#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d3s s THR 2 N 0.00 0.29 -0.07 3.15 2.01 -1.26 -0.81 115.64 118.95 2d3s s THR 2 Ca 0.00 -0.09 0.01 0.00 0.31 0.00 0.00 61.69 61.92 2d3s s THR 2 Cb 0.00 -0.29 0.02 0.00 0.01 0.00 0.00 72.50 72.24 2d3s s THR 2 CO 0.00 0.11 -0.08 -0.51 -0.69 0.00 0.00 174.62 173.45 2d3s s ILE 3 N 0.30 0.89 -0.04 1.82 1.10 -0.26 -5.01 121.20 120.00 2d3s s ILE 3 Ca -0.03 -0.31 -0.09 0.00 -0.51 0.00 0.00 60.65 59.71 2d3s s ILE 3 Cb -0.06 -0.87 0.02 0.00 0.15 0.00 0.00 42.46 41.70 2d3s s ILE 3 CO -0.01 0.31 0.21 -0.94 -2.11 0.00 0.00 174.94 172.41 2d3s s SER 4 N 0.98 -0.14 -0.03 4.50 1.04 -1.26 -1.05 113.70 117.75 2d3s s SER 4 Ca -0.09 0.15 -0.15 0.00 0.48 0.00 0.00 55.95 56.34 2d3s s SER 4 Cb -0.15 0.35 0.03 0.00 0.10 0.00 0.00 66.02 66.35 2d3s s SER 4 CO 0.00 -0.25 0.33 0.72 0.98 0.00 0.00 173.24 175.02 2d3s s PHE 5 N -0.69 -0.23 0.00 5.02 -0.12 -0.40 -4.99 117.98 116.57 2d3s s PHE 5 Ca -0.08 0.38 0.02 0.00 -0.05 0.00 0.00 56.93 57.20 2d3s s PHE 5 Cb -0.04 0.12 -0.01 0.00 -0.63 0.00 0.00 43.02 42.45 2d3s s PHE 5 CO 0.02 -0.38 -0.08 1.21 -0.05 0.00 0.00 175.22 175.94 2d3s s ASN 6 N -1.17 0.89 -0.28 1.98 2.47 -1.26 -0.61 114.94 116.96 2d3s s ASN 6 Ca -0.12 -0.18 -0.01 0.00 0.42 0.00 0.00 52.86 52.97 2d3s s ASN 6 Cb -0.05 -0.09 0.09 0.00 -1.45 0.00 0.00 41.25 39.76 2d3s s ASN 6 CO 0.04 0.07 0.07 -0.36 -3.72 0.00 0.00 177.10 173.19 2d3s s PHE 7 N -0.29 1.78 0.15 0.43 0.40 -0.02 -4.96 117.98 115.46 2d3s s PHE 7 Ca 0.02 -1.65 -0.00 0.00 -0.60 0.00 0.00 56.93 54.69 2d3s s PHE 7 Cb -0.04 -1.64 -0.05 0.00 0.51 0.00 0.00 43.02 41.80 2d3s s PHE 7 CO -0.00 -0.82 1.34 -0.91 0.70 0.00 0.00 175.22 175.53 2d3s h ASN 8 N 8.07 0.37 -5.28 1.36 -0.26 -1.90 -1.73 115.58 116.23 2d3s h ASN 8 Ca -0.14 -0.30 -0.12 0.00 -0.56 0.00 0.00 56.30 55.18 2d3s h ASN 8 Cb 1.04 -0.11 -0.13 0.00 -1.06 0.00 0.00 38.32 38.05 2d3s h ASN 8 CO 0.44 1.10 -0.39 -1.10 -1.06 0.00 0.00 177.43 176.43 2d3s s GLN 9 N -3.23 1.07 -0.28 0.81 1.11 -1.26 -4.57 119.66 113.32 2d3s s GLN 9 Ca -0.04 -1.20 -0.06 0.00 0.01 0.00 0.00 55.36 54.07 2d3s s GLN 9 Cb 0.10 0.35 0.00 0.00 -1.01 0.00 0.00 33.01 32.45 2d3s s GLN 9 CO 0.84 -0.37 0.05 -0.06 0.01 0.00 0.00 175.29 175.76 2d3s s PHE 10 N -3.97 3.11 0.60 0.91 0.08 -0.94 -5.03 117.98 112.74 2d3s s PHE 10 Ca 0.17 -0.97 -0.01 0.00 0.12 0.00 0.00 56.93 56.24 2d3s s PHE 10 Cb 0.04 -2.21 0.05 0.00 -0.57 0.00 0.00 43.02 40.32 2d3s s PHE 10 CO -0.01 -0.56 0.85 -1.01 -0.10 0.00 0.00 175.22 174.39 2d3s s HIS 11 N 1.49 2.82 -0.65 0.36 3.76 -1.26 -3.95 115.29 117.86 2d3s s HIS 11 Ca 0.03 0.10 -0.26 0.00 -0.15 0.00 0.00 55.06 54.78 2d3s s HIS 11 Cb -0.17 -2.89 -0.05 0.00 1.11 0.00 0.00 32.58 30.59 2d3s s HIS 11 CO 0.01 -1.06 2.06 -0.65 -0.85 0.00 0.00 174.74 174.25 2d3s s GLN 12 N -4.91 2.39 -0.21 1.40 -1.52 -1.26 -4.21 119.66 111.35 2d3s s GLN 12 Ca 0.58 0.62 -0.08 0.00 -1.95 0.00 0.00 55.36 54.53 2d3s s GLN 12 Cb -0.10 -4.59 0.03 0.00 -0.22 0.00 0.00 33.01 28.13 2d3s s GLN 12 CO 0.40 -3.13 0.17 0.27 -0.25 0.00 0.00 175.29 172.75 2d3s n ASN 13 N 14.26 -2.88 0.01 5.90 0.23 -1.26 -4.91 115.26 126.60 2d3s n ASN 13 Ca 0.30 1.34 0.12 0.00 -0.53 0.00 0.00 54.58 55.81 2d3s n ASN 13 Cb 0.51 -5.06 0.21 0.00 -2.08 0.00 0.00 39.78 33.36 2d3s n ASN 13 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2d3s n GLU 14 N 1.48 0.04 -0.87 -3.83 4.71 -1.26 -4.90 120.64 116.01 2d3s n GLU 14 Ca -0.29 0.01 0.00 0.00 -0.01 0.00 0.00 57.16 56.87 2d3s n GLU 14 Cb 0.45 -1.52 0.00 0.00 -1.01 0.00 0.00 31.44 29.36 2d3s n GLU 14 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2d3s n GLU 15 N -1.58 -0.41 -0.03 3.49 1.02 -1.26 -4.72 120.64 117.14 2d3s n GLU 15 Ca 0.05 0.10 0.05 0.00 -0.02 0.00 0.00 57.16 57.35 2d3s n GLU 15 Cb 0.35 -3.66 -0.16 0.00 -0.02 0.00 0.00 31.44 27.95 2d3s n GLU 15 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2d3s n GLN 16 N -1.61 0.67 -4.15 3.49 1.13 -1.26 -4.83 117.38 110.81 2d3s n GLN 16 Ca 0.00 -0.13 -0.29 0.00 -1.94 0.00 0.00 57.00 54.64 2d3s n GLN 16 Cb 0.10 -1.53 -0.08 0.00 0.11 0.00 0.00 30.24 28.84 2d3s n GLN 16 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2d3s s LEU 17 N -4.82 3.43 -0.24 1.08 1.43 -1.26 0.51 118.68 118.81 2d3s s LEU 17 Ca -0.08 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 2d3s s LEU 17 Cb 0.12 -2.13 0.06 0.00 0.03 0.00 0.00 46.19 44.26 2d3s s LEU 17 CO 0.88 0.14 -0.08 -0.75 0.23 0.00 0.00 176.35 176.77 2d3s s LYS 18 N -2.54 1.92 0.04 1.70 2.20 0.17 -4.72 119.74 118.50 2d3s s LYS 18 Ca 0.26 -1.09 -0.07 0.00 -0.36 0.00 0.00 55.97 54.71 2d3s s LYS 18 Cb -0.11 -2.67 -0.05 0.00 -1.51 0.00 0.00 37.83 33.49 2d3s s LYS 18 CO 0.19 -0.56 0.32 -0.51 -0.36 0.00 0.00 175.35 174.42 2d3s s LEU 19 N 1.29 4.36 0.03 5.43 1.02 -1.26 -0.54 118.68 129.01 2d3s s LEU 19 Ca -0.06 0.63 0.02 0.00 0.02 0.00 0.00 54.13 54.74 2d3s s LEU 19 Cb -0.19 -2.83 -0.02 0.00 0.02 0.00 0.00 46.19 43.17 2d3s s LEU 19 CO -0.06 0.21 -0.07 -1.10 0.02 0.00 0.00 176.35 175.35 2d3s s GLN 20 N -1.89 0.49 7.59 1.70 -0.21 -0.30 -5.00 119.66 122.03 2d3s s GLN 20 Ca 0.31 -0.62 0.00 0.00 0.02 0.00 0.00 55.36 55.07 2d3s s GLN 20 Cb -0.13 -0.29 0.00 0.00 1.00 0.00 0.00 33.01 33.59 2d3s s GLN 20 CO 0.18 0.06 0.00 0.54 -2.12 0.00 0.00 175.29 173.94 2d3s n ARG 21 N 1.80 0.00 0.00 2.91 5.12 -1.26 -2.17 116.66 123.06 2d3s n ARG 21 Ca -0.21 0.00 0.15 0.00 -1.93 0.00 0.00 57.85 55.86 2d3s n ARG 21 Cb 0.55 0.00 0.73 0.00 -1.16 0.00 0.00 32.46 32.59 2d3s n ARG 21 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2d3s n ASP 22 N 6.21 0.05 -4.68 0.55 8.00 -0.25 -4.87 116.55 121.55 2d3s n ASP 22 Ca 0.00 -0.16 -0.51 0.00 0.71 0.00 0.00 54.79 54.83 2d3s n ASP 22 Cb 0.00 -0.27 -0.05 0.00 -0.02 0.00 0.00 41.12 40.78 2d3s n ASP 22 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d3s n ALA 23 N -1.26 0.51 -3.06 2.24 0.00 -1.00 -4.45 120.51 113.48 2d3s n ALA 23 Ca 0.14 0.35 -0.12 0.00 0.00 0.00 0.00 53.44 53.80 2d3s n ALA 23 Cb 0.25 -2.38 -0.13 0.00 0.00 0.00 0.00 19.45 17.19 2d3s n ALA 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2d3s s ARG 24 N 3.32 0.09 -0.23 0.00 6.06 0.67 -4.66 118.95 124.20 2d3s s ARG 24 Ca 0.92 0.14 -0.15 0.00 -2.50 0.00 0.00 55.73 54.14 2d3s s ARG 24 Cb -0.82 0.02 -0.04 0.00 0.06 0.00 0.00 34.95 34.17 2d3s s ARG 24 CO 0.54 -0.03 0.38 0.42 -2.50 0.00 0.00 175.30 174.10 2d3s s ILE 25 N 0.19 5.19 0.72 4.11 1.01 -1.26 -0.35 121.20 130.81 2d3s s ILE 25 Ca -0.01 0.63 -0.11 0.00 0.00 0.00 0.00 60.65 61.16 2d3s s ILE 25 Cb -0.02 -3.71 0.02 0.00 0.01 0.00 0.00 42.46 38.77 2d3s s ILE 25 CO -0.01 0.21 1.07 -0.94 0.00 0.00 0.00 174.94 175.28 2d3s s SER 26 N 1.29 5.09 0.62 3.58 1.04 -0.43 -4.93 113.70 119.96 2d3s s SER 26 Ca 0.17 1.65 0.38 0.00 0.48 0.00 0.00 55.95 58.62 2d3s s SER 26 Cb -0.15 -2.47 2.06 0.00 0.10 0.00 0.00 66.02 65.56 2d3s s SER 26 CO 0.08 -1.63 2.27 0.77 0.98 0.00 0.00 173.24 175.72 2d3s h SER 27 N -0.85 0.00 -0.90 7.02 4.64 -1.95 -2.40 113.55 119.10 2d3s h SER 27 Ca -0.44 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.37 2d3s h SER 27 Cb 1.22 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.03 2d3s h SER 27 CO 0.56 0.02 0.56 -0.46 -0.87 0.00 0.00 176.83 176.63 2d3s n ASN 28 N -3.37 4.50 -0.34 4.97 6.94 -1.26 -4.95 115.26 121.75 2d3s n ASN 28 Ca -0.03 -3.68 -0.04 0.00 -0.02 0.00 0.00 54.58 50.81 2d3s n ASN 28 Cb 0.11 -0.83 -0.02 0.00 -2.36 0.00 0.00 39.78 36.69 2d3s n ASN 28 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2d3s n SER 29 N -1.08 -3.95 -4.65 0.53 7.64 -0.90 -4.98 113.62 106.23 2d3s n SER 29 Ca 0.57 0.11 -0.35 0.00 1.01 0.00 0.00 58.87 60.21 2d3s n SER 29 Cb 1.34 -1.84 -0.10 0.00 -1.01 0.00 0.00 64.21 62.60 2d3s n SER 29 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2d3s s VAL 30 N -2.03 4.35 -0.40 0.44 -7.23 -1.26 -2.21 120.40 112.06 2d3s s VAL 30 Ca 0.00 -0.22 -0.27 0.00 -1.81 0.00 0.00 61.98 59.68 2d3s s VAL 30 Cb 0.00 -2.87 0.02 0.00 0.56 0.00 0.00 36.38 34.09 2d3s s VAL 30 CO 0.00 0.56 0.99 -0.22 -0.31 0.00 0.00 175.10 176.12 2d3s s LEU 31 N -0.44 3.92 -0.46 1.32 2.96 -0.54 -1.31 118.68 124.13 2d3s s LEU 31 Ca 0.08 0.53 -0.13 0.00 -0.22 0.00 0.00 54.13 54.38 2d3s s LEU 31 Cb -0.12 -3.34 0.08 0.00 0.50 0.00 0.00 46.19 43.30 2d3s s LEU 31 CO 0.02 -0.98 0.35 -1.61 -1.32 0.00 0.00 176.35 172.82 2d3s s GLU 32 N 3.75 2.85 0.21 1.98 2.02 0.53 0.11 118.70 130.14 2d3s s GLU 32 Ca 0.41 -1.40 -0.07 0.00 0.02 0.00 0.00 54.97 53.93 2d3s s GLU 32 Cb -0.11 -4.02 0.16 0.00 0.10 0.00 0.00 34.13 30.27 2d3s s GLU 32 CO 0.22 -1.01 1.69 -0.07 0.02 0.00 0.00 175.26 176.11 2d3s h LEU 33 N 8.64 0.97 -9.36 1.80 3.38 -1.59 0.19 115.31 119.34 2d3s h LEU 33 Ca -0.27 -0.25 -0.59 0.00 0.09 0.00 0.00 57.88 56.86 2d3s h LEU 33 Cb 1.10 -0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.47 2d3s h LEU 33 CO 0.84 1.01 -0.71 0.42 0.09 0.00 0.00 178.44 180.09 2d3s s THR 34 N -5.07 2.76 0.21 0.22 -4.23 -1.26 -2.43 115.64 105.83 2d3s s THR 34 Ca -0.11 -2.21 -0.32 0.00 -1.18 0.00 0.00 61.69 57.87 2d3s s THR 34 Cb 0.14 -2.53 -0.12 0.00 1.34 0.00 0.00 72.50 71.33 2d3s s THR 34 CO 0.84 -0.36 1.69 1.17 -0.54 0.00 0.00 174.62 177.42 2d3s n LYS 35 N -0.74 2.67 -3.54 3.99 4.81 -1.26 -4.81 118.16 119.27 2d3s n LYS 35 Ca -0.05 0.96 -0.21 0.00 -0.87 0.00 0.00 58.31 58.14 2d3s n LYS 35 Cb 0.60 -2.79 -0.15 0.00 0.02 0.00 0.00 35.03 32.72 2d3s n LYS 35 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2d3s s VAL 36 N 1.02 -0.23 -0.17 3.15 0.11 -1.26 -2.34 120.40 120.68 2d3s s VAL 36 Ca 0.75 -0.13 -0.05 0.00 -2.93 0.00 0.00 61.98 59.61 2d3s s VAL 36 Cb -0.53 -0.63 -0.03 0.00 -1.53 0.00 0.00 36.38 33.65 2d3s s VAL 36 CO 0.35 -0.23 0.01 0.68 -3.33 0.00 0.00 175.10 172.57 2d3s s VAL 37 N 2.25 4.27 -1.53 2.04 -7.23 0.14 -4.58 120.40 115.77 2d3s s VAL 37 Ca 0.05 -0.22 -0.09 0.00 -1.81 0.00 0.00 61.98 59.91 2d3s s VAL 37 Cb -0.16 -2.90 0.07 0.00 0.56 0.00 0.00 36.38 33.95 2d3s s VAL 37 CO -0.11 0.47 0.65 0.59 -0.31 0.00 0.00 175.10 176.40 2d3s n ASN 38 N 3.60 -2.12 -0.09 4.85 5.03 -1.26 -0.49 115.26 124.78 2d3s n ASN 38 Ca -0.17 -0.96 -0.01 0.00 0.87 0.00 0.00 54.58 54.31 2d3s n ASN 38 Cb 0.52 -3.14 -0.01 0.00 -1.02 0.00 0.00 39.78 36.14 2d3s n ASN 38 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2d3s n GLY 39 N -1.71 0.46 2.98 7.41 0.00 -1.26 -5.01 105.19 108.06 2d3s n GLY 39 Ca -0.12 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.46 2d3s n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d3s s VAL 40 N -1.84 1.18 0.25 1.61 1.01 0.36 -5.12 120.40 117.85 2d3s s VAL 40 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 2d3s s VAL 40 Cb 0.00 -1.12 -0.09 0.00 0.00 0.00 0.00 36.38 35.17 2d3s s VAL 40 CO 0.00 0.38 1.05 -2.16 0.00 0.00 0.00 175.10 174.37 2d3s s PRO 41 N 1.15 4.70 0.33 2.72 0.04 -1.26 0.29 135.00 142.96 2d3s s PRO 41 Ca -0.05 1.69 0.07 0.00 0.04 0.00 0.00 61.00 62.75 2d3s s PRO 41 Cb -0.14 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2d3s s PRO 41 CO -0.02 0.28 0.27 0.95 0.04 0.00 0.00 177.00 178.52 2d3s s THR 42 N -1.01 3.62 0.00 1.26 -4.23 -0.99 -4.79 115.64 109.50 2d3s s THR 42 Ca 0.44 -1.39 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 2d3s s THR 42 Cb -0.30 -3.20 0.00 0.00 1.34 0.00 0.00 72.50 70.34 2d3s s THR 42 CO 0.37 -0.20 0.00 -2.67 -0.54 0.00 0.00 174.62 171.59 2d3s n TRP 43 N -1.34 -3.07 -4.29 3.99 4.27 -1.26 -4.45 117.44 111.29 2d3s n TRP 43 Ca -0.03 0.00 -0.37 0.00 -3.89 0.00 0.00 57.50 53.21 2d3s n TRP 43 Cb 0.60 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.50 2d3s n TRP 43 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2d3s n ASN 44 N -2.50 -2.68 -4.25 -0.67 5.15 0.13 -4.90 115.26 105.54 2d3s n ASN 44 Ca 0.00 -1.08 -0.30 0.00 -0.60 0.00 0.00 54.58 52.60 2d3s n ASN 44 Cb 0.00 -2.46 -0.16 0.00 -0.53 0.00 0.00 39.78 36.63 2d3s n ASN 44 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2d3s s SER 45 N -3.37 2.86 -0.02 1.20 0.15 -1.26 -5.00 113.70 108.27 2d3s s SER 45 Ca 0.71 -0.47 -0.02 0.00 0.70 0.00 0.00 55.95 56.87 2d3s s SER 45 Cb -0.39 -0.67 0.00 0.00 -1.71 0.00 0.00 66.02 63.25 2d3s s SER 45 CO 0.95 0.24 0.05 -0.89 1.20 0.00 0.00 173.24 174.80 2d3s s THR 46 N -0.23 0.00 -0.04 6.45 2.01 -1.26 -0.15 115.64 122.42 2d3s s THR 46 Ca -0.00 -0.00 -0.31 0.00 0.31 0.00 0.00 61.69 61.69 2d3s s THR 46 Cb -0.12 -0.08 0.07 0.00 0.01 0.00 0.00 72.50 72.38 2d3s s THR 46 CO 0.02 -0.00 0.68 -0.83 -0.69 0.00 0.00 174.62 173.80 2d3s s GLY 47 N 0.02 -0.58 0.06 4.40 0.00 -0.91 -1.10 107.32 109.21 2d3s s GLY 47 Ca -0.00 1.28 0.00 0.00 0.00 0.00 0.00 44.72 46.00 2d3s s GLY 47 CO 0.00 0.92 -0.04 0.50 0.00 0.00 0.00 173.10 174.48 2d3s s ARG 48 N -1.32 0.61 -0.14 2.90 0.52 -0.92 -1.38 118.95 119.22 2d3s s ARG 48 Ca -0.10 -1.10 -0.03 0.00 -0.52 0.00 0.00 55.73 53.97 2d3s s ARG 48 Cb -0.00 0.03 0.05 0.00 0.52 0.00 0.00 34.95 35.55 2d3s s ARG 48 CO 0.09 -0.06 0.06 0.00 0.02 0.00 0.00 175.30 175.41 2d3s s ALA 49 N -3.17 0.60 0.03 2.13 0.00 -0.33 -1.15 121.76 119.87 2d3s s ALA 49 Ca 0.03 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 51.72 2d3s s ALA 49 Cb 0.02 -0.96 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 2d3s s ALA 49 CO -0.06 -0.95 -0.06 -0.51 0.00 0.00 0.00 175.76 174.17 2d3s s LEU 50 N 2.04 3.20 0.08 0.00 2.01 0.30 -1.04 118.68 125.27 2d3s s LEU 50 Ca 0.02 -0.18 -0.31 0.00 0.01 0.00 0.00 54.13 53.67 2d3s s LEU 50 Cb -0.15 -1.87 -0.07 0.00 0.01 0.00 0.00 46.19 44.11 2d3s s LEU 50 CO -0.07 0.25 1.30 -0.47 1.01 0.00 0.00 176.35 178.37 2d3s s TYR 51 N -1.07 3.31 0.37 0.29 5.04 -0.55 0.45 117.35 125.19 2d3s s TYR 51 Ca 0.19 1.11 0.10 0.00 -2.44 0.00 0.00 57.07 56.03 2d3s s TYR 51 Cb -0.11 -3.56 0.84 0.00 0.35 0.00 0.00 41.96 39.49 2d3s s TYR 51 CO 0.10 -1.86 1.88 0.00 -1.34 0.00 0.00 175.55 174.33 2d3s h ALA 52 N 6.87 1.86 -2.72 3.97 0.00 -0.22 -3.43 119.26 125.59 2d3s h ALA 52 Ca -0.41 0.01 -0.60 0.00 0.00 0.00 0.00 54.91 53.91 2d3s h ALA 52 Cb 1.21 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 2d3s h ALA 52 CO 0.84 -0.09 -0.15 0.15 0.00 0.00 0.00 179.25 180.00 2d3s s LYS 53 N -5.64 4.04 0.38 0.00 -0.14 -1.26 -5.03 119.74 112.08 2d3s s LYS 53 Ca -0.10 0.49 -0.25 0.00 -1.36 0.00 0.00 55.97 54.76 2d3s s LYS 53 Cb 0.22 -3.25 -0.09 0.00 -1.68 0.00 0.00 37.83 33.02 2d3s s LYS 53 CO 0.78 0.61 1.03 -1.25 -0.76 0.00 0.00 175.35 175.76 2d3s s PRO 54 N -0.86 4.29 -0.10 -1.68 0.04 -1.26 -4.82 135.00 130.61 2d3s s PRO 54 Ca 0.25 1.49 0.02 0.00 0.04 0.00 0.00 61.00 62.80 2d3s s PRO 54 Cb -0.17 -2.63 -0.01 0.00 0.04 0.00 0.00 34.50 31.72 2d3s s PRO 54 CO 0.14 -0.03 -0.17 0.14 0.04 0.00 0.00 177.00 177.12 2d3s s VAL 55 N -1.63 2.70 -0.30 -0.36 -7.23 0.27 -4.90 120.40 108.94 2d3s s VAL 55 Ca 0.55 -0.81 -0.27 0.00 -1.81 0.00 0.00 61.98 59.64 2d3s s VAL 55 Cb -0.22 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.65 2d3s s VAL 55 CO 0.27 0.55 0.98 -1.58 -0.31 0.00 0.00 175.10 175.02 2d3s s GLN 56 N 0.10 4.06 0.14 4.82 0.74 -1.26 -0.80 119.66 127.47 2d3s s GLN 56 Ca -0.08 0.97 0.22 0.00 0.05 0.00 0.00 55.36 56.52 2d3s s GLN 56 Cb -0.15 -3.72 -0.06 0.00 1.10 0.00 0.00 33.01 30.18 2d3s s GLN 56 CO 0.05 -0.79 0.93 1.33 -0.55 0.00 0.00 175.29 176.26 2d3s n VAL 57 N 5.69 0.45 -3.57 1.34 0.24 0.13 -4.83 118.33 117.78 2d3s n VAL 57 Ca 0.09 -0.50 -0.11 0.00 -2.04 0.00 0.00 64.34 61.78 2d3s n VAL 57 Cb 0.47 -0.22 -0.04 0.00 -1.47 0.00 0.00 33.84 32.59 2d3s n VAL 57 CO 0.00 0.00 0.00 -1.66 -2.14 0.00 0.00 176.83 173.03 2d3s s TRP 58 N -3.38 -0.33 -0.15 6.34 1.48 -1.21 0.40 118.94 122.09 2d3s s TRP 58 Ca -0.02 0.09 0.01 0.00 -1.06 0.00 0.00 56.10 55.13 2d3s s TRP 58 Cb 0.11 0.35 0.02 0.00 -1.16 0.00 0.00 33.47 32.79 2d3s s TRP 58 CO 0.81 -0.73 -0.18 0.34 -4.06 0.00 0.00 176.95 173.13 2d3s s ASP 59 N -2.67 2.92 0.38 -2.66 2.15 0.07 -4.62 116.67 112.25 2d3s s ASP 59 Ca 0.01 -0.57 0.17 0.00 0.43 0.00 0.00 52.55 52.60 2d3s s ASP 59 Cb 0.01 -1.34 0.74 0.00 -0.30 0.00 0.00 42.92 42.03 2d3s s ASP 59 CO -0.11 0.01 1.78 0.77 -0.17 0.00 0.00 175.17 177.45 2d3s h SER 60 N 7.74 0.00 0.07 -0.34 4.64 -1.93 0.82 113.55 124.56 2d3s h SER 60 Ca -0.39 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.83 2d3s h SER 60 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2d3s h SER 60 CO 0.57 0.38 -0.32 0.74 -0.87 0.00 0.00 176.83 177.32 2d3s h THR 61 N 0.00 1.28 0.00 2.95 2.02 -1.96 -3.30 112.91 113.90 2d3s h THR 61 Ca -0.00 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 65.81 2d3s h THR 61 Cb 0.80 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 2d3s h THR 61 CO 0.05 0.42 -1.10 0.35 0.37 0.00 0.00 175.52 175.61 2d3s n THR 62 N -4.08 0.00 -0.62 3.16 -2.24 -1.16 -4.99 114.28 104.35 2d3s n THR 62 Ca -0.01 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2d3s n THR 62 Cb 0.44 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 2d3s n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d3s n GLY 63 N 1.75 1.69 3.77 3.38 0.00 0.29 -5.00 105.19 111.06 2d3s n GLY 63 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2d3s n GLY 63 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d3s s ASN 64 N -3.35 6.28 -0.01 1.61 0.02 -1.18 -4.77 114.94 113.55 2d3s s ASN 64 Ca 0.00 2.47 0.06 0.00 -1.02 0.00 0.00 52.86 54.36 2d3s s ASN 64 Cb 0.00 -2.62 -0.03 0.00 0.02 0.00 0.00 41.25 38.62 2d3s s ASN 64 CO 0.00 -0.85 -0.17 -0.69 0.02 0.00 0.00 177.10 175.41 2d3s s VAL 65 N -1.38 2.84 0.43 1.60 1.01 -1.26 -0.75 120.40 122.89 2d3s s VAL 65 Ca 0.59 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 61.45 2d3s s VAL 65 Cb -0.33 -2.14 -0.09 0.00 0.00 0.00 0.00 36.38 33.82 2d3s s VAL 65 CO 0.42 0.48 0.88 0.00 0.00 0.00 0.00 175.10 176.88 2d3s s ALA 66 N -0.81 3.17 0.03 5.51 0.00 0.16 -4.73 121.76 125.09 2d3s s ALA 66 Ca 0.13 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.23 2d3s s ALA 66 Cb -0.10 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.01 2d3s s ALA 66 CO 0.03 0.01 0.01 -1.12 0.00 0.00 0.00 175.76 174.69 2d3s s SER 67 N -2.73 5.17 0.06 0.00 0.01 -0.90 -4.44 113.70 110.88 2d3s s SER 67 Ca 0.57 -0.04 -0.12 0.00 1.31 0.00 0.00 55.95 57.68 2d3s s SER 67 Cb -0.10 -1.34 0.01 0.00 0.21 0.00 0.00 66.02 64.81 2d3s s SER 67 CO 0.24 0.25 0.27 0.72 0.41 0.00 0.00 173.24 175.13 2d3s s PHE 68 N -1.17 -0.03 -0.02 2.43 -0.12 -0.76 -1.27 117.98 117.04 2d3s s PHE 68 Ca 0.22 -0.19 0.01 0.00 -0.05 0.00 0.00 56.93 56.91 2d3s s PHE 68 Cb -0.12 0.05 0.02 0.00 -0.63 0.00 0.00 43.02 42.35 2d3s s PHE 68 CO 0.13 -0.51 -0.01 -2.00 -0.05 0.00 0.00 175.22 172.78 2d3s s GLU 69 N -2.90 0.33 0.00 1.99 2.12 0.67 0.22 118.70 121.13 2d3s s GLU 69 Ca -0.03 0.01 0.02 0.00 0.36 0.00 0.00 54.97 55.34 2d3s s GLU 69 Cb 0.00 -0.44 -0.01 0.00 0.26 0.00 0.00 34.13 33.94 2d3s s GLU 69 CO -0.06 -0.08 -0.06 -0.08 -0.54 0.00 0.00 175.26 174.44 2d3s s THR 70 N 0.72 0.50 -0.00 -1.70 -1.32 0.22 -0.75 115.64 113.31 2d3s s THR 70 Ca -0.07 -0.35 0.04 0.00 -1.21 0.00 0.00 61.69 60.10 2d3s s THR 70 Cb -0.11 -0.43 -0.01 0.00 -1.51 0.00 0.00 72.50 70.44 2d3s s THR 70 CO -0.01 0.09 -0.11 -0.13 -2.21 0.00 0.00 174.62 172.24 2d3s s ARG 71 N -0.29 0.89 0.14 7.08 0.52 -0.39 -1.02 118.95 125.88 2d3s s ARG 71 Ca 0.01 -0.43 -0.23 0.00 -0.52 0.00 0.00 55.73 54.56 2d3s s ARG 71 Cb -0.03 -0.86 0.07 0.00 0.52 0.00 0.00 34.95 34.64 2d3s s ARG 71 CO -0.00 0.23 0.58 -0.59 0.02 0.00 0.00 175.30 175.54 2d3s s PHE 72 N -0.33 -0.51 0.01 -0.53 -0.71 -0.98 -0.28 117.98 114.65 2d3s s PHE 72 Ca 0.04 0.34 0.08 0.00 -1.04 0.00 0.00 56.93 56.34 2d3s s PHE 72 Cb -0.05 0.51 -0.03 0.00 -1.21 0.00 0.00 43.02 42.25 2d3s s PHE 72 CO -0.00 -0.82 -0.24 -1.12 -1.34 0.00 0.00 175.22 171.71 2d3s s SER 73 N -2.64 3.32 0.22 1.98 0.01 -0.89 -1.01 113.70 114.68 2d3s s SER 73 Ca 0.00 -0.48 -0.02 0.00 1.31 0.00 0.00 55.95 56.76 2d3s s SER 73 Cb -0.01 -0.41 -0.03 0.00 0.21 0.00 0.00 66.02 65.77 2d3s s SER 73 CO -0.11 0.29 0.19 0.72 0.41 0.00 0.00 173.24 174.73 2d3s s PHE 74 N -0.75 1.13 -0.11 2.43 -0.12 -0.78 -0.84 117.98 118.94 2d3s s PHE 74 Ca 0.12 -1.33 -0.05 0.00 -0.05 0.00 0.00 56.93 55.61 2d3s s PHE 74 Cb -0.10 -0.48 0.05 0.00 -0.63 0.00 0.00 43.02 41.85 2d3s s PHE 74 CO 0.01 -0.71 0.25 0.45 -0.05 0.00 0.00 175.22 175.17 2d3s s SER 75 N -3.17 -0.27 -0.20 1.98 0.15 0.25 -1.28 113.70 111.17 2d3s s SER 75 Ca 0.37 0.53 0.01 0.00 0.70 0.00 0.00 55.95 57.56 2d3s s SER 75 Cb 0.06 0.41 0.03 0.00 -1.71 0.00 0.00 66.02 64.81 2d3s s SER 75 CO 0.13 -0.16 -0.18 -0.63 1.20 0.00 0.00 173.24 173.60 2d3s s ILE 76 N 1.22 2.07 -0.18 6.45 1.01 -1.26 -1.59 121.20 128.91 2d3s s ILE 76 Ca -0.09 -1.09 -0.03 0.00 0.00 0.00 0.00 60.65 59.44 2d3s s ILE 76 Cb -0.10 -1.94 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 2d3s s ILE 76 CO -0.08 0.41 -0.05 -0.60 0.00 0.00 0.00 174.94 174.62 2d3s s ARG 77 N 1.25 3.52 -0.55 2.79 3.52 -1.24 -1.60 118.95 126.64 2d3s s ARG 77 Ca 0.02 -0.58 -0.02 0.00 -0.13 0.00 0.00 55.73 55.02 2d3s s ARG 77 Cb -0.15 -2.94 0.14 0.00 -1.56 0.00 0.00 34.95 30.45 2d3s s ARG 77 CO -0.11 0.04 0.35 -0.65 -0.81 0.00 0.00 175.30 174.12 2d3s s GLN 78 N 0.87 2.32 0.25 5.12 -0.21 -1.26 -1.05 119.66 125.70 2d3s s GLN 78 Ca -0.01 -2.34 0.11 0.00 0.02 0.00 0.00 55.36 53.14 2d3s s GLN 78 Cb -0.15 -3.63 0.24 0.00 1.00 0.00 0.00 33.01 30.47 2d3s s GLN 78 CO 0.01 -1.13 1.53 -1.35 -2.12 0.00 0.00 175.29 172.23 2d3s h PRO 79 N 7.24 0.00 -3.61 2.91 0.11 -1.97 -3.39 132.00 133.29 2d3s h PRO 79 Ca -0.05 0.00 -0.73 0.00 0.11 0.00 0.00 66.00 65.32 2d3s h PRO 79 Cb 0.97 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 31.76 2d3s h PRO 79 CO 0.70 0.67 -0.13 -0.06 -0.21 0.00 0.00 178.00 178.96 2d3s s PHE 80 N -3.32 3.63 -0.06 0.65 0.08 -1.26 -4.93 117.98 112.77 2d3s s PHE 80 Ca -0.00 -2.53 -0.27 0.00 0.12 0.00 0.00 56.93 54.26 2d3s s PHE 80 Cb 0.11 -3.44 -0.22 0.00 -0.57 0.00 0.00 43.02 38.90 2d3s s PHE 80 CO 0.76 -0.88 1.11 -1.00 -0.10 0.00 0.00 175.22 175.11 2d3s h PRO 81 N 7.10 0.03 -0.20 0.24 0.13 -1.91 -3.38 132.00 134.00 2d3s h PRO 81 Ca 0.06 -0.02 0.02 0.00 -0.87 0.00 0.00 66.00 65.19 2d3s h PRO 81 Cb 0.96 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.07 2d3s h PRO 81 CO 0.76 0.68 -0.12 0.54 -0.23 0.00 0.00 178.00 179.63 2d3s n ARG 82 N -4.75 -0.09 0.00 0.86 5.12 -1.26 -3.67 116.66 112.88 2d3s n ARG 82 Ca -0.09 0.79 0.00 0.00 -1.93 0.00 0.00 57.85 56.62 2d3s n ARG 82 Cb 0.34 -1.18 0.00 0.00 -1.16 0.00 0.00 32.46 30.46 2d3s n ARG 82 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2d3s n PRO 83 N -3.32 0.00 -3.16 5.56 -0.02 -1.26 -5.00 135.00 127.80 2d3s n PRO 83 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.53 2d3s n PRO 83 Cb 0.05 -0.69 -0.03 0.00 -0.02 0.00 0.00 33.50 32.82 2d3s n PRO 83 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2d3s s HIS 84 N -0.47 -0.08 0.80 6.00 -3.43 -1.24 -5.11 115.29 111.76 2d3s s HIS 84 Ca 0.00 0.11 -0.14 0.00 -0.80 0.00 0.00 55.06 54.23 2d3s s HIS 84 Cb 0.00 0.04 0.08 0.00 -1.43 0.00 0.00 32.58 31.27 2d3s s HIS 84 CO 0.00 -0.04 1.22 -2.14 -2.00 0.00 0.00 174.74 171.77 2d3s s PRO 85 N 2.57 1.66 -0.04 -0.38 0.02 -1.26 -4.22 135.00 133.35 2d3s s PRO 85 Ca -0.05 1.79 -0.29 0.00 0.02 0.00 0.00 61.00 62.47 2d3s s PRO 85 Cb -0.05 -1.77 0.09 0.00 0.02 0.00 0.00 34.50 32.79 2d3s s PRO 85 CO -0.11 -2.20 0.78 0.00 -0.33 0.00 0.00 177.00 175.14 2d3s s ALA 86 N -2.09 -1.79 -0.06 -1.55 0.00 -1.26 -4.16 121.76 110.85 2d3s s ALA 86 Ca 0.74 1.21 0.04 0.00 0.00 0.00 0.00 51.96 53.94 2d3s s ALA 86 Cb -0.30 0.02 -0.06 0.00 0.00 0.00 0.00 23.12 22.79 2d3s s ALA 86 CO 0.50 -0.47 -0.00 -0.25 0.00 0.00 0.00 175.76 175.54 2d3s n ASP 87 N 0.47 3.64 0.00 0.00 9.92 0.20 -3.51 116.55 127.27 2d3s n ASP 87 Ca -0.15 -0.01 0.00 0.00 -0.53 0.00 0.00 54.79 54.10 2d3s n ASP 87 Cb 0.59 0.43 0.00 0.00 -0.64 0.00 0.00 41.12 41.50 2d3s n ASP 87 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2d3s n GLY 88 N 2.81 1.27 3.28 0.44 0.00 -1.17 -1.25 105.19 110.57 2d3s n GLY 88 Ca -0.09 -1.96 -0.16 0.00 0.00 0.00 0.00 46.02 43.81 2d3s n GLY 88 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2d3s s LEU 89 N 0.00 2.54 0.04 0.99 0.05 -1.00 -2.46 118.68 118.84 2d3s s LEU 89 Ca 0.00 -1.02 -0.02 0.00 0.05 0.00 0.00 54.13 53.15 2d3s s LEU 89 Cb 0.00 -0.46 -0.03 0.00 -2.05 0.00 0.00 46.19 43.66 2d3s s LEU 89 CO 0.00 -0.28 -0.00 0.68 -0.55 0.00 0.00 176.35 176.20 2d3s s VAL 90 N -3.21 0.17 -0.18 1.48 -7.23 0.60 -0.94 120.40 111.08 2d3s s VAL 90 Ca 0.19 -1.37 -0.05 0.00 -1.81 0.00 0.00 61.98 58.93 2d3s s VAL 90 Cb 0.01 -0.99 -0.03 0.00 0.56 0.00 0.00 36.38 35.94 2d3s s VAL 90 CO 0.03 -0.76 0.01 0.12 -0.31 0.00 0.00 175.10 174.19 2d3s s PHE 91 N -2.87 3.09 0.16 2.82 5.36 0.06 -1.64 117.98 124.97 2d3s s PHE 91 Ca -0.03 -0.26 0.02 0.00 -0.96 0.00 0.00 56.93 55.70 2d3s s PHE 91 Cb 0.00 -2.05 -0.05 0.00 -0.34 0.00 0.00 43.02 40.59 2d3s s PHE 91 CO -0.06 -0.08 -0.01 -0.59 -1.46 0.00 0.00 175.22 173.02 2d3s s PHE 92 N 0.67 1.16 -0.07 10.12 -0.71 0.02 -0.37 117.98 128.79 2d3s s PHE 92 Ca 0.00 -1.00 0.01 0.00 -1.04 0.00 0.00 56.93 54.91 2d3s s PHE 92 Cb -0.14 -0.66 0.02 0.00 -1.21 0.00 0.00 43.02 41.03 2d3s s PHE 92 CO 0.02 -0.20 -0.09 0.42 -1.34 0.00 0.00 175.22 174.03 2d3s s ILE 93 N -3.65 0.99 0.23 -4.49 1.01 0.37 -1.83 121.20 113.83 2d3s s ILE 93 Ca 0.22 -0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.42 2d3s s ILE 93 Cb 0.06 -0.95 -0.01 0.00 0.01 0.00 0.00 42.46 41.57 2d3s s ILE 93 CO 0.02 0.33 0.39 0.00 0.00 0.00 0.00 174.94 175.68 2d3s s ALA 94 N 1.02 0.12 0.75 9.38 0.00 -0.55 -1.92 121.76 130.56 2d3s s ALA 94 Ca -0.08 -1.09 -0.15 0.00 0.00 0.00 0.00 51.96 50.64 2d3s s ALA 94 Cb -0.15 1.15 0.04 0.00 0.00 0.00 0.00 23.12 24.16 2d3s s ALA 94 CO -0.00 -0.78 1.18 -2.30 0.00 0.00 0.00 175.76 173.86 2d3s n PRO 95 N -0.35 0.51 -1.40 0.00 -0.02 -1.26 -0.52 135.00 131.96 2d3s n PRO 95 Ca -0.01 0.24 -0.31 0.00 -2.02 0.00 0.00 63.50 61.40 2d3s n PRO 95 Cb 0.63 -2.43 0.08 0.00 -0.02 0.00 0.00 33.50 31.76 2d3s n PRO 95 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2d3s s PRO 96 N -3.76 2.50 -1.46 0.52 0.04 -1.26 -3.95 135.00 127.63 2d3s s PRO 96 Ca 0.76 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.84 2d3s s PRO 96 Cb -0.33 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2d3s s PRO 96 CO 0.48 -1.44 0.00 0.09 0.04 0.00 0.00 177.00 176.17 2d3s n ASN 97 N -3.37 -4.76 -4.90 6.66 5.03 -1.26 -5.01 115.26 107.65 2d3s n ASN 97 Ca 0.08 0.14 -0.29 0.00 0.87 0.00 0.00 54.58 55.39 2d3s n ASN 97 Cb 0.53 -3.79 0.05 0.00 -1.02 0.00 0.00 39.78 35.55 2d3s n ASN 97 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2d3s s THR 98 N -2.70 3.26 0.31 3.41 -4.23 -1.25 -5.09 115.64 109.35 2d3s s THR 98 Ca 0.00 0.26 0.10 0.00 -1.18 0.00 0.00 61.69 60.87 2d3s s THR 98 Cb 0.00 -3.38 -0.05 0.00 1.34 0.00 0.00 72.50 70.41 2d3s s THR 98 CO 0.00 -0.47 -0.06 -1.10 -0.54 0.00 0.00 174.62 172.45 2d3s s GLN 99 N -5.29 1.99 0.19 3.99 -0.21 -1.26 -5.08 119.66 113.99 2d3s s GLN 99 Ca 0.58 -1.70 -0.33 0.00 0.02 0.00 0.00 55.36 53.93 2d3s s GLN 99 Cb -0.11 -1.92 -0.13 0.00 1.00 0.00 0.00 33.01 31.85 2d3s s GLN 99 CO 0.49 0.25 1.57 2.41 -2.12 0.00 0.00 175.29 177.89 2d3s n THR 100 N -0.83 0.24 -0.29 -0.19 -1.04 -1.26 -4.97 114.28 105.95 2d3s n THR 100 Ca -0.05 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 2d3s n THR 100 Cb 0.61 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.50 2d3s n THR 100 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2d3s n GLY 101 N 3.18 0.46 3.78 3.41 0.00 0.96 -4.98 105.19 112.00 2d3s n GLY 101 Ca 0.15 -1.64 -0.35 0.00 0.00 0.00 0.00 46.02 44.18 2d3s n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d3s s GLU 102 N 0.68 3.67 0.00 1.61 2.56 0.33 -4.61 118.70 122.94 2d3s s GLU 102 Ca 0.00 1.58 0.00 0.00 0.00 0.00 0.00 54.97 56.55 2d3s s GLU 102 Cb 0.00 -2.20 0.00 0.00 2.00 0.00 0.00 34.13 33.93 2d3s s GLU 102 CO 0.00 -0.58 0.00 0.41 -0.56 0.00 0.00 175.26 174.53 2d3s n GLY 103 N 0.16 1.09 7.00 -1.50 0.00 -1.26 -0.51 105.19 110.17 2d3s n GLY 103 Ca 0.09 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2d3s n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3s n GLY 104 N 5.00 2.44 0.00 -0.02 0.00 -1.25 -1.43 105.19 109.93 2d3s n GLY 104 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2d3s n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3s n GLY 105 N 0.00 -0.35 0.25 -0.02 0.00 -1.26 -1.48 105.19 102.32 2d3s n GLY 105 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2d3s n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2d3s n TYR 106 N -1.35 0.00 -0.72 1.61 4.01 -0.51 -4.95 117.16 115.24 2d3s n TYR 106 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2d3s n TYR 106 Cb 0.00 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 2d3s n TYR 106 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2d3s n PHE 107 N -0.66 0.00 -0.63 -0.72 3.72 -0.55 -1.97 117.46 116.65 2d3s n PHE 107 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2d3s n PHE 107 Cb 0.36 -1.71 0.00 0.00 -0.94 0.00 0.00 39.48 37.19 2d3s n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2d3s n GLY 108 N -0.49 0.69 0.01 1.37 0.00 0.33 -3.05 105.19 104.05 2d3s n GLY 108 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2d3s n GLY 108 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2d3s n ILE 109 N -2.59 0.07 -3.67 -0.61 -5.35 -0.83 -0.03 119.36 106.34 2d3s n ILE 109 Ca 0.00 -0.29 -0.37 0.00 -0.27 0.00 0.00 62.75 61.83 2d3s n ILE 109 Cb 0.00 0.15 -0.07 0.00 -1.74 0.00 0.00 39.64 37.98 2d3s n ILE 109 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2d3s s TYR 110 N -2.77 3.53 -0.34 4.28 5.04 -1.22 -4.66 117.35 121.21 2d3s s TYR 110 Ca -0.04 0.58 -0.00 0.00 -2.44 0.00 0.00 57.07 55.17 2d3s s TYR 110 Cb 0.07 -2.17 0.11 0.00 0.35 0.00 0.00 41.96 40.32 2d3s s TYR 110 CO 0.49 0.46 0.15 1.21 -1.34 0.00 0.00 175.55 176.52 2d3s s ASN 111 N -0.25 3.78 0.40 4.32 2.47 -1.26 0.12 114.94 124.52 2d3s s ASN 111 Ca 0.15 -1.91 0.14 0.00 0.42 0.00 0.00 52.86 51.66 2d3s s ASN 111 Cb -0.13 -0.81 0.98 0.00 -1.45 0.00 0.00 41.25 39.84 2d3s s ASN 111 CO 0.04 -0.37 1.87 -0.65 -3.72 0.00 0.00 177.10 174.27 2d3s h PRO 112 N 7.66 0.49 -0.78 0.43 0.11 -1.99 0.34 132.00 138.27 2d3s h PRO 112 Ca -0.09 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.02 2d3s h PRO 112 Cb 0.99 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 2d3s h PRO 112 CO 0.45 0.33 0.51 1.37 -0.21 0.00 0.00 178.00 180.45 2d3s h LEU 113 N 0.51 0.85 -5.00 2.35 -0.00 -2.04 -3.38 115.31 108.60 2d3s h LEU 113 Ca 0.45 -0.01 -0.16 0.00 -0.00 0.00 0.00 57.88 58.16 2d3s h LEU 113 Cb 0.97 -0.20 -0.15 0.00 -0.00 0.00 0.00 40.66 41.27 2d3s h LEU 113 CO -0.19 0.60 -0.45 -1.54 -0.00 0.00 0.00 178.44 176.86 2d3s n SER 114 N -4.44 -3.06 -4.69 0.17 3.41 -0.92 -5.15 113.62 98.93 2d3s n SER 114 Ca 0.09 -2.86 -0.41 0.00 -0.26 0.00 0.00 58.87 55.44 2d3s n SER 114 Cb 0.08 1.67 0.01 0.00 -0.26 0.00 0.00 64.21 65.72 2d3s n SER 114 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2d3s n PRO 115 N 2.45 1.85 -4.36 4.33 -0.02 0.06 -4.83 135.00 134.48 2d3s n PRO 115 Ca 0.14 0.66 -0.26 0.00 -2.02 0.00 0.00 63.50 62.02 2d3s n PRO 115 Cb 0.59 -2.36 -0.12 0.00 -0.02 0.00 0.00 33.50 31.59 2d3s n PRO 115 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2d3s s TYR 116 N -1.21 2.08 0.66 6.00 -0.85 -1.26 -5.04 117.35 117.73 2d3s s TYR 116 Ca 0.62 -0.40 -0.16 0.00 -0.52 0.00 0.00 57.07 56.61 2d3s s TYR 116 Cb -0.51 -1.10 0.00 0.00 0.38 0.00 0.00 41.96 40.74 2d3s s TYR 116 CO 0.57 0.33 1.17 -1.25 -1.52 0.00 0.00 175.55 174.85 2d3s s PRO 117 N -2.23 2.61 -0.13 -3.49 0.04 -1.26 -4.97 135.00 125.57 2d3s s PRO 117 Ca 0.13 1.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.53 2d3s s PRO 117 Cb -0.09 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.67 2d3s s PRO 117 CO 0.06 -1.45 0.99 -0.59 0.04 0.00 0.00 177.00 176.05 2d3s s PHE 118 N -1.98 -0.34 -0.06 0.56 -0.12 -1.26 -4.03 117.98 110.75 2d3s s PHE 118 Ca 0.73 0.48 0.04 0.00 -0.05 0.00 0.00 56.93 58.14 2d3s s PHE 118 Cb -0.26 0.48 -0.00 0.00 -0.63 0.00 0.00 43.02 42.60 2d3s s PHE 118 CO 0.40 -0.37 -0.19 0.08 -0.05 0.00 0.00 175.22 175.08 2d3s s VAL 119 N -1.66 1.63 0.03 -2.49 1.01 -0.81 0.60 120.40 118.71 2d3s s VAL 119 Ca 0.01 -0.82 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 2d3s s VAL 119 Cb -0.01 -1.41 0.03 0.00 0.00 0.00 0.00 36.38 35.00 2d3s s VAL 119 CO -0.01 0.46 0.40 0.00 0.00 0.00 0.00 175.10 175.95 2d3s s ALA 120 N 0.09 -1.00 -0.21 5.51 0.00 -0.19 -0.47 121.76 125.49 2d3s s ALA 120 Ca -0.07 0.37 -0.04 0.00 0.00 0.00 0.00 51.96 52.22 2d3s s ALA 120 Cb -0.13 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 2d3s s ALA 120 CO 0.04 -0.41 -0.05 0.08 0.00 0.00 0.00 175.76 175.42 2d3s s VAL 121 N -2.16 3.42 0.10 0.00 1.01 0.50 -0.54 120.40 122.73 2d3s s VAL 121 Ca -0.07 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.48 2d3s s VAL 121 Cb -0.02 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 2d3s s VAL 121 CO -0.00 0.44 -0.01 -1.83 0.00 0.00 0.00 175.10 173.70 2d3s s GLU 122 N 1.27 2.49 -0.42 2.72 -1.05 0.11 -0.76 118.70 123.06 2d3s s GLU 122 Ca 0.03 -0.89 0.03 0.00 -0.15 0.00 0.00 54.97 53.99 2d3s s GLU 122 Cb -0.14 -2.50 0.12 0.00 -0.44 0.00 0.00 34.13 31.17 2d3s s GLU 122 CO -0.02 0.52 0.18 -0.06 0.95 0.00 0.00 175.26 176.84 2d3s s PHE 123 N -1.36 2.75 -0.09 4.83 0.08 -0.12 -1.28 117.98 122.80 2d3s s PHE 123 Ca 0.26 -2.71 -0.19 0.00 0.12 0.00 0.00 56.93 54.41 2d3s s PHE 123 Cb -0.11 -2.41 -0.04 0.00 -0.57 0.00 0.00 43.02 39.88 2d3s s PHE 123 CO 0.18 -0.82 0.52 0.34 -0.10 0.00 0.00 175.22 175.33 2d3s s ASP 124 N 0.46 6.77 -0.00 1.36 -1.08 -0.39 -2.37 116.67 121.42 2d3s s ASP 124 Ca 0.15 0.92 0.03 0.00 -0.52 0.00 0.00 52.55 53.12 2d3s s ASP 124 Cb -0.23 -2.31 -0.03 0.00 -1.46 0.00 0.00 42.92 38.90 2d3s s ASP 124 CO -0.05 0.02 0.11 0.35 0.52 0.00 0.00 175.17 176.11 2d3s n THR 125 N 3.44 0.00 -5.00 1.71 -2.24 -0.38 -1.63 114.28 110.18 2d3s n THR 125 Ca -0.07 -0.43 -0.32 0.00 -2.27 0.00 0.00 64.05 60.96 2d3s n THR 125 Cb 0.52 0.98 -0.15 0.00 -2.10 0.00 0.00 70.33 69.58 2d3s n THR 125 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2d3s s PHE 126 N -1.28 2.63 -0.82 4.78 5.36 -1.20 -4.73 117.98 122.73 2d3s s PHE 126 Ca 0.01 -0.50 -0.21 0.00 -0.96 0.00 0.00 56.93 55.26 2d3s s PHE 126 Cb 0.02 -1.68 0.09 0.00 -0.34 0.00 0.00 43.02 41.11 2d3s s PHE 126 CO 0.11 -0.07 1.10 0.50 -1.46 0.00 0.00 175.22 175.40 2d3s s ARG 127 N -0.22 3.38 1.11 10.12 3.52 -1.26 -4.95 118.95 130.64 2d3s s ARG 127 Ca -0.00 -1.23 -0.18 0.00 -0.13 0.00 0.00 55.73 54.19 2d3s s ARG 127 Cb -0.13 -4.65 0.25 0.00 -1.56 0.00 0.00 34.95 28.86 2d3s s ARG 127 CO 0.03 -1.86 1.19 -0.80 -0.81 0.00 0.00 175.30 173.05 2d3s s ASN 128 N 3.82 1.75 0.23 -2.12 0.01 -1.26 -4.87 114.94 112.51 2d3s s ASN 128 Ca 0.30 0.50 -0.07 0.00 -0.71 0.00 0.00 52.86 52.87 2d3s s ASN 128 Cb -0.09 -0.66 0.21 0.00 0.41 0.00 0.00 41.25 41.12 2d3s s ASN 128 CO -0.00 -3.60 1.88 0.71 -1.51 0.00 0.00 177.10 174.58 2d3s h THR 129 N -2.23 1.25 -0.01 1.60 1.35 -2.00 -2.00 112.91 110.88 2d3s h THR 129 Ca -0.45 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 2d3s h THR 129 Cb 1.27 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 2d3s h THR 129 CO 0.36 0.27 0.00 -2.67 -0.25 0.00 0.00 175.52 173.22 2d3s n TRP 130 N -4.38 0.01 -4.06 4.73 2.14 -1.26 -4.90 117.44 109.72 2d3s n TRP 130 Ca 0.10 -0.00 -0.27 0.00 2.07 0.00 0.00 57.50 59.40 2d3s n TRP 130 Cb 0.06 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 30.51 2d3s n TRP 130 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2d3s s ASP 131 N -1.30 5.66 0.49 -0.67 1.01 -0.75 -4.85 116.67 116.27 2d3s s ASP 131 Ca 0.15 -0.07 -0.00 0.00 0.71 0.00 0.00 52.55 53.34 2d3s s ASP 131 Cb 0.07 -1.53 0.03 0.00 1.01 0.00 0.00 42.92 42.50 2d3s s ASP 131 CO 0.11 0.07 0.21 -0.81 0.21 0.00 0.00 175.17 174.97 2d3s n PRO 132 N -0.32 0.41 -1.70 8.23 -0.04 -1.26 -4.79 135.00 135.53 2d3s n PRO 132 Ca -0.08 -0.56 -0.42 0.00 -0.04 0.00 0.00 63.50 62.40 2d3s n PRO 132 Cb 0.54 -0.15 -0.01 0.00 -0.04 0.00 0.00 33.50 33.85 2d3s n PRO 132 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2d3s n GLN 133 N -1.40 2.14 -4.20 0.54 7.27 -1.26 -4.82 117.38 115.65 2d3s n GLN 133 Ca 0.03 0.75 -0.24 0.00 0.07 0.00 0.00 57.00 57.61 2d3s n GLN 133 Cb 0.12 -2.34 -0.06 0.00 2.41 0.00 0.00 30.24 30.37 2d3s n GLN 133 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 2d3s s ILE 134 N -1.10 3.91 0.71 1.69 -5.25 -1.26 -4.28 121.20 115.62 2d3s s ILE 134 Ca 0.55 -1.53 -0.11 0.00 -0.99 0.00 0.00 60.65 58.57 2d3s s ILE 134 Cb -0.57 -3.05 0.02 0.00 2.95 0.00 0.00 42.46 41.81 2d3s s ILE 134 CO 0.62 -0.25 1.08 -2.84 -1.79 0.00 0.00 174.94 171.76 2d3s s PRO 135 N -3.41 2.84 0.02 0.37 0.02 -1.26 -4.98 135.00 128.59 2d3s s PRO 135 Ca 0.30 0.67 -0.27 0.00 0.02 0.00 0.00 61.00 61.72 2d3s s PRO 135 Cb -0.08 -2.00 0.07 0.00 0.02 0.00 0.00 34.50 32.50 2d3s s PRO 135 CO 0.21 -1.10 0.62 -3.38 -0.33 0.00 0.00 177.00 173.03 2d3s s HIS 136 N -3.21 -0.58 0.19 6.54 -3.43 -0.65 -2.28 115.29 111.88 2d3s s HIS 136 Ca 0.58 0.81 -0.11 0.00 -0.80 0.00 0.00 55.06 55.54 2d3s s HIS 136 Cb -0.12 0.42 -0.07 0.00 -1.43 0.00 0.00 32.58 31.38 2d3s s HIS 136 CO 0.54 -0.66 0.53 0.42 -2.00 0.00 0.00 174.74 173.57 2d3s s ILE 137 N -2.00 4.93 -0.01 -5.38 1.01 0.91 -1.27 121.20 119.40 2d3s s ILE 137 Ca -0.07 0.55 -0.14 0.00 0.00 0.00 0.00 60.65 61.00 2d3s s ILE 137 Cb -0.01 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.83 2d3s s ILE 137 CO 0.03 0.04 0.28 -0.83 0.00 0.00 0.00 174.94 174.46 2d3s s GLY 138 N -2.15 -0.12 -0.23 6.18 0.00 -0.40 -1.94 107.32 108.66 2d3s s GLY 138 Ca 0.44 0.23 -0.05 0.00 0.00 0.00 0.00 44.72 45.34 2d3s s GLY 138 CO 0.20 0.03 -0.01 -0.42 0.00 0.00 0.00 173.10 172.90 2d3s s ILE 139 N -1.42 3.56 -0.16 0.90 1.01 -0.94 -0.71 121.20 123.44 2d3s s ILE 139 Ca -0.13 -0.46 -0.02 0.00 0.00 0.00 0.00 60.65 60.04 2d3s s ILE 139 Cb -0.05 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.75 2d3s s ILE 139 CO 0.03 0.38 -0.10 -1.81 0.00 0.00 0.00 174.94 173.44 2d3s s ASP 140 N 1.50 4.14 -0.26 3.58 1.01 0.30 -1.06 116.67 125.88 2d3s s ASP 140 Ca 0.06 -0.33 0.03 0.00 0.71 0.00 0.00 52.55 53.01 2d3s s ASP 140 Cb -0.15 -1.66 0.06 0.00 1.01 0.00 0.00 42.92 42.19 2d3s s ASP 140 CO -0.02 0.11 -0.10 -0.69 0.21 0.00 0.00 175.17 174.68 2d3s s VAL 141 N 0.69 2.18 0.00 -1.27 1.01 -1.26 -1.03 120.40 120.73 2d3s s VAL 141 Ca -0.05 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.26 2d3s s VAL 141 Cb -0.15 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2d3s s VAL 141 CO 0.02 -0.06 0.00 0.59 0.00 0.00 0.00 175.10 175.65 2d3s n ASN 142 N 4.42 0.00 -3.99 3.32 3.02 0.20 -4.87 115.26 117.36 2d3s n ASN 142 Ca -0.13 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.32 2d3s n ASN 142 Cb 0.42 -1.74 -0.06 0.00 -0.61 0.00 0.00 39.78 37.79 2d3s n ASN 142 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2d3s s SER 143 N -2.16 -0.05 0.00 6.41 1.04 -1.26 -4.83 113.70 112.85 2d3s s SER 143 Ca 0.00 -0.93 0.26 0.00 0.48 0.00 0.00 55.95 55.76 2d3s s SER 143 Cb 0.00 0.53 0.67 0.00 0.10 0.00 0.00 66.02 67.32 2d3s s SER 143 CO 0.00 -1.04 1.52 0.52 0.98 0.00 0.00 173.24 175.22 2d3s n VAL 144 N -0.32 0.00 -2.75 5.02 0.31 -1.26 -4.60 118.33 114.73 2d3s n VAL 144 Ca -0.03 -0.07 -0.42 0.00 -0.01 0.00 0.00 64.34 63.81 2d3s n VAL 144 Cb 0.63 0.30 -0.03 0.00 -0.91 0.00 0.00 33.84 33.82 2d3s n VAL 144 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2d3s s ILE 145 N -2.73 4.18 0.32 2.52 1.01 -1.26 -4.98 121.20 120.26 2d3s s ILE 145 Ca 0.18 -0.38 -0.28 0.00 0.00 0.00 0.00 60.65 60.18 2d3s s ILE 145 Cb 0.18 -4.80 -0.13 0.00 0.01 0.00 0.00 42.46 37.72 2d3s s ILE 145 CO 0.60 -1.63 1.13 -1.20 0.00 0.00 0.00 174.94 173.84 2d3s n SER 146 N 8.11 1.90 0.04 3.58 7.64 -1.26 -4.78 113.62 128.85 2d3s n SER 146 Ca 0.06 1.18 -0.11 0.00 1.01 0.00 0.00 58.87 61.01 2d3s n SER 146 Cb 0.48 -1.38 0.01 0.00 -1.01 0.00 0.00 64.21 62.31 2d3s n SER 146 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2d3s h THR 147 N 2.17 1.36 -3.94 0.44 1.35 -1.47 -3.45 112.91 109.37 2d3s h THR 147 Ca -0.43 -2.12 -0.17 0.00 -0.55 0.00 0.00 66.41 63.14 2d3s h THR 147 Cb 1.32 2.10 -0.21 0.00 -1.73 0.00 0.00 68.15 69.63 2d3s h THR 147 CO 0.61 0.64 -0.69 -0.75 -0.25 0.00 0.00 175.52 175.09 2d3s s LYS 148 N -3.62 0.32 -0.08 4.72 2.47 -1.25 -5.03 119.74 117.26 2d3s s LYS 148 Ca -0.06 -0.58 -0.10 0.00 -1.56 0.00 0.00 55.97 53.66 2d3s s LYS 148 Cb 0.10 0.11 0.02 0.00 -1.46 0.00 0.00 37.83 36.61 2d3s s LYS 148 CO 0.85 -0.05 0.26 0.99 0.16 0.00 0.00 175.35 177.55 2d3s s THR 149 N -1.43 0.02 -0.01 3.43 2.01 -1.26 -2.22 115.64 116.17 2d3s s THR 149 Ca -0.16 -0.15 0.01 0.00 0.31 0.00 0.00 61.69 61.71 2d3s s THR 149 Cb -0.10 -0.42 0.01 0.00 0.01 0.00 0.00 72.50 72.01 2d3s s THR 149 CO -0.01 -0.08 -0.02 0.54 -0.69 0.00 0.00 174.62 174.36 2d3s s VAL 150 N -0.24 0.23 0.41 3.82 0.11 -0.82 -4.99 120.40 118.93 2d3s s VAL 150 Ca -0.04 -0.05 -0.11 0.00 -2.93 0.00 0.00 61.98 58.85 2d3s s VAL 150 Cb -0.03 -0.25 -0.07 0.00 -1.53 0.00 0.00 36.38 34.50 2d3s s VAL 150 CO 0.01 0.11 0.79 -2.16 -3.33 0.00 0.00 175.10 170.52 2d3s s PRO 151 N 0.40 3.80 0.17 1.54 0.04 -1.26 -0.06 135.00 139.63 2d3s s PRO 151 Ca -0.04 0.52 -0.10 0.00 0.04 0.00 0.00 61.00 61.42 2d3s s PRO 151 Cb -0.07 -2.37 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 2d3s s PRO 151 CO -0.01 -0.06 0.33 -0.59 0.04 0.00 0.00 177.00 176.71 2d3s s PHE 152 N -2.39 0.32 -0.26 0.56 -0.12 -0.96 -4.87 117.98 110.26 2d3s s PHE 152 Ca 0.52 -0.68 -0.05 0.00 -0.05 0.00 0.00 56.93 56.68 2d3s s PHE 152 Cb -0.10 0.02 0.00 0.00 -0.63 0.00 0.00 43.02 42.31 2d3s s PHE 152 CO 0.31 -0.76 0.01 0.99 -0.05 0.00 0.00 175.22 175.72 2d3s s THR 153 N -3.95 3.53 0.45 -4.49 2.01 -1.26 -4.01 115.64 107.92 2d3s s THR 153 Ca 0.16 -0.67 -0.24 0.00 0.31 0.00 0.00 61.69 61.25 2d3s s THR 153 Cb 0.03 -2.74 -0.07 0.00 0.01 0.00 0.00 72.50 69.72 2d3s s THR 153 CO -0.00 0.24 1.23 -0.22 -0.69 0.00 0.00 174.62 175.18 2d3s s LEU 154 N 1.46 4.06 -0.95 4.42 2.96 -1.26 -4.96 118.68 124.41 2d3s s LEU 154 Ca 0.03 2.47 -0.12 0.00 -0.22 0.00 0.00 54.13 56.30 2d3s s LEU 154 Cb -0.16 -4.13 0.24 0.00 0.50 0.00 0.00 46.19 42.64 2d3s s LEU 154 CO -0.01 -0.97 0.92 -0.62 -1.32 0.00 0.00 176.35 174.35 2d3s s ASP 155 N -1.11 7.00 -0.48 3.68 2.15 -1.26 -5.00 116.67 121.65 2d3s s ASP 155 Ca 0.62 -3.06 -0.45 0.00 0.43 0.00 0.00 52.55 50.10 2d3s s ASP 155 Cb -0.33 -2.21 -0.19 0.00 -0.30 0.00 0.00 42.92 39.88 2d3s s ASP 155 CO 0.41 -0.46 1.87 -3.20 -0.17 0.00 0.00 175.17 173.61 2d3s n ASN 156 N 3.50 1.10 0.00 -0.34 2.85 -1.26 0.18 115.26 121.29 2d3s n ASN 156 Ca 0.18 0.93 0.00 0.00 -0.11 0.00 0.00 54.58 55.58 2d3s n ASN 156 Cb 0.44 -0.92 0.00 0.00 1.24 0.00 0.00 39.78 40.54 2d3s n ASN 156 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2d3s n GLY 157 N 5.65 1.62 3.91 8.20 0.00 -0.63 -4.96 105.19 118.98 2d3s n GLY 157 Ca 0.42 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.14 2d3s n GLY 157 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2d3s s GLY 158 N -2.00 1.66 -0.03 -0.02 0.00 0.46 -4.87 107.32 102.53 2d3s s GLY 158 Ca 0.00 -0.86 -0.13 0.00 0.00 0.00 0.00 44.72 43.73 2d3s s GLY 158 CO 0.00 -0.26 0.34 -0.42 0.00 0.00 0.00 173.10 172.76 2d3s s ILE 159 N -3.69 5.15 -0.04 0.90 1.01 -1.26 -4.32 121.20 118.94 2d3s s ILE 159 Ca 0.67 0.68 0.06 0.00 0.00 0.00 0.00 60.65 62.06 2d3s s ILE 159 Cb -0.08 -3.64 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 2d3s s ILE 159 CO 0.51 0.59 -0.23 0.00 0.00 0.00 0.00 174.94 175.80 2d3s s ALA 160 N -1.04 2.00 -0.21 9.38 0.00 -0.41 -4.15 121.76 127.34 2d3s s ALA 160 Ca 0.22 -0.98 -0.05 0.00 0.00 0.00 0.00 51.96 51.14 2d3s s ALA 160 Cb -0.15 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 2d3s s ALA 160 CO 0.11 0.42 0.00 -0.80 0.00 0.00 0.00 175.76 175.49 2d3s s ASN 161 N -0.25 4.79 -0.04 0.00 0.01 0.25 -1.86 114.94 117.83 2d3s s ASN 161 Ca 0.00 -0.23 0.05 0.00 -0.71 0.00 0.00 52.86 51.97 2d3s s ASN 161 Cb -0.12 -1.83 -0.02 0.00 0.41 0.00 0.00 41.25 39.69 2d3s s ASN 161 CO 0.02 0.03 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.75 2d3s s VAL 162 N 1.18 2.55 -0.11 1.60 1.01 -0.18 0.02 120.40 126.46 2d3s s VAL 162 Ca 0.03 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.11 2d3s s VAL 162 Cb -0.14 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.30 2d3s s VAL 162 CO 0.01 0.58 -0.12 -0.69 0.00 0.00 0.00 175.10 174.89 2d3s s VAL 163 N -0.56 1.27 -0.16 2.92 1.01 -0.14 -2.32 120.40 122.42 2d3s s VAL 163 Ca 0.08 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.59 2d3s s VAL 163 Cb -0.11 -1.21 0.03 0.00 0.00 0.00 0.00 36.38 35.09 2d3s s VAL 163 CO 0.01 0.40 -0.14 -0.63 0.00 0.00 0.00 175.10 174.74 2d3s s ILE 164 N 1.32 1.63 0.01 2.22 1.01 -0.19 -0.03 121.20 127.16 2d3s s ILE 164 Ca -0.01 -0.75 0.08 0.00 0.00 0.00 0.00 60.65 59.96 2d3s s ILE 164 Cb -0.14 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 2d3s s ILE 164 CO -0.05 0.39 -0.24 -0.75 0.00 0.00 0.00 174.94 174.29 2d3s s LYS 165 N 1.45 1.82 -0.15 2.79 2.20 -0.16 -0.61 119.74 127.07 2d3s s LYS 165 Ca 0.03 -0.92 -0.01 0.00 -0.36 0.00 0.00 55.97 54.72 2d3s s LYS 165 Cb -0.14 -1.83 0.04 0.00 -1.51 0.00 0.00 37.83 34.39 2d3s s LYS 165 CO -0.10 0.49 -0.05 -0.47 -0.36 0.00 0.00 175.35 174.86 2d3s s TYR 166 N -0.65 1.56 -0.41 4.03 5.04 0.13 -1.25 117.35 125.81 2d3s s TYR 166 Ca 0.09 -0.96 -0.14 0.00 -2.44 0.00 0.00 57.07 53.62 2d3s s TYR 166 Cb -0.09 -1.25 0.02 0.00 0.35 0.00 0.00 41.96 40.99 2d3s s TYR 166 CO 0.00 -0.58 0.29 0.34 -1.34 0.00 0.00 175.55 174.26 2d3s s ASP 167 N 1.68 6.06 0.35 4.32 2.15 -0.88 -1.83 116.67 128.52 2d3s s ASP 167 Ca 0.02 -0.94 0.03 0.00 0.43 0.00 0.00 52.55 52.09 2d3s s ASP 167 Cb -0.15 -2.14 0.64 0.00 -0.30 0.00 0.00 42.92 40.97 2d3s s ASP 167 CO -0.08 -0.45 1.97 0.00 -0.17 0.00 0.00 175.17 176.44 2d3s h ALA 168 N 8.61 1.50 0.00 3.66 0.00 -1.88 0.34 119.26 131.49 2d3s h ALA 168 Ca -0.27 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 2d3s h ALA 168 Cb 1.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2d3s h ALA 168 CO 0.73 0.41 -0.23 0.66 0.00 0.00 0.00 179.25 180.82 2d3s h SER 169 N 0.72 0.00 -0.00 0.00 4.64 -1.93 -3.13 113.55 113.85 2d3s h SER 169 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2d3s h SER 169 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2d3s h SER 169 CO -0.03 0.23 -0.26 0.35 -0.87 0.00 0.00 176.83 176.25 2d3s n THR 170 N -3.78 0.00 -1.84 2.95 -2.24 -1.04 -4.99 114.28 103.35 2d3s n THR 170 Ca -0.01 -0.37 -0.17 0.00 -2.27 0.00 0.00 64.05 61.22 2d3s n THR 170 Cb 0.33 1.03 -0.05 0.00 -2.10 0.00 0.00 70.33 69.55 2d3s n THR 170 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2d3s n LYS 171 N -0.84 -1.28 -3.36 -0.78 5.02 0.12 -4.91 118.16 112.13 2d3s n LYS 171 Ca 0.02 1.00 -0.38 0.00 -2.02 0.00 0.00 58.31 56.93 2d3s n LYS 171 Cb 0.13 -5.34 -0.07 0.00 -0.02 0.00 0.00 35.03 29.73 2d3s n LYS 171 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2d3s s ILE 172 N -2.74 5.18 -0.38 -0.18 1.01 -1.13 -0.34 121.20 122.63 2d3s s ILE 172 Ca 0.00 0.77 -0.09 0.00 0.00 0.00 0.00 60.65 61.32 2d3s s ILE 172 Cb 0.00 -3.75 0.05 0.00 0.01 0.00 0.00 42.46 38.76 2d3s s ILE 172 CO 0.00 0.24 0.20 -0.22 0.00 0.00 0.00 174.94 175.16 2d3s s LEU 173 N 1.33 4.77 -0.06 2.97 2.96 0.55 -2.07 118.68 129.14 2d3s s LEU 173 Ca 0.20 -1.20 0.03 0.00 -0.22 0.00 0.00 54.13 52.94 2d3s s LEU 173 Cb -0.15 -1.98 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 2d3s s LEU 173 CO 0.08 -0.42 -0.14 -1.38 -1.32 0.00 0.00 176.35 173.17 2d3s s HIS 174 N 1.48 2.73 0.01 5.38 -3.43 -0.38 -1.57 115.29 119.51 2d3s s HIS 174 Ca 0.01 -0.20 0.05 0.00 -0.80 0.00 0.00 55.06 54.12 2d3s s HIS 174 Cb -0.20 -1.66 -0.02 0.00 -1.43 0.00 0.00 32.58 29.27 2d3s s HIS 174 CO 0.04 0.15 -0.15 0.14 -2.00 0.00 0.00 174.74 172.93 2d3s s VAL 175 N -0.61 1.17 -0.06 -5.38 -7.23 0.02 -0.99 120.40 107.33 2d3s s VAL 175 Ca 0.09 -0.78 0.04 0.00 -1.81 0.00 0.00 61.98 59.52 2d3s s VAL 175 Cb -0.11 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.83 2d3s s VAL 175 CO 0.01 0.21 -0.18 -0.69 -0.31 0.00 0.00 175.10 174.15 2d3s s VAL 176 N -0.53 1.52 -0.16 1.32 1.01 0.95 -2.17 120.40 122.34 2d3s s VAL 176 Ca 0.04 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2d3s s VAL 176 Cb -0.06 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.01 2d3s s VAL 176 CO 0.00 0.44 -0.18 -0.22 0.00 0.00 0.00 175.10 175.13 2d3s s LEU 177 N 0.19 2.28 -0.04 3.92 2.96 0.11 -0.97 118.68 127.14 2d3s s LEU 177 Ca -0.08 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.29 2d3s s LEU 177 Cb -0.14 -1.51 0.01 0.00 0.50 0.00 0.00 46.19 45.06 2d3s s LEU 177 CO 0.04 0.06 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.36 2d3s s VAL 178 N 0.92 0.76 -0.65 1.68 1.01 0.10 -1.08 120.40 123.15 2d3s s VAL 178 Ca -0.04 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.58 2d3s s VAL 178 Cb -0.15 -0.71 0.17 0.00 0.00 0.00 0.00 36.38 35.69 2d3s s VAL 178 CO -0.03 0.26 0.49 -0.36 0.00 0.00 0.00 175.10 175.46 2d3s s PHE 179 N 0.48 3.48 0.28 5.22 0.08 -1.08 0.85 117.98 127.29 2d3s s PHE 179 Ca -0.08 -2.56 0.01 0.00 0.12 0.00 0.00 56.93 54.42 2d3s s PHE 179 Cb -0.12 -3.32 0.66 0.00 -0.57 0.00 0.00 43.02 39.67 2d3s s PHE 179 CO 0.01 -0.87 1.66 -1.00 -0.10 0.00 0.00 175.22 174.92 2d3s h PRO 180 N 7.22 0.25 -0.48 0.24 0.13 -1.86 0.47 132.00 137.97 2d3s h PRO 180 Ca -0.00 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.15 2d3s h PRO 180 Cb 0.97 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.01 2d3s h PRO 180 CO 0.72 0.17 0.25 0.77 -0.23 0.00 0.00 178.00 179.68 2d3s h SER 181 N 0.26 0.37 1.42 1.44 0.02 -1.94 -2.32 113.55 112.80 2d3s h SER 181 Ca 0.52 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 2d3s h SER 181 Cb 1.01 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2d3s h SER 181 CO -0.60 0.26 -0.47 -0.07 -1.14 0.00 0.00 176.83 174.81 2d3s h LEU 182 N 0.49 0.00 0.63 5.07 3.38 -1.77 -3.47 115.31 119.64 2d3s h LEU 182 Ca 0.21 -0.03 -0.21 0.00 0.09 0.00 0.00 57.88 57.94 2d3s h LEU 182 Cb 0.10 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 2d3s h LEU 182 CO -0.14 0.01 -0.20 0.61 0.09 0.00 0.00 178.44 178.82 2d3s n GLY 183 N 1.18 0.98 3.83 0.83 0.00 0.16 -5.01 105.19 107.17 2d3s n GLY 183 Ca 0.02 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.14 2d3s n GLY 183 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d3s s THR 184 N -2.40 4.76 -0.10 2.61 -4.23 -1.19 -4.95 115.64 110.14 2d3s s THR 184 Ca 0.00 0.97 0.02 0.00 -1.18 0.00 0.00 61.69 61.50 2d3s s THR 184 Cb 0.00 -3.77 0.02 0.00 1.34 0.00 0.00 72.50 70.09 2d3s s THR 184 CO 0.00 0.22 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.53 2d3s s ILE 185 N -1.50 1.40 -0.03 2.99 1.01 -1.26 -2.63 121.20 121.18 2d3s s ILE 185 Ca 0.40 -0.59 0.06 0.00 0.00 0.00 0.00 60.65 60.53 2d3s s ILE 185 Cb -0.15 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 2d3s s ILE 185 CO 0.20 0.42 -0.22 -0.31 0.00 0.00 0.00 174.94 175.03 2d3s s TYR 186 N 1.00 2.03 0.02 3.97 2.02 -0.24 -5.01 117.35 121.14 2d3s s TYR 186 Ca -0.07 -0.44 0.01 0.00 -0.37 0.00 0.00 57.07 56.20 2d3s s TYR 186 Cb -0.15 -1.32 -0.02 0.00 -0.40 0.00 0.00 41.96 40.08 2d3s s TYR 186 CO -0.01 -0.07 -0.04 -0.08 -1.57 0.00 0.00 175.55 173.77 2d3s s THR 187 N -0.41 0.22 -0.16 -0.71 -1.32 -1.26 -0.71 115.64 111.28 2d3s s THR 187 Ca 0.06 -0.72 -0.19 0.00 -1.21 0.00 0.00 61.69 59.63 2d3s s THR 187 Cb -0.10 -0.31 0.05 0.00 -1.51 0.00 0.00 72.50 70.64 2d3s s THR 187 CO 0.00 -0.32 0.52 -0.51 -2.21 0.00 0.00 174.62 172.10 2d3s s ILE 188 N -1.04 0.01 0.06 5.08 2.07 -0.92 -4.96 121.20 121.49 2d3s s ILE 188 Ca -0.10 -0.05 -0.06 0.00 -1.41 0.00 0.00 60.65 59.03 2d3s s ILE 188 Cb -0.07 -0.74 -0.01 0.00 0.13 0.00 0.00 42.46 41.76 2d3s s ILE 188 CO -0.00 -0.03 0.12 0.00 -1.91 0.00 0.00 174.94 173.12 2d3s s ALA 189 N -0.03 -0.05 0.01 1.50 0.00 -1.26 -0.80 121.76 121.13 2d3s s ALA 189 Ca -0.02 -0.68 -0.28 0.00 0.00 0.00 0.00 51.96 50.98 2d3s s ALA 189 Cb -0.03 0.35 0.09 0.00 0.00 0.00 0.00 23.12 23.53 2d3s s ALA 189 CO 0.02 -0.41 0.77 0.34 0.00 0.00 0.00 175.76 176.48 2d3s s ASP 190 N -2.57 -0.50 -0.12 0.00 -1.08 -0.61 -4.99 116.67 106.81 2d3s s ASP 190 Ca 0.01 0.24 -0.23 0.00 -0.52 0.00 0.00 52.55 52.06 2d3s s ASP 190 Cb 0.03 0.47 -0.03 0.00 -1.46 0.00 0.00 42.92 41.93 2d3s s ASP 190 CO -0.08 -0.67 0.69 -0.63 0.52 0.00 0.00 175.17 175.00 2d3s s ILE 191 N -2.50 5.02 -0.03 4.11 1.01 -1.26 -0.33 121.20 127.22 2d3s s ILE 191 Ca -0.01 1.38 -0.00 0.00 0.00 0.00 0.00 60.65 62.02 2d3s s ILE 191 Cb -0.01 -4.02 0.03 0.00 0.01 0.00 0.00 42.46 38.47 2d3s s ILE 191 CO -0.04 0.18 0.02 -0.69 0.00 0.00 0.00 174.94 174.42 2d3s s VAL 192 N 1.30 0.02 -0.73 2.92 1.01 0.54 -4.95 120.40 120.52 2d3s s VAL 192 Ca 0.35 0.20 -0.14 0.00 0.00 0.00 0.00 61.98 62.39 2d3s s VAL 192 Cb -0.17 -0.16 0.19 0.00 0.00 0.00 0.00 36.38 36.24 2d3s s VAL 192 CO 0.15 0.12 0.67 -0.62 0.00 0.00 0.00 175.10 175.41 2d3s s ASP 193 N 1.21 6.51 0.30 3.32 -1.08 -1.26 -4.69 116.67 120.98 2d3s s ASP 193 Ca -0.07 -2.41 0.01 0.00 -0.52 0.00 0.00 52.55 49.55 2d3s s ASP 193 Cb -0.13 -2.19 0.54 0.00 -1.46 0.00 0.00 42.92 39.68 2d3s s ASP 193 CO -0.03 -0.65 1.88 -0.07 0.52 0.00 0.00 175.17 176.82 2d3s h LEU 194 N 8.09 0.91 -1.92 -1.34 3.38 -1.96 -0.48 115.31 121.99 2d3s h LEU 194 Ca -0.02 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2d3s h LEU 194 Cb 1.06 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 2d3s h LEU 194 CO 0.84 0.55 -0.11 0.50 0.09 0.00 0.00 178.44 180.30 2d3s h LYS 195 N 1.01 0.00 0.00 1.13 3.64 -1.91 0.11 116.57 120.55 2d3s h LYS 195 Ca 0.43 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 2d3s h LYS 195 Cb 0.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2d3s h LYS 195 CO -0.19 0.11 -0.68 0.94 -2.27 0.00 0.00 179.45 177.37 2d3s n GLN 196 N -4.01 0.26 -0.03 1.90 -0.06 -0.22 -4.49 117.38 110.73 2d3s n GLN 196 Ca -0.02 0.06 -0.04 0.00 -2.00 0.00 0.00 57.00 55.00 2d3s n GLN 196 Cb 0.20 -1.65 -0.04 0.00 -4.06 0.00 0.00 30.24 24.69 2d3s n GLN 196 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 2d3s n VAL 197 N -2.02 0.42 -4.30 1.69 0.24 -0.77 -5.08 118.33 108.51 2d3s n VAL 197 Ca 0.03 -0.21 -0.23 0.00 -2.04 0.00 0.00 64.34 61.89 2d3s n VAL 197 Cb 0.43 -0.81 -0.07 0.00 -1.47 0.00 0.00 33.84 31.92 2d3s n VAL 197 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2d3s s LEU 198 N -4.94 3.15 0.79 1.34 1.43 0.31 -4.75 118.68 116.01 2d3s s LEU 198 Ca -0.07 -0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 52.23 2d3s s LEU 198 Cb 0.02 -1.66 0.06 0.00 0.03 0.00 0.00 46.19 44.64 2d3s s LEU 198 CO 0.21 -0.01 1.12 -2.16 0.23 0.00 0.00 176.35 175.74 2d3s s PRO 199 N -3.67 2.18 0.29 1.29 0.04 -1.26 -4.67 135.00 129.20 2d3s s PRO 199 Ca 0.32 0.45 0.03 0.00 0.04 0.00 0.00 61.00 61.84 2d3s s PRO 199 Cb -0.06 -1.94 0.63 0.00 0.04 0.00 0.00 34.50 33.17 2d3s s PRO 199 CO 0.20 -1.51 1.80 0.93 0.04 0.00 0.00 177.00 178.45 2d3s h GLU 200 N -1.01 0.82 -5.70 4.56 5.08 -1.96 -3.41 114.58 112.97 2d3s h GLU 200 Ca -0.47 -0.05 -0.67 0.00 -1.00 0.00 0.00 59.36 57.18 2d3s h GLU 200 Cb 1.28 -0.19 -0.23 0.00 0.50 0.00 0.00 28.75 30.12 2d3s h GLU 200 CO 0.62 0.55 -0.72 -1.12 -1.00 0.00 0.00 179.01 177.33 2d3s s SER 201 N -5.54 4.36 0.31 1.42 0.01 -1.26 0.21 113.70 113.21 2d3s s SER 201 Ca -0.12 -0.18 0.05 0.00 1.31 0.00 0.00 55.95 57.01 2d3s s SER 201 Cb 0.23 -1.40 -0.03 0.00 0.21 0.00 0.00 66.02 65.03 2d3s s SER 201 CO 0.80 0.25 0.22 0.68 0.41 0.00 0.00 173.24 175.60 2d3s s VAL 202 N -0.13 0.09 0.04 3.43 -7.23 0.02 -4.19 120.40 112.42 2d3s s VAL 202 Ca 0.00 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.25 2d3s s VAL 202 Cb -0.13 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 2d3s s VAL 202 CO 0.03 0.00 -0.21 0.20 -0.31 0.00 0.00 175.10 174.81 2d3s s ASN 203 N -3.35 3.56 0.13 4.85 0.02 0.32 -0.57 114.94 119.90 2d3s s ASN 203 Ca 0.38 -0.48 0.11 0.00 -1.02 0.00 0.00 52.86 51.85 2d3s s ASN 203 Cb 0.04 -0.49 -0.04 0.00 0.02 0.00 0.00 41.25 40.77 2d3s s ASN 203 CO 0.22 0.26 -0.26 0.68 0.02 0.00 0.00 177.10 178.02 2d3s s VAL 204 N -0.87 2.29 -2.15 1.60 -7.23 -1.26 -1.48 120.40 111.30 2d3s s VAL 204 Ca 0.13 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 2d3s s VAL 204 Cb -0.10 -2.02 0.00 0.00 0.56 0.00 0.00 36.38 34.82 2d3s s VAL 204 CO 0.04 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.52 2d3s n GLY 205 N 0.89 -0.88 3.40 2.32 0.00 -0.76 -1.48 105.19 108.68 2d3s n GLY 205 Ca -0.18 -0.89 -0.21 0.00 0.00 0.00 0.00 46.02 44.74 2d3s n GLY 205 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2d3s s PHE 206 N -3.00 1.95 -0.07 1.61 0.40 -0.20 -0.80 117.98 117.88 2d3s s PHE 206 Ca 0.00 -0.49 -0.19 0.00 -0.60 0.00 0.00 56.93 55.65 2d3s s PHE 206 Cb 0.00 -0.90 0.04 0.00 0.51 0.00 0.00 43.02 42.67 2d3s s PHE 206 CO 0.00 0.49 0.44 0.45 0.70 0.00 0.00 175.22 177.30 2d3s s SER 207 N -3.40 -0.38 0.20 1.36 0.15 -0.65 -1.18 113.70 109.79 2d3s s SER 207 Ca 0.26 0.47 -0.15 0.00 0.70 0.00 0.00 55.95 57.23 2d3s s SER 207 Cb -0.02 0.55 0.01 0.00 -1.71 0.00 0.00 66.02 64.85 2d3s s SER 207 CO 0.10 -0.40 0.46 0.00 1.20 0.00 0.00 173.24 174.60 2d3s s ALA 208 N -0.85 -0.61 -0.04 5.45 0.00 -0.48 -0.29 121.76 124.94 2d3s s ALA 208 Ca -0.09 -0.48 -0.26 0.00 0.00 0.00 0.00 51.96 51.12 2d3s s ALA 208 Cb -0.03 0.88 0.06 0.00 0.00 0.00 0.00 23.12 24.02 2d3s s ALA 208 CO 0.05 -0.78 0.56 0.00 0.00 0.00 0.00 175.76 175.59 2d3s s ALA 209 N -3.92 -1.46 0.47 0.00 0.00 -1.03 -2.14 121.76 113.68 2d3s s ALA 209 Ca 0.13 1.01 0.07 0.00 0.00 0.00 0.00 51.96 53.17 2d3s s ALA 209 Cb -0.00 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.16 2d3s s ALA 209 CO -0.00 -0.34 0.46 0.95 0.00 0.00 0.00 175.76 176.83 2d3s s THR 210 N -1.25 2.37 0.20 0.00 -4.23 0.79 0.59 115.64 114.11 2d3s s THR 210 Ca -0.12 -1.30 -0.29 0.00 -1.18 0.00 0.00 61.69 58.81 2d3s s THR 210 Cb -0.02 -2.67 -0.17 0.00 1.34 0.00 0.00 72.50 70.98 2d3s s THR 210 CO 0.08 0.00 0.59 0.61 -0.54 0.00 0.00 174.62 175.37 2d3s n GLY 211 N -1.73 -1.54 3.82 3.99 0.00 0.17 -3.97 105.19 105.94 2d3s n GLY 211 Ca 0.05 0.36 -0.36 0.00 0.00 0.00 0.00 46.02 46.07 2d3s n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2d3s s ASP 212 N -0.90 7.02 0.30 1.61 2.15 -1.26 0.19 116.67 125.78 2d3s s ASP 212 Ca 0.65 1.34 0.05 0.00 0.43 0.00 0.00 52.55 55.02 2d3s s ASP 212 Cb -0.93 -2.39 0.73 0.00 -0.30 0.00 0.00 42.92 40.03 2d3s s ASP 212 CO 0.56 0.08 1.76 -0.65 -0.17 0.00 0.00 175.17 176.76 2d3s h PRO 213 N 3.62 0.67 0.00 4.34 0.11 -1.93 0.44 132.00 139.24 2d3s h PRO 213 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2d3s h PRO 213 Cb 1.20 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2d3s h PRO 213 CO 0.65 0.44 0.12 0.66 -0.21 0.00 0.00 178.00 179.67 2d3s h SER 214 N 0.69 0.00 1.54 -2.05 4.64 -1.99 0.31 113.55 116.69 2d3s h SER 214 Ca 0.57 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 2d3s h SER 214 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2d3s h SER 214 CO -0.41 0.00 0.00 1.23 -0.87 0.00 0.00 176.83 176.78 2d3s h GLY 215 N 0.00 0.00 -0.73 -0.77 0.00 -1.29 -3.47 103.07 96.81 2d3s h GLY 215 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 2d3s h GLY 215 CO 0.00 0.00 -0.29 0.28 0.00 0.00 0.00 176.54 176.53 2d3s n LYS 216 N -2.41 -1.27 -3.92 4.80 4.76 0.11 -4.98 118.16 115.26 2d3s n LYS 216 Ca 0.05 1.03 -0.29 0.00 -2.87 0.00 0.00 58.31 56.23 2d3s n LYS 216 Cb 0.44 -5.27 -0.16 0.00 -1.84 0.00 0.00 35.03 28.20 2d3s n LYS 216 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2d3s s GLN 217 N -3.26 1.60 0.30 1.97 -1.52 -1.26 -5.00 119.66 112.49 2d3s s GLN 217 Ca 0.00 -0.66 0.13 0.00 -1.95 0.00 0.00 55.36 52.88 2d3s s GLN 217 Cb 0.00 -2.19 0.46 0.00 -0.22 0.00 0.00 33.01 31.06 2d3s s GLN 217 CO 0.00 -0.46 1.65 0.00 -0.25 0.00 0.00 175.29 176.24 2d3s h ARG 218 N 8.06 0.00 0.00 2.91 3.08 -1.96 -2.85 114.38 123.62 2d3s h ARG 218 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2d3s h ARG 218 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2d3s h ARG 218 CO 0.42 0.54 0.00 0.09 -1.07 0.00 0.00 179.97 179.95 2d3s n ASN 219 N -3.74 0.00 -3.99 7.04 3.02 -1.26 -4.36 115.26 111.97 2d3s n ASN 219 Ca -0.01 -0.92 -0.42 0.00 -0.03 0.00 0.00 54.58 53.20 2d3s n ASN 219 Cb 0.58 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 2d3s n ASN 219 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2d3s n ALA 220 N -0.92 4.94 -3.72 5.41 0.00 -1.08 -4.52 120.51 120.61 2d3s n ALA 220 Ca 0.16 -3.90 -0.08 0.00 0.00 0.00 0.00 53.44 49.62 2d3s n ALA 220 Cb 0.07 -3.52 -0.01 0.00 0.00 0.00 0.00 19.45 15.99 2d3s n ALA 220 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2d3s s THR 221 N 3.33 0.00 0.03 0.00 -1.32 -1.25 0.47 115.64 116.90 2d3s s THR 221 Ca 0.49 -1.08 -0.27 0.00 -1.21 0.00 0.00 61.69 59.62 2d3s s THR 221 Cb 0.11 -2.35 0.09 0.00 -1.51 0.00 0.00 72.50 68.83 2d3s s THR 221 CO -0.04 0.00 1.22 -1.83 -2.21 0.00 0.00 174.62 171.77 2d3s s GLU 222 N -3.34 0.62 0.26 7.08 -1.05 -1.24 -4.04 118.70 116.99 2d3s s GLU 222 Ca 0.15 -0.40 0.04 0.00 -0.15 0.00 0.00 54.97 54.61 2d3s s GLU 222 Cb -0.05 0.17 -0.03 0.00 -0.44 0.00 0.00 34.13 33.78 2d3s s GLU 222 CO 0.09 -0.29 0.39 0.95 0.95 0.00 0.00 175.26 177.36 2d3s s THR 223 N -2.05 5.17 -0.42 1.83 -4.23 -0.22 -4.82 115.64 110.90 2d3s s THR 223 Ca 0.28 -0.91 0.04 0.00 -1.18 0.00 0.00 61.69 59.92 2d3s s THR 223 Cb -0.01 -3.84 0.17 0.00 1.34 0.00 0.00 72.50 70.17 2d3s s THR 223 CO 0.01 -0.35 0.39 -1.00 -0.54 0.00 0.00 174.62 173.12 2d3s s HIS 224 N -2.04 0.74 -0.14 3.99 0.09 -1.26 -3.72 115.29 112.95 2d3s s HIS 224 Ca 0.35 -2.10 -0.06 0.00 -0.00 0.00 0.00 55.06 53.25 2d3s s HIS 224 Cb -0.09 -0.76 -0.04 0.00 -0.00 0.00 0.00 32.58 31.69 2d3s s HIS 224 CO 0.30 -0.89 0.08 -0.51 -0.00 0.00 0.00 174.74 173.72 2d3s s ASP 225 N 0.17 5.84 -0.29 1.40 1.01 -0.62 -1.74 116.67 122.44 2d3s s ASP 225 Ca 0.33 0.24 -0.08 0.00 0.71 0.00 0.00 52.55 53.74 2d3s s ASP 225 Cb 0.03 -1.89 -0.01 0.00 1.01 0.00 0.00 42.92 42.06 2d3s s ASP 225 CO -0.18 0.30 0.11 -0.63 0.21 0.00 0.00 175.17 174.98 2d3s s ILE 226 N -0.41 4.36 -0.05 0.77 -1.09 0.12 -0.58 121.20 124.31 2d3s s ILE 226 Ca 0.10 -0.40 -0.10 0.00 -2.23 0.00 0.00 60.65 58.02 2d3s s ILE 226 Cb -0.12 -3.17 -0.30 0.00 -1.58 0.00 0.00 42.46 37.29 2d3s s ILE 226 CO 0.02 0.16 0.64 -0.07 -1.23 0.00 0.00 174.94 174.45 2d3s h LEU 227 N 8.29 0.58 -7.61 2.97 4.07 -1.29 -1.43 115.31 120.89 2d3s h LEU 227 Ca -0.34 -0.91 -0.04 0.00 0.08 0.00 0.00 57.88 56.66 2d3s h LEU 227 Cb 1.15 -0.19 -0.12 0.00 1.08 0.00 0.00 40.66 42.59 2d3s h LEU 227 CO 0.60 1.78 -0.06 -0.94 -1.08 0.00 0.00 178.44 178.74 2d3s s SER 228 N -7.24 -0.21 -0.30 -0.43 1.04 -1.22 -4.42 113.70 100.92 2d3s s SER 228 Ca -0.16 -0.46 -0.14 0.00 0.48 0.00 0.00 55.95 55.66 2d3s s SER 228 Cb 0.06 0.51 0.14 0.00 0.10 0.00 0.00 66.02 66.83 2d3s s SER 228 CO 0.84 -0.94 0.88 0.86 0.98 0.00 0.00 173.24 175.86 2d3s s TRP 229 N -3.86 -0.83 0.08 5.02 -0.00 -0.65 -2.10 118.94 116.60 2d3s s TRP 229 Ca 0.07 1.51 0.08 0.00 -0.00 0.00 0.00 56.10 57.77 2d3s s TRP 229 Cb 0.01 0.50 -0.03 0.00 -0.00 0.00 0.00 33.47 33.95 2d3s s TRP 229 CO -0.06 -0.41 -0.22 -1.54 -0.00 0.00 0.00 176.95 174.72 2d3s s SER 230 N 2.17 2.63 -0.02 5.86 1.04 0.61 -0.84 113.70 125.14 2d3s s SER 230 Ca -0.06 -0.63 -0.01 0.00 0.48 0.00 0.00 55.95 55.73 2d3s s SER 230 Cb -0.07 -0.18 0.02 0.00 0.10 0.00 0.00 66.02 65.89 2d3s s SER 230 CO -0.17 0.12 0.05 0.12 0.98 0.00 0.00 173.24 174.34 2d3s s PHE 231 N -1.00 -0.03 -0.02 5.02 5.36 0.22 -1.26 117.98 126.27 2d3s s PHE 231 Ca 0.08 0.17 0.00 0.00 -0.96 0.00 0.00 56.93 56.22 2d3s s PHE 231 Cb -0.10 -0.10 0.02 0.00 -0.34 0.00 0.00 43.02 42.51 2d3s s PHE 231 CO 0.03 -0.07 0.01 0.45 -1.46 0.00 0.00 175.22 174.19 2d3s s SER 232 N 0.59 0.17 -0.10 6.13 0.15 0.07 -1.27 113.70 119.45 2d3s s SER 232 Ca -0.05 0.01 -0.07 0.00 0.70 0.00 0.00 55.95 56.54 2d3s s SER 232 Cb -0.07 -0.10 0.03 0.00 -1.71 0.00 0.00 66.02 64.18 2d3s s SER 232 CO -0.02 -0.09 0.25 0.00 1.20 0.00 0.00 173.24 174.58 2d3s s ALA 233 N 0.79 -0.60 -0.06 5.45 0.00 -0.22 -0.24 121.76 126.88 2d3s s ALA 233 Ca -0.07 0.81 0.02 0.00 0.00 0.00 0.00 51.96 52.73 2d3s s ALA 233 Cb -0.10 -0.49 0.01 0.00 0.00 0.00 0.00 23.12 22.54 2d3s s ALA 233 CO -0.02 -0.15 -0.11 -1.54 0.00 0.00 0.00 175.76 173.94 2d3s s SER 234 N 0.53 1.61 -0.37 0.00 1.04 -0.39 -1.10 113.70 115.01 2d3s s SER 234 Ca -0.03 -0.26 -0.01 0.00 0.48 0.00 0.00 55.95 56.13 2d3s s SER 234 Cb -0.05 -0.71 0.09 0.00 0.10 0.00 0.00 66.02 65.46 2d3s s SER 234 CO -0.03 0.03 0.12 -0.22 0.98 0.00 0.00 173.24 174.12 2d3s s LEU 235 N 0.62 4.81 0.32 2.42 2.96 0.01 -2.11 118.68 127.71 2d3s s LEU 235 Ca -0.13 -1.89 0.04 0.00 -0.22 0.00 0.00 54.13 51.94 2d3s s LEU 235 Cb -0.15 -1.75 0.65 0.00 0.50 0.00 0.00 46.19 45.45 2d3s s LEU 235 CO 0.03 -0.44 1.88 1.55 -1.32 0.00 0.00 176.35 178.05 2d3s h PRO 236 N 7.92 0.86 0.00 0.98 0.13 -1.85 -2.08 132.00 137.96 2d3s h PRO 236 Ca -0.13 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 2d3s h PRO 236 Cb 1.04 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2d3s h PRO 236 CO 0.61 0.57 0.00 0.41 -0.23 0.00 0.00 178.00 179.36