#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4pep s GLY 2 N 0.00 1.91 -0.25 3.28 0.00 0.11 -4.95 107.32 107.42 4pep s GLY 2 Ca 0.00 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 43.85 4pep s GLY 2 CO 0.00 -0.72 -0.01 -0.35 0.00 0.00 0.00 173.10 172.02 4pep s ASP 3 N -1.40 3.90 -0.37 1.64 3.68 -0.83 -0.86 116.67 122.43 4pep s ASP 3 Ca 0.18 -1.33 -0.06 0.00 2.13 0.00 0.00 52.55 53.48 4pep s ASP 3 Cb -0.12 -1.13 0.07 0.00 -1.45 0.00 0.00 42.92 40.29 4pep s ASP 3 CO 0.09 -0.29 0.15 -0.70 0.13 0.00 0.00 175.17 174.55 4pep s GLU 4 N 1.41 2.45 0.46 4.34 2.56 0.53 -4.35 118.70 126.10 4pep s GLU 4 Ca -0.01 -1.41 -0.21 0.00 0.00 0.00 0.00 54.97 53.34 4pep s GLU 4 Cb -0.18 -3.52 -0.09 0.00 2.00 0.00 0.00 34.13 32.33 4pep s GLU 4 CO -0.09 -0.82 1.01 -2.14 -0.56 0.00 0.00 175.26 172.66 4pep s PRO 5 N 1.33 3.97 0.01 4.30 0.02 -1.26 -1.10 135.00 142.26 4pep s PRO 5 Ca 0.01 1.30 0.08 0.00 0.02 0.00 0.00 61.00 62.41 4pep s PRO 5 Cb -0.21 -2.16 -0.02 0.00 0.02 0.00 0.00 34.50 32.12 4pep s PRO 5 CO 0.00 -0.28 -0.24 -0.51 -0.33 0.00 0.00 177.00 175.64 4pep s LEU 6 N -3.31 2.10 0.20 -5.54 1.43 0.08 -4.47 118.68 109.17 4pep s LEU 6 Ca 0.65 -0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 4pep s LEU 6 Cb -0.15 -1.21 -0.08 0.00 0.03 0.00 0.00 46.19 44.79 4pep s LEU 6 CO 0.18 0.26 0.94 -0.70 0.23 0.00 0.00 176.35 177.26 4pep s GLU 7 N -0.86 4.79 -0.42 1.70 2.12 0.15 -4.02 118.70 122.16 4pep s GLU 7 Ca 0.10 1.46 -0.09 0.00 0.36 0.00 0.00 54.97 56.80 4pep s GLU 7 Cb -0.09 -3.31 0.08 0.00 0.26 0.00 0.00 34.13 31.07 4pep s GLU 7 CO 0.00 0.43 0.26 1.21 -0.54 0.00 0.00 175.26 176.62 4pep s ASN 8 N -0.81 5.62 -0.39 -1.70 3.84 -1.26 -2.43 114.94 117.80 4pep s ASN 8 Ca 0.42 -1.52 -0.16 0.00 0.21 0.00 0.00 52.86 51.81 4pep s ASN 8 Cb -0.25 -1.98 0.01 0.00 -0.55 0.00 0.00 41.25 38.48 4pep s ASN 8 CO 0.31 -0.54 0.37 -0.47 -2.79 0.00 0.00 177.10 173.99 4pep s TYR 9 N 1.41 3.20 -1.65 0.43 6.14 0.27 -4.58 117.35 122.57 4pep s TYR 9 Ca 0.03 -0.33 -0.18 0.00 0.64 0.00 0.00 57.07 57.23 4pep s TYR 9 Cb -0.23 -2.74 0.18 0.00 0.42 0.00 0.00 41.96 39.59 4pep s TYR 9 CO 0.02 -0.58 0.45 1.28 0.64 0.00 0.00 175.55 177.35 4pep n LEU 10 N 5.41 -0.77 -1.07 6.97 4.77 -1.26 0.26 117.00 131.31 4pep n LEU 10 Ca -0.09 -1.13 -0.10 0.00 -0.03 0.00 0.00 56.01 54.66 4pep n LEU 10 Cb 0.48 -1.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.09 4pep n LEU 10 CO 0.43 0.15 -0.10 0.47 -1.33 0.00 0.00 177.39 177.01 4pep n ASP 11 N -2.21 -3.47 -0.06 -1.43 8.00 -1.26 -4.74 116.55 111.38 4pep n ASP 11 Ca 0.04 0.25 -0.09 0.00 0.71 0.00 0.00 54.79 55.70 4pep n ASP 11 Cb 0.44 -3.01 -0.06 0.00 -0.02 0.00 0.00 41.12 38.47 4pep n ASP 11 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 4pep n THR 12 N -1.72 0.73 -4.20 -3.53 -1.04 0.14 -4.94 114.28 99.72 4pep n THR 12 Ca -0.10 -0.30 -0.17 0.00 -2.04 0.00 0.00 64.05 61.45 4pep n THR 12 Cb 0.40 -0.93 -0.13 0.00 -1.82 0.00 0.00 70.33 67.85 4pep n THR 12 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 4pep s GLU 13 N -2.26 0.69 -0.08 -2.82 0.41 -0.73 -4.47 118.70 109.44 4pep s GLU 13 Ca -0.16 -0.66 0.01 0.00 -0.41 0.00 0.00 54.97 53.75 4pep s GLU 13 Cb 0.04 -0.61 0.02 0.00 -1.78 0.00 0.00 34.13 31.81 4pep s GLU 13 CO 0.31 0.14 -0.09 0.71 -0.49 0.00 0.00 175.26 175.85 4pep s TYR 14 N -0.92 1.32 0.03 1.61 1.51 -1.26 -0.57 117.35 119.07 4pep s TYR 14 Ca -0.03 -0.55 0.01 0.00 -1.01 0.00 0.00 57.07 55.49 4pep s TYR 14 Cb -0.08 -1.06 -0.02 0.00 -0.11 0.00 0.00 41.96 40.69 4pep s TYR 14 CO 0.01 -0.37 -0.05 -0.59 -1.11 0.00 0.00 175.55 173.44 4pep s PHE 15 N 1.21 0.44 0.32 2.71 -0.12 -1.02 -4.03 117.98 117.48 4pep s PHE 15 Ca -0.05 -0.49 0.04 0.00 -0.05 0.00 0.00 56.93 56.39 4pep s PHE 15 Cb -0.14 -0.28 -0.06 0.00 -0.63 0.00 0.00 43.02 41.91 4pep s PHE 15 CO -0.02 -0.13 0.04 0.20 -0.05 0.00 0.00 175.22 175.26 4pep s GLY 16 N -1.43 2.03 -0.06 1.99 0.00 -0.40 0.30 107.32 109.75 4pep s GLY 16 Ca -0.12 -2.03 -0.11 0.00 0.00 0.00 0.00 44.72 42.46 4pep s GLY 16 CO -0.00 -1.82 0.27 -1.59 0.00 0.00 0.00 173.10 169.96 4pep s THR 17 N -3.26 5.28 0.12 0.90 2.01 -1.26 -0.74 115.64 118.69 4pep s THR 17 Ca 0.35 0.51 0.01 0.00 0.31 0.00 0.00 61.69 62.88 4pep s THR 17 Cb 0.08 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 4pep s THR 17 CO 0.15 0.60 -0.03 0.27 -0.69 0.00 0.00 174.62 174.91 4pep s ILE 18 N -1.05 0.62 0.03 1.82 -4.36 -0.24 -4.71 121.20 113.32 4pep s ILE 18 Ca 0.19 -1.94 0.09 0.00 -0.26 0.00 0.00 60.65 58.73 4pep s ILE 18 Cb -0.14 -1.84 -0.03 0.00 1.25 0.00 0.00 42.46 41.70 4pep s ILE 18 CO 0.08 -0.72 -0.26 -0.83 0.24 0.00 0.00 174.94 173.45 4pep s GLY 19 N -3.08 1.37 -0.03 6.27 0.00 -0.89 -1.18 107.32 109.78 4pep s GLY 19 Ca 0.16 -1.23 0.02 0.00 0.00 0.00 0.00 44.72 43.67 4pep s GLY 19 CO -0.02 -1.11 -0.07 -0.42 0.00 0.00 0.00 173.10 171.49 4pep s ILE 20 N -0.77 0.64 0.00 0.90 1.01 0.31 0.10 121.20 123.39 4pep s ILE 20 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.52 4pep s ILE 20 Cb -0.10 -0.60 0.00 0.00 0.01 0.00 0.00 42.46 41.77 4pep s ILE 20 CO 0.01 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.79 4pep n GLY 21 N 3.58 -3.93 2.67 6.18 0.00 0.45 -1.34 105.19 112.79 4pep n GLY 21 Ca -0.21 -2.00 -0.27 0.00 0.00 0.00 0.00 46.02 43.54 4pep n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4pep s THR 22 N -0.98 0.23 0.65 2.61 2.01 -1.26 -2.92 115.64 115.99 4pep s THR 22 Ca 0.00 -0.40 -0.14 0.00 0.31 0.00 0.00 61.69 61.46 4pep s THR 22 Cb 0.00 -0.83 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 4pep s THR 22 CO 0.00 -0.27 1.07 -2.16 -0.69 0.00 0.00 174.62 172.57 4pep s PRO 23 N 1.99 3.01 0.33 4.92 0.04 -1.26 -2.19 135.00 141.84 4pep s PRO 23 Ca 0.01 1.15 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 4pep s PRO 23 Cb -0.17 -1.99 -0.11 0.00 0.04 0.00 0.00 34.50 32.28 4pep s PRO 23 CO -0.10 -1.05 1.42 0.00 0.04 0.00 0.00 177.00 177.31 4pep s ALA 24 N -2.66 3.56 -0.22 8.56 0.00 -1.15 -4.87 121.76 124.99 4pep s ALA 24 Ca 0.62 1.42 -0.09 0.00 0.00 0.00 0.00 51.96 53.91 4pep s ALA 24 Cb -0.16 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.36 4pep s ALA 24 CO 0.45 -0.84 0.11 -0.65 0.00 0.00 0.00 175.76 174.83 4pep s GLN 25 N -1.62 3.97 -0.02 0.00 -0.21 -0.45 -4.85 119.66 116.48 4pep s GLN 25 Ca 0.53 -0.33 -0.15 0.00 0.02 0.00 0.00 55.36 55.43 4pep s GLN 25 Cb -0.43 -3.39 -0.05 0.00 1.00 0.00 0.00 33.01 30.13 4pep s GLN 25 CO 0.55 0.09 0.42 -0.51 -2.12 0.00 0.00 175.29 173.72 4pep s ASP 26 N 0.92 6.78 0.04 5.90 -0.00 -1.26 -0.53 116.67 128.52 4pep s ASP 26 Ca 0.06 0.93 -0.01 0.00 -0.00 0.00 0.00 52.55 53.53 4pep s ASP 26 Cb -0.13 -2.26 -0.04 0.00 -0.00 0.00 0.00 42.92 40.50 4pep s ASP 26 CO 0.03 0.27 -0.03 -0.36 -0.00 0.00 0.00 175.17 175.08 4pep s PHE 27 N -0.77 0.47 -0.04 4.23 0.40 -0.32 -4.95 117.98 117.00 4pep s PHE 27 Ca 0.24 -0.94 0.02 0.00 -0.60 0.00 0.00 56.93 55.65 4pep s PHE 27 Cb -0.16 -0.35 -0.03 0.00 0.51 0.00 0.00 43.02 42.99 4pep s PHE 27 CO 0.13 -0.33 -0.09 0.95 0.70 0.00 0.00 175.22 176.58 4pep s THR 28 N -3.35 3.53 0.00 0.64 -4.23 -1.26 -1.08 115.64 109.89 4pep s THR 28 Ca 0.02 -0.63 -0.04 0.00 -1.18 0.00 0.00 61.69 59.85 4pep s THR 28 Cb 0.04 -2.46 -0.00 0.00 1.34 0.00 0.00 72.50 71.41 4pep s THR 28 CO -0.08 0.53 0.07 0.68 -0.54 0.00 0.00 174.62 175.29 4pep s VAL 29 N -0.85 0.08 0.19 2.29 -7.23 0.08 -1.01 120.40 113.95 4pep s VAL 29 Ca 0.14 -0.66 -0.28 0.00 -1.81 0.00 0.00 61.98 59.36 4pep s VAL 29 Cb -0.11 -0.33 -0.08 0.00 0.56 0.00 0.00 36.38 36.42 4pep s VAL 29 CO 0.03 -0.36 0.87 -0.63 -0.31 0.00 0.00 175.10 174.70 4pep s ILE 30 N -1.20 4.25 -0.97 -0.62 -1.09 -0.89 -1.28 121.20 119.41 4pep s ILE 30 Ca -0.13 1.93 -0.14 0.00 -2.23 0.00 0.00 60.65 60.07 4pep s ILE 30 Cb -0.07 -4.25 0.20 0.00 -1.58 0.00 0.00 42.46 36.76 4pep s ILE 30 CO 0.00 0.48 1.04 -0.36 -1.23 0.00 0.00 174.94 174.88 4pep s PHE 31 N -1.00 3.65 -0.42 3.97 0.40 -1.26 -1.25 117.98 122.08 4pep s PHE 31 Ca 0.40 -1.99 -0.18 0.00 -0.60 0.00 0.00 56.93 54.55 4pep s PHE 31 Cb -0.24 -4.03 0.02 0.00 0.51 0.00 0.00 43.02 39.27 4pep s PHE 31 CO 0.29 -1.18 0.47 0.34 0.70 0.00 0.00 175.22 175.84 4pep s ASP 32 N 2.50 6.22 0.00 1.36 2.15 -0.28 -4.48 116.67 124.14 4pep s ASP 32 Ca 0.29 -0.57 0.01 0.00 0.43 0.00 0.00 52.55 52.70 4pep s ASP 32 Cb -0.07 -2.24 0.05 0.00 -0.30 0.00 0.00 42.92 40.36 4pep s ASP 32 CO -0.08 -0.60 0.96 0.35 -0.17 0.00 0.00 175.17 175.63 4pep n THR 33 N 5.50 0.00 0.41 1.71 -2.24 -1.26 -0.97 114.28 117.42 4pep n THR 33 Ca -0.06 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.78 4pep n THR 33 Cb 0.48 -0.05 0.07 0.00 -2.10 0.00 0.00 70.33 68.72 4pep n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4pep n GLY 34 N 0.44 0.24 3.56 3.38 0.00 -1.26 -4.21 105.19 107.33 4pep n GLY 34 Ca 0.01 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 4pep n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 4pep s SER 35 N -1.03 0.13 0.00 1.61 1.04 -1.15 -5.00 113.70 109.31 4pep s SER 35 Ca 0.16 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.51 4pep s SER 35 Cb 0.11 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.83 4pep s SER 35 CO 0.16 -1.19 0.12 -1.20 0.98 0.00 0.00 173.24 172.11 4pep n SER 36 N -0.64 0.23 -4.91 7.02 7.64 -1.26 -0.56 113.62 121.14 4pep n SER 36 Ca -0.01 -0.60 -0.28 0.00 1.01 0.00 0.00 58.87 58.98 4pep n SER 36 Cb 0.62 0.26 -0.03 0.00 -1.01 0.00 0.00 64.21 64.05 4pep n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 4pep s ASN 37 N -0.26 6.43 -0.16 6.43 -0.87 -1.26 -4.34 114.94 120.91 4pep s ASN 37 Ca 0.00 0.69 -0.04 0.00 -1.57 0.00 0.00 52.86 51.95 4pep s ASN 37 Cb 0.00 -2.14 -0.03 0.00 -0.02 0.00 0.00 41.25 39.07 4pep s ASN 37 CO 0.00 -0.20 -0.04 -0.22 -2.57 0.00 0.00 177.10 174.07 4pep s LEU 38 N -3.60 3.23 -0.05 0.60 2.96 -1.26 -0.63 118.68 119.93 4pep s LEU 38 Ca 0.44 -0.14 -0.23 0.00 -0.22 0.00 0.00 54.13 53.97 4pep s LEU 38 Cb -0.11 -1.78 0.05 0.00 0.50 0.00 0.00 46.19 44.86 4pep s LEU 38 CO 0.30 0.16 0.52 -1.66 -1.32 0.00 0.00 176.35 174.36 4pep s TRP 39 N 0.39 -0.46 0.06 5.38 1.48 -0.63 -1.70 118.94 123.46 4pep s TRP 39 Ca -0.04 0.81 -0.00 0.00 -1.06 0.00 0.00 56.10 55.81 4pep s TRP 39 Cb -0.14 0.26 -0.04 0.00 -1.16 0.00 0.00 33.47 32.39 4pep s TRP 39 CO 0.03 -0.49 -0.04 0.14 -4.06 0.00 0.00 176.95 172.53 4pep s VAL 40 N -1.11 0.31 0.75 -0.66 -7.23 -0.93 -2.24 120.40 109.30 4pep s VAL 40 Ca -0.11 -1.81 -0.13 0.00 -1.81 0.00 0.00 61.98 58.11 4pep s VAL 40 Cb -0.02 -1.52 0.05 0.00 0.56 0.00 0.00 36.38 35.45 4pep s VAL 40 CO 0.07 -0.96 1.15 -2.84 -0.31 0.00 0.00 175.10 172.21 4pep s PRO 41 N -3.84 2.12 0.10 4.82 0.02 -1.26 -0.91 135.00 136.05 4pep s PRO 41 Ca 0.07 1.54 -0.03 0.00 0.02 0.00 0.00 61.00 62.60 4pep s PRO 41 Cb 0.07 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.70 4pep s PRO 41 CO -0.09 -1.80 0.06 -1.54 -0.33 0.00 0.00 177.00 173.30 4pep s SER 42 N -2.50 0.33 0.67 2.53 1.04 -1.25 -1.00 113.70 113.52 4pep s SER 42 Ca 0.69 -1.04 0.41 0.00 0.48 0.00 0.00 55.95 56.49 4pep s SER 42 Cb -0.24 0.28 2.24 0.00 0.10 0.00 0.00 66.02 68.40 4pep s SER 42 CO 0.48 -0.70 2.27 1.62 0.98 0.00 0.00 173.24 177.89 4pep h VAL 43 N 2.93 0.01 -0.00 5.02 3.04 -1.71 0.19 116.25 125.73 4pep h VAL 43 Ca -0.34 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 4pep h VAL 43 Cb 1.18 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.38 4pep h VAL 43 CO 0.60 0.00 -0.07 -1.22 -1.01 0.00 0.00 177.57 175.87 4pep n TYR 44 N -3.06 0.00 -3.38 3.17 4.01 -1.26 -4.81 117.16 111.83 4pep n TYR 44 Ca -0.03 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.33 4pep n TYR 44 Cb 0.15 -0.42 -0.08 0.00 -0.31 0.00 0.00 39.34 38.68 4pep n TYR 44 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 4pep n SER 46 N 4.58 0.69 -4.43 0.00 7.64 -1.24 -4.84 113.62 116.02 4pep n SER 46 Ca -0.08 -0.60 -0.35 0.00 1.01 0.00 0.00 58.87 58.85 4pep n SER 46 Cb 0.51 1.13 0.09 0.00 -1.01 0.00 0.00 64.21 64.93 4pep n SER 46 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 4pep n SER 47 N -1.75 -1.73 -0.27 6.43 7.64 -1.26 -4.84 113.62 117.85 4pep n SER 47 Ca 0.02 0.46 -0.06 0.00 1.01 0.00 0.00 58.87 60.30 4pep n SER 47 Cb 0.40 -1.20 0.05 0.00 -1.01 0.00 0.00 64.21 62.46 4pep n SER 47 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 4pep h LEU 48 N -0.91 0.97 -2.27 -3.43 5.85 -1.91 -2.18 115.31 111.44 4pep h LEU 48 Ca -0.45 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.16 4pep h LEU 48 Cb 1.32 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 4pep h LEU 48 CO 0.38 0.85 0.10 0.00 -0.34 0.00 0.00 178.44 179.43 4pep h ALA 49 N 1.16 1.77 0.00 1.25 0.00 -1.81 -1.29 119.26 120.34 4pep h ALA 49 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 4pep h ALA 49 Cb 0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 4pep h ALA 49 CO -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 179.25 179.02 4pep n SER 51 N -2.19 0.67 -1.29 0.00 3.41 -0.49 -3.89 113.62 109.85 4pep n SER 51 Ca 0.05 -0.57 0.04 0.00 -0.26 0.00 0.00 58.87 58.13 4pep n SER 51 Cb 0.42 0.04 0.08 0.00 -0.26 0.00 0.00 64.21 64.50 4pep n SER 51 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 4pep n ASP 52 N -0.97 1.33 -3.90 4.04 5.75 -1.18 -5.05 116.55 116.57 4pep n ASP 52 Ca 0.11 -2.64 -0.10 0.00 -0.01 0.00 0.00 54.79 52.16 4pep n ASP 52 Cb 0.32 -0.38 -0.09 0.00 -1.03 0.00 0.00 41.12 39.94 4pep n ASP 52 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 4pep s HIS 53 N -1.25 0.14 0.22 2.11 3.76 -1.23 -5.09 115.29 113.95 4pep s HIS 53 Ca 0.35 -0.40 -0.30 0.00 -0.15 0.00 0.00 55.06 54.56 4pep s HIS 53 Cb 0.38 -0.10 -0.10 0.00 1.11 0.00 0.00 32.58 33.88 4pep s HIS 53 CO -0.13 -0.38 1.43 -0.80 -0.85 0.00 0.00 174.74 174.01 4pep s ASN 54 N -2.03 6.71 -0.14 1.40 0.01 -1.26 -4.89 114.94 114.74 4pep s ASN 54 Ca -0.06 2.58 -0.02 0.00 -0.71 0.00 0.00 52.86 54.65 4pep s ASN 54 Cb -0.02 -2.61 -0.02 0.00 0.41 0.00 0.00 41.25 39.01 4pep s ASN 54 CO -0.04 -0.68 -0.08 -1.10 -1.51 0.00 0.00 177.10 173.69 4pep s GLN 55 N 0.02 3.46 0.06 -0.60 -0.21 -1.26 -4.37 119.66 116.76 4pep s GLN 55 Ca 0.61 -0.59 -0.31 0.00 0.02 0.00 0.00 55.36 55.09 4pep s GLN 55 Cb -0.41 -2.76 -0.06 0.00 1.00 0.00 0.00 33.01 30.78 4pep s GLN 55 CO 0.39 0.27 1.30 0.12 -2.12 0.00 0.00 175.29 175.25 4pep s PHE 56 N 0.24 3.26 -0.37 0.91 2.19 -0.17 -4.70 117.98 119.34 4pep s PHE 56 Ca -0.05 1.10 0.00 0.00 0.33 0.00 0.00 56.93 58.31 4pep s PHE 56 Cb -0.15 -3.55 0.10 0.00 -1.31 0.00 0.00 43.02 38.12 4pep s PHE 56 CO 0.04 -1.84 0.11 1.21 1.83 0.00 0.00 175.22 176.57 4pep s ASN 57 N 1.24 5.00 0.55 6.13 2.47 -1.26 -2.15 114.94 126.92 4pep s ASN 57 Ca 0.61 -1.99 0.37 0.00 0.42 0.00 0.00 52.86 52.28 4pep s ASN 57 Cb -0.32 -1.73 1.91 0.00 -1.45 0.00 0.00 41.25 39.66 4pep s ASN 57 CO 0.29 -0.44 2.12 1.55 -3.72 0.00 0.00 177.10 176.90 4pep h PRO 58 N 7.86 0.00 0.00 0.43 0.13 -1.95 -2.23 132.00 136.24 4pep h PRO 58 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 4pep h PRO 58 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 4pep h PRO 58 CO 0.60 0.00 0.00 0.22 -0.23 0.00 0.00 178.00 178.59 4pep h ASP 59 N 0.00 0.00 0.16 1.44 1.82 -2.00 -3.19 116.42 114.65 4pep h ASP 59 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 4pep h ASP 59 Cb 0.11 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.12 4pep h ASP 59 CO 0.00 0.00 -0.24 0.47 -1.61 0.00 0.00 179.24 177.86 4pep n ASP 60 N -2.98 1.26 -4.53 2.28 8.00 -0.84 -4.89 116.55 114.86 4pep n ASP 60 Ca 0.02 -1.08 -0.34 0.00 0.71 0.00 0.00 54.79 54.10 4pep n ASP 60 Cb 0.34 0.15 -0.12 0.00 -0.02 0.00 0.00 41.12 41.48 4pep n ASP 60 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 4pep s SER 61 N -2.41 4.65 0.11 -2.24 0.15 -1.21 -4.31 113.70 108.45 4pep s SER 61 Ca 0.26 -0.09 0.23 0.00 0.70 0.00 0.00 55.95 57.05 4pep s SER 61 Cb 0.19 -1.47 0.09 0.00 -1.71 0.00 0.00 66.02 63.13 4pep s SER 61 CO 0.49 0.27 1.08 -1.54 1.20 0.00 0.00 173.24 174.74 4pep n SER 62 N 2.87 0.68 -0.66 5.45 3.41 -0.93 -4.11 113.62 120.33 4pep n SER 62 Ca -0.18 0.07 0.06 0.00 -0.26 0.00 0.00 58.87 58.56 4pep n SER 62 Cb 0.53 0.58 0.14 0.00 -0.26 0.00 0.00 64.21 65.19 4pep n SER 62 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 4pep n THR 63 N -2.25 0.70 -2.46 6.66 -2.24 -1.26 -5.01 114.28 108.41 4pep n THR 63 Ca 0.01 -0.85 -0.41 0.00 -2.27 0.00 0.00 64.05 60.54 4pep n THR 63 Cb 0.48 0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 69.40 4pep n THR 63 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 4pep s PHE 64 N -1.01 3.54 -0.12 4.78 5.36 -1.26 -4.43 117.98 124.84 4pep s PHE 64 Ca 0.23 1.58 -0.01 0.00 -0.96 0.00 0.00 56.93 57.76 4pep s PHE 64 Cb 0.13 -3.32 0.03 0.00 -0.34 0.00 0.00 43.02 39.52 4pep s PHE 64 CO 0.17 -0.76 -0.04 -1.21 -1.46 0.00 0.00 175.22 171.92 4pep s GLU 65 N -0.60 1.20 0.76 10.12 2.02 -0.17 -5.00 118.70 127.03 4pep s GLU 65 Ca 0.49 -0.23 -0.11 0.00 0.02 0.00 0.00 54.97 55.14 4pep s GLU 65 Cb -0.31 -1.56 0.04 0.00 0.10 0.00 0.00 34.13 32.40 4pep s GLU 65 CO 0.37 -0.34 1.09 0.00 0.02 0.00 0.00 175.26 176.40 4pep s ALA 66 N 1.77 2.51 0.00 5.21 0.00 -1.26 -1.18 121.76 128.81 4pep s ALA 66 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.78 4pep s ALA 66 Cb -0.13 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.90 4pep s ALA 66 CO -0.07 -1.47 0.00 0.25 0.00 0.00 0.00 175.76 174.46 4pep n THR 67 N -3.26 0.00 -0.96 0.00 -2.24 -1.22 -4.89 114.28 101.72 4pep n THR 67 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 4pep n THR 67 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 4pep n THR 67 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4pep n GLN 69 N 0.00 -2.70 -3.40 -0.78 6.02 -1.26 -4.72 117.38 110.54 4pep n GLN 69 Ca 0.00 1.96 -0.26 0.00 -0.01 0.00 0.00 57.00 58.69 4pep n GLN 69 Cb 0.00 -2.16 -0.02 0.00 1.02 0.00 0.00 30.24 29.08 4pep n GLN 69 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 4pep s GLU 70 N -3.35 3.53 -0.02 -1.09 4.04 -1.26 -1.37 118.70 119.18 4pep s GLU 70 Ca 0.00 -0.24 0.02 0.00 0.04 0.00 0.00 54.97 54.79 4pep s GLU 70 Cb 0.00 -2.68 0.00 0.00 0.02 0.00 0.00 34.13 31.47 4pep s GLU 70 CO 0.00 0.20 -0.06 -1.17 -1.84 0.00 0.00 175.26 172.39 4pep s LEU 71 N -3.97 1.82 -0.11 1.83 2.96 0.59 -4.81 118.68 116.99 4pep s LEU 71 Ca 0.41 -0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 54.15 4pep s LEU 71 Cb -0.10 -0.37 0.06 0.00 0.50 0.00 0.00 46.19 46.27 4pep s LEU 71 CO 0.34 0.05 0.23 -0.55 -1.32 0.00 0.00 176.35 175.09 4pep s SER 72 N 0.14 0.27 -0.01 3.68 0.15 -1.26 -0.86 113.70 115.81 4pep s SER 72 Ca -0.01 0.52 -0.00 0.00 0.70 0.00 0.00 55.95 57.15 4pep s SER 72 Cb -0.06 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 4pep s SER 72 CO -0.00 -0.22 0.01 -0.51 1.20 0.00 0.00 173.24 173.72 4pep s ILE 73 N 2.08 -0.01 -0.11 6.45 1.10 -0.77 -4.85 121.20 125.10 4pep s ILE 73 Ca -0.01 0.03 0.03 0.00 -0.51 0.00 0.00 60.65 60.19 4pep s ILE 73 Cb -0.12 -0.03 0.01 0.00 0.15 0.00 0.00 42.46 42.47 4pep s ILE 73 CO -0.08 0.01 -0.21 0.42 -2.11 0.00 0.00 174.94 172.97 4pep s THR 74 N 0.14 1.90 0.51 4.00 -4.23 -1.26 -1.30 115.64 115.40 4pep s THR 74 Ca -0.01 -0.91 0.05 0.00 -1.18 0.00 0.00 61.69 59.64 4pep s THR 74 Cb -0.02 -1.66 0.01 0.00 1.34 0.00 0.00 72.50 72.17 4pep s THR 74 CO -0.00 0.52 0.26 -0.31 -0.54 0.00 0.00 174.62 174.55 4pep s TYR 75 N 0.57 1.89 -0.56 3.99 2.02 0.58 -4.98 117.35 120.85 4pep s TYR 75 Ca -0.14 -0.82 0.20 0.00 -0.37 0.00 0.00 57.07 55.95 4pep s TYR 75 Cb -0.17 -1.85 0.89 0.00 -0.40 0.00 0.00 41.96 40.43 4pep s TYR 75 CO 0.04 -0.17 1.62 0.41 -1.57 0.00 0.00 175.55 175.88 4pep n GLY 76 N -1.54 -1.12 0.03 0.71 0.00 -1.26 -2.45 105.19 99.56 4pep n GLY 76 Ca -0.06 0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.10 4pep n GLY 76 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 4pep n THR 77 N -2.06 0.00 -2.12 2.61 -2.24 -1.26 -5.10 114.28 104.11 4pep n THR 77 Ca 0.02 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 4pep n THR 77 Cb 0.18 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 4pep n THR 77 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4pep n GLY 78 N 1.30 -0.05 3.54 3.38 0.00 -1.03 -4.92 105.19 107.41 4pep n GLY 78 Ca 0.03 -1.52 -0.25 0.00 0.00 0.00 0.00 46.02 44.28 4pep n GLY 78 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4pep s SER 79 N -4.00 3.17 -0.02 1.61 0.01 -1.26 0.21 113.70 113.42 4pep s SER 79 Ca 0.00 -1.38 -0.25 0.00 1.31 0.00 0.00 55.95 55.64 4pep s SER 79 Cb 0.00 -0.25 0.05 0.00 0.21 0.00 0.00 66.02 66.03 4pep s SER 79 CO 0.00 -0.53 0.54 0.00 0.41 0.00 0.00 173.24 173.67 4pep s MET 80 N -3.80 0.93 0.07 12.44 0.23 -0.42 -4.07 119.30 124.69 4pep s MET 80 Ca 0.36 0.05 0.04 0.00 -1.03 0.00 0.00 55.69 55.10 4pep s MET 80 Cb 0.09 0.43 -0.03 0.00 -1.53 0.00 0.00 34.83 33.80 4pep s MET 80 CO 0.17 -0.29 -0.11 0.99 -2.03 0.00 0.00 175.02 173.75 4pep s THR 81 N -1.41 0.87 -0.19 3.16 2.01 -0.46 -1.84 115.64 117.78 4pep s THR 81 Ca -0.11 -1.30 0.00 0.00 0.31 0.00 0.00 61.69 60.59 4pep s THR 81 Cb -0.02 -0.97 0.00 0.00 0.01 0.00 0.00 72.50 71.52 4pep s THR 81 CO 0.07 -0.36 0.00 0.61 -0.69 0.00 0.00 174.62 174.25 4pep n GLY 82 N 1.18 -0.78 3.41 4.40 0.00 -0.04 -0.35 105.19 113.01 4pep n GLY 82 Ca -0.21 -0.68 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 4pep n GLY 82 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 4pep s ILE 83 N -3.00 1.88 0.20 -0.61 -5.25 -0.46 -0.30 121.20 113.66 4pep s ILE 83 Ca 0.00 -2.22 -0.06 0.00 -0.99 0.00 0.00 60.65 57.39 4pep s ILE 83 Cb 0.00 -2.28 -0.06 0.00 2.95 0.00 0.00 42.46 43.07 4pep s ILE 83 CO 0.00 -0.42 0.46 -0.76 -1.79 0.00 0.00 174.94 172.42 4pep s LEU 84 N -3.42 4.20 0.22 0.37 1.43 -0.47 -0.77 118.68 120.23 4pep s LEU 84 Ca 0.27 0.68 -0.12 0.00 -1.03 0.00 0.00 54.13 53.93 4pep s LEU 84 Cb 0.00 -3.44 -0.00 0.00 0.03 0.00 0.00 46.19 42.78 4pep s LEU 84 CO 0.11 -0.04 0.43 -0.83 0.23 0.00 0.00 176.35 176.25 4pep s GLY 85 N -2.62 0.46 0.03 -3.19 0.00 -0.16 -3.38 107.32 98.46 4pep s GLY 85 Ca 0.43 -0.81 0.08 0.00 0.00 0.00 0.00 44.72 44.42 4pep s GLY 85 CO 0.25 -0.65 -0.23 -0.19 0.00 0.00 0.00 173.10 172.28 4pep s TYR 86 N -3.99 2.01 0.21 1.90 1.51 -0.32 -1.17 117.35 117.51 4pep s TYR 86 Ca 0.20 -0.39 -0.21 0.00 -1.01 0.00 0.00 57.07 55.66 4pep s TYR 86 Cb 0.01 -1.23 0.07 0.00 -0.11 0.00 0.00 41.96 40.70 4pep s TYR 86 CO 0.05 0.07 1.00 0.34 -1.11 0.00 0.00 175.55 175.90 4pep s ASP 87 N -1.03 -0.01 -0.13 2.29 -1.08 -0.59 -1.00 116.67 115.12 4pep s ASP 87 Ca 0.09 -0.73 -0.16 0.00 -0.52 0.00 0.00 52.55 51.23 4pep s ASP 87 Cb -0.09 0.55 -0.04 0.00 -1.46 0.00 0.00 42.92 41.88 4pep s ASP 87 CO 0.01 -1.10 0.39 -0.89 0.52 0.00 0.00 175.17 174.10 4pep s THR 88 N -2.26 5.23 -0.18 1.71 2.01 -1.26 -1.47 115.64 119.43 4pep s THR 88 Ca 0.20 0.76 -0.01 0.00 0.31 0.00 0.00 61.69 62.96 4pep s THR 88 Cb -0.03 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.76 4pep s THR 88 CO 0.06 0.37 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.54 4pep s VAL 89 N 0.44 2.70 -0.26 3.82 1.01 -0.08 -0.41 120.40 127.61 4pep s VAL 89 Ca 0.21 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 4pep s VAL 89 Cb -0.14 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 4pep s VAL 89 CO 0.07 0.50 0.53 -1.10 0.00 0.00 0.00 175.10 175.11 4pep s GLN 90 N 1.12 4.07 -0.05 2.72 -1.52 0.12 -0.33 119.66 125.78 4pep s GLN 90 Ca 0.00 0.36 -0.02 0.00 -1.95 0.00 0.00 55.36 53.76 4pep s GLN 90 Cb -0.14 -3.65 0.03 0.00 -0.22 0.00 0.00 33.01 29.02 4pep s GLN 90 CO -0.04 -0.36 0.04 0.54 -0.25 0.00 0.00 175.29 175.21 4pep s VAL 91 N 2.34 0.07 -1.53 1.09 0.11 -0.31 -2.09 120.40 120.08 4pep s VAL 91 Ca 0.22 0.31 -0.05 0.00 -2.93 0.00 0.00 61.98 59.53 4pep s VAL 91 Cb -0.16 -0.28 0.01 0.00 -1.53 0.00 0.00 36.38 34.43 4pep s VAL 91 CO 0.09 0.20 0.59 0.61 -3.33 0.00 0.00 175.10 173.27 4pep n GLY 92 N 5.19 -0.52 2.26 6.54 0.00 -1.26 -1.44 105.19 115.97 4pep n GLY 92 Ca -0.06 0.13 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 4pep n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4pep n GLY 93 N -1.48 0.38 3.81 -0.02 0.00 -1.26 -1.97 105.19 104.65 4pep n GLY 93 Ca -0.10 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 4pep n GLY 93 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4pep s ILE 94 N -1.75 5.33 -0.57 -0.61 1.01 -0.52 -5.06 121.20 119.04 4pep s ILE 94 Ca 0.00 0.44 -0.16 0.00 0.00 0.00 0.00 60.65 60.93 4pep s ILE 94 Cb 0.00 -3.54 0.14 0.00 0.01 0.00 0.00 42.46 39.07 4pep s ILE 94 CO 0.00 0.53 0.53 -0.44 0.00 0.00 0.00 174.94 175.57 4pep s SER 95 N -0.52 6.24 -0.79 3.58 0.01 -1.26 -1.17 113.70 119.80 4pep s SER 95 Ca 0.17 -1.86 -0.24 0.00 1.31 0.00 0.00 55.95 55.33 4pep s SER 95 Cb -0.13 -2.21 0.06 0.00 0.21 0.00 0.00 66.02 63.94 4pep s SER 95 CO 0.05 -0.84 1.20 -0.62 0.41 0.00 0.00 173.24 173.45 4pep s ASP 96 N 3.47 6.28 0.55 2.44 2.15 0.55 -4.93 116.67 127.18 4pep s ASP 96 Ca 0.05 -0.98 -0.12 0.00 0.43 0.00 0.00 52.55 51.93 4pep s ASP 96 Cb -0.28 -2.50 -0.05 0.00 -0.30 0.00 0.00 42.92 39.79 4pep s ASP 96 CO 0.02 -1.57 0.96 0.42 -0.17 0.00 0.00 175.17 174.82 4pep s THR 97 N 4.76 4.69 -1.41 1.71 -4.23 -1.26 -0.90 115.64 119.00 4pep s THR 97 Ca 0.33 0.86 -0.01 0.00 -1.18 0.00 0.00 61.69 61.69 4pep s THR 97 Cb -0.09 -3.81 0.01 0.00 1.34 0.00 0.00 72.50 69.95 4pep s THR 97 CO 0.06 -0.91 0.45 0.59 -0.54 0.00 0.00 174.62 174.26 4pep n ASN 98 N -2.20 -0.49 -4.71 3.99 5.03 -1.21 -4.95 115.26 110.73 4pep n ASN 98 Ca 0.05 -1.00 -0.36 0.00 0.87 0.00 0.00 54.58 54.14 4pep n ASN 98 Cb 0.54 -3.09 -0.08 0.00 -1.02 0.00 0.00 39.78 36.13 4pep n ASN 98 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 4pep s GLN 99 N -6.54 4.17 0.16 3.52 2.00 -0.54 -4.86 119.66 117.57 4pep s GLN 99 Ca 0.04 -0.15 -0.26 0.00 -2.00 0.00 0.00 55.36 52.99 4pep s GLN 99 Cb -0.02 -3.46 -0.08 0.00 0.80 0.00 0.00 33.01 30.25 4pep s GLN 99 CO 0.89 0.20 0.81 -1.50 -0.50 0.00 0.00 175.29 175.18 4pep s ILE 100 N 0.65 4.37 0.17 -2.34 2.07 -1.26 -1.54 121.20 123.31 4pep s ILE 100 Ca 0.10 1.77 -0.16 0.00 -1.41 0.00 0.00 60.65 60.95 4pep s ILE 100 Cb -0.12 -4.17 0.02 0.00 0.13 0.00 0.00 42.46 38.32 4pep s ILE 100 CO 0.02 0.49 0.45 0.72 -1.91 0.00 0.00 174.94 174.71 4pep s PHE 101 N -0.98 -0.07 -0.01 3.50 -0.12 -0.31 -4.83 117.98 115.15 4pep s PHE 101 Ca 0.37 -0.27 -0.04 0.00 -0.05 0.00 0.00 56.93 56.94 4pep s PHE 101 Cb -0.23 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.40 4pep s PHE 101 CO 0.27 -0.82 0.21 0.20 -0.05 0.00 0.00 175.22 175.02 4pep s GLY 102 N -2.86 2.20 -0.34 1.99 0.00 -0.69 -0.99 107.32 106.62 4pep s GLY 102 Ca 0.08 -0.69 -0.12 0.00 0.00 0.00 0.00 44.72 43.99 4pep s GLY 102 CO -0.05 -0.54 0.23 1.08 0.00 0.00 0.00 173.10 173.81 4pep s LEU 103 N -1.79 4.52 0.55 0.66 1.02 0.05 -2.18 118.68 121.51 4pep s LEU 103 Ca 0.26 -0.53 -0.18 0.00 0.02 0.00 0.00 54.13 53.71 4pep s LEU 103 Cb -0.13 -2.11 -0.06 0.00 0.02 0.00 0.00 46.19 43.92 4pep s LEU 103 CO 0.16 -0.26 1.06 -0.94 0.02 0.00 0.00 176.35 176.39 4pep s SER 104 N 1.69 5.96 -0.02 2.29 1.04 -0.09 -1.35 113.70 123.22 4pep s SER 104 Ca 0.05 1.90 0.00 0.00 0.48 0.00 0.00 55.95 58.39 4pep s SER 104 Cb -0.18 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.38 4pep s SER 104 CO 0.09 -1.04 -0.02 -0.62 0.98 0.00 0.00 173.24 172.63 4pep n GLU 105 N -1.57 0.06 -4.12 4.02 1.02 0.52 -3.50 120.64 117.07 4pep n GLU 105 Ca 0.09 0.01 -0.15 0.00 -0.02 0.00 0.00 57.16 57.10 4pep n GLU 105 Cb 0.52 -1.02 -0.14 0.00 -0.02 0.00 0.00 31.44 30.78 4pep n GLU 105 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 4pep s THR 106 N -2.05 0.40 -0.45 2.62 -4.23 -0.93 -3.64 115.64 107.36 4pep s THR 106 Ca -0.03 -0.36 0.06 0.00 -1.18 0.00 0.00 61.69 60.18 4pep s THR 106 Cb 0.01 -0.37 0.21 0.00 1.34 0.00 0.00 72.50 73.69 4pep s THR 106 CO 0.05 0.01 0.60 -0.62 -0.54 0.00 0.00 174.62 174.12 4pep n GLU 107 N 2.69 0.51 -2.48 3.99 1.02 -1.26 -1.35 120.64 123.76 4pep n GLU 107 Ca -0.15 -2.58 -0.35 0.00 -0.02 0.00 0.00 57.16 54.06 4pep n GLU 107 Cb 0.58 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.49 4pep n GLU 107 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 4pep s PRO 108 N 0.15 3.85 0.00 3.49 0.04 -1.26 -4.43 135.00 136.84 4pep s PRO 108 Ca 0.32 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.85 4pep s PRO 108 Cb 0.09 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.38 4pep s PRO 108 CO -0.15 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 176.89 4pep n GLY 109 N 0.05 3.02 0.06 0.56 0.00 -1.26 -4.69 105.19 102.93 4pep n GLY 109 Ca 0.08 -1.87 0.11 0.00 0.00 0.00 0.00 46.02 44.35 4pep n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 4pep n SER 110 N 0.00 0.60 -0.32 1.61 3.41 -1.26 -3.98 113.62 113.68 4pep n SER 110 Ca 0.00 0.06 -0.03 0.00 -0.26 0.00 0.00 58.87 58.63 4pep n SER 110 Cb 0.00 0.83 0.08 0.00 -0.26 0.00 0.00 64.21 64.86 4pep n SER 110 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 4pep h PHE 111 N 0.00 1.10 0.01 7.33 3.57 -1.91 -1.77 116.94 125.27 4pep h PHE 111 Ca 0.00 0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.31 4pep h PHE 111 Cb 0.88 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 4pep h PHE 111 CO 0.00 0.70 -0.99 -0.07 -2.23 0.00 0.00 178.31 175.72 4pep h LEU 112 N 1.18 0.04 -0.68 0.59 4.07 -1.88 -2.46 115.31 116.17 4pep h LEU 112 Ca 0.32 -0.04 0.11 0.00 0.08 0.00 0.00 57.88 58.35 4pep h LEU 112 Cb -0.12 -0.01 -0.08 0.00 1.08 0.00 0.00 40.66 41.53 4pep h LEU 112 CO -0.07 1.00 0.28 0.22 -1.08 0.00 0.00 178.44 178.80 4pep h TYR 113 N 0.01 0.49 0.22 1.13 3.20 -1.56 -2.89 116.97 117.57 4pep h TYR 113 Ca -0.02 0.03 -0.33 0.00 3.14 0.00 0.00 58.73 61.55 4pep h TYR 113 Cb 1.73 -0.12 0.03 0.00 1.54 0.00 0.00 36.73 39.91 4pep h TYR 113 CO 0.01 0.13 -1.49 1.88 -1.64 0.00 0.00 178.16 177.04 4pep h TYR 114 N 0.47 0.84 -2.27 -3.82 0.05 -1.40 -3.47 116.97 107.38 4pep h TYR 114 Ca 0.35 -0.61 -0.61 0.00 0.05 0.00 0.00 58.73 57.90 4pep h TYR 114 Cb 0.44 -0.03 0.13 0.00 1.01 0.00 0.00 36.73 38.28 4pep h TYR 114 CO -0.15 1.53 -0.22 0.00 -1.05 0.00 0.00 178.16 178.27 4pep n ALA 115 N -2.71 -1.17 0.46 3.88 0.00 -0.93 -4.89 120.51 115.14 4pep n ALA 115 Ca -0.17 0.27 0.12 0.00 0.00 0.00 0.00 53.44 53.67 4pep n ALA 115 Cb 1.09 -1.85 0.27 0.00 0.00 0.00 0.00 19.45 18.96 4pep n ALA 115 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 4pep h PRO 116 N 1.22 0.00 -6.57 0.00 0.13 -1.92 -3.46 132.00 121.39 4pep h PRO 116 Ca -0.39 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.30 4pep h PRO 116 Cb 1.38 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.54 4pep h PRO 116 CO 0.55 0.00 -0.18 -0.59 -0.23 0.00 0.00 178.00 177.55 4pep s PHE 117 N -3.16 2.98 -0.22 1.56 -0.12 -1.26 -5.00 117.98 112.75 4pep s PHE 117 Ca 0.08 -0.12 0.05 0.00 -0.05 0.00 0.00 56.93 56.89 4pep s PHE 117 Cb 0.10 -2.38 -0.17 0.00 -0.63 0.00 0.00 43.02 39.94 4pep s PHE 117 CO 0.65 -0.43 -0.14 -0.25 -0.05 0.00 0.00 175.22 175.00 4pep n ASP 118 N -1.98 1.79 -0.52 1.98 8.00 -0.18 -5.00 116.55 120.63 4pep n ASP 118 Ca 0.05 -0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.45 4pep n ASP 118 Cb 0.59 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 4pep n ASP 118 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 4pep n GLY 119 N 2.27 3.97 2.99 0.44 0.00 -0.50 -4.26 105.19 110.10 4pep n GLY 119 Ca -0.38 -1.36 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 4pep n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4pep s ILE 120 N -1.95 0.36 -0.31 -0.61 1.01 -0.95 -2.09 121.20 116.66 4pep s ILE 120 Ca 0.00 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.02 4pep s ILE 120 Cb 0.00 -0.39 0.09 0.00 0.01 0.00 0.00 42.46 42.17 4pep s ILE 120 CO 0.00 -0.20 0.02 -0.22 0.00 0.00 0.00 174.94 174.54 4pep s LEU 121 N -0.92 3.79 0.24 2.97 0.20 -0.38 -1.60 118.68 122.98 4pep s LEU 121 Ca -0.06 -1.80 -0.30 0.00 0.69 0.00 0.00 54.13 52.66 4pep s LEU 121 Cb -0.06 -1.41 -0.09 0.00 -0.43 0.00 0.00 46.19 44.20 4pep s LEU 121 CO -0.00 -0.34 1.07 -0.83 -0.29 0.00 0.00 176.35 175.96 4pep s GLY 122 N 1.13 3.02 -0.09 7.98 0.00 0.20 -1.13 107.32 118.43 4pep s GLY 122 Ca 0.05 0.81 0.13 0.00 0.00 0.00 0.00 44.72 45.71 4pep s GLY 122 CO -0.10 1.48 1.09 1.04 0.00 0.00 0.00 173.10 176.60 4pep n LEU 123 N 1.59 2.04 0.00 0.66 4.77 -0.10 -4.47 117.00 121.48 4pep n LEU 123 Ca -0.00 -2.60 -0.02 0.00 -0.03 0.00 0.00 56.01 53.36 4pep n LEU 123 Cb 0.46 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 4pep n LEU 123 CO 0.53 0.61 0.05 0.00 -1.33 0.00 0.00 177.39 177.24 4pep n ALA 124 N -1.07 0.07 -1.64 -1.18 0.00 0.27 -4.81 120.51 112.16 4pep n ALA 124 Ca 0.11 -0.20 -0.34 0.00 0.00 0.00 0.00 53.44 53.01 4pep n ALA 124 Cb 0.55 0.05 0.02 0.00 0.00 0.00 0.00 19.45 20.06 4pep n ALA 124 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 4pep s TYR 125 N 0.30 2.71 0.37 0.00 2.02 0.27 -4.74 117.35 118.28 4pep s TYR 125 Ca 0.06 1.54 0.38 0.00 -0.37 0.00 0.00 57.07 58.69 4pep s TYR 125 Cb -0.00 -3.18 1.99 0.00 -0.40 0.00 0.00 41.96 40.36 4pep s TYR 125 CO 0.04 -1.52 2.16 -1.35 -1.57 0.00 0.00 175.55 173.31 4pep h PRO 126 N 0.57 0.00 0.00 -1.71 0.11 -1.94 -2.49 132.00 126.55 4pep h PRO 126 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 4pep h PRO 126 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 4pep h PRO 126 CO 0.56 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.22 4pep n SER 127 N -2.90 0.38 -0.13 -2.05 3.41 -1.26 -1.18 113.62 109.90 4pep n SER 127 Ca -0.02 0.63 0.09 0.00 -0.26 0.00 0.00 58.87 59.31 4pep n SER 127 Cb 0.11 -0.69 0.14 0.00 -0.26 0.00 0.00 64.21 63.50 4pep n SER 127 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 4pep n ILE 128 N -1.95 1.86 -3.07 -1.33 -5.35 -0.94 -5.00 119.36 103.58 4pep n ILE 128 Ca 0.01 -2.16 -0.41 0.00 -0.27 0.00 0.00 62.75 59.92 4pep n ILE 128 Cb 0.12 -0.19 -0.06 0.00 -1.74 0.00 0.00 39.64 37.77 4pep n ILE 128 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 4pep s SER 129 N -2.69 6.67 0.43 7.28 0.15 -0.32 -4.50 113.70 120.71 4pep s SER 129 Ca 0.31 0.82 -0.25 0.00 0.70 0.00 0.00 55.95 57.52 4pep s SER 129 Cb 0.27 -2.36 -0.08 0.00 -1.71 0.00 0.00 66.02 62.14 4pep s SER 129 CO 0.03 -0.35 1.31 0.00 1.20 0.00 0.00 173.24 175.42 4pep s ALA 130 N 2.31 3.19 0.00 5.45 0.00 -1.26 -1.51 121.76 129.93 4pep s ALA 130 Ca 0.29 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.48 4pep s ALA 130 Cb -0.16 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.47 4pep s ALA 130 CO 0.09 -0.89 0.00 0.43 0.00 0.00 0.00 175.76 175.39 4pep n SER 131 N -0.08 -5.09 0.00 0.00 7.64 -1.26 -2.42 113.62 112.41 4pep n SER 131 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.93 4pep n SER 131 Cb 0.44 -2.78 0.00 0.00 -1.01 0.00 0.00 64.21 60.86 4pep n SER 131 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 4pep n GLY 132 N 0.00 0.22 3.68 0.23 0.00 -0.57 -4.94 105.19 103.81 4pep n GLY 132 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 4pep n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4pep n ALA 133 N 1.00 1.55 -1.71 4.61 0.00 -1.02 -4.88 120.51 120.06 4pep n ALA 133 Ca 0.00 0.37 -0.42 0.00 0.00 0.00 0.00 53.44 53.39 4pep n ALA 133 Cb 0.27 -2.45 -0.03 0.00 0.00 0.00 0.00 19.45 17.24 4pep n ALA 133 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 4pep s THR 134 N 2.09 2.33 0.66 0.00 2.01 -1.26 -4.85 115.64 116.63 4pep s THR 134 Ca 0.82 0.02 -0.13 0.00 0.31 0.00 0.00 61.69 62.72 4pep s THR 134 Cb -0.62 -3.01 -0.00 0.00 0.01 0.00 0.00 72.50 68.87 4pep s THR 134 CO 0.40 0.00 1.07 -2.84 -0.69 0.00 0.00 174.62 172.57 4pep s PRO 135 N 2.19 2.96 0.16 4.92 0.02 -1.26 -4.66 135.00 139.33 4pep s PRO 135 Ca 0.79 1.14 -0.23 0.00 0.02 0.00 0.00 61.00 62.72 4pep s PRO 135 Cb -0.48 -1.99 0.04 0.00 0.02 0.00 0.00 34.50 32.10 4pep s PRO 135 CO 0.35 -1.09 1.62 0.28 -0.33 0.00 0.00 177.00 177.82 4pep h VAL 136 N -0.24 0.32 -0.62 3.83 2.07 -1.81 -2.12 116.25 117.69 4pep h VAL 136 Ca -0.45 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 4pep h VAL 136 Cb 1.22 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 4pep h VAL 136 CO 0.56 0.00 0.34 0.15 0.02 0.00 0.00 177.57 178.63 4pep h PHE 137 N -0.25 0.83 -0.50 1.57 3.04 -1.93 -1.62 116.94 118.08 4pep h PHE 137 Ca 0.15 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.06 4pep h PHE 137 Cb 0.50 -0.27 -0.02 0.00 2.56 0.00 0.00 35.95 38.71 4pep h PHE 137 CO -0.45 0.58 0.20 -0.44 -2.02 0.00 0.00 178.31 176.18 4pep h ASP 138 N 0.86 0.69 0.05 0.41 5.19 -1.88 -1.87 116.42 119.86 4pep h ASP 138 Ca 0.22 -0.17 -0.06 0.00 -0.62 0.00 0.00 57.03 56.40 4pep h ASP 138 Cb 0.03 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 4pep h ASP 138 CO -0.04 0.67 -0.18 -1.13 -3.12 0.00 0.00 179.24 175.45 4pep h ASN 139 N 0.67 0.24 -0.36 6.45 -1.24 -0.83 0.34 115.58 120.85 4pep h ASN 139 Ca 0.17 -0.06 -0.11 0.00 0.71 0.00 0.00 56.30 57.01 4pep h ASN 139 Cb 0.20 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.17 4pep h ASN 139 CO -0.01 0.44 -0.19 -0.07 -1.29 0.00 0.00 177.43 176.30 4pep h LEU 140 N 0.24 0.79 -0.14 0.34 3.38 -0.61 -2.92 115.31 116.39 4pep h LEU 140 Ca 0.04 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 4pep h LEU 140 Cb 0.46 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 4pep h LEU 140 CO 0.03 1.03 0.03 -0.25 0.09 0.00 0.00 178.44 179.37 4pep h TRP 141 N 0.55 0.23 0.00 1.13 2.91 -0.98 0.19 115.95 119.98 4pep h TRP 141 Ca 0.08 -0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.07 4pep h TRP 141 Cb 0.74 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 29.33 4pep h TRP 141 CO 0.06 0.38 -0.01 -0.44 -1.03 0.00 0.00 178.44 177.40 4pep h ASP 142 N 0.02 0.00 -0.36 2.65 3.45 -0.28 -2.10 116.42 119.80 4pep h ASP 142 Ca 0.04 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.50 4pep h ASP 142 Cb 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 4pep h ASP 142 CO 0.00 0.01 0.00 0.00 -1.57 0.00 0.00 179.24 177.68 4pep n GLN 143 N -3.50 2.32 -2.55 3.56 6.02 -1.11 -5.00 117.38 117.12 4pep n GLN 143 Ca -0.03 -2.05 -0.20 0.00 -0.01 0.00 0.00 57.00 54.71 4pep n GLN 143 Cb 0.09 -1.38 -0.00 0.00 1.02 0.00 0.00 30.24 29.97 4pep n GLN 143 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 4pep n GLY 144 N 1.00 -0.50 0.05 1.08 0.00 -0.79 -4.91 105.19 101.11 4pep n GLY 144 Ca 0.15 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.32 4pep n GLY 144 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 4pep n LEU 145 N -3.20 0.32 -4.08 0.99 4.77 0.03 -4.74 117.00 111.08 4pep n LEU 145 Ca -0.20 0.55 -0.14 0.00 -0.03 0.00 0.00 56.01 56.18 4pep n LEU 145 Cb 0.66 -0.46 -0.12 0.00 -2.33 0.00 0.00 43.42 41.17 4pep n LEU 145 CO 0.31 -0.18 -0.41 0.68 -1.33 0.00 0.00 177.39 176.46 4pep s VAL 146 N -3.07 0.62 0.01 4.08 -7.23 -1.25 -4.75 120.40 108.80 4pep s VAL 146 Ca 0.10 -1.10 -0.17 0.00 -1.81 0.00 0.00 61.98 59.00 4pep s VAL 146 Cb 0.14 -0.67 -0.35 0.00 0.56 0.00 0.00 36.38 36.06 4pep s VAL 146 CO 0.47 -0.35 0.96 0.28 -0.31 0.00 0.00 175.10 176.15 4pep h SER 147 N 4.50 0.75 -4.14 4.85 0.02 -1.85 -3.46 113.55 114.22 4pep h SER 147 Ca -0.36 -0.93 -0.69 0.00 -0.84 0.00 0.00 61.79 58.97 4pep h SER 147 Cb 1.20 -0.25 -0.24 0.00 0.14 0.00 0.00 62.40 63.25 4pep h SER 147 CO 0.41 1.65 -0.83 -1.10 -1.14 0.00 0.00 176.83 175.82 4pep s GLN 148 N -2.56 2.11 -0.12 3.45 -0.21 -1.26 -5.02 119.66 116.05 4pep s GLN 148 Ca -0.10 -0.95 -0.06 0.00 0.02 0.00 0.00 55.36 54.27 4pep s GLN 148 Cb 0.03 -2.16 -0.24 0.00 1.00 0.00 0.00 33.01 31.64 4pep s GLN 148 CO 0.92 0.55 3.44 -3.47 -2.12 0.00 0.00 175.29 174.61 4pep n ASP 149 N 1.87 5.27 -4.06 5.90 2.03 -1.26 -4.29 116.55 122.00 4pep n ASP 149 Ca -0.16 -2.44 -0.10 0.00 0.52 0.00 0.00 54.79 52.60 4pep n ASP 149 Cb 0.52 -1.37 -0.08 0.00 -0.72 0.00 0.00 41.12 39.47 4pep n ASP 149 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 4pep s LEU 150 N 0.01 1.12 0.02 -2.67 0.05 -1.26 -0.56 118.68 115.40 4pep s LEU 150 Ca 0.64 -1.07 -0.07 0.00 0.05 0.00 0.00 54.13 53.68 4pep s LEU 150 Cb 0.29 0.87 -0.00 0.00 -2.05 0.00 0.00 46.19 45.30 4pep s LEU 150 CO -0.00 -0.87 0.14 0.72 -0.55 0.00 0.00 176.35 175.78 4pep s PHE 151 N -4.03 0.09 0.03 3.48 -0.71 0.20 -0.52 117.98 116.53 4pep s PHE 151 Ca 0.24 -0.29 0.03 0.00 -1.04 0.00 0.00 56.93 55.87 4pep s PHE 151 Cb 0.05 -0.07 -0.02 0.00 -1.21 0.00 0.00 43.02 41.76 4pep s PHE 151 CO 0.04 -0.35 -0.09 -1.54 -1.34 0.00 0.00 175.22 171.94 4pep s SER 152 N -1.81 1.06 -0.07 1.98 1.04 -0.17 -0.12 113.70 115.63 4pep s SER 152 Ca -0.09 -0.42 0.03 0.00 0.48 0.00 0.00 55.95 55.95 4pep s SER 152 Cb -0.04 -0.03 0.01 0.00 0.10 0.00 0.00 66.02 66.06 4pep s SER 152 CO -0.02 -0.07 -0.14 -0.69 0.98 0.00 0.00 173.24 173.30 4pep s VAL 153 N -0.93 1.28 -0.15 5.02 1.01 0.19 -1.01 120.40 125.80 4pep s VAL 153 Ca -0.04 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.38 4pep s VAL 153 Cb -0.08 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.18 4pep s VAL 153 CO 0.01 0.39 -0.15 -0.47 0.00 0.00 0.00 175.10 174.87 4pep s TYR 154 N 0.54 2.24 -0.14 5.22 5.04 -0.18 -1.88 117.35 128.18 4pep s TYR 154 Ca -0.14 -1.26 -0.01 0.00 -2.44 0.00 0.00 57.07 53.22 4pep s TYR 154 Cb -0.15 -1.63 -0.01 0.00 0.35 0.00 0.00 41.96 40.51 4pep s TYR 154 CO 0.04 -0.68 -0.11 -0.51 -1.34 0.00 0.00 175.55 172.95 4pep s LEU 155 N 1.44 2.79 0.75 6.97 1.43 -1.26 -0.11 118.68 130.68 4pep s LEU 155 Ca 0.04 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 4pep s LEU 155 Cb -0.13 -1.64 0.06 0.00 0.03 0.00 0.00 46.19 44.52 4pep s LEU 155 CO -0.11 0.15 1.09 -0.94 0.23 0.00 0.00 176.35 176.77 4pep s SER 156 N 0.47 4.74 0.49 2.29 1.04 -1.26 -4.52 113.70 116.94 4pep s SER 156 Ca -0.08 0.66 0.04 0.00 0.48 0.00 0.00 55.95 57.05 4pep s SER 156 Cb -0.15 -1.26 -0.02 0.00 0.10 0.00 0.00 66.02 64.69 4pep s SER 156 CO 0.04 -1.71 0.14 -0.44 0.98 0.00 0.00 173.24 172.25 4pep s SER 157 N -4.53 4.28 -1.06 7.02 0.01 -1.26 -4.81 113.70 113.35 4pep s SER 157 Ca 0.61 -1.40 -0.04 0.00 1.31 0.00 0.00 55.95 56.43 4pep s SER 157 Cb -0.11 0.18 0.03 0.00 0.21 0.00 0.00 66.02 66.33 4pep s SER 157 CO 0.47 -0.80 0.21 0.59 0.41 0.00 0.00 173.24 174.12 4pep n ASN 158 N -1.35 -3.60 -1.62 2.44 5.03 -1.26 -1.47 115.26 113.44 4pep n ASN 158 Ca -0.09 -0.02 -0.20 0.00 0.87 0.00 0.00 54.58 55.13 4pep n ASN 158 Cb 0.66 -3.03 -0.08 0.00 -1.02 0.00 0.00 39.78 36.30 4pep n ASN 158 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 4pep n ASP 159 N -1.99 -5.47 -4.85 6.41 9.92 -1.26 -4.97 116.55 114.34 4pep n ASP 159 Ca -0.08 0.46 -0.32 0.00 -0.53 0.00 0.00 54.79 54.33 4pep n ASP 159 Cb 0.57 -4.74 -0.04 0.00 -0.64 0.00 0.00 41.12 36.28 4pep n ASP 159 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 4pep s ASP 160 N -2.73 6.61 0.71 -2.24 -0.00 -0.54 -4.91 116.67 113.56 4pep s ASP 160 Ca 0.00 1.43 -0.11 0.00 -0.00 0.00 0.00 52.55 53.87 4pep s ASP 160 Cb 0.00 -2.45 0.01 0.00 -0.00 0.00 0.00 42.92 40.48 4pep s ASP 160 CO 0.00 -0.51 1.08 -0.94 -0.00 0.00 0.00 175.17 174.79 4pep s SER 161 N -3.05 5.38 0.00 0.27 1.04 -1.26 -4.64 113.70 111.44 4pep s SER 161 Ca 0.57 1.31 0.00 0.00 0.48 0.00 0.00 55.95 58.31 4pep s SER 161 Cb -0.10 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 63.86 4pep s SER 161 CO 0.30 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 173.73 4pep n GLY 162 N -2.57 1.07 3.77 7.32 0.00 -1.26 -5.00 105.19 108.51 4pep n GLY 162 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 4pep n GLY 162 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4pep s SER 163 N -0.97 6.40 0.03 1.61 0.01 -1.26 -4.85 113.70 114.67 4pep s SER 163 Ca 0.00 2.59 -0.11 0.00 1.31 0.00 0.00 55.95 59.74 4pep s SER 163 Cb 0.00 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.61 4pep s SER 163 CO 0.00 -0.78 0.24 0.68 0.41 0.00 0.00 173.24 173.78 4pep s VAL 164 N -1.28 0.09 -0.20 3.43 -7.23 0.84 -0.74 120.40 115.32 4pep s VAL 164 Ca 0.56 -0.73 0.01 0.00 -1.81 0.00 0.00 61.98 60.00 4pep s VAL 164 Cb -0.37 -0.80 0.03 0.00 0.56 0.00 0.00 36.38 35.80 4pep s VAL 164 CO 0.47 -0.40 -0.17 -0.69 -0.31 0.00 0.00 175.10 174.00 4pep s VAL 165 N -2.17 2.20 -0.36 1.32 1.01 -0.26 -1.02 120.40 121.13 4pep s VAL 165 Ca -0.08 -1.03 -0.07 0.00 0.00 0.00 0.00 61.98 60.80 4pep s VAL 165 Cb -0.03 -2.00 0.05 0.00 0.00 0.00 0.00 36.38 34.40 4pep s VAL 165 CO -0.01 0.42 0.15 -0.22 0.00 0.00 0.00 175.10 175.44 4pep s LEU 166 N 1.27 4.59 -0.37 3.92 2.96 -0.18 -0.35 118.68 130.52 4pep s LEU 166 Ca 0.02 -1.25 -0.27 0.00 -0.22 0.00 0.00 54.13 52.41 4pep s LEU 166 Cb -0.14 -1.91 0.02 0.00 0.50 0.00 0.00 46.19 44.66 4pep s LEU 166 CO -0.11 -0.39 1.01 -0.76 -1.32 0.00 0.00 176.35 174.78 4pep s LEU 167 N 1.41 3.92 -0.13 -0.68 1.43 -0.04 -1.00 118.68 123.59 4pep s LEU 167 Ca 0.00 0.71 0.00 0.00 -1.03 0.00 0.00 54.13 53.82 4pep s LEU 167 Cb -0.20 -3.39 0.00 0.00 0.03 0.00 0.00 46.19 42.62 4pep s LEU 167 CO 0.03 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.29 4pep n GLY 168 N 4.29 0.35 3.82 -3.19 0.00 0.33 0.09 105.19 110.88 4pep n GLY 168 Ca 0.09 -0.87 -0.06 0.00 0.00 0.00 0.00 46.02 45.18 4pep n GLY 168 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4pep s GLY 169 N -2.95 -0.03 0.02 -0.02 0.00 -1.25 -4.19 107.32 98.90 4pep s GLY 169 Ca 0.00 -0.25 0.03 0.00 0.00 0.00 0.00 44.72 44.50 4pep s GLY 169 CO 0.00 0.18 -0.09 -0.42 0.00 0.00 0.00 173.10 172.77 4pep s ILE 170 N -3.23 0.68 -0.33 0.90 1.01 -1.26 -3.82 121.20 115.15 4pep s ILE 170 Ca 0.13 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 60.09 4pep s ILE 170 Cb -0.04 -0.64 0.09 0.00 0.01 0.00 0.00 42.46 41.88 4pep s ILE 170 CO 0.06 -0.06 0.03 -0.62 0.00 0.00 0.00 174.94 174.35 4pep s ASP 171 N -0.88 4.75 0.42 3.58 3.68 -1.26 -4.96 116.67 122.00 4pep s ASP 171 Ca -0.02 -2.00 0.25 0.00 2.13 0.00 0.00 52.55 52.91 4pep s ASP 171 Cb -0.06 -1.63 1.34 0.00 -1.45 0.00 0.00 42.92 41.12 4pep s ASP 171 CO 0.00 -0.36 1.73 0.28 0.13 0.00 0.00 175.17 176.96 4pep h SER 172 N 7.67 0.00 0.76 -0.34 0.02 -2.00 -1.71 113.55 117.95 4pep h SER 172 Ca -0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 4pep h SER 172 Cb 1.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.57 4pep h SER 172 CO 0.52 0.00 -0.44 -0.24 -1.14 0.00 0.00 176.83 175.53 4pep n SER 173 N -2.42 0.51 -0.31 3.07 2.88 -1.26 -3.96 113.62 112.13 4pep n SER 173 Ca -0.02 0.04 0.14 0.00 -1.33 0.00 0.00 58.87 57.71 4pep n SER 173 Cb 0.14 0.05 0.62 0.00 -0.75 0.00 0.00 64.21 64.27 4pep n SER 173 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 4pep n TYR 174 N -1.76 0.00 -4.15 0.66 4.02 -0.64 -4.75 117.16 110.53 4pep n TYR 174 Ca 0.05 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.82 4pep n TYR 174 Cb 0.38 -0.03 -0.09 0.00 -0.02 0.00 0.00 39.34 39.58 4pep n TYR 174 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 176.86 177.37 4pep s TYR 175 N -2.10 1.01 0.09 -0.72 1.13 -1.25 -2.03 117.35 113.48 4pep s TYR 175 Ca 0.38 -1.24 0.07 0.00 -1.41 0.00 0.00 57.07 54.87 4pep s TYR 175 Cb 0.21 -0.38 -0.03 0.00 -1.10 0.00 0.00 41.96 40.66 4pep s TYR 175 CO 0.38 -0.76 -0.19 0.95 -2.51 0.00 0.00 175.55 173.42 4pep s THR 176 N -4.04 1.58 0.00 -3.49 -4.23 -0.48 -4.59 115.64 100.39 4pep s THR 176 Ca 0.35 -1.48 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 4pep s THR 176 Cb 0.05 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.44 4pep s THR 176 CO 0.13 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 4pep n GLY 177 N 1.15 0.10 3.90 3.99 0.00 -1.26 -4.28 105.19 108.80 4pep n GLY 177 Ca -0.20 -0.93 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 4pep n GLY 177 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4pep s SER 178 N -4.00 6.00 0.18 1.61 0.01 -1.26 -5.06 113.70 111.18 4pep s SER 178 Ca 0.00 -0.03 -0.30 0.00 1.31 0.00 0.00 55.95 56.93 4pep s SER 178 Cb 0.00 -1.69 -0.08 0.00 0.21 0.00 0.00 66.02 64.47 4pep s SER 178 CO 0.00 -0.02 0.95 -0.76 0.41 0.00 0.00 173.24 173.82 4pep s LEU 179 N -3.72 4.59 -0.13 2.44 1.43 -1.26 -4.68 118.68 117.34 4pep s LEU 179 Ca 0.33 1.88 -0.02 0.00 -1.03 0.00 0.00 54.13 55.30 4pep s LEU 179 Cb -0.09 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 4pep s LEU 179 CO 0.27 0.06 -0.05 0.20 0.23 0.00 0.00 176.35 177.06 4pep s ASN 180 N -0.68 4.71 -0.18 2.29 0.01 -0.71 -4.89 114.94 115.49 4pep s ASN 180 Ca 0.44 -0.11 -0.06 0.00 -0.71 0.00 0.00 52.86 52.41 4pep s ASN 180 Cb -0.25 -1.62 -0.04 0.00 0.41 0.00 0.00 41.25 39.76 4pep s ASN 180 CO 0.31 0.22 0.03 0.26 -1.51 0.00 0.00 177.10 176.42 4pep s TRP 181 N 0.04 3.17 -0.14 2.20 0.52 -1.26 -0.82 118.94 122.65 4pep s TRP 181 Ca -0.00 -0.07 0.00 0.00 0.02 0.00 0.00 56.10 56.05 4pep s TRP 181 Cb -0.14 -2.06 -0.01 0.00 -1.15 0.00 0.00 33.47 30.12 4pep s TRP 181 CO 0.03 0.06 -0.14 0.08 0.02 0.00 0.00 176.95 177.00 4pep s VAL 182 N 0.46 2.86 0.36 4.03 1.01 0.12 -4.91 120.40 124.33 4pep s VAL 182 Ca 0.01 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 60.99 4pep s VAL 182 Cb -0.13 -2.21 -0.11 0.00 0.00 0.00 0.00 36.38 33.93 4pep s VAL 182 CO 0.01 0.52 1.48 -2.84 0.00 0.00 0.00 175.10 174.27 4pep s PRO 183 N 0.59 4.14 0.31 2.72 0.02 -1.26 0.18 135.00 141.70 4pep s PRO 183 Ca -0.08 2.52 -0.29 0.00 0.02 0.00 0.00 61.00 63.17 4pep s PRO 183 Cb -0.16 -2.99 -0.10 0.00 0.02 0.00 0.00 34.50 31.27 4pep s PRO 183 CO 0.03 -0.51 1.18 0.08 -0.33 0.00 0.00 177.00 177.46 4pep s VAL 184 N -0.92 3.17 -0.15 3.83 1.01 -0.28 -4.65 120.40 122.40 4pep s VAL 184 Ca 0.54 1.17 -0.10 0.00 0.00 0.00 0.00 61.98 63.59 4pep s VAL 184 Cb -0.46 -3.74 -0.24 0.00 0.00 0.00 0.00 36.38 31.95 4pep s VAL 184 CO 0.59 0.27 0.29 -1.54 0.00 0.00 0.00 175.10 174.71 4pep n SER 185 N 0.98 2.06 -3.75 3.32 3.41 0.13 -4.89 113.62 114.87 4pep n SER 185 Ca -0.00 0.25 -0.21 0.00 -0.26 0.00 0.00 58.87 58.64 4pep n SER 185 Cb 0.44 -0.87 -0.18 0.00 -0.26 0.00 0.00 64.21 63.34 4pep n SER 185 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 4pep s VAL 186 N -2.51 0.22 -0.49 -3.33 1.01 -1.25 -5.06 120.40 108.99 4pep s VAL 186 Ca -0.25 0.21 -0.26 0.00 0.00 0.00 0.00 61.98 61.67 4pep s VAL 186 Cb 0.07 -0.40 0.03 0.00 0.00 0.00 0.00 36.38 36.08 4pep s VAL 186 CO 0.71 0.23 1.01 -1.61 0.00 0.00 0.00 175.10 175.44 4pep s GLU 187 N 1.92 3.55 0.00 2.72 2.02 -1.26 -3.82 118.70 123.83 4pep s GLU 187 Ca 0.03 0.21 0.00 0.00 0.02 0.00 0.00 54.97 55.23 4pep s GLU 187 Cb -0.12 -3.95 0.00 0.00 0.10 0.00 0.00 34.13 30.16 4pep s GLU 187 CO -0.04 -1.35 0.00 0.41 0.02 0.00 0.00 175.26 174.30 4pep n GLY 188 N 4.96 -2.10 4.01 -1.39 0.00 -1.26 -4.90 105.19 104.50 4pep n GLY 188 Ca 0.07 0.65 -0.23 0.00 0.00 0.00 0.00 46.02 46.51 4pep n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4pep s TYR 189 N -0.15 1.37 -1.12 1.61 2.02 -1.26 -0.57 117.35 119.24 4pep s TYR 189 Ca 0.00 -0.44 -0.13 0.00 -0.37 0.00 0.00 57.07 56.13 4pep s TYR 189 Cb 0.00 -2.80 0.19 0.00 -0.40 0.00 0.00 41.96 38.95 4pep s TYR 189 CO 0.00 -1.66 1.27 -1.58 -1.57 0.00 0.00 175.55 172.01 4pep s TRP 190 N -3.06 3.65 -0.15 2.71 0.52 -1.26 -4.81 118.94 116.54 4pep s TRP 190 Ca 0.66 -2.16 -0.13 0.00 0.02 0.00 0.00 56.10 54.50 4pep s TRP 190 Cb -0.05 -4.16 -0.05 0.00 -1.15 0.00 0.00 33.47 28.06 4pep s TRP 190 CO 0.44 -1.28 0.27 -1.14 0.02 0.00 0.00 176.95 175.26 4pep s GLN 191 N 0.96 4.16 0.29 4.98 0.74 -1.25 -1.07 119.66 128.48 4pep s GLN 191 Ca 0.37 0.07 0.03 0.00 0.05 0.00 0.00 55.36 55.88 4pep s GLN 191 Cb -0.05 -3.39 -0.06 0.00 1.10 0.00 0.00 33.01 30.61 4pep s GLN 191 CO -0.04 0.32 0.06 0.96 -0.55 0.00 0.00 175.29 176.04 4pep s ILE 192 N 0.23 0.93 -0.30 -2.34 -4.36 0.23 0.18 121.20 115.77 4pep s ILE 192 Ca 0.16 -2.01 -0.10 0.00 -0.26 0.00 0.00 60.65 58.45 4pep s ILE 192 Cb -0.13 -2.67 -0.02 0.00 1.25 0.00 0.00 42.46 40.89 4pep s ILE 192 CO 0.04 -0.05 0.16 -0.89 0.24 0.00 0.00 174.94 174.44 4pep s THR 193 N -3.49 4.76 -0.39 8.37 2.01 -1.26 -1.34 115.64 124.30 4pep s THR 193 Ca 0.36 -0.26 -0.23 0.00 0.31 0.00 0.00 61.69 61.87 4pep s THR 193 Cb 0.08 -3.37 0.01 0.00 0.01 0.00 0.00 72.50 69.23 4pep s THR 193 CO 0.14 0.13 0.78 -0.22 -0.69 0.00 0.00 174.62 174.75 4pep s LEU 194 N 1.65 4.17 0.08 4.42 0.20 0.89 -4.04 118.68 126.05 4pep s LEU 194 Ca 0.05 0.19 -0.21 0.00 0.69 0.00 0.00 54.13 54.85 4pep s LEU 194 Cb -0.17 -2.99 -0.11 0.00 -0.43 0.00 0.00 46.19 42.49 4pep s LEU 194 CO 0.07 -0.79 1.59 0.44 -0.29 0.00 0.00 176.35 177.37 4pep h ASP 195 N 8.65 0.23 -5.69 3.68 3.45 -1.28 1.12 116.42 126.59 4pep h ASP 195 Ca -0.25 -0.20 0.28 0.00 0.43 0.00 0.00 57.03 57.30 4pep h ASP 195 Cb 1.09 -0.06 -0.07 0.00 -0.56 0.00 0.00 39.33 39.74 4pep h ASP 195 CO 0.92 0.37 0.79 -0.94 -1.57 0.00 0.00 179.24 178.81 4pep s SER 196 N -5.61 -0.01 0.00 6.45 1.04 -1.23 -2.15 113.70 112.20 4pep s SER 196 Ca -0.14 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 55.97 4pep s SER 196 Cb 0.07 0.26 -0.01 0.00 0.10 0.00 0.00 66.02 66.44 4pep s SER 196 CO 0.70 -0.51 -0.05 -0.63 0.98 0.00 0.00 173.24 173.73 4pep s ILE 197 N -2.17 0.37 0.01 -1.02 1.01 -1.03 -2.14 121.20 116.22 4pep s ILE 197 Ca 0.24 -0.28 -0.12 0.00 0.00 0.00 0.00 60.65 60.50 4pep s ILE 197 Cb -0.00 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 42.15 4pep s ILE 197 CO 0.01 0.05 0.24 -0.89 0.00 0.00 0.00 174.94 174.34 4pep s THR 198 N -0.24 0.08 -0.06 2.92 2.01 -0.60 -3.14 115.64 116.61 4pep s THR 198 Ca 0.00 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.36 4pep s THR 198 Cb -0.03 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.83 4pep s THR 198 CO -0.00 -0.36 -0.05 -0.32 -0.69 0.00 0.00 174.62 173.20 4pep s MET 199 N -1.77 0.98 -0.16 4.92 1.75 0.24 -1.61 119.30 123.65 4pep s MET 199 Ca -0.11 -0.12 -0.15 0.00 -1.25 0.00 0.00 55.69 54.06 4pep s MET 199 Cb -0.04 -1.02 0.02 0.00 2.84 0.00 0.00 34.83 36.63 4pep s MET 199 CO 0.01 -0.13 0.24 -0.25 -0.65 0.00 0.00 175.02 174.24 4pep n ASP 200 N 4.32 -4.68 0.00 1.11 8.00 -1.26 -1.13 116.55 122.91 4pep n ASP 200 Ca -0.20 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.40 4pep n ASP 200 Cb 0.51 -1.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.38 4pep n ASP 200 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 4pep n GLY 201 N 0.52 0.00 3.59 0.44 0.00 -1.26 -4.87 105.19 103.62 4pep n GLY 201 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 4pep n GLY 201 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4pep s GLU 202 N -0.25 2.86 -1.35 1.61 8.01 -0.28 -5.07 118.70 124.23 4pep s GLU 202 Ca 0.00 -0.52 -0.16 0.00 0.01 0.00 0.00 54.97 54.30 4pep s GLU 202 Cb 0.00 -2.65 0.03 0.00 -4.31 0.00 0.00 34.13 27.20 4pep s GLU 202 CO 0.00 0.64 2.07 2.41 0.01 0.00 0.00 175.26 180.39 4pep n THR 203 N 2.31 3.39 0.00 3.63 -1.04 -1.26 -0.59 114.28 120.72 4pep n THR 203 Ca -0.18 -3.14 0.00 0.00 -2.04 0.00 0.00 64.05 58.69 4pep n THR 203 Cb 0.53 -2.50 0.00 0.00 -1.82 0.00 0.00 70.33 66.54 4pep n THR 203 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 4pep n ILE 204 N 5.60 1.46 0.00 12.58 -5.35 -1.19 -4.80 119.36 127.66 4pep n ILE 204 Ca 0.51 0.47 0.00 0.00 -0.27 0.00 0.00 62.75 63.46 4pep n ILE 204 Cb 0.41 -1.47 0.00 0.00 -1.74 0.00 0.00 39.64 36.84 4pep n ILE 204 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 4pep n ALA 205 N -1.36 0.00 -3.68 -1.28 0.00 -1.25 -4.65 120.51 108.29 4pep n ALA 205 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 4pep n ALA 205 Cb 0.11 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.59 4pep n ALA 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4pep s SER 207 N -3.34 7.16 0.00 0.00 1.04 -1.26 -3.23 113.70 114.07 4pep s SER 207 Ca 0.35 1.38 0.00 0.00 0.48 0.00 0.00 55.95 58.16 4pep s SER 207 Cb -0.14 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.56 4pep s SER 207 CO 0.87 0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.84 4pep n GLY 208 N 2.06 1.26 0.00 7.32 0.00 -1.26 -4.83 105.19 109.74 4pep n GLY 208 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 4pep n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4pep n GLY 209 N -2.00 -1.34 1.36 -0.02 0.00 -0.91 -5.02 105.19 97.26 4pep n GLY 209 Ca 0.00 -1.57 -0.06 0.00 0.00 0.00 0.00 46.02 44.39 4pep n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4pep s GLN 211 N -2.38 3.38 0.17 0.00 -1.52 -1.26 -0.08 119.66 117.96 4pep s GLN 211 Ca 0.13 -0.56 0.05 0.00 -1.95 0.00 0.00 55.36 53.03 4pep s GLN 211 Cb -0.00 -2.77 -0.05 0.00 -0.22 0.00 0.00 33.01 29.97 4pep s GLN 211 CO 0.09 0.35 -0.09 0.00 -0.25 0.00 0.00 175.29 175.39 4pep s ALA 212 N 0.05 1.56 0.13 6.09 0.00 -0.45 -2.56 121.76 126.58 4pep s ALA 212 Ca -0.01 -1.56 0.08 0.00 0.00 0.00 0.00 51.96 50.47 4pep s ALA 212 Cb -0.14 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 4pep s ALA 212 CO 0.03 -0.11 -0.20 0.96 0.00 0.00 0.00 175.76 176.44 4pep s ILE 213 N -3.32 1.78 -0.39 0.00 -4.36 -0.44 -0.60 121.20 113.86 4pep s ILE 213 Ca 0.19 -1.70 -0.16 0.00 -0.26 0.00 0.00 60.65 58.72 4pep s ILE 213 Cb 0.03 -1.69 0.01 0.00 1.25 0.00 0.00 42.46 42.06 4pep s ILE 213 CO 0.03 -0.16 0.37 -0.69 0.24 0.00 0.00 174.94 174.73 4pep s VAL 214 N -1.52 5.16 -0.29 8.37 1.01 -0.23 -0.37 120.40 132.53 4pep s VAL 214 Ca 0.10 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.79 4pep s VAL 214 Cb -0.08 -3.94 0.08 0.00 0.00 0.00 0.00 36.38 32.44 4pep s VAL 214 CO 0.05 -0.29 0.00 -0.62 0.00 0.00 0.00 175.10 174.25 4pep s ASP 215 N 1.75 4.38 0.60 3.32 3.68 -0.36 -4.63 116.67 125.42 4pep s ASP 215 Ca 0.10 -1.70 0.37 0.00 2.13 0.00 0.00 52.55 53.45 4pep s ASP 215 Cb -0.17 -1.39 1.92 0.00 -1.45 0.00 0.00 42.92 41.82 4pep s ASP 215 CO 0.12 -0.31 2.21 0.71 0.13 0.00 0.00 175.17 178.03 4pep h THR 216 N 6.64 0.19 0.00 1.71 1.35 -1.85 -2.86 112.91 118.09 4pep h THR 216 Ca -0.12 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 4pep h THR 216 Cb 1.04 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 4pep h THR 216 CO 0.48 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 4pep n GLY 217 N -0.77 -1.45 3.47 5.82 0.00 -1.26 -4.71 105.19 106.28 4pep n GLY 217 Ca -0.02 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 4pep n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4pep s THR 218 N -3.10 3.65 0.06 2.61 2.01 -1.08 -5.04 115.64 114.76 4pep s THR 218 Ca 0.10 -0.45 -0.15 0.00 0.31 0.00 0.00 61.69 61.50 4pep s THR 218 Cb 0.13 -2.58 -0.25 0.00 0.01 0.00 0.00 72.50 69.81 4pep s THR 218 CO 0.48 0.51 1.16 0.28 -0.69 0.00 0.00 174.62 176.36 4pep h SER 219 N 6.61 0.88 -6.12 3.53 0.02 -1.86 0.38 113.55 116.98 4pep h SER 219 Ca -0.31 -0.76 -0.46 0.00 -0.84 0.00 0.00 61.79 59.42 4pep h SER 219 Cb 1.20 -0.27 0.01 0.00 0.14 0.00 0.00 62.40 63.47 4pep h SER 219 CO 0.60 1.53 -0.11 0.18 -1.14 0.00 0.00 176.83 177.89 4pep n LEU 220 N -3.87 0.00 -4.63 5.07 4.77 -1.26 -1.50 117.00 115.58 4pep n LEU 220 Ca -0.12 -2.35 -0.39 0.00 -0.03 0.00 0.00 56.01 53.13 4pep n LEU 220 Cb 0.89 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 41.61 4pep n LEU 220 CO 0.56 -0.65 0.04 -0.22 -1.33 0.00 0.00 177.39 175.79 4pep s LEU 221 N 0.00 4.08 0.15 2.23 2.96 -0.84 -3.23 118.68 124.02 4pep s LEU 221 Ca 0.47 0.32 0.09 0.00 -0.22 0.00 0.00 54.13 54.79 4pep s LEU 221 Cb -0.04 -2.41 -0.04 0.00 0.50 0.00 0.00 46.19 44.21 4pep s LEU 221 CO 0.30 -0.12 -0.20 0.42 -1.32 0.00 0.00 176.35 175.43 4pep s THR 222 N 1.75 1.86 0.35 3.68 -4.23 -0.73 -0.13 115.64 118.20 4pep s THR 222 Ca 0.15 -1.83 -0.12 0.00 -1.18 0.00 0.00 61.69 58.71 4pep s THR 222 Cb -0.15 -1.80 0.03 0.00 1.34 0.00 0.00 72.50 71.91 4pep s THR 222 CO 0.09 -0.22 0.66 -0.83 -0.54 0.00 0.00 174.62 173.78 4pep s GLY 223 N -2.45 0.66 0.21 3.99 0.00 -0.74 -0.57 107.32 108.41 4pep s GLY 223 Ca 0.14 -0.93 -0.30 0.00 0.00 0.00 0.00 44.72 43.62 4pep s GLY 223 CO 0.06 -0.52 1.36 2.56 0.00 0.00 0.00 173.10 176.57 4pep s PRO 224 N -2.91 4.34 0.37 2.90 0.04 -1.24 -0.37 135.00 138.13 4pep s PRO 224 Ca 0.20 2.14 0.19 0.00 0.04 0.00 0.00 61.00 63.57 4pep s PRO 224 Cb -0.03 -3.17 1.24 0.00 0.04 0.00 0.00 34.50 32.57 4pep s PRO 224 CO 0.13 -0.33 1.62 1.79 0.04 0.00 0.00 177.00 180.26 4pep h THR 225 N 3.73 0.16 -0.28 1.26 1.35 -1.88 -0.01 112.91 117.23 4pep h THR 225 Ca -0.45 -0.06 -0.05 0.00 -0.55 0.00 0.00 66.41 65.30 4pep h THR 225 Cb 1.21 -0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 67.60 4pep h THR 225 CO 0.78 0.03 -0.03 0.77 -0.25 0.00 0.00 175.52 176.82 4pep h SER 226 N 0.16 0.51 0.67 5.36 4.64 -1.99 -1.79 113.55 121.12 4pep h SER 226 Ca 0.79 -0.34 -0.23 0.00 -0.47 0.00 0.00 61.79 61.55 4pep h SER 226 Cb 2.02 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.96 4pep h SER 226 CO -0.65 0.73 -1.03 0.00 -0.87 0.00 0.00 176.83 175.01 4pep h ALA 227 N 0.80 0.33 -0.59 5.18 0.00 -1.42 -3.26 119.26 120.31 4pep h ALA 227 Ca 0.08 -0.81 0.01 0.00 0.00 0.00 0.00 54.91 54.18 4pep h ALA 227 Cb 0.48 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 4pep h ALA 227 CO 0.02 1.00 0.39 0.82 0.00 0.00 0.00 179.25 181.48 4pep h ILE 228 N 0.08 1.14 -0.80 0.00 1.08 -1.25 -2.69 117.51 115.07 4pep h ILE 228 Ca -0.07 -0.27 0.11 0.00 -0.39 0.00 0.00 64.86 64.24 4pep h ILE 228 Cb 1.72 0.28 -0.08 0.00 -3.07 0.00 0.00 36.82 35.67 4pep h ILE 228 CO 0.16 0.14 0.43 0.00 -0.69 0.00 0.00 178.15 178.19 4pep h ALA 229 N 1.22 1.15 -0.39 1.87 0.00 -1.36 0.28 119.26 122.03 4pep h ALA 229 Ca 0.22 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.20 4pep h ALA 229 Cb -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 4pep h ALA 229 CO -0.06 0.01 0.24 -0.91 0.00 0.00 0.00 179.25 178.53 4pep h ASN 230 N 0.69 0.40 -0.44 0.00 4.21 -1.57 -1.77 115.58 117.10 4pep h ASN 230 Ca 0.40 -0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.87 4pep h ASN 230 Cb 0.44 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 37.53 4pep h ASN 230 CO -0.28 0.29 0.12 0.40 -1.29 0.00 0.00 177.43 176.67 4pep h ILE 231 N 0.49 1.23 -0.95 2.81 2.04 -1.01 -1.22 117.51 120.89 4pep h ILE 231 Ca 0.15 -0.77 0.15 0.00 1.00 0.00 0.00 64.86 65.38 4pep h ILE 231 Cb -0.02 0.89 -0.09 0.00 -0.74 0.00 0.00 36.82 36.86 4pep h ILE 231 CO -0.06 0.28 0.56 1.56 0.00 0.00 0.00 178.15 180.49 4pep h GLN 232 N 0.58 0.79 0.33 2.37 1.08 -0.77 -1.13 115.11 118.36 4pep h GLN 232 Ca 0.14 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.28 4pep h GLN 232 Cb 0.29 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 4pep h GLN 232 CO -0.00 0.52 -0.16 0.77 -0.95 0.00 0.00 178.83 179.02 4pep h SER 233 N 0.81 -0.37 -0.08 1.46 0.02 -1.00 0.19 113.55 114.58 4pep h SER 233 Ca 0.51 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.33 4pep h SER 233 Cb 0.65 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 4pep h SER 233 CO -0.32 -0.03 0.10 0.44 -1.14 0.00 0.00 176.83 175.88 4pep h ASP 234 N -0.75 0.00 -0.01 3.07 3.32 -0.45 -2.97 116.42 118.63 4pep h ASP 234 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 4pep h ASP 234 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 4pep h ASP 234 CO 0.07 0.00 -0.34 2.30 -1.72 0.00 0.00 179.24 179.56 4pep n ILE 235 N -3.69 0.00 -1.20 0.35 -5.35 -0.50 -5.01 119.36 103.96 4pep n ILE 235 Ca -0.01 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 4pep n ILE 235 Cb 0.20 1.17 0.00 0.00 -1.74 0.00 0.00 39.64 39.27 4pep n ILE 235 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 4pep n GLY 236 N 1.13 1.06 3.84 3.28 0.00 -1.01 -4.94 105.19 108.54 4pep n GLY 236 Ca 0.06 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 4pep n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4pep s ALA 237 N -2.23 3.74 0.00 4.61 0.00 0.64 -4.53 121.76 123.99 4pep s ALA 237 Ca 0.00 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.61 4pep s ALA 237 Cb 0.00 -2.27 -0.00 0.00 0.00 0.00 0.00 23.12 20.84 4pep s ALA 237 CO 0.00 0.48 -0.03 0.45 0.00 0.00 0.00 175.76 176.66 4pep s SER 238 N -0.91 0.40 0.03 0.00 0.15 -0.93 -4.48 113.70 107.97 4pep s SER 238 Ca 0.21 -0.11 -0.30 0.00 0.70 0.00 0.00 55.95 56.44 4pep s SER 238 Cb -0.15 -0.03 -0.06 0.00 -1.71 0.00 0.00 66.02 64.07 4pep s SER 238 CO 0.10 0.01 1.39 -0.70 1.20 0.00 0.00 173.24 175.24 4pep s GLU 239 N -0.25 4.30 0.74 5.44 2.12 -1.26 -2.66 118.70 127.13 4pep s GLU 239 Ca -0.00 1.99 -0.02 0.00 0.36 0.00 0.00 54.97 57.30 4pep s GLU 239 Cb -0.02 -3.48 0.13 0.00 0.26 0.00 0.00 34.13 31.02 4pep s GLU 239 CO -0.00 -0.53 1.02 0.54 -0.54 0.00 0.00 175.26 175.75 4pep s ASN 240 N 1.66 4.24 0.30 -1.70 4.22 -0.72 -4.99 114.94 117.95 4pep s ASN 240 Ca 0.64 -0.34 0.04 0.00 -2.14 0.00 0.00 52.86 51.06 4pep s ASN 240 Cb -0.33 -0.01 0.48 0.00 1.28 0.00 0.00 41.25 42.67 4pep s ASN 240 CO 0.28 -1.94 1.76 0.77 -2.04 0.00 0.00 177.10 175.93 4pep h SER 241 N -0.62 0.44 -0.28 3.54 4.64 -1.96 -3.08 113.55 116.23 4pep h SER 241 Ca -0.37 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 60.80 4pep h SER 241 Cb 1.26 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 4pep h SER 241 CO 0.40 0.66 0.02 0.47 -0.87 0.00 0.00 176.83 177.51 4pep n ASP 242 N -4.15 3.23 0.00 4.97 9.92 -1.26 -4.94 116.55 124.33 4pep n ASP 242 Ca -0.00 -2.46 0.00 0.00 -0.53 0.00 0.00 54.79 51.80 4pep n ASP 242 Cb 0.37 -0.59 0.00 0.00 -0.64 0.00 0.00 41.12 40.26 4pep n ASP 242 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 4pep n GLY 243 N 0.26 2.49 3.22 0.44 0.00 -1.16 -5.05 105.19 105.37 4pep n GLY 243 Ca 0.14 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 4pep n GLY 243 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4pep n GLU 244 N 0.00 0.04 -2.93 1.61 1.02 -1.26 -4.47 120.64 114.64 4pep n GLU 244 Ca 0.00 0.03 -0.34 0.00 -0.02 0.00 0.00 57.16 56.83 4pep n GLU 244 Cb 0.00 -1.27 -0.02 0.00 -0.02 0.00 0.00 31.44 30.13 4pep n GLU 244 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 4pep n MET 245 N 1.09 4.05 -1.59 3.49 2.81 -1.26 -1.75 117.12 123.95 4pep n MET 245 Ca 0.04 -4.73 -0.38 0.00 -1.81 0.00 0.00 57.70 50.83 4pep n MET 245 Cb 0.52 -2.36 0.05 0.00 -0.71 0.00 0.00 33.22 30.72 4pep n MET 245 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 4pep n VAL 246 N 0.23 3.50 -3.85 2.03 0.24 -1.09 -2.78 118.33 116.62 4pep n VAL 246 Ca 0.35 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.34 62.06 4pep n VAL 246 Cb 0.34 -1.07 -0.08 0.00 -1.47 0.00 0.00 33.84 31.56 4pep n VAL 246 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 4pep s ILE 247 N -1.55 0.12 -0.17 1.34 2.07 1.00 -2.18 121.20 121.82 4pep s ILE 247 Ca 0.75 -1.00 -0.23 0.00 -1.41 0.00 0.00 60.65 58.75 4pep s ILE 247 Cb -0.42 -1.06 -0.02 0.00 0.13 0.00 0.00 42.46 41.09 4pep s ILE 247 CO 0.48 -0.55 0.74 -0.55 -1.91 0.00 0.00 174.94 173.15 4pep s SER 248 N -2.36 6.85 0.54 4.50 0.15 -1.26 -3.97 113.70 118.14 4pep s SER 248 Ca -0.02 1.04 0.31 0.00 0.70 0.00 0.00 55.95 57.98 4pep s SER 248 Cb 0.01 -2.41 1.47 0.00 -1.71 0.00 0.00 66.02 63.38 4pep s SER 248 CO -0.06 -0.33 1.90 0.00 1.20 0.00 0.00 173.24 175.95 4pep h SER 250 N 0.00 0.15 -0.45 0.00 0.02 -2.01 -2.17 113.55 109.09 4pep h SER 250 Ca 0.41 -0.00 0.12 0.00 -0.84 0.00 0.00 61.79 61.47 4pep h SER 250 Cb 1.63 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 64.11 4pep h SER 250 CO -0.01 0.11 0.32 0.28 -1.14 0.00 0.00 176.83 176.39 4pep h SER 251 N 0.18 0.06 -0.20 3.07 0.02 -0.53 -2.49 113.55 113.66 4pep h SER 251 Ca 0.06 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.07 4pep h SER 251 Cb 0.04 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.51 4pep h SER 251 CO -0.01 0.04 -0.20 0.40 -1.14 0.00 0.00 176.83 175.91 4pep h ILE 252 N 0.07 0.47 0.00 3.27 2.04 -1.54 2.13 117.51 123.95 4pep h ILE 252 Ca 0.22 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.01 4pep h ILE 252 Cb 0.77 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 4pep h ILE 252 CO -0.02 0.00 -0.33 0.44 0.00 0.00 0.00 178.15 178.24 4pep h ASP 253 N -0.23 0.00 0.22 1.72 3.45 -1.62 -3.31 116.42 116.65 4pep h ASP 253 Ca 0.12 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 57.24 4pep h ASP 253 Cb 0.41 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.12 4pep h ASP 253 CO -0.33 0.33 -2.07 -1.54 -1.57 0.00 0.00 179.24 174.07 4pep n SER 254 N -3.94 0.79 -4.80 6.45 3.41 -0.54 -5.01 113.62 109.96 4pep n SER 254 Ca -0.02 0.19 -0.33 0.00 -0.26 0.00 0.00 58.87 58.45 4pep n SER 254 Cb 0.39 0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 4pep n SER 254 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 4pep s LEU 255 N -6.01 3.58 0.94 1.04 1.02 0.71 -5.06 118.68 114.89 4pep s LEU 255 Ca -0.11 1.86 -0.14 0.00 0.02 0.00 0.00 54.13 55.75 4pep s LEU 255 Cb 0.07 -4.54 0.20 0.00 0.02 0.00 0.00 46.19 41.94 4pep s LEU 255 CO 0.80 -1.10 1.29 -2.16 0.02 0.00 0.00 176.35 175.20 4pep s PRO 256 N -3.88 0.67 0.24 1.29 0.04 -1.26 -4.68 135.00 127.43 4pep s PRO 256 Ca 0.65 -0.59 -0.06 0.00 0.04 0.00 0.00 61.00 61.04 4pep s PRO 256 Cb -0.16 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 4pep s PRO 256 CO 0.33 -2.35 0.51 -0.51 0.04 0.00 0.00 177.00 175.03 4pep s ASP 257 N -4.90 6.49 -0.24 6.66 -0.00 -1.26 -4.30 116.67 119.12 4pep s ASP 257 Ca 0.74 0.73 -0.09 0.00 -0.00 0.00 0.00 52.55 53.93 4pep s ASP 257 Cb -0.03 -2.15 -0.04 0.00 -0.00 0.00 0.00 42.92 40.70 4pep s ASP 257 CO 0.52 -0.11 0.12 -0.63 -0.00 0.00 0.00 175.17 175.07 4pep s ILE 258 N -1.93 4.94 -0.21 0.77 1.01 -0.25 -4.55 121.20 120.97 4pep s ILE 258 Ca 0.44 0.04 -0.07 0.00 0.00 0.00 0.00 60.65 61.05 4pep s ILE 258 Cb -0.11 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 4pep s ILE 258 CO 0.27 0.35 0.07 -0.69 0.00 0.00 0.00 174.94 174.93 4pep s VAL 259 N 1.21 4.58 -0.26 2.92 1.01 -0.63 -0.93 120.40 128.30 4pep s VAL 259 Ca 0.06 -0.10 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 4pep s VAL 259 Cb -0.14 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 4pep s VAL 259 CO 0.05 0.40 0.17 -0.36 0.00 0.00 0.00 175.10 175.36 4pep s PHE 260 N 0.95 3.26 -0.29 5.22 0.40 -0.95 -1.56 117.98 125.01 4pep s PHE 260 Ca 0.04 0.15 -0.14 0.00 -0.60 0.00 0.00 56.93 56.38 4pep s PHE 260 Cb -0.14 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 41.04 4pep s PHE 260 CO 0.03 -0.05 0.34 0.99 0.70 0.00 0.00 175.22 177.22 4pep s THR 261 N 1.41 5.19 -0.12 0.64 2.01 -0.91 0.08 115.64 123.94 4pep s THR 261 Ca 0.07 0.36 0.01 0.00 0.31 0.00 0.00 61.69 62.44 4pep s THR 261 Cb -0.15 -3.71 0.02 0.00 0.01 0.00 0.00 72.50 68.67 4pep s THR 261 CO 0.08 0.10 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.33 4pep s ILE 262 N 2.01 1.49 -1.73 1.82 1.01 -0.03 -0.91 121.20 124.86 4pep s ILE 262 Ca 0.13 -0.62 -0.20 0.00 0.00 0.00 0.00 60.65 59.96 4pep s ILE 262 Cb -0.16 -1.38 0.17 0.00 0.01 0.00 0.00 42.46 41.10 4pep s ILE 262 CO 0.11 0.44 0.76 -0.67 0.00 0.00 0.00 174.94 175.58 4pep n ASP 263 N 4.41 -3.13 0.00 3.58 2.03 -1.26 0.01 116.55 122.19 4pep n ASP 263 Ca -0.18 -1.03 0.00 0.00 0.52 0.00 0.00 54.79 54.09 4pep n ASP 263 Cb 0.51 -2.58 0.00 0.00 -0.72 0.00 0.00 41.12 38.33 4pep n ASP 263 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 4pep n GLY 264 N -1.33 2.72 3.91 0.27 0.00 -1.26 -5.01 105.19 104.49 4pep n GLY 264 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 4pep n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4pep s VAL 265 N -2.92 5.40 -0.14 1.61 0.11 0.10 -5.06 120.40 119.51 4pep s VAL 265 Ca 0.00 -0.25 -0.17 0.00 -2.93 0.00 0.00 61.98 58.63 4pep s VAL 265 Cb 0.00 -3.58 -0.04 0.00 -1.53 0.00 0.00 36.38 31.22 4pep s VAL 265 CO 0.00 0.24 0.43 -1.10 -3.33 0.00 0.00 175.10 171.34 4pep s GLN 266 N -2.21 4.30 -0.61 1.54 -0.21 -1.26 -0.85 119.66 120.36 4pep s GLN 266 Ca 0.31 0.35 0.03 0.00 0.02 0.00 0.00 55.36 56.08 4pep s GLN 266 Cb -0.13 -3.45 0.15 0.00 1.00 0.00 0.00 33.01 30.58 4pep s GLN 266 CO 0.23 0.14 0.38 0.71 -2.12 0.00 0.00 175.29 174.63 4pep s TYR 267 N 0.70 3.37 0.38 0.91 1.51 0.11 -4.97 117.35 119.36 4pep s TYR 267 Ca 0.23 -3.17 -0.26 0.00 -1.01 0.00 0.00 57.07 52.86 4pep s TYR 267 Cb -0.15 -2.85 -0.09 0.00 -0.11 0.00 0.00 41.96 38.76 4pep s TYR 267 CO 0.09 -0.69 1.19 -1.25 -1.11 0.00 0.00 175.55 173.78 4pep s PRO 268 N -0.69 4.16 -0.21 -1.71 0.04 -1.26 -2.23 135.00 133.10 4pep s PRO 268 Ca 0.20 1.91 0.02 0.00 0.04 0.00 0.00 61.00 63.17 4pep s PRO 268 Cb -0.18 -2.80 0.03 0.00 0.04 0.00 0.00 34.50 31.60 4pep s PRO 268 CO -0.06 -0.25 -0.16 -1.17 0.04 0.00 0.00 177.00 175.40 4pep s LEU 269 N -2.27 2.54 0.36 -3.56 2.96 -0.11 -4.98 118.68 113.63 4pep s LEU 269 Ca 0.54 -0.90 -0.11 0.00 -0.22 0.00 0.00 54.13 53.45 4pep s LEU 269 Cb -0.33 -1.46 -0.07 0.00 0.50 0.00 0.00 46.19 44.83 4pep s LEU 269 CO 0.42 -0.08 0.72 -0.94 -1.32 0.00 0.00 176.35 175.15 4pep s SER 270 N 1.25 6.57 0.53 3.68 1.04 -1.26 -1.09 113.70 124.41 4pep s SER 270 Ca -0.00 1.09 0.30 0.00 0.48 0.00 0.00 55.95 57.82 4pep s SER 270 Cb -0.16 -2.30 1.44 0.00 0.10 0.00 0.00 66.02 65.10 4pep s SER 270 CO -0.10 -0.31 1.90 1.55 0.98 0.00 0.00 173.24 177.26 4pep h PRO 271 N 1.59 0.03 0.00 4.02 0.13 -1.83 0.67 132.00 136.61 4pep h PRO 271 Ca -0.47 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 4pep h PRO 271 Cb 1.18 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 4pep h PRO 271 CO 0.65 0.02 -0.02 1.03 -0.23 0.00 0.00 178.00 179.44 4pep h SER 272 N 0.03 0.00 0.00 1.44 0.87 -1.87 -1.77 113.55 112.25 4pep h SER 272 Ca 0.41 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.79 4pep h SER 272 Cb 1.57 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.51 4pep h SER 272 CO -0.02 0.02 -1.02 0.00 -0.53 0.00 0.00 176.83 175.29 4pep h ALA 273 N 1.98 0.20 0.00 6.23 0.00 -0.03 -3.40 119.26 124.23 4pep h ALA 273 Ca -0.00 -1.04 0.00 0.00 0.00 0.00 0.00 54.91 53.87 4pep h ALA 273 Cb 0.04 0.62 0.00 0.00 0.00 0.00 0.00 17.79 18.46 4pep h ALA 273 CO 0.00 0.59 0.00 2.48 0.00 0.00 0.00 179.25 182.33 4pep n TYR 274 N -4.48 0.64 -4.50 0.00 0.18 -0.85 -4.62 117.16 103.54 4pep n TYR 274 Ca -0.26 0.23 -0.34 0.00 1.88 0.00 0.00 57.90 59.41 4pep n TYR 274 Cb 0.60 -0.88 -0.12 0.00 -0.38 0.00 0.00 39.34 38.57 4pep n TYR 274 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 4pep s ILE 275 N -3.20 3.81 -0.22 -3.48 1.09 -0.67 0.75 121.20 119.29 4pep s ILE 275 Ca 0.07 -0.41 -0.12 0.00 -1.10 0.00 0.00 60.65 59.09 4pep s ILE 275 Cb 0.11 -2.62 -0.05 0.00 -1.06 0.00 0.00 42.46 38.84 4pep s ILE 275 CO 0.42 0.54 0.21 -0.76 -0.10 0.00 0.00 174.94 175.25 4pep s LEU 276 N -0.14 4.15 -0.23 2.97 1.43 0.09 -4.80 118.68 122.14 4pep s LEU 276 Ca 0.02 0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.33 4pep s LEU 276 Cb -0.13 -2.20 -0.00 0.00 0.03 0.00 0.00 46.19 43.89 4pep s LEU 276 CO 0.03 0.06 -0.04 -1.58 0.23 0.00 0.00 176.35 175.04 4pep s GLN 277 N 0.94 3.27 -0.17 1.70 0.74 -1.26 -1.24 119.66 123.64 4pep s GLN 277 Ca 0.10 -0.70 -0.04 0.00 0.05 0.00 0.00 55.36 54.77 4pep s GLN 277 Cb -0.13 -3.01 0.07 0.00 1.10 0.00 0.00 33.01 31.04 4pep s GLN 277 CO 0.04 -0.24 0.16 -0.51 -0.55 0.00 0.00 175.29 174.18 4pep s ASP 278 N 1.45 1.67 -0.66 6.67 1.11 0.14 -4.97 116.67 122.08 4pep s ASP 278 Ca 0.05 -0.30 -0.10 0.00 0.18 0.00 0.00 52.55 52.38 4pep s ASP 278 Cb -0.15 0.11 0.01 0.00 1.07 0.00 0.00 42.92 43.97 4pep s ASP 278 CO -0.03 -0.32 0.56 -0.67 1.18 0.00 0.00 175.17 175.88 4pep n ASP 279 N 5.30 -4.49 0.00 0.27 -0.08 -1.26 -1.57 116.55 114.72 4pep n ASP 279 Ca -0.06 -0.70 0.00 0.00 -1.51 0.00 0.00 54.79 52.52 4pep n ASP 279 Cb 0.49 -1.44 0.00 0.00 2.34 0.00 0.00 41.12 42.51 4pep n ASP 279 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 4pep n ASP 280 N -1.75 0.00 -4.50 1.67 8.00 -1.26 -4.96 116.55 113.76 4pep n ASP 280 Ca -0.24 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 54.89 4pep n ASP 280 Cb 0.63 -0.70 -0.12 0.00 -0.02 0.00 0.00 41.12 40.91 4pep n ASP 280 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 4pep s SER 281 N -3.07 5.49 -0.12 -2.24 0.01 -0.61 -4.89 113.70 108.27 4pep s SER 281 Ca 0.00 -0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.09 4pep s SER 281 Cb 0.00 -2.00 -0.01 0.00 0.21 0.00 0.00 66.02 64.22 4pep s SER 281 CO 0.00 -0.06 -0.15 0.00 0.41 0.00 0.00 173.24 173.44 4pep s THR 283 N 0.31 1.02 0.35 0.00 -4.23 -0.37 -0.00 115.64 112.71 4pep s THR 283 Ca -0.12 -2.03 -0.26 0.00 -1.18 0.00 0.00 61.69 58.11 4pep s THR 283 Cb -0.16 -2.38 -0.09 0.00 1.34 0.00 0.00 72.50 71.21 4pep s THR 283 CO 0.06 -0.29 1.01 -0.55 -0.54 0.00 0.00 174.62 174.31 4pep s SER 284 N -3.31 7.07 0.00 3.99 0.15 -1.12 -0.73 113.70 119.74 4pep s SER 284 Ca 0.29 1.99 0.27 0.00 0.70 0.00 0.00 55.95 59.20 4pep s SER 284 Cb 0.06 -2.59 0.76 0.00 -1.71 0.00 0.00 66.02 62.54 4pep s SER 284 CO 0.09 -0.27 1.58 0.61 1.20 0.00 0.00 173.24 176.45 4pep n GLY 285 N 0.56 0.05 3.87 9.45 0.00 0.23 -4.75 105.19 114.60 4pep n GLY 285 Ca 0.03 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 4pep n GLY 285 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4pep s PHE 286 N -2.14 3.61 0.02 1.61 0.40 -1.26 -1.98 117.98 118.23 4pep s PHE 286 Ca 0.32 0.63 0.00 0.00 -0.60 0.00 0.00 56.93 57.28 4pep s PHE 286 Cb 0.20 -2.02 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 4pep s PHE 286 CO 0.38 0.66 -0.03 -2.00 0.70 0.00 0.00 175.22 174.94 4pep s GLU 287 N -1.40 0.26 -0.33 0.44 2.12 0.82 -4.94 118.70 115.67 4pep s GLU 287 Ca 0.23 -0.47 -0.20 0.00 0.36 0.00 0.00 54.97 54.88 4pep s GLU 287 Cb -0.13 0.05 -0.00 0.00 0.26 0.00 0.00 34.13 34.30 4pep s GLU 287 CO 0.12 -0.03 0.62 0.20 -0.54 0.00 0.00 175.26 175.62 4pep s GLY 288 N -1.11 1.77 -0.28 -1.50 0.00 -1.26 -1.79 107.32 103.15 4pep s GLY 288 Ca -0.12 -0.76 -0.04 0.00 0.00 0.00 0.00 44.72 43.80 4pep s GLY 288 CO -0.01 1.45 0.56 -0.29 0.00 0.00 0.00 173.10 174.81 4pep s MET 289 N 2.62 0.51 -0.25 2.90 1.75 0.50 -4.85 119.30 122.48 4pep s MET 289 Ca 0.24 1.06 -0.25 0.00 -1.25 0.00 0.00 55.69 55.49 4pep s MET 289 Cb -0.15 0.46 -0.00 0.00 2.84 0.00 0.00 34.83 37.98 4pep s MET 289 CO 0.13 -0.47 0.86 -0.51 -0.65 0.00 0.00 175.02 174.39 4pep s ASP 290 N 2.80 6.85 -0.61 1.11 1.11 -1.26 -3.70 116.67 122.96 4pep s ASP 290 Ca 0.10 1.03 0.06 0.00 0.18 0.00 0.00 52.55 53.91 4pep s ASP 290 Cb -0.14 -2.45 0.21 0.00 1.07 0.00 0.00 42.92 41.61 4pep s ASP 290 CO -0.19 -0.57 0.56 0.52 1.18 0.00 0.00 175.17 176.68 4pep n VAL 291 N 5.34 1.24 -2.18 -1.27 0.31 -1.26 -5.03 118.33 115.48 4pep n VAL 291 Ca 0.06 -4.70 -0.42 0.00 -0.01 0.00 0.00 64.34 59.27 4pep n VAL 291 Cb 0.47 -2.06 -0.03 0.00 -0.91 0.00 0.00 33.84 31.32 4pep n VAL 291 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 4pep s PRO 292 N -1.58 4.23 0.00 5.55 0.04 -1.26 -1.36 135.00 140.62 4pep s PRO 292 Ca 0.32 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.36 4pep s PRO 292 Cb 0.06 -3.79 0.00 0.00 0.04 0.00 0.00 34.50 30.81 4pep s PRO 292 CO -0.11 -0.72 0.00 0.25 0.04 0.00 0.00 177.00 176.45 4pep n THR 293 N 5.16 0.00 -0.07 1.26 -2.24 0.50 -4.99 114.28 113.90 4pep n THR 293 Ca 0.15 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.81 4pep n THR 293 Cb 0.43 -0.14 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 4pep n THR 293 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 4pep h SER 294 N 0.00 0.00 -0.09 3.42 4.64 -2.03 -3.31 113.55 116.17 4pep h SER 294 Ca 0.00 -0.65 -0.05 0.00 -0.47 0.00 0.00 61.79 60.62 4pep h SER 294 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 4pep h SER 294 CO 0.00 0.95 0.07 -1.54 -0.87 0.00 0.00 176.83 175.44 4pep n SER 295 N -4.62 3.62 0.00 4.97 3.41 -1.26 -4.95 113.62 114.79 4pep n SER 295 Ca -0.11 -2.24 0.00 0.00 -0.26 0.00 0.00 58.87 56.26 4pep n SER 295 Cb 0.39 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 4pep n SER 295 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4pep n GLY 296 N 0.55 0.30 3.54 5.00 0.00 -1.25 -4.83 105.19 108.49 4pep n GLY 296 Ca 0.06 -2.31 -0.39 0.00 0.00 0.00 0.00 46.02 43.38 4pep n GLY 296 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4pep s GLU 297 N -0.16 3.70 0.39 1.61 2.02 -1.26 0.19 118.70 125.18 4pep s GLU 297 Ca 0.00 -0.49 -0.18 0.00 0.02 0.00 0.00 54.97 54.32 4pep s GLU 297 Cb 0.00 -3.66 -0.10 0.00 0.10 0.00 0.00 34.13 30.47 4pep s GLU 297 CO 0.00 -0.29 0.86 -0.51 0.02 0.00 0.00 175.26 175.33 4pep s LEU 298 N 1.71 3.98 -0.12 1.80 1.43 -0.46 -4.65 118.68 122.37 4pep s LEU 298 Ca 0.06 1.50 -0.02 0.00 -1.03 0.00 0.00 54.13 54.64 4pep s LEU 298 Cb -0.16 -4.33 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 4pep s LEU 298 CO 0.09 -0.30 -0.05 0.26 0.23 0.00 0.00 176.35 176.58 4pep s TRP 299 N -2.12 3.00 -0.29 0.29 0.52 -1.06 -4.22 118.94 115.06 4pep s TRP 299 Ca 0.58 -0.18 -0.06 0.00 0.02 0.00 0.00 56.10 56.47 4pep s TRP 299 Cb -0.10 -1.86 0.01 0.00 -1.15 0.00 0.00 33.47 30.38 4pep s TRP 299 CO 0.16 0.11 0.05 0.42 0.02 0.00 0.00 176.95 177.71 4pep s ILE 300 N -0.10 3.71 -0.90 2.03 -1.09 0.26 -1.33 121.20 123.77 4pep s ILE 300 Ca 0.02 -0.78 -0.20 0.00 -2.23 0.00 0.00 60.65 57.45 4pep s ILE 300 Cb -0.13 -2.91 0.11 0.00 -1.58 0.00 0.00 42.46 37.95 4pep s ILE 300 CO 0.03 0.10 1.15 -0.76 -1.23 0.00 0.00 174.94 174.22 4pep s LEU 301 N 1.46 4.75 0.00 2.97 1.43 0.50 -1.77 118.68 128.02 4pep s LEU 301 Ca 0.02 -1.81 0.00 0.00 -1.03 0.00 0.00 54.13 51.31 4pep s LEU 301 Cb -0.17 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.62 4pep s LEU 301 CO 0.01 -1.18 0.00 0.61 0.23 0.00 0.00 176.35 176.02 4pep n GLY 302 N 5.66 -0.79 0.37 -3.19 0.00 -1.20 -1.22 105.19 104.82 4pep n GLY 302 Ca 0.21 -1.70 0.12 0.00 0.00 0.00 0.00 46.02 44.66 4pep n GLY 302 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 4pep h ASP 303 N 0.00 0.63 -0.64 1.61 3.32 -0.09 -1.03 116.42 120.23 4pep h ASP 303 Ca 0.00 0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.22 4pep h ASP 303 Cb 0.00 -0.09 -0.10 0.00 0.22 0.00 0.00 39.33 39.36 4pep h ASP 303 CO 0.00 0.32 0.07 0.58 -1.72 0.00 0.00 179.24 178.50 4pep h VAL 304 N 0.67 0.54 -0.05 -1.35 2.07 -1.54 0.03 116.25 116.61 4pep h VAL 304 Ca 0.44 -0.06 -0.09 0.00 0.82 0.00 0.00 66.70 67.80 4pep h VAL 304 Cb 0.72 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 4pep h VAL 304 CO -0.19 0.03 -0.31 0.15 0.02 0.00 0.00 177.57 177.27 4pep h PHE 305 N 0.19 0.41 -0.79 1.57 3.04 -1.56 -3.36 116.94 116.45 4pep h PHE 305 Ca 0.34 -0.19 -0.00 0.00 3.98 0.00 0.00 57.97 62.10 4pep h PHE 305 Cb 0.55 -0.06 -0.04 0.00 2.56 0.00 0.00 35.95 38.96 4pep h PHE 305 CO -0.31 0.93 0.48 0.82 -2.02 0.00 0.00 178.31 178.21 4pep h ILE 306 N -0.23 1.22 0.00 1.41 2.04 -0.89 -1.42 117.51 119.64 4pep h ILE 306 Ca -0.02 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.35 4pep h ILE 306 Cb 0.98 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 4pep h ILE 306 CO 0.06 0.23 0.07 0.03 0.00 0.00 0.00 178.15 178.54 4pep h ARG 307 N 1.08 0.00 0.00 2.37 3.08 -1.14 -2.08 114.38 117.69 4pep h ARG 307 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 4pep h ARG 307 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 4pep h ARG 307 CO -0.05 0.00 -1.28 1.04 -1.07 0.00 0.00 179.97 178.60 4pep n GLN 308 N -2.88 0.36 -4.15 0.04 1.13 -0.54 -4.83 117.38 106.52 4pep n GLN 308 Ca -0.03 -0.05 -0.27 0.00 -1.94 0.00 0.00 57.00 54.71 4pep n GLN 308 Cb 0.12 -1.58 -0.17 0.00 0.11 0.00 0.00 30.24 28.73 4pep n GLN 308 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 4pep s TYR 309 N -3.26 1.71 0.20 1.08 1.51 -0.78 -2.08 117.35 115.73 4pep s TYR 309 Ca 0.01 -0.84 -0.30 0.00 -1.01 0.00 0.00 57.07 54.93 4pep s TYR 309 Cb 0.14 -1.31 -0.09 0.00 -0.11 0.00 0.00 41.96 40.58 4pep s TYR 309 CO 0.84 -0.50 1.43 -0.47 -1.11 0.00 0.00 175.55 175.74 4pep s TYR 310 N 1.35 3.11 -0.08 2.71 6.14 0.44 -4.75 117.35 126.28 4pep s TYR 310 Ca -0.01 0.99 0.05 0.00 0.64 0.00 0.00 57.07 58.74 4pep s TYR 310 Cb -0.14 -3.77 -0.00 0.00 0.42 0.00 0.00 41.96 38.47 4pep s TYR 310 CO -0.05 -2.58 -0.24 0.99 0.64 0.00 0.00 175.55 174.30 4pep s THR 311 N 0.39 2.01 -0.18 4.34 2.01 -0.79 -2.54 115.64 120.89 4pep s THR 311 Ca 0.61 -1.02 -0.03 0.00 0.31 0.00 0.00 61.69 61.57 4pep s THR 311 Cb -0.40 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.37 4pep s THR 311 CO 0.38 0.55 -0.07 -0.69 -0.69 0.00 0.00 174.62 174.10 4pep s VAL 312 N 0.11 3.39 -0.32 3.82 1.01 -0.47 0.53 120.40 128.47 4pep s VAL 312 Ca -0.11 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 4pep s VAL 312 Cb -0.16 -2.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 4pep s VAL 312 CO 0.06 0.47 0.16 -0.36 0.00 0.00 0.00 175.10 175.43 4pep s PHE 313 N 0.88 3.19 -0.30 5.22 0.40 0.83 -0.90 117.98 127.30 4pep s PHE 313 Ca -0.02 -0.56 0.01 0.00 -0.60 0.00 0.00 56.93 55.76 4pep s PHE 313 Cb -0.15 -2.37 0.07 0.00 0.51 0.00 0.00 43.02 41.08 4pep s PHE 313 CO 0.01 -0.46 -0.01 0.34 0.70 0.00 0.00 175.22 175.80 4pep s ASP 314 N 1.62 4.73 0.18 1.36 3.68 -0.87 -0.63 116.67 126.75 4pep s ASP 314 Ca 0.05 -1.58 0.25 0.00 2.13 0.00 0.00 52.55 53.40 4pep s ASP 314 Cb -0.17 -1.64 0.66 0.00 -1.45 0.00 0.00 42.92 40.32 4pep s ASP 314 CO 0.07 -0.28 1.63 0.54 0.13 0.00 0.00 175.17 177.26 4pep n ARG 315 N 4.47 0.27 -0.08 4.34 5.12 0.28 0.04 116.66 131.10 4pep n ARG 315 Ca -0.09 0.18 -0.13 0.00 -1.93 0.00 0.00 57.85 55.88 4pep n ARG 315 Cb 0.42 -1.77 -0.05 0.00 -1.16 0.00 0.00 32.46 29.90 4pep n ARG 315 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 4pep h ALA 316 N 2.51 0.32 0.00 7.54 0.00 -1.87 -3.34 119.26 124.43 4pep h ALA 316 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 4pep h ALA 316 Cb 0.74 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.46 4pep h ALA 316 CO 0.00 0.21 -1.44 0.09 0.00 0.00 0.00 179.25 178.12 4pep n ASN 317 N -4.47 0.43 -3.53 0.00 3.02 -1.24 -5.03 115.26 104.44 4pep n ASN 317 Ca -0.05 -0.11 -0.19 0.00 -0.03 0.00 0.00 54.58 54.21 4pep n ASN 317 Cb 0.37 1.27 0.07 0.00 -0.61 0.00 0.00 39.78 40.88 4pep n ASN 317 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 4pep n ASN 318 N -2.17 -1.76 -4.21 6.41 3.02 0.11 -4.90 115.26 111.75 4pep n ASN 318 Ca -0.01 -0.70 -0.12 0.00 -0.03 0.00 0.00 54.58 53.72 4pep n ASN 318 Cb 0.50 -4.72 -0.10 0.00 -0.61 0.00 0.00 39.78 34.86 4pep n ASN 318 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 4pep s LYS 319 N -5.58 0.97 -0.09 3.52 1.02 -0.86 -1.13 119.74 117.58 4pep s LYS 319 Ca 0.01 -1.41 0.03 0.00 0.02 0.00 0.00 55.97 54.61 4pep s LYS 319 Cb -0.00 -0.35 -0.01 0.00 -0.52 0.00 0.00 37.83 36.94 4pep s LYS 319 CO 0.76 -0.01 -0.18 0.08 -0.92 0.00 0.00 175.35 175.08 4pep s VAL 320 N -3.53 2.66 -0.15 3.17 1.01 0.13 -2.04 120.40 121.64 4pep s VAL 320 Ca 0.16 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.28 4pep s VAL 320 Cb 0.05 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 4pep s VAL 320 CO -0.01 0.56 -0.06 -0.83 0.00 0.00 0.00 175.10 174.75 4pep s GLY 321 N -0.01 1.66 -0.02 4.51 0.00 -0.08 0.10 107.32 113.49 4pep s GLY 321 Ca -0.06 -0.85 0.05 0.00 0.00 0.00 0.00 44.72 43.85 4pep s GLY 321 CO 0.05 -0.08 -0.15 1.08 0.00 0.00 0.00 173.10 173.99 4pep s LEU 322 N 0.41 1.98 -0.09 0.66 1.43 0.00 -1.37 118.68 121.69 4pep s LEU 322 Ca -0.06 -0.29 -0.12 0.00 -1.03 0.00 0.00 54.13 52.64 4pep s LEU 322 Cb -0.15 -0.82 0.03 0.00 0.03 0.00 0.00 46.19 45.28 4pep s LEU 322 CO 0.04 0.17 0.31 0.00 0.23 0.00 0.00 176.35 177.10 4pep s ALA 323 N -0.23 -0.78 0.32 4.21 0.00 -1.05 -1.74 121.76 122.49 4pep s ALA 323 Ca 0.03 0.75 -0.29 0.00 0.00 0.00 0.00 51.96 52.45 4pep s ALA 323 Cb -0.07 -0.38 -0.11 0.00 0.00 0.00 0.00 23.12 22.55 4pep s ALA 323 CO 0.00 -0.18 1.57 -1.25 0.00 0.00 0.00 175.76 175.91 4pep s PRO 324 N -0.19 4.10 0.68 0.00 0.04 -1.26 0.17 135.00 138.54 4pep s PRO 324 Ca -0.03 2.60 -0.16 0.00 0.04 0.00 0.00 61.00 63.44 4pep s PRO 324 Cb -0.03 -3.00 0.01 0.00 0.04 0.00 0.00 34.50 31.52 4pep s PRO 324 CO 0.01 -0.62 1.21 0.14 0.04 0.00 0.00 177.00 177.78 4pep s VAL 325 N -0.36 2.41 -2.00 -0.36 -7.23 -0.88 -1.38 120.40 110.60 4pep s VAL 325 Ca 0.60 0.22 0.30 0.00 -1.81 0.00 0.00 61.98 61.29 4pep s VAL 325 Cb -0.48 -2.90 0.84 0.00 0.56 0.00 0.00 36.38 34.40 4pep s VAL 325 CO 0.53 -0.09 2.10 0.00 -0.31 0.00 0.00 175.10 177.33