#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rjz s PRO 2 N 0.00 -0.14 0.33 1.61 0.04 -1.26 -4.48 135.00 131.10 1rjz s PRO 2 Ca 0.00 0.74 0.01 0.00 0.04 0.00 0.00 61.00 61.79 1rjz s PRO 2 Cb 0.00 -1.65 -0.01 0.00 0.04 0.00 0.00 34.50 32.88 1rjz s PRO 2 CO 0.00 -3.17 0.40 -1.01 0.04 0.00 0.00 177.00 173.25 1rjz s HIS 3 N -2.71 1.29 -0.25 0.56 3.76 -1.09 -4.99 115.29 111.86 1rjz s HIS 3 Ca 0.67 -1.41 -0.27 0.00 -0.15 0.00 0.00 55.06 53.89 1rjz s HIS 3 Cb -0.22 -0.31 0.16 0.00 1.11 0.00 0.00 32.58 33.32 1rjz s HIS 3 CO 0.61 -1.03 1.20 -1.54 -0.85 0.00 0.00 174.74 173.13 1rjz s SER 4 N -3.28 -0.24 -0.21 1.40 1.04 -1.26 -1.45 113.70 109.70 1rjz s SER 4 Ca 0.34 0.37 0.01 0.00 0.48 0.00 0.00 55.95 57.15 1rjz s SER 4 Cb 0.01 0.35 0.05 0.00 0.10 0.00 0.00 66.02 66.53 1rjz s SER 4 CO 0.22 -0.14 -0.08 -0.22 0.98 0.00 0.00 173.24 174.00 1rjz s LEU 5 N -0.45 2.35 0.07 2.42 2.96 -0.47 -0.29 118.68 125.27 1rjz s LEU 5 Ca 0.04 -0.99 0.04 0.00 -0.22 0.00 0.00 54.13 53.01 1rjz s LEU 5 Cb -0.03 -1.19 -0.03 0.00 0.50 0.00 0.00 46.19 45.45 1rjz s LEU 5 CO -0.07 -0.18 -0.12 -0.13 -1.32 0.00 0.00 176.35 174.53 1rjz s ARG 6 N 1.41 0.75 -0.10 1.98 0.52 -0.19 -0.42 118.95 122.90 1rjz s ARG 6 Ca -0.03 -0.94 0.04 0.00 -0.52 0.00 0.00 55.73 54.28 1rjz s ARG 6 Cb -0.17 -0.64 0.00 0.00 0.52 0.00 0.00 34.95 34.66 1rjz s ARG 6 CO -0.07 0.13 -0.24 0.71 0.02 0.00 0.00 175.30 175.85 1rjz s TYR 7 N -1.49 2.58 -0.46 -0.53 1.51 0.21 0.67 117.35 119.84 1rjz s TYR 7 Ca -0.03 -1.07 -0.09 0.00 -1.01 0.00 0.00 57.07 54.88 1rjz s TYR 7 Cb -0.09 -1.72 0.11 0.00 -0.11 0.00 0.00 41.96 40.15 1rjz s TYR 7 CO 0.01 -0.43 0.32 -0.06 -1.11 0.00 0.00 175.55 174.28 1rjz s PHE 8 N 0.38 3.42 -0.13 2.71 0.40 0.96 -1.47 117.98 124.25 1rjz s PHE 8 Ca -0.18 -1.84 -0.06 0.00 -0.60 0.00 0.00 56.93 54.25 1rjz s PHE 8 Cb -0.18 -3.38 -0.04 0.00 0.51 0.00 0.00 43.02 39.93 1rjz s PHE 8 CO 0.08 -0.97 0.09 0.08 0.70 0.00 0.00 175.22 175.20 1rjz s VAL 9 N 1.36 5.04 -0.02 -0.44 1.01 -0.46 -1.50 120.40 125.40 1rjz s VAL 9 Ca 0.05 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1rjz s VAL 9 Cb -0.25 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1rjz s VAL 9 CO -0.00 0.57 -0.05 -0.89 0.00 0.00 0.00 175.10 174.73 1rjz s THR 10 N -0.59 0.43 -0.13 3.92 2.01 -0.53 -0.75 115.64 120.01 1rjz s THR 10 Ca 0.12 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.93 1rjz s THR 10 Cb -0.12 -0.41 0.03 0.00 0.01 0.00 0.00 72.50 72.02 1rjz s THR 10 CO 0.02 0.15 -0.03 0.00 -0.69 0.00 0.00 174.62 174.07 1rjz s ALA 11 N 0.23 1.14 -0.28 7.40 0.00 -0.29 -0.11 121.76 129.85 1rjz s ALA 11 Ca -0.02 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.40 1rjz s ALA 11 Cb -0.06 -0.95 0.04 0.00 0.00 0.00 0.00 23.12 22.14 1rjz s ALA 11 CO -0.00 -0.63 -0.02 0.08 0.00 0.00 0.00 175.76 175.19 1rjz s VAL 12 N 1.79 3.00 0.14 0.00 1.01 0.17 -1.68 120.40 124.83 1rjz s VAL 12 Ca 0.03 -1.19 -0.31 0.00 0.00 0.00 0.00 61.98 60.51 1rjz s VAL 12 Cb -0.14 -2.63 -0.08 0.00 0.00 0.00 0.00 36.38 33.54 1rjz s VAL 12 CO -0.07 0.03 1.29 -0.94 0.00 0.00 0.00 175.10 175.41 1rjz s SER 13 N 1.30 6.94 -0.61 3.32 1.04 -0.80 -0.70 113.70 124.18 1rjz s SER 13 Ca -0.03 2.27 0.06 0.00 0.48 0.00 0.00 55.95 58.73 1rjz s SER 13 Cb -0.18 -2.60 0.26 0.00 0.10 0.00 0.00 66.02 63.60 1rjz s SER 13 CO -0.02 -0.53 0.75 0.54 0.98 0.00 0.00 173.24 174.96 1rjz n ARG 14 N 3.30 2.45 -1.61 4.02 1.74 -1.26 -3.58 116.66 121.71 1rjz n ARG 14 Ca 0.08 -4.57 -0.49 0.00 -0.77 0.00 0.00 57.85 52.10 1rjz n ARG 14 Cb 0.44 -2.17 -0.05 0.00 -1.02 0.00 0.00 32.46 29.66 1rjz n ARG 14 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1rjz n PRO 15 N 0.76 1.47 0.00 5.56 -0.04 -1.26 -1.96 135.00 139.54 1rjz n PRO 15 Ca 0.29 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 64.28 1rjz n PRO 15 Cb 0.42 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1rjz n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rjz n GLY 16 N 2.53 2.16 0.27 0.55 0.00 -1.26 -4.67 105.19 104.77 1rjz n GLY 16 Ca 0.16 -0.35 0.18 0.00 0.00 0.00 0.00 46.02 46.01 1rjz n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rjz h LEU 17 N 0.00 0.00 0.00 0.99 3.38 -1.84 -3.47 115.31 114.37 1rjz h LEU 17 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rjz h LEU 17 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1rjz h LEU 17 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1rjz n GLY 18 N -1.17 0.82 3.73 0.83 0.00 -0.97 -5.08 105.19 103.35 1rjz n GLY 18 Ca -0.02 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 1rjz n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rjz s GLU 19 N -1.30 2.24 0.34 1.61 0.41 -1.26 -4.31 118.70 116.42 1rjz s GLU 19 Ca 0.00 1.65 -0.29 0.00 -0.41 0.00 0.00 54.97 55.93 1rjz s GLU 19 Cb 0.00 -1.86 -0.11 0.00 -1.78 0.00 0.00 34.13 30.38 1rjz s GLU 19 CO 0.00 -1.73 1.51 -2.14 -0.49 0.00 0.00 175.26 172.41 1rjz s PRO 20 N -4.00 4.14 -0.41 0.39 0.02 -1.26 -4.56 135.00 129.32 1rjz s PRO 20 Ca 0.72 2.53 -0.29 0.00 0.02 0.00 0.00 61.00 63.98 1rjz s PRO 20 Cb -0.27 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.27 1rjz s PRO 20 CO 0.45 -0.54 1.19 0.50 -0.33 0.00 0.00 177.00 178.27 1rjz s ARG 21 N -1.39 3.80 -0.18 5.54 3.00 0.12 -4.82 118.95 125.00 1rjz s ARG 21 Ca 0.57 0.82 -0.07 0.00 -1.00 0.00 0.00 55.73 56.04 1rjz s ARG 21 Cb -0.46 -3.89 -0.04 0.00 0.00 0.00 0.00 34.95 30.56 1rjz s ARG 21 CO 0.56 -1.28 0.05 0.12 0.00 0.00 0.00 175.30 174.75 1rjz s PHE 22 N 4.43 3.21 -0.20 5.12 5.36 -1.26 -0.66 117.98 133.98 1rjz s PHE 22 Ca 0.51 -0.01 -0.04 0.00 -0.96 0.00 0.00 56.93 56.42 1rjz s PHE 22 Cb -0.10 -2.08 0.07 0.00 -0.34 0.00 0.00 43.02 40.57 1rjz s PHE 22 CO 0.27 0.09 0.09 0.42 -1.46 0.00 0.00 175.22 174.63 1rjz s ILE 23 N 0.48 0.02 -0.21 3.12 1.01 0.84 -0.91 121.20 125.55 1rjz s ILE 23 Ca 0.02 -0.35 -0.08 0.00 0.00 0.00 0.00 60.65 60.24 1rjz s ILE 23 Cb -0.13 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 1rjz s ILE 23 CO 0.01 -0.36 0.09 -0.55 0.00 0.00 0.00 174.94 174.13 1rjz s SER 24 N 2.08 5.68 -0.14 3.58 0.15 -1.00 -1.45 113.70 122.60 1rjz s SER 24 Ca 0.03 0.04 -0.00 0.00 0.70 0.00 0.00 55.95 56.72 1rjz s SER 24 Cb -0.16 -1.99 0.03 0.00 -1.71 0.00 0.00 66.02 62.19 1rjz s SER 24 CO -0.14 0.11 -0.06 -0.69 1.20 0.00 0.00 173.24 173.66 1rjz s VAL 25 N 0.74 1.08 -0.06 4.45 1.01 -0.56 0.50 120.40 127.56 1rjz s VAL 25 Ca 0.05 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.38 1rjz s VAL 25 Cb -0.13 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 1rjz s VAL 25 CO 0.02 0.23 0.44 -0.83 0.00 0.00 0.00 175.10 174.96 1rjz s GLY 26 N 1.66 2.43 -0.05 4.51 0.00 -0.48 -0.03 107.32 115.38 1rjz s GLY 26 Ca 0.03 -0.21 0.06 0.00 0.00 0.00 0.00 44.72 44.60 1rjz s GLY 26 CO -0.08 0.44 -0.23 -0.19 0.00 0.00 0.00 173.10 173.04 1rjz s TYR 27 N -0.26 2.25 -0.23 1.90 1.51 0.21 -1.11 117.35 121.61 1rjz s TYR 27 Ca 0.24 -0.61 0.02 0.00 -1.01 0.00 0.00 57.07 55.72 1rjz s TYR 27 Cb -0.16 -1.47 0.05 0.00 -0.11 0.00 0.00 41.96 40.26 1rjz s TYR 27 CO 0.12 -0.16 -0.14 0.08 -1.11 0.00 0.00 175.55 174.33 1rjz s VAL 28 N -0.23 2.16 -1.17 0.71 1.01 -0.67 -1.02 120.40 121.19 1rjz s VAL 28 Ca -0.00 -1.38 -0.01 0.00 0.00 0.00 0.00 61.98 60.59 1rjz s VAL 28 Cb -0.12 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.11 1rjz s VAL 28 CO 0.02 0.17 0.98 0.47 0.00 0.00 0.00 175.10 176.74 1rjz n ASP 29 N 4.50 -2.66 -2.25 3.32 9.92 0.60 -1.77 116.55 128.22 1rjz n ASP 29 Ca -0.16 -0.58 -0.16 0.00 -0.53 0.00 0.00 54.79 53.36 1rjz n ASP 29 Cb 0.45 -4.90 -0.02 0.00 -0.64 0.00 0.00 41.12 36.01 1rjz n ASP 29 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1rjz n ASN 30 N -3.00 -4.67 -3.91 -2.24 3.02 -1.26 -4.95 115.26 98.26 1rjz n ASN 30 Ca -0.23 0.16 -0.30 0.00 -0.03 0.00 0.00 54.58 54.18 1rjz n ASN 30 Cb 0.65 -3.98 -0.16 0.00 -0.61 0.00 0.00 39.78 35.68 1rjz n ASN 30 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1rjz s THR 31 N -2.72 1.34 0.12 3.41 2.01 -0.73 -5.07 115.64 114.00 1rjz s THR 31 Ca 0.00 -1.04 -0.35 0.00 0.31 0.00 0.00 61.69 60.61 1rjz s THR 31 Cb 0.00 -1.62 -0.16 0.00 0.01 0.00 0.00 72.50 70.74 1rjz s THR 31 CO 0.00 -0.07 1.41 1.21 -0.69 0.00 0.00 174.62 176.48 1rjz n GLU 32 N 4.75 1.52 0.00 4.92 2.13 -1.26 -1.67 120.64 131.02 1rjz n GLU 32 Ca -0.12 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.25 1rjz n GLU 32 Cb 0.45 -2.22 0.00 0.00 0.27 0.00 0.00 31.44 29.94 1rjz n GLU 32 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1rjz n PHE 33 N 2.71 0.00 -3.91 4.31 -1.74 -0.27 -4.25 117.46 114.31 1rjz n PHE 33 Ca 0.17 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.98 1rjz n PHE 33 Cb 0.23 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.15 1rjz n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1rjz s VAL 34 N -1.19 0.16 -0.27 1.97 -7.23 -1.20 0.78 120.40 113.42 1rjz s VAL 34 Ca 0.00 -1.28 -0.25 0.00 -1.81 0.00 0.00 61.98 58.64 1rjz s VAL 34 Cb 0.00 -1.31 0.09 0.00 0.56 0.00 0.00 36.38 35.71 1rjz s VAL 34 CO 0.00 -0.71 0.81 -0.60 -0.31 0.00 0.00 175.10 174.29 1rjz s ARG 35 N -3.68 0.75 0.22 4.82 3.52 -1.08 -1.38 118.95 122.12 1rjz s ARG 35 Ca 0.04 0.86 0.11 0.00 -0.13 0.00 0.00 55.73 56.61 1rjz s ARG 35 Cb 0.05 0.36 -0.05 0.00 -1.56 0.00 0.00 34.95 33.76 1rjz s ARG 35 CO -0.10 -0.10 -0.21 0.12 -0.81 0.00 0.00 175.30 174.21 1rjz s PHE 36 N 0.28 2.16 -0.30 5.12 5.36 0.18 -2.29 117.98 128.50 1rjz s PHE 36 Ca 0.01 -0.39 -0.02 0.00 -0.96 0.00 0.00 56.93 55.57 1rjz s PHE 36 Cb -0.05 -1.02 0.19 0.00 -0.34 0.00 0.00 43.02 41.80 1rjz s PHE 36 CO -0.01 0.54 0.67 0.34 -1.46 0.00 0.00 175.22 175.30 1rjz s ASP 37 N -3.02 -1.28 0.22 6.13 -1.08 -1.26 -2.37 116.67 114.02 1rjz s ASP 37 Ca 0.23 0.71 -0.09 0.00 -0.52 0.00 0.00 52.55 52.88 1rjz s ASP 37 Cb -0.06 2.03 0.19 0.00 -1.46 0.00 0.00 42.92 43.62 1rjz s ASP 37 CO 0.11 -0.24 1.88 0.77 0.52 0.00 0.00 175.17 178.21 1rjz h SER 38 N 7.99 0.99 0.00 -0.34 4.64 -1.40 -2.70 113.55 122.73 1rjz h SER 38 Ca -0.19 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1rjz h SER 38 Cb 1.17 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1rjz h SER 38 CO 0.19 0.75 0.00 -0.67 -0.87 0.00 0.00 176.83 176.23 1rjz n ASP 39 N -4.46 2.42 -4.42 4.97 2.03 -1.26 -4.59 116.55 111.24 1rjz n ASP 39 Ca 0.09 -1.52 -0.22 0.00 0.52 0.00 0.00 54.79 53.65 1rjz n ASP 39 Cb 0.04 -0.49 -0.10 0.00 -0.72 0.00 0.00 41.12 39.85 1rjz n ASP 39 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rjz s ALA 40 N 0.80 2.46 0.00 -1.67 0.00 -1.02 -5.08 121.76 117.25 1rjz s ALA 40 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 51.96 50.19 1rjz s ALA 40 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1rjz s ALA 40 CO 0.00 0.22 0.57 0.39 0.00 0.00 0.00 175.76 176.94 1rjz n GLU 41 N -0.42 0.00 -3.74 0.00 1.02 -1.26 -3.63 120.64 112.61 1rjz n GLU 41 Ca -0.07 0.57 -0.29 0.00 -0.02 0.00 0.00 57.16 57.35 1rjz n GLU 41 Cb 0.60 -0.96 -0.12 0.00 -0.02 0.00 0.00 31.44 30.94 1rjz n GLU 41 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1rjz s ASN 42 N -2.64 3.69 -0.44 1.62 3.84 -1.26 -5.09 114.94 114.65 1rjz s ASN 42 Ca 0.00 -3.16 -0.42 0.00 0.21 0.00 0.00 52.86 49.50 1rjz s ASN 42 Cb 0.00 -1.19 -0.18 0.00 -0.55 0.00 0.00 41.25 39.34 1rjz s ASN 42 CO 0.00 -0.18 1.44 -0.81 -2.79 0.00 0.00 177.10 174.76 1rjz n PRO 43 N 2.85 0.00 -3.71 0.43 -0.04 -1.24 -4.96 135.00 128.33 1rjz n PRO 43 Ca 0.16 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.51 1rjz n PRO 43 Cb 0.37 -1.33 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 1rjz n PRO 43 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1rjz s ARG 44 N 2.79 0.96 -0.10 0.54 0.52 -1.26 -5.01 118.95 117.39 1rjz s ARG 44 Ca 0.94 -0.70 -0.30 0.00 -0.52 0.00 0.00 55.73 55.15 1rjz s ARG 44 Cb -1.33 0.42 -0.02 0.00 0.52 0.00 0.00 34.95 34.54 1rjz s ARG 44 CO 0.72 -0.35 1.07 0.71 0.02 0.00 0.00 175.30 177.48 1rjz s TYR 45 N -3.50 3.39 0.01 -0.53 4.12 -1.26 -4.57 117.35 115.00 1rjz s TYR 45 Ca 0.01 1.46 0.07 0.00 0.02 0.00 0.00 57.07 58.63 1rjz s TYR 45 Cb 0.02 -3.27 -0.03 0.00 -1.52 0.00 0.00 41.96 37.16 1rjz s TYR 45 CO -0.10 -0.61 -0.21 -1.21 0.02 0.00 0.00 175.55 173.44 1rjz s GLU 46 N 2.19 2.09 0.40 -0.62 0.41 -0.97 -4.97 118.70 117.23 1rjz s GLU 46 Ca 0.50 -0.95 -0.25 0.00 -0.41 0.00 0.00 54.97 53.86 1rjz s GLU 46 Cb -0.20 -2.14 -0.09 0.00 -1.78 0.00 0.00 34.13 29.93 1rjz s GLU 46 CO 0.18 0.55 1.17 -1.25 -0.49 0.00 0.00 175.26 175.43 1rjz s PRO 47 N -1.09 4.08 -0.01 0.39 0.04 -1.26 -2.63 135.00 134.51 1rjz s PRO 47 Ca 0.12 1.85 0.11 0.00 0.04 0.00 0.00 61.00 63.12 1rjz s PRO 47 Cb -0.10 -2.70 -0.16 0.00 0.04 0.00 0.00 34.50 31.58 1rjz s PRO 47 CO 0.02 -0.30 0.26 0.54 0.04 0.00 0.00 177.00 177.56 1rjz n ARG 48 N 0.12 0.74 -4.27 4.56 5.12 0.23 -4.90 116.66 118.26 1rjz n ARG 48 Ca 0.04 -0.08 -0.33 0.00 -1.93 0.00 0.00 57.85 55.55 1rjz n ARG 48 Cb 0.46 -1.22 -0.16 0.00 -1.16 0.00 0.00 32.46 30.39 1rjz n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1rjz s ALA 49 N -2.63 2.33 0.35 7.54 0.00 -1.19 -4.86 121.76 123.30 1rjz s ALA 49 Ca -0.03 -1.18 0.21 0.00 0.00 0.00 0.00 51.96 50.96 1rjz s ALA 49 Cb 0.07 -1.15 1.27 0.00 0.00 0.00 0.00 23.12 23.31 1rjz s ALA 49 CO 0.43 -0.26 1.47 0.54 0.00 0.00 0.00 175.76 177.95 1rjz n ARG 50 N 4.47 -0.05 0.00 0.00 5.12 -1.26 0.61 116.66 125.54 1rjz n ARG 50 Ca -0.21 1.27 0.02 0.00 -1.93 0.00 0.00 57.85 57.01 1rjz n ARG 50 Cb 0.50 -2.31 0.12 0.00 -1.16 0.00 0.00 32.46 29.61 1rjz n ARG 50 CO 0.00 0.00 0.00 -2.67 -1.93 0.00 0.00 177.63 173.03 1rjz n TRP 51 N -5.05 0.00 0.69 -1.55 4.27 -1.26 -1.81 117.44 112.73 1rjz n TRP 51 Ca 0.36 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 54.09 1rjz n TRP 51 Cb 1.23 -0.34 0.27 0.00 -1.36 0.00 0.00 31.31 31.11 1rjz n TRP 51 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 1rjz n MET 52 N -1.34 0.22 0.00 -2.67 2.81 0.20 -3.58 117.12 112.75 1rjz n MET 52 Ca 0.02 0.09 0.08 0.00 -1.81 0.00 0.00 57.70 56.09 1rjz n MET 52 Cb 0.04 -1.66 0.48 0.00 -0.71 0.00 0.00 33.22 31.37 1rjz n MET 52 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1rjz n GLU 53 N -1.99 0.43 0.00 0.03 1.02 -0.75 -1.78 120.64 117.60 1rjz n GLU 53 Ca 0.04 0.05 0.12 0.00 -0.02 0.00 0.00 57.16 57.35 1rjz n GLU 53 Cb 0.41 -1.50 0.56 0.00 -0.02 0.00 0.00 31.44 30.89 1rjz n GLU 53 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1rjz n GLN 54 N -1.10 0.14 -3.30 3.49 6.02 -1.24 -4.74 117.38 116.65 1rjz n GLN 54 Ca 0.11 0.07 -0.38 0.00 -0.01 0.00 0.00 57.00 56.79 1rjz n GLN 54 Cb 0.08 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.79 1rjz n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1rjz s GLU 55 N -2.83 4.22 1.02 -1.09 0.41 -0.74 -5.08 118.70 114.61 1rjz s GLU 55 Ca 0.16 0.61 -0.14 0.00 -0.41 0.00 0.00 54.97 55.18 1rjz s GLU 55 Cb 0.16 -3.32 0.20 0.00 -1.78 0.00 0.00 34.13 29.39 1rjz s GLU 55 CO 0.41 0.44 1.14 0.20 -0.49 0.00 0.00 175.26 176.96 1rjz s GLY 56 N -0.37 1.59 0.00 -1.39 0.00 -1.26 -4.90 107.32 100.98 1rjz s GLY 56 Ca 0.28 -0.66 0.06 0.00 0.00 0.00 0.00 44.72 44.40 1rjz s GLY 56 CO 0.15 0.02 0.93 -1.55 0.00 0.00 0.00 173.10 172.65 1rjz n PRO 57 N -4.13 0.13 -0.02 2.90 -0.04 -1.26 -2.82 135.00 129.76 1rjz n PRO 57 Ca 0.09 0.13 -0.00 0.00 -0.04 0.00 0.00 63.50 63.67 1rjz n PRO 57 Cb 0.59 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.55 1rjz n PRO 57 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1rjz h GLU 58 N 0.00 0.00 -0.68 0.54 3.07 -1.99 -2.94 114.58 112.58 1rjz h GLU 58 Ca 0.00 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 58.93 1rjz h GLU 58 Cb 0.03 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 27.85 1rjz h GLU 58 CO 0.00 0.00 -0.37 0.98 -1.40 0.00 0.00 179.01 178.22 1rjz n TYR 59 N -3.16 -0.23 0.01 4.33 9.36 -1.13 0.55 117.16 126.88 1rjz n TYR 59 Ca -0.00 0.85 -0.10 0.00 3.32 0.00 0.00 57.90 61.97 1rjz n TYR 59 Cb 0.00 -0.60 -0.04 0.00 -0.63 0.00 0.00 39.34 38.08 1rjz n TYR 59 CO 0.00 0.00 0.00 -1.49 0.22 0.00 0.00 176.86 175.59 1rjz h TRP 60 N 0.00 -0.30 0.44 2.98 4.06 -1.72 1.26 115.95 122.67 1rjz h TRP 60 Ca 0.14 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.10 1rjz h TRP 60 Cb 0.31 0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 28.60 1rjz h TRP 60 CO -0.68 -0.18 -0.41 1.49 -3.56 0.00 0.00 178.44 175.10 1rjz h GLU 61 N -0.16 -0.83 -0.53 0.49 4.57 0.14 0.72 114.58 118.99 1rjz h GLU 61 Ca 0.08 0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.39 1rjz h GLU 61 Cb 0.27 0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 28.98 1rjz h GLU 61 CO -0.19 -0.55 0.18 -0.09 -1.18 0.00 0.00 179.01 177.17 1rjz h ARG 62 N -0.86 0.34 -0.17 1.92 2.43 0.55 -1.04 114.38 117.55 1rjz h ARG 62 Ca -0.04 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 58.98 1rjz h ARG 62 Cb 0.75 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1rjz h ARG 62 CO -0.04 0.22 -0.46 0.93 -1.51 0.00 0.00 179.97 179.11 1rjz h GLU 63 N 0.35 0.42 -0.11 0.20 4.39 0.19 -2.86 114.58 117.16 1rjz h GLU 63 Ca 0.26 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1rjz h GLU 63 Cb 0.30 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1rjz h GLU 63 CO -0.28 0.80 0.01 1.15 -1.16 0.00 0.00 179.01 179.53 1rjz h THR 64 N 0.34 1.24 0.00 1.13 2.02 0.12 -1.72 112.91 116.04 1rjz h THR 64 Ca 0.02 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 1rjz h THR 64 Cb 0.94 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1rjz h THR 64 CO 0.08 0.21 -0.05 1.56 0.37 0.00 0.00 175.52 177.70 1rjz h GLN 65 N -0.07 0.00 0.02 6.66 1.08 -1.22 -0.18 115.11 121.40 1rjz h GLN 65 Ca 0.03 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 57.01 1rjz h GLN 65 Cb 0.32 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1rjz h GLN 65 CO 0.00 0.05 -0.97 -0.22 -0.95 0.00 0.00 178.83 176.74 1rjz h LYS 66 N 0.00 0.33 -0.60 1.46 3.64 -1.26 -2.24 116.57 117.91 1rjz h LYS 66 Ca -0.00 -0.38 -0.08 0.00 -1.27 0.00 0.00 60.65 58.92 1rjz h LYS 66 Cb 0.10 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 1rjz h LYS 66 CO 0.01 1.08 0.07 0.00 -2.27 0.00 0.00 179.45 178.33 1rjz h ALA 67 N 0.78 0.80 -0.12 5.00 0.00 -0.15 -0.99 119.26 124.58 1rjz h ALA 67 Ca -0.08 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 1rjz h ALA 67 Cb 1.61 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1rjz h ALA 67 CO 0.16 0.58 -0.30 0.87 0.00 0.00 0.00 179.25 180.56 1rjz h LYS 68 N 0.92 0.23 -0.07 0.00 1.57 -1.20 0.52 116.57 118.54 1rjz h LYS 68 Ca 0.18 -0.09 -0.17 0.00 -1.87 0.00 0.00 60.65 58.71 1rjz h LYS 68 Cb 0.47 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1rjz h LYS 68 CO 0.02 0.52 -0.68 0.78 -0.57 0.00 0.00 179.45 179.52 1rjz h GLY 69 N 1.04 0.33 1.58 3.86 0.00 -0.90 -2.43 103.07 106.55 1rjz h GLY 69 Ca 0.03 -0.45 -0.23 0.00 0.00 0.00 0.00 47.33 46.68 1rjz h GLY 69 CO 0.05 0.40 -0.96 3.43 0.00 0.00 0.00 176.54 179.46 1rjz h ASN 70 N 0.21 0.48 -0.01 0.19 2.35 -0.86 -2.83 115.58 115.12 1rjz h ASN 70 Ca -0.02 -0.40 0.03 0.00 -0.55 0.00 0.00 56.30 55.37 1rjz h ASN 70 Cb 1.22 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 39.39 1rjz h ASN 70 CO 0.11 1.20 -0.33 -0.08 -1.65 0.00 0.00 177.43 176.68 1rjz h GLU 71 N 0.20 -0.47 -0.86 0.81 4.81 -0.73 0.14 114.58 118.48 1rjz h GLU 71 Ca -0.08 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1rjz h GLU 71 Cb 1.60 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 31.04 1rjz h GLU 71 CO 0.16 -0.31 0.51 1.96 -0.73 0.00 0.00 179.01 180.60 1rjz h GLN 72 N -0.48 1.18 -0.65 1.92 1.08 -1.47 -0.00 115.11 116.69 1rjz h GLN 72 Ca 0.06 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 1rjz h GLN 72 Cb 0.57 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.73 1rjz h GLN 72 CO -0.28 0.84 0.38 0.77 -0.95 0.00 0.00 178.83 179.59 1rjz h SER 73 N 1.19 0.79 -0.47 1.46 0.02 -1.16 -0.89 113.55 114.49 1rjz h SER 73 Ca 0.31 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1rjz h SER 73 Cb -0.03 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 1rjz h SER 73 CO -0.06 0.64 0.29 -0.26 -1.14 0.00 0.00 176.83 176.30 1rjz h PHE 74 N 0.88 0.63 -0.62 3.45 0.05 0.09 0.57 116.94 121.99 1rjz h PHE 74 Ca 0.23 0.01 -0.05 0.00 3.82 0.00 0.00 57.97 61.97 1rjz h PHE 74 Cb 0.00 -0.21 -0.03 0.00 2.00 0.00 0.00 35.95 37.72 1rjz h PHE 74 CO -0.01 0.42 0.17 -0.09 -0.18 0.00 0.00 178.31 178.61 1rjz h ARG 75 N 0.66 0.95 0.06 1.51 2.43 0.12 -1.33 114.38 118.79 1rjz h ARG 75 Ca 0.18 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1rjz h ARG 75 Cb -0.03 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1rjz h ARG 75 CO -0.03 0.84 -0.03 0.28 -1.51 0.00 0.00 179.97 179.52 1rjz h VAL 76 N 0.92 1.27 -0.73 0.20 2.07 0.24 -3.15 116.25 117.07 1rjz h VAL 76 Ca 0.20 -1.34 0.15 0.00 0.82 0.00 0.00 66.70 66.52 1rjz h VAL 76 Cb 0.30 2.12 -0.14 0.00 -1.52 0.00 0.00 31.29 32.05 1rjz h VAL 76 CO -0.00 0.32 -0.19 0.44 0.02 0.00 0.00 177.57 178.16 1rjz h ASP 77 N -0.71 -0.71 -0.71 0.57 3.32 0.25 0.32 116.42 118.75 1rjz h ASP 77 Ca -0.01 0.22 0.12 0.00 0.02 0.00 0.00 57.03 57.39 1rjz h ASP 77 Cb 0.59 0.46 -0.09 0.00 0.22 0.00 0.00 39.33 40.52 1rjz h ASP 77 CO 0.01 -0.25 0.28 -0.07 -1.72 0.00 0.00 179.24 177.50 1rjz h LEU 78 N -0.01 0.27 -0.58 1.55 3.38 -1.29 0.15 115.31 118.78 1rjz h LEU 78 Ca 0.35 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.39 1rjz h LEU 78 Cb 0.54 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1rjz h LEU 78 CO -0.76 0.12 0.25 0.03 0.09 0.00 0.00 178.44 178.18 1rjz h ARG 79 N 0.44 0.86 0.01 1.13 3.08 -0.44 -2.18 114.38 117.28 1rjz h ARG 79 Ca 0.38 -0.15 0.01 0.00 0.07 0.00 0.00 59.98 60.29 1rjz h ARG 79 Cb 0.53 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1rjz h ARG 79 CO -0.37 0.72 -0.05 1.15 -1.07 0.00 0.00 179.97 180.36 1rjz h THR 80 N 0.79 0.87 0.00 2.04 2.02 0.11 -2.52 112.91 116.22 1rjz h THR 80 Ca 0.20 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.36 1rjz h THR 80 Cb 0.17 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1rjz h THR 80 CO -0.02 0.00 -0.06 -0.07 0.37 0.00 0.00 175.52 175.74 1rjz h LEU 81 N -0.10 0.00 -1.65 2.58 3.38 -0.60 0.42 115.31 119.33 1rjz h LEU 81 Ca 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1rjz h LEU 81 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1rjz h LEU 81 CO -0.05 0.06 -0.20 -0.07 0.09 0.00 0.00 178.44 178.27 1rjz h LEU 82 N 0.00 0.00 0.24 1.67 3.38 -0.97 -0.76 115.31 118.87 1rjz h LEU 82 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1rjz h LEU 82 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1rjz h LEU 82 CO 0.01 0.20 -0.12 1.23 0.09 0.00 0.00 178.44 179.85 1rjz h GLY 83 N 0.94 -0.34 0.05 0.83 0.00 0.03 -0.58 103.07 103.99 1rjz h GLY 83 Ca -0.00 0.13 0.12 0.00 0.00 0.00 0.00 47.33 47.58 1rjz h GLY 83 CO 0.03 -0.12 0.07 -0.97 0.00 0.00 0.00 176.54 175.54 1rjz h TYR 84 N -0.98 0.09 -0.42 5.60 0.05 -0.98 -1.45 116.97 118.87 1rjz h TYR 84 Ca -0.03 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1rjz h TYR 84 Cb 0.45 0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.25 1rjz h TYR 84 CO 0.05 -0.10 0.00 0.66 -1.05 0.00 0.00 178.16 177.71 1rjz n TYR 85 N -5.21 0.62 -3.96 4.88 4.01 -0.32 -4.92 117.16 112.27 1rjz n TYR 85 Ca 0.09 -0.30 -0.37 0.00 -0.16 0.00 0.00 57.90 57.17 1rjz n TYR 85 Cb 0.35 -0.03 0.01 0.00 -0.31 0.00 0.00 39.34 39.36 1rjz n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1rjz n ASN 86 N 0.71 -4.41 -4.43 7.72 5.15 -0.55 -4.96 115.26 114.49 1rjz n ASN 86 Ca 0.14 -1.16 -0.30 0.00 -0.60 0.00 0.00 54.58 52.66 1rjz n ASN 86 Cb 0.40 -1.58 -0.13 0.00 -0.53 0.00 0.00 39.78 37.94 1rjz n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1rjz s GLN 87 N -6.33 1.90 0.71 1.20 -0.21 -0.33 -5.04 119.66 111.57 1rjz s GLN 87 Ca 0.26 -1.07 -0.15 0.00 0.02 0.00 0.00 55.36 54.41 1rjz s GLN 87 Cb -0.15 -2.10 0.03 0.00 1.00 0.00 0.00 33.01 31.79 1rjz s GLN 87 CO 0.94 0.52 1.21 -1.54 -2.12 0.00 0.00 175.29 174.30 1rjz s SER 88 N -1.56 4.33 -0.04 5.90 1.04 -1.26 -4.79 113.70 117.31 1rjz s SER 88 Ca 0.14 2.36 0.03 0.00 0.48 0.00 0.00 55.95 58.97 1rjz s SER 88 Cb -0.10 -2.59 0.17 0.00 0.10 0.00 0.00 66.02 63.59 1rjz s SER 88 CO 0.05 -2.18 0.80 0.29 0.98 0.00 0.00 173.24 173.19 1rjz n LYS 89 N -2.58 1.77 -0.08 4.02 5.02 -1.26 -3.76 118.16 121.29 1rjz n LYS 89 Ca 0.13 -0.65 0.07 0.00 -2.02 0.00 0.00 58.31 55.85 1rjz n LYS 89 Cb 0.50 -1.60 0.11 0.00 -0.02 0.00 0.00 35.03 34.02 1rjz n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1rjz n GLY 90 N 0.20 4.20 3.38 0.72 0.00 -1.26 -4.89 105.19 107.55 1rjz n GLY 90 Ca 0.06 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.08 1rjz n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rjz s GLY 91 N -2.20 1.56 0.01 -0.02 0.00 -1.25 -4.90 107.32 100.52 1rjz s GLY 91 Ca 0.23 -1.63 -0.23 0.00 0.00 0.00 0.00 44.72 43.10 1rjz s GLY 91 CO 0.03 -1.69 0.68 -0.45 0.00 0.00 0.00 173.10 171.67 1rjz s SER 92 N -2.95 7.07 0.12 1.64 0.15 -1.26 -4.60 113.70 113.87 1rjz s SER 92 Ca 0.21 1.28 0.05 0.00 0.70 0.00 0.00 55.95 58.18 1rjz s SER 92 Cb -0.05 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.81 1rjz s SER 92 CO 0.09 0.03 -0.12 -1.00 1.20 0.00 0.00 173.24 173.45 1rjz s HIS 93 N 0.02 1.25 -0.10 3.44 4.02 -1.23 -4.97 115.29 117.71 1rjz s HIS 93 Ca 0.35 -0.64 0.03 0.00 1.02 0.00 0.00 55.06 55.82 1rjz s HIS 93 Cb -0.19 -0.66 0.01 0.00 -1.02 0.00 0.00 32.58 30.72 1rjz s HIS 93 CO 0.20 0.08 -0.20 0.99 1.02 0.00 0.00 174.74 176.83 1rjz s THR 94 N -2.52 1.79 -0.16 1.30 2.01 -1.26 -1.91 115.64 114.89 1rjz s THR 94 Ca 0.09 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 1rjz s THR 94 Cb -0.02 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.90 1rjz s THR 94 CO 0.01 0.50 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.69 1rjz s ILE 95 N 0.63 2.93 0.09 1.82 1.01 -0.68 0.51 121.20 127.52 1rjz s ILE 95 Ca -0.13 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 59.92 1rjz s ILE 95 Cb -0.16 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 1rjz s ILE 95 CO 0.04 0.50 -0.20 -1.10 0.00 0.00 0.00 174.94 174.18 1rjz s GLN 96 N 0.78 1.13 -0.02 2.79 -0.21 -0.08 -1.13 119.66 122.92 1rjz s GLN 96 Ca -0.05 -1.11 -0.07 0.00 0.02 0.00 0.00 55.36 54.16 1rjz s GLN 96 Cb -0.15 -1.35 0.01 0.00 1.00 0.00 0.00 33.01 32.51 1rjz s GLN 96 CO 0.01 0.32 0.14 0.08 -2.12 0.00 0.00 175.29 173.72 1rjz s VAL 97 N -1.11 0.06 -0.13 1.09 1.01 0.07 -1.33 120.40 120.06 1rjz s VAL 97 Ca 0.06 -0.48 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 1rjz s VAL 97 Cb -0.10 -0.37 0.02 0.00 0.00 0.00 0.00 36.38 35.94 1rjz s VAL 97 CO 0.04 -0.26 -0.11 -0.63 0.00 0.00 0.00 175.10 174.14 1rjz s ILE 98 N -0.93 1.29 -0.07 2.22 1.01 -0.94 -1.35 121.20 122.42 1rjz s ILE 98 Ca -0.10 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.09 1rjz s ILE 98 Cb -0.06 -1.25 0.03 0.00 0.01 0.00 0.00 42.46 41.19 1rjz s ILE 98 CO 0.01 0.41 -0.01 -0.55 0.00 0.00 0.00 174.94 174.80 1rjz s SER 99 N 1.60 1.55 0.00 3.58 0.15 -0.54 -2.02 113.70 118.03 1rjz s SER 99 Ca 0.05 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.59 1rjz s SER 99 Cb -0.13 -0.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.71 1rjz s SER 99 CO -0.09 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.79 1rjz n GLY 100 N 4.99 0.85 3.15 9.45 0.00 -1.02 0.66 105.19 123.27 1rjz n GLY 100 Ca -0.10 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 1rjz n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rjz s GLU 102 N -0.14 3.20 0.39 0.00 2.12 0.32 -1.37 118.70 123.22 1rjz s GLU 102 Ca -0.03 -0.77 0.08 0.00 0.36 0.00 0.00 54.97 54.61 1rjz s GLU 102 Cb -0.03 -2.56 -0.04 0.00 0.26 0.00 0.00 34.13 31.77 1rjz s GLU 102 CO 0.01 0.07 0.23 0.14 -0.54 0.00 0.00 175.26 175.18 1rjz s VAL 103 N 0.66 2.69 0.24 3.70 -7.23 -0.53 0.46 120.40 120.39 1rjz s VAL 103 Ca -0.09 -1.57 0.01 0.00 -1.81 0.00 0.00 61.98 58.52 1rjz s VAL 103 Cb -0.16 -3.00 0.05 0.00 0.56 0.00 0.00 36.38 33.82 1rjz s VAL 103 CO 0.02 -0.06 0.33 0.61 -0.31 0.00 0.00 175.10 175.69 1rjz n GLY 104 N -1.31 1.15 0.08 2.32 0.00 -0.62 -2.68 105.19 104.12 1rjz n GLY 104 Ca -0.00 -2.05 0.10 0.00 0.00 0.00 0.00 46.02 44.07 1rjz n GLY 104 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1rjz n SER 105 N -2.90 0.40 0.00 1.61 2.88 -1.26 -2.62 113.62 111.73 1rjz n SER 105 Ca 0.06 0.60 0.11 0.00 -1.33 0.00 0.00 58.87 58.32 1rjz n SER 105 Cb 0.21 -0.69 0.14 0.00 -0.75 0.00 0.00 64.21 63.12 1rjz n SER 105 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1rjz n ASP 106 N -1.95 0.63 0.00 -3.46 5.68 -1.26 -4.94 116.55 111.25 1rjz n ASP 106 Ca 0.02 -0.40 0.00 0.00 -0.50 0.00 0.00 54.79 53.91 1rjz n ASP 106 Cb 0.20 0.48 0.00 0.00 -1.14 0.00 0.00 41.12 40.65 1rjz n ASP 106 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rjz n GLY 107 N 1.48 0.84 3.98 6.12 0.00 -1.08 -5.07 105.19 111.46 1rjz n GLY 107 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1rjz n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rjz s ARG 108 N -0.79 2.21 -0.09 1.61 0.52 -1.26 -4.88 118.95 116.27 1rjz s ARG 108 Ca 0.00 -0.93 -0.18 0.00 -0.52 0.00 0.00 55.73 54.11 1rjz s ARG 108 Cb 0.00 -2.43 -0.05 0.00 0.52 0.00 0.00 34.95 32.99 1rjz s ARG 108 CO 0.00 -1.00 0.47 -1.17 0.02 0.00 0.00 175.30 173.63 1rjz s LEU 109 N -4.91 4.31 -0.22 2.53 2.96 -1.26 -1.59 118.68 120.50 1rjz s LEU 109 Ca 0.61 0.85 0.05 0.00 -0.22 0.00 0.00 54.13 55.42 1rjz s LEU 109 Cb -0.08 -2.69 -0.17 0.00 0.50 0.00 0.00 46.19 43.75 1rjz s LEU 109 CO 0.41 0.05 -0.15 0.18 -1.32 0.00 0.00 176.35 175.52 1rjz n LEU 110 N 3.35 2.35 -3.64 -0.68 4.77 0.17 -4.82 117.00 118.50 1rjz n LEU 110 Ca -0.08 -0.10 -0.03 0.00 -0.03 0.00 0.00 56.01 55.77 1rjz n LEU 110 Cb 0.52 -0.55 -0.07 0.00 -2.33 0.00 0.00 43.42 40.99 1rjz n LEU 110 CO 0.42 0.80 0.75 -0.60 -1.33 0.00 0.00 177.39 177.43 1rjz s ARG 111 N -2.46 0.35 0.12 3.23 3.52 -0.92 -5.01 118.95 117.77 1rjz s ARG 111 Ca -0.27 0.55 0.05 0.00 -0.13 0.00 0.00 55.73 55.93 1rjz s ARG 111 Cb 0.08 0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.52 1rjz s ARG 111 CO 0.58 -0.07 0.07 0.20 -0.81 0.00 0.00 175.30 175.28 1rjz s GLY 112 N 1.05 1.86 0.18 8.12 0.00 -1.26 -0.52 107.32 116.75 1rjz s GLY 112 Ca -0.06 -1.14 0.08 0.00 0.00 0.00 0.00 44.72 43.60 1rjz s GLY 112 CO -0.13 -1.14 -0.16 -0.19 0.00 0.00 0.00 173.10 171.48 1rjz s TYR 113 N -1.54 1.75 -0.34 1.90 1.51 0.40 -4.91 117.35 116.12 1rjz s TYR 113 Ca 0.29 -0.51 -0.07 0.00 -1.01 0.00 0.00 57.07 55.77 1rjz s TYR 113 Cb -0.11 -0.85 0.19 0.00 -0.11 0.00 0.00 41.96 41.08 1rjz s TYR 113 CO 0.21 0.33 0.98 -1.14 -1.11 0.00 0.00 175.55 174.83 1rjz s GLN 114 N -3.11 0.28 -0.02 -0.62 2.00 -1.22 -2.42 119.66 114.54 1rjz s GLN 114 Ca 0.18 -0.09 0.02 0.00 -2.00 0.00 0.00 55.36 53.47 1rjz s GLN 114 Cb -0.04 0.03 0.01 0.00 0.80 0.00 0.00 33.01 33.81 1rjz s GLN 114 CO 0.06 -0.40 -0.06 1.14 -0.50 0.00 0.00 175.29 175.53 1rjz s GLN 115 N 1.95 0.73 0.33 1.67 -2.07 -0.85 -0.73 119.66 120.69 1rjz s GLN 115 Ca 0.15 -0.20 0.07 0.00 -1.82 0.00 0.00 55.36 53.56 1rjz s GLN 115 Cb 0.02 -0.72 -0.02 0.00 -1.09 0.00 0.00 33.01 31.20 1rjz s GLN 115 CO -0.14 0.05 0.38 0.71 -1.32 0.00 0.00 175.29 174.98 1rjz s TYR 116 N 0.34 3.03 -0.18 9.60 1.51 0.18 -2.21 117.35 129.63 1rjz s TYR 116 Ca -0.04 -0.25 -0.15 0.00 -1.01 0.00 0.00 57.07 55.62 1rjz s TYR 116 Cb -0.09 -1.89 0.05 0.00 -0.11 0.00 0.00 41.96 39.93 1rjz s TYR 116 CO 0.00 0.10 0.46 0.00 -1.11 0.00 0.00 175.55 175.00 1rjz s ALA 117 N -2.22 -1.15 -0.07 3.71 0.00 -0.44 -1.07 121.76 120.52 1rjz s ALA 117 Ca 0.43 1.37 0.05 0.00 0.00 0.00 0.00 51.96 53.80 1rjz s ALA 117 Cb -0.08 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 1rjz s ALA 117 CO 0.29 -0.23 -0.22 -0.47 0.00 0.00 0.00 175.76 175.13 1rjz s TYR 118 N 0.44 2.52 -0.76 0.00 5.04 -0.96 -0.90 117.35 122.73 1rjz s TYR 118 Ca -0.02 -0.68 -0.06 0.00 -2.44 0.00 0.00 57.07 53.87 1rjz s TYR 118 Cb -0.04 -1.64 0.06 0.00 0.35 0.00 0.00 41.96 40.69 1rjz s TYR 118 CO -0.02 -0.19 0.21 -0.25 -1.34 0.00 0.00 175.55 173.96 1rjz n ASP 119 N 2.99 -2.19 0.00 4.32 8.00 0.18 -1.40 116.55 128.45 1rjz n ASP 119 Ca -0.18 -0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.29 1rjz n ASP 119 Cb 0.52 -1.92 0.00 0.00 -0.02 0.00 0.00 41.12 39.70 1rjz n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rjz n GLY 120 N -0.79 0.39 2.79 0.44 0.00 -1.26 -4.99 105.19 101.77 1rjz n GLY 120 Ca -0.01 -0.90 -0.17 0.00 0.00 0.00 0.00 46.02 44.95 1rjz n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rjz n ASP 122 N 4.97 -0.07 -0.03 0.00 8.00 -1.26 -2.26 116.55 125.90 1rjz n ASP 122 Ca -0.11 0.91 -0.04 0.00 0.71 0.00 0.00 54.79 56.25 1rjz n ASP 122 Cb 0.50 -0.72 -0.01 0.00 -0.02 0.00 0.00 41.12 40.86 1rjz n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rjz n TYR 123 N 1.10 0.00 -3.80 1.24 9.36 -0.23 -4.61 117.16 120.22 1rjz n TYR 123 Ca 0.16 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.28 1rjz n TYR 123 Cb 0.07 -0.24 -0.07 0.00 -0.63 0.00 0.00 39.34 38.47 1rjz n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1rjz s ILE 124 N -2.25 0.12 -0.13 2.97 2.07 -1.22 -0.02 121.20 122.74 1rjz s ILE 124 Ca -0.14 -1.01 -0.26 0.00 -1.41 0.00 0.00 60.65 57.82 1rjz s ILE 124 Cb 0.02 -1.27 0.06 0.00 0.13 0.00 0.00 42.46 41.40 1rjz s ILE 124 CO 0.21 -0.56 0.65 0.00 -1.91 0.00 0.00 174.94 173.33 1rjz s ALA 125 N -3.76 -1.64 0.25 1.50 0.00 -1.22 0.51 121.76 117.40 1rjz s ALA 125 Ca 0.04 1.48 -0.29 0.00 0.00 0.00 0.00 51.96 53.19 1rjz s ALA 125 Cb 0.04 -0.46 -0.09 0.00 0.00 0.00 0.00 23.12 22.60 1rjz s ALA 125 CO -0.11 -0.34 0.93 -1.17 0.00 0.00 0.00 175.76 175.08 1rjz s LEU 126 N -0.54 4.62 0.57 0.00 2.96 0.09 -1.64 118.68 124.74 1rjz s LEU 126 Ca -0.06 1.93 -0.16 0.00 -0.22 0.00 0.00 54.13 55.61 1rjz s LEU 126 Cb -0.02 -3.64 -0.05 0.00 0.50 0.00 0.00 46.19 42.98 1rjz s LEU 126 CO 0.06 0.14 1.04 0.20 -1.32 0.00 0.00 176.35 176.46 1rjz s ASN 127 N -1.22 6.02 0.57 3.68 0.02 -0.12 -4.76 114.94 119.12 1rjz s ASN 127 Ca 0.42 1.76 0.27 0.00 -1.02 0.00 0.00 52.86 54.29 1rjz s ASN 127 Cb -0.25 -2.53 1.55 0.00 0.02 0.00 0.00 41.25 40.04 1rjz s ASN 127 CO 0.31 -1.01 2.03 -0.33 0.02 0.00 0.00 177.10 178.13 1rjz h GLU 128 N 0.60 0.00 0.00 -0.60 5.08 -1.91 0.24 114.58 117.99 1rjz h GLU 128 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1rjz h GLU 128 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1rjz h GLU 128 CO 0.58 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.19 1rjz n ASP 129 N -3.93 0.00 -3.81 1.42 5.68 -1.26 -4.85 116.55 109.80 1rjz n ASP 129 Ca 0.05 0.13 -0.30 0.00 -0.50 0.00 0.00 54.79 54.17 1rjz n ASP 129 Cb 0.45 -0.29 0.01 0.00 -1.14 0.00 0.00 41.12 40.16 1rjz n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1rjz n LEU 130 N -1.29 -2.21 0.00 -2.12 4.77 0.85 -4.76 117.00 112.25 1rjz n LEU 130 Ca 0.05 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1rjz n LEU 130 Cb 0.09 -2.41 0.00 0.00 -2.33 0.00 0.00 43.42 38.77 1rjz n LEU 130 CO 0.09 0.36 0.00 0.29 -1.33 0.00 0.00 177.39 176.80 1rjz n LYS 131 N -4.41 0.00 -4.43 3.23 5.02 -1.26 -4.68 118.16 111.63 1rjz n LYS 131 Ca 0.03 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.08 1rjz n LYS 131 Cb 0.53 -0.37 -0.11 0.00 -0.02 0.00 0.00 35.03 35.06 1rjz n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1rjz s THR 132 N -1.00 2.30 0.23 -0.18 -4.23 -1.26 -4.73 115.64 106.77 1rjz s THR 132 Ca 0.00 -2.23 0.08 0.00 -1.18 0.00 0.00 61.69 58.36 1rjz s THR 132 Cb 0.00 -2.18 -0.04 0.00 1.34 0.00 0.00 72.50 71.62 1rjz s THR 132 CO 0.00 -0.33 0.03 0.26 -0.54 0.00 0.00 174.62 174.04 1rjz s TRP 133 N -2.26 2.82 -0.54 3.99 0.52 -1.26 -0.95 118.94 121.26 1rjz s TRP 133 Ca 0.25 -0.17 0.03 0.00 0.02 0.00 0.00 56.10 56.23 1rjz s TRP 133 Cb -0.06 -1.30 0.14 0.00 -1.15 0.00 0.00 33.47 31.10 1rjz s TRP 133 CO 0.12 0.56 0.29 0.99 0.02 0.00 0.00 176.95 178.93 1rjz s THR 134 N -2.06 2.75 0.06 2.01 2.01 -0.65 -4.92 115.64 114.85 1rjz s THR 134 Ca 0.30 -3.30 -0.31 0.00 0.31 0.00 0.00 61.69 58.69 1rjz s THR 134 Cb -0.08 -2.89 -0.06 0.00 0.01 0.00 0.00 72.50 69.48 1rjz s THR 134 CO 0.20 -0.81 1.33 0.00 -0.69 0.00 0.00 174.62 174.65 1rjz s ALA 135 N -0.29 3.53 -0.04 7.40 0.00 -1.26 -3.37 121.76 127.72 1rjz s ALA 135 Ca 0.17 0.96 0.22 0.00 0.00 0.00 0.00 51.96 53.31 1rjz s ALA 135 Cb -0.25 -3.52 0.59 0.00 0.00 0.00 0.00 23.12 19.94 1rjz s ALA 135 CO -0.01 -0.64 1.68 0.00 0.00 0.00 0.00 175.76 176.79 1rjz h ALA 136 N 7.09 0.91 -2.19 0.00 0.00 -0.70 -3.47 119.26 120.91 1rjz h ALA 136 Ca -0.41 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.28 1rjz h ALA 136 Cb 1.20 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1rjz h ALA 136 CO 0.86 0.34 0.14 -0.40 0.00 0.00 0.00 179.25 180.19 1rjz n ASP 137 N -3.28 -0.74 -0.31 0.00 3.85 -1.26 -5.02 116.55 109.79 1rjz n ASP 137 Ca 0.01 -1.47 0.09 0.00 -0.71 0.00 0.00 54.79 52.71 1rjz n ASP 137 Cb 0.53 1.22 0.25 0.00 -1.35 0.00 0.00 41.12 41.78 1rjz n ASP 137 CO 0.00 0.00 0.00 0.24 -1.01 0.00 0.00 177.20 176.43 1rjz h MET 138 N 0.00 0.62 0.42 0.11 2.86 -1.99 -2.10 114.93 114.86 1rjz h MET 138 Ca -0.11 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 1rjz h MET 138 Cb 0.43 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1rjz h MET 138 CO 0.14 0.41 -0.20 0.00 1.06 0.00 0.00 176.91 178.32 1rjz h ALA 139 N 1.59 -0.57 -0.90 6.32 0.00 -1.96 -2.96 119.26 120.78 1rjz h ALA 139 Ca 0.50 -0.17 0.23 0.00 0.00 0.00 0.00 54.91 55.47 1rjz h ALA 139 Cb 0.74 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 1rjz h ALA 139 CO -0.38 -0.72 0.61 0.00 0.00 0.00 0.00 179.25 178.76 1rjz h ALA 140 N -0.29 2.49 -0.49 0.00 0.00 -1.73 -0.36 119.26 118.90 1rjz h ALA 140 Ca -0.06 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1rjz h ALA 140 Cb 0.53 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1rjz h ALA 140 CO 0.10 -0.77 0.32 -0.07 0.00 0.00 0.00 179.25 178.83 1rjz h LEU 141 N 0.22 0.55 -0.50 0.00 3.38 -1.22 0.13 115.31 117.87 1rjz h LEU 141 Ca 0.45 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.35 1rjz h LEU 141 Cb 1.42 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1rjz h LEU 141 CO -0.11 0.40 0.07 0.40 0.09 0.00 0.00 178.44 179.28 1rjz h ILE 142 N 0.65 1.25 -0.57 1.22 2.04 -1.11 -0.41 117.51 120.58 1rjz h ILE 142 Ca 0.18 -0.96 -0.10 0.00 1.00 0.00 0.00 64.86 64.98 1rjz h ILE 142 Cb -0.06 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1rjz h ILE 142 CO -0.04 0.34 -0.02 0.74 0.00 0.00 0.00 178.15 179.17 1rjz h THR 143 N 0.71 1.27 -0.65 -0.27 2.02 -1.38 -2.49 112.91 112.11 1rjz h THR 143 Ca 0.15 -1.16 0.06 0.00 0.77 0.00 0.00 66.41 66.23 1rjz h THR 143 Cb 0.42 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.65 1rjz h THR 143 CO 0.01 0.42 0.35 0.50 0.37 0.00 0.00 175.52 177.17 1rjz h LYS 144 N 0.91 0.63 -0.12 6.66 3.64 -0.21 0.28 116.57 128.35 1rjz h LYS 144 Ca 0.16 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.34 1rjz h LYS 144 Cb 0.58 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1rjz h LYS 144 CO 0.03 0.42 -0.62 0.45 -2.27 0.00 0.00 179.45 177.46 1rjz h HIS 145 N 0.65 0.56 -0.23 1.91 3.86 -1.01 -1.75 115.15 119.13 1rjz h HIS 145 Ca 0.29 -0.22 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1rjz h HIS 145 Cb 0.19 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 1rjz h HIS 145 CO -0.09 0.94 0.13 0.87 0.86 0.00 0.00 177.93 180.64 1rjz h LYS 146 N 0.32 0.32 0.00 2.45 1.57 -0.84 -1.79 116.57 118.60 1rjz h LYS 146 Ca -0.01 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 1rjz h LYS 146 Cb 1.17 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1rjz h LYS 146 CO 0.11 0.29 -0.31 -1.49 -0.57 0.00 0.00 179.45 177.48 1rjz h TRP 147 N 0.27 0.00 -0.24 -1.35 6.55 -0.43 -0.87 115.95 119.88 1rjz h TRP 147 Ca 0.08 0.00 -0.15 0.00 0.95 0.00 0.00 58.89 59.77 1rjz h TRP 147 Cb 0.05 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.35 1rjz h TRP 147 CO -0.04 0.31 -0.45 0.93 -1.05 0.00 0.00 178.44 178.14 1rjz h GLU 148 N 0.00 0.73 0.52 0.49 5.08 -1.11 0.21 114.58 120.50 1rjz h GLU 148 Ca -0.00 -0.46 -0.03 0.00 -1.00 0.00 0.00 59.36 57.87 1rjz h GLU 148 Cb 0.86 0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.17 1rjz h GLU 148 CO 0.04 1.09 -0.25 1.96 -1.00 0.00 0.00 179.01 180.85 1rjz h GLN 149 N 0.46 -0.67 0.00 2.33 1.08 -1.11 -2.78 115.11 114.42 1rjz h GLN 149 Ca 0.01 0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1rjz h GLN 149 Cb 1.05 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 1rjz h GLN 149 CO 0.10 -0.40 0.00 0.00 -0.95 0.00 0.00 178.83 177.58 1rjz h ALA 150 N -0.36 1.00 -1.56 3.87 0.00 -1.21 -3.46 119.26 117.54 1rjz h ALA 150 Ca -0.07 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1rjz h ALA 150 Cb 0.58 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.38 1rjz h ALA 150 CO 0.12 0.00 -0.07 0.41 0.00 0.00 0.00 179.25 179.71 1rjz n GLY 151 N -0.36 0.77 0.25 0.00 0.00 -0.21 -4.96 105.19 100.67 1rjz n GLY 151 Ca -0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 46.02 45.38 1rjz n GLY 151 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1rjz h GLU 152 N -0.27 0.81 -1.10 1.61 4.57 -0.93 -2.45 114.58 116.81 1rjz h GLU 152 Ca -0.06 -0.09 0.30 0.00 -1.18 0.00 0.00 59.36 58.33 1rjz h GLU 152 Cb 1.04 -0.16 -0.10 0.00 -0.16 0.00 0.00 28.75 29.37 1rjz h GLU 152 CO 0.06 0.62 0.72 0.00 -1.18 0.00 0.00 179.01 179.22 1rjz h ALA 153 N 1.15 2.39 -0.01 2.92 0.00 -1.85 -0.25 119.26 123.61 1rjz h ALA 153 Ca 0.20 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 1rjz h ALA 153 Cb 0.04 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1rjz h ALA 153 CO -0.03 -0.84 -0.22 0.93 0.00 0.00 0.00 179.25 179.09 1rjz h GLU 154 N 0.30 0.17 -0.99 0.00 3.07 -1.72 -1.56 114.58 113.86 1rjz h GLU 154 Ca 0.64 -0.17 0.16 0.00 -0.50 0.00 0.00 59.36 59.48 1rjz h GLU 154 Cb 1.77 0.04 -0.09 0.00 -0.84 0.00 0.00 28.75 29.63 1rjz h GLU 154 CO -0.30 0.89 0.62 -0.09 -1.40 0.00 0.00 179.01 178.72 1rjz h ARG 155 N -0.48 0.81 0.07 2.33 2.43 -0.90 0.60 114.38 119.25 1rjz h ARG 155 Ca -0.02 -0.05 -0.24 0.00 -0.81 0.00 0.00 59.98 58.86 1rjz h ARG 155 Cb 0.96 -0.18 0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1rjz h ARG 155 CO 0.04 0.54 -0.98 -0.07 -1.51 0.00 0.00 179.97 177.99 1rjz h LEU 156 N 0.84 0.74 -1.03 3.80 3.38 -1.32 -2.36 115.31 119.36 1rjz h LEU 156 Ca 0.52 -0.81 0.15 0.00 0.09 0.00 0.00 57.88 57.84 1rjz h LEU 156 Cb 0.72 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.15 1rjz h LEU 156 CO -0.30 1.47 0.62 -0.09 0.09 0.00 0.00 178.44 180.23 1rjz h ARG 157 N 0.11 0.86 0.16 1.13 2.43 -0.27 0.61 114.38 119.40 1rjz h ARG 157 Ca -0.14 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 1rjz h ARG 157 Cb 1.68 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 31.04 1rjz h ARG 157 CO 0.19 0.57 -0.08 0.00 -1.51 0.00 0.00 179.97 179.14 1rjz h ALA 158 N 1.59 -0.22 0.03 2.80 0.00 -0.86 -1.61 119.26 121.00 1rjz h ALA 158 Ca 0.53 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.33 1rjz h ALA 158 Cb 0.68 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1rjz h ALA 158 CO -0.31 -0.53 -0.09 -0.92 0.00 0.00 0.00 179.25 177.40 1rjz h TYR 159 N -0.40 -0.23 -0.63 0.00 3.20 -0.57 -1.39 116.97 116.95 1rjz h TYR 159 Ca -0.02 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.91 1rjz h TYR 159 Cb 0.32 0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.63 1rjz h TYR 159 CO -0.01 -0.14 0.34 -0.07 -1.64 0.00 0.00 178.16 176.64 1rjz h LEU 160 N -0.17 0.50 -0.07 2.82 3.38 0.16 0.26 115.31 122.18 1rjz h LEU 160 Ca 0.02 0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 1rjz h LEU 160 Cb 0.20 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1rjz h LEU 160 CO -0.07 0.33 -0.65 -0.33 0.09 0.00 0.00 178.44 177.81 1rjz h GLU 161 N 0.64 0.00 0.00 1.13 5.08 -1.18 -3.31 114.58 116.94 1rjz h GLU 161 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1rjz h GLU 161 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1rjz h GLU 161 CO -0.18 0.65 0.00 0.41 -1.00 0.00 0.00 179.01 178.89 1rjz n GLY 162 N 1.19 0.62 0.15 -3.84 0.00 -0.53 -4.63 105.19 98.15 1rjz n GLY 162 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 1rjz n GLY 162 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rjz n THR 163 N 0.00 -0.20 0.04 2.61 -1.04 -1.16 -0.21 114.28 114.32 1rjz n THR 163 Ca 0.00 0.90 -0.02 0.00 -2.04 0.00 0.00 64.05 62.88 1rjz n THR 163 Cb 0.00 -1.19 -0.01 0.00 -1.82 0.00 0.00 70.33 67.31 1rjz n THR 163 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rjz h VAL 165 N -0.13 0.23 -0.59 0.00 2.07 -0.82 0.10 116.25 117.13 1rjz h VAL 165 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.62 1rjz h VAL 165 Cb 0.11 0.23 -0.11 0.00 -1.52 0.00 0.00 31.29 30.00 1rjz h VAL 165 CO -0.01 0.00 -0.29 -0.33 0.02 0.00 0.00 177.57 176.96 1rjz h GLU 166 N -0.21 -0.13 -0.17 1.57 5.08 -0.49 0.30 114.58 120.54 1rjz h GLU 166 Ca 0.20 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1rjz h GLU 166 Cb 0.53 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1rjz h GLU 166 CO -0.58 -0.08 -0.19 -1.49 -1.00 0.00 0.00 179.01 175.67 1rjz h TRP 167 N -0.13 0.31 0.06 4.33 4.06 0.30 -1.83 115.95 123.05 1rjz h TRP 167 Ca 0.25 -0.05 0.01 0.00 2.06 0.00 0.00 58.89 61.16 1rjz h TRP 167 Cb 0.53 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 1rjz h TRP 167 CO -0.60 0.47 -0.09 1.25 -3.56 0.00 0.00 178.44 175.91 1rjz h LEU 168 N 0.27 -0.23 -0.73 -4.49 5.85 0.20 0.17 115.31 116.33 1rjz h LEU 168 Ca 0.05 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.89 1rjz h LEU 168 Cb 0.49 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.54 1rjz h LEU 168 CO 0.03 -0.13 0.38 0.03 -0.34 0.00 0.00 178.44 178.40 1rjz h ARG 169 N -0.18 0.62 -0.82 1.25 3.08 -0.74 -0.12 114.38 117.47 1rjz h ARG 169 Ca 0.01 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1rjz h ARG 169 Cb 0.19 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 1rjz h ARG 169 CO -0.04 0.41 0.42 -0.09 -1.07 0.00 0.00 179.97 179.59 1rjz h ARG 170 N 0.64 1.16 -0.04 0.04 2.43 -0.47 -1.96 114.38 116.18 1rjz h ARG 170 Ca 0.36 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1rjz h ARG 170 Cb 0.37 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1rjz h ARG 170 CO -0.26 0.87 -0.04 1.88 -1.51 0.00 0.00 179.97 180.91 1rjz h TYR 171 N 1.15 0.11 -0.07 2.20 0.05 0.18 -3.29 116.97 117.30 1rjz h TYR 171 Ca 0.28 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 59.07 1rjz h TYR 171 Cb 0.07 -0.02 -0.06 0.00 1.01 0.00 0.00 36.73 37.73 1rjz h TYR 171 CO 0.01 0.57 -0.42 -0.07 -1.05 0.00 0.00 178.16 177.20 1rjz h LEU 172 N -0.38 -1.29 -1.58 3.88 3.38 -0.97 -1.43 115.31 116.92 1rjz h LEU 172 Ca 0.00 0.16 0.49 0.00 0.09 0.00 0.00 57.88 58.63 1rjz h LEU 172 Cb 0.55 0.51 -0.09 0.00 0.09 0.00 0.00 40.66 41.73 1rjz h LEU 172 CO 0.01 -0.44 1.10 0.29 0.09 0.00 0.00 178.44 179.49 1rjz n LYS 173 N -5.44 -0.01 -0.19 1.13 5.02 -0.74 0.18 118.16 118.11 1rjz n LYS 173 Ca -0.05 1.05 0.07 0.00 -2.02 0.00 0.00 58.31 57.36 1rjz n LYS 173 Cb 0.36 -2.26 0.17 0.00 -0.02 0.00 0.00 35.03 33.28 1rjz n LYS 173 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1rjz n ASN 174 N -4.06 3.00 0.00 4.39 4.13 -0.58 -4.56 115.26 117.58 1rjz n ASN 174 Ca 0.39 -1.94 0.00 0.00 1.68 0.00 0.00 54.58 54.71 1rjz n ASN 174 Cb 1.67 -0.25 0.00 0.00 -1.54 0.00 0.00 39.78 39.67 1rjz n ASN 174 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rjz n GLY 175 N 0.75 0.88 0.46 7.41 0.00 0.49 -4.77 105.19 110.41 1rjz n GLY 175 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 1rjz n GLY 175 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1rjz h ASN 176 N 0.00 -1.81 -0.93 1.61 2.35 -0.75 0.79 115.58 116.84 1rjz h ASN 176 Ca 0.00 0.23 0.13 0.00 -0.55 0.00 0.00 56.30 56.11 1rjz h ASN 176 Cb 0.06 0.73 -0.14 0.00 0.05 0.00 0.00 38.32 39.02 1rjz h ASN 176 CO 0.00 -0.43 -0.44 0.00 -1.65 0.00 0.00 177.43 174.91 1rjz h ALA 177 N -0.10 -0.08 0.34 -0.83 0.00 -1.90 0.12 119.26 116.81 1rjz h ALA 177 Ca 0.06 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1rjz h ALA 177 Cb 0.62 1.09 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1rjz h ALA 177 CO -0.55 -0.73 -0.16 1.15 0.00 0.00 0.00 179.25 178.95 1rjz h THR 178 N -0.03 0.65 -0.84 0.00 2.02 -1.44 -3.19 112.91 110.07 1rjz h THR 178 Ca 0.28 -0.48 0.12 0.00 0.77 0.00 0.00 66.41 67.10 1rjz h THR 178 Cb 0.55 0.89 -0.06 0.00 -1.74 0.00 0.00 68.15 67.79 1rjz h THR 178 CO -0.93 0.09 0.55 -0.07 0.37 0.00 0.00 175.52 175.53 1rjz h LEU 179 N -0.74 0.64 0.00 2.58 3.38 0.12 0.04 115.31 121.34 1rjz h LEU 179 Ca -0.05 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1rjz h LEU 179 Cb 0.50 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1rjz h LEU 179 CO 0.08 0.35 0.00 0.18 0.09 0.00 0.00 178.44 179.14 1rjz n LEU 180 N -4.53 0.00 -4.29 1.67 4.77 0.36 -4.89 117.00 110.09 1rjz n LEU 180 Ca 0.15 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.79 1rjz n LEU 180 Cb 0.41 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.58 1rjz n LEU 180 CO 0.31 0.00 -0.46 -1.14 -1.33 0.00 0.00 177.39 174.77 1rjz n ARG 181 N -0.99 -0.12 -3.66 3.23 0.63 -0.00 -5.02 116.66 110.73 1rjz n ARG 181 Ca 0.21 -0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 57.06 1rjz n ARG 181 Cb 0.10 -1.57 -0.08 0.00 0.45 0.00 0.00 32.46 31.36 1rjz n ARG 181 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 1rjz s THR 182 N -2.20 -0.25 -0.27 5.15 -1.32 -1.26 -4.68 115.64 110.80 1rjz s THR 182 Ca 0.53 0.05 0.02 0.00 -1.21 0.00 0.00 61.69 61.08 1rjz s THR 182 Cb -0.23 -0.84 0.07 0.00 -1.51 0.00 0.00 72.50 69.99 1rjz s THR 182 CO 0.71 0.02 -0.04 -1.81 -2.21 0.00 0.00 174.62 171.28 1rjz s ASP 183 N 1.89 4.30 0.60 8.08 1.01 0.26 -4.95 116.67 127.86 1rjz s ASP 183 Ca -0.08 -1.50 -0.19 0.00 0.71 0.00 0.00 52.55 51.48 1rjz s ASP 183 Cb -0.08 -1.40 -0.03 0.00 1.01 0.00 0.00 42.92 42.42 1rjz s ASP 183 CO -0.17 -0.26 1.28 -0.44 0.21 0.00 0.00 175.17 175.80 1rjz s SER 184 N 1.19 4.98 0.52 0.27 0.01 -1.26 -0.22 113.70 119.18 1rjz s SER 184 Ca -0.03 2.59 -0.14 0.00 1.31 0.00 0.00 55.95 59.69 1rjz s SER 184 Cb -0.19 -2.62 -0.06 0.00 0.21 0.00 0.00 66.02 63.36 1rjz s SER 184 CO -0.07 -1.75 0.95 -2.16 0.41 0.00 0.00 173.24 170.61 1rjz s PRO 185 N -3.22 3.82 -0.24 12.44 0.04 -1.26 -4.45 135.00 142.12 1rjz s PRO 185 Ca 0.78 0.78 0.02 0.00 0.04 0.00 0.00 61.00 62.62 1rjz s PRO 185 Cb -0.36 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.05 1rjz s PRO 185 CO 0.40 -0.29 -0.13 0.15 0.04 0.00 0.00 177.00 177.17 1rjz s LYS 186 N -4.32 2.44 0.22 4.56 1.02 -1.04 -4.87 119.74 117.74 1rjz s LYS 186 Ca 0.56 -1.21 0.06 0.00 0.02 0.00 0.00 55.97 55.39 1rjz s LYS 186 Cb -0.10 -2.82 -0.04 0.00 -0.52 0.00 0.00 37.83 34.35 1rjz s LYS 186 CO 0.37 -0.48 0.20 0.00 -0.92 0.00 0.00 175.35 174.53 1rjz s ALA 187 N 1.15 3.65 0.20 5.17 0.00 -1.24 -1.53 121.76 129.16 1rjz s ALA 187 Ca -0.05 -1.31 -0.21 0.00 0.00 0.00 0.00 51.96 50.38 1rjz s ALA 187 Cb -0.18 -1.40 0.05 0.00 0.00 0.00 0.00 23.12 21.58 1rjz s ALA 187 CO -0.07 0.35 0.62 -3.38 0.00 0.00 0.00 175.76 173.28 1rjz s HIS 188 N -1.97 -0.37 -0.10 0.00 -3.43 -0.41 -4.97 115.29 104.04 1rjz s HIS 188 Ca 0.32 0.06 0.02 0.00 -0.80 0.00 0.00 55.06 54.67 1rjz s HIS 188 Cb -0.09 0.57 -0.01 0.00 -1.43 0.00 0.00 32.58 31.62 1rjz s HIS 188 CO 0.25 -0.97 -0.18 0.08 -2.00 0.00 0.00 174.74 171.92 1rjz s VAL 189 N -3.82 2.64 0.21 -5.38 1.01 -1.26 -0.27 120.40 113.53 1rjz s VAL 189 Ca 0.05 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.27 1rjz s VAL 189 Cb -0.02 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1rjz s VAL 189 CO -0.06 0.55 0.13 0.42 0.00 0.00 0.00 175.10 176.14 1rjz s THR 190 N 0.16 4.26 -0.09 3.92 -4.23 0.49 -4.68 115.64 115.47 1rjz s THR 190 Ca -0.10 -1.35 0.05 0.00 -1.18 0.00 0.00 61.69 59.11 1rjz s THR 190 Cb -0.16 -3.24 -0.00 0.00 1.34 0.00 0.00 72.50 70.44 1rjz s THR 190 CO 0.06 -0.24 -0.24 -2.28 -0.54 0.00 0.00 174.62 171.38 1rjz s HIS 191 N -1.97 2.52 -0.06 3.99 2.46 -1.26 -2.32 115.29 118.65 1rjz s HIS 191 Ca 0.31 -0.94 -0.02 0.00 0.47 0.00 0.00 55.06 54.88 1rjz s HIS 191 Cb -0.09 -1.67 0.03 0.00 -0.13 0.00 0.00 32.58 30.72 1rjz s HIS 191 CO 0.23 -0.36 0.04 -1.01 -2.47 0.00 0.00 174.74 171.17 1rjz s HIS 192 N 0.18 0.31 0.04 3.88 3.76 -0.77 -4.99 115.29 117.70 1rjz s HIS 192 Ca -0.14 0.06 -0.30 0.00 -0.15 0.00 0.00 55.06 54.52 1rjz s HIS 192 Cb -0.17 -0.62 -0.04 0.00 1.11 0.00 0.00 32.58 32.86 1rjz s HIS 192 CO 0.07 -0.26 1.08 -1.12 -0.85 0.00 0.00 174.74 173.66 1rjz s SER 193 N 2.09 7.24 0.37 1.40 0.01 -1.26 0.56 113.70 124.11 1rjz s SER 193 Ca 0.05 1.83 0.07 0.00 1.31 0.00 0.00 55.95 59.22 1rjz s SER 193 Cb -0.12 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.52 1rjz s SER 193 CO -0.04 -0.34 0.43 -0.13 0.41 0.00 0.00 173.24 173.56 1rjz s ARG 194 N 0.95 2.81 0.40 12.44 0.52 -1.04 -4.91 118.95 130.12 1rjz s ARG 194 Ca 0.55 -1.26 -0.26 0.00 -0.52 0.00 0.00 55.73 54.24 1rjz s ARG 194 Cb -0.25 -2.62 -0.11 0.00 0.52 0.00 0.00 34.95 32.50 1rjz s ARG 194 CO 0.29 -0.07 1.21 -0.35 0.02 0.00 0.00 175.30 176.40 1rjz n PRO 195 N -1.60 1.82 0.00 3.54 -0.04 -1.26 -4.25 135.00 133.21 1rjz n PRO 195 Ca 0.02 0.64 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 1rjz n PRO 195 Cb 0.60 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 1rjz n PRO 195 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1rjz n GLU 196 N 0.18 0.00 -0.72 0.54 4.07 -1.26 -3.79 120.64 119.66 1rjz n GLU 196 Ca 0.07 0.00 0.08 0.00 -0.06 0.00 0.00 57.16 57.25 1rjz n GLU 196 Cb 0.39 0.00 0.37 0.00 -0.06 0.00 0.00 31.44 32.13 1rjz n GLU 196 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1rjz n ASP 197 N 3.61 5.09 -4.89 4.31 5.75 -1.26 -4.99 116.55 124.16 1rjz n ASP 197 Ca 0.00 -2.73 -0.21 0.00 -0.01 0.00 0.00 54.79 51.84 1rjz n ASP 197 Cb 0.00 -0.62 0.06 0.00 -1.03 0.00 0.00 41.12 39.54 1rjz n ASP 197 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1rjz s LYS 198 N -2.37 2.23 0.02 0.11 -0.14 -1.25 -0.88 119.74 117.46 1rjz s LYS 198 Ca 0.51 -1.17 -0.19 0.00 -1.36 0.00 0.00 55.97 53.76 1rjz s LYS 198 Cb 0.37 -2.51 0.04 0.00 -1.68 0.00 0.00 37.83 34.04 1rjz s LYS 198 CO 0.19 -0.93 0.42 0.14 -0.76 0.00 0.00 175.35 174.40 1rjz s VAL 199 N -2.81 0.05 -0.10 3.17 -7.23 -0.52 -2.50 120.40 110.48 1rjz s VAL 199 Ca 0.61 -0.40 -0.00 0.00 -1.81 0.00 0.00 61.98 60.38 1rjz s VAL 199 Cb -0.07 -0.87 -0.03 0.00 0.56 0.00 0.00 36.38 35.97 1rjz s VAL 199 CO 0.40 -0.22 -0.08 -0.89 -0.31 0.00 0.00 175.10 174.00 1rjz s THR 200 N -2.01 3.57 -0.35 5.32 2.01 0.19 -1.40 115.64 122.98 1rjz s THR 200 Ca -0.08 -0.51 -0.01 0.00 0.31 0.00 0.00 61.69 61.40 1rjz s THR 200 Cb -0.02 -2.49 0.08 0.00 0.01 0.00 0.00 72.50 70.09 1rjz s THR 200 CO 0.01 0.56 0.08 -0.76 -0.69 0.00 0.00 174.62 173.83 1rjz s LEU 201 N -0.35 4.57 -0.24 4.42 1.43 -0.56 -1.84 118.68 126.12 1rjz s LEU 201 Ca 0.05 -1.74 -0.09 0.00 -1.03 0.00 0.00 54.13 51.32 1rjz s LEU 201 Cb -0.12 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 1rjz s LEU 201 CO 0.02 -0.39 0.13 -0.60 0.23 0.00 0.00 176.35 175.74 1rjz s ARG 202 N 1.14 3.95 -0.26 1.70 3.52 -0.98 -2.53 118.95 125.48 1rjz s ARG 202 Ca 0.03 -0.33 -0.11 0.00 -0.13 0.00 0.00 55.73 55.18 1rjz s ARG 202 Cb -0.21 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.67 1rjz s ARG 202 CO -0.04 0.01 0.20 0.00 -0.81 0.00 0.00 175.30 174.65 1rjz s TRP 204 N 1.52 3.10 -0.16 0.00 0.52 0.62 -2.12 118.94 122.42 1rjz s TRP 204 Ca 0.08 0.01 0.01 0.00 0.02 0.00 0.00 56.10 56.22 1rjz s TRP 204 Cb -0.15 -1.86 0.02 0.00 -1.15 0.00 0.00 33.47 30.33 1rjz s TRP 204 CO 0.09 0.27 -0.18 0.00 0.02 0.00 0.00 176.95 177.14 1rjz s ALA 205 N -0.37 2.14 0.19 0.98 0.00 -0.41 -1.28 121.76 123.00 1rjz s ALA 205 Ca 0.07 -1.08 0.10 0.00 0.00 0.00 0.00 51.96 51.05 1rjz s ALA 205 Cb -0.12 -1.10 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 1rjz s ALA 205 CO 0.02 -0.31 -0.20 -0.51 0.00 0.00 0.00 175.76 174.76 1rjz s LEU 206 N 1.28 2.46 -1.41 0.00 1.43 -0.58 -2.61 118.68 119.25 1rjz s LEU 206 Ca 0.03 -0.89 -0.05 0.00 -1.03 0.00 0.00 54.13 52.18 1rjz s LEU 206 Cb -0.13 -0.98 0.00 0.00 0.03 0.00 0.00 46.19 45.11 1rjz s LEU 206 CO -0.10 0.03 0.35 0.61 0.23 0.00 0.00 176.35 177.47 1rjz n GLY 207 N 0.14 -0.32 3.69 -3.19 0.00 -1.04 -2.50 105.19 101.96 1rjz n GLY 207 Ca -0.12 0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 1rjz n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1rjz s PHE 208 N -4.00 2.90 -0.24 1.61 -0.12 -1.11 -4.54 117.98 112.48 1rjz s PHE 208 Ca 0.09 -0.11 -0.21 0.00 -0.05 0.00 0.00 56.93 56.64 1rjz s PHE 208 Cb -0.04 -1.40 0.06 0.00 -0.63 0.00 0.00 43.02 41.01 1rjz s PHE 208 CO 0.93 0.52 0.63 -0.47 -0.05 0.00 0.00 175.22 176.78 1rjz s TYR 209 N -1.75 -0.71 1.24 3.49 5.04 0.70 -0.91 117.35 124.45 1rjz s TYR 209 Ca 0.28 1.71 -0.21 0.00 -2.44 0.00 0.00 57.07 56.41 1rjz s TYR 209 Cb -0.09 0.25 0.31 0.00 0.35 0.00 0.00 41.96 42.78 1rjz s TYR 209 CO 0.20 -0.34 1.12 -1.25 -1.34 0.00 0.00 175.55 173.93 1rjz s PRO 210 N 0.41 -1.53 0.43 4.97 0.04 -1.26 -0.57 135.00 137.48 1rjz s PRO 210 Ca -0.01 -0.20 0.11 0.00 0.04 0.00 0.00 61.00 60.94 1rjz s PRO 210 Cb -0.04 -1.57 0.98 0.00 0.04 0.00 0.00 34.50 33.90 1rjz s PRO 210 CO -0.00 -3.89 2.03 0.00 0.04 0.00 0.00 177.00 175.18 1rjz h ALA 211 N -2.70 1.88 -1.68 8.56 0.00 -1.94 -3.44 119.26 119.94 1rjz h ALA 211 Ca -0.43 -0.02 -0.68 0.00 0.00 0.00 0.00 54.91 53.79 1rjz h ALA 211 Cb 1.28 -0.11 0.05 0.00 0.00 0.00 0.00 17.79 19.01 1rjz h ALA 211 CO 0.29 0.04 0.47 -0.25 0.00 0.00 0.00 179.25 179.80 1rjz n ASP 212 N -4.48 1.68 -3.56 0.00 8.00 -1.26 -4.93 116.55 112.00 1rjz n ASP 212 Ca 0.06 1.12 -0.06 0.00 0.71 0.00 0.00 54.79 56.61 1rjz n ASP 212 Cb 0.21 -1.19 -0.02 0.00 -0.02 0.00 0.00 41.12 40.10 1rjz n ASP 212 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1rjz s ILE 213 N 0.58 0.00 -0.02 0.53 2.07 -1.26 -4.73 121.20 118.37 1rjz s ILE 213 Ca 0.85 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 60.08 1rjz s ILE 213 Cb -0.95 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 40.65 1rjz s ILE 213 CO 0.47 0.00 0.04 -0.89 -1.91 0.00 0.00 174.94 172.65 1rjz s THR 214 N -2.62 -0.02 0.06 4.00 2.01 -0.97 -5.02 115.64 113.09 1rjz s THR 214 Ca 0.07 0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.19 1rjz s THR 214 Cb -0.01 -0.07 -0.03 0.00 0.01 0.00 0.00 72.50 72.40 1rjz s THR 214 CO -0.06 0.02 -0.18 -0.76 -0.69 0.00 0.00 174.62 172.96 1rjz s LEU 215 N 0.31 2.22 0.06 4.42 1.43 -1.26 -1.06 118.68 124.79 1rjz s LEU 215 Ca -0.02 -0.56 -0.06 0.00 -1.03 0.00 0.00 54.13 52.46 1rjz s LEU 215 Cb -0.04 -0.76 -0.01 0.00 0.03 0.00 0.00 46.19 45.41 1rjz s LEU 215 CO -0.01 0.06 0.12 0.42 0.23 0.00 0.00 176.35 177.16 1rjz s THR 216 N -0.98 0.16 -0.02 5.49 -4.23 -0.46 -4.98 115.64 110.61 1rjz s THR 216 Ca 0.04 -1.29 0.07 0.00 -1.18 0.00 0.00 61.69 59.33 1rjz s THR 216 Cb -0.09 -1.24 -0.02 0.00 1.34 0.00 0.00 72.50 72.49 1rjz s THR 216 CO 0.02 -0.71 -0.23 0.26 -0.54 0.00 0.00 174.62 173.42 1rjz s TRP 217 N -3.47 2.08 0.04 3.99 0.52 -1.26 -1.07 118.94 119.77 1rjz s TRP 217 Ca 0.02 -0.39 0.05 0.00 0.02 0.00 0.00 56.10 55.80 1rjz s TRP 217 Cb 0.04 -1.34 -0.02 0.00 -1.15 0.00 0.00 33.47 31.00 1rjz s TRP 217 CO -0.09 -0.03 -0.15 -0.65 0.02 0.00 0.00 176.95 176.05 1rjz s GLN 218 N -0.55 0.99 -0.44 4.98 -0.21 -0.10 -0.64 119.66 123.69 1rjz s GLN 218 Ca 0.09 -0.80 -0.05 0.00 0.02 0.00 0.00 55.36 54.63 1rjz s GLN 218 Cb -0.09 -1.02 0.12 0.00 1.00 0.00 0.00 33.01 33.02 1rjz s GLN 218 CO -0.01 0.25 0.26 -1.17 -2.12 0.00 0.00 175.29 172.50 1rjz s LEU 219 N -1.18 5.38 -1.26 2.90 2.96 -0.77 -2.01 118.68 124.70 1rjz s LEU 219 Ca 0.02 -2.07 -0.01 0.00 -0.22 0.00 0.00 54.13 51.86 1rjz s LEU 219 Cb -0.08 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.73 1rjz s LEU 219 CO 0.01 -0.57 0.81 0.59 -1.32 0.00 0.00 176.35 175.87 1rjz n ASN 220 N 4.59 -1.67 -2.24 3.68 3.02 -1.06 -3.64 115.26 117.93 1rjz n ASN 220 Ca -0.03 -0.75 -0.07 0.00 -0.03 0.00 0.00 54.58 53.70 1rjz n ASN 220 Cb 0.41 -4.44 0.03 0.00 -0.61 0.00 0.00 39.78 35.17 1rjz n ASN 220 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rjz n GLY 221 N -1.42 0.01 3.60 7.41 0.00 -1.26 -5.08 105.19 108.45 1rjz n GLY 221 Ca -0.29 0.04 -0.01 0.00 0.00 0.00 0.00 46.02 45.76 1rjz n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rjz s GLU 222 N -3.83 0.53 -0.40 1.61 2.02 -1.24 -5.11 118.70 112.28 1rjz s GLU 222 Ca 0.16 1.27 -0.27 0.00 0.02 0.00 0.00 54.97 56.15 1rjz s GLU 222 Cb -0.02 0.70 -0.04 0.00 0.10 0.00 0.00 34.13 34.87 1rjz s GLU 222 CO 0.33 -0.17 2.03 -1.21 0.02 0.00 0.00 175.26 176.26 1rjz s GLU 223 N 2.64 2.87 -1.21 1.61 2.02 -1.26 -1.85 118.70 123.52 1rjz s GLU 223 Ca -0.06 1.38 -0.11 0.00 0.02 0.00 0.00 54.97 56.21 1rjz s GLU 223 Cb -0.10 -4.36 -0.07 0.00 0.10 0.00 0.00 34.13 29.71 1rjz s GLU 223 CO -0.19 -2.41 2.39 1.28 0.02 0.00 0.00 175.26 176.36 1rjz n LEU 224 N 12.34 6.40 0.00 1.80 4.77 0.18 -4.68 117.00 137.81 1rjz n LEU 224 Ca 0.27 -3.57 0.03 0.00 -0.03 0.00 0.00 56.01 52.71 1rjz n LEU 224 Cb 0.49 -1.33 0.19 0.00 -2.33 0.00 0.00 43.42 40.43 1rjz n LEU 224 CO 0.69 1.05 0.55 -0.38 -1.33 0.00 0.00 177.39 177.97 1rjz n ILE 225 N 4.37 0.00 -0.09 -0.08 5.41 -1.26 -3.74 119.36 123.96 1rjz n ILE 225 Ca 0.58 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 64.10 1rjz n ILE 225 Cb 0.24 -0.19 -0.12 0.00 -0.71 0.00 0.00 39.64 38.86 1rjz n ILE 225 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1rjz n GLN 226 N -0.61 0.61 -0.75 0.38 7.27 -1.26 -4.52 117.38 118.49 1rjz n GLN 226 Ca 0.05 0.45 -0.03 0.00 0.07 0.00 0.00 57.00 57.54 1rjz n GLN 226 Cb 0.02 -1.69 0.22 0.00 2.41 0.00 0.00 30.24 31.20 1rjz n GLN 226 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1rjz n ASP 227 N -4.19 3.15 -4.66 1.69 8.00 -1.25 -4.96 116.55 114.33 1rjz n ASP 227 Ca -0.37 -3.51 -0.38 0.00 0.71 0.00 0.00 54.79 51.25 1rjz n ASP 227 Cb 0.79 -0.64 -0.08 0.00 -0.02 0.00 0.00 41.12 41.18 1rjz n ASP 227 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1rjz s MET 228 N -3.12 4.13 -0.06 -1.24 -2.45 -1.25 -4.43 119.30 110.89 1rjz s MET 228 Ca 0.46 0.13 -0.11 0.00 -1.25 0.00 0.00 55.69 54.91 1rjz s MET 228 Cb 0.40 -3.56 -0.05 0.00 1.25 0.00 0.00 34.83 32.87 1rjz s MET 228 CO 0.04 -0.08 0.28 -2.00 1.05 0.00 0.00 175.02 174.31 1rjz s GLU 229 N 1.44 3.69 -0.02 4.11 2.12 0.90 -4.88 118.70 126.06 1rjz s GLU 229 Ca 0.17 0.15 -0.17 0.00 0.36 0.00 0.00 54.97 55.48 1rjz s GLU 229 Cb -0.15 -3.21 0.03 0.00 0.26 0.00 0.00 34.13 31.06 1rjz s GLU 229 CO 0.08 0.73 0.36 -0.48 -0.54 0.00 0.00 175.26 175.40 1rjz s LEU 230 N -1.03 0.65 0.23 2.70 2.34 -1.26 0.57 118.68 122.89 1rjz s LEU 230 Ca 0.19 0.16 0.04 0.00 0.06 0.00 0.00 54.13 54.59 1rjz s LEU 230 Cb -0.14 1.44 -0.03 0.00 -0.56 0.00 0.00 46.19 46.89 1rjz s LEU 230 CO 0.09 -0.47 0.36 0.68 -1.06 0.00 0.00 176.35 175.94 1rjz s VAL 231 N -1.34 5.26 0.37 1.48 -7.23 -1.19 -5.04 120.40 112.72 1rjz s VAL 231 Ca -0.13 -0.89 -0.26 0.00 -1.81 0.00 0.00 61.98 58.89 1rjz s VAL 231 Cb -0.04 -3.84 -0.09 0.00 0.56 0.00 0.00 36.38 32.97 1rjz s VAL 231 CO 0.05 -0.30 1.09 -1.61 -0.31 0.00 0.00 175.10 174.02 1rjz s GLU 232 N -3.86 4.25 0.07 4.82 2.02 -1.26 -4.61 118.70 120.13 1rjz s GLU 232 Ca 0.35 1.67 -0.36 0.00 0.02 0.00 0.00 54.97 56.65 1rjz s GLU 232 Cb -0.09 -2.74 -0.15 0.00 0.10 0.00 0.00 34.13 31.24 1rjz s GLU 232 CO 0.29 -0.10 1.48 2.41 0.02 0.00 0.00 175.26 179.36 1rjz n THR 233 N 0.29 0.06 -4.21 3.63 -1.04 -1.26 -4.86 114.28 106.88 1rjz n THR 233 Ca 0.03 -0.01 -0.20 0.00 -2.04 0.00 0.00 64.05 61.83 1rjz n THR 233 Cb 0.48 -1.13 -0.12 0.00 -1.82 0.00 0.00 70.33 67.73 1rjz n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rjz s ARG 234 N 1.06 0.92 0.28 -2.82 1.70 -0.47 -4.92 118.95 114.70 1rjz s ARG 234 Ca 0.84 -1.02 -0.29 0.00 -0.47 0.00 0.00 55.73 54.79 1rjz s ARG 234 Cb -0.86 -1.02 -0.10 0.00 -0.57 0.00 0.00 34.95 32.40 1rjz s ARG 234 CO 0.46 0.23 1.11 -1.25 -1.08 0.00 0.00 175.30 174.77 1rjz s PRO 235 N -1.79 4.62 0.11 3.89 0.04 -1.26 0.66 135.00 141.26 1rjz s PRO 235 Ca 0.01 1.82 -0.01 0.00 0.04 0.00 0.00 61.00 62.86 1rjz s PRO 235 Cb -0.10 -3.17 -0.20 0.00 0.04 0.00 0.00 34.50 31.07 1rjz s PRO 235 CO 0.03 0.18 1.23 0.00 0.04 0.00 0.00 177.00 178.48 1rjz h ALA 236 N 3.77 0.25 0.00 8.56 0.00 -1.57 -3.46 119.26 126.80 1rjz h ALA 236 Ca -0.47 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 53.60 1rjz h ALA 236 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1rjz h ALA 236 CO 0.67 0.99 0.00 0.41 0.00 0.00 0.00 179.25 181.32 1rjz n GLY 237 N 1.31 0.89 0.40 0.00 0.00 -1.26 -4.93 105.19 101.60 1rjz n GLY 237 Ca -0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.00 1rjz n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rjz n ASP 238 N 0.00 2.66 0.00 1.61 5.68 -1.26 -4.96 116.55 120.27 1rjz n ASP 238 Ca 0.00 -2.19 0.00 0.00 -0.50 0.00 0.00 54.79 52.10 1rjz n ASP 238 Cb 0.00 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 39.78 1rjz n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rjz n GLY 239 N -0.11 1.49 3.97 6.12 0.00 -1.26 -5.08 105.19 110.32 1rjz n GLY 239 Ca 0.09 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1rjz n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rjz s THR 240 N -1.76 2.11 0.29 2.61 -4.23 -1.26 -4.92 115.64 108.48 1rjz s THR 240 Ca 0.00 -0.40 0.05 0.00 -1.18 0.00 0.00 61.69 60.16 1rjz s THR 240 Cb 0.00 -2.71 -0.06 0.00 1.34 0.00 0.00 72.50 71.07 1rjz s THR 240 CO 0.00 0.00 0.00 -0.36 -0.54 0.00 0.00 174.62 173.72 1rjz s PHE 241 N -3.37 1.89 0.15 3.99 0.40 -0.09 -1.48 117.98 119.48 1rjz s PHE 241 Ca 0.68 -0.85 0.02 0.00 -0.60 0.00 0.00 56.93 56.18 1rjz s PHE 241 Cb -0.05 -1.16 -0.05 0.00 0.51 0.00 0.00 43.02 42.27 1rjz s PHE 241 CO 0.47 0.10 -0.03 -0.65 0.70 0.00 0.00 175.22 175.81 1rjz s GLN 242 N -3.82 1.05 -0.27 0.44 -0.21 0.21 -2.51 119.66 114.54 1rjz s GLN 242 Ca 0.32 -1.48 -0.27 0.00 0.02 0.00 0.00 55.36 53.95 1rjz s GLN 242 Cb 0.06 -0.31 0.17 0.00 1.00 0.00 0.00 33.01 33.93 1rjz s GLN 242 CO 0.13 -0.08 1.29 0.21 -2.12 0.00 0.00 175.29 174.72 1rjz s LYS 243 N -3.87 0.20 0.11 2.91 2.20 -1.07 -1.37 119.74 118.84 1rjz s LYS 243 Ca 0.20 0.13 -0.00 0.00 -0.36 0.00 0.00 55.97 55.94 1rjz s LYS 243 Cb 0.05 0.10 -0.04 0.00 -1.51 0.00 0.00 37.83 36.43 1rjz s LYS 243 CO 0.02 -0.05 0.02 1.67 -0.36 0.00 0.00 175.35 176.65 1rjz s TRP 244 N -0.48 0.81 -0.06 4.03 1.48 -1.26 -1.29 118.94 122.17 1rjz s TRP 244 Ca 0.06 -1.14 -0.10 0.00 -1.06 0.00 0.00 56.10 53.86 1rjz s TRP 244 Cb -0.03 -0.49 0.02 0.00 -1.16 0.00 0.00 33.47 31.82 1rjz s TRP 244 CO -0.09 -0.41 0.26 0.00 -4.06 0.00 0.00 176.95 172.64 1rjz s ALA 245 N -3.93 -0.63 0.06 2.67 0.00 -0.90 -3.15 121.76 115.87 1rjz s ALA 245 Ca 0.18 0.51 -0.06 0.00 0.00 0.00 0.00 51.96 52.59 1rjz s ALA 245 Cb 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1rjz s ALA 245 CO -0.02 -0.17 0.12 -1.54 0.00 0.00 0.00 175.76 174.15 1rjz s SER 246 N -0.45 0.20 0.07 0.00 1.04 0.19 -0.52 113.70 114.23 1rjz s SER 246 Ca -0.06 -0.66 -0.01 0.00 0.48 0.00 0.00 55.95 55.70 1rjz s SER 246 Cb -0.04 0.28 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 1rjz s SER 246 CO 0.01 -0.63 -0.03 0.68 0.98 0.00 0.00 173.24 174.26 1rjz s VAL 247 N -3.40 0.28 -0.26 5.02 -7.23 -1.05 -0.07 120.40 113.69 1rjz s VAL 247 Ca 0.02 -1.84 -0.06 0.00 -1.81 0.00 0.00 61.98 58.29 1rjz s VAL 247 Cb 0.03 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.36 1rjz s VAL 247 CO -0.08 -0.92 0.03 -0.69 -0.31 0.00 0.00 175.10 173.13 1rjz s VAL 248 N -3.89 3.82 0.35 1.32 1.01 -1.26 -1.49 120.40 120.26 1rjz s VAL 248 Ca 0.10 -0.51 0.09 0.00 0.00 0.00 0.00 61.98 61.66 1rjz s VAL 248 Cb 0.08 -2.85 -0.06 0.00 0.00 0.00 0.00 36.38 33.55 1rjz s VAL 248 CO -0.08 0.26 -0.03 0.68 0.00 0.00 0.00 175.10 175.94 1rjz s VAL 249 N 1.52 2.38 0.46 2.92 -7.23 -0.49 -4.93 120.40 115.02 1rjz s VAL 249 Ca 0.04 -2.07 -0.22 0.00 -1.81 0.00 0.00 61.98 57.92 1rjz s VAL 249 Cb -0.16 -2.76 -0.08 0.00 0.56 0.00 0.00 36.38 33.95 1rjz s VAL 249 CO 0.01 -0.17 1.12 -2.84 -0.31 0.00 0.00 175.10 172.91 1rjz s PRO 250 N -3.68 3.80 -0.07 4.82 0.02 -1.26 -1.43 135.00 137.20 1rjz s PRO 250 Ca 0.34 1.66 -0.30 0.00 0.02 0.00 0.00 61.00 62.72 1rjz s PRO 250 Cb 0.02 -2.36 -0.06 0.00 0.02 0.00 0.00 34.50 32.13 1rjz s PRO 250 CO 0.18 -0.49 1.76 -1.17 -0.33 0.00 0.00 177.00 176.95 1rjz s LEU 251 N -3.08 4.21 0.00 -5.54 2.96 -0.06 -2.03 118.68 115.15 1rjz s LEU 251 Ca 0.64 2.21 0.00 0.00 -0.22 0.00 0.00 54.13 56.76 1rjz s LEU 251 Cb -0.25 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 42.91 1rjz s LEU 251 CO 0.31 -1.08 0.00 0.61 -1.32 0.00 0.00 176.35 174.86 1rjz n GLY 252 N 4.43 2.58 1.53 7.98 0.00 -1.26 -4.93 105.19 115.52 1rjz n GLY 252 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 1rjz n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rjz n LYS 253 N -1.00 2.54 0.05 1.61 4.76 -0.86 -4.66 118.16 120.60 1rjz n LYS 253 Ca 0.00 -3.07 0.02 0.00 -2.87 0.00 0.00 58.31 52.39 1rjz n LYS 253 Cb 0.00 -1.99 0.36 0.00 -1.84 0.00 0.00 35.03 31.56 1rjz n LYS 253 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1rjz h GLU 254 N 1.51 0.41 0.00 1.97 3.07 -1.92 -2.44 114.58 117.18 1rjz h GLU 254 Ca 0.28 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1rjz h GLU 254 Cb 2.03 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.88 1rjz h GLU 254 CO 0.59 0.44 0.00 1.04 -1.40 0.00 0.00 179.01 179.69 1rjz n GLN 255 N -4.31 0.70 -0.05 2.33 1.13 -1.26 -2.65 117.38 113.26 1rjz n GLN 255 Ca 0.01 0.01 0.12 0.00 -1.94 0.00 0.00 57.00 55.20 1rjz n GLN 255 Cb 0.22 -1.50 0.44 0.00 0.11 0.00 0.00 30.24 29.51 1rjz n GLN 255 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1rjz n TYR 256 N -1.08 0.14 -4.31 1.08 4.02 -0.92 -4.86 117.16 111.22 1rjz n TYR 256 Ca 0.18 -0.07 -0.25 0.00 -0.01 0.00 0.00 57.90 57.75 1rjz n TYR 256 Cb 0.13 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.32 1rjz n TYR 256 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1rjz s TYR 257 N -1.86 1.90 -0.03 -0.72 1.51 -1.08 -2.56 117.35 114.50 1rjz s TYR 257 Ca 0.34 -0.41 -0.09 0.00 -1.01 0.00 0.00 57.07 55.89 1rjz s TYR 257 Cb 0.18 -1.03 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1rjz s TYR 257 CO 0.28 0.25 0.21 0.95 -1.11 0.00 0.00 175.55 176.13 1rjz s THR 258 N -1.22 0.05 0.09 -0.71 -4.23 -0.85 -4.63 115.64 104.14 1rjz s THR 258 Ca 0.09 -0.41 -0.02 0.00 -1.18 0.00 0.00 61.69 60.17 1rjz s THR 258 Cb -0.10 -0.44 -0.05 0.00 1.34 0.00 0.00 72.50 73.26 1rjz s THR 258 CO 0.05 -0.22 0.28 0.00 -0.54 0.00 0.00 174.62 174.19 1rjz s HIS 260 N -1.56 1.20 -0.19 0.00 3.76 -0.23 -1.33 115.29 116.93 1rjz s HIS 260 Ca 0.37 -0.40 -0.00 0.00 -0.15 0.00 0.00 55.06 54.88 1rjz s HIS 260 Cb -0.13 -0.90 0.01 0.00 1.11 0.00 0.00 32.58 32.67 1rjz s HIS 260 CO 0.26 -0.22 -0.15 0.08 -0.85 0.00 0.00 174.74 173.86 1rjz s VAL 261 N 0.62 2.47 -0.32 -0.90 1.01 -0.40 -1.36 120.40 121.52 1rjz s VAL 261 Ca -0.12 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1rjz s VAL 261 Cb -0.14 -2.06 0.06 0.00 0.00 0.00 0.00 36.38 34.24 1rjz s VAL 261 CO 0.02 0.51 0.04 -0.31 0.00 0.00 0.00 175.10 175.36 1rjz s TYR 262 N 1.27 3.35 0.05 5.22 2.02 -0.23 -0.39 117.35 128.63 1rjz s TYR 262 Ca 0.04 -2.02 0.03 0.00 -0.37 0.00 0.00 57.07 54.75 1rjz s TYR 262 Cb -0.14 -2.37 -0.02 0.00 -0.40 0.00 0.00 41.96 39.03 1rjz s TYR 262 CO -0.09 -0.84 -0.10 -1.58 -1.57 0.00 0.00 175.55 171.37 1rjz s HIS 263 N 1.22 0.89 0.13 2.71 2.46 -1.26 -2.28 115.29 119.16 1rjz s HIS 263 Ca -0.02 -0.43 0.34 0.00 0.47 0.00 0.00 55.06 55.42 1rjz s HIS 263 Cb -0.20 -0.52 1.56 0.00 -0.13 0.00 0.00 32.58 33.29 1rjz s HIS 263 CO -0.02 -0.02 2.02 -0.56 -2.47 0.00 0.00 174.74 173.69 1rjz h GLN 264 N 4.64 0.00 0.00 2.88 3.07 -1.94 -2.14 115.11 121.62 1rjz h GLN 264 Ca -0.37 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.27 1rjz h GLN 264 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.74 1rjz h GLN 264 CO 0.42 0.00 -0.47 0.78 0.09 0.00 0.00 178.83 179.65 1rjz h GLY 265 N 1.45 0.00 -3.83 0.06 0.00 -1.89 -3.45 103.07 95.41 1rjz h GLY 265 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1rjz h GLY 265 CO 0.00 0.00 0.45 1.08 0.00 0.00 0.00 176.54 178.07 1rjz s LEU 266 N -6.96 4.56 0.32 3.11 1.43 -0.81 -4.70 118.68 115.64 1rjz s LEU 266 Ca 0.01 2.19 0.08 0.00 -1.03 0.00 0.00 54.13 55.37 1rjz s LEU 266 Cb 0.10 -3.62 0.55 0.00 0.03 0.00 0.00 46.19 43.26 1rjz s LEU 266 CO 0.71 -0.10 1.76 1.55 0.23 0.00 0.00 176.35 180.51 1rjz h PRO 267 N 4.06 0.23 -2.28 1.29 0.13 -1.88 -3.44 132.00 130.11 1rjz h PRO 267 Ca -0.46 -0.09 -0.07 0.00 -0.87 0.00 0.00 66.00 64.51 1rjz h PRO 267 Cb 1.21 -0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.11 1rjz h PRO 267 CO 0.68 0.54 -0.01 -1.83 -0.23 0.00 0.00 178.00 177.15 1rjz s GLU 268 N -4.30 0.70 0.65 0.86 -1.05 -1.26 -5.16 118.70 109.13 1rjz s GLU 268 Ca -0.05 0.85 -0.13 0.00 -0.15 0.00 0.00 54.97 55.49 1rjz s GLU 268 Cb 0.14 0.33 -0.11 0.00 -0.44 0.00 0.00 34.13 34.05 1rjz s GLU 268 CO 0.76 -0.09 -0.46 -2.30 0.95 0.00 0.00 175.26 174.12 1rjz n PRO 269 N 2.84 0.00 -3.94 -4.83 -0.02 -1.26 -4.95 135.00 122.84 1rjz n PRO 269 Ca -0.14 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.04 1rjz n PRO 269 Cb 0.56 -0.75 -0.04 0.00 -0.02 0.00 0.00 33.50 33.25 1rjz n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1rjz s LEU 270 N 5.36 4.29 -0.10 2.45 1.43 0.47 -4.88 118.68 127.71 1rjz s LEU 270 Ca 0.33 0.21 -0.02 0.00 -1.03 0.00 0.00 54.13 53.62 1rjz s LEU 270 Cb -0.20 -2.89 0.04 0.00 0.03 0.00 0.00 46.19 43.16 1rjz s LEU 270 CO 0.58 0.14 0.02 -0.89 0.23 0.00 0.00 176.35 176.43 1rjz s THR 271 N -1.57 0.32 0.26 5.49 2.01 -1.25 -1.27 115.64 119.63 1rjz s THR 271 Ca 0.34 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.36 1rjz s THR 271 Cb -0.12 -0.59 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 1rjz s THR 271 CO 0.28 0.13 0.10 -0.76 -0.69 0.00 0.00 174.62 173.67 1rjz s LEU 272 N 1.98 1.61 0.25 4.42 1.02 -0.44 -4.94 118.68 122.58 1rjz s LEU 272 Ca 0.04 -1.39 -0.07 0.00 0.02 0.00 0.00 54.13 52.73 1rjz s LEU 272 Cb -0.13 0.05 -0.02 0.00 0.02 0.00 0.00 46.19 46.11 1rjz s LEU 272 CO -0.06 -0.74 0.35 -0.13 0.02 0.00 0.00 176.35 175.79 1rjz s ARG 273 N -4.03 1.49 0.20 1.70 0.52 -1.26 -0.08 118.95 117.49 1rjz s ARG 273 Ca 0.38 -1.48 -0.31 0.00 -0.52 0.00 0.00 55.73 53.79 1rjz s ARG 273 Cb 0.08 0.39 -0.11 0.00 0.52 0.00 0.00 34.95 35.83 1rjz s ARG 273 CO 0.14 -0.58 1.62 -0.46 0.02 0.00 0.00 175.30 176.04 1rjz s TRP 274 N -3.90 2.97 -0.63 -0.53 -0.00 -1.26 -4.65 118.94 110.95 1rjz s TRP 274 Ca 0.30 0.55 0.05 0.00 -0.00 0.00 0.00 56.10 56.99 1rjz s TRP 274 Cb 0.02 -4.02 0.16 0.00 -0.00 0.00 0.00 33.47 29.63 1rjz s TRP 274 CO 0.12 -3.75 0.42 -1.21 -0.00 0.00 0.00 176.95 172.53 1rjz s GLU 275 N 0.92 2.18 0.16 5.86 0.41 -1.26 -4.96 118.70 122.02 1rjz s GLU 275 Ca 0.71 -3.02 -0.32 0.00 -0.41 0.00 0.00 54.97 51.93 1rjz s GLU 275 Cb -0.46 -3.20 -0.10 0.00 -1.78 0.00 0.00 34.13 28.58 1rjz s GLU 275 CO 0.34 -1.25 1.56 -1.25 -0.49 0.00 0.00 175.26 174.17 1rjz s PRO 276 N -0.99 4.22 -0.15 0.39 0.04 -1.26 -4.86 135.00 132.40 1rjz s PRO 276 Ca 0.23 2.34 -0.41 0.00 0.04 0.00 0.00 61.00 63.20 1rjz s PRO 276 Cb -0.10 -3.17 -0.19 0.00 0.04 0.00 0.00 34.50 31.08 1rjz s PRO 276 CO -0.12 -0.60 1.37 -0.35 0.04 0.00 0.00 177.00 177.34 1rjz n PRO 277 N 4.00 0.44 0.00 0.56 -0.04 -1.26 -5.30 135.00 133.40 1rjz n PRO 277 Ca 0.14 0.16 0.06 0.00 -0.04 0.00 0.00 63.50 63.82 1rjz n PRO 277 Cb 0.39 -1.72 0.35 0.00 -0.04 0.00 0.00 33.50 32.47 1rjz n PRO 277 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11