0.03 -0.45 -0.04 0.15 -1.52 0.00 0.00 175.55 173.71 2wzp s LYS 169 N -3.96 0.59 -0.38 -3.49 1.02 -1.26 -5.10 119.74 107.16 2wzp s LYS 169 Ca 0.37 -1.08 -0.16 0.00 0.02 0.00 0.00 55.97 55.12 2wzp s LYS 169 Cb 0.07 0.06 0.01 0.00 -0.52 0.00 0.00 37.83 37.44 2wzp s LYS 169 CO 0.15 -0.06 0.38 0.71 -0.92 0.00 0.00 175.35 175.60 2wzp s TYR 170 N -3.13 3.20 -0.17 3.18 2.02 -1.26 -3.75 117.35 117.44 2wzp s TYR 170 Ca 0.02 -0.25 0.00 0.00 -0.37 0.00 0.00 57.07 56.47 2wzp s TYR 170 Cb 0.02 -2.74 0.04 0.00 -0.40 0.00 0.00 41.96 38.88 2wzp s TYR 170 CO -0.06 -0.56 -0.09 0.42 -1.57 0.00 0.00 175.55 173.69 2wzp s ILE 171 N 2.01 1.38 -0.49 2.71 1.01 -1.26 -4.89 121.20 121.66 2wzp s ILE 171 Ca 0.11 -0.74 -0.46 0.00 0.00 0.00 0.00 60.65 59.56 2wzp s ILE 171 Cb -0.17 -1.46 -0.20 0.00 0.01 0.00 0.00 42.46 40.65 2wzp s ILE 171 CO 0.12 0.22 1.71 0.29 0.00 0.00 0.00 174.94 177.28 2wzp n LYS 172 N 4.79 0.05 -0.43 2.79 5.02 -1.26 0.27 118.16 129.39 2wzp n LYS 172 Ca -0.14 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2wzp n LYS 172 Cb 0.48 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 2wzp n LYS 172 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wzp n GLY 173 N 4.65 1.33 0.00 0.72 0.00 -1.26 -4.53 105.19 106.10 2wzp n GLY 173 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2wzp n GLY 173 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wzp n THR 174 N -2.00 0.00 0.00 2.61 -2.24 -0.32 -5.06 114.28 107.27 2wzp n THR 174 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2wzp n THR 174 Cb 0.00 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 2wzp n THR 174 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2wzp n SER 175 N -0.82 0.00 -3.77 3.42 2.88 0.78 -4.53 113.62 111.58 2wzp n SER 175 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 2wzp n SER 175 Cb 0.09 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.42 2wzp n SER 175 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2wzp s TYR 176 N 0.00 -0.19 0.22 0.66 1.13 -1.22 -4.31 117.35 113.64 2wzp s TYR 176 Ca 0.00 0.50 0.09 0.00 -1.41 0.00 0.00 57.07 56.25 2wzp s TYR 176 Cb 0.00 -0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.80 2wzp s TYR 176 CO 0.00 -0.14 -0.18 0.95 -2.51 0.00 0.00 175.55 173.67 2wzp s THR 177 N 0.76 2.02 -0.18 -3.49 -4.23 -0.07 -4.91 115.64 105.55 2wzp s THR 177 Ca -0.06 -2.18 -0.19 0.00 -1.18 0.00 0.00 61.69 58.08 2wzp s THR 177 Cb -0.07 -2.07 -0.03 0.00 1.34 0.00 0.00 72.50 71.66 2wzp s THR 177 CO -0.04 -0.43 0.55 -0.31 -0.54 0.00 0.00 174.62 173.85 2wzp s TYR 178 N -2.50 3.41 0.28 3.99 2.02 -1.26 -0.76 117.35 122.52 2wzp s TYR 178 Ca 0.23 0.86 0.00 0.00 -0.37 0.00 0.00 57.07 57.79 2wzp s TYR 178 Cb -0.04 -2.69 0.51 0.00 -0.40 0.00 0.00 41.96 39.34 2wzp s TYR 178 CO 0.09 -0.06 1.85 0.10 -1.57 0.00 0.00 175.55 175.96 2wzp h TYR 179 N 7.29 1.16 0.00 2.71 -0.00 -1.88 -3.47 116.97 122.77 2wzp h TYR 179 Ca -0.35 0.03 0.00 0.00 0.00 0.00 0.00 58.73 58.41 2wzp h TYR 179 Cb 1.16 -0.37 0.00 0.00 0.00 0.00 0.00 36.73 37.52 2wzp h TYR 179 CO 0.69 0.50 0.00 0.41 -0.00 0.00 0.00 178.16 179.76 2wzp n GLY 180 N -1.35 0.97 3.18 0.10 0.00 -1.26 -0.42 105.19 106.41 2wzp n GLY 180 Ca 0.18 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2wzp n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wzp s GLU 181 N 2.61 0.85 0.12 1.61 2.02 -1.26 -5.02 118.70 119.62 2wzp s GLU 181 Ca 0.00 -0.99 -0.31 0.00 0.02 0.00 0.00 54.97 53.69 2wzp s GLU 181 Cb 0.00 -0.84 -0.07 0.00 0.10 0.00 0.00 34.13 33.32 2wzp s GLU 181 CO 0.00 0.18 1.26 -1.12 0.02 0.00 0.00 175.26 175.60 2wzp s SER 182 N -1.83 7.00 -1.22 -0.19 0.01 -1.26 -3.27 113.70 112.94 2wzp s SER 182 Ca -0.01 2.19 -0.04 0.00 1.31 0.00 0.00 55.95 59.40 2wzp s SER 182 Cb -0.09 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.53 2wzp s SER 182 CO 0.02 -0.49 0.80 -0.67 0.41 0.00 0.00 173.24 173.31 2wzp n ASP 183 N 3.42 -2.95 0.25 2.44 2.03 -1.26 -4.89 116.55 115.59 2wzp n ASP 183 Ca 0.08 -0.80 0.08 0.00 0.52 0.00 0.00 54.79 54.67 2wzp n ASP 183 Cb 0.45 -4.33 0.63 0.00 -0.72 0.00 0.00 41.12 37.14 2wzp n ASP 183 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2wzp h ILE 184 N -1.73 0.98 -0.01 5.18 6.09 -1.91 -2.11 117.51 124.00 2wzp h ILE 184 Ca -0.62 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 62.70 2wzp h ILE 184 Cb 1.35 1.10 -0.00 0.00 0.47 0.00 0.00 36.82 39.73 2wzp h ILE 184 CO 0.52 0.05 0.05 -0.78 -3.07 0.00 0.00 178.15 174.92 2wzp h ASP 185 N 0.00 0.00 -0.15 2.19 1.82 -1.90 -2.48 116.42 115.90 2wzp h ASP 185 Ca -0.00 0.00 0.04 0.00 -0.39 0.00 0.00 57.03 56.68 2wzp h ASP 185 Cb 0.09 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.10 2wzp h ASP 185 CO 0.01 0.00 0.12 0.08 -1.61 0.00 0.00 179.24 177.84 2wzp h ARG 186 N 0.00 0.00 0.00 0.28 0.11 -1.75 -1.80 114.38 111.22 2wzp h ARG 186 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2wzp h ARG 186 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 2wzp h ARG 186 CO -0.00 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.35 2wzp n LEU 187 N -4.21 0.51 -0.78 0.08 4.77 -0.93 -2.81 117.00 113.62 2wzp n LEU 187 Ca 0.01 0.58 0.09 0.00 -0.03 0.00 0.00 56.01 56.65 2wzp n LEU 187 Cb 0.25 -0.46 0.24 0.00 -2.33 0.00 0.00 43.42 41.12 2wzp n LEU 187 CO 0.32 -0.28 0.69 -1.54 -1.33 0.00 0.00 177.39 175.24 2wzp n SER 188 N -2.01 3.66 -4.09 -1.43 3.41 -0.68 -0.83 113.62 111.64 2wzp n SER 188 Ca 0.04 -2.98 -0.13 0.00 -0.26 0.00 0.00 58.87 55.54 2wzp n SER 188 Cb 0.31 -0.52 -0.11 0.00 -0.26 0.00 0.00 64.21 63.63 2wzp n SER 188 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2wzp s ARG 189 N -2.75 0.62 -0.27 4.33 0.52 -1.12 -4.04 118.95 116.24 2wzp s ARG 189 Ca 0.40 -0.88 -0.10 0.00 -0.52 0.00 0.00 55.73 54.63 2wzp s ARG 189 Cb 0.32 -0.35 -0.04 0.00 0.52 0.00 0.00 34.95 35.40 2wzp s ARG 189 CO 0.08 0.06 0.15 -0.46 0.02 0.00 0.00 175.30 175.15 2wzp s TRP 190 N -1.73 3.17 -0.59 -0.53 -0.00 -0.73 -4.95 118.94 113.57 2wzp s TRP 190 Ca -0.05 -0.10 -0.19 0.00 -0.00 0.00 0.00 56.10 55.76 2wzp s TRP 190 Cb -0.08 -2.33 0.10 0.00 -0.00 0.00 0.00 33.47 31.16 2wzp s TRP 190 CO -0.00 -0.24 0.72 0.34 -0.00 0.00 0.00 176.95 177.77 2wzp s ASP 191 N 1.70 6.18 -0.56 5.86 2.15 -1.26 -1.07 116.67 129.68 2wzp s ASP 191 Ca 0.07 -1.37 -0.26 0.00 0.43 0.00 0.00 52.55 51.42 2wzp s ASP 191 Cb -0.16 -2.31 0.04 0.00 -0.30 0.00 0.00 42.92 40.19 2wzp s ASP 191 CO 0.08 -1.13 1.02 -0.63 -0.17 0.00 0.00 175.17 174.35 2wzp s ILE 192 N 2.80 4.27 -0.24 4.11 1.01 0.29 -4.83 121.20 128.60 2wzp s ILE 192 Ca 0.13 0.50 0.07 0.00 0.00 0.00 0.00 60.65 61.34 2wzp s ILE 192 Cb -0.23 -4.60 -0.09 0.00 0.01 0.00 0.00 42.46 37.55 2wzp s ILE 192 CO 0.07 -1.19 0.26 0.29 0.00 0.00 0.00 174.94 174.38 2wzp n LYS 193 N 7.78 3.24 -4.46 2.79 5.02 -1.26 -1.43 118.16 129.84 2wzp n LYS 193 Ca 0.04 -0.02 -0.22 0.00 -2.02 0.00 0.00 58.31 56.09 2wzp n LYS 193 Cb 0.48 -0.95 -0.10 0.00 -0.02 0.00 0.00 35.03 34.44 2wzp n LYS 193 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2wzp s GLU 194 N -1.95 1.62 0.33 1.97 8.01 -1.26 -4.98 118.70 122.44 2wzp s GLU 194 Ca 0.01 -1.84 -0.26 0.00 0.01 0.00 0.00 54.97 52.89 2wzp s GLU 194 Cb 0.05 -1.23 -0.10 0.00 -4.31 0.00 0.00 34.13 28.55 2wzp s GLU 194 CO 0.30 0.02 0.99 -1.21 0.01 0.00 0.00 175.26 175.37 2wzp s GLU 195 N -3.73 4.51 -0.00 1.61 2.02 -1.26 -4.83 118.70 117.01 2wzp s GLU 195 Ca 0.31 1.44 0.03 0.00 0.02 0.00 0.00 54.97 56.77 2wzp s GLU 195 Cb 0.04 -2.82 -0.01 0.00 0.10 0.00 0.00 34.13 31.45 2wzp s GLU 195 CO 0.13 0.19 -0.10 0.96 0.02 0.00 0.00 175.26 176.46 2wzp s ILE 196 N -1.54 0.79 0.03 -1.63 -0.00 -1.26 -2.22 121.20 115.37 2wzp s ILE 196 Ca 0.51 -0.47 -0.17 0.00 -0.00 0.00 0.00 60.65 60.51 2wzp s ILE 196 Cb -0.22 -0.67 -0.27 0.00 -0.00 0.00 0.00 42.46 41.31 2wzp s ILE 196 CO 0.27 0.19 1.09 -0.26 -0.00 0.00 0.00 174.94 176.24 2wzp h PHE 197 N 5.80 0.87 -2.10 1.37 0.04 -1.22 -3.46 116.94 118.24 2wzp h PHE 197 Ca -0.32 -0.52 0.34 0.00 2.80 0.00 0.00 57.97 60.27 2wzp h PHE 197 Cb 1.18 -0.08 -0.07 0.00 2.20 0.00 0.00 35.95 39.18 2wzp h PHE 197 CO 0.42 1.36 0.90 -1.54 -0.60 0.00 0.00 178.31 178.85 2wzp s SER 198 N -7.18 0.00 0.09 2.17 1.04 -1.23 -4.85 113.70 103.74 2wzp s SER 198 Ca -0.11 -0.20 -0.06 0.00 0.48 0.00 0.00 55.95 56.06 2wzp s SER 198 Cb 0.05 0.15 -0.02 0.00 0.10 0.00 0.00 66.02 66.30 2wzp s SER 198 CO 0.89 -0.30 0.12 0.72 0.98 0.00 0.00 173.24 175.66 2wzp s PHE 199 N -2.04 0.34 -0.05 5.02 -0.12 -1.26 -1.28 117.98 118.59 2wzp s PHE 199 Ca 0.29 -0.80 0.06 0.00 -0.05 0.00 0.00 56.93 56.43 2wzp s PHE 199 Cb -0.00 -0.19 -0.01 0.00 -0.63 0.00 0.00 43.02 42.19 2wzp s PHE 199 CO -0.01 -0.51 -0.24 -1.64 -0.05 0.00 0.00 175.22 172.77 2wzp s MET 200 N -3.90 2.37 0.01 1.99 -1.94 -0.32 -1.53 119.30 115.97 2wzp s MET 200 Ca 0.08 -0.87 -0.01 0.00 -1.71 0.00 0.00 55.69 53.18 2wzp s MET 200 Cb 0.06 -2.06 -0.01 0.00 2.01 0.00 0.00 34.83 34.83 2wzp s MET 200 CO -0.09 0.39 0.01 0.20 -0.01 0.00 0.00 175.02 175.53 2wzp s GLY 201 N -0.21 0.12 -0.28 -0.03 0.00 0.23 -0.50 107.32 106.64 2wzp s GLY 201 Ca -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 44.72 44.40 2wzp s GLY 201 CO 0.03 -0.33 -0.01 -0.42 0.00 0.00 0.00 173.10 172.37 2wzp s ILE 202 N -0.86 3.09 -0.13 0.90 1.01 0.01 -0.96 121.20 124.25 2wzp s ILE 202 Ca -0.09 -1.17 -0.05 0.00 0.00 0.00 0.00 60.65 59.33 2wzp s ILE 202 Cb -0.06 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 2wzp s ILE 202 CO -0.00 0.02 0.06 -0.76 0.00 0.00 0.00 174.94 174.26 2wzp s LEU 203 N 1.31 3.91 -0.61 2.97 1.43 0.27 -0.75 118.68 127.21 2wzp s LEU 203 Ca -0.02 0.22 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 2wzp s LEU 203 Cb -0.18 -1.94 0.16 0.00 0.03 0.00 0.00 46.19 44.25 2wzp s LEU 203 CO -0.02 0.32 0.45 -0.31 0.23 0.00 0.00 176.35 177.02 2wzp s TYR 204 N -0.49 3.47 0.74 0.29 2.02 -0.39 -0.70 117.35 122.30 2wzp s TYR 204 Ca 0.10 -2.52 -0.14 0.00 -0.37 0.00 0.00 57.07 54.14 2wzp s TYR 204 Cb -0.12 -3.31 0.05 0.00 -0.40 0.00 0.00 41.96 38.18 2wzp s TYR 204 CO 0.02 -0.89 1.20 -2.14 -1.57 0.00 0.00 175.55 172.17 2wzp s PRO 205 N 0.22 2.06 -0.08 -1.71 0.02 -1.26 -1.19 135.00 133.06 2wzp s PRO 205 Ca 0.15 1.72 -0.09 0.00 0.02 0.00 0.00 61.00 62.80 2wzp s PRO 205 Cb -0.20 -1.83 -0.03 0.00 0.02 0.00 0.00 34.50 32.46 2wzp s PRO 205 CO -0.04 -1.89 -0.18 1.63 -0.33 0.00 0.00 177.00 176.20 2wzp n LYS 206 N -2.86 0.27 -3.87 5.54 5.02 -0.41 -4.67 118.16 117.19 2wzp n LYS 206 Ca 0.13 0.11 -0.34 0.00 -2.02 0.00 0.00 58.31 56.19 2wzp n LYS 206 Cb 0.50 -0.93 -0.05 0.00 -0.02 0.00 0.00 35.03 34.53 2wzp n LYS 206 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wzp s LEU 207 N -6.81 4.37 0.08 -0.35 1.43 -1.26 -5.06 118.68 111.07 2wzp s LEU 207 Ca -0.15 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 2wzp s LEU 207 Cb 0.02 -2.58 -0.18 0.00 0.03 0.00 0.00 46.19 43.48 2wzp s LEU 207 CO 0.22 0.27 1.66 -0.65 0.23 0.00 0.00 176.35 178.08 2wzp h PRO 208 N 3.96 -0.63 0.01 1.29 0.11 -1.95 -3.39 132.00 131.41 2wzp h PRO 208 Ca -0.50 0.04 -0.34 0.00 0.11 0.00 0.00 66.00 65.31 2wzp h PRO 208 Cb 1.19 0.14 -0.06 0.00 0.11 0.00 0.00 31.00 32.39 2wzp h PRO 208 CO 0.67 -0.42 -2.10 1.63 -0.21 0.00 0.00 178.00 177.58 2wzp n LYS 209 N -5.37 0.67 -1.77 1.05 4.76 -1.26 -4.42 118.16 111.82 2wzp n LYS 209 Ca -0.12 0.15 -0.40 0.00 -2.87 0.00 0.00 58.31 55.07 2wzp n LYS 209 Cb 0.27 -1.64 0.01 0.00 -1.84 0.00 0.00 35.03 31.83 2wzp n LYS 209 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2wzp s THR 210 N -2.54 2.01 0.62 -0.18 -4.23 -1.26 -4.70 115.64 105.35 2wzp s THR 210 Ca -0.12 0.01 -0.18 0.00 -1.18 0.00 0.00 61.69 60.22 2wzp s THR 210 Cb 0.07 -3.00 -0.04 0.00 1.34 0.00 0.00 72.50 70.86 2wzp s THR 210 CO 0.80 0.00 0.88 -0.81 -0.54 0.00 0.00 174.62 174.95 2wzp n PRO 211 N 0.06 0.75 -4.11 3.99 -0.04 -1.26 -4.82 135.00 129.57 2wzp n PRO 211 Ca 0.03 0.30 -0.17 0.00 -0.04 0.00 0.00 63.50 63.62 2wzp n PRO 211 Cb 0.40 -2.10 -0.15 0.00 -0.04 0.00 0.00 33.50 31.62 2wzp n PRO 211 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wzp s ALA 212 N -1.60 0.45 0.00 0.55 0.00 0.57 -4.55 121.76 117.18 2wzp s ALA 212 Ca 0.75 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.61 2wzp s ALA 212 Cb -0.40 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.50 2wzp s ALA 212 CO 0.48 0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.70 2wzp n GLY 213 N 3.43 -0.74 3.01 0.00 0.00 -0.49 -0.69 105.19 109.71 2wzp n GLY 213 Ca -0.19 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 2wzp n GLY 213 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wzp s VAL 214 N -4.00 0.23 0.08 1.61 -7.23 -0.40 0.02 120.40 110.71 2wzp s VAL 214 Ca 0.00 -1.02 0.07 0.00 -1.81 0.00 0.00 61.98 59.22 2wzp s VAL 214 Cb 0.00 -0.44 -0.03 0.00 0.56 0.00 0.00 36.38 36.47 2wzp s VAL 214 CO 0.00 -0.51 -0.19 0.00 -0.31 0.00 0.00 175.10 174.09 2wzp s ARG 215 N -1.68 1.11 -0.14 4.82 1.70 -0.03 -1.30 118.95 123.43 2wzp s ARG 215 Ca -0.13 -1.05 -0.00 0.00 -0.47 0.00 0.00 55.73 54.08 2wzp s ARG 215 Cb -0.09 -1.28 -0.01 0.00 -0.57 0.00 0.00 34.95 33.00 2wzp s ARG 215 CO -0.01 0.30 -0.13 -0.06 -1.08 0.00 0.00 175.30 174.32 2wzp s PHE 216 N -1.08 2.82 -0.02 5.89 0.08 -0.07 -0.95 117.98 124.65 2wzp s PHE 216 Ca 0.05 -0.70 0.04 0.00 0.12 0.00 0.00 56.93 56.44 2wzp s PHE 216 Cb -0.10 -1.86 -0.03 0.00 -0.57 0.00 0.00 43.02 40.46 2wzp s PHE 216 CO 0.03 -0.26 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.27 2wzp s LEU 217 N 0.45 2.91 0.00 -0.37 1.43 0.60 -2.22 118.68 121.48 2wzp s LEU 217 Ca -0.09 -0.20 -0.14 0.00 -1.03 0.00 0.00 54.13 52.66 2wzp s LEU 217 Cb -0.16 -1.65 0.21 0.00 0.03 0.00 0.00 46.19 44.62 2wzp s LEU 217 CO 0.05 0.31 1.24 -0.90 0.23 0.00 0.00 176.35 177.28 2wzp n ASP 218 N 1.89 0.20 0.29 2.29 3.85 -0.14 -1.63 116.55 123.29 2wzp n ASP 218 Ca -0.16 -1.52 0.16 0.00 -0.71 0.00 0.00 54.79 52.56 2wzp n ASP 218 Cb 0.52 -0.94 0.93 0.00 -1.35 0.00 0.00 41.12 40.29 2wzp n ASP 218 CO 0.00 0.00 0.00 -2.24 -1.01 0.00 0.00 177.20 173.95 2wzp h ASP 219 N -1.57 0.00 -0.49 -1.12 3.04 -1.86 -1.18 116.42 113.24 2wzp h ASP 219 Ca -0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.39 2wzp h ASP 219 Cb 1.13 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.42 2wzp h ASP 219 CO 0.29 0.00 0.00 2.30 -2.04 0.00 0.00 179.24 179.79 2wzp n ILE 220 N -3.77 0.81 -1.15 4.15 -5.35 -1.26 -4.95 119.36 107.85 2wzp n ILE 220 Ca -0.02 -0.70 -0.04 0.00 -0.27 0.00 0.00 62.75 61.71 2wzp n ILE 220 Cb 0.11 0.25 -0.02 0.00 -1.74 0.00 0.00 39.64 38.24 2wzp n ILE 220 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wzp n GLY 221 N 1.19 0.69 3.85 3.28 0.00 -0.44 -5.05 105.19 108.70 2wzp n GLY 221 Ca 0.17 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 2wzp n GLY 221 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wzp s ASN 222 N -2.95 6.36 -0.10 1.61 0.01 -1.26 -4.80 114.94 113.81 2wzp s ASN 222 Ca 0.00 0.43 -0.30 0.00 -0.71 0.00 0.00 52.86 52.28 2wzp s ASN 222 Cb 0.00 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.55 2wzp s ASN 222 CO 0.00 0.36 1.36 -0.70 -1.51 0.00 0.00 177.10 176.60 2wzp s GLU 223 N -0.72 4.25 -0.05 -0.60 2.12 -1.26 -0.97 118.70 121.47 2wzp s GLU 223 Ca 0.14 1.82 0.12 0.00 0.36 0.00 0.00 54.97 57.41 2wzp s GLU 223 Cb -0.12 -3.75 -0.17 0.00 0.26 0.00 0.00 34.13 30.35 2wzp s GLU 223 CO 0.03 -0.67 0.19 2.48 -0.54 0.00 0.00 175.26 176.75 2wzp n TYR 224 N 6.29 0.00 -3.56 5.30 0.18 -0.94 -4.98 117.16 119.45 2wzp n TYR 224 Ca 0.14 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.81 2wzp n TYR 224 Cb 0.44 -0.37 -0.03 0.00 -0.38 0.00 0.00 39.34 39.01 2wzp n TYR 224 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 2wzp s THR 225 N -2.66 0.01 -0.26 -3.48 -1.32 -1.24 -4.59 115.64 102.09 2wzp s THR 225 Ca -0.05 -0.34 -0.25 0.00 -1.21 0.00 0.00 61.69 59.84 2wzp s THR 225 Cb 0.06 -1.27 0.08 0.00 -1.51 0.00 0.00 72.50 69.87 2wzp s THR 225 CO 0.49 -0.05 0.79 0.00 -2.21 0.00 0.00 174.62 173.65 2wzp s ALA 226 N -3.80 -1.83 -0.41 11.08 0.00 0.09 -0.89 121.76 126.00 2wzp s ALA 226 Ca 0.04 1.96 -0.07 0.00 0.00 0.00 0.00 51.96 53.89 2wzp s ALA 226 Cb -0.02 -1.18 0.08 0.00 0.00 0.00 0.00 23.12 22.01 2wzp s ALA 226 CO -0.08 -0.32 0.23 0.42 0.00 0.00 0.00 175.76 176.01 2wzp s ILE 227 N 0.26 3.94 0.02 0.00 1.01 -0.42 -2.47 121.20 123.54 2wzp s ILE 227 Ca 0.00 -1.52 0.02 0.00 0.00 0.00 0.00 60.65 59.16 2wzp s ILE 227 Cb -0.05 -3.45 -0.01 0.00 0.01 0.00 0.00 42.46 38.96 2wzp s ILE 227 CO -0.00 -0.50 -0.07 -0.69 0.00 0.00 0.00 174.94 173.67 2wzp s VAL 228 N 1.36 0.55 0.00 2.92 1.01 -1.26 -1.27 120.40 123.71 2wzp s VAL 228 Ca 0.03 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2wzp s VAL 228 Cb -0.23 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.61 2wzp s VAL 228 CO 0.01 -0.08 -0.10 -0.36 0.00 0.00 0.00 175.10 174.56 2wzp s PHE 229 N -0.69 0.90 -0.55 5.22 0.08 0.13 -1.59 117.98 121.47 2wzp s PHE 229 Ca -0.03 -0.22 0.04 0.00 0.12 0.00 0.00 56.93 56.85 2wzp s PHE 229 Cb -0.06 -0.56 0.14 0.00 -0.57 0.00 0.00 43.02 41.96 2wzp s PHE 229 CO 0.00 -0.01 0.30 0.21 -0.10 0.00 0.00 175.22 175.62 2wzp s LYS 230 N -0.47 2.06 0.27 0.44 2.20 -0.88 -0.32 119.74 123.05 2wzp s LYS 230 Ca 0.02 -2.74 -0.12 0.00 -0.36 0.00 0.00 55.97 52.77 2wzp s LYS 230 Cb -0.05 -3.34 -0.08 0.00 -1.51 0.00 0.00 37.83 32.85 2wzp s LYS 230 CO -0.00 -1.14 0.63 0.95 -0.36 0.00 0.00 175.35 175.43 2wzp s THR 231 N -0.48 4.83 0.17 3.43 -4.23 -1.26 -4.88 115.64 113.22 2wzp s THR 231 Ca 0.18 0.64 -0.10 0.00 -1.18 0.00 0.00 61.69 61.23 2wzp s THR 231 Cb -0.23 -3.62 0.05 0.00 1.34 0.00 0.00 72.50 70.05 2wzp s THR 231 CO -0.03 -0.14 1.63 -0.33 -0.54 0.00 0.00 174.62 175.22 2wzp h GLU 232 N 2.37 1.01 -6.77 3.99 5.08 -1.94 -3.41 114.58 114.91 2wzp h GLU 232 Ca -0.47 -0.32 -0.68 0.00 -1.00 0.00 0.00 59.36 56.88 2wzp h GLU 232 Cb 1.17 -0.09 -0.21 0.00 0.50 0.00 0.00 28.75 30.12 2wzp h GLU 232 CO 0.67 1.00 -0.84 -0.65 -1.00 0.00 0.00 179.01 178.20 2wzp s GLN 233 N -5.03 1.68 0.12 2.33 -0.21 -1.26 -4.72 119.66 112.56 2wzp s GLN 233 Ca -0.12 -1.21 -0.31 0.00 0.02 0.00 0.00 55.36 53.74 2wzp s GLN 233 Cb 0.13 -2.03 -0.09 0.00 1.00 0.00 0.00 33.01 32.02 2wzp s GLN 233 CO 0.85 0.48 1.55 0.08 -2.12 0.00 0.00 175.29 176.13 2wzp s VAL 234 N -1.05 2.91 0.21 1.09 1.01 -1.26 -4.98 120.40 118.33 2wzp s VAL 234 Ca 0.15 0.57 -0.16 0.00 0.00 0.00 0.00 61.98 62.55 2wzp s VAL 234 Cb -0.10 -3.37 -0.08 0.00 0.00 0.00 0.00 36.38 32.83 2wzp s VAL 234 CO 0.07 0.03 0.64 -1.10 0.00 0.00 0.00 175.10 174.74 2wzp s GLN 235 N 1.63 4.05 0.21 2.72 -1.52 -1.26 -4.90 119.66 120.60 2wzp s GLN 235 Ca 0.70 0.62 -0.09 0.00 -1.95 0.00 0.00 55.36 54.63 2wzp s GLN 235 Cb -0.41 -2.79 0.17 0.00 -0.22 0.00 0.00 33.01 29.76 2wzp s GLN 235 CO 0.31 0.37 1.86 -0.44 -0.25 0.00 0.00 175.29 177.14 2wzp h ASP 236 N 3.15 0.95 -4.80 5.90 3.32 0.08 -3.40 116.42 121.63 2wzp h ASP 236 Ca -0.48 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 56.53 2wzp h ASP 236 Cb 1.19 -0.24 -0.15 0.00 0.22 0.00 0.00 39.33 40.34 2wzp h ASP 236 CO 0.66 0.73 0.33 -0.72 -1.72 0.00 0.00 179.24 178.52 2wzp s TYR 237 N -5.98 -0.49 -0.07 4.55 1.13 -1.17 -4.45 117.35 110.88 2wzp s TYR 237 Ca -0.13 0.47 0.06 0.00 -1.41 0.00 0.00 57.07 56.05 2wzp s TYR 237 Cb 0.15 0.52 -0.01 0.00 -1.10 0.00 0.00 41.96 41.52 2wzp s TYR 237 CO 0.80 -0.66 -0.24 0.42 -2.51 0.00 0.00 175.55 173.35 2wzp s ILE 238 N -2.84 2.11 -0.24 -3.49 1.01 0.12 -0.45 121.20 117.42 2wzp s ILE 238 Ca -0.00 -1.04 -0.10 0.00 0.00 0.00 0.00 60.65 59.50 2wzp s ILE 238 Cb -0.01 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.64 2wzp s ILE 238 CO -0.06 0.57 0.15 -0.76 0.00 0.00 0.00 174.94 174.84 2wzp s LEU 239 N -0.09 4.10 -0.03 2.97 1.43 0.19 -0.56 118.68 126.69 2wzp s LEU 239 Ca -0.06 0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.21 2wzp s LEU 239 Cb -0.14 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.97 2wzp s LEU 239 CO 0.04 0.08 -0.18 0.27 0.23 0.00 0.00 176.35 176.79 2wzp s ILE 240 N 0.99 1.50 -0.07 -0.59 -4.36 -0.14 -1.32 121.20 117.21 2wzp s ILE 240 Ca 0.07 -0.78 -0.01 0.00 -0.26 0.00 0.00 60.65 59.67 2wzp s ILE 240 Cb -0.13 -1.27 0.03 0.00 1.25 0.00 0.00 42.46 42.34 2wzp s ILE 240 CO 0.04 0.43 -0.00 0.21 0.24 0.00 0.00 174.94 175.85 2wzp s ASN 241 N -0.19 1.61 0.00 4.36 3.04 0.23 -0.61 114.94 123.38 2wzp s ASN 241 Ca 0.01 -0.10 0.26 0.00 0.04 0.00 0.00 52.86 53.07 2wzp s ASN 241 Cb -0.10 -0.46 0.61 0.00 -1.54 0.00 0.00 41.25 39.76 2wzp s ASN 241 CO 0.01 -0.19 1.47 1.07 -3.04 0.00 0.00 177.10 176.43 2wzp n THR 242 N 5.12 0.00 -1.69 -5.21 5.66 -0.58 -1.43 114.28 116.14 2wzp n THR 242 Ca -0.08 -0.12 -0.55 0.00 -3.05 0.00 0.00 64.05 60.26 2wzp n THR 242 Cb 0.50 0.48 -0.07 0.00 -1.55 0.00 0.00 70.33 69.69 2wzp n THR 242 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2wzp n ASP 243 N -0.76 2.50 -0.03 1.09 -0.08 -1.26 -4.82 116.55 113.19 2wzp n ASP 243 Ca 0.11 1.06 0.22 0.00 -1.51 0.00 0.00 54.79 54.67 2wzp n ASP 243 Cb 0.36 -1.19 0.70 0.00 2.34 0.00 0.00 41.12 43.33 2wzp n ASP 243 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 2wzp h VAL 244 N 5.04 0.68 0.00 5.18 -1.51 -1.93 -1.44 116.25 122.27 2wzp h VAL 244 Ca -0.47 0.00 -0.23 0.00 -1.23 0.00 0.00 66.70 64.77 2wzp h VAL 244 Cb 1.31 0.70 -0.04 0.00 -2.13 0.00 0.00 31.29 31.13 2wzp h VAL 244 CO 0.94 0.00 -1.68 0.59 -1.23 0.00 0.00 177.57 176.19 2wzp n ASN 245 N -4.32 0.71 -3.16 4.19 3.02 -1.26 -4.58 115.26 109.86 2wzp n ASN 245 Ca 0.11 0.33 -0.21 0.00 -0.03 0.00 0.00 54.58 54.78 2wzp n ASN 245 Cb 0.67 0.27 -0.04 0.00 -0.61 0.00 0.00 39.78 40.07 2wzp n ASN 245 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2wzp n ASP 246 N -2.90 1.60 -4.81 6.41 2.03 -0.93 -5.13 116.55 112.82 2wzp n ASP 246 Ca -0.15 -3.11 -0.33 0.00 0.52 0.00 0.00 54.79 51.72 2wzp n ASP 246 Cb 0.95 -0.61 -0.01 0.00 -0.72 0.00 0.00 41.12 40.72 2wzp n ASP 246 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 2wzp s GLU 247 N -2.42 3.60 -0.11 -0.67 -1.05 -0.59 -4.56 118.70 112.91 2wzp s GLU 247 Ca 0.41 1.15 -0.19 0.00 -0.15 0.00 0.00 54.97 56.19 2wzp s GLU 247 Cb 0.29 -2.08 0.04 0.00 -0.44 0.00 0.00 34.13 31.95 2wzp s GLU 247 CO -0.09 -0.57 0.47 0.95 0.95 0.00 0.00 175.26 176.97 2wzp s THR 248 N -2.43 0.02 -0.34 1.83 -4.23 -0.51 -4.94 115.64 105.04 2wzp s THR 248 Ca 0.63 -0.13 0.00 0.00 -1.18 0.00 0.00 61.69 61.01 2wzp s THR 248 Cb -0.14 -0.72 0.14 0.00 1.34 0.00 0.00 72.50 73.12 2wzp s THR 248 CO 0.32 -0.07 0.27 -0.31 -0.54 0.00 0.00 174.62 174.29 2wzp s TYR 249 N -0.42 0.06 -0.07 3.99 2.02 -1.25 -0.60 117.35 121.08 2wzp s TYR 249 Ca -0.06 -0.94 0.01 0.00 -0.37 0.00 0.00 57.07 55.71 2wzp s TYR 249 Cb -0.03 -0.64 0.02 0.00 -0.40 0.00 0.00 41.96 40.90 2wzp s TYR 249 CO 0.03 -0.90 -0.10 -1.14 -1.57 0.00 0.00 175.55 171.88 2wzp s GLN 250 N 1.60 1.49 0.04 -0.62 0.74 -0.43 -0.41 119.66 122.08 2wzp s GLN 250 Ca 0.15 -0.31 -0.01 0.00 0.05 0.00 0.00 55.36 55.24 2wzp s GLN 250 Cb -0.17 -1.35 -0.04 0.00 1.10 0.00 0.00 33.01 32.55 2wzp s GLN 250 CO -0.13 -0.07 0.20 0.20 -0.55 0.00 0.00 175.29 174.94 2wzp s GLY 251 N 1.00 2.19 -0.13 2.59 0.00 -0.08 0.54 107.32 113.42 2wzp s GLY 251 Ca -0.09 -0.82 0.01 0.00 0.00 0.00 0.00 44.72 43.82 2wzp s GLY 251 CO -0.00 -0.78 -0.14 -0.98 0.00 0.00 0.00 173.10 171.20 2wzp s TRP 252 N -1.47 2.04 -0.25 1.90 0.52 0.40 -1.08 118.94 121.00 2wzp s TRP 252 Ca 0.33 -1.08 -0.01 0.00 0.02 0.00 0.00 56.10 55.37 2wzp s TRP 252 Cb -0.13 -1.50 0.07 0.00 -1.15 0.00 0.00 33.47 30.76 2wzp s TRP 252 CO 0.26 -0.59 0.03 0.21 0.02 0.00 0.00 176.95 176.88 2wzp s LYS 253 N 1.34 0.96 7.49 4.98 2.20 -0.33 0.86 119.74 137.24 2wzp s LYS 253 Ca 0.01 -0.85 0.00 0.00 -0.36 0.00 0.00 55.97 54.78 2wzp s LYS 253 Cb -0.13 -2.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 2wzp s LYS 253 CO -0.07 -0.76 0.00 0.41 -0.36 0.00 0.00 175.35 174.57 2wzp n GLY 254 N 4.85 2.44 0.66 5.54 0.00 -1.26 -1.83 105.19 115.59 2wzp n GLY 254 Ca -0.07 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.73 2wzp n GLY 254 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wzp n THR 255 N 0.00 0.99 -3.54 2.61 -2.24 -1.26 -4.97 114.28 105.88 2wzp n THR 255 Ca 0.00 -1.00 -0.37 0.00 -2.27 0.00 0.00 64.05 60.41 2wzp n THR 255 Cb 0.00 0.51 -0.09 0.00 -2.10 0.00 0.00 70.33 68.65 2wzp n THR 255 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2wzp s THR 256 N -1.00 5.28 0.01 4.28 2.01 -0.76 -5.08 115.64 120.37 2wzp s THR 256 Ca 0.24 0.40 -0.07 0.00 0.31 0.00 0.00 61.69 62.57 2wzp s THR 256 Cb 0.13 -3.60 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 2wzp s THR 256 CO 0.16 0.29 0.28 0.00 -0.69 0.00 0.00 174.62 174.67 2wzp s ALA 257 N 1.29 3.83 -0.03 7.40 0.00 -1.26 -1.19 121.76 131.79 2wzp s ALA 257 Ca 0.12 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.55 2wzp s ALA 257 Cb -0.14 -2.10 0.02 0.00 0.00 0.00 0.00 23.12 20.90 2wzp s ALA 257 CO 0.07 0.63 -0.01 -1.17 0.00 0.00 0.00 175.76 175.27 2wzp s LEU 258 N -1.70 1.26 -0.10 0.00 0.20 -0.24 -4.99 118.68 113.11 2wzp s LEU 258 Ca 0.27 -0.05 -0.30 0.00 0.69 0.00 0.00 54.13 54.74 2wzp s LEU 258 Cb -0.13 -0.27 -0.03 0.00 -0.43 0.00 0.00 46.19 45.33 2wzp s LEU 258 CO 0.15 -0.08 1.24 0.21 -0.29 0.00 0.00 176.35 177.59 2wzp s ASN 259 N 0.92 6.99 0.00 3.68 2.47 -1.26 -0.90 114.94 126.84 2wzp s ASN 259 Ca -0.10 1.78 0.26 0.00 0.42 0.00 0.00 52.86 55.21 2wzp s ASN 259 Cb -0.13 -2.55 0.63 0.00 -1.45 0.00 0.00 41.25 37.75 2wzp s ASN 259 CO -0.01 -0.68 1.50 0.18 -3.72 0.00 0.00 177.10 174.37 2wzp n LEU 260 N 5.88 0.59 -0.29 3.21 4.77 0.46 -4.34 117.00 127.28 2wzp n LEU 260 Ca 0.12 -0.03 0.02 0.00 -0.03 0.00 0.00 56.01 56.09 2wzp n LEU 260 Cb 0.45 -0.23 0.09 0.00 -2.33 0.00 0.00 43.42 41.40 2wzp n LEU 260 CO 0.56 0.13 0.69 0.15 -1.33 0.00 0.00 177.39 177.58 2wzp h PHE 261 N 0.29 -0.51 0.00 -1.77 3.57 -1.92 0.11 116.94 116.72 2wzp h PHE 261 Ca 0.00 0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2wzp h PHE 261 Cb 0.50 0.35 -0.00 0.00 2.79 0.00 0.00 35.95 39.59 2wzp h PHE 261 CO 0.00 -0.36 -0.00 -1.35 -2.23 0.00 0.00 178.31 174.37 2wzp h PRO 262 N -0.01 0.00 -0.09 6.41 0.11 -1.97 -2.73 132.00 133.73 2wzp h PRO 262 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2wzp h PRO 262 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 2wzp h PRO 262 CO -0.84 0.00 0.00 1.55 -0.21 0.00 0.00 178.00 178.50 2wzp n VAL 263 N -3.09 0.26 -2.62 3.15 3.14 0.29 -5.00 118.33 114.46 2wzp n VAL 263 Ca -0.03 -0.63 -0.36 0.00 -2.96 0.00 0.00 64.34 60.37 2wzp n VAL 263 Cb 0.10 1.02 -0.05 0.00 -1.06 0.00 0.00 33.84 33.85 2wzp n VAL 263 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 2wzp s MET 264 N -0.84 4.22 -0.72 1.45 0.00 -0.64 -2.06 119.30 120.71 2wzp s MET 264 Ca 0.13 1.42 -0.24 0.00 0.00 0.00 0.00 55.69 57.01 2wzp s MET 264 Cb 0.09 -2.52 0.06 0.00 0.00 0.00 0.00 34.83 32.46 2wzp s MET 264 CO 0.12 -0.07 1.11 0.34 0.00 0.00 0.00 175.02 176.52 2wzp s ASP 265 N -1.67 6.20 0.00 1.11 3.68 -0.62 -4.89 116.67 120.47 2wzp s ASP 265 Ca 0.58 -0.85 0.13 0.00 2.13 0.00 0.00 52.55 54.54 2wzp s ASP 265 Cb -0.20 -2.48 0.63 0.00 -1.45 0.00 0.00 42.92 39.43 2wzp s ASP 265 CO 0.25 -1.58 1.38 0.49 0.13 0.00 0.00 175.17 175.84 2wzp n PHE 266 N 8.34 0.00 -0.03 -5.34 3.72 -1.26 -2.79 117.46 120.10 2wzp n PHE 266 Ca 0.02 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.23 2wzp n PHE 266 Cb 0.47 -0.37 -0.14 0.00 -0.94 0.00 0.00 39.48 38.50 2wzp n PHE 266 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2wzp n GLU 267 N -1.37 0.71 0.09 -1.08 1.02 -1.26 -4.46 120.64 114.29 2wzp n GLU 267 Ca 0.05 0.23 0.02 0.00 -0.02 0.00 0.00 57.16 57.44 2wzp n GLU 267 Cb 0.13 -1.67 -0.02 0.00 -0.02 0.00 0.00 31.44 29.86 2wzp n GLU 267 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wzp h ARG 268 N 0.04 0.00 -4.45 3.49 3.08 -1.82 -3.39 114.38 111.32 2wzp h ARG 268 Ca -0.45 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 58.87 2wzp h ARG 268 Cb 2.01 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.93 2wzp h ARG 268 CO 0.04 0.36 1.96 0.98 -1.07 0.00 0.00 179.97 182.24 2wzp n TYR 269 N -3.03 4.09 0.11 3.04 4.19 -1.03 -0.74 117.16 123.79 2wzp n TYR 269 Ca -0.03 -3.04 -0.19 0.00 3.31 0.00 0.00 57.90 57.95 2wzp n TYR 269 Cb 0.76 -2.24 -0.13 0.00 0.49 0.00 0.00 39.34 38.22 2wzp n TYR 269 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2wzp h ARG 270 N 6.62 0.42 -2.91 2.98 2.47 -1.81 -3.48 114.38 118.66 2wzp h ARG 270 Ca 0.40 -0.65 -0.08 0.00 -1.26 0.00 0.00 59.98 58.39 2wzp h ARG 270 Cb 0.76 0.23 -0.17 0.00 -1.65 0.00 0.00 29.97 29.14 2wzp h ARG 270 CO 1.49 1.29 -0.10 -0.08 0.56 0.00 0.00 179.97 183.13 2wzp s THR 271 N -2.78 0.05 -1.76 2.04 -1.32 -1.26 -5.02 115.64 105.58 2wzp s THR 271 Ca -0.06 -0.41 0.16 0.00 -1.21 0.00 0.00 61.69 60.17 2wzp s THR 271 Cb 0.06 -0.89 0.07 0.00 -1.51 0.00 0.00 72.50 70.24 2wzp s THR 271 CO 0.91 -0.22 0.93 -2.11 -2.21 0.00 0.00 174.62 171.92 2wzp n ARG 272 N 0.70 1.44 -2.77 7.08 1.85 -1.26 -4.83 116.66 118.86 2wzp n ARG 272 Ca -0.19 -1.19 -0.43 0.00 -1.00 0.00 0.00 57.85 55.05 2wzp n ARG 272 Cb 0.59 -1.28 -0.04 0.00 -1.05 0.00 0.00 32.46 30.68 2wzp n ARG 272 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2wzp s ILE 273 N -1.54 4.21 -0.26 8.89 -1.09 -1.26 -4.95 121.20 125.20 2wzp s ILE 273 Ca 0.16 0.06 -0.26 0.00 -2.23 0.00 0.00 60.65 58.38 2wzp s ILE 273 Cb 0.13 -4.69 0.00 0.00 -1.58 0.00 0.00 42.46 36.32 2wzp s ILE 273 CO 0.27 -1.42 0.92 -0.63 -1.23 0.00 0.00 174.94 172.85 2wzp s ILE 274 N 4.41 4.74 0.51 2.92 -1.09 -1.26 -5.05 121.20 126.38 2wzp s ILE 274 Ca 0.28 1.68 -0.01 0.00 -2.23 0.00 0.00 60.65 60.37 2wzp s ILE 274 Cb -0.13 -4.22 0.01 0.00 -1.58 0.00 0.00 42.46 36.54 2wzp s ILE 274 CO 0.15 -0.19 0.75 -1.61 -1.23 0.00 0.00 174.94 172.81 2wzp s GLU 275 N 3.08 2.89 0.41 2.79 0.41 -1.26 -4.70 118.70 122.32 2wzp s GLU 275 Ca 0.39 -0.44 -0.27 0.00 -0.41 0.00 0.00 54.97 54.24 2wzp s GLU 275 Cb -0.15 -2.47 -0.09 0.00 -1.78 0.00 0.00 34.13 29.64 2wzp s GLU 275 CO 0.09 -0.49 1.40 0.15 -0.49 0.00 0.00 175.26 175.92 2wzp s LYS 276 N -4.71 3.94 0.00 1.61 1.02 -1.26 -4.71 119.74 115.62 2wzp s LYS 276 Ca 0.52 2.36 0.00 0.00 0.02 0.00 0.00 55.97 58.87 2wzp s LYS 276 Cb -0.10 -2.81 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 2wzp s LYS 276 CO 0.40 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 174.65 2wzp n GLY 277 N 0.60 0.06 3.23 -3.33 0.00 -0.51 -2.73 105.19 102.51 2wzp n GLY 277 Ca 0.03 -0.56 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 2wzp n GLY 277 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2wzp s GLN 278 N 0.00 0.65 -0.18 1.61 -2.07 -0.65 -0.55 119.66 118.47 2wzp s GLN 278 Ca 0.00 -0.18 -0.07 0.00 -1.82 0.00 0.00 55.36 53.29 2wzp s GLN 278 Cb 0.00 0.29 -0.04 0.00 -1.09 0.00 0.00 33.01 32.17 2wzp s GLN 278 CO 0.00 -0.18 0.05 1.41 -1.32 0.00 0.00 175.29 175.26 2wzp s MET 279 N -1.27 3.95 0.16 9.60 -2.45 -0.23 -0.29 119.30 128.77 2wzp s MET 279 Ca -0.13 -0.36 0.08 0.00 -1.25 0.00 0.00 55.69 54.03 2wzp s MET 279 Cb -0.05 -3.19 -0.04 0.00 1.25 0.00 0.00 34.83 32.80 2wzp s MET 279 CO 0.04 0.27 -0.07 -1.21 1.05 0.00 0.00 175.02 175.10 2wzp s GLU 280 N 0.37 2.18 0.36 4.11 2.02 -0.12 -1.78 118.70 125.84 2wzp s GLU 280 Ca 0.02 -1.17 -0.15 0.00 0.02 0.00 0.00 54.97 53.70 2wzp s GLU 280 Cb -0.13 -2.25 -0.09 0.00 0.10 0.00 0.00 34.13 31.77 2wzp s GLU 280 CO 0.00 0.46 0.78 -0.51 0.02 0.00 0.00 175.26 176.01 2wzp s LEU 281 N -2.74 3.98 -0.24 1.80 1.43 -1.26 -0.85 118.68 120.80 2wzp s LEU 281 Ca 0.25 1.32 0.02 0.00 -1.03 0.00 0.00 54.13 54.69 2wzp s LEU 281 Cb -0.09 -4.15 0.06 0.00 0.03 0.00 0.00 46.19 42.03 2wzp s LEU 281 CO 0.16 -0.28 -0.08 -0.63 0.23 0.00 0.00 176.35 175.74 2wzp s ILE 282 N -2.11 1.82 -1.52 -0.59 1.01 0.10 -4.80 121.20 115.12 2wzp s ILE 282 Ca 0.55 -1.37 -0.11 0.00 0.00 0.00 0.00 60.65 59.72 2wzp s ILE 282 Cb -0.10 -2.00 0.08 0.00 0.01 0.00 0.00 42.46 40.45 2wzp s ILE 282 CO 0.20 -0.03 0.80 -3.20 0.00 0.00 0.00 174.94 172.70 2wzp n ASN 283 N 4.57 -3.11 -4.29 3.58 5.15 -1.26 -1.39 115.26 118.50 2wzp n ASN 283 Ca -0.13 -0.88 -0.29 0.00 -0.60 0.00 0.00 54.58 52.67 2wzp n ASN 283 Cb 0.43 -3.49 -0.15 0.00 -0.53 0.00 0.00 39.78 36.04 2wzp n ASN 283 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2wzp s LEU 284 N -7.13 2.11 -0.00 1.20 1.43 -1.26 -1.28 118.68 113.74 2wzp s LEU 284 Ca 0.47 -0.50 0.12 0.00 -1.03 0.00 0.00 54.13 53.19 2wzp s LEU 284 Cb -0.24 -1.21 -0.22 0.00 0.03 0.00 0.00 46.19 44.55 2wzp s LEU 284 CO 0.86 0.26 0.80 0.77 0.23 0.00 0.00 176.35 179.27 2wzp h SER 285 N 5.18 0.00 -5.00 2.29 4.64 -1.42 -3.43 113.55 115.81 2wzp h SER 285 Ca -0.43 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.86 2wzp h SER 285 Cb 1.14 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.09 2wzp h SER 285 CO 0.45 0.96 0.19 -0.75 -0.87 0.00 0.00 176.83 176.82 2wzp s LYS 286 N -2.65 1.22 -0.15 4.77 2.20 -1.26 -1.08 119.74 122.79 2wzp s LYS 286 Ca -0.03 -0.31 -0.13 0.00 -0.36 0.00 0.00 55.97 55.14 2wzp s LYS 286 Cb 0.08 0.56 0.04 0.00 -1.51 0.00 0.00 37.83 37.01 2wzp s LYS 286 CO 0.82 -0.50 0.39 0.00 -0.36 0.00 0.00 175.35 175.70 2wzp s ALA 287 N -3.14 -0.97 -0.19 3.13 0.00 -0.47 -1.26 121.76 118.86 2wzp s ALA 287 Ca -0.02 1.16 0.01 0.00 0.00 0.00 0.00 51.96 53.12 2wzp s ALA 287 Cb -0.01 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.46 2wzp s ALA 287 CO -0.08 -0.20 -0.16 -1.21 0.00 0.00 0.00 175.76 174.12 2wzp s GLU 288 N 0.42 2.57 -0.01 0.00 2.02 0.07 -0.79 118.70 122.98 2wzp s GLU 288 Ca -0.02 -0.86 0.04 0.00 0.02 0.00 0.00 54.97 54.16 2wzp s GLU 288 Cb -0.04 -2.50 -0.03 0.00 0.10 0.00 0.00 34.13 31.66 2wzp s GLU 288 CO -0.02 -0.31 -0.12 -0.06 0.02 0.00 0.00 175.26 174.78 2wzp s PHE 289 N 1.32 2.76 -0.37 1.61 2.99 0.90 -0.81 117.98 126.38 2wzp s PHE 289 Ca 0.02 -0.12 0.02 0.00 0.00 0.00 0.00 56.93 56.85 2wzp s PHE 289 Cb -0.15 -1.59 0.11 0.00 0.00 0.00 0.00 43.02 41.39 2wzp s PHE 289 CO -0.10 0.29 0.10 0.21 -0.00 0.00 0.00 175.22 175.71 2wzp s LYS 290 N -1.17 1.64 -0.07 0.44 2.20 0.35 -0.91 119.74 122.22 2wzp s LYS 290 Ca 0.14 -1.93 -0.19 0.00 -0.36 0.00 0.00 55.97 53.63 2wzp s LYS 290 Cb -0.11 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.86 2wzp s LYS 290 CO 0.04 -0.98 0.54 0.42 -0.36 0.00 0.00 175.35 175.01 2wzp s ILE 291 N 0.85 5.08 -0.84 5.43 1.01 0.31 -1.18 121.20 131.86 2wzp s ILE 291 Ca 0.11 1.11 -0.17 0.00 0.00 0.00 0.00 60.65 61.70 2wzp s ILE 291 Cb -0.20 -3.88 0.16 0.00 0.01 0.00 0.00 42.46 38.55 2wzp s ILE 291 CO -0.07 0.35 0.92 -0.75 0.00 0.00 0.00 174.94 175.40 2wzp s LYS 292 N 0.34 3.52 0.57 2.79 2.20 -0.40 -1.09 119.74 127.66 2wzp s LYS 292 Ca 0.29 -1.97 -0.20 0.00 -0.36 0.00 0.00 55.97 53.73 2wzp s LYS 292 Cb -0.16 -4.62 -0.04 0.00 -1.51 0.00 0.00 37.83 31.49 2wzp s LYS 292 CO 0.14 -1.55 1.24 1.03 -0.36 0.00 0.00 175.35 175.84 2wzp s ARG 293 N 1.68 3.10 -0.11 4.03 0.52 -0.15 -0.79 118.95 127.23 2wzp s ARG 293 Ca 0.24 1.91 0.02 0.00 -0.52 0.00 0.00 55.73 57.38 2wzp s ARG 293 Cb -0.10 -2.06 -0.01 0.00 0.52 0.00 0.00 34.95 33.30 2wzp s ARG 293 CO -0.07 -1.12 -0.19 0.21 0.02 0.00 0.00 175.30 174.15 2wzp s LYS 294 N -3.15 3.21 -0.20 3.54 2.20 -0.94 -3.37 119.74 121.02 2wzp s LYS 294 Ca 0.75 -0.78 -0.03 0.00 -0.36 0.00 0.00 55.97 55.54 2wzp s LYS 294 Cb -0.32 -2.46 0.06 0.00 -1.51 0.00 0.00 37.83 33.60 2wzp s LYS 294 CO 0.36 0.20 0.06 0.00 -0.36 0.00 0.00 175.35 175.61 2wzp s ALA 295 N 0.33 0.89 0.31 3.13 0.00 -1.04 -4.64 121.76 120.74 2wzp s ALA 295 Ca -0.15 -0.70 0.08 0.00 0.00 0.00 0.00 51.96 51.19 2wzp s ALA 295 Cb -0.17 -1.19 0.50 0.00 0.00 0.00 0.00 23.12 22.26 2wzp s ALA 295 CO 0.07 -1.23 1.72 -0.44 0.00 0.00 0.00 175.76 175.88 2wzp h ASP 296 N 8.28 0.19 -3.87 0.00 3.32 -1.84 -3.38 116.42 119.12 2wzp h ASP 296 Ca -0.16 -0.08 -0.22 0.00 0.02 0.00 0.00 57.03 56.59 2wzp h ASP 296 Cb 1.11 -0.05 -0.27 0.00 0.22 0.00 0.00 39.33 40.34 2wzp h ASP 296 CO 0.34 0.59 -0.69 0.12 -1.72 0.00 0.00 179.24 177.88 2wzp s PHE 297 N -4.13 0.00 0.00 4.55 2.19 -1.26 -4.89 117.98 114.44 2wzp s PHE 297 Ca -0.04 0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.23 2wzp s PHE 297 Cb 0.14 -0.01 0.00 0.00 -1.31 0.00 0.00 43.02 41.84 2wzp s PHE 297 CO 0.76 -0.03 0.00 1.55 1.83 0.00 0.00 175.22 179.33