#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wal s VAL 12 N 0.00 2.51 0.25 1.08 1.01 -1.26 -4.90 120.40 119.09 2wal s VAL 12 Ca 0.00 0.39 -0.31 0.00 0.00 0.00 0.00 61.98 62.06 2wal s VAL 12 Cb 0.00 -3.25 -0.14 0.00 0.00 0.00 0.00 36.38 33.00 2wal s VAL 12 CO 0.00 0.04 1.28 -2.65 0.00 0.00 0.00 175.10 173.77 2wal n PRO 13 N 3.45 1.76 -0.68 2.72 -0.02 -1.26 -2.09 135.00 138.89 2wal n PRO 13 Ca 0.12 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2wal n PRO 13 Cb 0.38 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 2wal n PRO 13 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wal n GLU 14 N 1.55 0.00 -2.79 -0.52 1.02 -1.26 -4.93 120.64 113.71 2wal n GLU 14 Ca 0.11 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.81 2wal n GLU 14 Cb 0.31 -3.67 0.00 0.00 -0.02 0.00 0.00 31.44 28.06 2wal n GLU 14 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2wal n SER 15 N 0.00 5.29 -4.95 1.62 2.88 -0.89 -4.76 113.62 112.81 2wal n SER 15 Ca 0.00 -3.06 -0.20 0.00 -1.33 0.00 0.00 58.87 54.28 2wal n SER 15 Cb 0.00 -1.50 0.04 0.00 -0.75 0.00 0.00 64.21 62.00 2wal n SER 15 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2wal s THR 16 N 0.61 2.65 0.17 2.46 -4.23 -1.26 -4.87 115.64 111.16 2wal s THR 16 Ca 0.40 -0.76 -0.14 0.00 -1.18 0.00 0.00 61.69 60.01 2wal s THR 16 Cb 0.01 -2.89 0.06 0.00 1.34 0.00 0.00 72.50 71.02 2wal s THR 16 CO 0.00 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 175.89 2wal h ALA 17 N 0.14 0.67 -0.49 3.99 0.00 -1.98 0.40 119.26 122.00 2wal h ALA 17 Ca -0.40 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 54.54 2wal h ALA 17 Cb 1.29 -0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 2wal h ALA 17 CO 0.48 0.16 -0.15 -0.09 0.00 0.00 0.00 179.25 179.65 2wal h ARG 18 N 0.71 -0.03 -0.34 0.00 2.43 -1.97 0.14 114.38 115.31 2wal h ARG 18 Ca 0.19 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.19 2wal h ARG 18 Cb -0.01 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2wal h ARG 18 CO -0.04 -0.02 -0.44 1.98 -1.51 0.00 0.00 179.97 179.94 2wal h MET 19 N -0.03 0.89 -0.37 0.20 4.05 -1.67 -0.38 114.93 117.62 2wal h MET 19 Ca 0.23 -0.50 0.01 0.00 -0.28 0.00 0.00 59.70 59.17 2wal h MET 19 Cb 0.39 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.20 2wal h MET 19 CO -0.52 1.15 0.22 1.96 0.23 0.00 0.00 176.91 179.95 2wal h GLN 20 N 0.71 0.44 -0.52 0.39 1.08 0.16 -2.00 115.11 115.38 2wal h GLN 20 Ca 0.04 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.19 2wal h GLN 20 Cb 1.04 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 28.34 2wal h GLN 20 CO 0.10 0.29 0.21 0.78 -0.95 0.00 0.00 178.83 179.26 2wal h GLY 21 N 0.46 0.83 0.66 3.46 0.00 -0.59 -2.48 103.07 105.42 2wal h GLY 21 Ca 0.15 -0.46 0.07 0.00 0.00 0.00 0.00 47.33 47.08 2wal h GLY 21 CO -0.06 0.43 0.42 0.00 0.00 0.00 0.00 176.54 177.33 2wal h ALA 22 N 1.05 1.00 -0.44 3.60 0.00 -0.88 -0.19 119.26 123.40 2wal h ALA 22 Ca 0.17 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 2wal h ALA 22 Cb 0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2wal h ALA 22 CO -0.01 0.10 -0.23 0.78 0.00 0.00 0.00 179.25 179.89 2wal h GLY 23 N 0.76 1.01 1.04 0.00 0.00 -1.17 -1.53 103.07 103.17 2wal h GLY 23 Ca 0.33 -0.92 -0.08 0.00 0.00 0.00 0.00 47.33 46.67 2wal h GLY 23 CO -0.19 0.83 0.08 0.50 0.00 0.00 0.00 176.54 177.76 2wal h LYS 24 N 0.76 1.01 -0.60 4.80 1.57 -1.20 -1.62 116.57 121.30 2wal h LYS 24 Ca 0.10 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2wal h LYS 24 Cb 0.80 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 2wal h LYS 24 CO 0.07 0.96 0.38 0.00 -0.57 0.00 0.00 179.45 180.29 2wal h ALA 25 N 1.01 0.76 -0.04 3.86 0.00 -0.81 -1.33 119.26 122.70 2wal h ALA 25 Ca 0.18 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2wal h ALA 25 Cb 0.45 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2wal h ALA 25 CO 0.01 0.21 0.01 1.25 0.00 0.00 0.00 179.25 180.74 2wal h LEU 26 N 0.81 0.07 -0.53 0.00 6.46 -1.14 0.25 115.31 121.22 2wal h LEU 26 Ca 0.22 -0.21 0.11 0.00 -0.12 0.00 0.00 57.88 57.88 2wal h LEU 26 Cb -0.06 -0.02 -0.11 0.00 -0.73 0.00 0.00 40.66 39.75 2wal h LEU 26 CO -0.04 0.26 -0.20 -0.74 -0.62 0.00 0.00 178.44 177.09 2wal h HIS 27 N -0.13 -0.50 -0.65 1.25 2.76 -1.19 0.10 115.15 116.81 2wal h HIS 27 Ca 0.01 0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.17 2wal h HIS 27 Cb 0.21 0.30 -0.03 0.00 1.55 0.00 0.00 27.41 29.45 2wal h HIS 27 CO -0.00 -0.29 0.12 1.49 -1.30 0.00 0.00 177.93 177.94 2wal h GLU 28 N -0.08 1.05 -0.36 5.26 4.81 -0.60 -2.54 114.58 122.12 2wal h GLU 28 Ca 0.25 -0.26 -0.15 0.00 -0.13 0.00 0.00 59.36 59.07 2wal h GLU 28 Cb 0.46 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2wal h GLU 28 CO -0.59 0.95 -0.36 1.25 -0.73 0.00 0.00 179.01 179.53 2wal h LEU 29 N 0.99 0.89 -0.94 1.64 6.46 0.24 -0.23 115.31 124.36 2wal h LEU 29 Ca 0.20 -0.39 -0.02 0.00 -0.12 0.00 0.00 57.88 57.55 2wal h LEU 29 Cb 0.41 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 40.05 2wal h LEU 29 CO 0.01 1.16 0.49 -0.07 -0.62 0.00 0.00 178.44 179.40 2wal h LEU 30 N 0.69 1.10 -0.09 2.25 3.38 -0.69 0.25 115.31 122.20 2wal h LEU 30 Ca 0.06 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2wal h LEU 30 Cb 0.93 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2wal h LEU 30 CO 0.09 0.88 -0.19 -0.07 0.09 0.00 0.00 178.44 179.24 2wal h LEU 31 N 1.24 0.33 -0.53 1.67 3.38 -1.03 -1.92 115.31 118.45 2wal h LEU 31 Ca 0.31 -0.56 -0.10 0.00 0.09 0.00 0.00 57.88 57.61 2wal h LEU 31 Cb 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2wal h LEU 31 CO -0.05 0.83 -0.07 0.77 0.09 0.00 0.00 178.44 180.01 2wal h SER 32 N -0.16 0.98 -0.40 -0.43 4.64 -0.98 -0.14 113.55 117.06 2wal h SER 32 Ca 0.00 -0.34 -0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2wal h SER 32 Cb 0.78 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.59 2wal h SER 32 CO 0.04 1.09 0.21 0.00 -0.87 0.00 0.00 176.83 177.30 2wal h ALA 33 N 0.92 0.51 -0.02 5.18 0.00 -1.00 -0.28 119.26 124.58 2wal h ALA 33 Ca 0.14 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2wal h ALA 33 Cb 0.63 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2wal h ALA 33 CO 0.04 0.06 -0.12 0.37 0.00 0.00 0.00 179.25 179.60 2wal h GLN 34 N 0.51 -0.18 -0.84 0.00 4.15 -1.25 -0.63 115.11 116.88 2wal h GLN 34 Ca 0.14 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.58 2wal h GLN 34 Cb 0.09 0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 2wal h GLN 34 CO -0.02 -0.12 0.55 -0.09 -1.93 0.00 0.00 178.83 177.21 2wal h ARG 35 N -0.19 1.12 -0.06 1.69 2.43 -0.52 -1.49 114.38 117.36 2wal h ARG 35 Ca 0.05 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2wal h ARG 35 Cb 0.25 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2wal h ARG 35 CO -0.13 0.75 0.00 1.04 -1.51 0.00 0.00 179.97 180.12 2wal n GLN 36 N -4.40 1.42 -2.60 0.20 6.02 -0.16 -4.92 117.38 112.95 2wal n GLN 36 Ca 0.09 -0.63 -0.12 0.00 -0.01 0.00 0.00 57.00 56.34 2wal n GLN 36 Cb 0.03 -1.42 0.02 0.00 1.02 0.00 0.00 30.24 29.89 2wal n GLN 36 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wal n GLY 37 N 1.05 0.01 1.10 1.08 0.00 -0.56 -4.92 105.19 102.95 2wal n GLY 37 Ca 0.18 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.93 2wal n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wal s LEU 39 N -1.88 2.86 -0.16 0.00 0.20 -1.20 -1.05 118.68 117.45 2wal s LEU 39 Ca 0.36 -0.24 -0.02 0.00 0.69 0.00 0.00 54.13 54.92 2wal s LEU 39 Cb 0.38 -1.64 -0.02 0.00 -0.43 0.00 0.00 46.19 44.48 2wal s LEU 39 CO -0.11 0.22 -0.07 -0.89 -0.29 0.00 0.00 176.35 175.21 2wal s THR 40 N 0.05 3.53 -0.16 3.68 2.01 0.09 -4.96 115.64 119.87 2wal s THR 40 Ca -0.04 -0.48 -0.00 0.00 0.31 0.00 0.00 61.69 61.48 2wal s THR 40 Cb -0.14 -2.53 -0.00 0.00 0.01 0.00 0.00 72.50 69.83 2wal s THR 40 CO 0.04 0.49 -0.15 0.00 -0.69 0.00 0.00 174.62 174.32 2wal s ALA 41 N 0.51 2.52 0.00 7.40 0.00 -1.26 -0.95 121.76 129.98 2wal s ALA 41 Ca -0.05 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2wal s ALA 41 Cb -0.15 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.71 2wal s ALA 41 CO 0.03 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.13 2wal n GLY 42 N 4.14 3.34 0.24 0.00 0.00 0.12 -4.65 105.19 108.37 2wal n GLY 42 Ca -0.19 -1.65 -0.07 0.00 0.00 0.00 0.00 46.02 44.11 2wal n GLY 42 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wal h VAL 43 N 0.00 1.20 0.08 1.61 2.07 -1.91 0.24 116.25 119.54 2wal h VAL 43 Ca 0.00 -0.54 -0.25 0.00 0.82 0.00 0.00 66.70 66.73 2wal h VAL 43 Cb 0.00 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2wal h VAL 43 CO 0.00 0.22 -1.12 1.88 0.02 0.00 0.00 177.57 178.57 2wal h TYR 44 N 0.73 0.46 -0.37 1.57 0.05 -1.96 -0.33 116.97 117.13 2wal h TYR 44 Ca 0.19 -0.31 -0.07 0.00 0.05 0.00 0.00 58.73 58.59 2wal h TYR 44 Cb 0.10 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 2wal h TYR 44 CO -0.01 1.20 -0.04 0.93 -1.05 0.00 0.00 178.16 179.19 2wal h GLU 45 N 0.11 0.68 -0.34 4.88 3.07 -1.81 -2.11 114.58 119.05 2wal h GLU 45 Ca -0.10 -0.24 -0.02 0.00 -0.50 0.00 0.00 59.36 58.50 2wal h GLU 45 Cb 1.82 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 29.67 2wal h GLU 45 CO 0.18 0.81 0.14 0.77 -1.40 0.00 0.00 179.01 179.51 2wal h SER 46 N 0.48 0.47 -0.90 1.42 0.02 -0.47 -2.62 113.55 111.94 2wal h SER 46 Ca 0.10 -0.16 0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2wal h SER 46 Cb 0.53 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.90 2wal h SER 46 CO 0.03 0.50 0.59 0.00 -1.14 0.00 0.00 176.83 176.81 2wal h ALA 47 N 0.99 1.43 -0.31 3.77 0.00 -0.99 -1.18 119.26 122.96 2wal h ALA 47 Ca 0.11 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 2wal h ALA 47 Cb 0.18 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2wal h ALA 47 CO -0.01 0.49 -0.35 -0.22 0.00 0.00 0.00 179.25 179.16 2wal h LYS 48 N 1.13 0.79 0.14 0.00 3.11 -1.22 0.15 116.57 120.67 2wal h LYS 48 Ca 0.36 -0.43 -0.01 0.00 -2.81 0.00 0.00 60.65 57.76 2wal h LYS 48 Cb 0.01 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.27 2wal h LYS 48 CO -0.11 1.06 -0.07 0.28 -2.81 0.00 0.00 179.45 177.80 2wal h VAL 49 N 0.55 0.86 -0.61 2.00 2.07 -1.09 0.30 116.25 120.33 2wal h VAL 49 Ca 0.04 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.62 2wal h VAL 49 Cb 0.93 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 2wal h VAL 49 CO 0.08 0.00 0.41 -0.07 0.02 0.00 0.00 177.57 178.02 2wal h LEU 50 N -0.20 0.47 0.03 2.57 3.38 -1.02 0.92 115.31 121.46 2wal h LEU 50 Ca -0.02 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 2wal h LEU 50 Cb 0.15 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 40.82 2wal h LEU 50 CO 0.03 0.29 -0.41 -1.13 0.09 0.00 0.00 178.44 177.32 2wal h ASN 51 N 0.53 0.31 0.00 -0.43 -1.24 -0.32 -3.35 115.58 111.07 2wal h ASN 51 Ca 0.27 -0.84 0.00 0.00 0.71 0.00 0.00 56.30 56.44 2wal h ASN 51 Cb 0.39 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.34 2wal h ASN 51 CO -0.08 1.12 0.00 0.52 -1.29 0.00 0.00 177.43 177.70 2wal n VAL 52 N -4.38 0.00 -3.50 2.57 0.31 0.10 -4.81 118.33 108.63 2wal n VAL 52 Ca -0.11 0.87 -0.27 0.00 -0.01 0.00 0.00 64.34 64.82 2wal n VAL 52 Cb 0.61 -1.82 -0.13 0.00 -0.91 0.00 0.00 33.84 31.58 2wal n VAL 52 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wal s ASP 53 N -2.48 3.13 0.00 4.52 -1.08 0.29 -4.99 116.67 116.06 2wal s ASP 53 Ca 0.00 -1.48 0.29 0.00 -0.52 0.00 0.00 52.55 50.85 2wal s ASP 53 Cb 0.00 -0.25 1.37 0.00 -1.46 0.00 0.00 42.92 42.58 2wal s ASP 53 CO 0.00 -0.40 1.94 -0.81 0.52 0.00 0.00 175.17 176.43 2wal n PRO 54 N 4.92 0.72 0.11 4.34 -0.04 -1.18 -4.40 135.00 139.47 2wal n PRO 54 Ca -0.00 -0.19 0.11 0.00 -0.04 0.00 0.00 63.50 63.37 2wal n PRO 54 Cb 0.41 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 32.84 2wal n PRO 54 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2wal n ASP 55 N -0.98 0.54 -0.57 3.54 8.00 -1.26 -2.29 116.55 123.54 2wal n ASP 55 Ca 0.16 0.65 0.05 0.00 0.71 0.00 0.00 54.79 56.36 2wal n ASP 55 Cb 0.25 -0.76 0.13 0.00 -0.02 0.00 0.00 41.12 40.72 2wal n ASP 55 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2wal n ASN 56 N -2.12 2.70 -4.70 -2.24 5.15 -1.26 -4.98 115.26 107.80 2wal n ASN 56 Ca 0.02 -1.90 -0.39 0.00 -0.60 0.00 0.00 54.58 51.71 2wal n ASN 56 Cb 0.19 -0.18 -0.06 0.00 -0.53 0.00 0.00 39.78 39.20 2wal n ASN 56 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2wal s VAL 57 N -0.98 5.12 -0.06 3.44 0.11 -0.97 -1.10 120.40 125.97 2wal s VAL 57 Ca 0.20 1.05 0.22 0.00 -2.93 0.00 0.00 61.98 60.51 2wal s VAL 57 Cb 0.11 -3.87 -0.31 0.00 -1.53 0.00 0.00 36.38 30.78 2wal s VAL 57 CO 0.15 0.24 0.48 0.00 -3.33 0.00 0.00 175.10 172.64 2wal n ALA 58 N 4.20 2.64 -3.59 1.54 0.00 0.18 -4.91 120.51 120.57 2wal n ALA 58 Ca -0.05 -0.59 -0.13 0.00 0.00 0.00 0.00 53.44 52.67 2wal n ALA 58 Cb 0.51 -0.72 -0.06 0.00 0.00 0.00 0.00 19.45 19.18 2wal n ALA 58 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2wal s PHE 59 N -3.39 -0.57 -0.02 0.00 5.36 -0.82 -4.05 117.98 114.50 2wal s PHE 59 Ca -0.08 1.21 0.04 0.00 -0.96 0.00 0.00 56.93 57.14 2wal s PHE 59 Cb 0.13 0.37 -0.01 0.00 -0.34 0.00 0.00 43.02 43.17 2wal s PHE 59 CO 0.89 -0.38 -0.12 0.00 -1.46 0.00 0.00 175.22 174.15 2wal s VAL 61 N -0.17 2.02 -0.18 0.00 1.01 0.40 -1.71 120.40 121.76 2wal s VAL 61 Ca 0.03 -0.94 -0.08 0.00 0.00 0.00 0.00 61.98 60.98 2wal s VAL 61 Cb -0.06 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 2wal s VAL 61 CO -0.00 0.54 0.09 -0.76 0.00 0.00 0.00 175.10 174.97 2wal s LEU 62 N 1.00 4.01 -0.11 3.92 1.43 -0.47 -1.19 118.68 127.28 2wal s LEU 62 Ca -0.03 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 2wal s LEU 62 Cb -0.15 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 44.07 2wal s LEU 62 CO -0.06 0.20 -0.13 0.00 0.23 0.00 0.00 176.35 176.59 2wal s ALA 63 N 0.23 1.55 -0.07 4.21 0.00 0.21 -1.06 121.76 126.82 2wal s ALA 63 Ca 0.06 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.34 2wal s ALA 63 Cb -0.12 -0.83 0.04 0.00 0.00 0.00 0.00 23.12 22.21 2wal s ALA 63 CO -0.00 -0.17 0.16 0.00 0.00 0.00 0.00 175.76 175.75 2wal s ALA 64 N 1.17 -0.30 1.03 0.00 0.00 -0.88 -4.42 121.76 118.36 2wal s ALA 64 Ca -0.04 0.72 -0.17 0.00 0.00 0.00 0.00 51.96 52.47 2wal s ALA 64 Cb -0.14 -0.50 0.24 0.00 0.00 0.00 0.00 23.12 22.72 2wal s ALA 64 CO -0.03 -0.19 1.32 0.20 0.00 0.00 0.00 175.76 177.06 2wal s GLY 65 N 1.25 1.79 0.21 0.00 0.00 -1.26 -4.33 107.32 104.98 2wal s GLY 65 Ca -0.09 -1.28 -0.10 0.00 0.00 0.00 0.00 44.72 43.25 2wal s GLY 65 CO -0.06 -0.43 1.88 -2.09 0.00 0.00 0.00 173.10 172.39 2wal h GLU 66 N -1.92 1.03 -0.23 2.90 4.81 -2.01 -2.60 114.58 116.55 2wal h GLU 66 Ca -0.44 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2wal h GLU 66 Cb 1.22 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 2wal h GLU 66 CO 0.31 0.69 0.15 1.05 -0.73 0.00 0.00 179.01 180.49 2wal h GLU 67 N 1.05 0.31 -0.11 1.92 4.11 -2.00 -2.68 114.58 117.18 2wal h GLU 67 Ca 0.28 -0.02 0.03 0.00 0.07 0.00 0.00 59.36 59.72 2wal h GLU 67 Cb -0.11 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.07 2wal h GLU 67 CO -0.06 0.21 0.38 -0.44 0.07 0.00 0.00 179.01 179.17 2wal h ASP 68 N 0.32 0.00 0.12 3.06 3.32 -1.82 -0.41 116.42 121.00 2wal h ASP 68 Ca 0.09 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 2wal h ASP 68 Cb -0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2wal h ASP 68 CO -0.02 0.00 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.08 2wal h GLU 69 N 0.00 0.00 -0.57 3.56 4.39 -1.34 -1.99 114.58 118.63 2wal h GLU 69 Ca 0.05 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 2wal h GLU 69 Cb 0.81 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.43 2wal h GLU 69 CO -0.00 0.09 0.06 0.41 -1.16 0.00 0.00 179.01 178.41 2wal n GLY 70 N -1.20 3.31 3.30 -3.84 0.00 -0.16 -4.81 105.19 101.79 2wal n GLY 70 Ca -0.03 -0.96 -0.46 0.00 0.00 0.00 0.00 46.02 44.57 2wal n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wal s ASP 71 N -1.01 6.40 0.24 1.61 -1.08 -0.75 -4.94 116.67 117.14 2wal s ASP 71 Ca 0.53 -2.34 -0.07 0.00 -0.52 0.00 0.00 52.55 50.16 2wal s ASP 71 Cb 0.41 -2.18 0.23 0.00 -1.46 0.00 0.00 42.92 39.93 2wal s ASP 71 CO 0.14 -0.67 1.91 0.40 0.52 0.00 0.00 175.17 177.47 2wal h ILE 72 N 5.29 1.25 -0.48 4.11 2.04 -1.87 -0.87 117.51 126.98 2wal h ILE 72 Ca -0.06 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 2wal h ILE 72 Cb 1.06 -0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2wal h ILE 72 CO 0.86 0.25 0.29 0.00 0.00 0.00 0.00 178.15 179.55 2wal h ALA 73 N 1.34 0.61 -0.09 1.87 0.00 -1.97 0.60 119.26 121.62 2wal h ALA 73 Ca 0.35 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2wal h ALA 73 Cb -0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 2wal h ALA 73 CO -0.07 0.09 0.04 1.25 0.00 0.00 0.00 179.25 180.56 2wal h LEU 74 N 0.64 0.12 -0.98 0.00 6.46 -1.72 -1.29 115.31 118.54 2wal h LEU 74 Ca 0.17 -0.13 -0.02 0.00 -0.12 0.00 0.00 57.88 57.78 2wal h LEU 74 Cb -0.02 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 39.84 2wal h LEU 74 CO -0.03 0.22 0.44 1.56 -0.62 0.00 0.00 178.44 180.00 2wal h GLN 75 N 0.01 1.16 -0.71 1.25 1.08 -0.94 -0.50 115.11 116.46 2wal h GLN 75 Ca 0.03 -0.14 -0.02 0.00 -1.45 0.00 0.00 58.65 57.07 2wal h GLN 75 Cb 0.13 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.30 2wal h GLN 75 CO -0.00 0.86 0.36 0.82 -0.95 0.00 0.00 178.83 179.92 2wal h ILE 76 N 1.16 1.23 -0.99 2.54 1.08 -0.66 0.16 117.51 122.03 2wal h ILE 76 Ca 0.29 -0.61 0.05 0.00 -0.39 0.00 0.00 64.86 64.20 2wal h ILE 76 Cb 0.05 0.32 -0.06 0.00 -3.07 0.00 0.00 36.82 34.06 2wal h ILE 76 CO -0.04 0.26 0.64 0.45 -0.69 0.00 0.00 178.15 178.77 2wal h HIS 77 N 0.99 1.20 -0.74 1.37 3.86 -0.56 -1.84 115.15 119.42 2wal h HIS 77 Ca 0.25 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.46 2wal h HIS 77 Cb 0.08 -0.39 -0.03 0.00 1.06 0.00 0.00 27.41 28.12 2wal h HIS 77 CO 0.00 0.64 0.34 0.74 0.86 0.00 0.00 177.93 180.52 2wal h PHE 78 N 1.19 1.09 -0.73 2.45 -1.00 -0.42 -0.30 116.94 119.22 2wal h PHE 78 Ca 0.42 -0.06 0.02 0.00 2.81 0.00 0.00 57.97 61.15 2wal h PHE 78 Cb 0.11 -0.33 -0.04 0.00 3.61 0.00 0.00 35.95 39.29 2wal h PHE 78 CO -0.00 0.81 0.48 1.15 -1.61 0.00 0.00 178.31 179.13 2wal h THR 79 N 1.05 1.15 -0.11 -1.55 2.02 -0.03 -0.17 112.91 115.28 2wal h THR 79 Ca 0.25 -0.33 -0.06 0.00 0.77 0.00 0.00 66.41 67.05 2wal h THR 79 Cb 0.14 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.66 2wal h THR 79 CO -0.03 0.17 -0.16 -0.07 0.37 0.00 0.00 175.52 175.81 2wal h LEU 80 N 0.96 0.33 -0.56 2.58 3.38 -1.07 -1.39 115.31 119.55 2wal h LEU 80 Ca 0.28 -0.52 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 2wal h LEU 80 Cb -0.06 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2wal h LEU 80 CO -0.08 0.79 0.19 0.40 0.09 0.00 0.00 178.44 179.82 2wal h ILE 81 N -0.11 1.23 -0.40 1.22 2.04 -0.91 -1.88 117.51 118.70 2wal h ILE 81 Ca 0.01 -0.77 -0.11 0.00 1.00 0.00 0.00 64.86 64.99 2wal h ILE 81 Cb 0.71 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 2wal h ILE 81 CO 0.04 0.29 -0.19 -0.61 0.00 0.00 0.00 178.15 177.68 2wal h GLN 82 N 0.77 0.83 -0.21 2.37 4.15 -1.02 -0.59 115.11 121.42 2wal h GLN 82 Ca 0.18 -0.36 0.01 0.00 0.77 0.00 0.00 58.65 59.25 2wal h GLN 82 Cb 0.26 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.91 2wal h GLN 82 CO -0.01 1.00 0.11 0.00 -1.93 0.00 0.00 178.83 178.00 2wal h ALA 83 N 0.82 0.25 -0.15 3.38 0.00 -1.16 -0.78 119.26 121.61 2wal h ALA 83 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2wal h ALA 83 Cb 0.74 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2wal h ALA 83 CO 0.06 -0.30 -0.03 0.35 0.00 0.00 0.00 179.25 179.32 2wal h PHE 84 N 0.23 -0.07 -0.60 0.00 3.57 -1.11 0.11 116.94 119.07 2wal h PHE 84 Ca 0.08 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.67 2wal h PHE 84 Cb 0.01 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.74 2wal h PHE 84 CO -0.09 -0.06 0.28 0.00 -2.23 0.00 0.00 178.31 176.22 2wal h GLU 87 N 0.12 0.00 -0.25 0.00 5.08 -0.47 -2.40 114.58 116.66 2wal h GLU 87 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2wal h GLU 87 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2wal h GLU 87 CO 0.00 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.10 2wal n ASN 88 N -4.45 3.68 -3.02 1.42 3.02 -0.00 -4.98 115.26 110.93 2wal n ASN 88 Ca -0.02 -2.92 -0.20 0.00 -0.03 0.00 0.00 54.58 51.41 2wal n ASN 88 Cb 0.12 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 2wal n ASN 88 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2wal n ASP 89 N -0.47 -4.40 -4.65 6.41 8.00 -0.07 -4.95 116.55 116.41 2wal n ASP 89 Ca 0.20 -0.21 -0.40 0.00 0.71 0.00 0.00 54.79 55.09 2wal n ASP 89 Cb 0.83 -3.64 -0.06 0.00 -0.02 0.00 0.00 41.12 38.22 2wal n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wal s ILE 90 N -2.91 5.03 0.33 0.53 1.01 0.56 -5.02 121.20 120.73 2wal s ILE 90 Ca 0.26 1.11 -0.29 0.00 0.00 0.00 0.00 60.65 61.74 2wal s ILE 90 Cb -0.13 -3.92 -0.11 0.00 0.01 0.00 0.00 42.46 38.31 2wal s ILE 90 CO 0.32 0.10 1.55 -1.81 0.00 0.00 0.00 174.94 175.10 2wal s ASP 91 N 1.27 6.35 -0.06 3.58 1.01 -1.26 -4.42 116.67 123.15 2wal s ASP 91 Ca 0.27 3.00 -0.03 0.00 0.71 0.00 0.00 52.55 56.50 2wal s ASP 91 Cb -0.16 -2.65 0.04 0.00 1.01 0.00 0.00 42.92 41.16 2wal s ASP 91 CO 0.10 -0.90 0.14 -0.51 0.21 0.00 0.00 175.17 174.20 2wal s ILE 92 N -0.52 -0.06 0.19 0.77 2.07 -1.26 -0.99 121.20 121.40 2wal s ILE 92 Ca 0.58 0.20 0.09 0.00 -1.41 0.00 0.00 60.65 60.11 2wal s ILE 92 Cb -0.47 -0.23 -0.04 0.00 0.13 0.00 0.00 42.46 41.84 2wal s ILE 92 CO 0.55 0.08 -0.18 0.68 -1.91 0.00 0.00 174.94 174.16 2wal s VAL 93 N 1.24 1.90 0.09 4.00 -7.23 -0.70 -4.44 120.40 115.27 2wal s VAL 93 Ca -0.08 -2.04 0.03 0.00 -1.81 0.00 0.00 61.98 58.07 2wal s VAL 93 Cb -0.12 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 2wal s VAL 93 CO -0.06 -0.38 0.13 -0.13 -0.31 0.00 0.00 175.10 174.35 2wal s ARG 94 N -3.05 3.03 -0.04 4.82 0.52 -0.03 -1.37 118.95 122.83 2wal s ARG 94 Ca 0.19 -0.66 -0.05 0.00 -0.52 0.00 0.00 55.73 54.69 2wal s ARG 94 Cb -0.05 -2.79 0.01 0.00 0.52 0.00 0.00 34.95 32.64 2wal s ARG 94 CO 0.08 0.56 0.12 0.08 0.02 0.00 0.00 175.30 176.16 2wal s VAL 95 N -1.49 0.01 -0.91 3.52 1.01 -0.22 -1.30 120.40 121.02 2wal s VAL 95 Ca 0.31 -0.12 0.14 0.00 0.00 0.00 0.00 61.98 62.31 2wal s VAL 95 Cb -0.12 -0.22 0.45 0.00 0.00 0.00 0.00 36.38 36.49 2wal s VAL 95 CO 0.24 -0.07 1.37 0.61 0.00 0.00 0.00 175.10 177.26 2wal n GLY 96 N 2.77 2.99 2.82 4.51 0.00 -1.26 -2.07 105.19 114.95 2wal n GLY 96 Ca -0.14 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 2wal n GLY 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wal s ASP 97 N -1.17 4.23 0.07 1.61 -1.08 -1.26 -4.31 116.67 114.76 2wal s ASP 97 Ca 0.34 -1.89 -0.18 0.00 -0.52 0.00 0.00 52.55 50.29 2wal s ASP 97 Cb 0.21 -1.12 -0.11 0.00 -1.46 0.00 0.00 42.92 40.44 2wal s ASP 97 CO 0.17 -0.39 1.42 0.58 0.52 0.00 0.00 175.17 177.48 2wal h VAL 98 N 6.42 1.31 -0.52 1.11 2.07 -1.87 -2.94 116.25 121.82 2wal h VAL 98 Ca -0.10 -1.21 0.04 0.00 0.82 0.00 0.00 66.70 66.25 2wal h VAL 98 Cb 1.01 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 32.36 2wal h VAL 98 CO 0.49 0.37 0.28 1.56 0.02 0.00 0.00 177.57 180.29 2wal h GLN 99 N 0.18 0.53 -0.45 1.57 7.50 -1.92 -1.62 115.11 120.90 2wal h GLN 99 Ca 0.05 -0.03 -0.07 0.00 0.50 0.00 0.00 58.65 59.10 2wal h GLN 99 Cb 0.63 -0.12 -0.02 0.00 0.05 0.00 0.00 27.48 28.02 2wal h GLN 99 CO 0.04 0.35 -0.01 -0.09 -1.50 0.00 0.00 178.83 177.61 2wal h ARG 100 N 0.54 0.74 -0.71 1.46 9.65 -1.90 -0.26 114.38 123.90 2wal h ARG 100 Ca 0.23 -0.19 -0.02 0.00 -1.10 0.00 0.00 59.98 58.89 2wal h ARG 100 Cb 0.11 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.57 2wal h ARG 100 CO -0.14 0.76 0.36 1.25 2.80 0.00 0.00 179.97 185.00 2wal h LEU 101 N 0.69 0.92 -0.23 3.80 5.85 -1.21 -1.75 115.31 123.37 2wal h LEU 101 Ca 0.14 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 2wal h LEU 101 Cb 0.44 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2wal h LEU 101 CO 0.02 0.77 -0.08 0.00 -0.34 0.00 0.00 178.44 178.81 2wal h ALA 102 N 1.18 0.33 -0.54 1.25 0.00 -0.62 -2.22 119.26 118.64 2wal h ALA 102 Ca 0.25 -0.28 0.11 0.00 0.00 0.00 0.00 54.91 54.99 2wal h ALA 102 Cb 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 2wal h ALA 102 CO -0.03 0.14 0.02 0.00 0.00 0.00 0.00 179.25 179.37 2wal h ALA 103 N 0.74 0.54 -0.38 0.00 0.00 -0.86 -2.60 119.26 116.69 2wal h ALA 103 Ca 0.06 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2wal h ALA 103 Cb 0.56 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2wal h ALA 103 CO 0.03 -0.38 0.20 0.82 0.00 0.00 0.00 179.25 179.92 2wal h ILE 104 N 0.13 1.15 -2.24 0.00 2.04 -1.16 -3.42 117.51 114.01 2wal h ILE 104 Ca 0.28 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2wal h ILE 104 Cb 0.43 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 2wal h ILE 104 CO -0.44 0.16 0.00 1.33 0.00 0.00 0.00 178.15 179.19 2wal n VAL 105 N -4.74 0.00 -1.44 1.67 0.24 -0.85 -4.80 118.33 108.41 2wal n VAL 105 Ca -0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.95 2wal n VAL 105 Cb 0.08 -1.76 0.09 0.00 -1.47 0.00 0.00 33.84 30.79 2wal n VAL 105 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2wal s GLY 106 N -2.33 2.36 -1.15 7.63 0.00 -1.26 -4.00 107.32 108.57 2wal s GLY 106 Ca 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 44.72 45.59 2wal s GLY 106 CO 0.00 1.30 0.97 0.00 0.00 0.00 0.00 173.10 175.36 2wal n ALA 107 N -2.71 -2.18 -3.12 3.20 0.00 -1.26 -4.83 120.51 109.62 2wal n ALA 107 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2wal n ALA 107 Cb 0.50 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.38 2wal n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wal n GLY 108 N -1.18 6.71 2.83 0.00 0.00 -1.25 -4.74 105.19 107.57 2wal n GLY 108 Ca -0.21 -2.06 -0.00 0.00 0.00 0.00 0.00 46.02 43.74 2wal n GLY 108 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wal n GLU 109 N -0.02 -2.80 -0.78 1.61 -0.58 -1.26 -4.71 120.64 112.11 2wal n GLU 109 Ca 0.00 2.35 0.10 0.00 -0.42 0.00 0.00 57.16 59.19 2wal n GLU 109 Cb 0.00 -4.30 -0.03 0.00 -0.57 0.00 0.00 31.44 26.54 2wal n GLU 109 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2wal n GLU 110 N 0.93 -1.64 0.00 3.49 -0.58 -1.26 -5.04 120.64 116.54 2wal n GLU 110 Ca -0.02 1.17 0.00 0.00 -0.42 0.00 0.00 57.16 57.89 2wal n GLU 110 Cb 0.15 -1.97 0.00 0.00 -0.57 0.00 0.00 31.44 29.05 2wal n GLU 110 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wal n ALA 111 N -2.46 0.00 -2.22 0.62 0.00 -1.26 -4.84 120.51 110.34 2wal n ALA 111 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 2wal n ALA 111 Cb 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.78 2wal n ALA 111 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wal s GLY 112 N 0.00 0.98 -0.07 0.00 0.00 -1.26 -3.87 107.32 103.10 2wal s GLY 112 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 44.72 44.68 2wal s GLY 112 CO 0.00 2.95 0.04 0.00 0.00 0.00 0.00 173.10 176.09 2wal n ALA 113 N 9.36 -3.18 -0.29 3.20 0.00 -1.26 -4.93 120.51 123.41 2wal n ALA 113 Ca 0.19 0.45 -0.11 0.00 0.00 0.00 0.00 53.44 53.96 2wal n ALA 113 Cb 0.48 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 2wal n ALA 113 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2wal n PRO 114 N 0.36 0.00 -1.91 0.00 -0.02 -1.25 -4.81 135.00 127.36 2wal n PRO 114 Ca -0.07 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.06 2wal n PRO 114 Cb 0.10 -0.28 -0.03 0.00 -0.02 0.00 0.00 33.50 33.26 2wal n PRO 114 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2wal s GLY 115 N 0.06 0.00 -0.34 -1.23 0.00 -1.26 -4.89 107.32 99.65 2wal s GLY 115 Ca 0.18 -0.58 -0.00 0.00 0.00 0.00 0.00 44.72 44.31 2wal s GLY 115 CO 0.11 3.63 0.21 0.99 0.00 0.00 0.00 173.10 178.04 2wal s ASP 116 N 9.20 2.97 -0.17 1.64 1.11 -1.26 -4.34 116.67 125.83 2wal s ASP 116 Ca 0.76 -2.08 -0.06 0.00 0.18 0.00 0.00 52.55 51.35 2wal s ASP 116 Cb -0.13 -0.36 -0.03 0.00 1.07 0.00 0.00 42.92 43.46 2wal s ASP 116 CO 0.19 -0.32 0.01 -1.48 1.18 0.00 0.00 175.17 174.76 2wal s LEU 117 N 1.18 3.54 0.00 1.23 0.05 -1.26 -4.99 118.68 118.44 2wal s LEU 117 Ca 0.17 -0.02 0.16 0.00 0.05 0.00 0.00 54.13 54.49 2wal s LEU 117 Cb -0.22 -1.88 -0.17 0.00 -2.05 0.00 0.00 46.19 41.87 2wal s LEU 117 CO -0.03 0.17 0.68 1.41 -0.55 0.00 0.00 176.35 178.04 2wal n HIS 118 N 3.53 0.00 -3.74 3.48 8.25 -1.26 -4.69 115.22 120.79 2wal n HIS 118 Ca -0.17 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.17 2wal n HIS 118 Cb 0.52 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.51 2wal n HIS 118 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wal s ILE 120 N 0.87 1.42 -0.07 0.00 -1.09 -0.33 0.13 121.20 122.13 2wal s ILE 120 Ca -0.06 -0.70 0.00 0.00 -2.23 0.00 0.00 60.65 57.66 2wal s ILE 120 Cb -0.07 -1.22 -0.03 0.00 -1.58 0.00 0.00 42.46 39.56 2wal s ILE 120 CO -0.06 0.41 -0.06 -0.76 -1.23 0.00 0.00 174.94 173.24 2wal s LEU 121 N 0.09 3.24 -0.20 2.97 1.43 -0.12 -0.46 118.68 125.63 2wal s LEU 121 Ca -0.05 0.00 -0.03 0.00 -1.03 0.00 0.00 54.13 53.03 2wal s LEU 121 Cb -0.12 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.38 2wal s LEU 121 CO 0.02 0.36 -0.08 -0.63 0.23 0.00 0.00 176.35 176.26 2wal s ILE 122 N -0.81 3.16 0.23 -0.59 1.01 0.75 -0.74 121.20 124.22 2wal s ILE 122 Ca 0.12 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.27 2wal s ILE 122 Cb -0.11 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 2wal s ILE 122 CO 0.02 0.46 0.09 -0.44 0.00 0.00 0.00 174.94 175.07 2wal s SER 123 N 1.24 5.09 0.17 3.58 0.01 -0.22 0.51 113.70 124.08 2wal s SER 123 Ca 0.03 -0.39 -0.31 0.00 1.31 0.00 0.00 55.95 56.59 2wal s SER 123 Cb -0.14 -1.17 -0.10 0.00 0.21 0.00 0.00 66.02 64.82 2wal s SER 123 CO -0.03 0.01 1.54 0.20 0.41 0.00 0.00 173.24 175.37 2wal s ASN 124 N -3.57 6.61 0.13 2.44 0.01 -0.25 -4.81 114.94 115.49 2wal s ASN 124 Ca 0.31 2.61 -0.03 0.00 -0.71 0.00 0.00 52.86 55.05 2wal s ASN 124 Cb -0.08 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 38.88 2wal s ASN 124 CO 0.22 -0.80 1.29 1.55 -1.51 0.00 0.00 177.10 177.86 2wal h PRO 125 N 6.56 0.34 -0.59 -0.60 0.13 -1.92 -3.48 132.00 132.43 2wal h PRO 125 Ca -0.43 -0.39 0.00 0.00 -0.87 0.00 0.00 66.00 64.31 2wal h PRO 125 Cb 1.21 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2wal h PRO 125 CO 0.89 1.09 0.00 0.09 -0.23 0.00 0.00 178.00 179.84 2wal n ASN 126 N -3.69 0.00 -1.33 1.44 3.02 -1.26 -4.83 115.26 108.61 2wal n ASN 126 Ca -0.06 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.61 2wal n ASN 126 Cb 0.86 0.00 0.31 0.00 -0.61 0.00 0.00 39.78 40.34 2wal n ASN 126 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2wal n GLU 127 N 0.06 2.71 -2.34 3.52 2.13 -1.26 -4.73 120.64 120.73 2wal n GLU 127 Ca 0.00 -2.63 -0.09 0.00 0.66 0.00 0.00 57.16 55.11 2wal n GLU 127 Cb 0.00 -1.56 0.00 0.00 0.27 0.00 0.00 31.44 30.15 2wal n GLU 127 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2wal n ASP 128 N 1.62 -3.16 -2.76 4.31 8.00 -1.26 -5.06 116.55 118.24 2wal n ASP 128 Ca 0.24 -0.06 -0.09 0.00 0.71 0.00 0.00 54.79 55.59 2wal n ASP 128 Cb 0.62 -2.29 0.05 0.00 -0.02 0.00 0.00 41.12 39.48 2wal n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wal n ALA 129 N -1.89 -0.22 -2.18 2.24 0.00 -1.26 -5.01 120.51 112.19 2wal n ALA 129 Ca -0.08 -0.63 -0.42 0.00 0.00 0.00 0.00 53.44 52.32 2wal n ALA 129 Cb 0.56 0.04 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 2wal n ALA 129 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2wal s TRP 130 N -1.42 3.27 -0.89 0.00 -0.00 -1.26 -4.96 118.94 113.68 2wal s TRP 130 Ca 0.24 1.03 -0.16 0.00 -0.00 0.00 0.00 56.10 57.21 2wal s TRP 130 Cb -0.01 -3.64 0.18 0.00 -0.00 0.00 0.00 33.47 30.00 2wal s TRP 130 CO 0.16 -2.18 0.95 0.21 -0.00 0.00 0.00 176.95 176.09 2wal s LYS 131 N 0.94 3.63 0.02 5.86 2.36 -1.26 -4.88 119.74 126.41 2wal s LYS 131 Ca 0.63 -2.18 -0.33 0.00 -2.55 0.00 0.00 55.97 51.54 2wal s LYS 131 Cb -0.36 -4.66 -0.12 0.00 -1.05 0.00 0.00 37.83 31.64 2wal s LYS 131 CO 0.31 -1.51 1.80 -3.47 1.55 0.00 0.00 175.35 174.03 2wal n ASP 132 N 5.10 3.47 0.28 1.43 -0.08 -1.26 -4.86 116.55 120.64 2wal n ASP 132 Ca 0.19 1.00 0.17 0.00 -1.51 0.00 0.00 54.79 54.64 2wal n ASP 132 Cb 0.48 -1.42 0.73 0.00 2.34 0.00 0.00 41.12 43.25 2wal n ASP 132 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2wal h PRO 133 N 8.31 0.00 -0.95 -0.67 0.11 -2.01 -2.57 132.00 134.22 2wal h PRO 133 Ca -0.47 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.78 2wal h PRO 133 Cb 1.26 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 2wal h PRO 133 CO 0.93 0.04 0.60 0.00 -0.21 0.00 0.00 178.00 179.36 2wal h ALA 134 N 1.96 1.71 -0.67 -0.75 0.00 -1.89 -0.78 119.26 118.85 2wal h ALA 134 Ca -0.00 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2wal h ALA 134 Cb 0.46 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2wal h ALA 134 CO 0.01 0.02 0.44 1.25 0.00 0.00 0.00 179.25 180.96 2wal h LEU 135 N 0.80 0.75 -0.08 0.00 6.46 -1.78 -1.56 115.31 119.90 2wal h LEU 135 Ca 0.49 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 58.22 2wal h LEU 135 Cb 0.69 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 40.44 2wal h LEU 135 CO -0.26 0.53 -0.00 -0.08 -0.62 0.00 0.00 178.44 178.02 2wal h GLU 136 N 0.88 0.14 -0.69 1.25 4.81 -1.37 -0.59 114.58 119.01 2wal h GLU 136 Ca 0.25 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.53 2wal h GLU 136 Cb -0.07 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.23 2wal h GLU 136 CO -0.07 0.41 0.34 -0.22 -0.73 0.00 0.00 179.01 178.74 2wal h LYS 137 N -0.15 0.56 -0.27 1.92 1.63 -1.04 -0.22 116.57 119.01 2wal h LYS 137 Ca 0.02 -0.03 -0.11 0.00 -0.85 0.00 0.00 60.65 59.67 2wal h LYS 137 Cb 0.34 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 2wal h LYS 137 CO 0.00 0.37 -0.31 -0.07 -3.45 0.00 0.00 179.45 176.00 2wal h LEU 138 N 0.58 0.58 -0.53 5.20 3.38 -1.02 0.11 115.31 123.61 2wal h LEU 138 Ca 0.34 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2wal h LEU 138 Cb 0.36 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2wal h LEU 138 CO -0.27 0.85 0.21 -1.28 0.09 0.00 0.00 178.44 178.05 2wal h SER 139 N 0.48 0.73 -0.38 -0.43 0.87 -0.50 -1.03 113.55 113.29 2wal h SER 139 Ca 0.06 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2wal h SER 139 Cb 0.77 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.53 2wal h SER 139 CO 0.06 0.70 0.22 0.25 -0.53 0.00 0.00 176.83 177.54 2wal h LEU 140 N 0.72 0.46 -0.32 2.23 5.85 -0.65 -0.53 115.31 123.07 2wal h LEU 140 Ca 0.18 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.90 2wal h LEU 140 Cb 0.20 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 2wal h LEU 140 CO -0.01 0.39 -0.13 0.15 -0.34 0.00 0.00 178.44 178.50 2wal h PHE 141 N 0.50 -0.31 -0.36 1.25 3.57 -0.49 0.32 116.94 121.42 2wal h PHE 141 Ca 0.14 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2wal h PHE 141 Cb 0.02 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 2wal h PHE 141 CO -0.03 -0.20 0.01 0.00 -2.23 0.00 0.00 178.31 175.86 2wal h GLU 143 N 0.54 0.58 -0.34 0.00 5.08 -0.25 -1.88 114.58 118.30 2wal h GLU 143 Ca 0.12 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2wal h GLU 143 Cb 0.33 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2wal h GLU 143 CO 0.01 0.50 0.23 0.93 -1.00 0.00 0.00 179.01 179.68 2wal h GLU 144 N 0.51 0.38 0.05 2.33 5.08 0.37 -1.84 114.58 121.46 2wal h GLU 144 Ca 0.14 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2wal h GLU 144 Cb 0.11 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2wal h GLU 144 CO -0.02 0.25 -0.02 0.77 -1.00 0.00 0.00 179.01 178.99 2wal h SER 145 N 0.39 -0.06 -0.96 1.42 0.02 -0.91 -3.17 113.55 110.28 2wal h SER 145 Ca 0.13 -0.54 0.21 0.00 -0.84 0.00 0.00 61.79 60.75 2wal h SER 145 Cb 0.05 0.01 -0.11 0.00 0.14 0.00 0.00 62.40 62.49 2wal h SER 145 CO -0.03 0.54 0.54 0.03 -1.14 0.00 0.00 176.83 176.77 2wal h ARG 146 N -0.70 0.59 0.00 3.45 3.08 -1.12 -0.52 114.38 119.16 2wal h ARG 146 Ca -0.01 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2wal h ARG 146 Cb 0.60 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2wal h ARG 146 CO 0.01 0.39 0.00 -1.13 -1.07 0.00 0.00 179.97 178.17 2wal n SER 147 N -4.88 0.00 -0.05 7.04 3.41 -0.71 -1.10 113.62 117.33 2wal n SER 147 Ca 0.23 0.17 0.05 0.00 -0.26 0.00 0.00 58.87 59.06 2wal n SER 147 Cb 0.63 -0.35 0.07 0.00 -0.26 0.00 0.00 64.21 64.30 2wal n SER 147 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2wal n VAL 148 N -1.35 1.36 -2.17 -3.33 0.31 -0.31 -4.99 118.33 107.85 2wal n VAL 148 Ca 0.07 -1.55 -0.17 0.00 -0.01 0.00 0.00 64.34 62.68 2wal n VAL 148 Cb 0.15 0.15 -0.02 0.00 -0.91 0.00 0.00 33.84 33.22 2wal n VAL 148 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2wal n ASN 149 N -0.92 -5.08 -4.30 4.52 3.02 -0.26 -4.98 115.26 107.26 2wal n ASN 149 Ca 0.08 0.07 -0.46 0.00 -0.03 0.00 0.00 54.58 54.24 2wal n ASN 149 Cb 0.47 -4.15 -0.04 0.00 -0.61 0.00 0.00 39.78 35.44 2wal n ASN 149 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2wal s ASP 150 N -2.33 6.41 0.08 6.41 -1.08 -0.56 -4.93 116.67 120.68 2wal s ASP 150 Ca 0.00 -2.32 -0.05 0.00 -0.52 0.00 0.00 52.55 49.66 2wal s ASP 150 Cb 0.00 -2.18 -0.25 0.00 -1.46 0.00 0.00 42.92 39.03 2wal s ASP 150 CO 0.00 -0.68 1.17 -0.50 0.52 0.00 0.00 175.17 175.68 2wal h TRP 151 N 8.19 0.53 -3.08 -5.34 4.06 -1.91 -3.25 115.95 115.15 2wal h TRP 151 Ca -0.07 -0.37 -0.74 0.00 2.06 0.00 0.00 58.89 59.77 2wal h TRP 151 Cb 1.06 -0.03 -0.33 0.00 -1.00 0.00 0.00 29.16 28.87 2wal h TRP 151 CO 0.88 1.27 0.22 1.55 -3.56 0.00 0.00 178.44 178.80 2wal n VAL 152 N -3.58 3.96 -2.28 1.49 3.14 -1.26 -4.93 118.33 114.87 2wal n VAL 152 Ca -0.08 -5.44 -0.38 0.00 -2.96 0.00 0.00 64.34 55.47 2wal n VAL 152 Cb 0.99 -2.29 -0.02 0.00 -1.06 0.00 0.00 33.84 31.46 2wal n VAL 152 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2wal s PRO 153 N -1.96 4.06 0.11 1.45 0.04 -1.26 -4.78 135.00 132.66 2wal s PRO 153 Ca 0.31 1.85 0.06 0.00 0.04 0.00 0.00 61.00 63.27 2wal s PRO 153 Cb -0.01 -2.68 -0.04 0.00 0.04 0.00 0.00 34.50 31.81 2wal s PRO 153 CO -0.03 -0.32 -0.05 -1.54 0.04 0.00 0.00 177.00 175.09 2wal s SER 154 N -1.11 4.66 -0.08 6.66 1.04 -1.26 -0.85 113.70 122.76 2wal s SER 154 Ca 0.57 -0.31 0.05 0.00 0.48 0.00 0.00 55.95 56.73 2wal s SER 154 Cb -0.31 -0.98 -0.00 0.00 0.10 0.00 0.00 66.02 64.82 2wal s SER 154 CO 0.39 0.17 -0.23 -0.63 0.98 0.00 0.00 173.24 173.91 2wal s ILE 155 N -1.30 1.98 0.21 -1.02 1.01 -0.42 -4.92 121.20 116.74 2wal s ILE 155 Ca 0.24 -1.00 0.02 0.00 0.00 0.00 0.00 60.65 59.91 2wal s ILE 155 Cb -0.11 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 2wal s ILE 155 CO 0.16 0.55 0.37 -0.89 0.00 0.00 0.00 174.94 175.12 2wal s THR 156 N 0.12 5.25 0.03 2.92 2.01 -1.26 -4.51 115.64 120.20 2wal s THR 156 Ca -0.11 -0.61 -0.30 0.00 0.31 0.00 0.00 61.69 60.97 2wal s THR 156 Cb -0.16 -3.78 -0.07 0.00 0.01 0.00 0.00 72.50 68.51 2wal s THR 156 CO 0.06 -0.22 1.54 -0.76 -0.69 0.00 0.00 174.62 174.56 2wal s LEU 157 N -3.53 4.34 0.18 4.42 1.43 -1.26 -4.58 118.68 119.68 2wal s LEU 157 Ca 0.36 2.31 -0.11 0.00 -1.03 0.00 0.00 54.13 55.67 2wal s LEU 157 Cb -0.10 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.65 2wal s LEU 157 CO 0.30 -0.82 1.74 1.55 0.23 0.00 0.00 176.35 179.35 2wal h PRO 158 N 8.16 0.96 0.00 1.29 0.13 -1.89 -3.51 132.00 137.14 2wal h PRO 158 Ca -0.40 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 2wal h PRO 158 Cb 1.19 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2wal h PRO 158 CO 0.92 0.81 0.00 -1.91 -0.23 0.00 0.00 178.00 177.59