#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 2.64 -0.08 -0.18 2.01 -1.26 -0.41 115.64 118.35 2d3s s THR 2 Ca 0.00 -1.97 -0.07 0.00 0.31 0.00 0.00 61.69 59.97 2d3s s THR 2 Cb 0.00 -2.30 0.03 0.00 0.01 0.00 0.00 72.50 70.24 2d3s s THR 2 CO 0.00 -0.16 0.21 -0.51 -0.69 0.00 0.00 174.62 173.47 2d3s s ILE 3 N -1.80 -0.01 -0.03 1.82 2.07 -0.47 -5.00 121.20 117.79 2d3s s ILE 3 Ca 0.23 0.03 -0.23 0.00 -1.41 0.00 0.00 60.65 59.28 2d3s s ILE 3 Cb -0.08 -0.30 0.05 0.00 0.13 0.00 0.00 42.46 42.26 2d3s s ILE 3 CO 0.12 0.01 0.50 -0.94 -1.91 0.00 0.00 174.94 172.73 2d3s s SER 4 N 0.35 -0.43 0.05 4.50 1.04 -1.26 -0.61 113.70 117.34 2d3s s SER 4 Ca -0.02 0.40 -0.12 0.00 0.48 0.00 0.00 55.95 56.69 2d3s s SER 4 Cb -0.03 0.43 0.01 0.00 0.10 0.00 0.00 66.02 66.53 2d3s s SER 4 CO -0.01 -0.55 0.26 0.72 0.98 0.00 0.00 173.24 174.64 2d3s s PHE 5 N -1.35 -0.03 -0.02 5.02 -0.71 0.13 -4.98 117.98 116.04 2d3s s PHE 5 Ca -0.12 -0.18 -0.02 0.00 -1.04 0.00 0.00 56.93 55.57 2d3s s PHE 5 Cb -0.02 0.05 0.01 0.00 -1.21 0.00 0.00 43.02 41.84 2d3s s PHE 5 CO 0.07 -0.50 0.06 1.21 -1.34 0.00 0.00 175.22 174.71 2d3s s ASN 6 N -2.23 -0.06 -0.29 1.98 2.47 -1.26 -0.03 114.94 115.52 2d3s s ASN 6 Ca -0.03 0.12 -0.00 0.00 0.42 0.00 0.00 52.86 53.37 2d3s s ASN 6 Cb 0.00 0.12 0.09 0.00 -1.45 0.00 0.00 41.25 40.01 2d3s s ASN 6 CO -0.05 -0.03 0.06 -0.36 -3.72 0.00 0.00 177.10 173.00 2d3s s PHE 7 N 0.10 1.95 0.20 0.43 0.08 0.24 -4.96 117.98 116.01 2d3s s PHE 7 Ca -0.01 -1.76 0.18 0.00 0.12 0.00 0.00 56.93 55.47 2d3s s PHE 7 Cb -0.01 -1.74 0.71 0.00 -0.57 0.00 0.00 43.02 41.41 2d3s s PHE 7 CO -0.00 -0.83 1.75 -0.91 -0.10 0.00 0.00 175.22 175.13 2d3s h ASN 8 N 8.04 0.00 -5.05 1.36 -0.26 -1.90 -1.40 115.58 116.37 2d3s h ASN 8 Ca -0.13 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.57 2d3s h ASN 8 Cb 1.04 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.29 2d3s h ASN 8 CO 0.45 0.37 0.23 0.00 -1.06 0.00 0.00 177.43 177.42 2d3s s GLN 9 N -3.67 2.17 -0.11 0.81 0.00 -1.26 -4.66 119.66 112.93 2d3s s GLN 9 Ca -0.00 -1.42 0.03 0.00 -0.00 0.00 0.00 55.36 53.96 2d3s s GLN 9 Cb 0.11 0.61 0.01 0.00 0.00 0.00 0.00 33.01 33.74 2d3s s GLN 9 CO 0.69 -1.00 -0.21 -0.06 0.00 0.00 0.00 175.29 174.70 2d3s s PHE 10 N -2.53 2.45 0.04 9.60 0.08 -0.83 -4.97 117.98 121.82 2d3s s PHE 10 Ca 0.16 -1.09 -0.04 0.00 0.12 0.00 0.00 56.93 56.08 2d3s s PHE 10 Cb -0.05 -1.66 -0.05 0.00 -0.57 0.00 0.00 43.02 40.69 2d3s s PHE 10 CO 0.12 -0.48 0.25 -1.01 -0.10 0.00 0.00 175.22 174.00 2d3s s HIS 11 N 0.59 3.54 0.29 0.36 3.76 -1.26 -3.97 115.29 118.60 2d3s s HIS 11 Ca -0.13 0.45 -0.29 0.00 -0.15 0.00 0.00 55.06 54.93 2d3s s HIS 11 Cb -0.17 -1.90 -0.10 0.00 1.11 0.00 0.00 32.58 31.52 2d3s s HIS 11 CO 0.04 0.59 1.45 -0.65 -0.85 0.00 0.00 174.74 175.32 2d3s s GLN 12 N -2.11 4.23 -0.84 1.40 -0.21 -1.26 -3.11 119.66 117.77 2d3s s GLN 12 Ca 0.31 2.38 -0.04 0.00 0.02 0.00 0.00 55.36 58.03 2d3s s GLN 12 Cb -0.13 -3.06 -0.05 0.00 1.00 0.00 0.00 33.01 30.77 2d3s s GLN 12 CO 0.21 -0.44 0.73 0.09 -2.12 0.00 0.00 175.29 173.76 2d3s n ASN 13 N 1.76 -5.21 -4.61 5.90 3.02 -1.26 -4.97 115.26 109.89 2d3s n ASN 13 Ca 0.05 -0.55 -0.42 0.00 -0.03 0.00 0.00 54.58 53.64 2d3s n ASN 13 Cb 0.40 -4.19 -0.05 0.00 -0.61 0.00 0.00 39.78 35.33 2d3s n ASN 13 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2d3s s GLU 14 N -4.21 3.94 0.42 3.52 2.56 -1.18 -4.93 118.70 118.83 2d3s s GLU 14 Ca 0.32 0.51 0.30 0.00 0.00 0.00 0.00 54.97 56.09 2d3s s GLU 14 Cb -0.04 -3.73 1.36 0.00 2.00 0.00 0.00 34.13 33.72 2d3s s GLU 14 CO 0.58 -0.66 1.89 1.05 -0.56 0.00 0.00 175.26 177.56 2d3s h GLU 15 N 8.15 0.00 0.00 4.30 4.11 -1.93 -2.59 114.58 126.62 2d3s h GLU 15 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.18 2d3s h GLU 15 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2d3s h GLU 15 CO 0.87 0.00 -0.41 1.04 0.07 0.00 0.00 179.01 180.58 2d3s n GLN 16 N -2.64 0.24 -4.17 1.06 1.13 -1.26 -4.80 117.38 106.93 2d3s n GLN 16 Ca 0.00 0.11 -0.30 0.00 -1.94 0.00 0.00 57.00 54.87 2d3s n GLN 16 Cb 0.20 -1.69 -0.09 0.00 0.11 0.00 0.00 30.24 28.77 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 -4.10 3.28 -0.25 1.08 1.43 -0.98 0.68 118.68 119.83 2d3s s LEU 17 Ca 0.08 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 2d3s s LEU 17 Cb 0.14 -2.04 0.05 0.00 0.03 0.00 0.00 46.19 44.37 2d3s s LEU 17 CO 0.67 0.17 -0.12 -0.75 0.23 0.00 0.00 176.35 176.55 2d3s s LYS 18 N -2.31 2.39 -0.06 1.70 2.20 0.73 -4.73 119.74 119.66 2d3s s LYS 18 Ca 0.24 -1.24 -0.12 0.00 -0.36 0.00 0.00 55.97 54.48 2d3s s LYS 18 Cb -0.11 -2.84 -0.05 0.00 -1.51 0.00 0.00 37.83 33.32 2d3s s LYS 18 CO 0.17 -0.50 0.32 -0.51 -0.36 0.00 0.00 175.35 174.46 2d3s s LEU 19 N 1.14 4.41 0.06 5.43 1.02 -1.26 -0.92 118.68 128.55 2d3s s LEU 19 Ca -0.06 0.75 0.04 0.00 0.02 0.00 0.00 54.13 54.88 2d3s s LEU 19 Cb -0.19 -2.41 -0.03 0.00 0.02 0.00 0.00 46.19 43.59 2d3s s LEU 19 CO -0.06 0.30 -0.12 -1.10 0.02 0.00 0.00 176.35 175.39 2d3s s GLN 20 N -0.77 0.75 5.30 1.70 -0.21 -0.40 -5.00 119.66 121.03 2d3s s GLN 20 Ca 0.20 -0.84 0.00 0.00 0.02 0.00 0.00 55.36 54.74 2d3s s GLN 20 Cb -0.15 -0.70 0.00 0.00 1.00 0.00 0.00 33.01 33.16 2d3s s GLN 20 CO 0.09 0.16 0.00 0.54 -2.12 0.00 0.00 175.29 173.96 2d3s n ARG 21 N 1.50 0.00 0.00 2.91 5.12 -1.26 -2.24 116.66 122.69 2d3s n ARG 21 Ca -0.21 0.00 0.10 0.00 -1.93 0.00 0.00 57.85 55.81 2d3s n ARG 21 Cb 0.54 0.00 0.46 0.00 -1.16 0.00 0.00 32.46 32.30 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 2.82 0.00 -4.64 0.55 8.00 -0.24 -4.89 116.55 118.15 2d3s n ASP 22 Ca 0.00 0.34 -0.44 0.00 0.71 0.00 0.00 54.79 55.40 2d3s n ASP 22 Cb 0.00 -0.43 -0.02 0.00 -0.02 0.00 0.00 41.12 40.65 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 -1.43 0.46 -3.36 2.24 0.00 -0.95 -4.51 120.51 112.96 2d3s n ALA 23 Ca 0.06 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.74 2d3s n ALA 23 Cb 0.21 -2.14 -0.07 0.00 0.00 0.00 0.00 19.45 17.45 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 -1.35 0.87 -0.24 0.00 6.06 -0.14 -4.71 118.95 119.44 2d3s s ARG 24 Ca 0.61 -0.01 -0.08 0.00 -2.50 0.00 0.00 55.73 53.74 2d3s s ARG 24 Cb -0.66 0.40 -0.04 0.00 0.06 0.00 0.00 34.95 34.71 2d3s s ARG 24 CO 0.58 -0.26 0.09 0.42 -2.50 0.00 0.00 175.30 173.63 2d3s s ILE 25 N -1.39 4.59 0.89 4.11 1.01 -1.26 -0.01 121.20 129.14 2d3s s ILE 25 Ca -0.12 -0.08 -0.12 0.00 0.00 0.00 0.00 60.65 60.33 2d3s s ILE 25 Cb -0.03 -3.15 0.13 0.00 0.01 0.00 0.00 42.46 39.43 2d3s s ILE 25 CO 0.06 0.34 1.13 -0.94 0.00 0.00 0.00 174.94 175.53 2d3s s SER 26 N 1.44 3.68 0.49 3.58 1.04 -0.32 -4.79 113.70 118.84 2d3s s SER 26 Ca 0.06 1.03 0.28 0.00 0.48 0.00 0.00 55.95 57.80 2d3s s SER 26 Cb -0.15 -1.64 1.20 0.00 0.10 0.00 0.00 66.02 65.53 2d3s s SER 26 CO 0.05 -2.45 1.93 0.77 0.98 0.00 0.00 173.24 174.52 2d3s h SER 27 N -1.43 0.00 -0.44 7.02 4.64 -1.94 -2.72 113.55 118.69 2d3s h SER 27 Ca -0.50 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.69 2d3s h SER 27 Cb 1.32 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.33 2d3s h SER 27 CO 0.61 0.14 0.16 0.59 -0.87 0.00 0.00 176.83 177.46 2d3s n ASN 28 N -3.34 3.62 -1.10 4.97 4.13 -1.26 -4.92 115.26 117.36 2d3s n ASN 28 Ca -0.00 -2.71 -0.12 0.00 1.68 0.00 0.00 54.58 53.43 2d3s n ASN 28 Cb 0.35 -0.65 -0.04 0.00 -1.54 0.00 0.00 39.78 37.90 2d3s n ASN 28 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2d3s n SER 29 N 0.01 -4.27 -4.64 6.41 3.41 -1.02 -4.96 113.62 108.56 2d3s n SER 29 Ca 0.24 0.19 -0.33 0.00 -0.26 0.00 0.00 58.87 58.71 2d3s n SER 29 Cb 0.97 -3.07 -0.10 0.00 -0.26 0.00 0.00 64.21 61.75 2d3s n SER 29 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2d3s s VAL 30 N -2.51 4.00 -0.45 -3.33 -7.23 -1.26 -1.96 120.40 107.66 2d3s s VAL 30 Ca 0.00 -0.52 -0.22 0.00 -1.81 0.00 0.00 61.98 59.43 2d3s s VAL 30 Cb 0.00 -2.71 0.03 0.00 0.56 0.00 0.00 36.38 34.25 2d3s s VAL 30 CO 0.00 0.49 0.74 -0.22 -0.31 0.00 0.00 175.10 175.80 2d3s s LEU 31 N -1.19 4.35 -0.47 1.32 2.96 -0.38 -1.17 118.68 124.09 2d3s s LEU 31 Ca 0.16 -0.21 -0.16 0.00 -0.22 0.00 0.00 54.13 53.70 2d3s s LEU 31 Cb -0.11 -2.87 0.06 0.00 0.50 0.00 0.00 46.19 43.76 2d3s s LEU 31 CO 0.06 -0.88 0.45 -1.61 -1.32 0.00 0.00 176.35 173.05 2d3s s GLU 32 N 3.14 3.02 0.15 1.98 2.02 0.99 -0.41 118.70 129.59 2d3s s GLU 32 Ca 0.27 -1.16 -0.12 0.00 0.02 0.00 0.00 54.97 53.99 2d3s s GLU 32 Cb -0.13 -4.10 0.02 0.00 0.10 0.00 0.00 34.13 30.02 2d3s s GLU 32 CO 0.21 -1.04 1.58 -0.07 0.02 0.00 0.00 175.26 175.97 2d3s h LEU 33 N 9.00 0.92 -9.25 1.80 3.38 -1.53 -0.33 115.31 119.30 2d3s h LEU 33 Ca -0.28 -0.34 -0.65 0.00 0.09 0.00 0.00 57.88 56.71 2d3s h LEU 33 Cb 1.11 -0.25 -0.16 0.00 0.09 0.00 0.00 40.66 41.45 2d3s h LEU 33 CO 0.88 1.04 -0.75 0.42 0.09 0.00 0.00 178.44 180.12 2d3s s THR 34 N -4.90 3.12 0.05 0.22 -4.23 -1.26 -2.80 115.64 105.83 2d3s s THR 34 Ca -0.12 -1.56 -0.37 0.00 -1.18 0.00 0.00 61.69 58.46 2d3s s THR 34 Cb 0.12 -2.50 -0.16 0.00 1.34 0.00 0.00 72.50 71.30 2d3s s THR 34 CO 0.84 -0.02 1.46 1.17 -0.54 0.00 0.00 174.62 177.52 2d3s n LYS 35 N 0.34 1.38 -3.65 3.99 4.81 -1.26 -4.74 118.16 119.02 2d3s n LYS 35 Ca -0.12 0.50 -0.27 0.00 -0.87 0.00 0.00 58.31 57.54 2d3s n LYS 35 Cb 0.54 -2.18 -0.17 0.00 0.02 0.00 0.00 35.03 33.25 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 1.09 0.16 -0.18 3.15 0.11 -1.26 -2.42 120.40 121.05 2d3s s VAL 36 Ca 0.85 -0.40 -0.05 0.00 -2.93 0.00 0.00 61.98 59.45 2d3s s VAL 36 Cb -0.91 -0.81 -0.03 0.00 -1.53 0.00 0.00 36.38 33.10 2d3s s VAL 36 CO 0.48 -0.31 0.01 0.68 -3.33 0.00 0.00 175.10 172.62 2d3s s VAL 37 N 2.02 4.22 -1.44 2.04 -7.23 0.29 -4.57 120.40 115.73 2d3s s VAL 37 Ca 0.02 -0.24 -0.05 0.00 -1.81 0.00 0.00 61.98 59.91 2d3s s VAL 37 Cb -0.16 -2.88 0.03 0.00 0.56 0.00 0.00 36.38 33.93 2d3s s VAL 37 CO -0.12 0.47 0.63 -0.46 -0.31 0.00 0.00 175.10 175.30 2d3s n ASN 38 N 3.71 -1.61 0.00 4.85 6.94 -1.26 -0.73 115.26 127.16 2d3s n ASN 38 Ca -0.17 -0.92 0.00 0.00 -0.02 0.00 0.00 54.58 53.47 2d3s n ASN 38 Cb 0.52 -3.42 0.00 0.00 -2.36 0.00 0.00 39.78 34.52 2d3s n ASN 38 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2d3s n GLY 39 N -1.75 0.32 3.19 4.83 0.00 -1.26 -4.99 105.19 105.52 2d3s n GLY 39 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.77 1.95 0.45 1.61 1.01 0.09 -5.12 120.40 118.62 2d3s s VAL 40 Ca 0.00 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 60.81 2d3s s VAL 40 Cb 0.00 -1.70 -0.09 0.00 0.00 0.00 0.00 36.38 34.60 2d3s s VAL 40 CO 0.00 0.53 1.03 -2.16 0.00 0.00 0.00 175.10 174.51 2d3s s PRO 41 N 0.43 3.98 0.30 2.72 0.04 -1.26 -0.55 135.00 140.66 2d3s s PRO 41 Ca -0.17 1.38 0.10 0.00 0.04 0.00 0.00 61.00 62.35 2d3s s PRO 41 Cb -0.17 -2.26 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 2d3s s PRO 41 CO 0.07 -0.28 -0.08 0.95 0.04 0.00 0.00 177.00 177.71 2d3s s THR 42 N -1.89 2.79 0.58 1.26 -4.23 -1.02 -4.83 115.64 108.31 2d3s s THR 42 Ca 0.63 -2.13 -0.07 0.00 -1.18 0.00 0.00 61.69 58.95 2d3s s THR 42 Cb -0.17 -2.62 0.13 0.00 1.34 0.00 0.00 72.50 71.17 2d3s s THR 42 CO 0.22 -0.32 0.79 -2.67 -0.54 0.00 0.00 174.62 172.10 2d3s n TRP 43 N -0.81 -3.65 -3.96 3.99 4.27 -1.26 -4.45 117.44 111.57 2d3s n TRP 43 Ca -0.05 -0.92 -0.27 0.00 -3.89 0.00 0.00 57.50 52.37 2d3s n TRP 43 Cb 0.61 -0.60 -0.01 0.00 -1.36 0.00 0.00 31.31 29.94 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 -3.33 -1.42 -4.14 -0.67 5.15 0.62 -4.88 115.26 106.59 2d3s n ASN 44 Ca 0.11 -0.96 -0.21 0.00 -0.60 0.00 0.00 54.58 52.92 2d3s n ASN 44 Cb 0.38 -3.22 -0.14 0.00 -0.53 0.00 0.00 39.78 36.27 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 -4.07 1.72 -0.09 1.20 0.15 -1.26 -5.00 113.70 106.35 2d3s s SER 45 Ca 0.20 -0.38 -0.08 0.00 0.70 0.00 0.00 55.95 56.39 2d3s s SER 45 Cb -0.11 -0.14 0.03 0.00 -1.71 0.00 0.00 66.02 64.08 2d3s s SER 45 CO 0.88 0.10 0.24 -0.89 1.20 0.00 0.00 173.24 174.77 2d3s s THR 46 N -0.64 -0.01 -0.09 6.45 2.01 -1.26 -0.56 115.64 121.55 2d3s s THR 46 Ca 0.04 0.02 -0.24 0.00 0.31 0.00 0.00 61.69 61.82 2d3s s THR 46 Cb -0.07 -0.35 0.05 0.00 0.01 0.00 0.00 72.50 72.15 2d3s s THR 46 CO 0.01 0.01 0.56 -0.83 -0.69 0.00 0.00 174.62 173.68 2d3s s GLY 47 N 0.30 -0.44 0.10 4.40 0.00 -0.91 -1.08 107.32 109.69 2d3s s GLY 47 Ca -0.01 1.16 0.02 0.00 0.00 0.00 0.00 44.72 45.89 2d3s s GLY 47 CO -0.01 0.88 -0.07 0.50 0.00 0.00 0.00 173.10 174.40 2d3s s ARG 48 N -0.82 0.84 -0.13 2.90 0.52 -0.97 -1.56 118.95 119.74 2d3s s ARG 48 Ca -0.09 -1.33 -0.05 0.00 -0.52 0.00 0.00 55.73 53.74 2d3s s ARG 48 Cb -0.02 -0.23 0.06 0.00 0.52 0.00 0.00 34.95 35.28 2d3s s ARG 48 CO 0.06 -0.01 0.27 0.00 0.02 0.00 0.00 175.30 175.64 2d3s s ALA 49 N -3.58 -0.60 0.13 2.13 0.00 -0.72 -1.27 121.76 117.84 2d3s s ALA 49 Ca 0.12 1.00 0.10 0.00 0.00 0.00 0.00 51.96 53.18 2d3s s ALA 49 Cb 0.05 -0.92 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 2d3s s ALA 49 CO -0.04 -0.50 -0.25 -0.51 0.00 0.00 0.00 175.76 174.46 2d3s s LEU 50 N 2.05 2.33 0.02 0.00 2.01 -0.10 -0.95 118.68 124.04 2d3s s LEU 50 Ca -0.02 -0.75 -0.30 0.00 0.01 0.00 0.00 54.13 53.07 2d3s s LEU 50 Cb -0.11 -1.10 -0.06 0.00 0.01 0.00 0.00 46.19 44.92 2d3s s LEU 50 CO -0.09 0.13 1.43 -0.47 1.01 0.00 0.00 176.35 178.36 2d3s s TYR 51 N -1.19 2.85 0.34 0.29 5.04 -0.58 -0.19 117.35 123.91 2d3s s TYR 51 Ca 0.12 0.78 0.14 0.00 -2.44 0.00 0.00 57.07 55.67 2d3s s TYR 51 Cb -0.10 -3.70 1.06 0.00 0.35 0.00 0.00 41.96 39.57 2d3s s TYR 51 CO 0.06 -2.60 1.68 0.00 -1.34 0.00 0.00 175.55 173.34 2d3s h ALA 52 N 7.76 1.95 -2.69 3.97 0.00 -0.04 -3.42 119.26 126.79 2d3s h ALA 52 Ca -0.39 0.17 -0.64 0.00 0.00 0.00 0.00 54.91 54.05 2d3s h ALA 52 Cb 1.19 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 19.04 2d3s h ALA 52 CO 0.90 -0.53 -0.40 0.15 0.00 0.00 0.00 179.25 179.37 2d3s s LYS 53 N -5.67 3.57 0.46 0.00 -0.14 -1.26 -5.01 119.74 111.69 2d3s s LYS 53 Ca -0.10 -0.04 -0.22 0.00 -1.36 0.00 0.00 55.97 54.25 2d3s s LYS 53 Cb 0.30 -3.14 -0.08 0.00 -1.68 0.00 0.00 37.83 33.23 2d3s s LYS 53 CO 0.79 0.70 1.10 -1.25 -0.76 0.00 0.00 175.35 175.93 2d3s s PRO 54 N -1.41 3.83 -0.02 -1.68 0.04 -1.26 -4.84 135.00 129.67 2d3s s PRO 54 Ca 0.22 1.58 0.06 0.00 0.04 0.00 0.00 61.00 62.91 2d3s s PRO 54 Cb -0.13 -2.32 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 2d3s s PRO 54 CO 0.11 -0.44 -0.20 0.14 0.04 0.00 0.00 177.00 176.65 2d3s s VAL 55 N -1.70 2.56 -0.38 -0.36 -7.23 0.37 -4.89 120.40 108.77 2d3s s VAL 55 Ca 0.64 -0.97 -0.23 0.00 -1.81 0.00 0.00 61.98 59.61 2d3s s VAL 55 Cb -0.23 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 34.75 2d3s s VAL 55 CO 0.28 0.54 0.76 -1.58 -0.31 0.00 0.00 175.10 174.80 2d3s s GLN 56 N -0.79 3.65 0.18 4.82 0.74 -1.26 -0.65 119.66 126.36 2d3s s GLN 56 Ca 0.11 0.16 0.23 0.00 0.05 0.00 0.00 55.36 55.92 2d3s s GLN 56 Cb -0.10 -3.84 0.11 0.00 1.10 0.00 0.00 33.01 30.28 2d3s s GLN 56 CO 0.01 -0.90 1.15 -0.39 -0.55 0.00 0.00 175.29 174.60 2d3s h VAL 57 N 5.80 0.00 -3.08 1.34 -1.51 -0.90 -3.45 116.25 114.45 2d3s h VAL 57 Ca -0.25 -0.83 -0.01 0.00 -1.23 0.00 0.00 66.70 64.38 2d3s h VAL 57 Cb 1.09 1.37 -0.11 0.00 -2.13 0.00 0.00 31.29 31.51 2d3s h VAL 57 CO 0.91 0.00 0.16 -1.66 -1.23 0.00 0.00 177.57 175.75 2d3s s TRP 58 N -3.29 -0.41 -0.14 5.19 1.48 -1.22 0.11 118.94 120.66 2d3s s TRP 58 Ca 0.02 0.14 0.00 0.00 -1.06 0.00 0.00 56.10 55.20 2d3s s TRP 58 Cb 0.11 0.52 0.02 0.00 -1.16 0.00 0.00 33.47 32.96 2d3s s TRP 58 CO 0.77 -0.89 -0.13 0.34 -4.06 0.00 0.00 176.95 172.97 2d3s s ASP 59 N -2.79 2.62 0.53 -2.66 2.15 -0.51 -4.58 116.67 111.43 2d3s s ASP 59 Ca 0.03 -0.46 0.31 0.00 0.43 0.00 0.00 52.55 52.86 2d3s s ASP 59 Cb -0.01 -1.14 1.35 0.00 -0.30 0.00 0.00 42.92 42.82 2d3s s ASP 59 CO -0.09 -0.06 1.99 0.77 -0.17 0.00 0.00 175.17 177.60 2d3s h SER 60 N 8.05 0.00 -0.25 -0.34 4.64 -1.93 0.67 113.55 124.39 2d3s h SER 60 Ca -0.37 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.81 2d3s h SER 60 Cb 1.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2d3s h SER 60 CO 0.52 0.08 -0.33 0.74 -0.87 0.00 0.00 176.83 176.96 2d3s h THR 61 N 0.00 1.28 0.00 2.95 2.02 -1.95 -3.31 112.91 113.90 2d3s h THR 61 Ca -0.00 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 65.69 2d3s h THR 61 Cb 0.51 1.37 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2d3s h THR 61 CO 0.01 0.49 -0.99 0.35 0.37 0.00 0.00 175.52 175.74 2d3s n THR 62 N -4.07 0.00 -0.74 3.16 -2.24 -1.14 -4.99 114.28 104.26 2d3s n THR 62 Ca -0.01 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2d3s n THR 62 Cb 0.50 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 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 1.60 1.40 3.77 3.38 0.00 0.23 -5.00 105.19 110.57 2d3s n GLY 63 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.17 5.90 0.07 1.61 0.02 -1.20 -4.80 114.94 113.36 2d3s s ASN 64 Ca 0.00 2.30 0.10 0.00 -1.02 0.00 0.00 52.86 54.23 2d3s s ASN 64 Cb 0.00 -2.60 -0.03 0.00 0.02 0.00 0.00 41.25 38.64 2d3s s ASN 64 CO 0.00 -1.10 -0.26 -0.69 0.02 0.00 0.00 177.10 175.06 2d3s s VAL 65 N -1.61 2.20 0.45 1.60 1.01 -1.26 -1.43 120.40 121.36 2d3s s VAL 65 Ca 0.68 -1.48 -0.21 0.00 0.00 0.00 0.00 61.98 60.97 2d3s s VAL 65 Cb -0.28 -1.89 -0.10 0.00 0.00 0.00 0.00 36.38 34.11 2d3s s VAL 65 CO 0.33 0.29 0.98 0.00 0.00 0.00 0.00 175.10 176.69 2d3s s ALA 66 N -0.88 2.99 0.09 5.51 0.00 0.29 -4.76 121.76 125.00 2d3s s ALA 66 Ca 0.12 0.46 0.05 0.00 0.00 0.00 0.00 51.96 52.60 2d3s s ALA 66 Cb -0.10 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 2d3s s ALA 66 CO 0.03 0.00 -0.00 -1.12 0.00 0.00 0.00 175.76 174.67 2d3s s SER 67 N -2.12 5.00 0.21 0.00 0.01 -0.92 -4.35 113.70 111.53 2d3s s SER 67 Ca 0.63 -0.19 -0.16 0.00 1.31 0.00 0.00 55.95 57.55 2d3s s SER 67 Cb -0.11 -1.18 0.02 0.00 0.21 0.00 0.00 66.02 64.95 2d3s s SER 67 CO 0.15 0.17 0.50 0.72 0.41 0.00 0.00 173.24 175.20 2d3s s PHE 68 N -1.32 0.04 -0.08 2.43 -0.12 -0.90 -1.01 117.98 117.02 2d3s s PHE 68 Ca 0.26 -0.40 -0.07 0.00 -0.05 0.00 0.00 56.93 56.67 2d3s s PHE 68 Cb -0.12 0.32 0.02 0.00 -0.63 0.00 0.00 43.02 42.62 2d3s s PHE 68 CO 0.18 -0.94 0.21 -2.00 -0.05 0.00 0.00 175.22 172.62 2d3s s GLU 69 N -3.92 0.23 -0.03 1.99 2.12 0.29 -1.04 118.70 118.34 2d3s s GLU 69 Ca 0.13 0.30 -0.03 0.00 0.36 0.00 0.00 54.97 55.74 2d3s s GLU 69 Cb -0.01 0.09 0.01 0.00 0.26 0.00 0.00 34.13 34.48 2d3s s GLU 69 CO 0.01 -0.04 0.09 -0.08 -0.54 0.00 0.00 175.26 174.70 2d3s s THR 70 N 0.21 0.00 -0.01 -1.70 -1.32 -0.17 -1.15 115.64 111.51 2d3s s THR 70 Ca -0.01 -0.02 0.03 0.00 -1.21 0.00 0.00 61.69 60.48 2d3s s THR 70 Cb -0.02 -0.14 -0.01 0.00 -1.51 0.00 0.00 72.50 70.82 2d3s s THR 70 CO -0.00 -0.01 -0.11 -0.13 -2.21 0.00 0.00 174.62 172.15 2d3s s ARG 71 N 0.00 0.91 0.16 7.08 0.52 -0.78 -1.15 118.95 125.69 2d3s s ARG 71 Ca -0.00 -0.39 -0.19 0.00 -0.52 0.00 0.00 55.73 54.62 2d3s s ARG 71 Cb -0.01 -0.88 0.05 0.00 0.52 0.00 0.00 34.95 34.63 2d3s s ARG 71 CO 0.00 0.23 0.52 -0.59 0.02 0.00 0.00 175.30 175.49 2d3s s PHE 72 N -0.24 -0.33 -0.04 -0.53 -0.71 -0.90 -1.02 117.98 114.22 2d3s s PHE 72 Ca 0.04 0.04 0.07 0.00 -1.04 0.00 0.00 56.93 56.04 2d3s s PHE 72 Cb -0.05 0.43 -0.02 0.00 -1.21 0.00 0.00 43.02 42.18 2d3s s PHE 72 CO -0.00 -0.83 -0.25 -1.12 -1.34 0.00 0.00 175.22 171.68 2d3s s SER 73 N -2.80 3.12 0.15 1.98 0.01 -1.01 -0.94 113.70 114.21 2d3s s SER 73 Ca 0.04 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.83 2d3s s SER 73 Cb -0.00 -0.60 -0.04 0.00 0.21 0.00 0.00 66.02 65.59 2d3s s SER 73 CO -0.10 0.29 0.03 0.72 0.41 0.00 0.00 173.24 174.58 2d3s s PHE 74 N -0.41 1.03 -0.04 2.43 -0.12 -0.39 -0.46 117.98 120.02 2d3s s PHE 74 Ca 0.04 -1.12 -0.02 0.00 -0.05 0.00 0.00 56.93 55.79 2d3s s PHE 74 Cb -0.12 -0.59 0.03 0.00 -0.63 0.00 0.00 43.02 41.72 2d3s s PHE 74 CO 0.01 -0.36 0.09 0.45 -0.05 0.00 0.00 175.22 175.37 2d3s s SER 75 N -3.11 0.14 -0.27 1.98 0.15 0.42 -1.16 113.70 111.85 2d3s s SER 75 Ca 0.23 0.17 0.01 0.00 0.70 0.00 0.00 55.95 57.06 2d3s s SER 75 Cb 0.07 0.05 0.05 0.00 -1.71 0.00 0.00 66.02 64.48 2d3s s SER 75 CO 0.02 -0.16 -0.08 -0.63 1.20 0.00 0.00 173.24 173.60 2d3s s ILE 76 N 1.30 2.48 -0.21 6.45 1.01 -1.26 -1.78 121.20 129.19 2d3s s ILE 76 Ca -0.07 -1.47 -0.08 0.00 0.00 0.00 0.00 60.65 59.02 2d3s s ILE 76 Cb -0.12 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 2d3s s ILE 76 CO -0.04 -0.00 0.10 -0.60 0.00 0.00 0.00 174.94 174.39 2d3s s ARG 77 N 1.18 3.96 -0.58 2.79 3.52 -1.25 -1.55 118.95 127.02 2d3s s ARG 77 Ca -0.06 -0.34 -0.00 0.00 -0.13 0.00 0.00 55.73 55.20 2d3s s ARG 77 Cb -0.19 -3.35 0.15 0.00 -1.56 0.00 0.00 34.95 30.00 2d3s s ARG 77 CO -0.04 0.13 0.36 -0.65 -0.81 0.00 0.00 175.30 174.29 2d3s s GLN 78 N 0.81 2.33 0.16 5.12 -0.21 -1.26 -1.49 119.66 125.12 2d3s s GLN 78 Ca 0.05 -2.55 -0.12 0.00 0.02 0.00 0.00 55.36 52.76 2d3s s GLN 78 Cb -0.13 -3.57 0.05 0.00 1.00 0.00 0.00 33.01 30.35 2d3s s GLN 78 CO 0.02 -1.14 1.68 -1.35 -2.12 0.00 0.00 175.29 172.38 2d3s h PRO 79 N 6.85 0.85 -4.32 2.91 0.11 -1.97 -3.39 132.00 133.05 2d3s h PRO 79 Ca -0.04 -0.19 -0.72 0.00 0.11 0.00 0.00 66.00 65.16 2d3s h PRO 79 Cb 0.93 -0.12 -0.30 0.00 0.11 0.00 0.00 31.00 31.62 2d3s h PRO 79 CO 0.70 0.79 -0.42 -0.06 -0.21 0.00 0.00 178.00 178.80 2d3s s PHE 80 N -5.36 3.46 -0.11 0.65 0.08 -1.26 -4.97 117.98 110.47 2d3s s PHE 80 Ca -0.13 -1.99 -0.22 0.00 0.12 0.00 0.00 56.93 54.71 2d3s s PHE 80 Cb 0.12 -3.45 -0.19 0.00 -0.57 0.00 0.00 43.02 38.93 2d3s s PHE 80 CO 0.80 -0.99 0.67 -1.00 -0.10 0.00 0.00 175.22 174.60 2d3s h PRO 81 N 8.35 -0.03 0.00 0.24 0.13 -1.92 -3.40 132.00 135.38 2d3s h PRO 81 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2d3s h PRO 81 Cb 1.07 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2d3s h PRO 81 CO 0.83 0.67 0.00 0.54 -0.23 0.00 0.00 178.00 179.81 2d3s n ARG 82 N -4.70 0.00 0.00 0.86 5.12 -1.26 -3.24 116.66 113.44 2d3s n ARG 82 Ca -0.08 0.37 0.00 0.00 -1.93 0.00 0.00 57.85 56.21 2d3s n ARG 82 Cb 0.34 -0.56 0.00 0.00 -1.16 0.00 0.00 32.46 31.08 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 -2.21 0.00 -3.27 5.56 -0.02 -1.26 -4.98 135.00 128.82 2d3s n PRO 83 Ca 0.00 0.01 0.04 0.00 -2.02 0.00 0.00 63.50 61.53 2d3s n PRO 83 Cb 0.00 -0.82 -0.04 0.00 -0.02 0.00 0.00 33.50 32.61 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 -0.64 -0.02 0.68 6.00 -3.43 -1.20 -5.10 115.29 111.59 2d3s s HIS 84 Ca 0.00 0.03 -0.16 0.00 -0.80 0.00 0.00 55.06 54.13 2d3s s HIS 84 Cb 0.00 0.01 0.01 0.00 -1.43 0.00 0.00 32.58 31.17 2d3s s HIS 84 CO 0.00 -0.01 1.17 -2.14 -2.00 0.00 0.00 174.74 171.76 2d3s s PRO 85 N 1.78 2.50 -0.00 -0.38 0.02 -1.26 -3.99 135.00 133.67 2d3s s PRO 85 Ca -0.01 1.63 -0.28 0.00 0.02 0.00 0.00 61.00 62.36 2d3s s PRO 85 Cb -0.01 -1.89 0.08 0.00 0.02 0.00 0.00 34.50 32.71 2d3s s PRO 85 CO -0.14 -1.53 0.74 0.00 -0.33 0.00 0.00 177.00 175.74 2d3s s ALA 86 N -2.06 -1.76 -0.07 -1.55 0.00 -1.26 -4.18 121.76 110.89 2d3s s ALA 86 Ca 0.72 1.08 0.05 0.00 0.00 0.00 0.00 51.96 53.81 2d3s s ALA 86 Cb -0.26 0.20 -0.08 0.00 0.00 0.00 0.00 23.12 22.99 2d3s s ALA 86 CO 0.42 -0.52 0.01 -0.25 0.00 0.00 0.00 175.76 175.41 2d3s n ASP 87 N 0.33 3.41 0.00 0.00 9.92 0.16 -3.44 116.55 126.93 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 0.60 0.55 0.00 0.00 -0.64 0.00 0.00 41.12 41.63 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 2.67 0.97 3.12 0.44 0.00 -1.17 -1.43 105.19 109.80 2d3s n GLY 88 Ca -0.11 -1.97 -0.08 0.00 0.00 0.00 0.00 46.02 43.85 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 2.11 0.05 0.99 0.05 -0.94 -2.48 118.68 118.46 2d3s s LEU 89 Ca 0.00 -1.09 -0.07 0.00 0.05 0.00 0.00 54.13 53.03 2d3s s LEU 89 Cb 0.00 0.28 -0.01 0.00 -2.05 0.00 0.00 46.19 44.41 2d3s s LEU 89 CO 0.00 -0.67 0.13 0.68 -0.55 0.00 0.00 176.35 175.94 2d3s s VAL 90 N -3.98 0.13 -0.13 1.48 -7.23 0.20 -0.76 120.40 110.12 2d3s s VAL 90 Ca 0.15 -1.10 -0.05 0.00 -1.81 0.00 0.00 61.98 59.18 2d3s s VAL 90 Cb 0.08 -1.01 -0.04 0.00 0.56 0.00 0.00 36.38 35.97 2d3s s VAL 90 CO -0.04 -0.61 0.04 0.12 -0.31 0.00 0.00 175.10 174.30 2d3s s PHE 91 N -2.88 3.26 0.10 2.82 5.36 -0.68 -1.85 117.98 124.10 2d3s s PHE 91 Ca -0.03 0.18 -0.07 0.00 -0.96 0.00 0.00 56.93 56.05 2d3s s PHE 91 Cb 0.00 -1.92 -0.01 0.00 -0.34 0.00 0.00 43.02 40.76 2d3s s PHE 91 CO -0.06 0.38 0.17 -0.59 -1.46 0.00 0.00 175.22 173.67 2d3s s PHE 92 N -0.43 0.29 -0.10 10.12 -0.71 0.21 -1.13 117.98 126.23 2d3s s PHE 92 Ca 0.09 -0.72 0.02 0.00 -1.04 0.00 0.00 56.93 55.28 2d3s s PHE 92 Cb -0.12 -0.13 0.01 0.00 -1.21 0.00 0.00 43.02 41.58 2d3s s PHE 92 CO 0.02 -0.56 -0.15 0.42 -1.34 0.00 0.00 175.22 173.62 2d3s s ILE 93 N -3.90 1.44 0.28 -4.49 1.01 -0.08 -2.06 121.20 113.40 2d3s s ILE 93 Ca 0.09 -0.62 -0.04 0.00 0.00 0.00 0.00 60.65 60.08 2d3s s ILE 93 Cb 0.05 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 2d3s s ILE 93 CO -0.08 0.43 0.36 0.00 0.00 0.00 0.00 174.94 175.65 2d3s s ALA 94 N 0.90 0.74 0.73 9.38 0.00 -0.83 -1.94 121.76 130.74 2d3s s ALA 94 Ca -0.09 -1.46 -0.14 0.00 0.00 0.00 0.00 51.96 50.27 2d3s s ALA 94 Cb -0.15 1.24 0.04 0.00 0.00 0.00 0.00 23.12 24.24 2d3s s ALA 94 CO 0.00 -0.74 1.15 -2.14 0.00 0.00 0.00 175.76 174.04 2d3s s PRO 95 N -3.66 2.26 0.61 0.00 0.02 -1.26 -0.97 135.00 132.00 2d3s s PRO 95 Ca 0.32 1.55 -0.17 0.00 0.02 0.00 0.00 61.00 62.72 2d3s s PRO 95 Cb 0.02 -1.87 -0.03 0.00 0.02 0.00 0.00 34.50 32.64 2d3s s PRO 95 CO 0.16 -1.70 1.12 -1.25 -0.33 0.00 0.00 177.00 175.00 2d3s s PRO 96 N -4.16 3.05 -1.10 5.54 0.04 -1.26 -3.95 135.00 133.17 2d3s s PRO 96 Ca 0.69 1.48 -0.05 0.00 0.04 0.00 0.00 61.00 63.16 2d3s s PRO 96 Cb -0.24 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.33 2d3s s PRO 96 CO 0.46 -1.07 0.95 0.09 0.04 0.00 0.00 177.00 177.47 2d3s n ASN 97 N -1.93 -4.44 -4.95 6.66 5.03 -1.26 -5.03 115.26 109.34 2d3s n ASN 97 Ca 0.11 -0.48 -0.23 0.00 0.87 0.00 0.00 54.58 54.85 2d3s n ASN 97 Cb 0.52 -4.35 -0.00 0.00 -1.02 0.00 0.00 39.78 34.93 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 -3.28 4.45 0.23 3.41 -4.23 -1.25 -5.11 115.64 109.86 2d3s s THR 98 Ca 0.32 -0.57 0.08 0.00 -1.18 0.00 0.00 61.69 60.34 2d3s s THR 98 Cb -0.14 -3.62 -0.04 0.00 1.34 0.00 0.00 72.50 70.03 2d3s s THR 98 CO 0.61 -0.39 0.04 -1.10 -0.54 0.00 0.00 174.62 173.25 2d3s s GLN 99 N -4.40 2.49 0.20 3.99 -1.52 -1.26 -5.07 119.66 114.10 2d3s s GLN 99 Ca 0.44 -1.21 -0.33 0.00 -1.95 0.00 0.00 55.36 52.32 2d3s s GLN 99 Cb -0.10 -2.33 -0.13 0.00 -0.22 0.00 0.00 33.01 30.23 2d3s s GLN 99 CO 0.36 0.41 1.54 2.41 -0.25 0.00 0.00 175.29 179.76 2d3s n THR 100 N -0.66 0.39 -0.76 -0.19 -1.04 -1.26 -4.96 114.28 105.80 2d3s n THR 100 Ca -0.08 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2d3s n THR 100 Cb 0.57 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.48 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 2.95 1.32 3.75 3.41 0.00 0.38 -4.99 105.19 112.02 2d3s n GLY 101 Ca 0.14 -1.77 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 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 2.21 4.30 0.00 1.61 2.56 0.26 -4.58 118.70 125.06 2d3s s GLU 102 Ca 0.00 2.27 0.00 0.00 0.00 0.00 0.00 54.97 57.24 2d3s s GLU 102 Cb 0.00 -3.09 0.00 0.00 2.00 0.00 0.00 34.13 33.04 2d3s s GLU 102 CO 0.00 -0.33 0.00 0.41 -0.56 0.00 0.00 175.26 174.78 2d3s n GLY 103 N 1.64 0.65 7.00 -1.50 0.00 -1.26 -0.08 105.19 111.64 2d3s n GLY 103 Ca 0.04 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.61 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 4.68 2.21 0.00 -0.02 0.00 -1.26 -1.92 105.19 108.89 2d3s n GLY 104 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.15 1.12 -0.02 0.00 -1.26 -1.10 105.19 103.78 2d3s n GLY 105 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.14 0.41 -0.37 1.61 4.01 -0.81 -4.96 117.16 115.91 2d3s n TYR 106 Ca 0.00 -0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.53 2d3s n TYR 106 Cb 0.00 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 1.47 0.00 -0.42 -0.72 3.72 -0.26 -1.38 117.46 119.87 2d3s n PHE 107 Ca 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.58 2d3s n PHE 107 Cb 0.61 -1.25 0.00 0.00 -0.94 0.00 0.00 39.48 37.90 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 -1.21 0.78 0.00 1.37 0.00 0.89 -3.39 105.19 103.64 2d3s n GLY 108 Ca 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.42 0.00 -4.10 -0.61 -5.35 -0.48 -0.47 119.36 105.94 2d3s n ILE 109 Ca 0.00 -0.35 -0.35 0.00 -0.27 0.00 0.00 62.75 61.79 2d3s n ILE 109 Cb 0.00 0.98 -0.13 0.00 -1.74 0.00 0.00 39.64 38.75 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 -1.61 3.02 -0.34 4.28 5.04 -1.21 -4.74 117.35 121.79 2d3s s TYR 110 Ca 0.02 -0.51 0.03 0.00 -2.44 0.00 0.00 57.07 54.16 2d3s s TYR 110 Cb 0.05 -2.07 0.09 0.00 0.35 0.00 0.00 41.96 40.38 2d3s s TYR 110 CO 0.25 -0.26 0.05 1.21 -1.34 0.00 0.00 175.55 175.45 2d3s s ASN 111 N 1.00 4.80 0.32 4.32 2.47 -1.26 -0.57 114.94 126.02 2d3s s ASN 111 Ca 0.01 -1.98 0.06 0.00 0.42 0.00 0.00 52.86 51.38 2d3s s ASN 111 Cb -0.14 -1.65 0.74 0.00 -1.45 0.00 0.00 41.25 38.74 2d3s s ASN 111 CO 0.01 -0.37 1.83 -0.65 -3.72 0.00 0.00 177.10 174.20 2d3s h PRO 112 N 7.72 0.76 -0.19 0.43 0.11 -1.99 -0.07 132.00 138.77 2d3s h PRO 112 Ca -0.09 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.98 2d3s h PRO 112 Cb 1.03 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2d3s h PRO 112 CO 0.54 0.50 0.00 1.47 -0.21 0.00 0.00 178.00 180.30 2d3s n LEU 113 N -4.64 1.13 -2.65 2.35 -0.00 -1.26 -4.30 117.00 107.63 2d3s n LEU 113 Ca 0.20 -0.54 -0.03 0.00 -0.00 0.00 0.00 56.01 55.64 2d3s n LEU 113 Cb 0.49 -0.12 0.10 0.00 -0.00 0.00 0.00 43.42 43.89 2d3s n LEU 113 CO 0.26 0.27 0.74 -1.54 -0.00 0.00 0.00 177.39 177.12 2d3s n SER 114 N 0.08 -1.06 -4.74 1.45 3.41 -0.98 -5.15 113.62 106.62 2d3s n SER 114 Ca 0.09 -1.59 -0.42 0.00 -0.26 0.00 0.00 58.87 56.70 2d3s n SER 114 Cb 0.20 0.86 -0.01 0.00 -0.26 0.00 0.00 64.21 65.00 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 0.88 2.44 -4.92 4.33 -0.02 -0.08 -4.74 135.00 132.88 2d3s n PRO 115 Ca -0.04 0.86 -0.29 0.00 -2.02 0.00 0.00 63.50 62.00 2d3s n PRO 115 Cb 0.75 -2.54 -0.15 0.00 -0.02 0.00 0.00 33.50 31.54 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 -0.92 2.17 0.87 6.00 -0.85 -1.26 -5.04 117.35 118.32 2d3s s TYR 116 Ca 0.56 -0.40 -0.11 0.00 -0.52 0.00 0.00 57.07 56.60 2d3s s TYR 116 Cb -0.52 -1.33 0.12 0.00 0.38 0.00 0.00 41.96 40.61 2d3s s TYR 116 CO 0.61 0.08 1.14 -1.25 -1.52 0.00 0.00 175.55 174.61 2d3s s PRO 117 N -1.06 1.38 -0.17 -3.49 0.04 -1.26 -4.94 135.00 125.49 2d3s s PRO 117 Ca 0.10 1.50 -0.31 0.00 0.04 0.00 0.00 61.00 62.33 2d3s s PRO 117 Cb -0.10 -1.77 0.14 0.00 0.04 0.00 0.00 34.50 32.81 2d3s s PRO 117 CO 0.01 -2.35 1.11 -0.59 0.04 0.00 0.00 177.00 175.21 2d3s s PHE 118 N -2.63 -0.24 -0.12 0.56 -0.12 -1.26 -4.16 117.98 110.01 2d3s s PHE 118 Ca 0.66 0.32 0.03 0.00 -0.05 0.00 0.00 56.93 57.89 2d3s s PHE 118 Cb -0.22 0.49 0.01 0.00 -0.63 0.00 0.00 43.02 42.66 2d3s s PHE 118 CO 0.56 -0.28 -0.20 0.08 -0.05 0.00 0.00 175.22 175.34 2d3s s VAL 119 N -1.72 1.86 0.03 -2.49 1.01 -0.82 -0.08 120.40 118.19 2d3s s VAL 119 Ca 0.04 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.15 2d3s s VAL 119 Cb -0.01 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 2d3s s VAL 119 CO -0.03 0.51 -0.03 0.00 0.00 0.00 0.00 175.10 175.54 2d3s s ALA 120 N 0.78 0.28 -0.26 5.51 0.00 0.74 -0.90 121.76 127.90 2d3s s ALA 120 Ca -0.09 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.08 2d3s s ALA 120 Cb -0.16 0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.18 2d3s s ALA 120 CO 0.00 -0.21 -0.08 0.08 0.00 0.00 0.00 175.76 175.56 2d3s s VAL 121 N -2.16 2.58 0.11 0.00 1.01 -0.28 0.05 120.40 121.72 2d3s s VAL 121 Ca -0.09 -1.31 0.02 0.00 0.00 0.00 0.00 61.98 60.60 2d3s s VAL 121 Cb -0.05 -2.40 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 2d3s s VAL 121 CO -0.03 0.08 0.21 -1.83 0.00 0.00 0.00 175.10 173.52 2d3s s GLU 122 N 1.23 3.27 -0.48 2.72 -1.05 -0.09 -1.69 118.70 122.61 2d3s s GLU 122 Ca -0.04 -0.60 0.03 0.00 -0.15 0.00 0.00 54.97 54.21 2d3s s GLU 122 Cb -0.18 -2.90 0.14 0.00 -0.44 0.00 0.00 34.13 30.74 2d3s s GLU 122 CO -0.05 0.55 0.26 -0.06 0.95 0.00 0.00 175.26 176.92 2d3s s PHE 123 N -1.61 2.45 -0.20 4.83 0.08 0.06 -1.49 117.98 122.10 2d3s s PHE 123 Ca 0.33 -2.73 -0.23 0.00 0.12 0.00 0.00 56.93 54.43 2d3s s PHE 123 Cb -0.12 -2.22 -0.02 0.00 -0.57 0.00 0.00 43.02 40.09 2d3s s PHE 123 CO 0.27 -0.76 0.73 0.34 -0.10 0.00 0.00 175.22 175.70 2d3s s ASP 124 N 0.02 6.80 0.00 1.36 -1.08 -0.48 -2.21 116.67 121.08 2d3s s ASP 124 Ca 0.18 0.98 0.13 0.00 -0.52 0.00 0.00 52.55 53.31 2d3s s ASP 124 Cb -0.23 -2.40 -0.02 0.00 -1.46 0.00 0.00 42.92 38.81 2d3s s ASP 124 CO -0.01 -0.36 0.70 0.35 0.52 0.00 0.00 175.17 176.36 2d3s n THR 125 N 4.83 0.00 -4.80 1.71 -2.24 -0.52 -1.98 114.28 111.29 2d3s n THR 125 Ca 0.02 -0.34 -0.26 0.00 -2.27 0.00 0.00 64.05 61.19 2d3s n THR 125 Cb 0.49 1.13 -0.16 0.00 -2.10 0.00 0.00 70.33 69.68 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 -1.68 1.73 -0.66 4.78 5.36 -1.19 -4.67 117.98 121.65 2d3s s PHE 126 Ca 0.10 -0.57 -0.26 0.00 -0.96 0.00 0.00 56.93 55.24 2d3s s PHE 126 Cb 0.10 -1.19 0.04 0.00 -0.34 0.00 0.00 43.02 41.63 2d3s s PHE 126 CO 0.35 -0.23 1.12 0.50 -1.46 0.00 0.00 175.22 175.50 2d3s s ARG 127 N 0.25 3.25 0.74 10.12 3.52 -1.26 -4.96 118.95 130.61 2d3s s ARG 127 Ca -0.09 -0.31 -0.09 0.00 -0.13 0.00 0.00 55.73 55.11 2d3s s ARG 127 Cb -0.13 -4.14 0.06 0.00 -1.56 0.00 0.00 34.95 29.18 2d3s s ARG 127 CO 0.03 -1.86 1.08 -0.80 -0.81 0.00 0.00 175.30 172.95 2d3s s ASN 128 N 3.42 4.82 0.45 -2.12 0.01 -1.26 -4.89 114.94 115.36 2d3s s ASN 128 Ca 0.32 0.68 0.23 0.00 -0.71 0.00 0.00 52.86 53.38 2d3s s ASN 128 Cb -0.11 -1.31 1.22 0.00 0.41 0.00 0.00 41.25 41.46 2d3s s ASN 128 CO 0.16 -1.65 1.83 0.71 -1.51 0.00 0.00 177.10 176.64 2d3s h THR 129 N -0.76 0.58 -0.40 1.60 1.35 -2.01 -0.51 112.91 112.77 2d3s h THR 129 Ca -0.45 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2d3s h THR 129 Cb 1.31 0.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2d3s h THR 129 CO 0.63 0.05 0.00 -2.67 -0.25 0.00 0.00 175.52 173.28 2d3s n TRP 130 N -4.46 0.61 -4.23 4.73 2.14 -1.26 -4.96 117.44 110.00 2d3s n TRP 130 Ca 0.22 -0.28 -0.23 0.00 2.07 0.00 0.00 57.50 59.27 2d3s n TRP 130 Cb 0.86 -0.04 -0.07 0.00 -0.81 0.00 0.00 31.31 31.26 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 -0.93 4.82 0.56 -0.67 1.01 -0.20 -4.86 116.67 116.39 2d3s s ASP 131 Ca 0.27 -0.50 -0.01 0.00 0.71 0.00 0.00 52.55 53.03 2d3s s ASP 131 Cb 0.15 -1.01 0.06 0.00 1.01 0.00 0.00 42.92 43.13 2d3s s ASP 131 CO 0.17 0.01 0.43 -0.81 0.21 0.00 0.00 175.17 175.18 2d3s n PRO 132 N -0.79 0.26 -1.62 8.23 -0.04 -1.26 -4.79 135.00 134.99 2d3s n PRO 132 Ca -0.07 -1.12 -0.46 0.00 -0.04 0.00 0.00 63.50 61.80 2d3s n PRO 132 Cb 0.58 -0.30 -0.03 0.00 -0.04 0.00 0.00 33.50 33.71 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 -1.80 1.60 -4.06 0.54 7.27 -1.26 -4.85 117.38 114.82 2d3s n GLN 133 Ca 0.07 0.57 -0.23 0.00 0.07 0.00 0.00 57.00 57.47 2d3s n GLN 133 Cb 0.25 -2.12 -0.04 0.00 2.41 0.00 0.00 30.24 30.74 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 -0.30 4.74 0.60 1.69 -5.25 -1.26 -4.31 121.20 117.11 2d3s s ILE 134 Ca 0.68 -1.15 -0.13 0.00 -0.99 0.00 0.00 60.65 59.06 2d3s s ILE 134 Cb -0.73 -3.51 -0.04 0.00 2.95 0.00 0.00 42.46 41.12 2d3s s ILE 134 CO 0.53 -0.25 1.03 -2.84 -1.79 0.00 0.00 174.94 171.61 2d3s s PRO 135 N -3.61 3.54 0.06 0.37 0.02 -1.26 -4.98 135.00 129.14 2d3s s PRO 135 Ca 0.33 0.92 -0.20 0.00 0.02 0.00 0.00 61.00 62.07 2d3s s PRO 135 Cb -0.09 -2.07 0.04 0.00 0.02 0.00 0.00 34.50 32.40 2d3s s PRO 135 CO 0.26 -0.62 0.47 -3.38 -0.33 0.00 0.00 177.00 173.40 2d3s s HIS 136 N -2.88 -0.34 0.04 6.54 -3.43 -0.84 -1.93 115.29 112.46 2d3s s HIS 136 Ca 0.58 0.30 -0.08 0.00 -0.80 0.00 0.00 55.06 55.06 2d3s s HIS 136 Cb -0.12 0.29 -0.05 0.00 -1.43 0.00 0.00 32.58 31.27 2d3s s HIS 136 CO 0.45 -0.63 0.34 0.42 -2.00 0.00 0.00 174.74 173.32 2d3s s ILE 137 N -2.65 5.19 -0.02 -5.38 1.01 0.16 -1.38 121.20 118.13 2d3s s ILE 137 Ca -0.04 0.32 -0.13 0.00 0.00 0.00 0.00 60.65 60.80 2d3s s ILE 137 Cb -0.00 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.88 2d3s s ILE 137 CO -0.03 0.33 0.28 -0.83 0.00 0.00 0.00 174.94 174.68 2d3s s GLY 138 N -1.72 -0.13 -0.27 6.18 0.00 -0.56 -1.43 107.32 109.39 2d3s s GLY 138 Ca 0.30 0.31 -0.09 0.00 0.00 0.00 0.00 44.72 45.24 2d3s s GLY 138 CO 0.17 0.13 0.13 -0.42 0.00 0.00 0.00 173.10 173.11 2d3s s ILE 139 N -1.13 4.75 -0.13 0.90 1.01 -0.83 -0.91 121.20 124.86 2d3s s ILE 139 Ca -0.12 -0.07 -0.00 0.00 0.00 0.00 0.00 60.65 60.45 2d3s s ILE 139 Cb -0.05 -3.27 -0.02 0.00 0.01 0.00 0.00 42.46 39.13 2d3s s ILE 139 CO 0.03 0.26 -0.12 -1.81 0.00 0.00 0.00 174.94 173.30 2d3s s ASP 140 N 1.67 4.11 -0.32 3.58 1.01 0.11 -0.89 116.67 125.94 2d3s s ASP 140 Ca 0.06 -0.30 0.02 0.00 0.71 0.00 0.00 52.55 53.05 2d3s s ASP 140 Cb -0.16 -1.59 0.10 0.00 1.01 0.00 0.00 42.92 42.27 2d3s s ASP 140 CO 0.07 0.18 0.06 -0.69 0.21 0.00 0.00 175.17 174.99 2d3s s VAL 141 N 0.29 1.65 0.00 -1.27 1.01 -1.26 -0.19 120.40 120.63 2d3s s VAL 141 Ca -0.09 -1.86 0.00 0.00 0.00 0.00 0.00 61.98 60.03 2d3s s VAL 141 Cb -0.15 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.03 2d3s s VAL 141 CO 0.05 -0.58 0.00 0.59 0.00 0.00 0.00 175.10 175.16 2d3s n ASN 142 N 4.53 0.00 -4.03 3.32 3.02 0.88 -4.90 115.26 118.08 2d3s n ASN 142 Ca -0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 2d3s n ASN 142 Cb 0.42 -0.50 -0.11 0.00 -0.61 0.00 0.00 39.78 38.98 2d3s n ASN 142 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2d3s s SER 143 N -2.15 0.54 0.00 6.41 0.15 -1.26 -4.87 113.70 112.52 2d3s s SER 143 Ca 0.00 -0.61 0.31 0.00 0.70 0.00 0.00 55.95 56.35 2d3s s SER 143 Cb 0.00 0.09 1.73 0.00 -1.71 0.00 0.00 66.02 66.13 2d3s s SER 143 CO 0.00 -0.31 2.13 0.52 1.20 0.00 0.00 173.24 176.78 2d3s n VAL 144 N 1.27 0.00 -2.98 4.45 0.31 -1.26 -4.41 118.33 115.70 2d3s n VAL 144 Ca -0.22 -0.03 -0.44 0.00 -0.01 0.00 0.00 64.34 63.64 2d3s n VAL 144 Cb 0.56 -0.35 -0.03 0.00 -0.91 0.00 0.00 33.84 33.11 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 -2.08 4.76 0.29 2.52 1.01 -1.26 -4.99 121.20 121.45 2d3s s ILE 145 Ca 0.44 -1.37 -0.28 0.00 0.00 0.00 0.00 60.65 59.43 2d3s s ILE 145 Cb 0.22 -4.69 -0.14 0.00 0.01 0.00 0.00 42.46 37.86 2d3s s ILE 145 CO 0.38 -1.40 1.09 -1.20 0.00 0.00 0.00 174.94 173.81 2d3s n SER 146 N 6.46 1.65 0.06 3.58 7.64 -1.26 -4.78 113.62 126.97 2d3s n SER 146 Ca 0.13 1.18 -0.11 0.00 1.01 0.00 0.00 58.87 61.08 2d3s n SER 146 Cb 0.47 -1.33 -0.00 0.00 -1.01 0.00 0.00 64.21 62.34 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 2.16 1.39 -3.82 0.44 1.35 -1.37 -3.45 112.91 109.61 2d3s h THR 147 Ca -0.41 -2.27 -0.19 0.00 -0.55 0.00 0.00 66.41 62.99 2d3s h THR 147 Cb 1.33 2.24 -0.23 0.00 -1.73 0.00 0.00 68.15 69.75 2d3s h THR 147 CO 0.62 0.68 -0.68 -0.75 -0.25 0.00 0.00 175.52 175.14 2d3s s LYS 148 N -3.47 0.22 0.01 4.72 2.47 -1.25 -5.02 119.74 117.42 2d3s s LYS 148 Ca -0.06 -0.35 -0.04 0.00 -1.56 0.00 0.00 55.97 53.97 2d3s s LYS 148 Cb 0.10 0.08 -0.01 0.00 -1.46 0.00 0.00 37.83 36.54 2d3s s LYS 148 CO 0.85 -0.04 0.06 0.99 0.16 0.00 0.00 175.35 177.37 2d3s s THR 149 N -0.90 0.08 -0.07 3.43 2.01 -1.26 -1.96 115.64 116.97 2d3s s THR 149 Ca -0.10 -0.69 -0.03 0.00 0.31 0.00 0.00 61.69 61.17 2d3s s THR 149 Cb -0.06 -0.32 0.04 0.00 0.01 0.00 0.00 72.50 72.17 2d3s s THR 149 CO -0.00 -0.38 0.16 0.54 -0.69 0.00 0.00 174.62 174.24 2d3s s VAL 150 N -1.23 -0.05 0.62 3.82 0.11 -0.52 -4.98 120.40 118.18 2d3s s VAL 150 Ca -0.13 0.17 -0.11 0.00 -2.93 0.00 0.00 61.98 58.97 2d3s s VAL 150 Cb -0.08 -0.25 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 2d3s s VAL 150 CO 0.00 0.07 1.03 -2.16 -3.33 0.00 0.00 175.10 170.71 2d3s s PRO 151 N 1.11 3.55 0.11 1.54 0.04 -1.26 0.40 135.00 140.49 2d3s s PRO 151 Ca -0.09 0.79 -0.21 0.00 0.04 0.00 0.00 61.00 61.54 2d3s s PRO 151 Cb -0.11 -2.07 0.05 0.00 0.04 0.00 0.00 34.50 32.41 2d3s s PRO 151 CO -0.06 -0.60 0.52 -0.59 0.04 0.00 0.00 177.00 176.30 2d3s s PHE 152 N -3.11 -0.41 -0.24 0.56 -0.12 -0.81 -4.82 117.98 109.02 2d3s s PHE 152 Ca 0.56 0.26 -0.09 0.00 -0.05 0.00 0.00 56.93 57.61 2d3s s PHE 152 Cb -0.11 0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 2d3s s PHE 152 CO 0.52 -0.73 0.13 0.99 -0.05 0.00 0.00 175.22 176.08 2d3s s THR 153 N -3.29 5.01 0.27 -4.49 2.01 -1.26 -4.10 115.64 109.80 2d3s s THR 153 Ca -0.01 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 61.76 2d3s s THR 153 Cb 0.00 -3.34 -0.09 0.00 0.01 0.00 0.00 72.50 69.08 2d3s s THR 153 CO -0.09 0.34 1.01 -0.22 -0.69 0.00 0.00 174.62 174.97 2d3s s LEU 154 N 1.23 4.55 -0.72 4.42 2.96 -1.26 -5.00 118.68 124.87 2d3s s LEU 154 Ca 0.06 2.06 -0.18 0.00 -0.22 0.00 0.00 54.13 55.86 2d3s s LEU 154 Cb -0.14 -3.69 0.13 0.00 0.50 0.00 0.00 46.19 42.98 2d3s s LEU 154 CO 0.05 -0.02 0.83 -0.62 -1.32 0.00 0.00 176.35 175.28 2d3s s ASP 155 N -1.14 6.40 -0.21 3.68 2.15 -1.26 -4.99 116.67 121.30 2d3s s ASP 155 Ca 0.44 -1.80 -0.34 0.00 0.43 0.00 0.00 52.55 51.28 2d3s s ASP 155 Cb -0.27 -2.31 -0.11 0.00 -0.30 0.00 0.00 42.92 39.93 2d3s s ASP 155 CO 0.34 -1.02 2.03 -3.20 -0.17 0.00 0.00 175.17 173.16 2d3s n ASN 156 N 6.00 2.90 0.00 -0.34 2.85 -1.26 -0.15 115.26 125.26 2d3s n ASN 156 Ca 0.03 0.67 0.00 0.00 -0.11 0.00 0.00 54.58 55.17 2d3s n ASN 156 Cb 0.45 -1.35 0.00 0.00 1.24 0.00 0.00 39.78 40.12 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 5.33 2.98 3.84 8.20 0.00 -0.59 -4.92 105.19 120.03 2d3s n GLY 157 Ca 0.30 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.71 1.70 -0.14 -0.02 0.00 0.79 -4.83 107.32 103.11 2d3s s GLY 158 Ca 0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 44.72 43.59 2d3s s GLY 158 CO 0.00 -0.28 0.19 -0.42 0.00 0.00 0.00 173.10 172.59 2d3s s ILE 159 N -3.61 5.39 -0.03 0.90 1.01 -1.26 -4.20 121.20 119.40 2d3s s ILE 159 Ca 0.71 0.34 0.07 0.00 0.00 0.00 0.00 60.65 61.77 2d3s s ILE 159 Cb -0.07 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 2d3s s ILE 159 CO 0.53 0.53 -0.25 0.00 0.00 0.00 0.00 174.94 175.74 2d3s s ALA 160 N -0.39 2.14 -0.11 9.38 0.00 -0.31 -4.23 121.76 128.25 2d3s s ALA 160 Ca 0.14 -1.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 2d3s s ALA 160 Cb -0.12 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 2d3s s ALA 160 CO 0.03 0.48 -0.06 -0.80 0.00 0.00 0.00 175.76 175.41 2d3s s ASN 161 N -0.44 4.62 0.00 0.00 0.01 0.91 -1.26 114.94 118.78 2d3s s ASN 161 Ca 0.05 -0.11 0.06 0.00 -0.71 0.00 0.00 52.86 52.15 2d3s s ASN 161 Cb -0.11 -1.49 -0.02 0.00 0.41 0.00 0.00 41.25 40.04 2d3s s ASN 161 CO 0.01 0.25 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.98 2d3s s VAL 162 N -0.16 1.43 -0.10 1.60 1.01 -0.12 0.03 120.40 124.09 2d3s s VAL 162 Ca 0.02 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.12 2d3s s VAL 162 Cb -0.13 -1.21 0.02 0.00 0.00 0.00 0.00 36.38 35.06 2d3s s VAL 162 CO 0.03 0.32 -0.07 -0.69 0.00 0.00 0.00 175.10 174.69 2d3s s VAL 163 N -0.54 0.91 -0.14 2.92 1.01 -0.35 -2.11 120.40 122.10 2d3s s VAL 163 Ca 0.06 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2d3s s VAL 163 Cb -0.07 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2d3s s VAL 163 CO 0.00 0.35 -0.19 -0.63 0.00 0.00 0.00 175.10 174.62 2d3s s ILE 164 N 1.66 2.31 -0.02 2.22 1.01 -0.30 -0.44 121.20 127.65 2d3s s ILE 164 Ca 0.03 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.81 2d3s s ILE 164 Cb -0.13 -1.94 -0.00 0.00 0.01 0.00 0.00 42.46 40.40 2d3s s ILE 164 CO -0.07 0.54 -0.10 -0.75 0.00 0.00 0.00 174.94 174.56 2d3s s LYS 165 N 0.77 0.95 -0.13 2.79 2.20 -0.12 -1.00 119.74 125.21 2d3s s LYS 165 Ca -0.07 -0.34 0.01 0.00 -0.36 0.00 0.00 55.97 55.20 2d3s s LYS 165 Cb -0.16 -0.90 0.02 0.00 -1.51 0.00 0.00 37.83 35.28 2d3s s LYS 165 CO -0.00 0.16 -0.14 -0.47 -0.36 0.00 0.00 175.35 174.53 2d3s s TYR 166 N 0.02 2.05 -0.32 4.03 5.04 -0.20 -0.83 117.35 127.13 2d3s s TYR 166 Ca -0.00 -1.07 -0.08 0.00 -2.44 0.00 0.00 57.07 53.48 2d3s s TYR 166 Cb -0.07 -1.50 0.02 0.00 0.35 0.00 0.00 41.96 40.75 2d3s s TYR 166 CO 0.00 -0.57 0.13 0.34 -1.34 0.00 0.00 175.55 174.10 2d3s s ASP 167 N 1.27 5.37 0.20 4.32 2.15 -0.52 -2.12 116.67 127.33 2d3s s ASP 167 Ca -0.00 -0.84 -0.11 0.00 0.43 0.00 0.00 52.55 52.03 2d3s s ASP 167 Cb -0.14 -1.93 0.13 0.00 -0.30 0.00 0.00 42.92 40.69 2d3s s ASP 167 CO -0.06 -0.27 1.84 0.00 -0.17 0.00 0.00 175.17 176.52 2d3s h ALA 168 N 8.29 0.90 -0.19 3.66 0.00 -1.87 0.62 119.26 130.67 2d3s h ALA 168 Ca -0.28 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.58 2d3s h ALA 168 Cb 1.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2d3s h ALA 168 CO 0.62 0.36 0.13 0.66 0.00 0.00 0.00 179.25 181.02 2d3s h SER 169 N 0.96 0.09 -0.00 0.00 4.64 -1.94 -2.88 113.55 114.42 2d3s h SER 169 Ca 0.25 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2d3s h SER 169 Cb -0.04 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2d3s h SER 169 CO -0.05 0.06 -0.40 0.35 -0.87 0.00 0.00 176.83 175.92 2d3s n THR 170 N -4.50 0.00 -1.76 2.95 -2.24 -1.06 -4.99 114.28 102.69 2d3s n THR 170 Ca 0.01 -0.30 -0.16 0.00 -2.27 0.00 0.00 64.05 61.33 2d3s n THR 170 Cb 0.20 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.39 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 -1.16 -1.19 -3.32 -0.78 5.02 0.21 -4.92 118.16 112.03 2d3s n LYS 171 Ca 0.02 0.98 -0.38 0.00 -2.02 0.00 0.00 58.31 56.90 2d3s n LYS 171 Cb 0.14 -5.24 -0.06 0.00 -0.02 0.00 0.00 35.03 29.85 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 -2.68 5.18 -0.31 -0.18 1.01 -1.08 -0.91 121.20 122.23 2d3s s ILE 172 Ca 0.00 0.90 -0.07 0.00 0.00 0.00 0.00 60.65 61.48 2d3s s ILE 172 Cb 0.00 -3.80 0.01 0.00 0.01 0.00 0.00 42.46 38.68 2d3s s ILE 172 CO 0.00 0.28 0.10 -0.22 0.00 0.00 0.00 174.94 175.10 2d3s s LEU 173 N 0.94 3.99 -0.05 2.97 2.96 -0.45 -1.44 118.68 127.60 2d3s s LEU 173 Ca 0.24 -0.78 0.06 0.00 -0.22 0.00 0.00 54.13 53.44 2d3s s LEU 173 Cb -0.15 -1.90 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2d3s s LEU 173 CO 0.09 -0.22 -0.25 -1.38 -1.32 0.00 0.00 176.35 173.27 2d3s s HIS 174 N 1.50 2.42 -0.02 5.38 -3.43 -0.01 -1.89 115.29 119.24 2d3s s HIS 174 Ca 0.02 -0.61 0.04 0.00 -0.80 0.00 0.00 55.06 53.71 2d3s s HIS 174 Cb -0.18 -1.57 -0.01 0.00 -1.43 0.00 0.00 32.58 29.39 2d3s s HIS 174 CO 0.03 -0.14 -0.13 0.54 -2.00 0.00 0.00 174.74 173.04 2d3s s VAL 175 N -0.32 1.03 -0.06 -5.38 0.11 0.08 -0.94 120.40 114.91 2d3s s VAL 175 Ca 0.01 -0.53 0.06 0.00 -2.93 0.00 0.00 61.98 58.58 2d3s s VAL 175 Cb -0.12 -0.88 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 2d3s s VAL 175 CO 0.02 0.30 -0.24 -0.69 -3.33 0.00 0.00 175.10 171.17 2d3s s VAL 176 N -0.12 1.95 -0.14 2.04 1.01 0.42 -2.03 120.40 123.52 2d3s s VAL 176 Ca 0.02 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.01 2d3s s VAL 176 Cb -0.07 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.67 2d3s s VAL 176 CO 0.00 0.54 -0.18 -0.22 0.00 0.00 0.00 175.10 175.25 2d3s s LEU 177 N -0.06 1.89 -0.02 3.92 2.96 -0.35 -1.22 118.68 125.81 2d3s s LEU 177 Ca -0.06 -0.53 0.05 0.00 -0.22 0.00 0.00 54.13 53.37 2d3s s LEU 177 Cb -0.14 -1.28 -0.01 0.00 0.50 0.00 0.00 46.19 45.26 2d3s s LEU 177 CO 0.04 0.01 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.22 2d3s s VAL 178 N 1.16 1.37 -0.56 1.68 1.01 0.10 -0.71 120.40 124.44 2d3s s VAL 178 Ca -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.25 2d3s s VAL 178 Cb -0.14 -1.15 0.14 0.00 0.00 0.00 0.00 36.38 35.24 2d3s s VAL 178 CO -0.07 0.39 0.34 -0.36 0.00 0.00 0.00 175.10 175.40 2d3s s PHE 179 N -0.30 3.33 0.39 5.22 0.08 -0.88 -0.06 117.98 125.76 2d3s s PHE 179 Ca 0.04 -2.93 0.17 0.00 0.12 0.00 0.00 56.93 54.34 2d3s s PHE 179 Cb -0.08 -3.02 1.07 0.00 -0.57 0.00 0.00 43.02 40.42 2d3s s PHE 179 CO -0.00 -0.80 1.79 -1.00 -0.10 0.00 0.00 175.22 175.11 2d3s h PRO 180 N 6.83 0.42 0.00 0.24 0.13 -1.85 0.31 132.00 138.08 2d3s h PRO 180 Ca -0.05 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.99 2d3s h PRO 180 Cb 0.93 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 2d3s h PRO 180 CO 0.70 0.28 -0.32 0.77 -0.23 0.00 0.00 178.00 179.19 2d3s h SER 181 N 0.43 0.00 0.00 1.44 0.02 -1.94 -3.16 113.55 110.34 2d3s h SER 181 Ca 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.51 2d3s h SER 181 Cb 1.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.92 2d3s h SER 181 CO -0.27 0.32 -1.89 0.18 -1.14 0.00 0.00 176.83 174.03 2d3s n LEU 182 N -3.57 0.08 -0.62 5.07 4.77 -0.16 -4.98 117.00 117.59 2d3s n LEU 182 Ca -0.00 -0.04 -0.07 0.00 -0.03 0.00 0.00 56.01 55.86 2d3s n LEU 182 Cb 0.46 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2d3s n LEU 182 CO 0.36 0.02 -0.07 0.61 -1.33 0.00 0.00 177.39 176.97 2d3s n GLY 183 N 1.32 0.78 3.87 -0.72 0.00 0.90 -5.01 105.19 106.33 2d3s n GLY 183 Ca -0.03 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.29 5.23 -0.06 2.61 -4.23 -1.19 -4.97 115.64 110.73 2d3s s THR 184 Ca 0.00 0.33 0.02 0.00 -1.18 0.00 0.00 61.69 60.86 2d3s s THR 184 Cb 0.00 -3.59 0.01 0.00 1.34 0.00 0.00 72.50 70.26 2d3s s THR 184 CO 0.00 0.39 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.72 2d3s s ILE 185 N -1.28 1.10 0.00 2.99 1.01 -1.26 -2.08 121.20 121.68 2d3s s ILE 185 Ca 0.28 -0.47 0.06 0.00 0.00 0.00 0.00 60.65 60.52 2d3s s ILE 185 Cb -0.14 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.32 2d3s s ILE 185 CO 0.15 0.34 -0.19 -0.31 0.00 0.00 0.00 174.94 174.94 2d3s s TYR 186 N 0.60 1.67 0.01 3.97 2.02 0.11 -4.99 117.35 120.75 2d3s s TYR 186 Ca -0.13 -0.33 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 2d3s s TYR 186 Cb -0.15 -1.05 -0.01 0.00 -0.40 0.00 0.00 41.96 40.35 2d3s s TYR 186 CO 0.03 0.01 -0.03 -0.08 -1.57 0.00 0.00 175.55 173.91 2d3s s THR 187 N -0.56 0.21 -0.07 -0.71 -1.32 -1.26 -1.21 115.64 110.73 2d3s s THR 187 Ca 0.07 -0.58 -0.23 0.00 -1.21 0.00 0.00 61.69 59.74 2d3s s THR 187 Cb -0.08 -0.27 0.05 0.00 -1.51 0.00 0.00 72.50 70.69 2d3s s THR 187 CO 0.00 -0.24 0.51 -0.51 -2.21 0.00 0.00 174.62 172.18 2d3s s ILE 188 N -0.82 0.02 0.02 5.08 2.07 -0.86 -4.97 121.20 121.74 2d3s s ILE 188 Ca -0.07 -0.18 -0.23 0.00 -1.41 0.00 0.00 60.65 58.76 2d3s s ILE 188 Cb -0.06 -0.81 0.05 0.00 0.13 0.00 0.00 42.46 41.77 2d3s s ILE 188 CO -0.00 -0.10 0.51 0.00 -1.91 0.00 0.00 174.94 173.44 2d3s s ALA 189 N -0.93 -1.31 0.22 1.50 0.00 -1.26 -0.75 121.76 119.23 2d3s s ALA 189 Ca -0.10 0.66 -0.16 0.00 0.00 0.00 0.00 51.96 52.36 2d3s s ALA 189 Cb -0.03 0.28 0.02 0.00 0.00 0.00 0.00 23.12 23.38 2d3s s ALA 189 CO 0.06 -0.45 0.52 0.34 0.00 0.00 0.00 175.76 176.24 2d3s s ASP 190 N -1.76 -0.20 -0.20 0.00 2.15 -0.79 -5.00 116.67 110.87 2d3s s ASP 190 Ca -0.07 -0.62 -0.17 0.00 0.43 0.00 0.00 52.55 52.11 2d3s s ASP 190 Cb -0.01 0.59 -0.04 0.00 -0.30 0.00 0.00 42.92 43.16 2d3s s ASP 190 CO 0.01 -1.10 0.44 -0.63 -0.17 0.00 0.00 175.17 173.72 2d3s s ILE 191 N -3.92 5.16 -0.04 4.11 1.01 -1.26 -1.34 121.20 124.92 2d3s s ILE 191 Ca 0.13 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.58 2d3s s ILE 191 Cb -0.01 -3.77 0.03 0.00 0.01 0.00 0.00 42.46 38.71 2d3s s ILE 191 CO 0.01 0.22 -0.01 -0.69 0.00 0.00 0.00 174.94 174.48 2d3s s VAL 192 N 1.44 0.28 -0.63 2.92 1.01 -0.09 -4.98 120.40 120.35 2d3s s VAL 192 Ca 0.21 0.07 -0.15 0.00 0.00 0.00 0.00 61.98 62.11 2d3s s VAL 192 Cb -0.15 -0.39 0.16 0.00 0.00 0.00 0.00 36.38 36.00 2d3s s VAL 192 CO 0.09 0.19 0.58 -0.62 0.00 0.00 0.00 175.10 175.34 2d3s s ASP 193 N 1.27 6.35 0.26 3.32 -1.08 -1.26 -4.65 116.67 120.87 2d3s s ASP 193 Ca -0.06 -2.10 -0.02 0.00 -0.52 0.00 0.00 52.55 49.85 2d3s s ASP 193 Cb -0.13 -2.20 0.46 0.00 -1.46 0.00 0.00 42.92 39.59 2d3s s ASP 193 CO -0.02 -0.75 1.82 -0.07 0.52 0.00 0.00 175.17 176.67 2d3s h LEU 194 N 8.49 0.80 -2.23 -1.34 3.38 -1.97 -1.38 115.31 121.05 2d3s h LEU 194 Ca -0.16 0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.88 2d3s h LEU 194 Cb 1.08 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 2d3s h LEU 194 CO 0.94 0.44 0.08 0.50 0.09 0.00 0.00 178.44 180.48 2d3s h LYS 195 N 0.90 0.00 0.00 1.13 3.64 -1.92 0.11 116.57 120.42 2d3s h LYS 195 Ca 0.44 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.81 2d3s h LYS 195 Cb 0.40 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2d3s h LYS 195 CO -0.25 0.00 -0.73 0.37 -2.27 0.00 0.00 179.45 176.56 2d3s h GLN 196 N 0.00 0.00 0.00 1.90 5.75 -1.67 -3.40 115.11 117.69 2d3s h GLN 196 Ca 0.04 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.37 2d3s h GLN 196 Cb 0.19 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 2d3s h GLN 196 CO -0.00 0.02 -1.63 1.33 -2.65 0.00 0.00 178.83 175.90 2d3s n VAL 197 N -2.81 0.63 -4.34 2.39 0.24 -0.66 -5.07 118.33 108.71 2d3s n VAL 197 Ca 0.01 -0.38 -0.24 0.00 -2.04 0.00 0.00 64.34 61.69 2d3s n VAL 197 Cb 0.56 -0.77 -0.09 0.00 -1.47 0.00 0.00 33.84 32.08 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 -4.75 2.97 0.85 1.34 1.43 0.28 -4.71 118.68 116.09 2d3s s LEU 198 Ca -0.05 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.20 2d3s s LEU 198 Cb 0.03 -1.54 0.10 0.00 0.03 0.00 0.00 46.19 44.81 2d3s s LEU 198 CO 0.37 0.04 1.15 -2.16 0.23 0.00 0.00 176.35 175.98 2d3s s PRO 199 N -3.38 1.66 0.17 1.29 0.04 -1.26 -4.67 135.00 128.85 2d3s s PRO 199 Ca 0.29 0.24 -0.14 0.00 0.04 0.00 0.00 61.00 61.42 2d3s s PRO 199 Cb -0.07 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.69 2d3s s PRO 199 CO 0.17 -1.83 1.74 0.93 0.04 0.00 0.00 177.00 178.06 2d3s h GLU 200 N -1.23 0.28 -5.77 4.56 5.08 -1.96 -3.42 114.58 112.12 2d3s h GLU 200 Ca -0.48 -0.02 -0.66 0.00 -1.00 0.00 0.00 59.36 57.20 2d3s h GLU 200 Cb 1.32 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 30.43 2d3s h GLU 200 CO 0.64 0.19 -0.51 -1.12 -1.00 0.00 0.00 179.01 177.20 2d3s s SER 201 N -5.36 6.19 0.31 1.42 0.01 -1.26 -0.25 113.70 114.76 2d3s s SER 201 Ca -0.13 0.36 -0.01 0.00 1.31 0.00 0.00 55.95 57.47 2d3s s SER 201 Cb 0.14 -1.94 -0.01 0.00 0.21 0.00 0.00 66.02 64.42 2d3s s SER 201 CO 0.72 0.34 0.38 0.68 0.41 0.00 0.00 173.24 175.78 2d3s s VAL 202 N -1.13 0.00 0.00 3.43 -7.23 0.18 -4.20 120.40 111.45 2d3s s VAL 202 Ca 0.20 -1.72 0.07 0.00 -1.81 0.00 0.00 61.98 58.72 2d3s s VAL 202 Cb -0.12 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 2d3s s VAL 202 CO 0.10 0.00 -0.21 0.20 -0.31 0.00 0.00 175.10 174.87 2d3s s ASN 203 N -3.23 3.49 0.05 4.85 0.02 -0.15 -0.48 114.94 119.50 2d3s s ASN 203 Ca 0.33 -0.43 0.09 0.00 -1.02 0.00 0.00 52.86 51.83 2d3s s ASN 203 Cb 0.01 -0.51 -0.03 0.00 0.02 0.00 0.00 41.25 40.74 2d3s s ASN 203 CO 0.19 0.29 -0.25 0.68 0.02 0.00 0.00 177.10 178.04 2d3s s VAL 204 N -0.76 1.99 -1.14 1.60 -7.23 -1.26 -1.97 120.40 111.62 2d3s s VAL 204 Ca 0.12 -1.35 0.00 0.00 -1.81 0.00 0.00 61.98 58.94 2d3s s VAL 204 Cb -0.10 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 35.13 2d3s s VAL 204 CO 0.02 0.29 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 2d3s n GLY 205 N 1.74 -0.56 3.40 2.32 0.00 -0.87 -1.52 105.19 109.69 2d3s n GLY 205 Ca -0.17 -0.71 -0.20 0.00 0.00 0.00 0.00 46.02 44.93 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 1.85 -0.17 1.61 0.40 -0.13 -0.62 117.98 117.92 2d3s s PHE 206 Ca 0.00 -0.68 -0.21 0.00 -0.60 0.00 0.00 56.93 55.44 2d3s s PHE 206 Cb 0.00 -1.00 0.05 0.00 0.51 0.00 0.00 43.02 42.58 2d3s s PHE 206 CO 0.00 0.28 0.56 0.45 0.70 0.00 0.00 175.22 177.21 2d3s s SER 207 N -3.40 -0.57 0.16 1.36 0.15 -0.77 -1.76 113.70 108.87 2d3s s SER 207 Ca 0.27 1.00 -0.07 0.00 0.70 0.00 0.00 55.95 57.85 2d3s s SER 207 Cb 0.03 1.00 -0.01 0.00 -1.71 0.00 0.00 66.02 65.32 2d3s s SER 207 CO 0.10 -0.28 0.24 0.00 1.20 0.00 0.00 173.24 174.51 2d3s s ALA 208 N -0.04 0.18 -0.03 5.45 0.00 -0.60 -0.63 121.76 126.08 2d3s s ALA 208 Ca -0.03 -1.01 -0.23 0.00 0.00 0.00 0.00 51.96 50.69 2d3s s ALA 208 Cb -0.04 0.87 0.05 0.00 0.00 0.00 0.00 23.12 24.00 2d3s s ALA 208 CO 0.02 -0.62 0.50 0.00 0.00 0.00 0.00 175.76 175.67 2d3s s ALA 209 N -3.99 -1.30 0.51 0.00 0.00 -1.04 -2.14 121.76 113.81 2d3s s ALA 209 Ca 0.19 0.84 0.05 0.00 0.00 0.00 0.00 51.96 53.04 2d3s s ALA 209 Cb 0.04 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.21 2d3s s ALA 209 CO 0.01 -0.32 0.31 0.95 0.00 0.00 0.00 175.76 176.70 2d3s s THR 210 N -1.28 1.78 -0.05 0.00 -4.23 0.28 0.37 115.64 112.51 2d3s s THR 210 Ca -0.12 -1.58 -0.41 0.00 -1.18 0.00 0.00 61.69 58.40 2d3s s THR 210 Cb -0.02 -2.37 -0.20 0.00 1.34 0.00 0.00 72.50 71.25 2d3s s THR 210 CO 0.07 0.00 1.16 0.61 -0.54 0.00 0.00 174.62 175.92 2d3s n GLY 211 N -1.59 -0.16 3.78 3.99 0.00 0.32 -4.13 105.19 107.40 2d3s n GLY 211 Ca -0.03 0.79 -0.38 0.00 0.00 0.00 0.00 46.02 46.39 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 0.42 7.38 0.32 1.61 2.15 -1.26 0.23 116.67 127.51 2d3s s ASP 212 Ca 0.92 1.76 0.09 0.00 0.43 0.00 0.00 52.55 55.75 2d3s s ASP 212 Cb -1.27 -2.55 0.87 0.00 -0.30 0.00 0.00 42.92 39.68 2d3s s ASP 212 CO 0.59 0.06 1.72 -0.65 -0.17 0.00 0.00 175.17 176.71 2d3s h PRO 213 N 3.66 0.51 -0.14 4.34 0.11 -1.93 -0.00 132.00 138.55 2d3s h PRO 213 Ca -0.47 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.65 2d3s h PRO 213 Cb 1.20 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2d3s h PRO 213 CO 0.66 0.34 0.42 0.66 -0.21 0.00 0.00 178.00 179.87 2d3s h SER 214 N 0.53 0.00 0.96 -2.05 4.64 -1.99 0.46 113.55 116.10 2d3s h SER 214 Ca 0.64 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.96 2d3s h SER 214 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2d3s h SER 214 CO -0.50 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.07 2d3s n GLY 215 N -1.32 -1.44 2.35 -0.77 0.00 -0.02 -4.91 105.19 99.08 2d3s n GLY 215 Ca 0.01 -0.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 2d3s n GLY 215 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d3s n LYS 216 N -1.59 -1.70 -3.80 1.61 5.02 0.16 -4.95 118.16 112.91 2d3s n LYS 216 Ca 0.06 0.87 -0.28 0.00 -2.02 0.00 0.00 58.31 56.93 2d3s n LYS 216 Cb 0.32 -5.35 -0.16 0.00 -0.02 0.00 0.00 35.03 29.81 2d3s n LYS 216 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2d3s s GLN 217 N -4.31 0.95 0.52 1.97 -1.52 -1.26 -5.00 119.66 111.01 2d3s s GLN 217 Ca 0.00 -0.58 0.31 0.00 -1.95 0.00 0.00 55.36 53.14 2d3s s GLN 217 Cb 0.00 -2.23 1.13 0.00 -0.22 0.00 0.00 33.01 31.69 2d3s s GLN 217 CO 0.00 -0.62 1.90 0.00 -0.25 0.00 0.00 175.29 176.32 2d3s h ARG 218 N 8.16 0.00 0.00 2.91 3.08 -1.96 -2.90 114.38 123.67 2d3s h ARG 218 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2d3s h ARG 218 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 2d3s h ARG 218 CO 0.36 0.01 0.00 0.09 -1.07 0.00 0.00 179.97 179.36 2d3s n ASN 219 N -3.10 0.79 -3.59 7.04 4.13 -1.26 -4.33 115.26 114.94 2d3s n ASN 219 Ca 0.01 0.59 -0.41 0.00 1.68 0.00 0.00 54.58 56.45 2d3s n ASN 219 Cb 0.36 -0.80 -0.05 0.00 -1.54 0.00 0.00 39.78 37.76 2d3s n ASN 219 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2d3s n ALA 220 N -1.78 3.78 -3.04 5.41 0.00 -1.10 -4.64 120.51 119.14 2d3s n ALA 220 Ca 0.05 -3.27 -0.09 0.00 0.00 0.00 0.00 53.44 50.13 2d3s n ALA 220 Cb 0.40 -3.56 -0.06 0.00 0.00 0.00 0.00 19.45 16.22 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 4.59 0.00 0.09 0.00 -1.32 -1.25 0.12 115.64 117.87 2d3s s THR 221 Ca 0.54 -1.46 -0.25 0.00 -1.21 0.00 0.00 61.69 59.31 2d3s s THR 221 Cb 0.14 -2.20 0.09 0.00 -1.51 0.00 0.00 72.50 69.01 2d3s s THR 221 CO 0.07 -0.02 1.14 -1.83 -2.21 0.00 0.00 174.62 171.77 2d3s s GLU 222 N -4.03 0.90 0.24 7.08 -1.05 -1.23 -4.19 118.70 116.43 2d3s s GLU 222 Ca 0.24 -0.56 -0.01 0.00 -0.15 0.00 0.00 54.97 54.49 2d3s s GLU 222 Cb 0.00 0.26 -0.04 0.00 -0.44 0.00 0.00 34.13 33.92 2d3s s GLU 222 CO 0.09 -0.42 0.44 0.95 0.95 0.00 0.00 175.26 177.27 2d3s s THR 223 N -2.30 5.17 -0.42 1.83 -4.23 -0.55 -4.78 115.64 110.35 2d3s s THR 223 Ca 0.22 -0.38 0.04 0.00 -1.18 0.00 0.00 61.69 60.38 2d3s s THR 223 Cb -0.01 -3.77 0.17 0.00 1.34 0.00 0.00 72.50 70.23 2d3s s THR 223 CO 0.02 -0.28 0.34 -1.00 -0.54 0.00 0.00 174.62 173.16 2d3s s HIS 224 N -1.99 1.19 -0.17 3.99 0.09 -1.26 -3.77 115.29 113.36 2d3s s HIS 224 Ca 0.39 -2.34 -0.08 0.00 -0.00 0.00 0.00 55.06 53.04 2d3s s HIS 224 Cb -0.10 -1.01 -0.04 0.00 -0.00 0.00 0.00 32.58 31.43 2d3s s HIS 224 CO 0.30 -0.82 0.10 -0.51 -0.00 0.00 0.00 174.74 173.82 2d3s s ASP 225 N 0.05 5.98 -0.20 1.40 1.01 -0.73 -1.53 116.67 122.65 2d3s s ASP 225 Ca 0.32 0.22 -0.07 0.00 0.71 0.00 0.00 52.55 53.72 2d3s s ASP 225 Cb 0.02 -2.00 -0.04 0.00 1.01 0.00 0.00 42.92 41.91 2d3s s ASP 225 CO -0.18 0.24 0.06 -0.63 0.21 0.00 0.00 175.17 174.87 2d3s s ILE 226 N 0.01 4.66 -0.15 0.77 -1.09 0.45 -0.44 121.20 125.42 2d3s s ILE 226 Ca 0.08 -0.07 0.05 0.00 -2.23 0.00 0.00 60.65 58.48 2d3s s ILE 226 Cb -0.12 -3.12 -0.23 0.00 -1.58 0.00 0.00 42.46 37.41 2d3s s ILE 226 CO 0.00 0.42 0.25 0.18 -1.23 0.00 0.00 174.94 174.57 2d3s n LEU 227 N 3.91 1.76 -3.52 2.97 4.32 0.39 -1.25 117.00 125.58 2d3s n LEU 227 Ca -0.16 0.14 -0.13 0.00 -0.02 0.00 0.00 56.01 55.84 2d3s n LEU 227 Cb 0.52 -0.43 -0.04 0.00 -1.62 0.00 0.00 43.42 41.85 2d3s n LEU 227 CO 0.34 0.69 0.32 -0.94 -1.22 0.00 0.00 177.39 176.58 2d3s s SER 228 N -6.38 -0.47 -0.28 -1.43 1.04 -1.24 -4.34 113.70 100.60 2d3s s SER 228 Ca -0.18 0.06 -0.11 0.00 0.48 0.00 0.00 55.95 56.19 2d3s s SER 228 Cb 0.07 0.54 0.11 0.00 0.10 0.00 0.00 66.02 66.84 2d3s s SER 228 CO 0.76 -0.84 0.63 0.86 0.98 0.00 0.00 173.24 175.63 2d3s s TRP 229 N -3.12 -1.21 0.12 5.02 -0.00 -0.53 -2.39 118.94 116.82 2d3s s TRP 229 Ca -0.02 2.18 0.11 0.00 -0.00 0.00 0.00 56.10 58.37 2d3s s TRP 229 Cb -0.00 0.71 -0.04 0.00 -0.00 0.00 0.00 33.47 34.14 2d3s s TRP 229 CO -0.07 -0.61 -0.27 -1.54 -0.00 0.00 0.00 176.95 174.46 2d3s s SER 230 N 2.55 3.26 -0.06 5.86 1.04 -0.19 -0.59 113.70 125.57 2d3s s SER 230 Ca -0.07 -0.72 -0.05 0.00 0.48 0.00 0.00 55.95 55.59 2d3s s SER 230 Cb -0.10 -0.22 0.02 0.00 0.10 0.00 0.00 66.02 65.81 2d3s s SER 230 CO -0.18 0.18 0.15 0.12 0.98 0.00 0.00 173.24 174.49 2d3s s PHE 231 N -1.03 -0.16 -0.04 5.02 5.36 0.95 -1.86 117.98 126.22 2d3s s PHE 231 Ca 0.13 0.41 -0.01 0.00 -0.96 0.00 0.00 56.93 56.50 2d3s s PHE 231 Cb -0.10 0.03 0.03 0.00 -0.34 0.00 0.00 43.02 42.64 2d3s s PHE 231 CO 0.05 -0.10 0.08 0.45 -1.46 0.00 0.00 175.22 174.25 2d3s s SER 232 N 0.33 -0.02 0.01 6.13 0.15 -0.30 -0.69 113.70 119.31 2d3s s SER 232 Ca -0.02 0.16 0.02 0.00 0.70 0.00 0.00 55.95 56.81 2d3s s SER 232 Cb -0.03 0.06 -0.01 0.00 -1.71 0.00 0.00 66.02 64.32 2d3s s SER 232 CO -0.01 -0.13 -0.07 0.00 1.20 0.00 0.00 173.24 174.23 2d3s s ALA 233 N 1.03 0.53 -0.08 5.45 0.00 0.22 -0.55 121.76 128.36 2d3s s ALA 233 Ca -0.08 -0.44 -0.01 0.00 0.00 0.00 0.00 51.96 51.43 2d3s s ALA 233 Cb -0.11 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.97 2d3s s ALA 233 CO -0.04 0.07 -0.03 0.45 0.00 0.00 0.00 175.76 176.22 2d3s s SER 234 N -0.65 1.69 -0.32 0.00 0.15 -0.18 -1.37 113.70 113.03 2d3s s SER 234 Ca -0.02 -0.15 0.01 0.00 0.70 0.00 0.00 55.95 56.49 2d3s s SER 234 Cb -0.05 -0.55 0.08 0.00 -1.71 0.00 0.00 66.02 63.78 2d3s s SER 234 CO 0.00 -0.16 0.02 -0.22 1.20 0.00 0.00 173.24 174.08 2d3s s LEU 235 N 1.79 4.24 0.14 3.45 0.20 0.45 -2.16 118.68 126.79 2d3s s LEU 235 Ca 0.03 -1.68 -0.12 0.00 0.69 0.00 0.00 54.13 53.05 2d3s s LEU 235 Cb -0.13 -1.66 -0.01 0.00 -0.43 0.00 0.00 46.19 43.97 2d3s s LEU 235 CO -0.05 -0.32 1.55 1.55 -0.29 0.00 0.00 176.35 178.78 2d3s h PRO 236 N 7.83 0.87 0.00 0.98 0.13 -1.86 -1.81 132.00 138.14 2d3s h PRO 236 Ca -0.14 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2d3s h PRO 236 Cb 1.04 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2d3s h PRO 236 CO 0.53 0.97 0.00 0.41 -0.23 0.00 0.00 178.00 179.69