#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wff s THR 2 N 0.00 3.97 -0.14 2.52 -1.32 -1.26 -5.00 115.64 114.41 2wff s THR 2 Ca 0.00 1.16 -0.06 0.00 -1.21 0.00 0.00 61.69 61.59 2wff s THR 2 Cb 0.00 -3.77 -0.04 0.00 -1.51 0.00 0.00 72.50 67.18 2wff s THR 2 CO 0.00 -0.13 0.06 0.21 -2.21 0.00 0.00 174.62 172.56 2wff s ASN 3 N 2.67 5.70 -0.81 8.08 2.47 -1.26 -5.00 114.94 126.79 2wff s ASN 3 Ca 0.63 0.19 0.00 0.00 0.42 0.00 0.00 52.86 54.11 2wff s ASN 3 Cb -0.26 -1.85 0.20 0.00 -1.45 0.00 0.00 41.25 37.88 2wff s ASN 3 CO 0.22 0.29 0.66 -0.69 -3.72 0.00 0.00 177.10 173.86 2wff s VAL 4 N -0.33 3.84 0.00 -5.21 1.01 -1.26 -5.05 120.40 113.40 2wff s VAL 4 Ca 0.09 -3.92 0.00 0.00 0.00 0.00 0.00 61.98 58.14 2wff s VAL 4 Cb -0.12 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2wff s VAL 4 CO 0.02 -1.04 0.00 0.61 0.00 0.00 0.00 175.10 174.68 2wff n GLY 5 N 2.31 -0.96 4.24 4.51 0.00 -1.26 -4.60 105.19 109.43 2wff n GLY 5 Ca 0.20 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.79 2wff n GLY 5 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wff n GLU 6 N 0.00 0.00 -2.20 1.61 2.13 -1.26 -4.83 120.64 116.09 2wff n GLU 6 Ca 0.00 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.39 2wff n GLU 6 Cb 0.00 -0.04 0.00 0.00 0.27 0.00 0.00 31.44 31.67 2wff n GLU 6 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2wff n ASP 7 N 1.96 4.54 0.00 4.31 4.64 -1.26 -4.92 116.55 125.82 2wff n ASP 7 Ca 0.00 -2.93 0.00 0.00 -1.38 0.00 0.00 54.79 50.48 2wff n ASP 7 Cb 0.00 -1.63 0.00 0.00 -1.04 0.00 0.00 41.12 38.45 2wff n ASP 7 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2wff n GLY 8 N 4.14 1.21 0.00 0.27 0.00 -1.26 -4.79 105.19 104.77 2wff n GLY 8 Ca 0.47 0.63 0.00 0.00 0.00 0.00 0.00 46.02 47.12 2wff n GLY 8 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wff n GLU 9 N 0.00 0.00 0.00 1.61 -0.58 -1.26 -4.93 120.64 115.48 2wff n GLU 9 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2wff n GLU 9 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2wff n GLU 9 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 2wff n PRO 10 N 0.00 0.00 0.00 3.49 -0.02 -1.26 -4.94 135.00 132.27 2wff n PRO 10 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2wff n PRO 10 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2wff n PRO 10 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wff n GLY 11 N 0.00 3.85 3.80 -1.23 0.00 -1.26 -4.96 105.19 105.38 2wff n GLY 11 Ca 0.00 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 2wff n GLY 11 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wff s GLU 12 N -4.42 2.20 0.00 1.61 -1.05 -1.26 -5.10 118.70 110.68 2wff s GLU 12 Ca 0.00 -2.18 0.00 0.00 -0.15 0.00 0.00 54.97 52.64 2wff s GLU 12 Cb 0.00 -1.79 0.00 0.00 -0.44 0.00 0.00 34.13 31.90 2wff s GLU 12 CO 0.00 -0.39 0.00 2.41 0.95 0.00 0.00 175.26 178.23 2wff n THR 13 N -1.40 0.00 -2.80 1.83 -1.04 -1.26 -4.71 114.28 104.89 2wff n THR 13 Ca -0.10 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.88 2wff n THR 13 Cb 0.66 -0.23 -0.02 0.00 -1.82 0.00 0.00 70.33 68.91 2wff n THR 13 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2wff n GLU 14 N -0.94 -3.19 0.00 -2.82 -0.00 -1.26 -4.90 120.64 107.53 2wff n GLU 14 Ca 0.00 2.54 0.00 0.00 -0.00 0.00 0.00 57.16 59.70 2wff n GLU 14 Cb 0.12 -3.57 0.00 0.00 -0.00 0.00 0.00 31.44 27.99 2wff n GLU 14 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2wff n PRO 15 N 1.80 0.63 -3.69 3.44 -0.02 -1.26 -5.04 135.00 130.86 2wff n PRO 15 Ca -0.22 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 60.93 2wff n PRO 15 Cb 0.38 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.81 2wff n PRO 15 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2wff s ARG 16 N -0.87 3.64 -1.28 -0.52 0.52 -1.26 -4.29 118.95 114.89 2wff s ARG 16 Ca 0.00 -0.02 -0.03 0.00 -0.52 0.00 0.00 55.73 55.16 2wff s ARG 16 Cb 0.00 -2.99 0.01 0.00 0.52 0.00 0.00 34.95 32.49 2wff s ARG 16 CO 0.00 0.57 1.01 0.72 0.02 0.00 0.00 175.30 177.62 2wff n HIS 17 N 0.75 -2.35 0.06 -0.53 8.25 -1.26 -4.82 115.22 115.31 2wff n HIS 17 Ca -0.08 0.95 0.00 0.00 -0.26 0.00 0.00 57.72 58.33 2wff n HIS 17 Cb 0.52 -4.91 0.00 0.00 1.12 0.00 0.00 29.99 26.73 2wff n HIS 17 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wff n ALA 18 N -4.43 0.00 0.00 -1.41 0.00 -1.26 -4.82 120.51 108.59 2wff n ALA 18 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2wff n ALA 18 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 2wff n ALA 18 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2wff n LEU 19 N -0.81 -1.37 -4.82 0.00 0.00 -1.26 -4.97 117.00 103.77 2wff n LEU 19 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 56.01 55.63 2wff n LEU 19 Cb 0.31 0.70 -0.06 0.00 0.00 0.00 0.00 43.42 44.37 2wff n LEU 19 CO 0.00 0.00 0.24 -0.94 0.00 0.00 0.00 177.39 176.69 2wff s SER 20 N -0.72 6.98 0.00 1.96 1.04 -1.26 -5.07 113.70 116.63 2wff s SER 20 Ca 0.00 1.18 0.00 0.00 0.48 0.00 0.00 55.95 57.61 2wff s SER 20 Cb 0.00 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 63.79 2wff s SER 20 CO 0.00 0.25 0.30 -2.65 0.98 0.00 0.00 173.24 172.11 2wff n PRO 21 N 1.54 0.00 -1.41 4.02 -0.02 -1.26 -5.07 135.00 132.80 2wff n PRO 21 Ca -0.10 0.27 0.17 0.00 -2.02 0.00 0.00 63.50 61.82 2wff n PRO 21 Cb 0.51 -0.80 -0.09 0.00 -0.02 0.00 0.00 33.50 33.10 2wff n PRO 21 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wff n VAL 22 N -0.57 -0.90 0.00 -1.45 0.31 -1.26 -4.62 118.33 109.84 2wff n VAL 22 Ca 0.00 0.93 0.00 0.00 -0.01 0.00 0.00 64.34 65.26 2wff n VAL 22 Cb 0.00 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 2wff n VAL 22 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2wff n ASP 23 N -4.29 0.00 -1.65 4.52 2.03 -1.26 -4.32 116.55 111.57 2wff n ASP 23 Ca -0.09 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.03 2wff n ASP 23 Cb 0.67 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 41.02 2wff n ASP 23 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 2wff n MET 24 N 0.00 -1.35 0.00 -0.67 2.81 -1.26 -3.57 117.12 113.08 2wff n MET 24 Ca 0.00 1.06 0.00 0.00 -1.81 0.00 0.00 57.70 56.95 2wff n MET 24 Cb 0.00 -5.43 0.00 0.00 -0.71 0.00 0.00 33.22 27.08 2wff n MET 24 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2wff n HIS 25 N -2.99 0.00 0.00 2.03 -0.00 -1.26 -4.85 115.22 108.15 2wff n HIS 25 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.52 2wff n HIS 25 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.62 2wff n HIS 25 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2wff n VAL 26 N 0.00 0.00 0.29 1.59 0.31 -1.23 0.12 118.33 119.41 2wff n VAL 26 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.36 2wff n VAL 26 Cb 0.00 0.00 0.15 0.00 -0.91 0.00 0.00 33.84 33.08 2wff n VAL 26 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 2wff n HIS 27 N -0.55 0.00 0.32 3.52 8.25 -1.26 -1.60 115.22 123.90 2wff n HIS 27 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.56 2wff n HIS 27 Cb 0.00 -0.23 0.16 0.00 1.12 0.00 0.00 29.99 31.04 2wff n HIS 27 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2wff n THR 28 N -1.23 0.44 -2.26 1.59 -2.24 0.12 -4.82 114.28 105.88 2wff n THR 28 Ca 0.03 -0.72 -0.43 0.00 -2.27 0.00 0.00 64.05 60.66 2wff n THR 28 Cb 0.04 1.01 -0.02 0.00 -2.10 0.00 0.00 70.33 69.26 2wff n THR 28 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wff s ASP 29 N -1.36 6.29 0.10 3.42 -1.08 -0.63 -4.92 116.67 118.50 2wff s ASP 29 Ca 0.31 1.07 -0.20 0.00 -0.52 0.00 0.00 52.55 53.21 2wff s ASP 29 Cb 0.19 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 39.06 2wff s ASP 29 CO 0.26 -1.43 1.08 0.52 0.52 0.00 0.00 175.17 176.13 2wff n VAL 30 N 6.97 -0.44 -0.14 1.11 0.31 -1.26 -0.55 118.33 124.33 2wff n VAL 30 Ca 0.18 1.70 -0.07 0.00 -0.01 0.00 0.00 64.34 66.14 2wff n VAL 30 Cb 0.47 -2.11 0.02 0.00 -0.91 0.00 0.00 33.84 31.31 2wff n VAL 30 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2wff h SER 31 N 0.00 0.45 0.80 4.52 4.64 -1.92 -2.72 113.55 119.30 2wff h SER 31 Ca 0.10 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 2wff h SER 31 Cb 0.26 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2wff h SER 31 CO -0.60 0.32 -0.38 0.15 -0.87 0.00 0.00 176.83 175.44 2wff h PHE 32 N 0.55 -0.99 -0.38 4.77 3.57 -1.22 -2.70 116.94 120.53 2wff h PHE 32 Ca 0.17 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.76 2wff h PHE 32 Cb -0.01 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2wff h PHE 32 CO -0.06 -0.62 0.47 -0.07 -2.23 0.00 0.00 178.31 175.80 2wff h LEU 33 N -1.11 0.00 -1.33 0.59 3.38 -0.83 -2.24 115.31 113.77 2wff h LEU 33 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2wff h LEU 33 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2wff h LEU 33 CO 0.18 0.00 -0.10 0.18 0.09 0.00 0.00 178.44 178.79 2wff n LEU 34 N -3.58 2.17 -2.24 1.67 4.77 -1.03 -4.52 117.00 114.24 2wff n LEU 34 Ca 0.07 -0.73 -0.23 0.00 -0.03 0.00 0.00 56.01 55.09 2wff n LEU 34 Cb 0.63 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.70 2wff n LEU 34 CO 0.25 0.37 1.42 -0.67 -1.33 0.00 0.00 177.39 177.44 2wff n ASP 35 N 0.56 6.57 -3.73 -1.43 4.64 -0.84 -1.66 116.55 120.66 2wff n ASP 35 Ca 0.15 -3.19 -0.13 0.00 -1.38 0.00 0.00 54.79 50.23 2wff n ASP 35 Cb 0.48 -1.14 -0.14 0.00 -1.04 0.00 0.00 41.12 39.28 2wff n ASP 35 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2wff s ARG 36 N -1.93 0.15 -0.50 -0.67 3.03 -1.26 -4.82 118.95 112.95 2wff s ARG 36 Ca 0.48 0.49 -0.35 0.00 2.03 0.00 0.00 55.73 58.37 2wff s ARG 36 Cb 0.33 -0.15 -0.14 0.00 -1.03 0.00 0.00 34.95 33.97 2wff s ARG 36 CO -0.12 -0.18 2.29 1.19 -1.13 0.00 0.00 175.30 177.35 2wff n PHE 37 N 4.34 1.33 -3.33 5.89 3.72 -1.19 -4.54 117.46 123.67 2wff n PHE 37 Ca -0.24 0.37 -0.23 0.00 -0.05 0.00 0.00 57.45 57.31 2wff n PHE 37 Cb 0.52 -2.47 -0.00 0.00 -0.94 0.00 0.00 39.48 36.59 2wff n PHE 37 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2wff s PHE 38 N 7.87 3.36 -0.48 1.38 2.99 -0.29 -4.80 117.98 128.01 2wff s PHE 38 Ca 1.15 0.20 -0.16 0.00 0.00 0.00 0.00 56.93 58.12 2wff s PHE 38 Cb -0.97 -2.00 0.08 0.00 0.00 0.00 0.00 43.02 40.12 2wff s PHE 38 CO 0.50 -0.01 0.41 0.34 -0.00 0.00 0.00 175.22 176.45 2wff s ASP 39 N -4.10 6.15 -0.01 1.36 -1.08 -1.26 -3.02 116.67 114.70 2wff s ASP 39 Ca 0.43 -1.34 0.04 0.00 -0.52 0.00 0.00 52.55 51.16 2wff s ASP 39 Cb -0.10 -2.19 -0.01 0.00 -1.46 0.00 0.00 42.92 39.17 2wff s ASP 39 CO 0.35 -0.66 -0.15 0.54 0.52 0.00 0.00 175.17 175.77 2wff s VAL 40 N 1.67 1.17 0.22 1.11 0.11 -1.25 -5.05 120.40 118.37 2wff s VAL 40 Ca 0.04 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.47 2wff s VAL 40 Cb -0.24 -0.98 0.00 0.00 -1.53 0.00 0.00 36.38 33.63 2wff s VAL 40 CO 0.07 0.33 0.00 -0.62 -3.33 0.00 0.00 175.10 171.55 2wff n GLU 41 N 2.77 -1.89 0.00 1.54 1.02 -1.26 -3.83 120.64 118.99 2wff n GLU 41 Ca -0.15 1.25 0.00 0.00 -0.02 0.00 0.00 57.16 58.24 2wff n GLU 41 Cb 0.55 -2.31 0.00 0.00 -0.02 0.00 0.00 31.44 29.66 2wff n GLU 41 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2wff n THR 42 N -3.12 0.00 -3.31 2.62 5.66 -1.26 -3.80 114.28 111.07 2wff n THR 42 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 2wff n THR 42 Cb 0.43 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 2wff n THR 42 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wff n LEU 43 N 0.00 0.00 -4.02 1.09 -0.00 -1.26 -4.96 117.00 107.85 2wff n LEU 43 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 56.01 55.77 2wff n LEU 43 Cb 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.26 2wff n LEU 43 CO 0.00 0.00 -0.46 -1.83 -0.00 0.00 0.00 177.39 175.10 2wff s GLU 44 N 0.06 1.57 1.29 1.47 -1.05 -1.26 -4.32 118.70 116.46 2wff s GLU 44 Ca 0.00 -0.39 -0.20 0.00 -0.15 0.00 0.00 54.97 54.23 2wff s GLU 44 Cb 0.00 -1.32 0.32 0.00 -0.44 0.00 0.00 34.13 32.69 2wff s GLU 44 CO 0.00 0.04 1.03 -0.51 0.95 0.00 0.00 175.26 176.77 2wff s LEU 45 N 0.60 -0.05 0.20 1.83 1.02 -1.26 -4.99 118.68 116.03 2wff s LEU 45 Ca -0.13 0.76 0.08 0.00 0.02 0.00 0.00 54.13 54.86 2wff s LEU 45 Cb -0.15 -2.38 -0.04 0.00 0.02 0.00 0.00 46.19 43.64 2wff s LEU 45 CO 0.03 -4.66 0.01 -0.44 0.02 0.00 0.00 176.35 171.32 2wff s SER 46 N -3.52 4.77 0.42 2.29 0.01 0.90 -4.72 113.70 113.85 2wff s SER 46 Ca 0.70 -0.44 -0.18 0.00 1.31 0.00 0.00 55.95 57.35 2wff s SER 46 Cb -0.12 -1.00 -0.09 0.00 0.21 0.00 0.00 66.02 65.01 2wff s SER 46 CO 0.57 0.06 0.89 0.21 0.41 0.00 0.00 173.24 175.38 2wff s ASN 47 N -3.13 6.80 0.30 2.44 3.04 -1.26 -2.05 114.94 121.07 2wff s ASN 47 Ca 0.28 1.51 -0.01 0.00 0.04 0.00 0.00 52.86 54.68 2wff s ASN 47 Cb -0.09 -2.47 0.45 0.00 -1.54 0.00 0.00 41.25 37.60 2wff s ASN 47 CO 0.19 -0.37 1.92 -0.07 -3.04 0.00 0.00 177.10 175.73 2wff h LEU 48 N 1.74 0.86-10.54 3.21 3.38 -1.88 -3.44 115.31 108.63 2wff h LEU 48 Ca -0.48 -0.07 -0.43 0.00 0.09 0.00 0.00 57.88 56.99 2wff h LEU 48 Cb 1.18 -0.22 0.18 0.00 0.09 0.00 0.00 40.66 41.89 2wff h LEU 48 CO 0.62 0.70 0.24 -0.89 0.09 0.00 0.00 178.44 179.20 2wff s THR 49 N -5.63 1.74 0.04 0.22 2.01 -1.26 -3.74 115.64 109.03 2wff s THR 49 Ca -0.11 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.89 2wff s THR 49 Cb 0.17 -2.67 0.00 0.00 0.01 0.00 0.00 72.50 70.01 2wff s THR 49 CO 0.79 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.33 2wff n GLY 50 N -1.94 -1.22 3.77 4.40 0.00 -1.26 -4.86 105.19 104.08 2wff n GLY 50 Ca 0.14 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.73 2wff n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wff s SER 51 N -4.38 6.07 0.52 1.61 0.01 -1.26 -4.55 113.70 111.73 2wff s SER 51 Ca 0.00 0.29 -0.02 0.00 1.31 0.00 0.00 55.95 57.52 2wff s SER 51 Cb 0.00 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.24 2wff s SER 51 CO 0.00 0.29 0.78 -2.16 0.41 0.00 0.00 173.24 172.56 2wff s PRO 52 N -0.30 2.94 -0.65 12.44 0.04 -1.25 -5.05 135.00 143.16 2wff s PRO 52 Ca 0.10 -0.31 -0.06 0.00 0.04 0.00 0.00 61.00 60.77 2wff s PRO 52 Cb -0.12 -2.42 0.17 0.00 0.04 0.00 0.00 34.50 32.17 2wff s PRO 52 CO 0.01 -0.51 0.50 0.00 0.04 0.00 0.00 177.00 177.04 2wff s ALA 53 N -2.77 3.67 -0.28 8.56 0.00 -1.26 -4.92 121.76 124.76 2wff s ALA 53 Ca 0.52 -3.19 -0.32 0.00 0.00 0.00 0.00 51.96 48.97 2wff s ALA 53 Cb -0.10 -2.87 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 2wff s ALA 53 CO 0.41 -2.12 2.19 2.41 0.00 0.00 0.00 175.76 178.65 2wff n THR 54 N 3.75 0.28 -2.42 0.00 -1.04 -1.26 -4.93 114.28 108.67 2wff n THR 54 Ca 0.08 -0.34 -0.39 0.00 -2.04 0.00 0.00 64.05 61.36 2wff n THR 54 Cb 0.40 -2.07 -0.03 0.00 -1.82 0.00 0.00 70.33 66.81 2wff n THR 54 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2wff s HIS 55 N 7.61 3.30 -0.17 -1.42 2.46 -0.81 -4.87 115.29 121.41 2wff s HIS 55 Ca 1.05 1.62 0.01 0.00 0.47 0.00 0.00 55.06 58.22 2wff s HIS 55 Cb -0.62 -3.30 0.02 0.00 -0.13 0.00 0.00 32.58 28.55 2wff s HIS 55 CO 0.43 -0.89 -0.20 0.08 -2.47 0.00 0.00 174.74 171.69 2wff s VAL 56 N -1.38 2.02 -1.07 0.89 1.01 -1.26 -1.04 120.40 119.57 2wff s VAL 56 Ca 0.52 -0.93 -0.20 0.00 0.00 0.00 0.00 61.98 61.38 2wff s VAL 56 Cb -0.29 -1.82 -0.07 0.00 0.00 0.00 0.00 36.38 34.20 2wff s VAL 56 CO 0.37 0.54 1.99 0.18 0.00 0.00 0.00 175.10 178.18 2wff n LEU 57 N 4.46 4.79 -4.10 3.92 4.77 0.27 -4.83 117.00 126.28 2wff n LEU 57 Ca -0.20 -3.38 -0.36 0.00 -0.03 0.00 0.00 56.01 52.03 2wff n LEU 57 Cb 0.50 -1.42 -0.10 0.00 -2.33 0.00 0.00 43.42 40.08 2wff n LEU 57 CO 0.26 -0.12 0.04 -0.62 -1.33 0.00 0.00 177.39 175.62 2wff s ASP 58 N 4.64 5.25 -0.29 -1.43 2.15 -1.26 -2.34 116.67 123.38 2wff s ASP 58 Ca 0.56 -2.83 -0.00 0.00 0.43 0.00 0.00 52.55 50.70 2wff s ASP 58 Cb 0.11 -1.86 0.24 0.00 -0.30 0.00 0.00 42.92 41.11 2wff s ASP 58 CO 0.06 -0.37 1.88 -0.81 -0.17 0.00 0.00 175.17 175.76 2wff n PRO 59 N 3.52 1.75 -0.44 4.34 -0.04 -1.26 -4.28 135.00 138.59 2wff n PRO 59 Ca 0.08 -1.52 0.06 0.00 -0.04 0.00 0.00 63.50 62.07 2wff n PRO 59 Cb 0.38 -1.60 0.19 0.00 -0.04 0.00 0.00 33.50 32.44 2wff n PRO 59 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2wff n PHE 60 N 0.21 0.39 -0.09 0.54 3.01 -1.26 -4.75 117.46 115.51 2wff n PHE 60 Ca 0.29 -1.25 -0.18 0.00 1.01 0.00 0.00 57.45 57.32 2wff n PHE 60 Cb 0.69 -0.28 -0.13 0.00 -0.01 0.00 0.00 39.48 39.75 2wff n PHE 60 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wff n GLY 61 N -1.13 -0.50 7.00 1.37 0.00 -1.26 -4.96 105.19 105.72 2wff n GLY 61 Ca 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wff n GLY 61 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2wff n SER 62 N -3.27 -4.68 0.00 1.61 2.88 -1.26 -5.02 113.62 103.88 2wff n SER 62 Ca -0.40 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.14 2wff n SER 62 Cb 1.02 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.48 2wff n SER 62 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2wff n THR 63 N -1.34 0.00 -1.83 2.46 -1.04 -1.26 -5.01 114.28 106.26 2wff n THR 63 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 2wff n THR 63 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 2wff n THR 63 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wff s ALA 64 N -1.90 2.42 -0.48 2.41 0.00 -1.26 -4.79 121.76 118.16 2wff s ALA 64 Ca 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 2wff s ALA 64 Cb 0.00 -4.16 -0.03 0.00 0.00 0.00 0.00 23.12 18.93 2wff s ALA 64 CO 0.00 -3.33 1.59 1.04 0.00 0.00 0.00 175.76 175.05 2wff n GLN 65 N 8.79 1.09 -1.26 0.00 3.00 -1.26 -4.70 117.38 123.04 2wff n GLN 65 Ca 0.27 -1.01 -0.20 0.00 -0.01 0.00 0.00 57.00 56.04 2wff n GLN 65 Cb 0.49 -2.25 -0.11 0.00 0.00 0.00 0.00 30.24 28.38 2wff n GLN 65 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2wff n LEU 66 N 4.65 5.96 0.00 1.08 7.99 -1.26 -4.77 117.00 130.64 2wff n LEU 66 Ca 0.24 -3.66 0.00 0.00 -0.01 0.00 0.00 56.01 52.58 2wff n LEU 66 Cb 0.07 -1.34 0.00 0.00 -0.11 0.00 0.00 43.42 42.05 2wff n LEU 66 CO 0.62 1.73 0.00 0.00 -1.51 0.00 0.00 177.39 178.23 2wff n ALA 67 N 1.76 0.00 -0.06 -1.18 0.00 -1.26 -4.33 120.51 115.45 2wff n ALA 67 Ca 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.85 2wff n ALA 67 Cb 0.72 -0.07 -0.08 0.00 0.00 0.00 0.00 19.45 20.02 2wff n ALA 67 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 2wff n TRP 68 N -0.05 0.00 0.21 0.00 4.27 -1.26 -4.67 117.44 115.95 2wff n TRP 68 Ca 0.00 0.00 -0.08 0.00 -3.89 0.00 0.00 57.50 53.53 2wff n TRP 68 Cb 0.02 -0.53 -0.04 0.00 -1.36 0.00 0.00 31.31 29.41 2wff n TRP 68 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2wff h ALA 69 N 0.38 -1.02 -2.77 -1.67 0.00 -1.84 -3.21 119.26 109.13 2wff h ALA 69 Ca -0.29 -0.12 -0.51 0.00 0.00 0.00 0.00 54.91 53.99 2wff h ALA 69 Cb 1.61 0.21 0.05 0.00 0.00 0.00 0.00 17.79 19.66 2wff h ALA 69 CO -0.00 -0.98 0.53 1.03 0.00 0.00 0.00 179.25 179.83 2wff s ARG 70 N -3.96 4.20 0.00 0.00 0.52 -1.26 -2.64 118.95 115.81 2wff s ARG 70 Ca -0.08 1.91 0.00 0.00 -0.52 0.00 0.00 55.73 57.04 2wff s ARG 70 Cb 0.01 -2.83 0.00 0.00 0.52 0.00 0.00 34.95 32.64 2wff s ARG 70 CO 0.24 -0.21 0.00 -0.11 0.02 0.00 0.00 175.30 175.24 2wff n LEU 71 N 0.39 0.00 0.03 2.53 0.00 -1.26 -4.68 117.00 114.01 2wff n LEU 71 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 56.01 55.97 2wff n LEU 71 Cb 0.45 0.00 -0.12 0.00 0.00 0.00 0.00 43.42 43.75 2wff n LEU 71 CO 0.53 0.00 -0.12 -0.07 0.00 0.00 0.00 177.39 177.73 2wff h LEU 72 N 0.00 0.00 -5.32 -1.96 3.38 -1.50 -3.37 115.31 106.54 2wff h LEU 72 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 2wff h LEU 72 Cb 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 40.42 2wff h LEU 72 CO 0.00 0.97 0.31 0.59 0.09 0.00 0.00 178.44 180.40 2wff n ASN 73 N -3.21 6.23 0.00 -0.43 3.02 -1.22 -3.84 115.26 115.81 2wff n ASN 73 Ca -0.07 -3.74 0.00 0.00 -0.03 0.00 0.00 54.58 50.74 2wff n ASN 73 Cb 0.97 -0.86 0.00 0.00 -0.61 0.00 0.00 39.78 39.28 2wff n ASN 73 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2wff n THR 74 N -0.33 0.00 -4.30 3.41 -1.04 -1.26 -4.77 114.28 105.99 2wff n THR 74 Ca 0.44 -0.10 -0.28 0.00 -2.04 0.00 0.00 64.05 62.07 2wff n THR 74 Cb 0.36 0.63 -0.06 0.00 -1.82 0.00 0.00 70.33 69.44 2wff n THR 74 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wff n THR 76 N -1.32 1.19 -4.38 0.00 -1.04 0.14 -4.67 114.28 104.20 2wff n THR 76 Ca -0.06 -0.10 -0.31 0.00 -2.04 0.00 0.00 64.05 61.53 2wff n THR 76 Cb 0.65 -1.89 -0.10 0.00 -1.82 0.00 0.00 70.33 67.18 2wff n THR 76 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2wff s TYR 77 N -2.45 2.81 -0.02 -1.42 2.02 -1.14 -0.22 117.35 116.93 2wff s TYR 77 Ca -0.25 -0.10 -0.01 0.00 -0.37 0.00 0.00 57.07 56.34 2wff s TYR 77 Cb 0.08 -1.53 0.01 0.00 -0.40 0.00 0.00 41.96 40.12 2wff s TYR 77 CO 0.33 0.38 0.04 0.12 -1.57 0.00 0.00 175.55 174.85 2wff s PHE 78 N -1.08 -0.03 -0.04 2.71 5.36 0.14 -1.35 117.98 123.69 2wff s PHE 78 Ca 0.19 0.12 -0.01 0.00 -0.96 0.00 0.00 56.93 56.27 2wff s PHE 78 Cb -0.11 -0.05 0.03 0.00 -0.34 0.00 0.00 43.02 42.55 2wff s PHE 78 CO 0.10 -0.04 0.03 0.12 -1.46 0.00 0.00 175.22 173.97 2wff s PHE 79 N 0.35 0.24 0.16 10.12 2.19 -0.50 -0.75 117.98 129.79 2wff s PHE 79 Ca -0.03 0.09 -0.24 0.00 0.33 0.00 0.00 56.93 57.08 2wff s PHE 79 Cb -0.04 -0.49 0.06 0.00 -1.31 0.00 0.00 43.02 41.24 2wff s PHE 79 CO -0.01 -0.19 0.74 -1.54 1.83 0.00 0.00 175.22 176.05 2wff s SER 80 N 1.68 -0.39 0.14 6.13 1.04 -1.26 -0.02 113.70 121.02 2wff s SER 80 Ca -0.01 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2wff s SER 80 Cb -0.13 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.57 2wff s SER 80 CO -0.03 -0.99 0.00 0.47 0.98 0.00 0.00 173.24 173.67 2wff n ASP 81 N -0.39 0.00 -4.03 7.02 10.43 -0.13 -4.54 116.55 124.91 2wff n ASP 81 Ca -0.10 -0.23 -0.10 0.00 2.57 0.00 0.00 54.79 56.93 2wff n ASP 81 Cb 0.62 0.00 -0.06 0.00 1.84 0.00 0.00 41.12 43.52 2wff n ASP 81 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2wff s LEU 82 N 0.00 0.54 -0.26 0.64 2.96 -0.14 -4.43 118.68 117.99 2wff s LEU 82 Ca 0.00 -1.01 -0.24 0.00 -0.22 0.00 0.00 54.13 52.66 2wff s LEU 82 Cb 0.00 1.44 0.07 0.00 0.50 0.00 0.00 46.19 48.20 2wff s LEU 82 CO 0.00 -1.06 0.70 -1.61 -1.32 0.00 0.00 176.35 173.07 2wff s GLU 83 N -4.04 0.81 0.40 1.98 2.02 -0.80 -2.03 118.70 117.03 2wff s GLU 83 Ca 0.25 1.00 0.05 0.00 0.02 0.00 0.00 54.97 56.29 2wff s GLU 83 Cb 0.01 0.37 -0.07 0.00 0.10 0.00 0.00 34.13 34.55 2wff s GLU 83 CO 0.09 -0.10 0.03 -0.51 0.02 0.00 0.00 175.26 174.78 2wff s LEU 84 N 0.50 2.57 -0.47 1.80 1.02 -1.01 -1.67 118.68 121.42 2wff s LEU 84 Ca -0.01 -1.42 0.07 0.00 0.02 0.00 0.00 54.13 52.79 2wff s LEU 84 Cb -0.05 -0.69 0.18 0.00 0.02 0.00 0.00 46.19 45.65 2wff s LEU 84 CO -0.01 -0.56 0.66 -0.55 0.02 0.00 0.00 176.35 175.90 2wff s SER 85 N -3.66 -1.23 0.33 2.29 0.15 -1.25 -1.41 113.70 108.92 2wff s SER 85 Ca 0.32 -1.42 -0.27 0.00 0.70 0.00 0.00 55.95 55.27 2wff s SER 85 Cb 0.08 1.76 -0.09 0.00 -1.71 0.00 0.00 66.02 66.06 2wff s SER 85 CO 0.15 -0.11 1.09 -0.63 1.20 0.00 0.00 173.24 174.94 2wff s ILE 86 N 1.24 3.54 0.07 6.45 1.09 -1.26 -4.21 121.20 128.11 2wff s ILE 86 Ca 0.24 1.41 -0.00 0.00 -1.10 0.00 0.00 60.65 61.19 2wff s ILE 86 Cb -0.02 -3.84 -0.00 0.00 -1.06 0.00 0.00 42.46 37.54 2wff s ILE 86 CO -0.06 0.23 -0.01 1.67 -0.10 0.00 0.00 174.94 176.67 2wff n GLN 87 N 0.70 0.02 -0.69 2.79 7.27 -0.16 -2.16 117.38 125.15 2wff n GLN 87 Ca 0.01 0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.09 2wff n GLN 87 Cb 0.46 -0.53 0.00 0.00 2.41 0.00 0.00 30.24 32.59 2wff n GLN 87 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2wff n PHE 88 N -3.42 0.00 -2.26 3.69 7.35 0.12 -3.86 117.46 119.07 2wff n PHE 88 Ca -0.01 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.26 2wff n PHE 88 Cb 0.12 -0.69 -0.02 0.00 0.35 0.00 0.00 39.48 39.24 2wff n PHE 88 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 2wff s LYS 89 N -1.17 4.18 0.40 -4.13 2.47 -1.26 -4.69 119.74 115.54 2wff s LYS 89 Ca 0.00 1.83 -0.26 0.00 -1.56 0.00 0.00 55.97 55.97 2wff s LYS 89 Cb 0.00 -3.86 -0.09 0.00 -1.46 0.00 0.00 37.83 32.42 2wff s LYS 89 CO 0.00 -0.80 1.35 -0.06 0.16 0.00 0.00 175.35 176.00 2wff s PHE 90 N 3.81 2.75 -0.18 4.03 0.08 -1.26 -1.22 117.98 125.98 2wff s PHE 90 Ca 0.62 1.35 0.22 0.00 0.12 0.00 0.00 56.93 59.24 2wff s PHE 90 Cb -0.26 -3.77 -0.27 0.00 -0.57 0.00 0.00 43.02 38.15 2wff s PHE 90 CO 0.21 -2.34 0.61 2.41 -0.10 0.00 0.00 175.22 176.00 2wff n THR 91 N 0.20 0.07 0.00 0.64 -1.04 -1.23 -4.80 114.28 108.11 2wff n THR 91 Ca 0.03 -0.44 0.00 0.00 -2.04 0.00 0.00 64.05 61.60 2wff n THR 91 Cb 0.42 0.08 0.00 0.00 -1.82 0.00 0.00 70.33 69.01 2wff n THR 91 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2wff n THR 92 N -2.21 0.00 -2.96 12.58 -1.04 -1.26 -4.93 114.28 114.46 2wff n THR 92 Ca -0.02 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.55 2wff n THR 92 Cb 0.54 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.01 2wff n THR 92 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2wff s THR 93 N 3.11 4.53 -0.94 12.58 2.01 -1.26 -4.95 115.64 130.73 2wff s THR 93 Ca 0.00 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.37 2wff s THR 93 Cb 0.00 -4.61 0.00 0.00 0.01 0.00 0.00 72.50 67.90 2wff s THR 93 CO 0.00 -1.33 0.00 -0.81 -0.69 0.00 0.00 174.62 171.79 2wff n PRO 94 N 7.14 0.00 -0.65 4.92 -0.04 -1.26 -2.28 135.00 142.83 2wff n PRO 94 Ca -0.06 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.46 2wff n PRO 94 Cb 0.44 -0.90 0.17 0.00 -0.04 0.00 0.00 33.50 33.17 2wff n PRO 94 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2wff n SER 95 N 0.08 1.65 -0.19 3.54 3.41 -1.26 -4.73 113.62 116.12 2wff n SER 95 Ca 0.00 -3.48 0.07 0.00 -0.26 0.00 0.00 58.87 55.20 2wff n SER 95 Cb 0.00 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.44 2wff n SER 95 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wff n SER 96 N -0.91 1.16 -4.04 4.04 7.64 -0.97 -4.77 113.62 115.78 2wff n SER 96 Ca 0.16 -1.08 -0.32 0.00 1.01 0.00 0.00 58.87 58.64 2wff n SER 96 Cb 0.75 0.70 -0.14 0.00 -1.01 0.00 0.00 64.21 64.50 2wff n SER 96 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2wff s VAL 97 N -2.00 2.51 -0.03 0.44 1.01 -1.26 -4.97 120.40 116.10 2wff s VAL 97 Ca 0.09 -2.33 0.00 0.00 0.00 0.00 0.00 61.98 59.74 2wff s VAL 97 Cb 0.11 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.67 2wff s VAL 97 CO 0.46 -0.63 0.96 0.61 0.00 0.00 0.00 175.10 176.49 2wff n GLY 98 N 4.27 1.93 0.33 4.51 0.00 -1.26 -4.59 105.19 110.38 2wff n GLY 98 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2wff n GLY 98 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wff n GLU 99 N 0.50 0.00 -3.07 1.61 2.13 -1.26 -4.92 120.64 115.63 2wff n GLU 99 Ca 0.00 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.76 2wff n GLU 99 Cb 0.48 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.20 2wff n GLU 99 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wff n GLY 100 N -1.45 -1.39 3.84 8.31 0.00 -1.26 0.27 105.19 113.52 2wff n GLY 100 Ca 0.00 0.41 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 2wff n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wff s PHE 101 N -1.39 3.57 -0.17 1.61 0.08 -1.26 -0.46 117.98 119.96 2wff s PHE 101 Ca 0.07 1.15 -0.01 0.00 0.12 0.00 0.00 56.93 58.27 2wff s PHE 101 Cb -0.01 -2.45 0.05 0.00 -0.57 0.00 0.00 43.02 40.04 2wff s PHE 101 CO 0.42 0.34 -0.03 0.08 -0.10 0.00 0.00 175.22 175.94 2wff s VAL 102 N -1.59 0.95 -1.41 -0.44 1.01 -0.92 -3.79 120.40 114.22 2wff s VAL 102 Ca 0.42 -0.61 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 2wff s VAL 102 Cb -0.14 -1.22 0.07 0.00 0.00 0.00 0.00 36.38 35.09 2wff s VAL 102 CO 0.20 0.03 2.10 0.79 0.00 0.00 0.00 175.10 178.22 2wff n TRP 103 N 4.92 3.60 -2.06 5.22 8.01 0.25 -4.08 117.44 133.29 2wff n TRP 103 Ca -0.11 -2.94 -0.43 0.00 -1.31 0.00 0.00 57.50 52.71 2wff n TRP 103 Cb 0.47 -2.46 -0.03 0.00 -2.01 0.00 0.00 31.31 27.29 2wff n TRP 103 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 2wff s VAL 104 N 2.82 3.59 -0.12 -0.99 1.01 -1.18 -3.87 120.40 121.66 2wff s VAL 104 Ca 0.46 0.64 0.01 0.00 0.00 0.00 0.00 61.98 63.10 2wff s VAL 104 Cb 0.12 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.84 2wff s VAL 104 CO -0.05 -0.34 -0.15 -0.75 0.00 0.00 0.00 175.10 173.80 2wff s LYS 105 N 5.07 2.25 0.21 2.72 2.20 -0.88 -1.34 119.74 129.96 2wff s LYS 105 Ca 0.75 -0.57 -0.07 0.00 -0.36 0.00 0.00 55.97 55.72 2wff s LYS 105 Cb -0.24 -1.94 -0.06 0.00 -1.51 0.00 0.00 37.83 34.07 2wff s LYS 105 CO 0.31 -0.09 0.48 -0.46 -0.36 0.00 0.00 175.35 175.23 2wff s TRP 106 N 1.08 3.45 0.02 4.03 -0.00 -1.17 -1.07 118.94 125.29 2wff s TRP 106 Ca -0.04 0.71 0.05 0.00 -0.00 0.00 0.00 56.10 56.82 2wff s TRP 106 Cb -0.14 -2.14 -0.02 0.00 -0.00 0.00 0.00 33.47 31.17 2wff s TRP 106 CO -0.03 0.31 -0.14 -0.06 -0.00 0.00 0.00 176.95 177.03 2wff s PHE 107 N -1.80 1.27 0.37 5.86 0.40 -1.20 -4.39 117.98 118.48 2wff s PHE 107 Ca 0.44 -0.32 -0.09 0.00 -0.60 0.00 0.00 56.93 56.37 2wff s PHE 107 Cb -0.11 -0.77 -0.06 0.00 0.51 0.00 0.00 43.02 42.58 2wff s PHE 107 CO 0.24 0.02 0.71 -1.25 0.70 0.00 0.00 175.22 175.64 2wff s PRO 108 N -0.88 3.76 -0.30 0.24 0.04 -1.26 -2.00 135.00 134.60 2wff s PRO 108 Ca 0.03 0.36 -0.38 0.00 0.04 0.00 0.00 61.00 61.05 2wff s PRO 108 Cb -0.07 -2.47 -0.14 0.00 0.04 0.00 0.00 34.50 31.87 2wff s PRO 108 CO 0.01 0.05 1.95 0.28 0.04 0.00 0.00 177.00 179.32 2wff n VAL 109 N -1.12 0.28 0.00 -0.36 0.31 -1.26 -1.99 118.33 114.19 2wff n VAL 109 Ca 0.01 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2wff n VAL 109 Cb 0.54 -1.41 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 2wff n VAL 109 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wff n GLY 110 N 5.26 2.70 3.65 2.92 0.00 -1.26 -4.80 105.19 113.66 2wff n GLY 110 Ca 0.33 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.91 2wff n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wff n ALA 111 N -0.77 0.57 -1.00 4.61 0.00 -0.84 -4.98 120.51 118.10 2wff n ALA 111 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2wff n ALA 111 Cb 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.31 2wff n ALA 111 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wff n PRO 112 N 0.69 -1.40 0.00 0.00 -0.04 -1.26 -5.01 135.00 127.98 2wff n PRO 112 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2wff n PRO 112 Cb 0.34 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.80 2wff n PRO 112 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2wff n THR 113 N -2.71 0.00 -0.08 0.52 -1.04 -1.26 -5.06 114.28 104.65 2wff n THR 113 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2wff n THR 113 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2wff n THR 113 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2wff n LYS 114 N -0.34 0.00 -3.92 -2.82 4.81 -1.26 -4.88 118.16 109.75 2wff n LYS 114 Ca 0.00 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.12 2wff n LYS 114 Cb 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 34.92 2wff n LYS 114 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2wff s THR 115 N 0.00 2.71 0.12 3.15 2.01 -1.26 -4.84 115.64 117.54 2wff s THR 115 Ca 0.00 -2.88 0.02 0.00 0.31 0.00 0.00 61.69 59.14 2wff s THR 115 Cb 0.00 -2.89 0.02 0.00 0.01 0.00 0.00 72.50 69.64 2wff s THR 115 CO 0.00 -0.74 0.17 0.41 -0.69 0.00 0.00 174.62 173.76 2wff n THR 116 N 3.62 0.00 -1.91 -0.82 -1.04 -1.26 -3.86 114.28 109.01 2wff n THR 116 Ca 0.04 -0.38 -0.31 0.00 -2.04 0.00 0.00 64.05 61.36 2wff n THR 116 Cb 0.37 -0.93 0.01 0.00 -1.82 0.00 0.00 70.33 67.95 2wff n THR 116 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2wff s ASP 117 N -1.73 6.04 0.00 8.00 1.01 -1.26 -0.54 116.67 128.19 2wff s ASP 117 Ca 0.12 1.54 0.00 0.00 0.71 0.00 0.00 52.55 54.92 2wff s ASP 117 Cb -0.01 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.43 2wff s ASP 117 CO 0.08 -0.99 0.00 0.00 0.21 0.00 0.00 175.17 174.47 2wff n ALA 118 N -2.55 0.00 -2.47 5.23 0.00 -1.26 -4.71 120.51 114.75 2wff n ALA 118 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.29 2wff n ALA 118 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.94 2wff n ALA 118 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2wff s TRP 119 N 0.00 2.81 -0.29 0.00 -0.00 -1.24 -5.00 118.94 115.22 2wff s TRP 119 Ca 0.00 -0.36 -0.18 0.00 -0.00 0.00 0.00 56.10 55.56 2wff s TRP 119 Cb 0.00 -1.80 0.17 0.00 -0.00 0.00 0.00 33.47 31.84 2wff s TRP 119 CO 0.00 0.20 1.12 -1.14 -0.00 0.00 0.00 176.95 177.13 2wff s GLN 120 N -3.96 0.26 -0.36 5.86 0.74 -1.26 -3.35 119.66 117.58 2wff s GLN 120 Ca 0.41 0.41 -0.10 0.00 0.05 0.00 0.00 55.36 56.13 2wff s GLN 120 Cb -0.04 0.07 0.03 0.00 1.10 0.00 0.00 33.01 34.17 2wff s GLN 120 CO 0.25 -0.05 0.19 -1.17 -0.55 0.00 0.00 175.29 173.97 2wff s LEU 121 N 0.95 4.62 -0.17 3.68 1.98 -0.93 -4.98 118.68 123.82 2wff s LEU 121 Ca -0.05 -0.96 -0.20 0.00 -2.89 0.00 0.00 54.13 50.03 2wff s LEU 121 Cb -0.04 -2.01 -0.03 0.00 0.66 0.00 0.00 46.19 44.78 2wff s LEU 121 CO -0.12 -0.36 0.56 -0.70 -1.89 0.00 0.00 176.35 173.84 2wff s GLU 122 N 1.55 4.24 -0.36 1.98 2.12 -1.26 -2.72 118.70 124.24 2wff s GLU 122 Ca 0.02 0.53 0.03 0.00 0.36 0.00 0.00 54.97 55.91 2wff s GLU 122 Cb -0.19 -3.54 0.19 0.00 0.26 0.00 0.00 34.13 30.85 2wff s GLU 122 CO 0.06 -0.11 0.73 0.20 -0.54 0.00 0.00 175.26 175.61 2wff s GLY 123 N 1.05 -1.30 0.00 -1.50 0.00 -1.26 -4.96 107.32 99.34 2wff s GLY 123 Ca 0.27 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.70 2wff s GLY 123 CO 0.11 3.83 0.00 0.61 0.00 0.00 0.00 173.10 177.65 2wff n GLY 124 N 4.49 2.03 0.00 0.20 0.00 -1.26 -4.74 105.19 105.92 2wff n GLY 124 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2wff n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wff n GLY 125 N -2.00 0.95 5.00 -0.02 0.00 -1.26 -5.04 105.19 102.82 2wff n GLY 125 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.04 2wff n GLY 125 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wff n ASN 126 N 2.59 0.00 -2.04 1.61 4.13 -1.26 -4.86 115.26 115.43 2wff n ASN 126 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2wff n ASN 126 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2wff n ASN 126 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2wff n SER 127 N 0.71 -6.93 -4.45 6.41 3.41 -1.26 -4.97 113.62 106.53 2wff n SER 127 Ca 0.00 1.40 -0.35 0.00 -0.26 0.00 0.00 58.87 59.66 2wff n SER 127 Cb 0.00 -4.28 -0.12 0.00 -0.26 0.00 0.00 64.21 59.54 2wff n SER 127 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2wff s VAL 128 N -0.41 4.03 0.65 -3.33 0.11 -1.10 -4.88 120.40 115.46 2wff s VAL 128 Ca 0.00 -0.29 -0.14 0.00 -2.93 0.00 0.00 61.98 58.62 2wff s VAL 128 Cb 0.00 -2.83 -0.01 0.00 -1.53 0.00 0.00 36.38 32.01 2wff s VAL 128 CO 0.00 0.42 1.08 -0.13 -3.33 0.00 0.00 175.10 173.14 2wff s ARG 129 N 1.04 2.99 0.12 1.54 1.81 -1.26 -2.19 118.95 123.00 2wff s ARG 129 Ca 0.02 1.21 0.06 0.00 -1.72 0.00 0.00 55.73 55.31 2wff s ARG 129 Cb -0.14 -1.99 -0.04 0.00 -0.45 0.00 0.00 34.95 32.33 2wff s ARG 129 CO 0.02 -1.08 -0.15 -1.50 -0.68 0.00 0.00 175.30 171.91 2wff s ILE 130 N -2.57 1.41 0.28 1.52 2.07 -1.21 -4.75 121.20 117.94 2wff s ILE 130 Ca 0.63 -1.71 -0.29 0.00 -1.41 0.00 0.00 60.65 57.87 2wff s ILE 130 Cb -0.17 -1.55 -0.10 0.00 0.13 0.00 0.00 42.46 40.77 2wff s ILE 130 CO 0.43 -0.37 1.36 -1.10 -1.91 0.00 0.00 174.94 173.35 2wff s GLN 131 N -2.59 4.33 0.00 3.50 -1.52 -1.25 -3.69 119.66 118.45 2wff s GLN 131 Ca 0.09 2.22 0.00 0.00 -1.95 0.00 0.00 55.36 55.73 2wff s GLN 131 Cb -0.06 -3.10 0.00 0.00 -0.22 0.00 0.00 33.01 29.63 2wff s GLN 131 CO 0.04 -0.29 0.99 0.94 -0.25 0.00 0.00 175.29 176.72 2wff n GLN 132 N 1.67 0.00 0.00 2.91 7.27 0.30 -1.16 117.38 128.36 2wff n GLN 132 Ca 0.03 0.79 0.03 0.00 0.07 0.00 0.00 57.00 57.92 2wff n GLN 132 Cb 0.41 -1.49 0.15 0.00 2.41 0.00 0.00 30.24 31.72 2wff n GLN 132 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2wff n LEU 133 N -2.56 0.00 -0.15 1.69 4.77 -1.26 -3.00 117.00 116.49 2wff n LEU 133 Ca 0.00 0.45 -0.11 0.00 -0.03 0.00 0.00 56.01 56.32 2wff n LEU 133 Cb 0.00 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 40.62 2wff n LEU 133 CO 0.00 -0.35 0.70 0.00 -1.33 0.00 0.00 177.39 176.41 2wff h ALA 134 N 2.26 0.60 -1.56 -1.18 0.00 -1.52 -3.46 119.26 114.40 2wff h ALA 134 Ca 0.00 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 2wff h ALA 134 Cb 0.11 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.77 2wff h ALA 134 CO 0.00 0.52 -0.02 1.33 0.00 0.00 0.00 179.25 181.08 2wff n VAL 135 N -4.25 0.00 -3.45 0.00 0.24 -1.16 -4.82 118.33 104.89 2wff n VAL 135 Ca -0.01 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.02 2wff n VAL 135 Cb 0.40 -0.10 -0.03 0.00 -1.47 0.00 0.00 33.84 32.64 2wff n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wff s ALA 136 N -2.01 3.70 0.00 2.33 0.00 -1.26 -4.86 121.76 119.66 2wff s ALA 136 Ca 0.07 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.29 2wff s ALA 136 Cb -0.01 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.95 2wff s ALA 136 CO 0.06 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.45 2wff n GLY 137 N -1.10 -0.49 0.33 0.00 0.00 -1.26 -5.02 105.19 97.65 2wff n GLY 137 Ca -0.03 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2wff n GLY 137 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2wff h MET 138 N 0.00 -0.48 -4.24 1.61 2.07 -2.00 -3.40 114.93 108.49 2wff h MET 138 Ca 0.00 0.03 -0.74 0.00 -2.07 0.00 0.00 59.70 56.92 2wff h MET 138 Cb 0.00 0.11 -0.24 0.00 -1.87 0.00 0.00 31.60 29.60 2wff h MET 138 CO 0.00 -0.32 -0.31 -1.54 1.07 0.00 0.00 176.91 175.81 2wff s SER 139 N -4.81 6.07 0.00 1.22 1.04 -1.26 -5.02 113.70 110.94 2wff s SER 139 Ca -0.16 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 54.72 2wff s SER 139 Cb 0.08 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.04 2wff s SER 139 CO 0.65 -0.71 0.00 -2.65 0.98 0.00 0.00 173.24 171.51 2wff n PRO 140 N 5.17 0.00 -4.00 4.02 -0.02 -1.26 -4.27 135.00 134.63 2wff n PRO 140 Ca -0.12 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.12 2wff n PRO 140 Cb 0.42 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.87 2wff n PRO 140 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2wff s THR 141 N 0.00 5.05 -0.04 3.45 2.01 -1.26 -3.04 115.64 121.81 2wff s THR 141 Ca 0.00 -0.96 -0.02 0.00 0.31 0.00 0.00 61.69 61.03 2wff s THR 141 Cb 0.00 -3.67 0.03 0.00 0.01 0.00 0.00 72.50 68.87 2wff s THR 141 CO 0.00 -0.22 0.05 -0.69 -0.69 0.00 0.00 174.62 173.07 2wff s VAL 142 N -1.88 -0.04 -0.30 3.82 1.01 -0.45 -5.01 120.40 117.54 2wff s VAL 142 Ca 0.34 0.37 -0.05 0.00 0.00 0.00 0.00 61.98 62.64 2wff s VAL 142 Cb -0.10 -0.19 0.03 0.00 0.00 0.00 0.00 36.38 36.12 2wff s VAL 142 CO 0.27 0.18 0.04 -0.69 0.00 0.00 0.00 175.10 174.91 2wff s VAL 143 N 2.03 3.48 -0.01 2.92 1.01 -1.26 -3.13 120.40 125.44 2wff s VAL 143 Ca 0.03 -1.05 0.06 0.00 0.00 0.00 0.00 61.98 61.02 2wff s VAL 143 Cb -0.12 -2.89 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 2wff s VAL 143 CO -0.03 -0.02 -0.19 0.72 0.00 0.00 0.00 175.10 175.58 2wff s PHE 144 N 1.38 1.69 0.37 5.22 -0.00 -1.26 -4.95 117.98 120.43 2wff s PHE 144 Ca -0.01 -0.33 -0.15 0.00 -0.00 0.00 0.00 56.93 56.45 2wff s PHE 144 Cb -0.18 -1.08 -0.08 0.00 -0.00 0.00 0.00 43.02 41.68 2wff s PHE 144 CO 0.00 -0.01 0.79 0.15 -0.00 0.00 0.00 175.22 176.15 2wff s LYS 145 N -0.54 3.97 -0.57 1.99 1.02 -1.25 -2.18 119.74 122.17 2wff s LYS 145 Ca 0.07 0.69 0.02 0.00 0.02 0.00 0.00 55.97 56.76 2wff s LYS 145 Cb -0.07 -2.37 0.42 0.00 -0.52 0.00 0.00 37.83 35.29 2wff s LYS 145 CO -0.00 0.06 1.64 -0.89 -0.92 0.00 0.00 175.35 175.24 2wff n ILE 146 N -0.72 3.11 -3.59 2.17 5.41 0.14 -4.71 119.36 121.17 2wff n ILE 146 Ca 0.04 -3.97 -0.08 0.00 1.00 0.00 0.00 62.75 59.74 2wff n ILE 146 Cb 0.53 -1.20 -0.09 0.00 -0.71 0.00 0.00 39.64 38.18 2wff n ILE 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wff s ALA 147 N -3.78 -1.20 0.00 -1.39 0.00 -1.24 -4.51 121.76 109.64 2wff s ALA 147 Ca 0.55 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.94 2wff s ALA 147 Cb 0.45 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2wff s ALA 147 CO -0.13 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.17 2wff n GLY 148 N 5.39 2.35 3.58 0.00 0.00 -1.26 -4.92 105.19 110.33 2wff n GLY 148 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 2wff n GLY 148 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wff s SER 149 N -1.83 5.46 0.00 1.61 0.15 -1.26 -4.81 113.70 113.01 2wff s SER 149 Ca 0.00 1.19 0.00 0.00 0.70 0.00 0.00 55.95 57.84 2wff s SER 149 Cb 0.00 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2wff s SER 149 CO 0.00 -2.07 0.00 0.54 1.20 0.00 0.00 173.24 172.91 2wff n ARG 150 N 8.73 0.00 0.00 5.44 3.00 -1.26 -3.28 116.66 129.29 2wff n ARG 150 Ca 0.26 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.10 2wff n ARG 150 Cb 0.49 -0.99 0.00 0.00 0.00 0.00 0.00 32.46 31.96 2wff n ARG 150 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2wff n SER 151 N -0.26 0.00 -1.81 0.55 3.41 -1.26 -5.04 113.62 109.21 2wff n SER 151 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2wff n SER 151 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2wff n SER 151 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wff n GLN 152 N 0.00 0.33 -4.41 4.33 6.02 -1.21 -4.76 117.38 117.68 2wff n GLN 152 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.79 2wff n GLN 152 Cb 0.00 -1.34 -0.10 0.00 1.02 0.00 0.00 30.24 29.82 2wff n GLN 152 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wff s ALA 153 N 1.32 2.20 0.00 -1.58 0.00 -1.25 -4.39 121.76 118.06 2wff s ALA 153 Ca 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 51.96 50.01 2wff s ALA 153 Cb 0.00 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.64 2wff s ALA 153 CO 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 175.76 175.51 2wff n GLY 155 N 2.11 4.39 0.80 0.00 0.00 -1.25 -4.56 105.19 106.68 2wff n GLY 155 Ca 0.00 -1.11 -0.02 0.00 0.00 0.00 0.00 46.02 44.89 2wff n GLY 155 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2wff n PHE 156 N -0.99 -1.21 -3.53 1.61 1.16 -0.50 -4.95 117.46 109.06 2wff n PHE 156 Ca 0.00 -0.38 -0.26 0.00 -1.87 0.00 0.00 57.45 54.95 2wff n PHE 156 Cb 0.00 0.19 -0.02 0.00 -1.61 0.00 0.00 39.48 38.03 2wff n PHE 156 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 2wff s SER 157 N -1.45 6.35 -0.41 5.98 0.01 -1.26 -2.41 113.70 120.51 2wff s SER 157 Ca 0.04 0.45 0.05 0.00 1.31 0.00 0.00 55.95 57.80 2wff s SER 157 Cb -0.01 -2.03 0.17 0.00 0.21 0.00 0.00 66.02 64.36 2wff s SER 157 CO 0.02 -0.17 0.51 -0.69 0.41 0.00 0.00 173.24 173.32 2wff s VAL 158 N -2.10 -0.59 0.69 3.43 1.01 -0.86 -4.91 120.40 117.07 2wff s VAL 158 Ca 0.40 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 2wff s VAL 158 Cb -0.10 -0.40 0.02 0.00 0.00 0.00 0.00 36.38 35.90 2wff s VAL 158 CO 0.32 -0.36 1.20 -2.16 0.00 0.00 0.00 175.10 174.09 2wff s PRO 159 N 1.34 2.42 -0.50 2.72 0.04 -1.26 -0.96 135.00 138.79 2wff s PRO 159 Ca 0.20 1.73 -0.31 0.00 0.04 0.00 0.00 61.00 62.66 2wff s PRO 159 Cb -0.08 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.48 2wff s PRO 159 CO -0.06 -1.62 2.35 0.98 0.04 0.00 0.00 177.00 178.69 2wff n TYR 160 N -2.42 1.38 0.00 0.56 9.36 -1.26 -4.86 117.16 119.92 2wff n TYR 160 Ca 0.13 0.23 0.00 0.00 3.32 0.00 0.00 57.90 61.58 2wff n TYR 160 Cb 0.50 -2.55 0.00 0.00 -0.63 0.00 0.00 39.34 36.67 2wff n TYR 160 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 2wff n THR 161 N 7.51 0.00 -0.04 2.97 -2.24 -1.26 -4.96 114.28 116.27 2wff n THR 161 Ca 0.44 0.82 -0.01 0.00 -2.27 0.00 0.00 64.05 63.02 2wff n THR 161 Cb 0.29 -1.74 -0.00 0.00 -2.10 0.00 0.00 70.33 66.78 2wff n THR 161 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2wff n SER 162 N -1.82 -0.06 -0.14 3.42 2.88 -1.26 -4.80 113.62 111.84 2wff n SER 162 Ca 0.00 0.03 -0.12 0.00 -1.33 0.00 0.00 58.87 57.45 2wff n SER 162 Cb 0.00 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.42 2wff n SER 162 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wff h MET 163 N 0.02 0.95 -6.45 -1.46 -0.00 -1.91 -3.46 114.93 102.61 2wff h MET 163 Ca -0.01 -0.43 -0.62 0.00 -0.00 0.00 0.00 59.70 58.64 2wff h MET 163 Cb 0.04 -0.02 0.08 0.00 -0.00 0.00 0.00 31.60 31.70 2wff h MET 163 CO 0.02 1.10 0.47 0.91 -0.00 0.00 0.00 176.91 179.40 2wff n TRP 164 N -4.13 1.76 0.30 -0.10 7.02 -1.26 -4.85 117.44 116.18 2wff n TRP 164 Ca -0.01 0.54 0.16 0.00 -1.02 0.00 0.00 57.50 57.17 2wff n TRP 164 Cb 0.48 -2.38 0.80 0.00 -2.42 0.00 0.00 31.31 27.79 2wff n TRP 164 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 2wff h ARG 165 N 4.02 0.00 -2.27 -0.99 0.11 -2.02 -3.40 114.38 109.83 2wff h ARG 165 Ca -0.44 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.63 2wff h ARG 165 Cb 1.31 0.00 -0.17 0.00 1.11 0.00 0.00 29.97 32.22 2wff h ARG 165 CO 0.74 0.00 0.29 0.54 0.10 0.00 0.00 179.97 181.65 2wff s VAL 166 N -4.18 0.00 -0.34 0.08 0.11 -1.26 -5.01 120.40 109.80 2wff s VAL 166 Ca -0.03 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 58.79 2wff s VAL 166 Cb 0.10 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.95 2wff s VAL 166 CO 0.32 0.00 0.76 -0.69 -3.33 0.00 0.00 175.10 172.15 2wff s VAL 167 N -2.21 4.79 -0.09 2.04 1.01 0.07 -4.88 120.40 121.13 2wff s VAL 167 Ca -0.04 0.96 -0.25 0.00 0.00 0.00 0.00 61.98 62.66 2wff s VAL 167 Cb -0.01 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2wff s VAL 167 CO -0.01 -0.33 0.78 -2.16 0.00 0.00 0.00 175.10 173.39 2wff s PRO 168 N 2.96 4.41 0.00 2.72 0.04 -1.26 0.28 135.00 144.16 2wff s PRO 168 Ca 0.30 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2wff s PRO 168 Cb -0.14 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.92 2wff s PRO 168 CO 0.15 -0.07 0.33 0.28 0.04 0.00 0.00 177.00 177.73 2wff n VAL 169 N 4.08 0.00 -3.34 -0.36 0.31 0.69 -4.75 118.33 114.96 2wff n VAL 169 Ca 0.01 0.77 -0.42 0.00 -0.01 0.00 0.00 64.34 64.69 2wff n VAL 169 Cb 0.51 -1.63 -0.09 0.00 -0.91 0.00 0.00 33.84 31.71 2wff n VAL 169 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2wff s PHE 170 N -1.46 3.19 -0.12 3.52 2.99 -1.26 -5.00 117.98 119.84 2wff s PHE 170 Ca 0.00 -0.18 -0.06 0.00 0.00 0.00 0.00 56.93 56.70 2wff s PHE 170 Cb 0.00 -2.81 -0.04 0.00 0.00 0.00 0.00 43.02 40.17 2wff s PHE 170 CO 0.00 -0.58 0.08 -0.47 -0.00 0.00 0.00 175.22 174.25 2wff s TYR 171 N 2.12 3.38 -0.34 0.36 5.04 -1.26 -5.05 117.35 121.60 2wff s TYR 171 Ca 0.13 0.33 0.01 0.00 -2.44 0.00 0.00 57.07 55.10 2wff s TYR 171 Cb -0.17 -1.93 0.09 0.00 0.35 0.00 0.00 41.96 40.30 2wff s TYR 171 CO 0.13 0.52 0.05 1.21 -1.34 0.00 0.00 175.55 176.12 2wff s ASN 172 N -0.66 4.84 0.00 4.32 2.47 -1.26 -4.22 114.94 120.43 2wff s ASN 172 Ca 0.12 -1.87 0.00 0.00 0.42 0.00 0.00 52.86 51.53 2wff s ASN 172 Cb -0.12 -1.67 0.00 0.00 -1.45 0.00 0.00 41.25 38.01 2wff s ASN 172 CO 0.02 -0.37 0.00 0.61 -3.72 0.00 0.00 177.10 173.65 2wff n GLY 173 N 4.41 -0.30 3.74 1.21 0.00 -1.26 -5.13 105.19 107.87 2wff n GLY 173 Ca -0.03 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.73 2wff n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2wff s TRP 174 N 0.00 -0.26 -0.10 1.61 0.51 -1.25 -4.53 118.94 114.92 2wff s TRP 174 Ca 0.00 -0.12 0.16 0.00 -2.12 0.00 0.00 56.10 54.02 2wff s TRP 174 Cb 0.00 0.67 -0.20 0.00 -0.81 0.00 0.00 33.47 33.12 2wff s TRP 174 CO 0.00 -1.10 0.62 0.41 -0.51 0.00 0.00 176.95 176.37 2wff n GLY 175 N -0.44 -1.07 3.06 0.98 0.00 0.43 -4.65 105.19 103.50 2wff n GLY 175 Ca -0.07 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 2wff n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wff s ALA 176 N -2.74 0.19 -1.47 4.61 0.00 -1.26 -4.21 121.76 116.88 2wff s ALA 176 Ca -0.05 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2wff s ALA 176 Cb 0.08 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.43 2wff s ALA 176 CO 0.82 -0.29 0.41 -2.30 0.00 0.00 0.00 175.76 174.41 2wff n PRO 177 N 0.79 0.00 -3.21 0.00 -0.02 -1.26 -3.24 135.00 128.06 2wff n PRO 177 Ca -0.19 0.02 -0.43 0.00 -2.02 0.00 0.00 63.50 60.89 2wff n PRO 177 Cb 0.58 -1.51 -0.00 0.00 -0.02 0.00 0.00 33.50 32.55 2wff n PRO 177 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2wff n THR 178 N -0.91 4.73 -1.47 3.45 -2.24 -1.26 -4.96 114.28 111.61 2wff n THR 178 Ca 0.00 -5.62 -0.14 0.00 -2.27 0.00 0.00 64.05 56.01 2wff n THR 178 Cb 0.01 -2.31 -0.12 0.00 -2.10 0.00 0.00 70.33 65.81 2wff n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2wff n LYS 179 N 1.92 0.23 -4.55 -0.78 5.02 -1.20 -4.81 118.16 113.99 2wff n LYS 179 Ca 0.25 -0.59 -0.29 0.00 -2.02 0.00 0.00 58.31 55.66 2wff n LYS 179 Cb 0.36 -2.49 -0.14 0.00 -0.02 0.00 0.00 35.03 32.75 2wff n LYS 179 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2wff s GLU 180 N 7.71 1.50 -0.49 1.97 2.02 -1.26 -5.07 118.70 125.08 2wff s GLU 180 Ca 0.92 -1.25 -0.27 0.00 0.02 0.00 0.00 54.97 54.39 2wff s GLU 180 Cb -0.34 -1.87 -0.03 0.00 0.10 0.00 0.00 34.13 31.99 2wff s GLU 180 CO 0.25 0.46 2.00 0.15 0.02 0.00 0.00 175.26 178.13 2wff s LYS 181 N -1.77 2.71 0.00 1.61 1.02 -1.26 -2.03 119.74 120.01 2wff s LYS 181 Ca 0.13 1.09 0.00 0.00 0.02 0.00 0.00 55.97 57.20 2wff s LYS 181 Cb -0.10 -4.39 0.00 0.00 -0.52 0.00 0.00 37.83 32.82 2wff s LYS 181 CO 0.05 -2.61 0.00 0.00 -0.92 0.00 0.00 175.35 171.87 2wff n ALA 182 N 12.83 0.00 1.14 5.17 0.00 -1.26 -4.93 120.51 133.46 2wff n ALA 182 Ca 0.25 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.72 2wff n ALA 182 Cb 0.51 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.11 2wff n ALA 182 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wff n THR 183 N 0.00 0.00 0.00 0.00 -2.24 -0.86 -3.85 114.28 107.32 2wff n THR 183 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2wff n THR 183 Cb 0.00 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 2wff n THR 183 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wff n TYR 184 N -0.63 0.00 0.54 4.78 9.36 -1.25 0.16 117.16 130.12 2wff n TYR 184 Ca 0.04 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.21 2wff n TYR 184 Cb 0.02 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 38.76 2wff n TYR 184 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2wff n ASN 185 N -0.32 3.17 0.00 2.98 3.02 -1.26 -3.88 115.26 118.98 2wff n ASN 185 Ca 0.00 -2.33 0.00 0.00 -0.03 0.00 0.00 54.58 52.22 2wff n ASN 185 Cb 0.00 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 38.60 2wff n ASN 185 CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 2wff n TRP 186 N 0.17 0.00 -1.55 3.10 -0.00 -1.22 -4.66 117.44 113.28 2wff n TRP 186 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.62 2wff n TRP 186 Cb 0.74 -0.15 0.00 0.00 -0.00 0.00 0.00 31.31 31.89 2wff n TRP 186 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 177.69 177.58 2wff n LEU 187 N -2.30 -4.84 -4.51 5.87 -0.00 -1.26 -4.61 117.00 105.36 2wff n LEU 187 Ca 0.00 2.26 -0.41 0.00 -0.00 0.00 0.00 56.01 57.86 2wff n LEU 187 Cb 0.00 -2.42 -0.08 0.00 -0.00 0.00 0.00 43.42 40.91 2wff n LEU 187 CO 0.00 -1.13 2.06 -0.81 -0.00 0.00 0.00 177.39 177.50 2wff n PRO 188 N 1.20 0.64 -3.01 1.96 -0.04 -1.26 -3.44 135.00 131.05 2wff n PRO 188 Ca 0.00 0.05 -0.10 0.00 -0.04 0.00 0.00 63.50 63.42 2wff n PRO 188 Cb 0.00 -2.49 0.04 0.00 -0.04 0.00 0.00 33.50 31.01 2wff n PRO 188 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wff n GLY 189 N 6.32 -1.00 2.30 0.55 0.00 -1.26 -4.91 105.19 107.20 2wff n GLY 189 Ca 0.49 0.47 -0.27 0.00 0.00 0.00 0.00 46.02 46.71 2wff n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wff n ALA 190 N -2.66 6.68 -3.00 4.61 0.00 -1.22 -4.75 120.51 120.17 2wff n ALA 190 Ca -0.04 -2.93 0.00 0.00 0.00 0.00 0.00 53.44 50.47 2wff n ALA 190 Cb 0.58 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2wff n ALA 190 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2wff n HIS 191 N 1.97 -0.15 0.65 0.00 1.44 -1.26 -4.92 115.22 112.95 2wff n HIS 191 Ca 0.54 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 56.32 2wff n HIS 191 Cb 0.56 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.67 2wff n HIS 191 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2wff n PHE 192 N 0.00 0.00 0.00 -1.40 0.99 -0.99 -4.01 117.46 112.05 2wff n PHE 192 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2wff n PHE 192 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 2wff n PHE 192 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2wff n GLY 193 N 1.08 0.55 0.24 1.37 0.00 -1.26 -4.71 105.19 102.46 2wff n GLY 193 Ca 0.06 -2.02 -0.02 0.00 0.00 0.00 0.00 46.02 44.05 2wff n GLY 193 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wff n SER 194 N 0.00 0.25 -3.63 1.61 3.41 -0.85 -0.57 113.62 113.84 2wff n SER 194 Ca 0.00 -1.16 -0.10 0.00 -0.26 0.00 0.00 58.87 57.35 2wff n SER 194 Cb 0.00 0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 63.99 2wff n SER 194 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2wff s ILE 195 N -1.96 0.00 -0.14 -1.33 -4.36 -0.21 -3.22 121.20 109.98 2wff s ILE 195 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.41 2wff s ILE 195 Cb 0.00 -1.00 0.03 0.00 1.25 0.00 0.00 42.46 42.74 2wff s ILE 195 CO 0.02 0.00 -0.11 -0.22 0.24 0.00 0.00 174.94 174.87 2wff s LEU 196 N 0.19 1.52 -0.22 0.37 0.20 -0.23 -1.92 118.68 118.60 2wff s LEU 196 Ca 0.02 -0.45 -0.05 0.00 0.69 0.00 0.00 54.13 54.34 2wff s LEU 196 Cb -0.05 -1.03 -0.02 0.00 -0.43 0.00 0.00 46.19 44.66 2wff s LEU 196 CO -0.04 -0.09 -0.01 -0.76 -0.29 0.00 0.00 176.35 175.16 2wff s LEU 197 N 1.58 3.13 -0.00 -0.68 1.43 -1.26 -2.08 118.68 120.80 2wff s LEU 197 Ca 0.04 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2wff s LEU 197 Cb -0.13 -1.80 -0.00 0.00 0.03 0.00 0.00 46.19 44.28 2wff s LEU 197 CO -0.09 0.01 -0.04 0.28 0.23 0.00 0.00 176.35 176.74 2wff s THR 198 N 1.31 0.31 -0.01 5.49 -1.32 -1.25 -0.07 115.64 120.10 2wff s THR 198 Ca 0.04 -0.22 -0.29 0.00 -1.21 0.00 0.00 61.69 60.01 2wff s THR 198 Cb -0.15 -0.27 0.10 0.00 -1.51 0.00 0.00 72.50 70.67 2wff s THR 198 CO 0.00 0.05 0.87 -0.55 -2.21 0.00 0.00 174.62 172.78 2wff s SER 199 N -0.19 -0.39 0.00 8.08 0.15 -0.87 0.85 113.70 121.33 2wff s SER 199 Ca 0.01 0.05 0.05 0.00 0.70 0.00 0.00 55.95 56.76 2wff s SER 199 Cb -0.02 0.40 0.30 0.00 -1.71 0.00 0.00 66.02 64.98 2wff s SER 199 CO -0.00 -0.62 0.82 -0.90 1.20 0.00 0.00 173.24 173.74 2wff n ASP 200 N -0.14 0.00 0.00 5.45 5.75 -1.25 -3.78 116.55 122.58 2wff n ASP 200 Ca -0.10 -0.08 0.00 0.00 -0.01 0.00 0.00 54.79 54.60 2wff n ASP 200 Cb 0.62 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 2wff n ASP 200 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wff n ALA 201 N -1.06 0.00 0.00 2.12 0.00 -1.26 -4.89 120.51 115.42 2wff n ALA 201 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2wff n ALA 201 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2wff n ALA 201 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2wff n HIS 202 N 0.00 0.00 -4.05 0.00 1.44 -1.25 -4.79 115.22 106.57 2wff n HIS 202 Ca 0.00 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.46 2wff n HIS 202 Cb 0.00 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.05 2wff n HIS 202 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 2wff s ASP 203 N 0.00 4.52 -0.74 4.39 3.84 -1.26 -4.04 116.67 123.38 2wff s ASP 203 Ca 0.00 -1.07 -0.02 0.00 -0.00 0.00 0.00 52.55 51.46 2wff s ASP 203 Cb 0.00 -0.37 0.00 0.00 -1.38 0.00 0.00 42.92 41.17 2wff s ASP 203 CO 0.00 -0.62 0.25 0.29 -0.00 0.00 0.00 175.17 175.09 2wff n LYS 204 N -1.33 -2.13 0.00 2.11 5.02 -1.26 -4.99 118.16 115.58 2wff n LYS 204 Ca -0.01 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 2wff n LYS 204 Cb 0.64 -4.31 0.00 0.00 -0.02 0.00 0.00 35.03 31.34 2wff n LYS 204 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wff n GLY 205 N -1.10 4.19 0.00 0.72 0.00 -1.26 -3.57 105.19 104.17 2wff n GLY 205 Ca -0.06 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.17 2wff n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wff n GLY 206 N -1.47 0.70 0.12 -0.02 0.00 -0.36 -4.64 105.19 99.52 2wff n GLY 206 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wff n GLY 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wff n TYR 208 N -2.30 -0.68 -0.51 0.00 0.53 -1.26 0.15 117.16 113.09 2wff n TYR 208 Ca 0.00 0.28 -0.30 0.00 -1.02 0.00 0.00 57.90 56.86 2wff n TYR 208 Cb 0.00 -1.99 0.27 0.00 -1.03 0.00 0.00 39.34 36.59 2wff n TYR 208 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 2wff s LEU 209 N -1.11 -0.41 0.06 7.72 1.98 -1.25 -3.86 118.68 121.81 2wff s LEU 209 Ca 0.04 0.99 -0.27 0.00 -2.89 0.00 0.00 54.13 52.00 2wff s LEU 209 Cb -0.01 -2.58 0.07 0.00 0.66 0.00 0.00 46.19 44.33 2wff s LEU 209 CO 0.15 -4.92 0.65 -0.13 -1.89 0.00 0.00 176.35 170.21 2wff s ARG 210 N -4.95 1.15 -0.01 1.98 0.52 -1.26 -3.84 118.95 112.54 2wff s ARG 210 Ca 0.69 -0.14 0.02 0.00 -0.52 0.00 0.00 55.73 55.77 2wff s ARG 210 Cb -0.16 0.54 0.00 0.00 0.52 0.00 0.00 34.95 35.85 2wff s ARG 210 CO 0.59 -0.45 -0.05 0.71 0.02 0.00 0.00 175.30 176.13 2wff s TYR 211 N -2.59 0.50 -0.23 -0.53 1.51 -1.17 -3.79 117.35 111.06 2wff s TYR 211 Ca -0.04 -0.10 0.02 0.00 -1.01 0.00 0.00 57.07 55.94 2wff s TYR 211 Cb -0.01 -0.36 0.05 0.00 -0.11 0.00 0.00 41.96 41.53 2wff s TYR 211 CO -0.03 -0.04 -0.12 0.50 -1.11 0.00 0.00 175.55 174.76 2wff s ARG 212 N 0.07 2.25 -1.00 -0.62 3.52 -0.67 -1.13 118.95 121.38 2wff s ARG 212 Ca -0.00 -1.09 -0.02 0.00 -0.13 0.00 0.00 55.73 54.49 2wff s ARG 212 Cb -0.04 -2.68 0.28 0.00 -1.56 0.00 0.00 34.95 30.95 2wff s ARG 212 CO -0.00 -0.47 2.01 1.19 -0.81 0.00 0.00 175.30 177.21 2wff n PHE 213 N 4.56 2.72 -1.80 5.12 3.01 -0.66 -1.90 117.46 128.51 2wff n PHE 213 Ca -0.15 -2.51 -0.38 0.00 1.01 0.00 0.00 57.45 55.42 2wff n PHE 213 Cb 0.45 -1.30 0.04 0.00 -0.01 0.00 0.00 39.48 38.66 2wff n PHE 213 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2wff s PRO 214 N -3.67 3.08 -1.10 -1.08 0.04 -1.26 -2.94 135.00 128.07 2wff s PRO 214 Ca 0.45 2.19 -0.00 0.00 0.04 0.00 0.00 61.00 63.67 2wff s PRO 214 Cb 0.25 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2wff s PRO 214 CO -0.19 -1.22 0.05 0.54 0.04 0.00 0.00 177.00 176.21 2wff n ARG 215 N -1.15 -1.31 -1.93 4.56 1.74 -1.26 -0.96 116.66 116.36 2wff n ARG 215 Ca 0.11 0.63 -0.42 0.00 -0.77 0.00 0.00 57.85 57.40 2wff n ARG 215 Cb 0.46 -4.85 -0.03 0.00 -1.02 0.00 0.00 32.46 27.02 2wff n ARG 215 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wff s ALA 216 N -2.69 3.66 -0.06 7.54 0.00 -1.15 -4.08 121.76 124.98 2wff s ALA 216 Ca 0.02 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.18 2wff s ALA 216 Cb -0.01 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2wff s ALA 216 CO 0.03 -1.19 -0.17 -0.80 0.00 0.00 0.00 175.76 173.63 2wff s ASN 217 N 2.73 2.23 0.04 0.00 0.01 0.98 -4.17 114.94 116.75 2wff s ASN 217 Ca 0.75 -0.38 0.08 0.00 -0.71 0.00 0.00 52.86 52.60 2wff s ASN 217 Cb -0.39 -0.82 -0.03 0.00 0.41 0.00 0.00 41.25 40.43 2wff s ASN 217 CO 0.32 0.12 -0.23 -0.04 -1.51 0.00 0.00 177.10 175.77 2wff s MET 218 N 0.27 1.57 0.16 -0.60 -1.94 -1.26 -1.42 119.30 116.08 2wff s MET 218 Ca -0.10 -0.98 0.02 0.00 -1.71 0.00 0.00 55.69 52.92 2wff s MET 218 Cb -0.14 -1.69 -0.05 0.00 2.01 0.00 0.00 34.83 34.97 2wff s MET 218 CO 0.04 0.44 -0.02 0.71 -0.01 0.00 0.00 175.02 176.17 2wff s TYR 219 N -0.77 1.16 -0.33 -0.03 2.02 -0.46 -4.97 117.35 113.97 2wff s TYR 219 Ca 0.09 -0.97 -0.24 0.00 -0.37 0.00 0.00 57.07 55.57 2wff s TYR 219 Cb -0.09 -0.65 0.04 0.00 -0.40 0.00 0.00 41.96 40.85 2wff s TYR 219 CO 0.02 -0.17 0.45 0.00 -1.57 0.00 0.00 175.55 174.28 2wff n PRO 221 N 0.23 -0.69 -3.98 0.00 -0.04 -1.26 -1.27 135.00 127.99 2wff n PRO 221 Ca -0.03 -0.19 -0.09 0.00 -0.04 0.00 0.00 63.50 63.15 2wff n PRO 221 Cb 0.57 -1.37 -0.05 0.00 -0.04 0.00 0.00 33.50 32.62 2wff n PRO 221 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2wff s ARG 222 N -2.74 1.59 0.50 0.54 0.52 -0.27 -4.64 118.95 114.45 2wff s ARG 222 Ca 0.47 -1.22 -0.20 0.00 -0.52 0.00 0.00 55.73 54.25 2wff s ARG 222 Cb -0.04 0.49 -0.08 0.00 0.52 0.00 0.00 34.95 35.84 2wff s ARG 222 CO 0.68 -0.67 1.06 -2.14 0.02 0.00 0.00 175.30 174.25 2wff s PRO 223 N -3.98 3.68 -0.34 3.54 0.02 -1.26 -4.80 135.00 131.84 2wff s PRO 223 Ca 0.21 1.40 -0.12 0.00 0.02 0.00 0.00 61.00 62.51 2wff s PRO 223 Cb -0.01 -2.07 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 2wff s PRO 223 CO 0.09 -0.54 0.22 0.42 -0.33 0.00 0.00 177.00 176.86 2wff s ILE 224 N -1.97 5.09 -0.44 2.83 1.01 -1.26 -4.71 121.20 121.75 2wff s ILE 224 Ca 0.68 -0.34 -0.27 0.00 0.00 0.00 0.00 60.65 60.73 2wff s ILE 224 Cb -0.18 -3.64 -0.06 0.00 0.01 0.00 0.00 42.46 38.59 2wff s ILE 224 CO 0.22 -0.03 2.32 -2.16 0.00 0.00 0.00 174.94 175.29 2wff s PRO 225 N 1.68 2.37 0.00 2.79 0.04 -1.26 -4.94 135.00 135.69 2wff s PRO 225 Ca 0.05 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.57 2wff s PRO 225 Cb -0.18 -4.52 0.00 0.00 0.04 0.00 0.00 34.50 29.85 2wff s PRO 225 CO 0.09 -2.97 0.00 -2.30 0.04 0.00 0.00 177.00 171.86 2wff n PRO 226 N 8.96 0.00 -0.41 0.56 -0.02 -1.26 -4.78 135.00 138.05 2wff n PRO 226 Ca 0.34 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2wff n PRO 226 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2wff n PRO 226 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wff n ALA 227 N -2.35 0.00 -2.99 3.55 0.00 -1.26 -4.91 120.51 112.55 2wff n ALA 227 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2wff n ALA 227 Cb 0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 19.45 18.92 2wff n ALA 227 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2wff s PHE 228 N -2.23 -0.10 1.28 0.00 0.40 -1.26 -5.10 117.98 110.97 2wff s PHE 228 Ca 0.00 0.24 -0.19 0.00 -0.60 0.00 0.00 56.93 56.38 2wff s PHE 228 Cb 0.00 0.03 0.30 0.00 0.51 0.00 0.00 43.02 43.86 2wff s PHE 228 CO 0.00 -0.07 0.68 0.25 0.70 0.00 0.00 175.22 176.78 2wff n THR 229 N 2.90 0.00 -3.30 0.64 -2.24 -1.26 -4.96 114.28 106.05 2wff n THR 229 Ca -0.13 -0.09 -0.31 0.00 -2.27 0.00 0.00 64.05 61.24 2wff n THR 229 Cb 0.59 -0.82 -0.05 0.00 -2.10 0.00 0.00 70.33 67.95 2wff n THR 229 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2wff s ARG 230 N -4.41 3.82 0.00 -0.78 3.52 -1.26 -5.10 118.95 114.74 2wff s ARG 230 Ca 0.57 0.33 0.00 0.00 -0.13 0.00 0.00 55.73 56.50 2wff s ARG 230 Cb -0.12 -2.58 0.00 0.00 -1.56 0.00 0.00 34.95 30.69 2wff s ARG 230 CO 0.51 0.24 0.00 -0.35 -0.81 0.00 0.00 175.30 174.89 2wff n PRO 231 N -0.38 3.50 -4.06 5.12 -0.04 -1.26 -5.07 135.00 132.81 2wff n PRO 231 Ca 0.01 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.12 2wff n PRO 231 Cb 0.53 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.90 2wff n PRO 231 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wff s ALA 232 N -3.50 3.46 0.85 0.55 0.00 -1.26 -5.07 121.76 116.78 2wff s ALA 232 Ca 0.00 -0.74 -0.15 0.00 0.00 0.00 0.00 51.96 51.07 2wff s ALA 232 Cb 0.00 -1.84 -0.02 0.00 0.00 0.00 0.00 23.12 21.26 2wff s ALA 232 CO 0.00 0.33 0.28 -0.25 0.00 0.00 0.00 175.76 176.12 2wff n ASP 233 N 3.02 -2.29 0.00 0.00 8.00 -1.26 -2.72 116.55 121.30 2wff n ASP 233 Ca -0.17 0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.75 2wff n ASP 233 Cb 0.53 -1.14 0.00 0.00 -0.02 0.00 0.00 41.12 40.49 2wff n ASP 233 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2wff n LYS 234 N -0.67 0.00 -3.18 -1.24 4.76 -1.26 -4.92 118.16 111.65 2wff n LYS 234 Ca 0.07 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.30 2wff n LYS 234 Cb 0.52 -0.37 0.06 0.00 -1.84 0.00 0.00 35.03 33.40 2wff n LYS 234 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2wff s THR 235 N 0.00 1.92 0.47 -0.18 -4.23 -1.10 -5.14 115.64 107.39 2wff s THR 235 Ca 0.00 -1.08 -0.11 0.00 -1.18 0.00 0.00 61.69 59.32 2wff s THR 235 Cb 0.00 -2.00 -0.06 0.00 1.34 0.00 0.00 72.50 71.78 2wff s THR 235 CO 0.00 0.00 0.86 -0.13 -0.54 0.00 0.00 174.62 174.81 2wff s ARG 236 N -4.65 3.75 -0.12 3.99 0.52 -1.26 -4.77 118.95 116.41 2wff s ARG 236 Ca 0.58 0.57 -0.06 0.00 -0.52 0.00 0.00 55.73 56.30 2wff s ARG 236 Cb -0.05 -2.29 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 2wff s ARG 236 CO 0.37 -0.19 0.10 -1.58 0.02 0.00 0.00 175.30 174.02 2wff s HIS 237 N -2.60 3.47 -0.32 -0.53 2.46 -1.26 -4.83 115.29 111.69 2wff s HIS 237 Ca 0.53 0.42 0.01 0.00 0.47 0.00 0.00 55.06 56.49 2wff s HIS 237 Cb -0.10 -1.92 0.10 0.00 -0.13 0.00 0.00 32.58 30.53 2wff s HIS 237 CO 0.37 0.63 0.07 0.15 -2.47 0.00 0.00 174.74 173.49 2wff s LYS 238 N -0.89 1.08 -0.17 2.88 1.02 -1.26 -5.09 119.74 117.31 2wff s LYS 238 Ca 0.14 -1.39 -0.11 0.00 0.02 0.00 0.00 55.97 54.63 2wff s LYS 238 Cb -0.12 -2.52 -0.05 0.00 -0.52 0.00 0.00 37.83 34.62 2wff s LYS 238 CO 0.03 -0.94 0.19 -0.06 -0.92 0.00 0.00 175.35 173.65 2wff s PHE 239 N 1.31 3.46 -0.22 3.18 0.40 -1.26 -5.03 117.98 119.82 2wff s PHE 239 Ca 0.09 0.46 -0.28 0.00 -0.60 0.00 0.00 56.93 56.60 2wff s PHE 239 Cb -0.18 -2.19 -0.05 0.00 0.51 0.00 0.00 43.02 41.11 2wff s PHE 239 CO -0.17 0.34 2.22 -1.25 0.70 0.00 0.00 175.22 177.06 2wff s PRO 240 N 0.18 3.11 0.00 0.24 0.04 -1.26 -4.95 135.00 132.36 2wff s PRO 240 Ca 0.12 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2wff s PRO 240 Cb -0.12 -4.38 0.00 0.00 0.04 0.00 0.00 34.50 30.04 2wff s PRO 240 CO 0.01 -2.13 0.00 0.25 0.04 0.00 0.00 177.00 175.17 2wff n THR 241 N 7.77 0.00 0.12 1.26 -2.24 -1.26 -5.02 114.28 114.92 2wff n THR 241 Ca 0.30 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.95 2wff n THR 241 Cb 0.45 -0.78 -0.08 0.00 -2.10 0.00 0.00 70.33 67.82 2wff n THR 241 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2wff h ASN 242 N 0.00 -0.29 0.00 3.42 2.35 -2.03 -3.40 115.58 115.63 2wff h ASN 242 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 2wff h ASN 242 Cb 0.00 0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.44 2wff h ASN 242 CO 0.00 0.13 0.00 -0.38 -1.65 0.00 0.00 177.43 175.53 2wff n ILE 243 N -5.06 0.00 -4.57 2.81 5.41 -1.26 -4.96 119.36 111.73 2wff n ILE 243 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2wff n ILE 243 Cb 0.26 -0.68 0.00 0.00 -0.71 0.00 0.00 39.64 38.50 2wff n ILE 243 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2wff n ASN 244 N 0.00 -0.37 -0.04 4.38 5.15 -1.26 -4.74 115.26 118.37 2wff n ASN 244 Ca 0.00 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 53.93 2wff n ASN 244 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 2wff n ASN 244 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 2wff n LYS 245 N 0.00 0.31 0.00 1.20 4.81 -1.26 -5.06 118.16 118.15 2wff n LYS 245 Ca 0.00 0.12 0.12 0.00 -0.87 0.00 0.00 58.31 57.68 2wff n LYS 245 Cb 0.00 -1.01 0.13 0.00 0.02 0.00 0.00 35.03 34.17 2wff n LYS 245 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57