#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 421p s THR 2 N 0.00 2.62 0.16 3.17 2.01 -1.26 -4.82 115.64 117.52 421p s THR 2 Ca 0.00 0.11 0.07 0.00 0.31 0.00 0.00 61.69 62.18 421p s THR 2 Cb 0.00 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 421p s THR 2 CO 0.00 -0.00 -0.02 -1.61 -0.69 0.00 0.00 174.62 172.30 421p s GLU 3 N 2.80 2.36 -0.23 4.92 2.02 -1.26 -1.00 118.70 128.30 421p s GLU 3 Ca 0.80 -1.08 0.01 0.00 0.02 0.00 0.00 54.97 54.72 421p s GLU 3 Cb -0.45 -2.36 0.06 0.00 0.10 0.00 0.00 34.13 31.48 421p s GLU 3 CO 0.36 0.47 -0.08 0.71 0.02 0.00 0.00 175.26 176.74 421p s TYR 4 N -1.63 2.61 -0.31 1.61 2.02 -0.59 -4.91 117.35 116.16 421p s TYR 4 Ca 0.26 -1.87 -0.29 0.00 -0.37 0.00 0.00 57.07 54.81 421p s TYR 4 Cb -0.10 -1.68 0.01 0.00 -0.40 0.00 0.00 41.96 39.80 421p s TYR 4 CO 0.18 -0.79 1.19 0.21 -1.57 0.00 0.00 175.55 174.76 421p s LYS 5 N 1.32 4.00 0.01 -0.62 2.36 -1.26 -3.15 119.74 122.40 421p s LYS 5 Ca -0.06 1.16 0.08 0.00 -2.55 0.00 0.00 55.97 54.60 421p s LYS 5 Cb -0.19 -3.81 -0.02 0.00 -1.05 0.00 0.00 37.83 32.76 421p s LYS 5 CO -0.06 -1.01 -0.26 -0.51 1.55 0.00 0.00 175.35 175.06 421p s LEU 6 N 3.99 2.09 -0.03 5.43 1.02 -0.89 0.25 118.68 130.55 421p s LEU 6 Ca 0.51 -0.51 0.03 0.00 0.02 0.00 0.00 54.13 54.17 421p s LEU 6 Cb -0.14 -1.30 0.00 0.00 0.02 0.00 0.00 46.19 44.77 421p s LEU 6 CO 0.19 0.29 -0.10 0.54 0.02 0.00 0.00 176.35 177.30 421p s VAL 7 N -0.68 0.83 -0.26 -1.59 0.11 -0.06 -1.91 120.40 116.84 421p s VAL 7 Ca 0.10 -0.38 -0.13 0.00 -2.93 0.00 0.00 61.98 58.64 421p s VAL 7 Cb -0.10 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 33.97 421p s VAL 7 CO 0.00 0.26 0.30 -0.69 -3.33 0.00 0.00 175.10 171.64 421p s VAL 8 N 0.19 5.23 0.12 2.04 1.01 -0.16 -1.36 120.40 127.47 421p s VAL 8 Ca -0.03 0.43 0.01 0.00 0.00 0.00 0.00 61.98 62.39 421p s VAL 8 Cb -0.09 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 421p s VAL 8 CO 0.01 0.21 -0.03 0.54 0.00 0.00 0.00 175.10 175.83 421p s VAL 9 N 1.84 0.60 -5.00 2.92 0.11 -0.78 -2.98 120.40 117.10 421p s VAL 9 Ca 0.12 -1.94 0.00 0.00 -2.93 0.00 0.00 61.98 57.23 421p s VAL 9 Cb -0.16 -1.86 0.00 0.00 -1.53 0.00 0.00 36.38 32.83 421p s VAL 9 CO 0.10 -0.70 0.00 0.61 -3.33 0.00 0.00 175.10 171.77 421p n GLY 10 N -0.11 0.18 3.86 6.54 0.00 -1.26 -1.65 105.19 112.75 421p n GLY 10 Ca -0.10 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.83 421p n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 421p s ALA 11 N -1.18 2.70 0.48 4.61 0.00 -1.24 -4.11 121.76 123.01 421p s ALA 11 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 51.96 51.40 421p s ALA 11 Cb 0.00 -3.04 -0.07 0.00 0.00 0.00 0.00 23.12 20.01 421p s ALA 11 CO 0.00 -1.34 1.11 1.03 0.00 0.00 0.00 175.76 176.55 421p s ARG 12 N -5.33 3.73 0.00 0.00 0.52 -1.26 -3.28 118.95 113.32 421p s ARG 12 Ca 0.59 1.60 0.00 0.00 -0.52 0.00 0.00 55.73 57.40 421p s ARG 12 Cb -0.12 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 33.10 421p s ARG 12 CO 0.52 -0.53 0.00 0.41 0.02 0.00 0.00 175.30 175.72 421p n GLY 13 N 0.20 2.36 0.16 -3.53 0.00 -1.26 -4.89 105.19 98.23 421p n GLY 13 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 421p n GLY 13 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 421p h VAL 14 N 0.00 0.00 0.00 1.61 -1.51 -1.93 -3.46 116.25 110.95 421p h VAL 14 Ca 0.00 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 421p h VAL 14 Cb 0.00 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 421p h VAL 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 421p n GLY 15 N 0.63 1.85 0.39 5.19 0.00 -1.26 -4.70 105.19 107.30 421p n GLY 15 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 421p n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 421p h LYS 16 N 0.00 -0.35 0.00 1.61 1.57 -1.90 -1.41 116.57 116.10 421p h LYS 16 Ca 0.00 0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 421p h LYS 16 Cb 0.00 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 421p h LYS 16 CO 0.00 -0.23 -0.27 0.77 -0.57 0.00 0.00 179.45 179.15 421p h SER 17 N -0.36 0.00 0.07 0.86 0.02 -1.95 -2.82 113.55 109.36 421p h SER 17 Ca 0.12 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 421p h SER 17 Cb 0.59 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.13 421p h SER 17 CO -0.53 0.27 -0.03 0.00 -1.14 0.00 0.00 176.83 175.40 421p h ALA 18 N 1.73 -0.09 -0.74 3.77 0.00 -1.87 -2.11 119.26 119.95 421p h ALA 18 Ca -0.00 -0.29 0.16 0.00 0.00 0.00 0.00 54.91 54.77 421p h ALA 18 Cb 0.49 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.20 421p h ALA 18 CO 0.04 -0.20 0.19 -0.07 0.00 0.00 0.00 179.25 179.21 421p h LEU 19 N -0.79 0.04 -0.30 0.00 4.07 -1.20 -1.98 115.31 115.16 421p h LEU 19 Ca -0.01 0.14 -0.07 0.00 0.08 0.00 0.00 57.88 58.02 421p h LEU 19 Cb 0.61 0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.53 421p h LEU 19 CO 0.02 -0.03 -0.10 0.74 -1.08 0.00 0.00 178.44 177.99 421p h THR 20 N 0.29 1.29 0.00 0.22 2.02 -1.51 -2.51 112.91 112.71 421p h THR 20 Ca 0.42 -1.17 -0.07 0.00 0.77 0.00 0.00 66.41 66.37 421p h THR 20 Cb 0.71 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 421p h THR 20 CO -0.50 0.37 -0.32 0.40 0.37 0.00 0.00 175.52 175.84 421p h ILE 21 N 0.36 0.73 -0.36 3.11 2.04 -1.25 -1.42 117.51 120.71 421p h ILE 21 Ca 0.07 -1.44 -0.14 0.00 1.00 0.00 0.00 64.86 64.36 421p h ILE 21 Cb 0.60 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.60 421p h ILE 21 CO 0.04 0.32 -0.33 -0.61 0.00 0.00 0.00 178.15 177.56 421p h GLN 22 N 0.00 0.80 0.25 2.37 5.75 -1.30 -1.02 115.11 121.96 421p h GLN 22 Ca -0.00 -0.38 -0.01 0.00 -0.15 0.00 0.00 58.65 58.10 421p h GLN 22 Cb 0.90 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.45 421p h GLN 22 CO 0.04 1.01 -0.12 1.25 -2.65 0.00 0.00 178.83 178.36 421p h LEU 23 N 0.67 -0.29 -0.04 -2.39 7.12 -1.24 -1.19 115.31 117.96 421p h LEU 23 Ca 0.07 -0.24 -0.02 0.00 0.13 0.00 0.00 57.88 57.82 421p h LEU 23 Cb 0.88 0.07 -0.00 0.00 -0.53 0.00 0.00 40.66 41.08 421p h LEU 23 CO 0.08 0.15 -0.04 0.40 -0.13 0.00 0.00 178.44 178.90 421p h ILE 24 N -0.80 1.39 -0.05 4.05 1.08 -1.30 -3.37 117.51 118.50 421p h ILE 24 Ca -0.03 -1.21 0.00 0.00 -0.39 0.00 0.00 64.86 63.22 421p h ILE 24 Cb 0.51 2.12 0.00 0.00 -3.07 0.00 0.00 36.82 36.38 421p h ILE 24 CO 0.06 0.33 0.00 0.00 -0.69 0.00 0.00 178.15 177.84 421p n GLN 25 N -4.77 0.58 -3.59 2.37 6.02 -0.47 -5.06 117.38 112.46 421p n GLN 25 Ca -0.08 -1.12 -0.26 0.00 -0.01 0.00 0.00 57.00 55.53 421p n GLN 25 Cb 0.28 -1.15 0.05 0.00 1.02 0.00 0.00 30.24 30.44 421p n GLN 25 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 421p n ASN 26 N 0.36 -4.95 -3.59 1.08 5.15 -0.45 -4.93 115.26 107.93 421p n ASN 26 Ca 0.05 -0.92 -0.08 0.00 -0.60 0.00 0.00 54.58 53.03 421p n ASN 26 Cb 0.22 -3.89 -0.05 0.00 -0.53 0.00 0.00 39.78 35.53 421p n ASN 26 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 421p s HIS 27 N -3.49 -0.28 -0.26 1.20 -3.43 -1.24 -4.99 115.29 102.80 421p s HIS 27 Ca 0.40 0.46 -0.26 0.00 -0.80 0.00 0.00 55.06 54.85 421p s HIS 27 Cb -0.12 0.47 0.00 0.00 -1.43 0.00 0.00 32.58 31.50 421p s HIS 27 CO 0.83 -0.26 0.91 0.12 -2.00 0.00 0.00 174.74 174.33 421p s PHE 28 N -1.18 3.28 -0.51 0.38 5.36 -1.26 -3.92 117.98 120.12 421p s PHE 28 Ca 0.01 1.19 -0.19 0.00 -0.96 0.00 0.00 56.93 56.99 421p s PHE 28 Cb -0.01 -3.21 0.06 0.00 -0.34 0.00 0.00 43.02 39.53 421p s PHE 28 CO -0.01 -0.49 0.61 0.08 -1.46 0.00 0.00 175.22 173.95 421p s VAL 29 N 3.05 4.91 -0.52 3.12 1.01 -1.26 -4.88 120.40 125.83 421p s VAL 29 Ca 0.38 -0.60 0.08 0.00 0.00 0.00 0.00 61.98 61.84 421p s VAL 29 Cb -0.15 -4.30 0.48 0.00 0.00 0.00 0.00 36.38 32.41 421p s VAL 29 CO 0.09 -0.82 1.28 -0.67 0.00 0.00 0.00 175.10 174.98 421p n ASP 30 N 6.09 3.77 -4.64 3.32 2.03 -1.26 -4.89 116.55 120.97 421p n ASP 30 Ca -0.07 -2.60 -0.24 0.00 0.52 0.00 0.00 54.79 52.39 421p n ASP 30 Cb 0.45 -0.62 0.11 0.00 -0.72 0.00 0.00 41.12 40.34 421p n ASP 30 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 421p s GLU 31 N -2.04 1.65 -0.37 -0.67 8.01 -1.26 -5.06 118.70 118.96 421p s GLU 31 Ca 0.33 -0.90 -0.05 0.00 0.01 0.00 0.00 54.97 54.35 421p s GLU 31 Cb 0.25 -2.26 0.07 0.00 -4.31 0.00 0.00 34.13 27.88 421p s GLU 31 CO 0.09 -1.51 0.15 -0.47 0.01 0.00 0.00 175.26 173.53 421p s TYR 32 N -3.23 3.36 -0.50 1.61 6.14 -1.26 -5.02 117.35 118.45 421p s TYR 32 Ca 0.66 -1.77 0.07 0.00 0.64 0.00 0.00 57.07 56.67 421p s TYR 32 Cb -0.06 -2.65 0.19 0.00 0.42 0.00 0.00 41.96 39.86 421p s TYR 32 CO 0.45 -0.83 0.67 -3.47 0.64 0.00 0.00 175.55 173.01 421p n ASP 33 N 4.75 -2.98 -4.76 4.32 2.03 -1.26 -5.14 116.55 113.52 421p n ASP 33 Ca -0.10 -2.85 -0.41 0.00 0.52 0.00 0.00 54.79 51.96 421p n ASP 33 Cb 0.43 1.40 -0.02 0.00 -0.72 0.00 0.00 41.12 42.21 421p n ASP 33 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 421p s PRO 34 N 0.73 4.26 0.07 -0.67 0.02 -1.26 -4.98 135.00 133.17 421p s PRO 34 Ca 0.31 2.34 -0.17 0.00 0.02 0.00 0.00 61.00 63.49 421p s PRO 34 Cb 0.01 -3.07 -0.06 0.00 0.02 0.00 0.00 34.50 31.40 421p s PRO 34 CO -0.08 -0.37 0.52 0.99 -0.33 0.00 0.00 177.00 177.73 421p s THR 35 N -0.60 4.85 -0.12 0.99 2.01 -1.26 -4.99 115.64 116.52 421p s THR 35 Ca 0.55 1.02 -0.12 0.00 0.31 0.00 0.00 61.69 63.45 421p s THR 35 Cb -0.42 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 421p s THR 35 CO 0.50 0.49 -0.23 -0.38 -0.69 0.00 0.00 174.62 174.32 421p n ILE 36 N 1.54 0.98 -3.64 1.82 2.08 -1.26 -4.13 119.36 116.75 421p n ILE 36 Ca -0.10 0.26 -0.05 0.00 0.56 0.00 0.00 62.75 63.42 421p n ILE 36 Cb 0.51 -2.05 -0.07 0.00 -0.75 0.00 0.00 39.64 37.29 421p n ILE 36 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 421p s GLU 37 N -2.24 0.54 -0.02 0.38 2.12 -1.26 -3.60 118.70 114.62 421p s GLU 37 Ca -0.19 0.89 0.04 0.00 0.36 0.00 0.00 54.97 56.07 421p s GLU 37 Cb 0.03 0.13 -0.00 0.00 0.26 0.00 0.00 34.13 34.54 421p s GLU 37 CO 0.28 -0.11 -0.12 -0.51 -0.54 0.00 0.00 175.26 174.26 421p s ASP 38 N 1.33 1.52 0.02 -1.70 1.01 -0.83 -5.03 116.67 113.00 421p s ASP 38 Ca -0.08 -0.24 0.07 0.00 0.71 0.00 0.00 52.55 53.01 421p s ASP 38 Cb -0.04 -0.28 -0.03 0.00 1.01 0.00 0.00 42.92 43.58 421p s ASP 38 CO -0.15 0.13 -0.21 -0.55 0.21 0.00 0.00 175.17 174.60 421p s SER 39 N -0.10 3.59 -0.02 0.27 0.15 -1.26 -0.22 113.70 116.10 421p s SER 39 Ca 0.01 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.22 421p s SER 39 Cb -0.07 -0.53 0.02 0.00 -1.71 0.00 0.00 66.02 63.73 421p s SER 39 CO 0.00 0.28 0.00 -0.31 1.20 0.00 0.00 173.24 174.41 421p s TYR 40 N -0.84 0.24 -0.13 3.44 1.51 0.42 -4.98 117.35 117.01 421p s TYR 40 Ca 0.13 0.03 0.02 0.00 -1.01 0.00 0.00 57.07 56.23 421p s TYR 40 Cb -0.10 -0.34 0.01 0.00 -0.11 0.00 0.00 41.96 41.42 421p s TYR 40 CO 0.03 -0.11 -0.18 1.03 -1.11 0.00 0.00 175.55 175.21 421p s ARG 41 N 0.93 2.65 -0.06 -0.62 0.52 -1.25 -0.63 118.95 120.49 421p s ARG 41 Ca -0.09 -0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 54.39 421p s ARG 41 Cb -0.12 -2.22 0.03 0.00 0.52 0.00 0.00 34.95 33.16 421p s ARG 41 CO -0.02 -0.08 0.03 0.21 0.02 0.00 0.00 175.30 175.47 421p s LYS 42 N 1.00 0.25 -0.17 3.54 2.47 0.15 -4.99 119.74 122.00 421p s LYS 42 Ca -0.04 0.22 -0.29 0.00 -1.56 0.00 0.00 55.97 54.31 421p s LYS 42 Cb -0.15 -0.80 -0.00 0.00 -1.46 0.00 0.00 37.83 35.42 421p s LYS 42 CO -0.04 -0.34 0.99 -1.14 0.16 0.00 0.00 175.35 174.98 421p s GLN 43 N 2.07 4.32 0.33 4.03 -0.44 -1.26 -0.62 119.66 128.09 421p s GLN 43 Ca 0.05 1.31 0.03 0.00 -2.50 0.00 0.00 55.36 54.25 421p s GLN 43 Cb -0.12 -3.59 -0.04 0.00 -1.64 0.00 0.00 33.01 27.61 421p s GLN 43 CO -0.04 -0.46 0.14 0.54 0.50 0.00 0.00 175.29 175.96 421p s VAL 44 N 2.59 0.49 -0.07 1.34 0.11 -0.56 -4.99 120.40 119.30 421p s VAL 44 Ca 0.44 -2.00 0.04 0.00 -2.93 0.00 0.00 61.98 57.53 421p s VAL 44 Cb -0.16 -2.51 0.00 0.00 -1.53 0.00 0.00 36.38 32.18 421p s VAL 44 CO 0.12 0.00 -0.18 -0.69 -3.33 0.00 0.00 175.10 171.01 421p s VAL 45 N -3.49 1.60 -0.07 2.04 1.01 -1.26 -2.00 120.40 118.23 421p s VAL 45 Ca 0.33 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.55 421p s VAL 45 Cb 0.05 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 35.05 421p s VAL 45 CO 0.17 0.46 -0.05 -0.63 0.00 0.00 0.00 175.10 175.04 421p s ILE 46 N 0.38 0.70 -1.48 2.22 1.01 0.23 -4.82 121.20 119.43 421p s ILE 46 Ca -0.14 -0.14 -0.04 0.00 0.00 0.00 0.00 60.65 60.34 421p s ILE 46 Cb -0.16 -0.75 0.03 0.00 0.01 0.00 0.00 42.46 41.60 421p s ILE 46 CO 0.05 0.29 0.46 0.47 0.00 0.00 0.00 174.94 176.22 421p n ASP 47 N 4.61 -0.86 0.00 3.58 8.00 -1.26 -1.22 116.55 129.40 421p n ASP 47 Ca -0.16 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.32 421p n ASP 47 Cb 0.50 -2.88 0.00 0.00 -0.02 0.00 0.00 41.12 38.72 421p n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 421p n GLY 48 N -1.92 1.26 3.74 0.44 0.00 -1.26 -5.02 105.19 102.44 421p n GLY 48 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 421p n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 421p s GLU 49 N -0.18 4.25 -0.03 1.61 2.12 -0.36 -5.06 118.70 121.05 421p s GLU 49 Ca 0.00 0.33 -0.30 0.00 0.36 0.00 0.00 54.97 55.36 421p s GLU 49 Cb 0.00 -3.40 -0.03 0.00 0.26 0.00 0.00 34.13 30.95 421p s GLU 49 CO 0.00 0.26 1.16 0.99 -0.54 0.00 0.00 175.26 177.13 421p s THR 50 N 0.33 4.32 0.17 -1.70 2.01 -1.26 -0.60 115.64 118.90 421p s THR 50 Ca 0.23 1.65 -0.14 0.00 0.31 0.00 0.00 61.69 63.74 421p s THR 50 Cb -0.15 -4.06 0.01 0.00 0.01 0.00 0.00 72.50 68.32 421p s THR 50 CO 0.09 0.04 0.40 0.00 -0.69 0.00 0.00 174.62 174.45 421p s LEU 52 N -2.89 2.76 -0.47 0.00 0.20 -0.17 -1.49 118.68 116.61 421p s LEU 52 Ca 0.11 -0.32 -0.25 0.00 0.69 0.00 0.00 54.13 54.35 421p s LEU 52 Cb 0.01 -1.63 0.03 0.00 -0.43 0.00 0.00 46.19 44.17 421p s LEU 52 CO -0.04 0.15 0.93 -0.76 -0.29 0.00 0.00 176.35 176.34 421p s LEU 53 N 0.43 4.00 -0.62 -0.68 1.02 0.20 -1.54 118.68 121.49 421p s LEU 53 Ca -0.09 0.09 -0.03 0.00 0.02 0.00 0.00 54.13 54.12 421p s LEU 53 Cb -0.16 -3.18 0.16 0.00 0.02 0.00 0.00 46.19 43.03 421p s LEU 53 CO 0.05 -1.07 0.44 -0.62 0.02 0.00 0.00 176.35 175.17 421p s ASP 54 N 2.31 5.32 -0.02 2.29 2.15 -1.19 -0.67 116.67 126.85 421p s ASP 54 Ca 0.37 -2.80 -0.13 0.00 0.43 0.00 0.00 52.55 50.42 421p s ASP 54 Cb -0.10 -1.87 -0.05 0.00 -0.30 0.00 0.00 42.92 40.59 421p s ASP 54 CO 0.26 -0.39 0.35 -0.63 -0.17 0.00 0.00 175.17 174.59 421p s ILE 55 N 0.02 5.13 -0.16 4.11 1.01 0.20 -2.09 121.20 129.41 421p s ILE 55 Ca 0.16 0.69 0.01 0.00 0.00 0.00 0.00 60.65 61.51 421p s ILE 55 Cb -0.20 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.65 421p s ILE 55 CO -0.04 0.58 -0.16 -0.22 0.00 0.00 0.00 174.94 175.10 421p s LEU 56 N -1.10 1.89 -0.19 2.97 1.98 -0.80 -0.44 118.68 122.99 421p s LEU 56 Ca 0.22 -0.57 -0.15 0.00 -2.89 0.00 0.00 54.13 50.74 421p s LEU 56 Cb -0.16 -1.30 -0.04 0.00 0.66 0.00 0.00 46.19 45.35 421p s LEU 56 CO 0.12 -0.04 0.37 -0.62 -1.89 0.00 0.00 176.35 174.29 421p s ASP 57 N 1.40 6.42 0.49 3.68 2.15 0.69 -0.99 116.67 130.51 421p s ASP 57 Ca 0.05 0.50 0.06 0.00 0.43 0.00 0.00 52.55 53.58 421p s ASP 57 Cb -0.13 -2.22 -0.00 0.00 -0.30 0.00 0.00 42.92 40.27 421p s ASP 57 CO -0.12 -0.04 0.28 0.42 -0.17 0.00 0.00 175.17 175.55 421p s THR 58 N 1.13 1.90 0.13 1.71 -4.23 -1.16 -1.97 115.64 113.15 421p s THR 58 Ca 0.18 -1.60 -0.25 0.00 -1.18 0.00 0.00 61.69 58.84 421p s THR 58 Cb -0.14 -2.50 -0.07 0.00 1.34 0.00 0.00 72.50 71.13 421p s THR 58 CO 0.07 0.00 0.76 0.00 -0.54 0.00 0.00 174.62 174.92 421p s ALA 59 N -2.70 3.44 0.01 3.99 0.00 -1.24 -4.78 121.76 120.48 421p s ALA 59 Ca 0.34 0.33 -0.05 0.00 0.00 0.00 0.00 51.96 52.58 421p s ALA 59 Cb 0.00 -2.95 -0.02 0.00 0.00 0.00 0.00 23.12 20.15 421p s ALA 59 CO 0.20 0.24 1.08 0.78 0.00 0.00 0.00 175.76 178.06 421p h GLY 60 N 4.68 -1.01 0.00 0.00 0.00 -1.82 -3.46 103.07 101.47 421p h GLY 60 Ca -0.46 0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.31 421p h GLY 60 CO 0.67 -0.37 0.00 -0.18 0.00 0.00 0.00 176.54 176.67 421p n GLN 61 N -2.79 3.10 0.00 4.80 0.00 -1.26 -4.52 117.38 116.72 421p n GLN 61 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.99 421p n GLN 61 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.30 421p n GLN 61 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 421p n GLU 62 N 0.00 0.00 0.00 3.69 0.28 -1.26 -4.50 120.64 118.85 421p n GLU 62 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 421p n GLU 62 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 421p n GLU 62 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 421p n GLU 63 N 0.00 0.32 -2.72 3.44 0.28 -1.26 -4.25 120.64 116.45 421p n GLU 63 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.58 421p n GLU 63 Cb 0.00 -1.11 -0.03 0.00 1.43 0.00 0.00 31.44 31.73 421p n GLU 63 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 421p s TYR 64 N -1.30 2.55 0.00 -1.84 1.51 -1.26 -4.70 117.35 112.31 421p s TYR 64 Ca 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 421p s TYR 64 Cb 0.00 -4.39 0.00 0.00 -0.11 0.00 0.00 41.96 37.46 421p s TYR 64 CO 0.00 -1.73 0.00 -1.13 -1.11 0.00 0.00 175.55 171.58 421p n SER 65 N 8.32 0.00 -0.07 2.29 3.41 -1.26 -4.72 113.62 121.59 421p n SER 65 Ca 0.01 0.00 0.22 0.00 -0.26 0.00 0.00 58.87 58.84 421p n SER 65 Cb 0.47 0.00 0.68 0.00 -0.26 0.00 0.00 64.21 65.10 421p n SER 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 421p h ALA 66 N 0.76 2.54 0.00 7.33 0.00 -1.98 -2.31 119.26 125.61 421p h ALA 66 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 421p h ALA 66 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 421p h ALA 66 CO 0.00 -0.73 0.21 -0.12 0.00 0.00 0.00 179.25 178.61 421p n MET 67 N -4.36 0.00 0.05 0.00 0.00 -1.26 0.15 117.12 111.69 421p n MET 67 Ca 0.13 0.09 -0.09 0.00 0.00 0.00 0.00 57.70 57.82 421p n MET 67 Cb 0.69 -1.71 -0.13 0.00 0.00 0.00 0.00 33.22 32.07 421p n MET 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 421p h ARG 68 N 0.00 0.06 -1.07 2.12 3.08 -1.70 -3.39 114.38 113.48 421p h ARG 68 Ca 0.00 -0.09 0.37 0.00 0.07 0.00 0.00 59.98 60.32 421p h ARG 68 Cb 0.42 0.04 -0.15 0.00 0.08 0.00 0.00 29.97 30.36 421p h ARG 68 CO 0.00 0.94 0.63 -0.44 -1.07 0.00 0.00 179.97 180.03 421p h ASP 69 N 0.02 0.41 -0.23 7.04 5.19 0.11 -0.76 116.42 128.20 421p h ASP 69 Ca -0.10 0.19 0.02 0.00 -0.62 0.00 0.00 57.03 56.53 421p h ASP 69 Cb 1.86 0.16 -0.02 0.00 0.18 0.00 0.00 39.33 41.51 421p h ASP 69 CO 0.13 -0.21 0.07 -0.61 -3.12 0.00 0.00 179.24 175.51 421p h GLN 70 N 0.20 0.17 0.00 3.56 4.15 -1.75 -0.60 115.11 120.84 421p h GLN 70 Ca 0.77 -0.01 -0.18 0.00 0.77 0.00 0.00 58.65 60.00 421p h GLN 70 Cb 1.99 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 29.62 421p h GLN 70 CO -0.59 0.11 -0.87 0.10 -1.93 0.00 0.00 178.83 175.65 421p h TYR 71 N 0.18 0.00 0.00 3.99 -0.00 -1.43 -3.15 116.97 116.55 421p h TYR 71 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 58.75 421p h TYR 71 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.79 421p h TYR 71 CO -0.13 0.85 -0.36 0.52 -0.00 0.00 0.00 178.16 179.04 421p h MET 72 N 0.00 0.00 -0.36 0.10 2.86 -1.42 0.14 114.93 116.25 421p h MET 72 Ca -0.01 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 421p h MET 72 Cb 1.66 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 421p h MET 72 CO 0.11 0.36 -0.24 -0.09 1.06 0.00 0.00 176.91 178.11 421p h ARG 73 N 0.00 0.71 0.00 1.72 2.43 -1.06 -3.36 114.38 114.83 421p h ARG 73 Ca -0.00 -0.29 -0.22 0.00 -0.81 0.00 0.00 59.98 58.66 421p h ARG 73 Cb 0.64 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.12 421p h ARG 73 CO 0.05 0.88 -1.89 0.25 -1.51 0.00 0.00 179.97 177.75 421p n THR 74 N -4.11 1.07 -2.07 0.20 -2.24 -1.07 -4.91 114.28 101.15 421p n THR 74 Ca -0.00 -0.72 -0.41 0.00 -2.27 0.00 0.00 64.05 60.64 421p n THR 74 Cb 0.43 -0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 421p n THR 74 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 421p s GLY 75 N -5.01 2.30 -0.02 3.38 0.00 0.45 -4.89 107.32 103.53 421p s GLY 75 Ca -0.07 1.26 -0.18 0.00 0.00 0.00 0.00 44.72 45.74 421p s GLY 75 CO 0.84 2.25 0.89 0.83 0.00 0.00 0.00 173.10 177.91 421p h GLU 76 N 5.29 0.41 -6.04 2.90 5.08 -0.54 -3.48 114.58 118.19 421p h GLU 76 Ca -0.45 -0.70 -0.54 0.00 -1.00 0.00 0.00 59.36 56.67 421p h GLU 76 Cb 1.22 0.26 -0.21 0.00 0.50 0.00 0.00 28.75 30.51 421p h GLU 76 CO 0.79 1.34 -0.82 0.20 -1.00 0.00 0.00 179.01 179.52 421p s GLY 77 N -4.60 1.22 -0.01 -3.84 0.00 -0.78 -4.30 107.32 95.01 421p s GLY 77 Ca -0.12 -1.25 0.08 0.00 0.00 0.00 0.00 44.72 43.42 421p s GLY 77 CO 0.88 -1.26 -0.24 -1.36 0.00 0.00 0.00 173.10 171.11 421p s PHE 78 N -1.29 2.16 -0.37 1.90 0.40 -0.80 -0.88 117.98 119.11 421p s PHE 78 Ca 0.07 -0.41 -0.12 0.00 -0.60 0.00 0.00 56.93 55.87 421p s PHE 78 Cb -0.09 -1.38 0.01 0.00 0.51 0.00 0.00 43.02 42.07 421p s PHE 78 CO 0.04 -0.02 0.23 -0.51 0.70 0.00 0.00 175.22 175.67 421p s LEU 79 N -0.66 4.69 -0.39 -0.37 1.43 -0.46 -2.62 118.68 120.30 421p s LEU 79 Ca 0.09 -0.76 -0.15 0.00 -1.03 0.00 0.00 54.13 52.29 421p s LEU 79 Cb -0.09 -2.09 0.01 0.00 0.03 0.00 0.00 46.19 44.05 421p s LEU 79 CO -0.01 -0.34 0.33 0.00 0.23 0.00 0.00 176.35 176.56 421p s VAL 81 N 1.84 4.47 0.41 0.00 1.01 -0.66 -0.51 120.40 126.96 421p s VAL 81 Ca 0.08 -0.16 0.03 0.00 0.00 0.00 0.00 61.98 61.93 421p s VAL 81 Cb -0.18 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 421p s VAL 81 CO 0.11 0.51 0.09 0.72 0.00 0.00 0.00 175.10 176.53 421p s PHE 82 N -0.01 1.86 -0.04 5.22 -0.71 -0.84 -3.72 117.98 119.73 421p s PHE 82 Ca 0.04 -1.14 0.05 0.00 -1.04 0.00 0.00 56.93 54.85 421p s PHE 82 Cb -0.13 -1.29 -0.02 0.00 -1.21 0.00 0.00 43.02 40.37 421p s PHE 82 CO 0.02 -0.11 -0.20 0.00 -1.34 0.00 0.00 175.22 173.58 421p s ALA 83 N -3.15 2.41 -1.68 1.99 0.00 -1.26 -1.69 121.76 118.38 421p s ALA 83 Ca 0.23 -1.04 0.18 0.00 0.00 0.00 0.00 51.96 51.34 421p s ALA 83 Cb 0.04 -0.78 0.99 0.00 0.00 0.00 0.00 23.12 23.37 421p s ALA 83 CO 0.13 0.52 1.52 0.44 0.00 0.00 0.00 175.76 178.37 421p n ILE 84 N 2.48 0.26 -0.58 0.00 -6.64 0.15 -1.86 119.36 113.18 421p n ILE 84 Ca -0.17 0.07 0.06 0.00 -1.77 0.00 0.00 62.75 60.94 421p n ILE 84 Cb 0.52 -0.77 0.13 0.00 -1.44 0.00 0.00 39.64 38.08 421p n ILE 84 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 421p n ASN 85 N -1.16 2.74 -3.76 7.28 6.94 -1.26 -1.25 115.26 124.80 421p n ASN 85 Ca 0.11 -2.55 -0.30 0.00 -0.02 0.00 0.00 54.58 51.82 421p n ASN 85 Cb 0.11 -0.30 -0.15 0.00 -2.36 0.00 0.00 39.78 37.08 421p n ASN 85 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 421p s ASN 86 N -1.75 4.05 0.24 0.53 2.47 -0.77 -4.60 114.94 115.10 421p s ASN 86 Ca 0.24 -1.80 -0.01 0.00 0.42 0.00 0.00 52.86 51.70 421p s ASN 86 Cb 0.19 -0.95 0.26 0.00 -1.45 0.00 0.00 41.25 39.29 421p s ASN 86 CO 0.06 -0.39 1.63 0.74 -3.72 0.00 0.00 177.10 175.42 421p h THR 87 N 6.35 1.29 -0.35 -5.21 2.02 -1.89 -2.97 112.91 112.15 421p h THR 87 Ca -0.11 -1.44 0.05 0.00 0.77 0.00 0.00 66.41 65.68 421p h THR 87 Cb 1.00 1.43 -0.05 0.00 -1.74 0.00 0.00 68.15 68.80 421p h THR 87 CO 0.48 0.46 0.06 0.11 0.37 0.00 0.00 175.52 177.00 421p h LYS 88 N 0.50 0.17 0.00 6.66 1.57 -1.95 -0.61 116.57 122.90 421p h LYS 88 Ca 0.06 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 421p h LYS 88 Cb 0.81 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 421p h LYS 88 CO 0.07 0.11 -0.12 0.66 -0.57 0.00 0.00 179.45 179.60 421p h SER 89 N 0.17 0.00 0.22 0.86 4.64 -1.88 0.96 113.55 118.52 421p h SER 89 Ca 0.17 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.19 421p h SER 89 Cb 0.19 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.31 421p h SER 89 CO -0.23 0.12 -1.23 0.15 -0.87 0.00 0.00 176.83 174.77 421p h PHE 90 N 0.00 0.91 -0.25 4.77 3.57 -1.19 -3.13 116.94 121.61 421p h PHE 90 Ca -0.00 -0.58 -0.16 0.00 3.53 0.00 0.00 57.97 60.76 421p h PHE 90 Cb 0.29 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 421p h PHE 90 CO 0.00 1.43 -0.49 0.93 -2.23 0.00 0.00 178.31 177.95 421p h GLU 91 N 0.24 0.69 0.00 1.11 5.08 -0.80 -2.77 114.58 118.13 421p h GLU 91 Ca -0.18 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 421p h GLU 91 Cb 1.91 0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.19 421p h GLU 91 CO 0.23 1.02 0.00 -0.44 -1.00 0.00 0.00 179.01 178.82 421p h ASP 92 N 0.54 0.00 -0.95 1.42 3.32 -0.84 -3.13 116.42 116.77 421p h ASP 92 Ca 0.03 0.00 0.18 0.00 0.02 0.00 0.00 57.03 57.26 421p h ASP 92 Cb 1.04 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.51 421p h ASP 92 CO 0.10 0.00 0.61 0.40 -1.72 0.00 0.00 179.24 178.63 421p h ILE 93 N 0.00 0.73 -0.31 0.35 1.08 -1.43 -2.49 117.51 115.43 421p h ILE 93 Ca 0.00 -0.22 0.02 0.00 -0.39 0.00 0.00 64.86 64.27 421p h ILE 93 Cb 0.05 0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 33.81 421p h ILE 93 CO 0.00 0.12 0.17 -0.74 -0.69 0.00 0.00 178.15 177.00 421p h HIS 94 N 0.63 0.32 -0.92 1.37 -0.00 -1.76 -2.40 115.15 112.39 421p h HIS 94 Ca 0.51 0.01 0.12 0.00 -0.00 0.00 0.00 60.37 61.01 421p h HIS 94 Cb 0.96 -0.10 -0.07 0.00 -0.00 0.00 0.00 27.41 28.20 421p h HIS 94 CO -0.00 0.18 0.59 1.96 -0.00 0.00 0.00 177.93 180.65 421p h GLN 95 N 0.35 0.82 0.02 5.26 7.50 -1.67 -1.68 115.11 125.72 421p h GLN 95 Ca 0.13 -0.05 -0.13 0.00 0.50 0.00 0.00 58.65 59.10 421p h GLN 95 Cb 0.02 -0.18 0.01 0.00 0.05 0.00 0.00 27.48 27.38 421p h GLN 95 CO -0.07 0.54 -0.50 1.88 -1.50 0.00 0.00 178.83 179.17 421p h TYR 96 N 0.84 0.46 -0.59 2.96 0.05 -1.49 -2.93 116.97 116.27 421p h TYR 96 Ca 0.45 -0.27 0.10 0.00 0.05 0.00 0.00 58.73 59.05 421p h TYR 96 Cb 0.54 -0.05 -0.07 0.00 1.01 0.00 0.00 36.73 38.16 421p h TYR 96 CO -0.00 1.11 0.20 -0.09 -1.05 0.00 0.00 178.16 178.33 421p h ARG 97 N -0.31 0.36 -0.43 4.88 9.65 -1.19 -0.20 114.38 127.13 421p h ARG 97 Ca -0.07 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.75 421p h ARG 97 Cb 1.26 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.74 421p h ARG 97 CO 0.10 0.24 0.10 0.93 2.80 0.00 0.00 179.97 184.13 421p h GLU 98 N 0.37 0.65 0.01 0.20 4.39 -1.40 -0.84 114.58 117.96 421p h GLU 98 Ca 0.30 -0.12 -0.19 0.00 0.34 0.00 0.00 59.36 59.70 421p h GLU 98 Cb 0.39 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 421p h GLU 98 CO -0.32 0.60 -0.87 0.37 -1.16 0.00 0.00 179.01 177.63 421p h GLN 99 N 0.63 0.06 -0.23 2.33 4.15 -1.29 -1.23 115.11 119.53 421p h GLN 99 Ca 0.14 -0.07 -0.20 0.00 0.77 0.00 0.00 58.65 59.29 421p h GLN 99 Cb 0.25 0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.96 421p h GLN 99 CO -0.00 0.89 -0.63 0.82 -1.93 0.00 0.00 178.83 177.98 421p h ILE 100 N 0.03 1.28 -0.53 2.39 2.04 -0.65 -1.25 117.51 120.82 421p h ILE 100 Ca -0.02 -1.82 -0.10 0.00 1.00 0.00 0.00 64.86 63.91 421p h ILE 100 Cb 1.51 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 39.33 421p h ILE 100 CO 0.12 0.59 -0.08 0.11 0.00 0.00 0.00 178.15 178.89 421p h LYS 101 N 0.61 0.96 -0.30 2.37 1.57 -1.14 -1.33 116.57 119.31 421p h LYS 101 Ca -0.01 -0.33 0.01 0.00 -1.87 0.00 0.00 60.65 58.46 421p h LYS 101 Cb 1.24 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 421p h LYS 101 CO 0.13 1.00 0.17 -0.09 -0.57 0.00 0.00 179.45 180.09 421p h ARG 102 N 0.87 0.33 0.06 3.15 2.43 -1.06 -2.00 114.38 118.17 421p h ARG 102 Ca 0.14 -0.02 -0.24 0.00 -0.81 0.00 0.00 59.98 59.05 421p h ARG 102 Cb 0.62 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 421p h ARG 102 CO 0.04 0.22 -1.11 -0.39 -1.51 0.00 0.00 179.97 177.22 421p h VAL 103 N 0.34 1.60 0.00 0.20 -1.51 -1.06 -3.27 116.25 112.55 421p h VAL 103 Ca 0.12 -3.22 0.00 0.00 -1.23 0.00 0.00 66.70 62.37 421p h VAL 103 Cb 0.01 2.88 0.00 0.00 -2.13 0.00 0.00 31.29 32.05 421p h VAL 103 CO -0.06 0.93 0.00 0.29 -1.23 0.00 0.00 177.57 177.50 421p n LYS 104 N -3.45 0.80 -2.66 5.19 5.02 -0.52 -4.90 118.16 117.64 421p n LYS 104 Ca -0.04 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.06 421p n LYS 104 Cb 0.97 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 421p n LYS 104 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 421p n ASP 105 N -1.10 -5.07 -3.86 4.39 8.00 -0.77 -4.96 116.55 113.19 421p n ASP 105 Ca 0.21 -0.05 -0.09 0.00 0.71 0.00 0.00 54.79 55.56 421p n ASP 105 Cb 0.15 -4.21 -0.06 0.00 -0.02 0.00 0.00 41.12 36.99 421p n ASP 105 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 421p s SER 106 N -2.26 -0.02 0.04 -2.24 1.04 -1.08 -5.04 113.70 104.14 421p s SER 106 Ca 0.11 -0.69 0.21 0.00 0.48 0.00 0.00 55.95 56.06 421p s SER 106 Cb -0.05 0.44 -0.20 0.00 0.10 0.00 0.00 66.02 66.31 421p s SER 106 CO 0.14 -0.87 0.66 0.47 0.98 0.00 0.00 173.24 174.61 421p n ASP 107 N -0.20 0.39 -4.13 7.02 8.00 -1.26 -4.49 116.55 121.88 421p n ASP 107 Ca -0.11 0.16 -0.34 0.00 0.71 0.00 0.00 54.79 55.22 421p n ASP 107 Cb 0.63 1.13 -0.14 0.00 -0.02 0.00 0.00 41.12 42.71 421p n ASP 107 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 421p s ASP 108 N -5.08 4.67 -0.05 -2.24 -1.08 -1.26 -4.99 116.67 106.64 421p s ASP 108 Ca -0.05 -1.32 0.05 0.00 -0.52 0.00 0.00 52.55 50.71 421p s ASP 108 Cb 0.11 -1.64 -0.00 0.00 -1.46 0.00 0.00 42.92 39.93 421p s ASP 108 CO 0.85 -0.22 -0.20 0.54 0.52 0.00 0.00 175.17 176.66 421p s VAL 109 N 1.19 1.66 -0.07 1.11 0.11 -1.26 -5.10 120.40 118.03 421p s VAL 109 Ca -0.07 -0.84 -0.37 0.00 -2.93 0.00 0.00 61.98 57.77 421p s VAL 109 Cb -0.20 -1.43 -0.15 0.00 -1.53 0.00 0.00 36.38 33.08 421p s VAL 109 CO -0.03 0.47 1.62 -2.65 -3.33 0.00 0.00 175.10 171.19 421p n PRO 110 N 3.17 1.48 -3.59 1.54 -0.02 -1.26 -4.96 135.00 131.35 421p n PRO 110 Ca -0.18 0.54 -0.13 0.00 -2.02 0.00 0.00 63.50 61.70 421p n PRO 110 Cb 0.53 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 421p n PRO 110 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 421p s MET 111 N 2.34 1.02 -0.07 -0.52 1.75 -1.26 -1.90 119.30 120.67 421p s MET 111 Ca 0.90 -0.28 -0.06 0.00 -1.25 0.00 0.00 55.69 55.00 421p s MET 111 Cb -0.91 0.47 0.02 0.00 2.84 0.00 0.00 34.83 37.24 421p s MET 111 CO 0.53 -0.37 0.18 0.54 -0.65 0.00 0.00 175.02 175.25 421p s VAL 112 N -2.55 -0.01 -0.08 10.11 0.11 -1.08 -4.29 120.40 122.61 421p s VAL 112 Ca -0.05 0.03 -0.22 0.00 -2.93 0.00 0.00 61.98 58.81 421p s VAL 112 Cb -0.01 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 421p s VAL 112 CO -0.03 0.01 0.62 -0.22 -3.33 0.00 0.00 175.10 172.16 421p s LEU 113 N 0.27 4.31 -0.21 2.54 2.96 -0.12 -1.28 118.68 127.16 421p s LEU 113 Ca -0.02 1.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.98 421p s LEU 113 Cb -0.03 -2.95 0.04 0.00 0.50 0.00 0.00 46.19 43.75 421p s LEU 113 CO -0.01 -0.06 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.13 421p s VAL 114 N 0.67 1.91 -0.74 1.68 1.01 0.33 -1.02 120.40 124.24 421p s VAL 114 Ca 0.33 -1.13 -0.16 0.00 0.00 0.00 0.00 61.98 61.02 421p s VAL 114 Cb -0.17 -1.90 0.17 0.00 0.00 0.00 0.00 36.38 34.48 421p s VAL 114 CO 0.16 0.25 0.76 -0.83 0.00 0.00 0.00 175.10 175.43 421p s GLY 115 N 1.29 2.28 0.51 4.51 0.00 -0.69 -2.00 107.32 113.23 421p s GLY 115 Ca -0.01 -2.89 -0.06 0.00 0.00 0.00 0.00 44.72 41.76 421p s GLY 115 CO -0.09 1.42 0.84 0.21 0.00 0.00 0.00 173.10 175.48 421p s ASN 116 N 2.93 6.21 -0.28 1.64 2.47 -0.68 -1.00 114.94 126.22 421p s ASN 116 Ca 0.16 1.01 -0.01 0.00 0.42 0.00 0.00 52.86 54.44 421p s ASN 116 Cb -0.16 -2.25 0.00 0.00 -1.45 0.00 0.00 41.25 37.39 421p s ASN 116 CO -0.04 -0.67 0.14 0.29 -3.72 0.00 0.00 177.10 173.11 421p n LYS 117 N -2.37 -1.07 0.06 0.43 5.02 -0.53 -0.67 118.16 119.02 421p n LYS 117 Ca 0.02 0.17 0.09 0.00 -2.02 0.00 0.00 58.31 56.57 421p n LYS 117 Cb 0.55 -3.42 0.38 0.00 -0.02 0.00 0.00 35.03 32.53 421p n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 421p h ASP 119 N 0.00 0.00 -3.22 0.00 2.03 -1.93 -3.45 116.42 109.85 421p h ASP 119 Ca 0.00 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.75 421p h ASP 119 Cb 0.27 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.75 421p h ASP 119 CO 0.00 0.28 0.57 -0.76 -1.03 0.00 0.00 179.24 178.30 421p s LEU 120 N -6.84 4.31 0.45 0.15 1.43 -0.98 -5.03 118.68 112.16 421p s LEU 120 Ca 0.01 1.75 -0.21 0.00 -1.03 0.00 0.00 54.13 54.65 421p s LEU 120 Cb 0.10 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.66 421p s LEU 120 CO 0.66 -0.46 1.01 0.00 0.23 0.00 0.00 176.35 177.79 421p s ALA 121 N 1.68 2.97 0.00 4.21 0.00 -1.26 -4.40 121.76 124.96 421p s ALA 121 Ca 0.54 0.55 0.00 0.00 0.00 0.00 0.00 51.96 53.05 421p s ALA 121 Cb -0.23 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.67 421p s ALA 121 CO 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 175.76 175.86 421p n ALA 122 N -0.67 -0.78 -2.90 0.00 0.00 -1.26 -5.08 120.51 109.82 421p n ALA 122 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.21 421p n ALA 122 Cb 0.52 -0.16 -0.04 0.00 0.00 0.00 0.00 19.45 19.77 421p n ALA 122 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 421p s ARG 123 N -2.73 3.37 0.00 0.00 1.70 -1.26 -4.63 118.95 115.40 421p s ARG 123 Ca 0.00 -0.46 0.06 0.00 -0.47 0.00 0.00 55.73 54.86 421p s ARG 123 Cb 0.00 -3.00 -0.02 0.00 -0.57 0.00 0.00 34.95 31.35 421p s ARG 123 CO 0.00 0.61 0.39 0.25 -1.08 0.00 0.00 175.30 175.47 421p n THR 124 N 0.37 0.00 -3.96 4.99 -2.24 -0.38 -4.89 114.28 108.17 421p n THR 124 Ca -0.06 -0.41 -0.33 0.00 -2.27 0.00 0.00 64.05 60.98 421p n THR 124 Cb 0.51 1.04 -0.14 0.00 -2.10 0.00 0.00 70.33 69.65 421p n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 421p s VAL 125 N -1.19 2.60 0.63 2.28 1.01 -0.78 -4.87 120.40 120.09 421p s VAL 125 Ca 0.04 -1.87 -0.15 0.00 0.00 0.00 0.00 61.98 60.00 421p s VAL 125 Cb 0.05 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.72 421p s VAL 125 CO 0.18 -0.34 1.07 -1.61 0.00 0.00 0.00 175.10 174.40 421p s GLU 126 N 1.08 3.08 0.32 2.72 0.41 -1.26 -4.87 118.70 120.18 421p s GLU 126 Ca 0.01 1.24 0.16 0.00 -0.41 0.00 0.00 54.97 55.96 421p s GLU 126 Cb -0.20 -2.00 0.43 0.00 -1.78 0.00 0.00 34.13 30.58 421p s GLU 126 CO -0.05 -1.01 1.62 0.77 -0.49 0.00 0.00 175.26 176.11 421p h SER 127 N 0.14 0.00 -0.58 -0.19 0.02 -1.99 -2.98 113.55 107.98 421p h SER 127 Ca -0.46 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 60.60 421p h SER 127 Cb 1.23 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.68 421p h SER 127 CO 0.56 0.50 0.04 0.03 -1.14 0.00 0.00 176.83 176.82 421p h ARG 128 N 0.00 0.16 0.07 3.45 2.47 -1.99 0.42 114.38 118.97 421p h ARG 128 Ca -0.00 -0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.72 421p h ARG 128 Cb 1.10 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.37 421p h ARG 128 CO 0.06 0.10 -0.12 1.96 0.56 0.00 0.00 179.97 182.54 421p h GLN 129 N 0.16 -0.23 0.00 0.04 4.20 -1.93 0.79 115.11 118.14 421p h GLN 129 Ca 0.30 0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.94 421p h GLN 129 Cb 0.47 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 421p h GLN 129 CO -0.45 -0.16 -0.41 0.00 -0.67 0.00 0.00 178.83 177.14 421p h ALA 130 N 0.65 0.95 -0.01 3.87 0.00 -1.37 -1.67 119.26 121.69 421p h ALA 130 Ca 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 421p h ALA 130 Cb 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 421p h ALA 130 CO -0.07 0.51 -0.03 0.37 0.00 0.00 0.00 179.25 180.03 421p h GLN 131 N 0.00 0.04 -0.94 0.00 5.75 0.59 -2.28 115.11 118.27 421p h GLN 131 Ca -0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 421p h GLN 131 Cb 0.96 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.47 421p h GLN 131 CO 0.05 0.61 0.59 -0.44 -2.65 0.00 0.00 178.83 177.00 421p h ASP 132 N -0.52 1.10 0.09 -0.69 3.32 -0.90 0.46 116.42 119.29 421p h ASP 132 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 421p h ASP 132 Cb 0.61 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 421p h ASP 132 CO 0.01 0.82 -0.07 0.25 -1.72 0.00 0.00 179.24 178.53 421p h LEU 133 N 1.28 -0.18 -0.34 1.55 5.85 -1.36 -0.97 115.31 121.14 421p h LEU 133 Ca 0.34 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.12 421p h LEU 133 Cb -0.10 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 421p h LEU 133 CO -0.07 -0.11 0.09 0.00 -0.34 0.00 0.00 178.44 178.00 421p h ALA 134 N 0.73 0.37 -0.86 1.25 0.00 -0.79 -0.49 119.26 119.48 421p h ALA 134 Ca -0.00 0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.18 421p h ALA 134 Cb 0.16 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 17.88 421p h ALA 134 CO -0.01 -0.32 0.32 0.00 0.00 0.00 0.00 179.25 179.25 421p h ARG 135 N 0.21 0.33 -0.50 0.00 3.08 0.13 -2.74 114.38 114.90 421p h ARG 135 Ca 0.16 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.08 421p h ARG 135 Cb 0.16 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 421p h ARG 135 CO -0.19 0.22 -0.11 0.77 -1.07 0.00 0.00 179.97 179.59 421p h SER 136 N 0.34 0.96 -4.22 7.04 0.02 0.31 -3.37 113.55 114.63 421p h SER 136 Ca 0.53 -0.36 -0.50 0.00 -0.84 0.00 0.00 61.79 60.62 421p h SER 136 Cb 1.00 -0.26 0.09 0.00 0.14 0.00 0.00 62.40 63.37 421p h SER 136 CO -0.55 1.09 0.37 -0.31 -1.14 0.00 0.00 176.83 176.29 421p s TYR 137 N -4.82 2.78 -1.24 3.45 2.02 -1.04 -4.94 117.35 113.56 421p s TYR 137 Ca -0.12 1.53 -0.06 0.00 -0.37 0.00 0.00 57.07 58.05 421p s TYR 137 Cb 0.12 -3.08 0.19 0.00 -0.40 0.00 0.00 41.96 38.79 421p s TYR 137 CO 0.85 -1.47 2.00 0.41 -1.57 0.00 0.00 175.55 175.76 421p n GLY 138 N -0.84 5.16 3.29 0.71 0.00 -1.26 -4.81 105.19 107.44 421p n GLY 138 Ca 0.09 -2.23 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 421p n GLY 138 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 421p s ILE 139 N -1.22 1.98 0.47 -0.61 1.09 -1.05 -5.04 121.20 116.83 421p s ILE 139 Ca 0.43 -1.07 -0.23 0.00 -1.10 0.00 0.00 60.65 58.68 421p s ILE 139 Cb 0.13 -1.64 -0.07 0.00 -1.06 0.00 0.00 42.46 39.82 421p s ILE 139 CO -0.03 0.56 1.25 -2.84 -0.10 0.00 0.00 174.94 173.78 421p s PRO 140 N -0.57 3.62 -0.16 2.79 0.02 -1.26 -4.16 135.00 135.28 421p s PRO 140 Ca 0.09 1.99 -0.02 0.00 0.02 0.00 0.00 61.00 63.08 421p s PRO 140 Cb -0.10 -2.44 -0.02 0.00 0.02 0.00 0.00 34.50 31.97 421p s PRO 140 CO -0.01 -0.73 -0.08 -0.47 -0.33 0.00 0.00 177.00 175.38 421p s TYR 141 N -1.41 2.92 -0.03 6.54 5.04 -1.26 -0.95 117.35 128.20 421p s TYR 141 Ca 0.64 -0.57 0.00 0.00 -2.44 0.00 0.00 57.07 54.71 421p s TYR 141 Cb -0.34 -1.93 0.03 0.00 0.35 0.00 0.00 41.96 40.06 421p s TYR 141 CO 0.41 -0.21 0.01 -1.50 -1.34 0.00 0.00 175.55 172.93 421p s ILE 142 N 0.56 0.10 0.19 3.14 1.10 -0.19 -4.98 121.20 121.12 421p s ILE 142 Ca -0.05 0.12 -0.27 0.00 -0.51 0.00 0.00 60.65 59.93 421p s ILE 142 Cb -0.15 -0.20 -0.08 0.00 0.15 0.00 0.00 42.46 42.17 421p s ILE 142 CO 0.03 0.12 0.84 -1.61 -2.11 0.00 0.00 174.94 172.21 421p s GLU 143 N 0.98 4.68 0.20 3.50 2.02 -1.26 -1.70 118.70 127.12 421p s GLU 143 Ca -0.09 1.28 0.01 0.00 0.02 0.00 0.00 54.97 56.19 421p s GLU 143 Cb -0.13 -3.27 -0.05 0.00 0.10 0.00 0.00 34.13 30.79 421p s GLU 143 CO -0.02 0.55 0.05 0.95 0.02 0.00 0.00 175.26 176.81 421p s THR 144 N -1.16 0.53 -0.16 3.63 -4.23 -0.17 -4.36 115.64 109.73 421p s THR 144 Ca 0.38 -1.98 -0.04 0.00 -1.18 0.00 0.00 61.69 58.86 421p s THR 144 Cb -0.24 -2.30 0.08 0.00 1.34 0.00 0.00 72.50 71.38 421p s THR 144 CO 0.28 -0.29 0.26 -0.55 -0.54 0.00 0.00 174.62 173.78 421p s SER 145 N -3.20 0.61 0.30 3.99 0.15 0.29 -1.45 113.70 114.39 421p s SER 145 Ca 0.29 0.34 0.26 0.00 0.70 0.00 0.00 55.95 57.54 421p s SER 145 Cb 0.07 0.66 0.92 0.00 -1.71 0.00 0.00 66.02 65.96 421p s SER 145 CO 0.07 -0.27 1.76 0.00 1.20 0.00 0.00 173.24 176.01 421p h ALA 146 N 8.28 1.00 0.17 5.45 0.00 -1.91 0.51 119.26 132.77 421p h ALA 146 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 421p h ALA 146 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 421p h ALA 146 CO 0.19 0.00 -0.08 -0.22 0.00 0.00 0.00 179.25 179.14 421p h LYS 147 N 0.00 -0.22 0.00 0.00 3.64 -1.94 -3.36 116.57 114.68 421p h LYS 147 Ca 0.00 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 421p h LYS 147 Cb 0.57 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 421p h LYS 147 CO 0.00 0.08 -0.53 1.15 -2.27 0.00 0.00 179.45 177.88 421p h THR 148 N -0.99 1.06 0.00 1.00 2.02 -1.98 -3.46 112.91 110.55 421p h THR 148 Ca -0.02 -2.08 0.00 0.00 0.77 0.00 0.00 66.41 65.07 421p h THR 148 Cb 0.40 2.24 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 421p h THR 148 CO 0.04 0.52 0.00 -1.14 0.37 0.00 0.00 175.52 175.31 421p n ARG 149 N -3.44 0.00 -1.89 6.66 0.63 0.17 -5.01 116.66 113.78 421p n ARG 149 Ca 0.00 0.01 -0.42 0.00 -0.92 0.00 0.00 57.85 56.52 421p n ARG 149 Cb 0.65 -2.54 -0.03 0.00 0.45 0.00 0.00 32.46 30.99 421p n ARG 149 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 421p s GLN 150 N -0.20 4.17 0.00 -0.14 0.74 -0.68 -2.60 119.66 120.96 421p s GLN 150 Ca 0.00 2.35 0.00 0.00 0.05 0.00 0.00 55.36 57.76 421p s GLN 150 Cb 0.00 -3.92 0.00 0.00 1.10 0.00 0.00 33.01 30.19 421p s GLN 150 CO 0.00 -0.84 0.00 0.41 -0.55 0.00 0.00 175.29 174.31 421p n GLY 151 N 4.20 1.96 0.18 2.59 0.00 -1.26 -0.55 105.19 112.31 421p n GLY 151 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 421p n GLY 151 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 421p h VAL 152 N 0.00 1.34 -0.61 1.61 -1.51 -1.78 -1.82 116.25 113.48 421p h VAL 152 Ca 0.00 -1.81 -0.06 0.00 -1.23 0.00 0.00 66.70 63.60 421p h VAL 152 Cb 0.00 2.10 -0.03 0.00 -2.13 0.00 0.00 31.29 31.23 421p h VAL 152 CO 0.00 0.55 0.14 -0.33 -1.23 0.00 0.00 177.57 176.70 421p h GLU 153 N 0.22 0.95 0.06 5.19 5.08 -1.93 -2.76 114.58 121.40 421p h GLU 153 Ca -0.03 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 421p h GLU 153 Cb 1.16 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 421p h GLU 153 CO 0.11 0.86 -0.03 0.22 -1.00 0.00 0.00 179.01 179.16 421p h ASP 154 N 0.91 -0.08 -0.73 1.42 3.58 -1.92 -0.82 116.42 118.78 421p h ASP 154 Ca 0.19 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.68 421p h ASP 154 Cb 0.34 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.37 421p h ASP 154 CO 0.00 -0.06 0.46 0.00 -2.88 0.00 0.00 179.24 176.77 421p h ALA 155 N 0.85 0.96 -0.10 -0.78 0.00 -1.16 -0.09 119.26 118.94 421p h ALA 155 Ca -0.01 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 421p h ALA 155 Cb 0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 421p h ALA 155 CO 0.01 0.25 -0.74 0.74 0.00 0.00 0.00 179.25 179.51 421p h PHE 156 N 0.90 0.67 -0.05 0.00 0.04 -1.26 -2.96 116.94 114.28 421p h PHE 156 Ca 0.29 -0.30 -0.25 0.00 2.80 0.00 0.00 57.97 60.52 421p h PHE 156 Cb 0.02 -0.10 0.02 0.00 2.20 0.00 0.00 35.95 38.08 421p h PHE 156 CO -0.04 1.07 -0.95 1.88 -0.60 0.00 0.00 178.31 179.67 421p h TYR 157 N 0.34 1.06 -0.40 -0.55 -1.99 -1.10 -2.61 116.97 111.72 421p h TYR 157 Ca -0.04 -0.54 0.05 0.00 2.00 0.00 0.00 58.73 60.21 421p h TYR 157 Cb 1.33 -0.14 -0.05 0.00 2.00 0.00 0.00 36.73 39.87 421p h TYR 157 CO 0.05 1.38 0.11 1.15 -0.00 0.00 0.00 178.16 180.85 421p h THR 158 N 0.44 0.84 -0.86 -2.88 2.02 -1.01 -2.05 112.91 109.41 421p h THR 158 Ca -0.10 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 421p h THR 158 Cb 1.60 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.53 421p h THR 158 CO 0.19 0.05 0.43 0.25 0.37 0.00 0.00 175.52 176.81 421p h LEU 159 N 0.25 1.11 -0.93 2.58 5.85 -1.53 -0.69 115.31 121.94 421p h LEU 159 Ca 0.19 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.79 421p h LEU 159 Cb 0.20 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 421p h LEU 159 CO -0.22 0.92 0.62 0.58 -0.34 0.00 0.00 178.44 180.00 421p h VAL 160 N 1.22 1.23 0.00 1.05 2.07 -1.07 -1.91 116.25 118.83 421p h VAL 160 Ca 0.30 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 421p h VAL 160 Cb 0.09 -0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 29.72 421p h VAL 160 CO -0.04 0.23 -0.04 0.03 0.02 0.00 0.00 177.57 177.77 421p h ARG 161 N 1.26 0.00 -0.05 1.57 3.08 -0.59 -0.57 114.38 119.08 421p h ARG 161 Ca 0.35 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.21 421p h ARG 161 Cb -0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 421p h ARG 161 CO -0.08 0.04 -0.77 0.93 -1.07 0.00 0.00 179.97 179.02 421p h GLU 162 N 0.00 0.32 -0.06 0.04 4.39 -0.45 -2.64 114.58 116.18 421p h GLU 162 Ca -0.00 -0.28 -0.10 0.00 0.34 0.00 0.00 59.36 59.32 421p h GLU 162 Cb 0.53 0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.25 421p h GLU 162 CO 0.00 0.94 -0.35 0.82 -1.16 0.00 0.00 179.01 179.27 421p h ILE 163 N 0.21 1.43 -0.91 3.13 2.04 -0.44 -3.07 117.51 119.90 421p h ILE 163 Ca -0.04 -1.80 0.24 0.00 1.00 0.00 0.00 64.86 64.27 421p h ILE 163 Cb 1.35 2.40 -0.05 0.00 -0.74 0.00 0.00 36.82 39.78 421p h ILE 163 CO 0.13 0.52 0.63 -0.09 0.00 0.00 0.00 178.15 179.33 421p h ARG 164 N -0.17 0.17 -0.01 2.37 2.43 -1.21 -1.59 114.38 116.37 421p h ARG 164 Ca -0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 421p h ARG 164 Cb 1.02 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 421p h ARG 164 CO 0.07 0.11 -0.34 1.04 -1.51 0.00 0.00 179.97 179.35 421p n GLN 165 N -4.38 0.97 0.00 0.20 1.13 -1.00 -5.09 117.38 109.21 421p n GLN 165 Ca 0.19 -0.67 0.15 0.00 -1.94 0.00 0.00 57.00 54.74 421p n GLN 165 Cb 0.86 -1.49 0.91 0.00 0.11 0.00 0.00 30.24 30.64 421p n GLN 165 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20