#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nwh s LYS 2 N 0.00 4.12 -0.40 3.17 -0.14 -1.26 -4.81 119.74 120.42 1nwh s LYS 2 Ca 0.00 1.13 -0.16 0.00 -1.36 0.00 0.00 55.97 55.58 1nwh s LYS 2 Cb 0.00 -2.16 0.01 0.00 -1.68 0.00 0.00 37.83 34.00 1nwh s LYS 2 CO 0.00 -0.13 0.37 -0.80 -0.76 0.00 0.00 175.35 174.03 1nwh s ASN 3 N -2.30 6.16 -0.15 2.83 0.01 -1.26 -0.86 114.94 119.37 1nwh s ASN 3 Ca 0.62 -0.63 -0.01 0.00 -0.71 0.00 0.00 52.86 52.14 1nwh s ASN 3 Cb -0.10 -2.19 -0.01 0.00 0.41 0.00 0.00 41.25 39.35 1nwh s ASN 3 CO 0.17 -0.47 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.48 1nwh s VAL 4 N 1.96 3.04 -0.10 1.60 1.01 -0.23 -1.24 120.40 126.42 1nwh s VAL 4 Ca 0.10 -0.65 -0.13 0.00 0.00 0.00 0.00 61.98 61.30 1nwh s VAL 4 Cb -0.17 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 1nwh s VAL 4 CO 0.12 0.51 0.29 -0.83 0.00 0.00 0.00 175.10 175.19 1nwh s GLY 5 N 0.58 2.28 -0.20 4.51 0.00 -0.38 -0.77 107.32 113.34 1nwh s GLY 5 Ca -0.08 -0.42 0.01 0.00 0.00 0.00 0.00 44.72 44.23 1nwh s GLY 5 CO 0.03 0.17 -0.18 -1.36 0.00 0.00 0.00 173.10 171.77 1nwh s PHE 6 N -0.33 2.87 -0.03 1.90 0.40 -0.57 0.12 117.98 122.33 1nwh s PHE 6 Ca 0.18 -1.71 0.07 0.00 -0.60 0.00 0.00 56.93 54.87 1nwh s PHE 6 Cb -0.14 -1.93 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 1nwh s PHE 6 CO 0.07 -0.81 -0.25 0.42 0.70 0.00 0.00 175.22 175.35 1nwh s ILE 7 N 1.27 2.10 -0.67 0.64 1.09 -0.52 -1.39 121.20 123.72 1nwh s ILE 7 Ca 0.03 -1.08 0.00 0.00 -1.10 0.00 0.00 60.65 58.50 1nwh s ILE 7 Cb -0.14 -1.74 0.00 0.00 -1.06 0.00 0.00 42.46 39.52 1nwh s ILE 7 CO -0.11 0.58 0.00 0.61 -0.10 0.00 0.00 174.94 175.92 1nwh n GLY 8 N 2.59 0.14 0.17 6.18 0.00 -1.26 -1.30 105.19 111.71 1nwh n GLY 8 Ca -0.16 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.41 1nwh n GLY 8 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1nwh h TRP 9 N 0.00 0.00 0.00 1.61 5.08 -1.87 -3.18 115.95 117.60 1nwh h TRP 9 Ca -0.18 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.77 1nwh h TRP 9 Cb 1.08 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.23 1nwh h TRP 9 CO 0.21 0.00 -0.68 0.00 -1.28 0.00 0.00 178.44 176.69 1nwh h ARG 10 N 0.00 0.00 0.00 0.12 2.47 -1.91 -2.85 114.38 112.21 1nwh h ARG 10 Ca 0.00 0.00 -0.31 0.00 -1.26 0.00 0.00 59.98 58.41 1nwh h ARG 10 Cb 0.62 0.00 0.15 0.00 -1.65 0.00 0.00 29.97 29.09 1nwh h ARG 10 CO 0.00 0.05 0.12 0.41 0.56 0.00 0.00 179.97 181.11 1nwh n GLY 11 N 1.17 -2.53 0.11 0.04 0.00 -1.20 -4.67 105.19 98.12 1nwh n GLY 11 Ca 0.01 -1.51 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 1nwh n GLY 11 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1nwh h MET 12 N 0.00 -0.18 -0.44 1.61 4.05 -1.92 0.34 114.93 118.39 1nwh h MET 12 Ca -0.32 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.06 1nwh h MET 12 Cb 0.95 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.78 1nwh h MET 12 CO 0.21 0.02 0.06 0.28 0.23 0.00 0.00 176.91 177.71 1nwh h VAL 13 N -0.37 1.25 -0.95 -5.77 2.07 -1.90 -2.70 116.25 107.89 1nwh h VAL 13 Ca -0.02 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1nwh h VAL 13 Cb 0.29 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 1nwh h VAL 13 CO 0.03 0.32 0.57 1.23 0.02 0.00 0.00 177.57 179.74 1nwh h GLY 14 N 0.59 1.38 1.59 2.17 0.00 -1.65 -1.78 103.07 105.37 1nwh h GLY 14 Ca 0.13 -0.58 -0.09 0.00 0.00 0.00 0.00 47.33 46.79 1nwh h GLY 14 CO 0.01 0.56 -0.21 1.76 0.00 0.00 0.00 176.54 178.66 1nwh h SER 15 N 1.31 0.48 0.06 0.19 0.02 -0.67 -0.01 113.55 114.94 1nwh h SER 15 Ca 0.34 -0.15 -0.14 0.00 -0.84 0.00 0.00 61.79 61.00 1nwh h SER 15 Cb -0.05 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1nwh h SER 15 CO -0.06 0.70 -0.48 0.58 -1.14 0.00 0.00 176.83 176.42 1nwh h VAL 16 N 0.43 1.32 -0.27 2.27 2.07 -1.12 -1.13 116.25 119.83 1nwh h VAL 16 Ca 0.07 -1.70 -0.07 0.00 0.82 0.00 0.00 66.70 65.82 1nwh h VAL 16 Cb 0.61 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1nwh h VAL 16 CO 0.04 0.52 -0.09 0.25 0.02 0.00 0.00 177.57 178.32 1nwh h LEU 17 N 0.39 0.55 -0.68 2.57 5.85 -0.80 -1.03 115.31 122.16 1nwh h LEU 17 Ca 0.02 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 1nwh h LEU 17 Cb 0.99 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.84 1nwh h LEU 17 CO 0.09 0.81 0.29 0.24 -0.34 0.00 0.00 178.44 179.53 1nwh h MET 18 N 0.29 1.00 -0.44 1.25 2.86 -0.90 -0.11 114.93 118.88 1nwh h MET 18 Ca 0.07 -0.17 -0.06 0.00 -2.06 0.00 0.00 59.70 57.48 1nwh h MET 18 Cb 0.58 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1nwh h MET 18 CO 0.03 0.81 0.05 -0.44 1.06 0.00 0.00 176.91 178.43 1nwh h ASP 19 N 0.95 0.71 -0.45 1.22 3.32 -1.10 -1.80 116.42 119.27 1nwh h ASP 19 Ca 0.23 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 56.89 1nwh h ASP 19 Cb 0.17 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1nwh h ASP 19 CO -0.02 0.80 -0.16 0.03 -1.72 0.00 0.00 179.24 178.17 1nwh h ARG 20 N 0.59 0.89 -0.33 3.56 2.47 -0.97 -2.02 114.38 118.57 1nwh h ARG 20 Ca 0.13 -0.37 -0.09 0.00 -1.26 0.00 0.00 59.98 58.40 1nwh h ARG 20 Cb 0.41 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.67 1nwh h ARG 20 CO 0.01 1.01 -0.16 0.52 0.56 0.00 0.00 179.97 181.92 1nwh h MET 21 N 0.73 0.58 -0.16 0.04 2.86 -0.98 -2.02 114.93 115.98 1nwh h MET 21 Ca 0.11 -0.19 -0.14 0.00 -2.06 0.00 0.00 59.70 57.41 1nwh h MET 21 Cb 0.72 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1nwh h MET 21 CO 0.05 0.72 -0.50 0.77 1.06 0.00 0.00 176.91 179.02 1nwh h SER 22 N 0.53 0.49 -0.22 1.22 0.02 -1.18 -0.02 113.55 114.39 1nwh h SER 22 Ca 0.09 -0.24 -0.11 0.00 -0.84 0.00 0.00 61.79 60.69 1nwh h SER 22 Cb 0.58 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1nwh h SER 22 CO 0.04 0.91 -0.24 1.56 -1.14 0.00 0.00 176.83 177.95 1nwh h GLN 23 N 0.35 0.69 -0.09 3.45 4.20 -0.98 -3.01 115.11 119.72 1nwh h GLN 23 Ca 0.02 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1nwh h GLN 23 Cb 1.00 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.75 1nwh h GLN 23 CO 0.09 0.87 0.00 0.39 -0.67 0.00 0.00 178.83 179.51 1nwh n GLU 24 N -4.11 2.12 -3.70 1.46 -0.58 -0.79 -4.97 120.64 110.07 1nwh n GLU 24 Ca -0.00 -1.65 -0.23 0.00 -0.42 0.00 0.00 57.16 54.86 1nwh n GLU 24 Cb 0.43 -1.47 0.05 0.00 -0.57 0.00 0.00 31.44 29.88 1nwh n GLU 24 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1nwh n ASN 25 N 0.96 -3.04 0.24 1.62 4.13 -0.53 -4.90 115.26 113.74 1nwh n ASN 25 Ca 0.16 -0.74 0.15 0.00 1.68 0.00 0.00 54.58 55.83 1nwh n ASN 25 Cb 0.51 -4.32 0.44 0.00 -1.54 0.00 0.00 39.78 34.87 1nwh n ASN 25 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 1nwh h ASP 26 N -2.06 0.00 1.18 6.41 3.32 -1.34 -3.23 116.42 120.70 1nwh h ASP 26 Ca -0.59 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.45 1nwh h ASP 26 Cb 1.36 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.91 1nwh h ASP 26 CO 0.58 0.00 -0.04 -0.26 -1.72 0.00 0.00 179.24 177.80 1nwh h PHE 27 N 0.00 0.00 -0.00 4.55 -1.00 -1.90 -2.87 116.94 115.71 1nwh h PHE 27 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1nwh h PHE 27 Cb 0.73 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.29 1nwh h PHE 27 CO 0.00 0.04 -0.01 -0.85 -1.61 0.00 0.00 178.31 175.88 1nwh n GLU 28 N -3.14 0.10 0.00 1.51 0.28 -1.22 -3.24 120.64 114.93 1nwh n GLU 28 Ca 0.01 -0.00 0.11 0.00 -0.16 0.00 0.00 57.16 57.12 1nwh n GLU 28 Cb 0.37 -1.50 0.04 0.00 1.43 0.00 0.00 31.44 31.78 1nwh n GLU 28 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1nwh n ASN 29 N -1.45 2.16 -4.03 -1.84 5.03 -1.08 -4.99 115.26 109.05 1nwh n ASN 29 Ca 0.09 -1.58 -0.10 0.00 0.87 0.00 0.00 54.58 53.86 1nwh n ASN 29 Cb 0.32 0.37 -0.08 0.00 -1.02 0.00 0.00 39.78 39.37 1nwh n ASN 29 CO 0.00 0.00 0.00 -1.48 -1.83 0.00 0.00 177.26 173.95 1nwh s LEU 30 N -2.38 1.05 -0.47 3.41 0.05 -1.20 -4.54 118.68 114.59 1nwh s LEU 30 Ca 0.21 -1.00 -0.13 0.00 0.05 0.00 0.00 54.13 53.25 1nwh s LEU 30 Cb 0.19 1.00 0.09 0.00 -2.05 0.00 0.00 46.19 45.42 1nwh s LEU 30 CO 0.52 -0.89 0.38 0.20 -0.55 0.00 0.00 176.35 176.01 1nwh s ASN 31 N -3.01 5.98 -0.04 1.48 0.01 -0.04 -4.89 114.94 114.43 1nwh s ASN 31 Ca 0.22 -1.55 -0.27 0.00 -0.71 0.00 0.00 52.86 50.55 1nwh s ASN 31 Cb 0.04 -2.12 -0.03 0.00 0.41 0.00 0.00 41.25 39.55 1nwh s ASN 31 CO 0.03 -0.67 0.85 -2.16 -1.51 0.00 0.00 177.10 173.63 1nwh s PRO 32 N 1.54 4.49 -0.23 -0.60 0.04 -1.26 -1.07 135.00 137.91 1nwh s PRO 32 Ca 0.04 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.26 1nwh s PRO 32 Cb -0.26 -3.46 0.05 0.00 0.04 0.00 0.00 34.50 30.88 1nwh s PRO 32 CO 0.04 -0.01 -0.12 0.08 0.04 0.00 0.00 177.00 177.02 1nwh s VAL 33 N 0.96 2.04 -0.04 -0.36 1.01 0.05 -4.97 120.40 119.08 1nwh s VAL 33 Ca 0.45 -1.38 -0.19 0.00 0.00 0.00 0.00 61.98 60.85 1nwh s VAL 33 Cb -0.19 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 1nwh s VAL 33 CO 0.23 0.11 0.54 -0.36 0.00 0.00 0.00 175.10 175.62 1nwh s PHE 34 N 1.20 3.63 0.27 5.22 0.40 -1.26 -1.52 117.98 125.92 1nwh s PHE 34 Ca -0.05 1.08 0.09 0.00 -0.60 0.00 0.00 56.93 57.45 1nwh s PHE 34 Cb -0.18 -2.57 -0.04 0.00 0.51 0.00 0.00 43.02 40.74 1nwh s PHE 34 CO -0.07 0.31 0.05 -0.06 0.70 0.00 0.00 175.22 176.15 1nwh s PHE 35 N 0.02 2.77 0.01 0.36 0.40 -0.48 -2.94 117.98 118.11 1nwh s PHE 35 Ca 0.29 -0.22 -0.07 0.00 -0.60 0.00 0.00 56.93 56.33 1nwh s PHE 35 Cb -0.17 -1.29 -0.00 0.00 0.51 0.00 0.00 43.02 42.07 1nwh s PHE 35 CO 0.15 0.57 0.12 -0.08 0.70 0.00 0.00 175.22 176.67 1nwh s THR 36 N -2.31 0.09 -1.16 0.64 -1.32 -0.33 -4.63 115.64 106.63 1nwh s THR 36 Ca 0.32 -0.74 0.24 0.00 -1.21 0.00 0.00 61.69 60.30 1nwh s THR 36 Cb -0.06 -0.45 -0.01 0.00 -1.51 0.00 0.00 72.50 70.46 1nwh s THR 36 CO 0.21 -0.41 1.30 0.35 -2.21 0.00 0.00 174.62 173.86 1nwh n THR 37 N 1.40 0.00 -1.84 5.08 -2.24 -1.26 -1.13 114.28 114.28 1nwh n THR 37 Ca -0.23 -0.03 -0.33 0.00 -2.27 0.00 0.00 64.05 61.19 1nwh n THR 37 Cb 0.56 0.49 0.04 0.00 -2.10 0.00 0.00 70.33 69.31 1nwh n THR 37 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1nwh s SER 38 N -2.90 5.33 -0.90 3.42 0.15 -1.26 -4.94 113.70 112.59 1nwh s SER 38 Ca 0.13 1.93 -0.01 0.00 0.70 0.00 0.00 55.95 58.70 1nwh s SER 38 Cb 0.17 -2.54 0.24 0.00 -1.71 0.00 0.00 66.02 62.18 1nwh s SER 38 CO 0.71 -1.48 0.89 0.00 1.20 0.00 0.00 173.24 174.56 1nwh n GLN 39 N -2.31 2.92 -1.41 5.44 6.02 -1.26 -4.91 117.38 121.86 1nwh n GLN 39 Ca 0.10 -4.52 0.00 0.00 -0.01 0.00 0.00 57.00 52.57 1nwh n GLN 39 Cb 0.52 -2.41 0.00 0.00 1.02 0.00 0.00 30.24 29.37 1nwh n GLN 39 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1nwh n LEU 55 N 1.98 -4.65 -4.87 1.08 4.77 -1.26 -5.23 117.00 108.82 1nwh n LEU 55 Ca 0.24 2.08 -0.21 0.00 -0.03 0.00 0.00 56.01 58.08 1nwh n LEU 55 Cb 0.37 -2.17 -0.03 0.00 -2.33 0.00 0.00 43.42 39.26 1nwh n LEU 55 CO 0.42 -0.93 -0.06 -0.54 -1.33 0.00 0.00 177.39 174.96 1nwh s LYS 56 N -1.85 2.77 0.02 3.23 1.02 -1.15 -4.93 119.74 118.85 1nwh s LYS 56 Ca 0.00 -1.26 -0.30 0.00 0.02 0.00 0.00 55.97 54.42 1nwh s LYS 56 Cb 0.00 -2.52 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 1nwh s LYS 56 CO 0.00 0.08 1.04 0.45 -0.92 0.00 0.00 175.35 175.99 1nwh s SER 57 N -4.03 7.29 0.12 2.83 0.15 -1.26 -1.19 113.70 117.62 1nwh s SER 57 Ca 0.42 1.75 0.19 0.00 0.70 0.00 0.00 55.95 59.02 1nwh s SER 57 Cb -0.06 -2.57 0.81 0.00 -1.71 0.00 0.00 66.02 62.48 1nwh s SER 57 CO 0.27 -0.32 1.60 0.00 1.20 0.00 0.00 173.24 176.00 1nwh n ALA 58 N 3.91 1.71 0.97 5.45 0.00 -0.29 -2.48 120.51 129.78 1nwh n ALA 58 Ca 0.07 0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.63 1nwh n ALA 58 Cb 0.50 -1.32 0.05 0.00 0.00 0.00 0.00 19.45 18.68 1nwh n ALA 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1nwh n PHE 59 N -1.85 0.00 -2.75 0.00 3.72 -1.26 -4.85 117.46 110.47 1nwh n PHE 59 Ca 0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.01 1nwh n PHE 59 Cb 0.21 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 1nwh n PHE 59 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1nwh s ASP 60 N -2.16 6.18 0.42 4.37 3.68 -1.03 -4.89 116.67 123.24 1nwh s ASP 60 Ca 0.23 -0.84 0.14 0.00 2.13 0.00 0.00 52.55 54.20 1nwh s ASP 60 Cb 0.19 -2.47 0.91 0.00 -1.45 0.00 0.00 42.92 40.09 1nwh s ASP 60 CO 0.41 -1.57 1.94 0.40 0.13 0.00 0.00 175.17 176.48 1nwh h ILE 61 N 6.00 1.18 0.00 4.11 5.03 -1.88 -2.52 117.51 129.43 1nwh h ILE 61 Ca -0.27 -0.84 -0.04 0.00 -0.12 0.00 0.00 64.86 63.59 1nwh h ILE 61 Cb 1.06 1.45 -0.01 0.00 -3.03 0.00 0.00 36.82 36.29 1nwh h ILE 61 CO 1.22 0.24 -0.20 -0.33 -0.68 0.00 0.00 178.15 178.40 1nwh h GLU 62 N 0.00 0.00 0.15 2.37 4.39 -1.98 -0.73 114.58 118.78 1nwh h GLU 62 Ca -0.00 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.35 1nwh h GLU 62 Cb 0.43 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1nwh h GLU 62 CO 0.03 0.20 -1.84 0.93 -1.16 0.00 0.00 179.01 177.17 1nwh h GLU 63 N 0.00 0.31 -0.02 2.33 4.39 -1.84 -3.36 114.58 116.39 1nwh h GLU 63 Ca -0.00 -0.54 -0.06 0.00 0.34 0.00 0.00 59.36 59.10 1nwh h GLU 63 Cb 0.61 0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 1nwh h GLU 63 CO 0.03 1.23 -0.29 -0.07 -1.16 0.00 0.00 179.01 178.75 1nwh h LEU 64 N 0.09 0.04 -1.67 1.33 3.38 -1.23 -2.87 115.31 114.38 1nwh h LEU 64 Ca -0.37 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 1nwh h LEU 64 Cb 2.06 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.80 1nwh h LEU 64 CO 0.14 0.33 -0.13 0.50 0.09 0.00 0.00 178.44 179.36 1nwh h LYS 65 N 0.04 0.00 0.00 1.13 3.64 -1.28 -2.85 116.57 117.25 1nwh h LYS 65 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1nwh h LYS 65 Cb 0.53 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1nwh h LYS 65 CO 0.04 0.13 -0.20 0.87 -2.27 0.00 0.00 179.45 178.02 1nwh h LYS 66 N 0.00 0.00 -7.11 1.90 1.57 -1.66 -3.46 116.57 107.81 1nwh h LYS 66 Ca -0.00 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.30 1nwh h LYS 66 Cb 0.47 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.79 1nwh h LYS 66 CO 0.02 0.20 0.31 -0.51 -0.57 0.00 0.00 179.45 178.90 1nwh s LEU 67 N -6.53 3.67 -0.09 2.94 1.43 -1.08 -4.99 118.68 114.02 1nwh s LEU 67 Ca 0.02 1.46 -0.05 0.00 -1.03 0.00 0.00 54.13 54.53 1nwh s LEU 67 Cb 0.09 -4.38 -0.27 0.00 0.03 0.00 0.00 46.19 41.66 1nwh s LEU 67 CO 0.64 -0.54 0.48 0.44 0.23 0.00 0.00 176.35 177.60 1nwh h ASP 68 N 0.98 0.39 -4.32 2.29 3.32 -1.49 -3.44 116.42 114.15 1nwh h ASP 68 Ca -0.47 -0.81 -0.34 0.00 0.02 0.00 0.00 57.03 55.43 1nwh h ASP 68 Cb 1.19 -0.13 -0.25 0.00 0.22 0.00 0.00 39.33 40.36 1nwh h ASP 68 CO 0.62 1.72 -0.76 -0.63 -1.72 0.00 0.00 179.24 178.47 1nwh s ILE 69 N -2.57 0.65 -0.12 0.35 1.01 -1.07 -0.76 121.20 118.69 1nwh s ILE 69 Ca -0.18 -0.72 -0.00 0.00 0.00 0.00 0.00 60.65 59.74 1nwh s ILE 69 Cb 0.07 -0.62 0.02 0.00 0.01 0.00 0.00 42.46 41.94 1nwh s ILE 69 CO 0.79 -0.08 -0.10 -0.63 0.00 0.00 0.00 174.94 174.93 1nwh s ILE 70 N -0.74 1.21 -0.27 2.92 1.01 0.26 -1.25 121.20 124.34 1nwh s ILE 70 Ca -0.02 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.16 1nwh s ILE 70 Cb -0.06 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.23 1nwh s ILE 70 CO 0.00 0.40 0.04 -0.69 0.00 0.00 0.00 174.94 174.69 1nwh s VAL 71 N 1.57 3.76 -0.06 2.92 1.01 0.12 0.11 120.40 129.83 1nwh s VAL 71 Ca 0.04 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.41 1nwh s VAL 71 Cb -0.13 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1nwh s VAL 71 CO -0.08 0.19 -0.16 0.28 0.00 0.00 0.00 175.10 175.32 1nwh s THR 72 N 1.49 1.42 -0.10 3.92 -1.32 0.06 -1.44 115.64 119.67 1nwh s THR 72 Ca 0.03 -0.67 0.14 0.00 -1.21 0.00 0.00 61.69 59.98 1nwh s THR 72 Cb -0.16 -1.25 0.22 0.00 -1.51 0.00 0.00 72.50 69.79 1nwh s THR 72 CO 0.01 0.42 1.10 0.00 -2.21 0.00 0.00 174.62 173.94 1nwh h GLN 74 N 0.00 0.64 0.00 0.00 5.75 -1.78 -3.43 115.11 116.28 1nwh h GLN 74 Ca 0.00 -0.43 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 1nwh h GLN 74 Cb 0.98 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.59 1nwh h GLN 74 CO 0.00 1.05 0.00 0.41 -2.65 0.00 0.00 178.83 177.64 1nwh n GLY 75 N 0.39 3.08 0.32 2.39 0.00 -1.26 -4.87 105.19 105.23 1nwh n GLY 75 Ca -0.04 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.06 1nwh n GLY 75 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nwh h GLY 76 N 0.00 0.87 1.10 -0.02 0.00 -1.96 -2.80 103.07 100.26 1nwh h GLY 76 Ca 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1nwh h GLY 76 CO 0.00 0.37 0.43 -0.55 0.00 0.00 0.00 176.54 176.78 1nwh h ASP 77 N 0.82 1.05 -0.11 0.19 5.19 -1.99 -0.37 116.42 121.21 1nwh h ASP 77 Ca 0.21 -0.11 -0.06 0.00 -0.62 0.00 0.00 57.03 56.45 1nwh h ASP 77 Cb 0.03 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 39.28 1nwh h ASP 77 CO -0.03 0.86 -0.17 0.22 -3.12 0.00 0.00 179.24 177.00 1nwh h TYR 78 N 1.16 0.38 -0.57 4.55 3.20 -1.87 -2.96 116.97 120.86 1nwh h TYR 78 Ca 0.29 -0.13 0.02 0.00 3.14 0.00 0.00 58.73 62.05 1nwh h TYR 78 Cb 0.07 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 1nwh h TYR 78 CO 0.01 0.77 0.36 1.15 -1.64 0.00 0.00 178.16 178.81 1nwh h THR 79 N -0.12 1.08 0.00 1.81 2.02 -1.29 -0.86 112.91 115.55 1nwh h THR 79 Ca 0.01 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1nwh h THR 79 Cb 0.74 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1nwh h THR 79 CO 0.04 0.13 0.00 0.78 0.37 0.00 0.00 175.52 176.84 1nwh h ASN 80 N 0.71 0.00 0.00 4.18 2.35 -1.10 -1.68 115.58 120.03 1nwh h ASN 80 Ca 0.23 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.76 1nwh h ASN 80 Cb -0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 1nwh h ASN 80 CO -0.09 0.00 -1.32 1.21 -1.65 0.00 0.00 177.43 175.59 1nwh n GLU 81 N -3.04 0.55 0.01 0.81 2.13 -0.87 -4.60 120.64 115.62 1nwh n GLU 81 Ca -0.00 0.51 -0.09 0.00 0.66 0.00 0.00 57.16 58.24 1nwh n GLU 81 Cb 0.26 -1.69 -0.14 0.00 0.27 0.00 0.00 31.44 30.14 1nwh n GLU 81 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1nwh h VAL 82 N -1.00 1.06 -0.59 6.31 -1.51 -1.22 -3.38 116.25 115.92 1nwh h VAL 82 Ca -0.33 -2.86 0.03 0.00 -1.23 0.00 0.00 66.70 62.31 1nwh h VAL 82 Cb 1.21 2.55 -0.04 0.00 -2.13 0.00 0.00 31.29 32.87 1nwh h VAL 82 CO -0.20 0.64 0.35 0.22 -1.23 0.00 0.00 177.57 177.35 1nwh h TYR 83 N 0.01 0.66 -0.37 5.19 3.20 -1.49 -0.88 116.97 123.28 1nwh h TYR 83 Ca -0.23 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.55 1nwh h TYR 83 Cb 1.96 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 40.01 1nwh h TYR 83 CO 0.01 0.37 -0.25 -1.35 -1.64 0.00 0.00 178.16 175.30 1nwh h PRO 84 N 0.69 0.75 -0.45 1.82 0.11 -1.76 -2.20 132.00 130.95 1nwh h PRO 84 Ca 0.24 -0.31 -0.06 0.00 0.11 0.00 0.00 66.00 65.98 1nwh h PRO 84 Cb 0.05 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1nwh h PRO 84 CO -0.11 0.92 0.04 0.87 -0.21 0.00 0.00 178.00 179.50 1nwh h LYS 85 N 0.65 0.72 0.06 1.05 1.57 -1.68 -2.06 116.57 116.87 1nwh h LYS 85 Ca 0.09 -0.17 -0.24 0.00 -1.87 0.00 0.00 60.65 58.46 1nwh h LYS 85 Cb 0.76 -0.10 0.02 0.00 0.08 0.00 0.00 32.23 32.99 1nwh h LYS 85 CO 0.06 0.71 -0.96 1.25 -0.57 0.00 0.00 179.45 179.95 1nwh h LEU 86 N 0.69 0.74 -0.42 2.94 5.85 -1.08 -3.25 115.31 120.77 1nwh h LEU 86 Ca 0.14 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 58.06 1nwh h LEU 86 Cb 0.37 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1nwh h LEU 86 CO 0.01 1.46 0.00 0.29 -0.34 0.00 0.00 178.44 179.86 1nwh n LYS 87 N -3.98 0.20 0.11 1.25 4.76 -0.83 -2.69 118.16 116.98 1nwh n LYS 87 Ca -0.12 0.34 0.13 0.00 -2.87 0.00 0.00 58.31 55.78 1nwh n LYS 87 Cb 0.85 -1.82 0.32 0.00 -1.84 0.00 0.00 35.03 32.54 1nwh n LYS 87 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1nwh h ALA 88 N 2.38 0.91 0.00 7.82 0.00 -1.40 -3.25 119.26 125.72 1nwh h ALA 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nwh h ALA 88 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1nwh h ALA 88 CO 0.00 0.00 -0.35 0.25 0.00 0.00 0.00 179.25 179.15 1nwh n THR 89 N -2.36 0.03 0.00 0.00 -2.24 -1.09 -4.93 114.28 103.69 1nwh n THR 89 Ca 0.05 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1nwh n THR 89 Cb 0.45 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1nwh n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nwh n GLY 90 N 1.49 0.91 3.69 3.38 0.00 -1.23 -5.06 105.19 108.36 1nwh n GLY 90 Ca 0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.64 1nwh n GLY 90 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1nwh n TRP 91 N -1.95 2.52 -1.03 1.61 -0.00 -1.25 -4.93 117.44 112.40 1nwh n TRP 91 Ca 0.00 0.05 0.04 0.00 -0.00 0.00 0.00 57.50 57.59 1nwh n TRP 91 Cb 0.00 -2.65 0.30 0.00 -0.00 0.00 0.00 31.31 28.96 1nwh n TRP 91 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 1nwh n ASP 92 N 4.56 4.40 -3.95 5.87 5.68 -1.26 -4.85 116.55 127.00 1nwh n ASP 92 Ca 0.18 -3.11 -0.23 0.00 -0.50 0.00 0.00 54.79 51.12 1nwh n ASP 92 Cb 0.33 -0.63 0.14 0.00 -1.14 0.00 0.00 41.12 39.83 1nwh n ASP 92 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nwh n GLY 93 N -0.23 -0.41 3.85 6.12 0.00 -1.26 -5.04 105.19 108.22 1nwh n GLY 93 Ca 0.28 -1.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.07 1nwh n GLY 93 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nwh s TYR 94 N -3.13 3.60 -0.23 1.61 1.51 0.06 -4.84 117.35 115.92 1nwh s TYR 94 Ca 0.62 0.60 -0.03 0.00 -1.01 0.00 0.00 57.07 57.25 1nwh s TYR 94 Cb -0.03 -2.05 0.00 0.00 -0.11 0.00 0.00 41.96 39.78 1nwh s TYR 94 CO 0.43 0.64 -0.04 -0.46 -1.11 0.00 0.00 175.55 175.01 1nwh s TRP 95 N -0.80 3.00 -0.21 2.71 -0.11 -0.01 -0.57 118.94 122.95 1nwh s TRP 95 Ca 0.16 -1.14 -0.03 0.00 1.22 0.00 0.00 56.10 56.32 1nwh s TRP 95 Cb -0.13 -2.10 -0.00 0.00 -1.50 0.00 0.00 33.47 29.74 1nwh s TRP 95 CO 0.05 -0.61 -0.08 0.08 -4.62 0.00 0.00 176.95 171.77 1nwh s VAL 96 N 1.43 3.09 0.04 5.86 1.01 0.12 -0.51 120.40 131.44 1nwh s VAL 96 Ca 0.04 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.49 1nwh s VAL 96 Cb -0.15 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1nwh s VAL 96 CO -0.04 0.45 -0.16 -0.62 0.00 0.00 0.00 175.10 174.73 1nwh s ASP 97 N 1.38 1.94 -0.04 3.32 -1.08 -0.67 -0.76 116.67 120.76 1nwh s ASP 97 Ca 0.05 -0.48 0.21 0.00 -0.52 0.00 0.00 52.55 51.81 1nwh s ASP 97 Cb -0.14 -0.14 -0.28 0.00 -1.46 0.00 0.00 42.92 40.90 1nwh s ASP 97 CO -0.05 0.08 0.46 0.00 0.52 0.00 0.00 175.17 176.18 1nwh n ALA 98 N 1.88 2.43 -1.71 3.66 0.00 -0.77 -0.84 120.51 125.17 1nwh n ALA 98 Ca -0.18 -0.68 -0.31 0.00 0.00 0.00 0.00 53.44 52.27 1nwh n ALA 98 Cb 0.54 -0.67 0.02 0.00 0.00 0.00 0.00 19.45 19.35 1nwh n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nwh s ALA 99 N -3.24 2.88 -0.25 0.00 0.00 -1.26 -4.66 121.76 115.23 1nwh s ALA 99 Ca -0.07 0.05 0.28 0.00 0.00 0.00 0.00 51.96 52.22 1nwh s ALA 99 Cb 0.11 -3.14 0.93 0.00 0.00 0.00 0.00 23.12 21.02 1nwh s ALA 99 CO 0.87 -0.90 1.80 0.66 0.00 0.00 0.00 175.76 178.20 1nwh h SER 100 N -0.33 0.00 -0.91 0.00 4.64 -1.94 -3.40 113.55 111.61 1nwh h SER 100 Ca -0.44 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.04 1nwh h SER 100 Cb 1.20 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.13 1nwh h SER 100 CO 0.59 0.00 -0.29 0.00 -0.87 0.00 0.00 176.83 176.26 1nwh n ALA 101 N -2.01 0.06 0.23 5.18 0.00 -1.26 -2.49 120.51 120.22 1nwh n ALA 101 Ca 0.02 0.95 0.10 0.00 0.00 0.00 0.00 53.44 54.52 1nwh n ALA 101 Cb 0.38 -0.50 0.19 0.00 0.00 0.00 0.00 19.45 19.52 1nwh n ALA 101 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1nwh n LEU 102 N -5.41 3.27 -0.25 0.00 4.77 -1.26 -4.68 117.00 113.44 1nwh n LEU 102 Ca 0.12 -1.53 0.04 0.00 -0.03 0.00 0.00 56.01 54.61 1nwh n LEU 102 Cb 0.41 -0.23 0.17 0.00 -2.33 0.00 0.00 43.42 41.44 1nwh n LEU 102 CO -0.12 0.72 1.03 0.03 -1.33 0.00 0.00 177.39 177.72 1nwh h ARG 103 N 3.95 0.47 -0.01 3.23 3.08 -1.76 -2.86 114.38 120.48 1nwh h ARG 103 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1nwh h ARG 103 Cb 0.91 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1nwh h ARG 103 CO 0.00 0.31 -0.03 -1.33 -1.07 0.00 0.00 179.97 177.85 1nwh n MET 104 N -4.96 1.40 -2.22 0.04 2.81 -1.26 -4.66 117.12 108.26 1nwh n MET 104 Ca 0.13 -0.70 -0.37 0.00 -1.81 0.00 0.00 57.70 54.95 1nwh n MET 104 Cb 0.37 -1.49 -0.00 0.00 -0.71 0.00 0.00 33.22 31.39 1nwh n MET 104 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1nwh s LYS 105 N -2.08 3.64 0.26 0.03 -0.14 -1.08 -4.94 119.74 115.42 1nwh s LYS 105 Ca 0.38 1.78 0.24 0.00 -1.36 0.00 0.00 55.97 57.00 1nwh s LYS 105 Cb 0.21 -2.32 0.97 0.00 -1.68 0.00 0.00 37.83 35.00 1nwh s LYS 105 CO 0.37 -0.65 1.72 -0.25 -0.76 0.00 0.00 175.35 175.78 1nwh n ASP 106 N -0.67 0.69 -1.18 2.83 10.43 -1.26 -2.56 116.55 124.83 1nwh n ASP 106 Ca 0.08 0.66 0.09 0.00 2.57 0.00 0.00 54.79 58.19 1nwh n ASP 106 Cb 0.48 -0.81 0.28 0.00 1.84 0.00 0.00 41.12 42.92 1nwh n ASP 106 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 1nwh n ASP 107 N -2.25 3.96 -4.28 -2.24 3.85 -1.26 -4.96 116.55 109.38 1nwh n ASP 107 Ca 0.02 -2.29 -0.28 0.00 -0.71 0.00 0.00 54.79 51.54 1nwh n ASP 107 Cb 0.25 -0.46 -0.15 0.00 -1.35 0.00 0.00 41.12 39.42 1nwh n ASP 107 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1nwh s ALA 108 N -1.54 1.93 -0.07 2.12 0.00 -1.06 -3.83 121.76 119.31 1nwh s ALA 108 Ca 0.42 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 51.32 1nwh s ALA 108 Cb 0.26 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 1nwh s ALA 108 CO 0.22 0.45 -0.14 0.42 0.00 0.00 0.00 175.76 176.71 1nwh s ILE 109 N -0.71 3.02 -0.22 0.00 1.01 -0.77 -4.78 121.20 118.76 1nwh s ILE 109 Ca 0.09 -0.72 -0.22 0.00 0.00 0.00 0.00 60.65 59.81 1nwh s ILE 109 Cb -0.09 -2.21 -0.02 0.00 0.01 0.00 0.00 42.46 40.15 1nwh s ILE 109 CO 0.01 0.57 0.68 -0.63 0.00 0.00 0.00 174.94 175.57 1nwh s ILE 110 N -0.38 4.97 -0.13 2.92 1.01 -1.26 -0.93 121.20 127.39 1nwh s ILE 110 Ca 0.04 1.27 -0.14 0.00 0.00 0.00 0.00 60.65 61.82 1nwh s ILE 110 Cb -0.12 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 1nwh s ILE 110 CO 0.02 0.05 0.33 -0.69 0.00 0.00 0.00 174.94 174.65 1nwh s VAL 111 N 2.23 5.27 -0.43 2.92 1.01 0.11 -4.67 120.40 126.83 1nwh s VAL 111 Ca 0.30 0.62 0.02 0.00 0.00 0.00 0.00 61.98 62.92 1nwh s VAL 111 Cb -0.16 -3.66 0.23 0.00 0.00 0.00 0.00 36.38 32.80 1nwh s VAL 111 CO 0.10 0.41 0.97 -0.11 0.00 0.00 0.00 175.10 176.47 1nwh n LEU 112 N 3.31 -2.41 -0.32 3.92 7.94 -1.26 -3.84 117.00 124.34 1nwh n LEU 112 Ca -0.12 -2.42 0.26 0.00 -1.11 0.00 0.00 56.01 52.62 1nwh n LEU 112 Cb 0.52 0.70 0.57 0.00 0.53 0.00 0.00 43.42 45.74 1nwh n LEU 112 CO 0.40 1.73 1.24 -2.24 -1.11 0.00 0.00 177.39 177.41 1nwh h ASP 113 N 4.09 0.33 0.80 1.96 2.03 -1.90 -0.03 116.42 123.69 1nwh h ASP 113 Ca -0.09 0.06 -0.02 0.00 -0.73 0.00 0.00 57.03 56.25 1nwh h ASP 113 Cb 1.12 0.01 -0.00 0.00 -0.83 0.00 0.00 39.33 39.63 1nwh h ASP 113 CO 0.05 0.05 -0.10 -0.65 -1.03 0.00 0.00 179.24 177.56 1nwh h PRO 114 N 0.28 0.00 0.01 4.15 0.11 -1.99 -2.47 132.00 132.09 1nwh h PRO 114 Ca 0.59 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 66.31 1nwh h PRO 114 Cb 1.72 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.76 1nwh h PRO 114 CO -0.23 0.10 -2.44 0.28 -0.21 0.00 0.00 178.00 175.49 1nwh n VAL 115 N -3.29 1.51 -2.36 3.15 0.31 -0.53 -4.74 118.33 112.39 1nwh n VAL 115 Ca -0.00 -0.56 -0.20 0.00 -0.01 0.00 0.00 64.34 63.56 1nwh n VAL 115 Cb 0.32 -1.48 0.02 0.00 -0.91 0.00 0.00 33.84 31.79 1nwh n VAL 115 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1nwh n ASN 116 N -3.35 4.03 0.19 4.52 6.94 -0.14 -4.83 115.26 122.62 1nwh n ASN 116 Ca -0.46 -3.40 0.07 0.00 -0.02 0.00 0.00 54.58 50.77 1nwh n ASN 116 Cb 0.99 -0.42 0.57 0.00 -2.36 0.00 0.00 39.78 38.56 1nwh n ASN 116 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1nwh h GLN 117 N 2.47 0.15 -0.11 -3.83 5.75 -1.67 -2.41 115.11 115.45 1nwh h GLN 117 Ca 0.23 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.70 1nwh h GLN 117 Cb 1.24 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 29.76 1nwh h GLN 117 CO 0.69 0.11 -0.00 1.25 -2.65 0.00 0.00 178.83 178.22 1nwh h HIS 118 N 0.15 0.21 -0.94 3.99 2.76 -1.88 -0.47 115.15 118.98 1nwh h HIS 118 Ca 0.04 -0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1nwh h HIS 118 Cb -0.00 -0.06 -0.05 0.00 1.55 0.00 0.00 27.41 28.86 1nwh h HIS 118 CO 0.00 0.45 0.62 0.28 -1.30 0.00 0.00 177.93 177.98 1nwh h VAL 119 N -0.08 1.24 -0.16 5.26 2.07 -1.79 -0.83 116.25 121.96 1nwh h VAL 119 Ca 0.03 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 1nwh h VAL 119 Cb 0.36 -0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 29.99 1nwh h VAL 119 CO 0.01 0.23 -0.09 0.40 0.02 0.00 0.00 177.57 178.14 1nwh h ILE 120 N 1.26 1.32 -0.67 4.57 2.04 -1.36 -0.90 117.51 123.77 1nwh h ILE 120 Ca 0.35 -1.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.97 1nwh h ILE 120 Cb -0.14 1.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 1nwh h ILE 120 CO -0.08 0.34 0.14 0.28 0.00 0.00 0.00 178.15 178.83 1nwh h SER 121 N 0.00 1.04 1.04 1.72 0.02 -0.76 -0.50 113.55 116.11 1nwh h SER 121 Ca 0.03 -0.23 -0.09 0.00 -0.84 0.00 0.00 61.79 60.66 1nwh h SER 121 Cb 0.58 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 1nwh h SER 121 CO 0.03 1.01 -0.43 -0.33 -1.14 0.00 0.00 176.83 175.97 1nwh h GLU 122 N 1.03 0.00 0.10 3.45 4.39 -1.17 -2.78 114.58 119.60 1nwh h GLU 122 Ca 0.21 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.65 1nwh h GLU 122 Cb 0.40 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1nwh h GLU 122 CO 0.01 0.43 -1.19 0.78 -1.16 0.00 0.00 179.01 177.88 1nwh h GLY 123 N 2.51 0.30 2.00 -3.84 0.00 -0.76 -2.43 103.07 100.84 1nwh h GLY 123 Ca -0.00 -0.72 -0.09 0.00 0.00 0.00 0.00 47.33 46.51 1nwh h GLY 123 CO 0.06 0.63 -0.45 1.41 0.00 0.00 0.00 176.54 178.19 1nwh h LEU 124 N 0.08 0.00 -0.07 3.11 3.38 -1.04 -1.60 115.31 119.16 1nwh h LEU 124 Ca -0.12 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1nwh h LEU 124 Cb 1.91 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.64 1nwh h LEU 124 CO 0.19 0.45 -0.56 0.50 0.09 0.00 0.00 178.44 179.10 1nwh h LYS 125 N 0.00 0.00 0.00 1.13 3.64 -1.51 -3.20 116.57 116.62 1nwh h LYS 125 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1nwh h LYS 125 Cb 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1nwh h LYS 125 CO 0.06 0.56 -0.26 1.17 -2.27 0.00 0.00 179.45 178.72 1nwh n LYS 126 N -3.27 0.08 -0.33 1.90 3.00 -0.85 -4.95 118.16 113.75 1nwh n LYS 126 Ca 0.02 0.04 0.00 0.00 -0.00 0.00 0.00 58.31 58.37 1nwh n LYS 126 Cb 0.75 -1.57 0.00 0.00 0.00 0.00 0.00 35.03 34.21 1nwh n LYS 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nwh n GLY 127 N 1.45 0.82 3.70 3.14 0.00 -0.86 -5.05 105.19 108.39 1nwh n GLY 127 Ca 0.06 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1nwh n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nwh s ILE 128 N -2.00 3.07 -0.54 -0.61 -1.09 -0.66 -4.92 121.20 114.45 1nwh s ILE 128 Ca 0.00 0.63 0.16 0.00 -2.23 0.00 0.00 60.65 59.21 1nwh s ILE 128 Cb 0.00 -3.41 -0.19 0.00 -1.58 0.00 0.00 42.46 37.28 1nwh s ILE 128 CO 0.00 0.02 0.58 0.29 -1.23 0.00 0.00 174.94 174.60 1nwh n LYS 129 N 4.91 1.47 -4.02 2.79 4.76 -1.26 -4.73 118.16 122.08 1nwh n LYS 129 Ca 0.14 -0.04 -0.35 0.00 -2.87 0.00 0.00 58.31 55.19 1nwh n LYS 129 Cb 0.41 -1.28 -0.14 0.00 -1.84 0.00 0.00 35.03 32.18 1nwh n LYS 129 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1nwh s THR 130 N -2.65 3.52 -0.13 -0.18 2.01 -1.25 -0.83 115.64 116.14 1nwh s THR 130 Ca 0.03 -0.45 0.02 0.00 0.31 0.00 0.00 61.69 61.59 1nwh s THR 130 Cb 0.11 -2.59 0.01 0.00 0.01 0.00 0.00 72.50 70.05 1nwh s THR 130 CO 0.65 0.43 -0.17 -0.36 -0.69 0.00 0.00 174.62 174.47 1nwh s PHE 131 N 1.27 2.26 -0.02 4.92 0.40 0.33 -1.85 117.98 125.29 1nwh s PHE 131 Ca 0.03 -1.15 0.05 0.00 -0.60 0.00 0.00 56.93 55.27 1nwh s PHE 131 Cb -0.14 -1.60 -0.01 0.00 0.51 0.00 0.00 43.02 41.78 1nwh s PHE 131 CO -0.01 -0.57 -0.18 0.08 0.70 0.00 0.00 175.22 175.24 1nwh s VAL 132 N 1.04 1.45 0.56 -0.44 1.01 -0.11 -1.67 120.40 122.24 1nwh s VAL 132 Ca -0.04 -0.76 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 1nwh s VAL 132 Cb -0.15 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 1nwh s VAL 132 CO -0.04 0.41 1.11 -0.83 0.00 0.00 0.00 175.10 175.75 1nwh s GLY 133 N -0.28 2.48 0.72 4.51 0.00 -0.02 0.06 107.32 114.79 1nwh s GLY 133 Ca 0.04 0.71 -0.05 0.00 0.00 0.00 0.00 44.72 45.41 1nwh s GLY 133 CO 0.00 1.06 1.01 -0.32 0.00 0.00 0.00 173.10 174.85 1nwh s GLY 134 N -2.04 1.74 0.00 0.20 0.00 -1.25 -4.79 107.32 101.18 1nwh s GLY 134 Ca 0.70 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 44.17 1nwh s GLY 134 CO 0.30 -0.77 0.00 -2.01 0.00 0.00 0.00 173.10 170.62 1nwh n ASN 135 N -2.92 0.00 0.00 1.64 5.15 -1.26 -4.79 115.26 113.08 1nwh n ASN 135 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1nwh n ASN 135 Cb 0.60 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.85 1nwh n ASN 135 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1nwh n THR 137 N -0.05 0.00 -0.05 -0.44 -2.24 -1.26 -1.39 114.28 108.85 1nwh n THR 137 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 1nwh n THR 137 Cb 0.00 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.16 1nwh n THR 137 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1nwh h VAL 138 N 0.00 1.32 -0.37 2.28 2.07 -1.94 -2.17 116.25 117.44 1nwh h VAL 138 Ca 0.00 -1.13 -0.10 0.00 0.82 0.00 0.00 66.70 66.29 1nwh h VAL 138 Cb 0.00 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1nwh h VAL 138 CO 0.00 0.33 -0.19 0.77 0.02 0.00 0.00 177.57 178.50 1nwh h SER 139 N -0.02 0.69 0.71 0.57 4.64 -1.55 -1.69 113.55 116.90 1nwh h SER 139 Ca 0.03 -0.23 -0.13 0.00 -0.47 0.00 0.00 61.79 61.00 1nwh h SER 139 Cb 0.55 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 1nwh h SER 139 CO 0.02 0.88 -0.61 -0.07 -0.87 0.00 0.00 176.83 176.19 1nwh h LEU 140 N 0.61 0.00 -0.02 5.97 3.38 -1.81 -1.75 115.31 121.69 1nwh h LEU 140 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1nwh h LEU 140 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1nwh h LEU 140 CO 0.05 0.61 -0.03 -0.03 0.09 0.00 0.00 178.44 179.13 1nwh h MET 141 N 0.00 0.06 0.00 1.13 4.05 -1.17 -3.12 114.93 115.89 1nwh h MET 141 Ca -0.01 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.32 1nwh h MET 141 Cb 1.13 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.92 1nwh h MET 141 CO 0.08 0.56 -0.28 -0.07 0.23 0.00 0.00 176.91 177.43 1nwh h LEU 142 N -0.44 0.00 -0.95 3.39 3.38 -1.26 0.16 115.31 119.59 1nwh h LEU 142 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1nwh h LEU 142 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1nwh h LEU 142 CO 0.01 0.28 -0.17 0.24 0.09 0.00 0.00 178.44 178.89 1nwh h MET 143 N 0.00 0.00 0.04 1.13 2.86 -1.36 -0.57 114.93 117.03 1nwh h MET 143 Ca -0.00 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.25 1nwh h MET 143 Cb 0.55 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.15 1nwh h MET 143 CO 0.04 0.17 -2.26 0.00 1.06 0.00 0.00 176.91 175.91 1nwh n ALA 144 N -2.18 1.20 -0.19 6.32 0.00 -0.88 -4.42 120.51 120.36 1nwh n ALA 144 Ca 0.01 -0.92 0.05 0.00 0.00 0.00 0.00 53.44 52.58 1nwh n ALA 144 Cb 0.44 -0.27 0.13 0.00 0.00 0.00 0.00 19.45 19.76 1nwh n ALA 144 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1nwh n ILE 145 N -3.55 1.06 0.28 0.00 -0.00 0.51 -4.72 119.36 112.94 1nwh n ILE 145 Ca -0.42 -1.04 0.18 0.00 -0.00 0.00 0.00 62.75 61.46 1nwh n ILE 145 Cb 0.97 0.46 0.97 0.00 -0.00 0.00 0.00 39.64 42.04 1nwh n ILE 145 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1nwh h GLY 146 N 1.71 0.00 1.23 7.39 0.00 -1.28 -2.29 103.07 109.83 1nwh h GLY 146 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1nwh h GLY 146 CO 0.01 0.00 0.21 -1.33 0.00 0.00 0.00 176.54 175.42 1nwh h GLY 147 N 0.00 1.05 2.00 4.60 0.00 -1.84 -0.70 103.07 108.18 1nwh h GLY 147 Ca 0.03 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.67 1nwh h GLY 147 CO -0.00 0.55 -0.47 1.41 0.00 0.00 0.00 176.54 178.03 1nwh h LEU 148 N 0.94 0.00 -0.01 3.11 3.38 -1.68 -2.46 115.31 118.59 1nwh h LEU 148 Ca 0.21 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.92 1nwh h LEU 148 Cb 0.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1nwh h LEU 148 CO -0.01 0.47 -1.10 -0.26 0.09 0.00 0.00 178.44 177.63 1nwh h PHE 149 N 0.00 0.74 -0.66 1.13 -1.00 -1.50 -0.29 116.94 115.36 1nwh h PHE 149 Ca -0.00 -0.45 -0.08 0.00 2.81 0.00 0.00 57.97 60.25 1nwh h PHE 149 Cb 0.85 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 40.32 1nwh h PHE 149 CO 0.00 1.29 0.11 1.49 -1.61 0.00 0.00 178.31 179.60 1nwh h GLU 150 N 0.22 1.09 -0.57 1.51 4.81 -0.97 -2.64 114.58 118.03 1nwh h GLU 150 Ca -0.13 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1nwh h GLU 150 Cb 1.77 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 31.02 1nwh h GLU 150 CO 0.20 1.00 0.00 1.63 -0.73 0.00 0.00 179.01 181.10 1nwh n LYS 151 N -4.21 2.26 -3.89 1.92 4.76 -0.94 -4.92 118.16 113.13 1nwh n LYS 151 Ca 0.04 -1.30 -0.29 0.00 -2.87 0.00 0.00 58.31 53.89 1nwh n LYS 151 Cb 0.29 -1.55 0.03 0.00 -1.84 0.00 0.00 35.03 31.96 1nwh n LYS 151 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1nwh n ASP 152 N 0.38 -4.31 0.01 4.39 2.03 -1.00 -4.92 116.55 113.12 1nwh n ASP 152 Ca 0.12 -0.79 0.11 0.00 0.52 0.00 0.00 54.79 54.75 1nwh n ASP 152 Cb 0.48 -3.90 -0.09 0.00 -0.72 0.00 0.00 41.12 36.89 1nwh n ASP 152 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1nwh n LEU 153 N -4.64 0.45 -4.67 -2.67 4.77 -0.12 -4.85 117.00 105.27 1nwh n LEU 153 Ca -0.00 -0.06 -0.41 0.00 -0.03 0.00 0.00 56.01 55.50 1nwh n LEU 153 Cb 0.55 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1nwh n LEU 153 CO 0.75 0.04 0.52 -0.69 -1.33 0.00 0.00 177.39 176.67 1nwh s VAL 154 N -3.32 4.94 -0.22 4.08 1.01 -1.22 -0.13 120.40 125.54 1nwh s VAL 154 Ca -0.01 1.46 -0.18 0.00 0.00 0.00 0.00 61.98 63.25 1nwh s VAL 154 Cb 0.14 -4.06 -0.18 0.00 0.00 0.00 0.00 36.38 32.28 1nwh s VAL 154 CO 0.86 0.06 0.07 1.21 0.00 0.00 0.00 175.10 177.30 1nwh n GLU 155 N 5.13 0.59 -3.49 2.72 2.13 -0.44 -4.88 120.64 122.40 1nwh n GLU 155 Ca 0.02 0.47 -0.11 0.00 0.66 0.00 0.00 57.16 58.20 1nwh n GLU 155 Cb 0.49 -1.68 -0.02 0.00 0.27 0.00 0.00 31.44 30.51 1nwh n GLU 155 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 1nwh s TRP 156 N -2.42 -0.48 -0.04 4.31 1.48 -1.17 -4.05 118.94 116.56 1nwh s TRP 156 Ca -0.31 0.23 0.01 0.00 -1.06 0.00 0.00 56.10 54.97 1nwh s TRP 156 Cb 0.08 0.57 0.02 0.00 -1.16 0.00 0.00 33.47 32.99 1nwh s TRP 156 CO 0.58 -0.90 -0.04 0.42 -4.06 0.00 0.00 176.95 172.94 1nwh s ILE 157 N -3.78 0.53 -0.30 0.66 1.01 -0.16 -1.53 121.20 117.64 1nwh s ILE 157 Ca 0.02 -0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 1nwh s ILE 157 Cb -0.02 -0.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.86 1nwh s ILE 157 CO -0.10 0.23 0.18 -0.55 0.00 0.00 0.00 174.94 174.70 1nwh s SER 158 N 0.94 5.82 -0.06 3.58 0.15 -0.14 -2.17 113.70 121.83 1nwh s SER 158 Ca -0.11 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.28 1nwh s SER 158 Cb -0.14 -2.08 -0.03 0.00 -1.71 0.00 0.00 66.02 62.06 1nwh s SER 158 CO -0.00 -0.13 -0.04 -0.69 1.20 0.00 0.00 173.24 173.58 1nwh s VAL 159 N 1.70 3.96 -0.15 4.45 1.01 -0.52 -1.98 120.40 128.87 1nwh s VAL 159 Ca 0.06 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.56 1nwh s VAL 159 Cb -0.17 -2.67 0.05 0.00 0.00 0.00 0.00 36.38 33.60 1nwh s VAL 159 CO 0.09 0.55 0.05 0.00 0.00 0.00 0.00 175.10 175.78 1nwh s ALA 160 N -0.89 0.70 0.20 5.51 0.00 -0.53 -1.09 121.76 125.65 1nwh s ALA 160 Ca 0.14 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.74 1nwh s ALA 160 Cb -0.11 -1.00 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 1nwh s ALA 160 CO 0.04 -0.97 0.34 0.95 0.00 0.00 0.00 175.76 176.11 1nwh s THR 161 N 1.99 5.27 -0.54 0.00 -4.23 -0.65 0.07 115.64 117.55 1nwh s THR 161 Ca 0.02 -0.74 0.04 0.00 -1.18 0.00 0.00 61.69 59.83 1nwh s THR 161 Cb -0.15 -3.79 0.17 0.00 1.34 0.00 0.00 72.50 70.06 1nwh s THR 161 CO -0.07 -0.22 0.40 -0.31 -0.54 0.00 0.00 174.62 173.88 1nwh s TYR 162 N -1.88 2.26 0.08 3.99 1.51 0.15 -3.35 117.35 120.11 1nwh s TYR 162 Ca 0.35 -2.77 -0.24 0.00 -1.01 0.00 0.00 57.07 53.40 1nwh s TYR 162 Cb -0.10 -1.80 -0.06 0.00 -0.11 0.00 0.00 41.96 39.88 1nwh s TYR 162 CO 0.29 -0.70 0.73 -0.65 -1.11 0.00 0.00 175.55 174.11 1nwh s GLN 163 N -0.56 4.47 0.55 -0.62 -0.21 0.15 -1.17 119.66 122.26 1nwh s GLN 163 Ca 0.28 1.02 -0.14 0.00 0.02 0.00 0.00 55.36 56.54 1nwh s GLN 163 Cb -0.03 -3.32 -0.06 0.00 1.00 0.00 0.00 33.01 30.60 1nwh s GLN 163 CO -0.16 0.41 0.98 0.00 -2.12 0.00 0.00 175.29 174.41 1nwh s ALA 164 N -0.50 3.10 0.04 6.09 0.00 -1.24 -0.56 121.76 128.70 1nwh s ALA 164 Ca 0.36 0.05 0.29 0.00 0.00 0.00 0.00 51.96 52.66 1nwh s ALA 164 Cb -0.21 -3.07 1.53 0.00 0.00 0.00 0.00 23.12 21.38 1nwh s ALA 164 CO 0.23 -0.39 1.89 0.00 0.00 0.00 0.00 175.76 177.49 1nwh h ALA 165 N 0.48 1.00 -0.78 0.00 0.00 -1.25 -2.90 119.26 115.81 1nwh h ALA 165 Ca -0.46 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.51 1nwh h ALA 165 Cb 1.19 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1nwh h ALA 165 CO 0.62 0.00 0.47 1.03 0.00 0.00 0.00 179.25 181.37 1nwh h SER 166 N 0.00 0.73 0.69 0.00 0.87 -1.68 -2.34 113.55 111.82 1nwh h SER 166 Ca 0.00 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1nwh h SER 166 Cb 0.07 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1nwh h SER 166 CO 0.00 0.47 -0.13 1.23 -0.53 0.00 0.00 176.83 177.88 1nwh h GLY 167 N 0.87 0.00 1.44 5.77 0.00 -1.82 -3.01 103.07 106.32 1nwh h GLY 167 Ca 0.34 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.40 1nwh h GLY 167 CO -0.17 0.00 -1.39 0.00 0.00 0.00 0.00 176.54 174.98 1nwh h ALA 168 N 1.87 0.48 0.00 3.60 0.00 -1.62 -3.50 119.26 120.10 1nwh h ALA 168 Ca -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 53.75 1nwh h ALA 168 Cb 0.50 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1nwh h ALA 168 CO 0.02 1.35 0.00 0.41 0.00 0.00 0.00 179.25 181.02 1nwh n GLY 169 N 1.51 3.08 0.28 0.00 0.00 -1.07 -4.86 105.19 104.12 1nwh n GLY 169 Ca -0.10 -1.63 -0.08 0.00 0.00 0.00 0.00 46.02 44.21 1nwh n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nwh h ALA 170 N 0.00 0.78 0.00 4.61 0.00 -1.86 -2.81 119.26 119.99 1nwh h ALA 170 Ca 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1nwh h ALA 170 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1nwh h ALA 170 CO 0.00 0.47 -0.21 0.87 0.00 0.00 0.00 179.25 180.38 1nwh h LYS 171 N 0.85 0.00 -0.09 0.00 1.57 -1.94 -2.83 116.57 114.13 1nwh h LYS 171 Ca 0.19 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.79 1nwh h LYS 171 Cb 0.32 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1nwh h LYS 171 CO -0.00 0.21 -0.71 -0.91 -0.57 0.00 0.00 179.45 177.47 1nwh h ASN 172 N 0.00 0.49 -0.30 0.86 2.35 -1.80 -1.82 115.58 115.36 1nwh h ASN 172 Ca -0.00 -0.31 -0.13 0.00 -0.55 0.00 0.00 56.30 55.30 1nwh h ASN 172 Cb 0.71 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1nwh h ASN 172 CO 0.03 1.05 -0.29 0.24 -1.65 0.00 0.00 177.43 176.80 1nwh h MET 173 N 0.28 0.81 -0.28 0.81 2.86 -1.31 -1.53 114.93 116.58 1nwh h MET 173 Ca -0.03 -0.37 -0.14 0.00 -2.06 0.00 0.00 59.70 57.11 1nwh h MET 173 Cb 1.28 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.91 1nwh h MET 173 CO 0.12 0.99 -0.40 0.00 1.06 0.00 0.00 176.91 178.69 1nwh h ARG 174 N 0.69 0.67 -0.46 1.72 3.08 -1.47 -2.49 114.38 116.12 1nwh h ARG 174 Ca 0.08 -0.35 -0.13 0.00 0.07 0.00 0.00 59.98 59.65 1nwh h ARG 174 Cb 0.83 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1nwh h ARG 174 CO 0.07 0.95 -0.22 1.49 -1.07 0.00 0.00 179.97 181.19 1nwh h GLU 175 N 0.55 0.97 -0.37 0.04 4.81 -1.14 -1.41 114.58 118.03 1nwh h GLU 175 Ca 0.05 -0.42 0.01 0.00 -0.13 0.00 0.00 59.36 58.86 1nwh h GLU 175 Cb 0.93 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 1nwh h GLU 175 CO 0.08 1.09 0.23 1.25 -0.73 0.00 0.00 179.01 180.94 1nwh h LEU 176 N 0.82 0.40 -0.47 1.64 5.85 -1.17 -0.19 115.31 122.18 1nwh h LEU 176 Ca 0.10 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 1nwh h LEU 176 Cb 0.80 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 1nwh h LEU 176 CO 0.07 0.29 0.19 -0.07 -0.34 0.00 0.00 178.44 178.57 1nwh h LEU 177 N 0.48 0.65 -0.72 2.25 3.38 -1.32 -1.15 115.31 118.87 1nwh h LEU 177 Ca 0.14 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1nwh h LEU 177 Cb -0.04 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1nwh h LEU 177 CO -0.04 0.64 0.31 0.28 0.09 0.00 0.00 178.44 179.71 1nwh h SER 178 N 0.61 0.98 -0.45 -0.43 0.02 -1.05 -1.82 113.55 111.42 1nwh h SER 178 Ca 0.16 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1nwh h SER 178 Cb 0.19 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1nwh h SER 178 CO -0.01 0.87 0.27 1.56 -1.14 0.00 0.00 176.83 178.38 1nwh h GLN 179 N 1.02 0.61 -0.70 3.45 4.20 -0.75 -1.99 115.11 120.95 1nwh h GLN 179 Ca 0.24 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 1nwh h GLN 179 Cb 0.18 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 1nwh h GLN 179 CO -0.02 0.45 0.30 0.52 -0.67 0.00 0.00 178.83 179.40 1nwh h MET 180 N 0.60 1.04 -0.10 1.46 2.86 -0.81 -2.15 114.93 117.83 1nwh h MET 180 Ca 0.16 -0.18 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 1nwh h MET 180 Cb -0.01 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 1nwh h MET 180 CO -0.03 0.85 -0.44 0.78 1.06 0.00 0.00 176.91 179.13 1nwh h GLY 181 N 1.00 0.25 2.00 8.32 0.00 -1.15 -2.81 103.07 110.69 1nwh h GLY 181 Ca 0.24 -0.25 -0.10 0.00 0.00 0.00 0.00 47.33 47.22 1nwh h GLY 181 CO -0.02 0.23 -0.47 1.41 0.00 0.00 0.00 176.54 177.68 1nwh h LEU 182 N 0.19 0.00 -0.22 3.11 4.07 -1.13 -1.79 115.31 119.53 1nwh h LEU 182 Ca 0.01 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.77 1nwh h LEU 182 Cb 0.86 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.61 1nwh h LEU 182 CO 0.07 0.47 -0.64 -0.07 -1.08 0.00 0.00 178.44 177.19 1nwh h LEU 183 N 0.00 0.95 -0.10 1.67 3.38 -1.14 -2.89 115.31 117.18 1nwh h LEU 183 Ca -0.00 -0.58 -0.24 0.00 0.09 0.00 0.00 57.88 57.15 1nwh h LEU 183 Cb 1.12 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.60 1nwh h LEU 183 CO 0.06 1.36 -0.99 -0.08 0.09 0.00 0.00 178.44 178.88 1nwh h GLU 184 N 0.59 0.50 -0.15 1.13 4.22 -1.51 -3.28 114.58 116.08 1nwh h GLU 184 Ca -0.02 -0.55 -0.02 0.00 0.08 0.00 0.00 59.36 58.85 1nwh h GLU 184 Cb 1.26 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 1nwh h GLU 184 CO 0.14 1.18 -0.01 1.96 -2.18 0.00 0.00 179.01 180.10 1nwh h GLN 185 N 0.28 0.21 0.00 1.92 1.08 -1.33 -1.21 115.11 116.06 1nwh h GLN 185 Ca -0.10 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 1nwh h GLN 185 Cb 1.64 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 29.03 1nwh h GLN 185 CO 0.18 0.25 -0.03 0.00 -0.95 0.00 0.00 178.83 178.28 1nwh h ALA 186 N 1.78 1.07 0.00 3.87 0.00 -1.57 -2.82 119.26 121.60 1nwh h ALA 186 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1nwh h ALA 186 Cb 0.17 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1nwh h ALA 186 CO 0.00 0.03 -0.38 1.33 0.00 0.00 0.00 179.25 180.24 1nwh n VAL 187 N -3.22 1.11 -0.22 0.00 0.24 -0.76 -4.87 118.33 110.60 1nwh n VAL 187 Ca -0.02 -1.56 0.02 0.00 -2.04 0.00 0.00 64.34 60.74 1nwh n VAL 187 Cb 0.19 0.16 0.10 0.00 -1.47 0.00 0.00 33.84 32.82 1nwh n VAL 187 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1nwh h SER 188 N 0.31 -0.41 -0.22 -1.34 0.87 -0.98 -0.91 113.55 110.87 1nwh h SER 188 Ca -0.03 0.18 -0.10 0.00 -1.23 0.00 0.00 61.79 60.60 1nwh h SER 188 Cb 1.25 0.34 -0.00 0.00 -0.44 0.00 0.00 62.40 63.54 1nwh h SER 188 CO 0.01 -0.17 -0.27 -1.28 -0.53 0.00 0.00 176.83 174.60 1nwh h SER 189 N 0.07 0.61 -0.49 6.23 0.87 -1.89 -3.20 113.55 115.76 1nwh h SER 189 Ca 0.34 -0.50 -0.03 0.00 -1.23 0.00 0.00 61.79 60.38 1nwh h SER 189 Cb 0.56 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 1nwh h SER 189 CO -0.61 0.98 0.21 -0.33 -0.53 0.00 0.00 176.83 176.55 1nwh h GLU 190 N 0.25 0.77 0.00 2.24 3.07 -1.79 -2.48 114.58 116.64 1nwh h GLU 190 Ca 0.03 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 58.74 1nwh h GLU 190 Cb 0.83 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1nwh h GLU 190 CO 0.06 0.64 -0.16 -0.07 -1.40 0.00 0.00 179.01 178.08 1nwh h LEU 191 N 0.76 0.00 -0.82 1.33 3.38 -1.22 -3.20 115.31 115.54 1nwh h LEU 191 Ca 0.18 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 1nwh h LEU 191 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1nwh h LEU 191 CO -0.02 0.16 -0.50 0.11 0.09 0.00 0.00 178.44 178.28 1nwh h LYS 192 N 0.00 0.21 -5.11 1.13 1.79 -1.43 -3.42 116.57 109.74 1nwh h LYS 192 Ca -0.00 -0.12 -0.63 0.00 -2.18 0.00 0.00 60.65 57.71 1nwh h LYS 192 Cb 0.73 0.01 -0.19 0.00 -1.58 0.00 0.00 32.23 31.20 1nwh h LYS 192 CO 0.02 0.67 -0.59 0.16 -1.08 0.00 0.00 179.45 178.63 1nwh s ASP 193 N -6.88 5.39 0.48 0.86 -4.77 -1.21 -5.00 116.67 105.53 1nwh s ASP 193 Ca -0.04 -0.07 0.32 0.00 -3.30 0.00 0.00 52.55 49.47 1nwh s ASP 193 Cb 0.13 -1.95 1.59 0.00 -1.09 0.00 0.00 42.92 41.60 1nwh s ASP 193 CO 0.78 0.07 1.98 1.55 0.70 0.00 0.00 175.17 180.24 1nwh h PRO 194 N 7.50 0.00 -0.00 2.11 0.13 -1.84 -3.10 132.00 136.80 1nwh h PRO 194 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1nwh h PRO 194 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1nwh h PRO 194 CO 0.63 0.00 -0.22 0.00 -0.23 0.00 0.00 178.00 178.18 1nwh n ALA 195 N -1.95 2.88 -1.46 -0.56 0.00 -1.26 -4.94 120.51 113.22 1nwh n ALA 195 Ca -0.01 -0.22 -0.34 0.00 0.00 0.00 0.00 53.44 52.87 1nwh n ALA 195 Cb 0.15 -1.31 0.07 0.00 0.00 0.00 0.00 19.45 18.36 1nwh n ALA 195 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nwh s SER 196 N -2.92 4.57 0.05 0.00 1.04 -1.17 -4.98 113.70 110.29 1nwh s SER 196 Ca 0.15 2.28 -0.31 0.00 0.48 0.00 0.00 55.95 58.55 1nwh s SER 196 Cb 0.19 -2.58 -0.06 0.00 0.10 0.00 0.00 66.02 63.67 1nwh s SER 196 CO 0.59 -2.00 1.24 -0.55 0.98 0.00 0.00 173.24 173.50 1nwh s SER 197 N -2.09 7.02 0.25 7.02 0.15 -1.26 -4.95 113.70 119.85 1nwh s SER 197 Ca 0.73 2.05 0.09 0.00 0.70 0.00 0.00 55.95 59.52 1nwh s SER 197 Cb -0.27 -2.58 0.28 0.00 -1.71 0.00 0.00 66.02 61.74 1nwh s SER 197 CO 0.42 -0.53 1.57 -0.29 1.20 0.00 0.00 173.24 175.61 1nwh h ILE 198 N 4.55 1.47 -0.09 6.45 6.09 -1.98 -2.60 117.51 131.40 1nwh h ILE 198 Ca -0.41 -2.27 -0.13 0.00 -1.37 0.00 0.00 64.86 60.68 1nwh h ILE 198 Cb 1.21 2.22 -0.01 0.00 0.47 0.00 0.00 36.82 40.71 1nwh h ILE 198 CO 0.83 0.65 -0.51 -0.07 -3.07 0.00 0.00 178.15 175.98 1nwh h LEU 199 N 0.01 0.26 -0.23 2.19 3.38 -1.99 -0.81 115.31 118.13 1nwh h LEU 199 Ca -0.01 -0.13 -0.21 0.00 0.09 0.00 0.00 57.88 57.62 1nwh h LEU 199 Cb 1.18 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.86 1nwh h LEU 199 CO 0.09 0.73 -0.76 -0.78 0.09 0.00 0.00 178.44 177.81 1nwh h ASP 200 N 0.19 0.83 -0.20 -0.43 1.82 -1.96 -1.51 116.42 115.16 1nwh h ASP 200 Ca 0.01 -0.54 -0.01 0.00 -0.39 0.00 0.00 57.03 56.09 1nwh h ASP 200 Cb 0.97 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 40.73 1nwh h ASP 200 CO 0.08 1.33 0.09 0.40 -1.61 0.00 0.00 179.24 179.53 1nwh h ILE 201 N 0.48 1.15 -0.72 2.25 2.04 -1.24 -2.53 117.51 118.94 1nwh h ILE 201 Ca -0.05 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 1nwh h ILE 201 Cb 1.37 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.49 1nwh h ILE 201 CO 0.15 0.15 0.24 1.05 0.00 0.00 0.00 178.15 179.74 1nwh h GLU 202 N 0.19 1.11 -0.20 2.37 -0.00 -1.12 -1.74 114.58 115.19 1nwh h GLU 202 Ca 0.07 -0.23 -0.02 0.00 -0.00 0.00 0.00 59.36 59.18 1nwh h GLU 202 Cb 0.15 -0.16 -0.01 0.00 -0.00 0.00 0.00 28.75 28.73 1nwh h GLU 202 CO -0.01 0.95 0.03 0.00 -0.00 0.00 0.00 179.01 179.98 1nwh h ARG 203 N 1.06 0.28 0.12 1.06 3.08 -1.16 -0.52 114.38 118.31 1nwh h ARG 203 Ca 0.23 -0.04 -0.28 0.00 0.07 0.00 0.00 59.98 59.97 1nwh h ARG 203 Cb 0.29 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1nwh h ARG 203 CO -0.01 0.28 -1.27 0.87 -1.07 0.00 0.00 179.97 178.77 1nwh h LYS 204 N 0.28 0.26 -0.40 0.04 1.57 -1.06 -2.60 116.57 114.66 1nwh h LYS 204 Ca 0.07 -0.44 -0.16 0.00 -1.87 0.00 0.00 60.65 58.25 1nwh h LYS 204 Cb 0.14 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1nwh h LYS 204 CO -0.00 1.20 -0.36 0.28 -0.57 0.00 0.00 179.45 179.99 1nwh h VAL 205 N 0.07 1.27 -0.21 0.50 2.07 -0.91 -2.61 116.25 116.43 1nwh h VAL 205 Ca -0.14 -1.54 -0.15 0.00 0.82 0.00 0.00 66.70 65.69 1nwh h VAL 205 Cb 1.97 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 1nwh h VAL 205 CO 0.20 0.52 -0.49 0.74 0.02 0.00 0.00 177.57 178.56 1nwh h THR 206 N 0.79 1.31 -0.54 2.57 2.02 -1.20 -2.23 112.91 115.64 1nwh h THR 206 Ca 0.07 -1.70 -0.06 0.00 0.77 0.00 0.00 66.41 65.48 1nwh h THR 206 Cb 0.96 1.67 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 1nwh h THR 206 CO 0.09 0.53 0.09 0.00 0.37 0.00 0.00 175.52 176.60 1nwh h ALA 207 N 1.01 1.15 -0.28 6.16 0.00 -1.40 -1.63 119.26 124.27 1nwh h ALA 207 Ca 0.02 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 1nwh h ALA 207 Cb 1.02 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1nwh h ALA 207 CO 0.09 0.57 -0.51 -0.22 0.00 0.00 0.00 179.25 179.18 1nwh h LYS 208 N 0.81 0.78 -0.07 0.00 1.63 -1.34 -1.82 116.57 116.56 1nwh h LYS 208 Ca 0.17 -0.47 -0.05 0.00 -0.85 0.00 0.00 60.65 59.45 1nwh h LYS 208 Cb 0.36 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.02 1nwh h LYS 208 CO 0.01 1.10 -0.19 1.98 -3.45 0.00 0.00 179.45 178.89 1nwh h MET 209 N 0.61 0.11 -0.00 1.90 4.05 -1.03 -2.75 114.93 117.82 1nwh h MET 209 Ca 0.02 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1nwh h MET 209 Cb 1.09 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.87 1nwh h MET 209 CO 0.11 0.31 -0.56 0.54 0.23 0.00 0.00 176.91 177.54 1nwh n ARG 210 N -4.26 0.38 -1.46 0.39 1.74 -0.65 -4.86 116.66 107.95 1nwh n ARG 210 Ca -0.02 -0.27 -0.32 0.00 -0.77 0.00 0.00 57.85 56.48 1nwh n ARG 210 Cb 0.29 -1.49 0.08 0.00 -1.02 0.00 0.00 32.46 30.31 1nwh n ARG 210 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nwh s ALA 211 N -2.80 2.26 0.23 7.54 0.00 -0.70 -4.97 121.76 123.31 1nwh s ALA 211 Ca 0.15 0.51 -0.05 0.00 0.00 0.00 0.00 51.96 52.56 1nwh s ALA 211 Cb 0.18 -3.34 0.22 0.00 0.00 0.00 0.00 23.12 20.18 1nwh s ALA 211 CO 0.68 -1.65 1.71 -0.44 0.00 0.00 0.00 175.76 176.06 1nwh h ASP 212 N -0.55 0.90 -0.01 0.00 3.32 -1.91 -3.08 116.42 115.09 1nwh h ASP 212 Ca -0.45 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.37 1nwh h ASP 212 Cb 1.25 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1nwh h ASP 212 CO 0.51 0.95 0.00 -0.46 -1.72 0.00 0.00 179.24 178.52 1nwh n ASN 213 N -4.20 0.07 -4.65 6.45 0.23 -1.26 -4.78 115.26 107.12 1nwh n ASN 213 Ca 0.03 -1.38 -0.43 0.00 -0.53 0.00 0.00 54.58 52.27 1nwh n ASN 213 Cb 0.31 -0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.99 1nwh n ASN 213 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 1nwh s PHE 214 N -1.99 3.18 -0.47 -2.53 2.19 -1.16 -4.96 117.98 112.24 1nwh s PHE 214 Ca 0.30 1.29 -0.27 0.00 0.33 0.00 0.00 56.93 58.59 1nwh s PHE 214 Cb 0.14 -3.48 -0.05 0.00 -1.31 0.00 0.00 43.02 38.32 1nwh s PHE 214 CO 0.23 -0.79 2.18 -1.25 1.83 0.00 0.00 175.22 177.43 1nwh s PRO 215 N 3.44 2.50 0.00 10.12 0.04 -1.26 -4.78 135.00 145.06 1nwh s PRO 215 Ca 0.46 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1nwh s PRO 215 Cb -0.15 -4.47 0.00 0.00 0.04 0.00 0.00 34.50 29.93 1nwh s PRO 215 CO 0.11 -2.83 0.76 0.25 0.04 0.00 0.00 177.00 175.33 1nwh n THR 216 N 7.70 0.57 0.15 1.26 -2.24 -1.26 -4.85 114.28 115.62 1nwh n THR 216 Ca 0.30 -0.62 0.12 0.00 -2.27 0.00 0.00 64.05 61.58 1nwh n THR 216 Cb 0.52 0.76 0.65 0.00 -2.10 0.00 0.00 70.33 70.16 1nwh n THR 216 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1nwh h ASP 217 N 0.00 0.02 0.64 3.42 3.45 -1.91 0.57 116.42 122.62 1nwh h ASP 217 Ca 0.00 -0.00 -0.27 0.00 0.43 0.00 0.00 57.03 57.19 1nwh h ASP 217 Cb 0.59 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.34 1nwh h ASP 217 CO 0.00 0.02 -1.33 0.78 -1.57 0.00 0.00 179.24 177.14 1nwh h ASN 218 N 0.03 0.27 0.17 6.45 2.35 -1.94 -3.38 115.58 119.53 1nwh h ASN 218 Ca 0.10 -0.33 -0.34 0.00 -0.55 0.00 0.00 56.30 55.17 1nwh h ASN 218 Cb 0.37 -0.09 -0.06 0.00 0.05 0.00 0.00 38.32 38.59 1nwh h ASN 218 CO -0.00 1.27 -2.15 0.49 -1.65 0.00 0.00 177.43 175.38 1nwh n PHE 219 N -3.42 0.38 -0.65 1.19 3.01 -1.07 -4.99 117.46 111.92 1nwh n PHE 219 Ca -0.10 0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1nwh n PHE 219 Cb 1.01 -1.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 1nwh n PHE 219 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1nwh n GLY 220 N 1.72 0.76 3.66 1.37 0.00 0.20 -4.97 105.19 107.93 1nwh n GLY 220 Ca -0.28 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 1nwh n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nwh s ALA 221 N -2.75 -1.88 0.26 4.61 0.00 -1.23 -5.03 121.76 115.74 1nwh s ALA 221 Ca 0.00 0.58 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 1nwh s ALA 221 Cb 0.00 0.45 -0.09 0.00 0.00 0.00 0.00 23.12 23.48 1nwh s ALA 221 CO 0.00 -0.94 1.09 0.00 0.00 0.00 0.00 175.76 175.92 1nwh s ALA 222 N -2.95 3.40 -0.05 0.00 0.00 -1.26 -4.81 121.76 116.09 1nwh s ALA 222 Ca 0.11 0.87 0.01 0.00 0.00 0.00 0.00 51.96 52.96 1nwh s ALA 222 Cb 0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 1nwh s ALA 222 CO -0.02 -0.15 -0.04 -0.11 0.00 0.00 0.00 175.76 175.44 1nwh n LEU 223 N 1.41 2.47 -0.09 0.00 7.94 -1.26 -4.30 117.00 123.16 1nwh n LEU 223 Ca -0.00 -0.02 -0.02 0.00 -1.11 0.00 0.00 56.01 54.85 1nwh n LEU 223 Cb 0.45 -0.14 -0.02 0.00 0.53 0.00 0.00 43.42 44.24 1nwh n LEU 223 CO 0.54 0.51 0.25 0.61 -1.11 0.00 0.00 177.39 178.18 1nwh n GLY 224 N 3.14 -1.47 1.53 -3.96 0.00 -1.26 -1.48 105.19 101.68 1nwh n GLY 224 Ca -0.09 0.42 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 1nwh n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nwh n GLY 225 N -1.05 5.90 0.00 -0.02 0.00 -1.26 -4.82 105.19 103.94 1nwh n GLY 225 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1nwh n GLY 225 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nwh n SER 226 N -0.87 0.00 -3.61 1.61 2.88 -0.55 -5.15 113.62 107.92 1nwh n SER 226 Ca 0.36 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.80 1nwh n SER 226 Cb 0.87 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.30 1nwh n SER 226 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1nwh s LEU 227 N 0.00 -0.18 -0.22 2.46 0.05 -1.26 -4.36 118.68 115.17 1nwh s LEU 227 Ca 0.00 -0.28 -0.01 0.00 0.05 0.00 0.00 54.13 53.89 1nwh s LEU 227 Cb 0.00 2.36 0.06 0.00 -2.05 0.00 0.00 46.19 46.56 1nwh s LEU 227 CO 0.00 -1.03 -0.01 -0.63 -0.55 0.00 0.00 176.35 174.13 1nwh s ILE 228 N -3.82 1.04 -0.23 1.48 1.01 -0.41 -4.93 121.20 115.35 1nwh s ILE 228 Ca 0.05 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 59.75 1nwh s ILE 228 Cb -0.01 -1.44 0.07 0.00 0.01 0.00 0.00 42.46 41.08 1nwh s ILE 228 CO -0.07 -0.18 2.41 -0.81 0.00 0.00 0.00 174.94 176.29 1nwh n PRO 229 N 4.85 1.79 -3.65 2.79 -0.04 -1.26 -0.41 135.00 139.06 1nwh n PRO 229 Ca -0.10 -1.31 -0.05 0.00 -0.04 0.00 0.00 63.50 62.00 1nwh n PRO 229 Cb 0.45 -1.65 -0.06 0.00 -0.04 0.00 0.00 33.50 32.20 1nwh n PRO 229 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 1nwh s TRP 230 N -1.00 -1.12 -0.08 0.54 -0.11 -1.22 -4.85 118.94 111.09 1nwh s TRP 230 Ca 0.35 2.06 -0.01 0.00 1.22 0.00 0.00 56.10 59.73 1nwh s TRP 230 Cb 0.23 0.63 0.03 0.00 -1.50 0.00 0.00 33.47 32.86 1nwh s TRP 230 CO -0.05 -0.58 -0.03 0.42 -4.62 0.00 0.00 176.95 172.09 1nwh s ILE 231 N 2.41 0.60 0.08 5.86 1.01 -1.26 -4.80 121.20 125.12 1nwh s ILE 231 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.54 1nwh s ILE 231 Cb -0.10 -0.69 0.00 0.00 0.01 0.00 0.00 42.46 41.68 1nwh s ILE 231 CO -0.18 0.29 0.00 -0.67 0.00 0.00 0.00 174.94 174.38 1nwh n ASP 232 N 4.88 -2.31 -4.79 3.58 -0.08 -1.26 -3.79 116.55 112.78 1nwh n ASP 232 Ca -0.12 0.38 -0.31 0.00 -1.51 0.00 0.00 54.79 53.24 1nwh n ASP 232 Cb 0.50 -1.08 0.08 0.00 2.34 0.00 0.00 41.12 42.96 1nwh n ASP 232 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1nwh s LYS 233 N -1.19 2.41 0.27 -0.67 1.02 -1.26 -4.61 119.74 115.71 1nwh s LYS 233 Ca 0.00 1.02 -0.22 0.00 0.02 0.00 0.00 55.97 56.80 1nwh s LYS 233 Cb 0.00 -1.93 -0.09 0.00 -0.52 0.00 0.00 37.83 35.30 1nwh s LYS 233 CO 0.00 -1.49 0.81 -1.17 -0.92 0.00 0.00 175.35 172.58 1nwh s LEU 234 N -5.80 4.31 -0.43 3.17 2.96 -1.26 -0.83 118.68 120.81 1nwh s LEU 234 Ca 0.60 1.57 -0.06 0.00 -0.22 0.00 0.00 54.13 56.02 1nwh s LEU 234 Cb -0.16 -3.80 0.10 0.00 0.50 0.00 0.00 46.19 42.83 1nwh s LEU 234 CO 0.56 -0.03 0.25 -0.76 -1.32 0.00 0.00 176.35 175.05 1nwh s LEU 235 N -2.10 5.31 0.62 -0.68 2.01 -0.21 -4.90 118.68 118.72 1nwh s LEU 235 Ca 0.47 -1.83 0.28 0.00 0.01 0.00 0.00 54.13 53.06 1nwh s LEU 235 Cb -0.17 -1.92 1.46 0.00 0.01 0.00 0.00 46.19 45.57 1nwh s LEU 235 CO 0.21 -0.58 1.85 -0.65 1.01 0.00 0.00 176.35 178.20 1nwh h PRO 236 N 8.26 0.00 -0.00 1.29 0.11 -1.95 -0.45 132.00 139.26 1nwh h PRO 236 Ca -0.18 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.76 1nwh h PRO 236 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1nwh h PRO 236 CO 0.76 0.00 -0.78 0.93 -0.21 0.00 0.00 178.00 178.70 1nwh h GLU 237 N 0.00 0.05 0.00 1.05 4.39 -1.95 -3.37 114.58 114.75 1nwh h GLU 237 Ca 0.14 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.76 1nwh h GLU 237 Cb 1.08 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.74 1nwh h GLU 237 CO -0.00 0.80 -1.22 0.25 -1.16 0.00 0.00 179.01 177.68 1nwh n THR 238 N -3.65 0.11 -0.15 1.13 -2.24 -0.98 -5.01 114.28 103.49 1nwh n THR 238 Ca -0.01 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1nwh n THR 238 Cb 0.74 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1nwh n THR 238 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nwh n GLY 239 N 2.49 0.92 3.85 3.38 0.00 -0.22 -5.05 105.19 110.56 1nwh n GLY 239 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1nwh n GLY 239 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nwh s GLN 240 N -0.64 2.77 0.38 1.61 -0.21 -1.25 -4.81 119.66 117.51 1nwh s GLN 240 Ca 0.00 0.65 0.04 0.00 0.02 0.00 0.00 55.36 56.07 1nwh s GLN 240 Cb 0.00 -2.00 -0.01 0.00 1.00 0.00 0.00 33.01 32.01 1nwh s GLN 240 CO 0.00 -1.14 0.55 0.95 -2.12 0.00 0.00 175.29 173.53 1nwh s THR 241 N -3.21 4.13 0.40 -0.19 -4.23 -1.26 -1.05 115.64 110.23 1nwh s THR 241 Ca 0.58 -0.77 0.08 0.00 -1.18 0.00 0.00 61.69 60.40 1nwh s THR 241 Cb -0.13 -3.47 0.23 0.00 1.34 0.00 0.00 72.50 70.47 1nwh s THR 241 CO 0.53 -0.25 2.01 0.11 -0.54 0.00 0.00 174.62 176.49 1nwh h LYS 242 N 0.69 0.44 -0.59 3.99 1.57 -1.14 -1.14 116.57 120.39 1nwh h LYS 242 Ca -0.46 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.18 1nwh h LYS 242 Cb 1.25 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 1nwh h LYS 242 CO 0.55 0.36 0.01 1.49 -0.57 0.00 0.00 179.45 181.29 1nwh h GLU 243 N 0.44 1.03 -0.06 3.15 4.57 -1.86 -2.16 114.58 119.69 1nwh h GLU 243 Ca 0.11 -0.32 -0.19 0.00 -1.18 0.00 0.00 59.36 57.79 1nwh h GLU 243 Cb 0.08 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1nwh h GLU 243 CO -0.01 1.00 -0.77 0.93 -1.18 0.00 0.00 179.01 178.98 1nwh h GLU 244 N 0.94 0.40 -0.44 1.92 5.08 -1.74 -3.24 114.58 117.51 1nwh h GLU 244 Ca 0.17 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 58.10 1nwh h GLU 244 Cb 0.54 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1nwh h GLU 244 CO 0.03 0.99 -0.07 2.35 -1.00 0.00 0.00 179.01 181.31 1nwh h TRP 245 N 0.26 0.82 0.00 4.33 7.01 -1.02 -2.71 115.95 124.63 1nwh h TRP 245 Ca -0.04 -0.13 0.00 0.00 2.11 0.00 0.00 58.89 60.83 1nwh h TRP 245 Cb 1.36 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 28.20 1nwh h TRP 245 CO 0.05 0.80 0.00 0.87 -2.79 0.00 0.00 178.44 177.36 1nwh h LYS 246 N 0.69 0.00 -0.39 2.65 1.57 -1.41 -2.28 116.57 117.41 1nwh h LYS 246 Ca 0.13 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.77 1nwh h LYS 246 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1nwh h LYS 246 CO 0.03 0.00 -0.30 0.78 -0.57 0.00 0.00 179.45 179.39 1nwh h GLY 247 N 0.83 0.91 0.06 3.86 0.00 -1.60 -1.31 103.07 105.83 1nwh h GLY 247 Ca 0.00 -0.85 -0.09 0.00 0.00 0.00 0.00 47.33 46.39 1nwh h GLY 247 CO 0.00 0.77 -0.50 -1.82 0.00 0.00 0.00 176.54 174.99 1nwh h TYR 248 N 0.71 0.05 -0.22 5.60 3.20 -1.26 -3.30 116.97 121.74 1nwh h TYR 248 Ca 0.08 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 1nwh h TYR 248 Cb 0.85 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 1nwh h TYR 248 CO 0.05 1.20 -0.10 0.00 -1.64 0.00 0.00 178.16 177.66 1nwh h ALA 249 N -0.15 0.31 0.00 1.82 0.00 -1.51 -3.26 119.26 116.47 1nwh h ALA 249 Ca -0.13 -0.29 -0.21 0.00 0.00 0.00 0.00 54.91 54.28 1nwh h ALA 249 Cb 1.16 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1nwh h ALA 249 CO -0.06 0.15 -1.06 0.93 0.00 0.00 0.00 179.25 179.21 1nwh h GLU 250 N 0.16 0.00 -0.41 0.00 5.08 -1.46 -3.02 114.58 114.94 1nwh h GLU 250 Ca 0.05 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1nwh h GLU 250 Cb 0.59 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1nwh h GLU 250 CO 0.03 0.82 0.15 1.15 -1.00 0.00 0.00 179.01 180.16 1nwh h THR 251 N 0.00 1.21 0.00 1.13 2.02 -1.66 -1.74 112.91 113.87 1nwh h THR 251 Ca -0.06 -0.65 -0.09 0.00 0.77 0.00 0.00 66.41 66.38 1nwh h THR 251 Cb 1.75 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 1nwh h THR 251 CO 0.11 0.23 -0.45 0.78 0.37 0.00 0.00 175.52 176.57 1nwh h ASN 252 N 0.52 0.00 0.20 4.18 2.35 -1.67 -2.34 115.58 118.82 1nwh h ASN 252 Ca 0.13 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.58 1nwh h ASN 252 Cb 0.22 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.62 1nwh h ASN 252 CO -0.01 0.45 -1.28 0.50 -1.65 0.00 0.00 177.43 175.44 1nwh h LYS 253 N 0.00 0.58 -0.06 0.81 3.64 -1.38 0.26 116.57 120.42 1nwh h LYS 253 Ca -0.00 -0.81 -0.00 0.00 -1.27 0.00 0.00 60.65 58.57 1nwh h LYS 253 Cb 0.96 0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1nwh h LYS 253 CO 0.06 1.37 0.04 0.82 -2.27 0.00 0.00 179.45 179.46 1nwh h ILE 254 N 0.24 1.04 0.00 2.00 2.04 -1.24 -2.87 117.51 118.72 1nwh h ILE 254 Ca -0.19 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1nwh h ILE 254 Cb 1.95 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.03 1nwh h ILE 254 CO 0.24 0.03 0.00 0.18 0.00 0.00 0.00 178.15 178.60 1nwh n LEU 255 N -5.03 0.80 -0.09 1.44 4.77 -0.89 -4.75 117.00 113.25 1nwh n LEU 255 Ca -0.06 0.61 -0.00 0.00 -0.03 0.00 0.00 56.01 56.53 1nwh n LEU 255 Cb 0.04 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 1nwh n LEU 255 CO 0.33 -0.32 -0.00 0.61 -1.33 0.00 0.00 177.39 176.69 1nwh n GLY 256 N 0.87 0.45 1.64 -0.72 0.00 -0.73 -4.99 105.19 101.71 1nwh n GLY 256 Ca 0.04 -0.86 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 1nwh n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nwh n LEU 257 N -0.09 4.73 0.20 0.99 4.77 0.85 -4.80 117.00 123.65 1nwh n LEU 257 Ca -0.00 -4.36 0.05 0.00 -0.03 0.00 0.00 56.01 51.67 1nwh n LEU 257 Cb 0.50 -0.51 0.42 0.00 -2.33 0.00 0.00 43.42 41.50 1nwh n LEU 257 CO 0.00 1.74 0.76 0.28 -1.33 0.00 0.00 177.39 178.84 1nwh h SER 258 N 1.72 0.00 1.02 -1.43 0.02 -1.90 -2.44 113.55 110.54 1nwh h SER 258 Ca 0.31 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 61.10 1nwh h SER 258 Cb 1.39 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.90 1nwh h SER 258 CO 0.66 0.33 -0.76 0.44 -1.14 0.00 0.00 176.83 176.36 1nwh h ASP 259 N 0.00 0.00 -2.28 3.07 3.32 -1.92 -3.38 116.42 115.22 1nwh h ASP 259 Ca -0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.46 1nwh h ASP 259 Cb 0.67 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.83 1nwh h ASP 259 CO 0.04 0.76 -0.98 -3.20 -1.72 0.00 0.00 179.24 174.14 1nwh n ASN 260 N -3.42 0.05 -4.76 6.45 5.15 -1.15 -5.14 115.26 112.43 1nwh n ASN 260 Ca 0.00 -2.55 -0.39 0.00 -0.60 0.00 0.00 54.58 51.04 1nwh n ASN 260 Cb 0.79 -0.59 0.01 0.00 -0.53 0.00 0.00 39.78 39.46 1nwh n ASN 260 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1nwh s PRO 261 N -0.50 3.73 -0.21 1.20 0.04 -0.93 -4.89 135.00 133.44 1nwh s PRO 261 Ca 0.33 2.13 -0.15 0.00 0.04 0.00 0.00 61.00 63.36 1nwh s PRO 261 Cb 0.08 -2.58 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 1nwh s PRO 261 CO -0.16 -0.68 0.36 0.42 0.04 0.00 0.00 177.00 176.98 1nwh s ILE 262 N -1.31 5.22 -0.17 0.56 1.01 -1.26 -5.04 121.20 120.21 1nwh s ILE 262 Ca 0.62 0.63 -0.29 0.00 0.00 0.00 0.00 60.65 61.60 1nwh s ILE 262 Cb -0.37 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 1nwh s ILE 262 CO 0.47 0.26 1.71 -2.84 0.00 0.00 0.00 174.94 174.54 1nwh s PRO 263 N 1.30 3.83 -0.19 2.79 0.02 -1.26 -4.89 135.00 136.60 1nwh s PRO 263 Ca 0.17 1.87 -0.01 0.00 0.02 0.00 0.00 61.00 63.06 1nwh s PRO 263 Cb -0.15 -4.07 0.05 0.00 0.02 0.00 0.00 34.50 30.36 1nwh s PRO 263 CO 0.07 -1.26 -0.02 0.08 -0.33 0.00 0.00 177.00 175.54 1nwh s VAL 264 N 5.23 1.04 0.06 3.83 1.01 -1.26 -0.98 120.40 129.33 1nwh s VAL 264 Ca 0.76 -0.77 -0.17 0.00 0.00 0.00 0.00 61.98 61.80 1nwh s VAL 264 Cb -0.29 -1.35 0.03 0.00 0.00 0.00 0.00 36.38 34.78 1nwh s VAL 264 CO 0.31 -0.04 0.39 -0.62 0.00 0.00 0.00 175.10 175.14 1nwh s ASP 265 N 1.64 -0.24 0.00 3.32 -1.08 -0.92 -2.76 116.67 116.63 1nwh s ASP 265 Ca -0.02 -0.12 0.00 0.00 -0.52 0.00 0.00 52.55 51.89 1nwh s ASP 265 Cb -0.17 0.43 0.00 0.00 -1.46 0.00 0.00 42.92 41.72 1nwh s ASP 265 CO -0.07 -0.71 0.00 0.61 0.52 0.00 0.00 175.17 175.52 1nwh n GLY 266 N 0.32 -0.55 3.40 2.66 0.00 -1.26 -1.44 105.19 108.32 1nwh n GLY 266 Ca -0.18 -0.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 1nwh n GLY 266 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nwh s LEU 267 N 0.00 2.78 -0.33 0.99 1.43 -0.25 -4.89 118.68 118.41 1nwh s LEU 267 Ca 0.00 -0.29 -0.12 0.00 -1.03 0.00 0.00 54.13 52.69 1nwh s LEU 267 Cb 0.00 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.58 1nwh s LEU 267 CO 0.00 0.18 0.21 0.00 0.23 0.00 0.00 176.35 176.97 1nwh s VAL 269 N 1.68 2.07 -0.20 0.00 1.01 -1.21 -3.45 120.40 120.29 1nwh s VAL 269 Ca 0.05 -1.05 -0.19 0.00 0.00 0.00 0.00 61.98 60.79 1nwh s VAL 269 Cb -0.17 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1nwh s VAL 269 CO 0.09 0.57 0.57 -0.60 0.00 0.00 0.00 175.10 175.73 1nwh s ARG 270 N -0.02 4.20 0.45 2.72 3.52 0.45 0.30 118.95 130.57 1nwh s ARG 270 Ca -0.08 0.50 0.04 0.00 -0.13 0.00 0.00 55.73 56.07 1nwh s ARG 270 Cb -0.15 -3.57 -0.05 0.00 -1.56 0.00 0.00 34.95 29.62 1nwh s ARG 270 CO 0.05 -0.20 0.01 0.96 -0.81 0.00 0.00 175.30 175.31 1nwh s ILE 271 N 1.79 1.64 0.00 4.11 -4.36 0.28 -1.28 121.20 123.37 1nwh s ILE 271 Ca 0.26 -1.99 -0.04 0.00 -0.26 0.00 0.00 60.65 58.61 1nwh s ILE 271 Cb -0.16 -2.63 -0.19 0.00 1.25 0.00 0.00 42.46 40.74 1nwh s ILE 271 CO 0.10 0.00 2.74 0.61 0.24 0.00 0.00 174.94 178.63 1nwh n GLY 272 N -1.11 2.46 3.58 6.27 0.00 -1.26 -4.33 105.19 110.80 1nwh n GLY 272 Ca -0.11 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.81 1nwh n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nwh s ALA 273 N 1.44 2.98 -0.15 4.61 0.00 -1.26 -5.03 121.76 124.35 1nwh s ALA 273 Ca 0.47 -1.50 -0.20 0.00 0.00 0.00 0.00 51.96 50.72 1nwh s ALA 273 Cb 0.22 -0.74 -0.18 0.00 0.00 0.00 0.00 23.12 22.42 1nwh s ALA 273 CO 0.00 0.43 0.43 -0.07 0.00 0.00 0.00 175.76 176.55 1nwh h LEU 274 N 2.74 0.00 0.00 0.00 3.38 -1.94 -0.82 115.31 118.67 1nwh h LEU 274 Ca -0.46 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 56.89 1nwh h LEU 274 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1nwh h LEU 274 CO 0.55 0.99 -0.34 0.54 0.09 0.00 0.00 178.44 180.28 1nwh n ARG 275 N -4.61 3.50 -4.35 1.13 1.74 -1.26 -2.17 116.66 110.64 1nwh n ARG 275 Ca -0.13 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.61 1nwh n ARG 275 Cb 0.41 -0.60 -0.11 0.00 -1.02 0.00 0.00 32.46 31.15 1nwh n ARG 275 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nwh s HIS 277 N -0.18 3.45 0.05 0.00 3.76 -0.52 -3.65 115.29 118.20 1nwh s HIS 277 Ca 0.04 0.62 0.08 0.00 -0.15 0.00 0.00 55.06 55.64 1nwh s HIS 277 Cb -0.13 -2.39 -0.03 0.00 1.11 0.00 0.00 32.58 31.14 1nwh s HIS 277 CO 0.02 0.19 -0.19 -1.12 -0.85 0.00 0.00 174.74 172.78 1nwh s SER 278 N 0.60 3.71 -0.00 1.40 0.01 -0.32 -1.95 113.70 117.15 1nwh s SER 278 Ca 0.18 -0.46 0.02 0.00 1.31 0.00 0.00 55.95 56.99 1nwh s SER 278 Cb -0.13 -0.56 -0.00 0.00 0.21 0.00 0.00 66.02 65.53 1nwh s SER 278 CO 0.05 0.25 -0.05 -1.10 0.41 0.00 0.00 173.24 172.80 1nwh s GLN 279 N -1.47 0.40 -0.20 12.44 -0.21 -0.54 0.34 119.66 130.42 1nwh s GLN 279 Ca 0.14 -0.19 -0.05 0.00 0.02 0.00 0.00 55.36 55.28 1nwh s GLN 279 Cb -0.10 -0.38 -0.02 0.00 1.00 0.00 0.00 33.01 33.50 1nwh s GLN 279 CO 0.05 0.10 0.00 0.00 -2.12 0.00 0.00 175.29 173.33 1nwh s ALA 280 N -0.15 3.04 0.18 6.09 0.00 0.11 -1.43 121.76 129.60 1nwh s ALA 280 Ca 0.02 -1.00 0.11 0.00 0.00 0.00 0.00 51.96 51.09 1nwh s ALA 280 Cb -0.02 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 1nwh s ALA 280 CO -0.00 -0.17 -0.21 -0.06 0.00 0.00 0.00 175.76 175.32 1nwh s PHE 281 N 1.03 2.38 -0.29 0.00 2.99 0.93 -1.46 117.98 123.56 1nwh s PHE 281 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 56.93 56.61 1nwh s PHE 281 Cb -0.14 -1.20 0.09 0.00 0.00 0.00 0.00 43.02 41.77 1nwh s PHE 281 CO 0.02 0.47 0.09 0.99 -0.00 0.00 0.00 175.22 176.79 1nwh s THR 282 N -1.55 0.78 -0.25 0.64 2.01 -0.84 -2.31 115.64 114.12 1nwh s THR 282 Ca 0.20 -1.24 -0.08 0.00 0.31 0.00 0.00 61.69 60.88 1nwh s THR 282 Cb -0.09 -1.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1nwh s THR 282 CO 0.10 -0.61 0.10 -0.63 -0.69 0.00 0.00 174.62 172.90 1nwh s ILE 283 N 1.68 4.65 -0.36 1.82 1.01 0.43 -0.96 121.20 129.46 1nwh s ILE 283 Ca 0.08 -0.06 -0.19 0.00 0.00 0.00 0.00 60.65 60.48 1nwh s ILE 283 Cb -0.17 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.12 1nwh s ILE 283 CO -0.24 0.33 0.57 -0.75 0.00 0.00 0.00 174.94 174.85 1nwh s LYS 284 N 1.51 3.61 0.35 2.79 2.47 -0.58 -0.01 119.74 129.89 1nwh s LYS 284 Ca 0.06 -0.10 -0.03 0.00 -1.56 0.00 0.00 55.97 54.34 1nwh s LYS 284 Cb -0.15 -3.82 -0.04 0.00 -1.46 0.00 0.00 37.83 32.36 1nwh s LYS 284 CO 0.05 -0.70 0.61 -0.51 0.16 0.00 0.00 175.35 174.96 1nwh s LEU 285 N 2.53 3.94 0.27 5.43 1.43 0.12 -1.33 118.68 131.08 1nwh s LEU 285 Ca 0.21 0.69 0.14 0.00 -1.03 0.00 0.00 54.13 54.14 1nwh s LEU 285 Cb -0.15 -3.55 0.14 0.00 0.03 0.00 0.00 46.19 42.66 1nwh s LEU 285 CO 0.14 -0.32 1.47 0.11 0.23 0.00 0.00 176.35 177.99 1nwh h LYS 286 N 1.05 0.00 -5.66 1.70 1.57 -0.83 -3.45 116.57 110.95 1nwh h LYS 286 Ca -0.48 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.83 1nwh h LYS 286 Cb 1.20 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.35 1nwh h LYS 286 CO 0.63 0.56 -0.76 0.15 -0.57 0.00 0.00 179.45 179.47 1nwh s LYS 287 N -3.05 1.25 -0.34 3.15 1.02 -1.26 -5.11 119.74 115.39 1nwh s LYS 287 Ca 0.03 -1.46 -0.19 0.00 0.02 0.00 0.00 55.97 54.38 1nwh s LYS 287 Cb 0.09 -1.14 -0.00 0.00 -0.52 0.00 0.00 37.83 36.25 1nwh s LYS 287 CO 0.75 0.21 0.54 0.34 -0.92 0.00 0.00 175.35 176.27 1nwh s ASP 288 N -2.92 6.35 0.09 2.83 -1.08 -1.26 -4.74 116.67 115.94 1nwh s ASP 288 Ca 0.17 0.06 0.06 0.00 -0.52 0.00 0.00 52.55 52.32 1nwh s ASP 288 Cb -0.03 -2.28 -0.03 0.00 -1.46 0.00 0.00 42.92 39.11 1nwh s ASP 288 CO 0.06 -0.49 -0.15 -0.76 0.52 0.00 0.00 175.17 174.35 1nwh s LEU 289 N 2.45 2.33 0.57 -1.34 1.02 -1.26 -5.10 118.68 117.36 1nwh s LEU 289 Ca 0.20 -0.70 -0.20 0.00 0.02 0.00 0.00 54.13 53.45 1nwh s LEU 289 Cb -0.15 -0.55 -0.04 0.00 0.02 0.00 0.00 46.19 45.46 1nwh s LEU 289 CO 0.13 -0.10 1.23 -2.84 0.02 0.00 0.00 176.35 174.80 1nwh s PRO 290 N -2.13 3.07 0.39 1.29 0.02 -1.26 -4.89 135.00 131.49 1nwh s PRO 290 Ca 0.03 1.90 0.06 0.00 0.02 0.00 0.00 61.00 63.01 1nwh s PRO 290 Cb -0.08 -2.03 0.80 0.00 0.02 0.00 0.00 34.50 33.21 1nwh s PRO 290 CO 0.03 -1.14 2.03 1.25 -0.33 0.00 0.00 177.00 178.83 1nwh h LEU 291 N 1.10 0.50 -0.91 -5.54 5.85 -2.00 -2.24 115.31 112.07 1nwh h LEU 291 Ca -0.50 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.11 1nwh h LEU 291 Cb 1.29 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 1nwh h LEU 291 CO 0.56 0.39 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.90 1nwh h GLU 292 N 0.58 0.72 -0.15 1.25 4.81 -1.99 -2.02 114.58 117.78 1nwh h GLU 292 Ca 0.15 -0.21 -0.16 0.00 -0.13 0.00 0.00 59.36 59.01 1nwh h GLU 292 Cb -0.01 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1nwh h GLU 292 CO -0.03 0.78 -0.60 1.49 -0.73 0.00 0.00 179.01 179.93 1nwh h GLU 293 N 0.66 0.49 -0.39 1.92 4.81 -1.79 -2.35 114.58 117.93 1nwh h GLU 293 Ca 0.12 -0.33 -0.15 0.00 -0.13 0.00 0.00 59.36 58.87 1nwh h GLU 293 Cb 0.52 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1nwh h GLU 293 CO 0.03 0.94 -0.36 0.82 -0.73 0.00 0.00 179.01 179.71 1nwh h ILE 294 N 0.37 1.27 -0.42 2.32 2.04 -1.22 -2.01 117.51 119.86 1nwh h ILE 294 Ca -0.00 -1.53 -0.06 0.00 1.00 0.00 0.00 64.86 64.27 1nwh h ILE 294 Cb 1.14 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 1nwh h ILE 294 CO 0.11 0.51 0.03 -0.33 0.00 0.00 0.00 178.15 178.47 1nwh h GLU 295 N 0.76 0.67 -0.00 2.37 5.08 -1.30 -2.40 114.58 119.76 1nwh h GLU 295 Ca 0.07 -0.15 -0.18 0.00 -1.00 0.00 0.00 59.36 58.10 1nwh h GLU 295 Cb 0.94 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 1nwh h GLU 295 CO 0.09 0.66 -0.82 1.96 -1.00 0.00 0.00 179.01 179.90 1nwh h GLN 296 N 0.64 0.09 -0.42 2.33 4.20 -1.28 -2.40 115.11 118.26 1nwh h GLN 296 Ca 0.13 -0.09 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1nwh h GLN 296 Cb 0.35 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1nwh h GLN 296 CO 0.01 0.86 -0.16 0.82 -0.67 0.00 0.00 178.83 179.69 1nwh h ILE 297 N 0.05 1.28 0.00 2.54 1.08 -0.99 -2.22 117.51 119.25 1nwh h ILE 297 Ca -0.02 -1.28 -0.06 0.00 -0.39 0.00 0.00 64.86 63.11 1nwh h ILE 297 Cb 1.43 1.22 -0.01 0.00 -3.07 0.00 0.00 36.82 36.40 1nwh h ILE 297 CO 0.11 0.43 -0.30 0.16 -0.69 0.00 0.00 178.15 177.86 1nwh h ILE 298 N 0.67 0.44 0.00 -0.67 3.07 -1.48 -3.27 117.51 116.27 1nwh h ILE 298 Ca 0.10 -1.63 -0.20 0.00 1.55 0.00 0.00 64.86 64.67 1nwh h ILE 298 Cb 0.71 2.20 -0.03 0.00 -0.27 0.00 0.00 36.82 39.43 1nwh h ILE 298 CO 0.05 0.25 -1.01 0.00 -1.05 0.00 0.00 178.15 176.40 1nwh h ALA 299 N 1.74 0.43 0.00 0.16 0.00 -1.39 -3.31 119.26 116.89 1nwh h ALA 299 Ca -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1nwh h ALA 299 Cb 1.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1nwh h ALA 299 CO 0.03 1.20 0.00 0.43 0.00 0.00 0.00 179.25 180.91 1nwh n SER 300 N -3.30 0.82 0.07 0.00 7.64 -0.84 -4.28 113.62 113.73 1nwh n SER 300 Ca -0.01 0.58 -0.13 0.00 1.01 0.00 0.00 58.87 60.32 1nwh n SER 300 Cb 0.92 -0.80 -0.07 0.00 -1.01 0.00 0.00 64.21 63.25 1nwh n SER 300 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 1nwh h HIS 301 N 0.00 -0.09 -3.92 1.43 6.17 -1.65 -3.47 115.15 113.63 1nwh h HIS 301 Ca 0.00 -0.00 -0.11 0.00 0.71 0.00 0.00 60.37 60.97 1nwh h HIS 301 Cb 0.73 0.03 -0.12 0.00 2.52 0.00 0.00 27.41 30.57 1nwh h HIS 301 CO 0.00 -0.02 -0.30 0.54 0.71 0.00 0.00 177.93 178.87 1nwh s ASN 302 N -5.15 0.01 0.00 3.26 2.20 -1.26 -5.01 114.94 108.99 1nwh s ASN 302 Ca -0.14 -0.98 0.29 0.00 -0.94 0.00 0.00 52.86 51.09 1nwh s ASN 302 Cb 0.05 0.48 1.23 0.00 -2.00 0.00 0.00 41.25 41.02 1nwh s ASN 302 CO 0.66 -0.98 1.93 -1.84 -2.94 0.00 0.00 177.10 173.93 1nwh n GLU 303 N -0.29 0.00 -0.02 3.55 0.28 -1.26 -3.89 120.64 119.01 1nwh n GLU 303 Ca -0.04 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.93 1nwh n GLU 303 Cb 0.63 -1.50 -0.13 0.00 1.43 0.00 0.00 31.44 31.87 1nwh n GLU 303 CO 0.00 0.00 0.00 0.91 -0.16 0.00 0.00 177.13 177.88 1nwh n TRP 304 N -1.51 0.61 -2.14 -1.84 8.01 -1.26 -4.91 117.44 114.40 1nwh n TRP 304 Ca 0.07 0.21 -0.41 0.00 -1.31 0.00 0.00 57.50 56.06 1nwh n TRP 304 Cb 0.34 -1.02 -0.03 0.00 -2.01 0.00 0.00 31.31 28.59 1nwh n TRP 304 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 1nwh s VAL 305 N -2.80 2.93 -0.18 -0.99 0.11 -1.25 -1.45 120.40 116.77 1nwh s VAL 305 Ca -0.06 0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 59.79 1nwh s VAL 305 Cb 0.08 -3.52 0.05 0.00 -1.53 0.00 0.00 36.38 31.47 1nwh s VAL 305 CO 0.83 0.14 -0.01 -0.75 -3.33 0.00 0.00 175.10 171.98 1nwh s LYS 306 N -0.61 1.03 -0.24 1.54 2.20 -0.77 -4.90 119.74 117.98 1nwh s LYS 306 Ca 0.55 -0.49 -0.29 0.00 -0.36 0.00 0.00 55.97 55.39 1nwh s LYS 306 Cb -0.39 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.90 1nwh s LYS 306 CO 0.43 -0.54 1.14 0.08 -0.36 0.00 0.00 175.35 176.10 1nwh s VAL 307 N 1.73 4.47 -0.23 4.02 1.01 -1.26 -0.99 120.40 129.16 1nwh s VAL 307 Ca -0.01 1.75 -0.15 0.00 0.00 0.00 0.00 61.98 63.57 1nwh s VAL 307 Cb -0.16 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 1nwh s VAL 307 CO -0.07 -0.28 0.37 -0.63 0.00 0.00 0.00 175.10 174.49 1nwh s ILE 308 N 3.53 5.20 0.53 2.22 -1.09 -0.02 -4.95 121.20 126.63 1nwh s ILE 308 Ca 0.49 0.62 -0.22 0.00 -2.23 0.00 0.00 60.65 59.30 1nwh s ILE 308 Cb -0.16 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 36.96 1nwh s ILE 308 CO 0.13 0.22 1.38 -2.65 -1.23 0.00 0.00 174.94 172.79 1nwh n PRO 309 N 4.78 1.81 -0.99 2.79 -0.02 -1.26 -4.31 135.00 137.80 1nwh n PRO 309 Ca -0.09 0.66 -0.30 0.00 -2.02 0.00 0.00 63.50 61.75 1nwh n PRO 309 Cb 0.51 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.37 1nwh n PRO 309 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1nwh n ASN 310 N -0.87 5.20 -4.08 2.55 5.15 -1.26 -4.56 115.26 117.39 1nwh n ASN 310 Ca 0.09 -2.46 -0.20 0.00 -0.60 0.00 0.00 54.58 51.42 1nwh n ASN 310 Cb 0.44 -1.23 -0.14 0.00 -0.53 0.00 0.00 39.78 38.32 1nwh n ASN 310 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1nwh s ASP 311 N 3.42 1.36 0.09 1.20 2.15 -1.26 -5.08 116.67 118.55 1nwh s ASP 311 Ca 0.49 -0.29 -0.34 0.00 0.43 0.00 0.00 52.55 52.84 1nwh s ASP 311 Cb 0.13 -0.12 -0.15 0.00 -0.30 0.00 0.00 42.92 42.48 1nwh s ASP 311 CO -0.02 0.08 1.53 0.50 -0.17 0.00 0.00 175.17 177.10 1nwh h LYS 312 N 5.51 -0.79 -0.62 4.34 3.64 -1.99 -1.38 116.57 125.29 1nwh h LYS 312 Ca -0.34 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.09 1nwh h LYS 312 Cb 1.18 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.15 1nwh h LYS 312 CO 0.47 -0.52 0.36 1.49 -2.27 0.00 0.00 179.45 178.97 1nwh h GLU 313 N -0.82 0.84 0.02 1.90 4.81 -1.98 -1.48 114.58 117.87 1nwh h GLU 313 Ca -0.03 -0.08 -0.20 0.00 -0.13 0.00 0.00 59.36 58.92 1nwh h GLU 313 Cb 0.77 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1nwh h GLU 313 CO -0.20 0.60 -0.92 0.82 -0.73 0.00 0.00 179.01 178.58 1nwh h ILE 314 N 0.85 1.53 -0.21 2.32 5.03 -1.90 -2.69 117.51 122.44 1nwh h ILE 314 Ca 0.22 -2.78 -0.07 0.00 -0.12 0.00 0.00 64.86 62.12 1nwh h ILE 314 Cb -0.01 2.56 -0.00 0.00 -3.03 0.00 0.00 36.82 36.34 1nwh h ILE 314 CO -0.04 0.80 -0.13 0.74 -0.68 0.00 0.00 178.15 178.85 1nwh h THR 315 N 0.08 1.31 -0.21 -0.27 2.02 -0.76 -0.46 112.91 114.62 1nwh h THR 315 Ca -0.04 -1.22 -0.04 0.00 0.77 0.00 0.00 66.41 65.87 1nwh h THR 315 Cb 1.57 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 69.63 1nwh h THR 315 CO 0.14 0.37 -0.07 -0.07 0.37 0.00 0.00 175.52 176.26 1nwh h LEU 316 N 0.16 0.29 0.06 2.58 4.07 -1.33 -0.00 115.31 121.14 1nwh h LEU 316 Ca 0.04 -0.05 -0.28 0.00 0.08 0.00 0.00 57.88 57.68 1nwh h LEU 316 Cb 0.63 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.27 1nwh h LEU 316 CO 0.04 0.40 -1.42 -0.09 -1.08 0.00 0.00 178.44 176.29 1nwh h ARG 317 N 0.30 0.12 0.00 1.13 2.43 -1.40 -3.43 114.38 113.53 1nwh h ARG 317 Ca 0.07 -0.21 -0.28 0.00 -0.81 0.00 0.00 59.98 58.75 1nwh h ARG 317 Cb 0.32 0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.90 1nwh h ARG 317 CO 0.01 0.94 -2.01 0.39 -1.51 0.00 0.00 179.97 177.79 1nwh n GLU 318 N -3.33 0.43 -1.94 0.20 -0.58 -0.19 -4.76 120.64 110.47 1nwh n GLU 318 Ca -0.12 0.12 -0.37 0.00 -0.42 0.00 0.00 57.16 56.37 1nwh n GLU 318 Cb 1.02 -1.31 -0.01 0.00 -0.57 0.00 0.00 31.44 30.57 1nwh n GLU 318 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1nwh n LEU 319 N -3.22 7.54 -3.95 -4.62 7.94 -0.03 -4.68 117.00 116.00 1nwh n LEU 319 Ca -0.33 -4.74 -0.09 0.00 -1.11 0.00 0.00 56.01 49.75 1nwh n LEU 319 Cb 0.81 -1.29 -0.10 0.00 0.53 0.00 0.00 43.42 43.38 1nwh n LEU 319 CO 0.14 1.96 -0.24 0.42 -1.11 0.00 0.00 177.39 178.56 1nwh s THR 320 N -1.99 0.13 0.45 1.96 -4.23 -1.26 -4.91 115.64 105.79 1nwh s THR 320 Ca 0.53 -1.11 0.13 0.00 -1.18 0.00 0.00 61.69 60.06 1nwh s THR 320 Cb 0.25 -0.84 0.21 0.00 1.34 0.00 0.00 72.50 73.46 1nwh s THR 320 CO -0.15 -0.61 2.03 -0.65 -0.54 0.00 0.00 174.62 174.70 1nwh h PRO 321 N 3.78 0.12 -0.93 3.99 0.11 -1.94 -2.29 132.00 134.85 1nwh h PRO 321 Ca -0.32 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.82 1nwh h PRO 321 Cb 1.18 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 1nwh h PRO 321 CO 0.50 0.20 0.60 0.00 -0.21 0.00 0.00 178.00 179.08 1nwh h ALA 322 N 1.82 1.26 0.01 -0.75 0.00 -1.97 -1.74 119.26 117.89 1nwh h ALA 322 Ca 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1nwh h ALA 322 Cb 0.20 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1nwh h ALA 322 CO 0.01 0.41 -0.13 -0.22 0.00 0.00 0.00 179.25 179.32 1nwh h LYS 323 N 1.12 0.07 0.00 0.00 1.63 -1.77 -3.38 116.57 114.24 1nwh h LYS 323 Ca 0.39 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 1nwh h LYS 323 Cb 0.09 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.75 1nwh h LYS 323 CO -0.15 0.93 -0.24 1.33 -3.45 0.00 0.00 179.45 177.87 1nwh n VAL 324 N -4.58 0.18 -1.67 2.00 0.24 -0.89 -4.89 118.33 108.72 1nwh n VAL 324 Ca -0.10 -0.11 -0.47 0.00 -2.04 0.00 0.00 64.34 61.62 1nwh n VAL 324 Cb 0.48 -0.26 -0.04 0.00 -1.47 0.00 0.00 33.84 32.55 1nwh n VAL 324 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1nwh n THR 325 N -1.76 0.31 -1.00 3.34 -1.04 -0.66 -1.72 114.28 111.75 1nwh n THR 325 Ca 0.06 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1nwh n THR 325 Cb 0.37 -1.70 0.00 0.00 -1.82 0.00 0.00 70.33 67.18 1nwh n THR 325 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nwh n GLY 326 N 3.93 0.55 3.59 3.41 0.00 -1.26 -5.04 105.19 110.39 1nwh n GLY 326 Ca 0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 1nwh n GLY 326 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nwh s THR 327 N -2.24 2.76 -2.43 2.61 -4.23 -0.70 -5.04 115.64 106.38 1nwh s THR 327 Ca 0.00 -2.07 0.26 0.00 -1.18 0.00 0.00 61.69 58.70 1nwh s THR 327 Cb 0.00 -2.69 0.52 0.00 1.34 0.00 0.00 72.50 71.67 1nwh s THR 327 CO 0.00 -0.28 1.68 0.18 -0.54 0.00 0.00 174.62 175.66 1nwh n LEU 328 N -0.86 1.56 -4.74 4.79 4.77 -1.26 -4.60 117.00 116.66 1nwh n LEU 328 Ca -0.05 -0.57 -0.41 0.00 -0.03 0.00 0.00 56.01 54.95 1nwh n LEU 328 Cb 0.61 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.63 1nwh n LEU 328 CO 0.41 0.28 0.86 -0.55 -1.33 0.00 0.00 177.39 177.06 1nwh s SER 329 N -1.86 7.14 -0.65 -1.43 0.15 -1.26 -4.84 113.70 110.95 1nwh s SER 329 Ca 0.36 2.17 0.05 0.00 0.70 0.00 0.00 55.95 59.23 1nwh s SER 329 Cb 0.20 -2.60 0.16 0.00 -1.71 0.00 0.00 66.02 62.07 1nwh s SER 329 CO 0.31 -0.34 0.43 -0.69 1.20 0.00 0.00 173.24 174.16 1nwh s VAL 330 N -0.00 2.66 0.29 4.45 1.01 -0.53 -4.61 120.40 123.66 1nwh s VAL 330 Ca 0.52 -3.96 -0.29 0.00 0.00 0.00 0.00 61.98 58.25 1nwh s VAL 330 Cb -0.31 -2.77 -0.09 0.00 0.00 0.00 0.00 36.38 33.20 1nwh s VAL 330 CO 0.35 -0.97 1.04 -2.16 0.00 0.00 0.00 175.10 173.36 1nwh s PRO 331 N -1.10 4.64 -0.06 2.72 0.04 -1.20 -1.85 135.00 138.19 1nwh s PRO 331 Ca 0.23 1.64 0.01 0.00 0.04 0.00 0.00 61.00 62.93 1nwh s PRO 331 Cb -0.09 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 31.36 1nwh s PRO 331 CO -0.13 0.26 -0.09 0.54 0.04 0.00 0.00 177.00 177.63 1nwh s VAL 332 N -1.26 0.87 0.00 -0.36 0.11 -0.16 -2.15 120.40 117.45 1nwh s VAL 332 Ca 0.46 -0.31 0.00 0.00 -2.93 0.00 0.00 61.98 59.19 1nwh s VAL 332 Cb -0.28 -0.84 0.00 0.00 -1.53 0.00 0.00 36.38 33.73 1nwh s VAL 332 CO 0.36 0.30 0.00 0.61 -3.33 0.00 0.00 175.10 173.04 1nwh n GLY 333 N 4.02 4.65 2.49 6.54 0.00 0.05 -0.84 105.19 122.10 1nwh n GLY 333 Ca -0.23 -1.19 -0.18 0.00 0.00 0.00 0.00 46.02 44.43 1nwh n GLY 333 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nwh n ARG 334 N 0.00 -2.17 -2.51 1.61 5.12 -1.26 -1.34 116.66 116.11 1nwh n ARG 334 Ca 0.00 0.83 -0.43 0.00 -1.93 0.00 0.00 57.85 56.33 1nwh n ARG 334 Cb 0.00 -5.49 -0.02 0.00 -1.16 0.00 0.00 32.46 25.79 1nwh n ARG 334 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1nwh s LEU 335 N -5.95 4.03 0.23 0.55 1.43 -1.25 -4.00 118.68 113.73 1nwh s LEU 335 Ca 0.03 1.37 -0.22 0.00 -1.03 0.00 0.00 54.13 54.29 1nwh s LEU 335 Cb -0.02 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 42.71 1nwh s LEU 335 CO 0.04 -0.86 0.87 0.00 0.23 0.00 0.00 176.35 176.64 1nwh s ARG 336 N 3.66 1.56 -0.03 1.70 1.70 -1.20 -4.88 118.95 121.46 1nwh s ARG 336 Ca 0.51 -0.92 -0.15 0.00 -0.47 0.00 0.00 55.73 54.70 1nwh s ARG 336 Cb -0.17 0.50 -0.05 0.00 -0.57 0.00 0.00 34.95 34.65 1nwh s ARG 336 CO 0.15 -0.72 0.41 0.15 -1.08 0.00 0.00 175.30 174.21 1nwh s LYS 337 N -3.15 4.02 0.61 3.89 -0.14 -1.26 -1.05 119.74 122.66 1nwh s LYS 337 Ca 0.14 0.39 -0.08 0.00 -1.36 0.00 0.00 55.97 55.05 1nwh s LYS 337 Cb -0.04 -3.28 -0.01 0.00 -1.68 0.00 0.00 37.83 32.83 1nwh s LYS 337 CO 0.06 0.56 0.96 -0.51 -0.76 0.00 0.00 175.35 175.66 1nwh s LEU 338 N -0.65 3.21 0.34 3.17 1.43 0.02 -4.89 118.68 121.31 1nwh s LEU 338 Ca 0.23 1.03 0.24 0.00 -1.03 0.00 0.00 54.13 54.61 1nwh s LEU 338 Cb -0.16 -3.92 1.21 0.00 0.03 0.00 0.00 46.19 43.35 1nwh s LEU 338 CO 0.12 -1.01 1.74 0.00 0.23 0.00 0.00 176.35 177.44 1nwh h ALA 339 N -0.27 1.00 0.00 4.21 0.00 -1.98 -2.97 119.26 119.25 1nwh h ALA 339 Ca -0.45 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1nwh h ALA 339 Cb 1.23 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1nwh h ALA 339 CO 0.62 0.00 -0.37 0.52 0.00 0.00 0.00 179.25 180.02 1nwh h MET 340 N 0.00 0.00 0.00 0.00 2.86 -1.93 -3.48 114.93 112.38 1nwh h MET 340 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1nwh h MET 340 Cb 0.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1nwh h MET 340 CO 0.00 0.37 0.00 0.41 1.06 0.00 0.00 176.91 178.75 1nwh n GLY 341 N 0.20 1.94 0.04 8.32 0.00 -1.12 -4.98 105.19 109.58 1nwh n GLY 341 Ca -0.00 -1.04 0.10 0.00 0.00 0.00 0.00 46.02 45.08 1nwh n GLY 341 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1nwh n PRO 342 N -0.86 0.06 0.00 1.61 -0.02 -1.26 -2.56 135.00 131.97 1nwh n PRO 342 Ca 0.00 0.22 0.12 0.00 -2.02 0.00 0.00 63.50 61.83 1nwh n PRO 342 Cb 0.00 -1.60 0.22 0.00 -0.02 0.00 0.00 33.50 32.10 1nwh n PRO 342 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1nwh n GLU 343 N -1.72 1.57 -3.43 -0.52 1.02 -1.26 -4.59 120.64 111.72 1nwh n GLU 343 Ca 0.04 -1.17 -0.41 0.00 -0.02 0.00 0.00 57.16 55.60 1nwh n GLU 343 Cb 0.25 -1.48 -0.10 0.00 -0.02 0.00 0.00 31.44 30.09 1nwh n GLU 343 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1nwh s TYR 344 N -2.23 3.21 -0.14 -0.32 2.02 -1.06 0.15 117.35 118.98 1nwh s TYR 344 Ca 0.27 -0.17 -0.03 0.00 -0.37 0.00 0.00 57.07 56.76 1nwh s TYR 344 Cb 0.20 -2.65 -0.03 0.00 -0.40 0.00 0.00 41.96 39.08 1nwh s TYR 344 CO 0.43 -0.47 -0.04 -1.17 -1.57 0.00 0.00 175.55 172.73 1nwh s LEU 345 N 1.93 3.24 -0.00 -1.29 2.96 0.99 -0.80 118.68 125.71 1nwh s LEU 345 Ca 0.10 -0.11 -0.15 0.00 -0.22 0.00 0.00 54.13 53.74 1nwh s LEU 345 Cb -0.17 -1.77 -0.06 0.00 0.50 0.00 0.00 46.19 44.69 1nwh s LEU 345 CO 0.11 0.19 0.41 0.00 -1.32 0.00 0.00 176.35 175.75 1nwh s ALA 346 N 0.21 3.69 -0.20 5.97 0.00 -0.22 -0.43 121.76 130.78 1nwh s ALA 346 Ca -0.02 -0.22 -0.22 0.00 0.00 0.00 0.00 51.96 51.50 1nwh s ALA 346 Cb -0.14 -2.40 0.06 0.00 0.00 0.00 0.00 23.12 20.64 1nwh s ALA 346 CO 0.03 0.46 0.60 0.00 0.00 0.00 0.00 175.76 176.86 1nwh s ALA 347 N -1.01 -1.50 -0.03 0.00 0.00 -0.98 -3.21 121.76 115.02 1nwh s ALA 347 Ca 0.24 1.62 0.03 0.00 0.00 0.00 0.00 51.96 53.85 1nwh s ALA 347 Cb -0.17 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.10 1nwh s ALA 347 CO 0.13 -0.29 -0.11 0.12 0.00 0.00 0.00 175.76 175.61 1nwh s PHE 348 N 0.11 1.18 0.10 0.00 5.36 -0.45 -0.05 117.98 124.23 1nwh s PHE 348 Ca -0.02 -0.32 0.04 0.00 -0.96 0.00 0.00 56.93 55.67 1nwh s PHE 348 Cb -0.04 -0.83 -0.04 0.00 -0.34 0.00 0.00 43.02 41.78 1nwh s PHE 348 CO 0.02 -0.13 -0.10 -0.08 -1.46 0.00 0.00 175.22 173.46 1nwh s THR 349 N 0.21 0.99 -0.04 0.12 -1.32 -0.51 -0.77 115.64 114.32 1nwh s THR 349 Ca -0.04 -1.67 0.01 0.00 -1.21 0.00 0.00 61.69 58.78 1nwh s THR 349 Cb -0.10 -1.40 0.02 0.00 -1.51 0.00 0.00 72.50 69.51 1nwh s THR 349 CO 0.01 -0.55 -0.04 -0.69 -2.21 0.00 0.00 174.62 171.13 1nwh s VAL 350 N -2.46 0.51 -0.00 5.08 1.01 -0.91 -1.47 120.40 122.15 1nwh s VAL 350 Ca 0.06 -0.13 -0.13 0.00 0.00 0.00 0.00 61.98 61.79 1nwh s VAL 350 Cb -0.03 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.84 1nwh s VAL 350 CO 0.00 0.21 0.26 -0.83 0.00 0.00 0.00 175.10 174.74 1nwh s GLY 351 N 0.77 -0.09 -0.14 4.51 0.00 -0.82 -3.25 107.32 108.30 1nwh s GLY 351 Ca -0.10 0.17 -0.29 0.00 0.00 0.00 0.00 44.72 44.49 1nwh s GLY 351 CO 0.00 -0.02 1.16 -0.35 0.00 0.00 0.00 173.10 173.89 1nwh s ASP 352 N -1.41 7.05 0.23 1.64 -1.08 -1.26 -1.44 116.67 120.40 1nwh s ASP 352 Ca -0.13 1.64 -0.08 0.00 -0.52 0.00 0.00 52.55 53.47 1nwh s ASP 352 Cb -0.05 -2.55 0.20 0.00 -1.46 0.00 0.00 42.92 39.06 1nwh s ASP 352 CO 0.03 -0.65 1.86 -0.61 0.52 0.00 0.00 175.17 176.32 1nwh h GLN 353 N 7.68 1.21 0.00 4.34 -0.00 -1.34 -3.10 115.11 123.90 1nwh h GLN 353 Ca -0.28 -0.13 -0.04 0.00 -0.00 0.00 0.00 58.65 58.21 1nwh h GLN 353 Cb 1.12 -0.24 -0.01 0.00 0.00 0.00 0.00 27.48 28.35 1nwh h GLN 353 CO 0.93 0.87 -0.18 -0.07 0.00 0.00 0.00 178.83 180.38 1nwh h LEU 354 N 1.22 0.00 0.00 -2.39 3.38 -1.89 -2.53 115.31 113.10 1nwh h LEU 354 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1nwh h LEU 354 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1nwh h LEU 354 CO -0.05 0.18 0.00 0.18 0.09 0.00 0.00 178.44 178.83 1nwh n LEU 355 N -3.22 0.11 0.27 1.67 4.77 -1.17 -1.04 117.00 118.39 1nwh n LEU 355 Ca 0.02 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.15 1nwh n LEU 355 Cb 0.49 0.00 0.77 0.00 -2.33 0.00 0.00 43.42 42.35 1nwh n LEU 355 CO 0.34 0.00 0.99 -0.50 -1.33 0.00 0.00 177.39 176.89 1nwh h TRP 356 N 0.00 0.00 -0.01 -1.77 4.06 -1.80 0.20 115.95 116.63 1nwh h TRP 356 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1nwh h TRP 356 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1nwh h TRP 356 CO 0.00 0.09 -0.14 0.41 -3.56 0.00 0.00 178.44 175.24 1nwh n GLY 357 N -0.49 -0.54 1.98 1.49 0.00 -1.17 -4.59 105.19 101.87 1nwh n GLY 357 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1nwh n GLY 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nwh n ALA 358 N -0.51 1.24 0.09 4.61 0.00 -0.81 -4.84 120.51 120.28 1nwh n ALA 358 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.48 1nwh n ALA 358 Cb 0.32 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.67 1nwh n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nwh h ALA 359 N 0.01 0.26 -0.60 0.00 0.00 -0.39 -3.38 119.26 115.16 1nwh h ALA 359 Ca 0.00 -0.86 -0.09 0.00 0.00 0.00 0.00 54.91 53.96 1nwh h ALA 359 Cb 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1nwh h ALA 359 CO 0.00 1.05 0.01 0.93 0.00 0.00 0.00 179.25 181.24 1nwh h GLU 360 N 0.06 1.04 0.00 0.00 4.39 -0.83 -1.04 114.58 118.20 1nwh h GLU 360 Ca -0.07 -0.32 -0.05 0.00 0.34 0.00 0.00 59.36 59.25 1nwh h GLU 360 Cb 1.81 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 30.35 1nwh h GLU 360 CO 0.17 1.01 -0.26 -1.35 -1.16 0.00 0.00 179.01 177.42 1nwh h PRO 361 N 0.95 0.00 0.01 2.33 0.11 -1.76 -1.92 132.00 131.72 1nwh h PRO 361 Ca 0.17 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.05 1nwh h PRO 361 Cb 0.54 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.67 1nwh h PRO 361 CO 0.03 0.26 -0.92 0.28 -0.21 0.00 0.00 178.00 177.43 1nwh h VAL 362 N 0.00 1.33 -0.24 3.15 2.07 -1.70 -2.90 116.25 117.95 1nwh h VAL 362 Ca -0.00 -2.21 -0.02 0.00 0.82 0.00 0.00 66.70 65.28 1nwh h VAL 362 Cb 0.73 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.97 1nwh h VAL 362 CO 0.03 0.67 0.08 -0.09 0.02 0.00 0.00 177.57 178.28 1nwh h ARG 363 N 0.22 0.37 -0.12 1.57 2.43 -1.05 -2.95 114.38 114.86 1nwh h ARG 363 Ca -0.12 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 58.88 1nwh h ARG 363 Cb 1.60 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.08 1nwh h ARG 363 CO 0.18 0.45 -0.34 0.00 -1.51 0.00 0.00 179.97 178.75 1nwh h ARG 364 N 0.22 0.25 -0.01 0.20 3.08 -1.44 -2.37 114.38 114.31 1nwh h ARG 364 Ca 0.08 -0.10 -0.17 0.00 0.07 0.00 0.00 59.98 59.85 1nwh h ARG 364 Cb 0.23 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1nwh h ARG 364 CO -0.00 0.56 -0.78 0.97 -1.07 0.00 0.00 179.97 179.65 1nwh h ILE 365 N 0.21 1.49 -0.42 2.04 6.09 -1.52 -2.90 117.51 122.50 1nwh h ILE 365 Ca 0.03 -2.47 -0.06 0.00 -1.37 0.00 0.00 64.86 60.98 1nwh h ILE 365 Cb 0.71 2.35 -0.02 0.00 0.47 0.00 0.00 36.82 40.33 1nwh h ILE 365 CO 0.05 0.72 0.03 0.25 -3.07 0.00 0.00 178.15 176.14 1nwh h LEU 366 N 0.09 0.70 -1.01 2.19 6.46 -1.33 -1.21 115.31 121.21 1nwh h LEU 366 Ca -0.03 -0.28 0.05 0.00 -0.12 0.00 0.00 57.88 57.50 1nwh h LEU 366 Cb 1.37 -0.19 -0.06 0.00 -0.73 0.00 0.00 40.66 41.05 1nwh h LEU 366 CO 0.11 0.81 0.65 0.50 -0.62 0.00 0.00 178.44 179.90 1nwh h LYS 367 N 0.57 1.19 -0.36 1.25 3.64 -1.40 -0.97 116.57 120.49 1nwh h LYS 367 Ca 0.12 -0.07 -0.17 0.00 -1.27 0.00 0.00 60.65 59.26 1nwh h LYS 367 Cb 0.43 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1nwh h LYS 367 CO 0.01 0.79 -0.44 1.96 -2.27 0.00 0.00 179.45 179.50 1nwh h GLN 368 N 1.23 0.93 0.00 1.90 4.20 -1.27 -2.47 115.11 119.63 1nwh h GLN 368 Ca 0.42 -0.52 -0.09 0.00 0.06 0.00 0.00 58.65 58.52 1nwh h GLN 368 Cb 0.09 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1nwh h GLN 368 CO -0.15 1.17 -0.44 -0.07 -0.67 0.00 0.00 178.83 178.67 1nwh h LEU 369 N 0.74 0.00 -1.58 1.46 3.38 -0.64 -3.08 115.31 115.60 1nwh h LEU 369 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1nwh h LEU 369 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1nwh h LEU 369 CO 0.10 0.44 -0.07 1.33 0.09 0.00 0.00 178.44 180.33 1nwh n VAL 370 N -3.76 0.00 0.74 1.22 0.24 -0.42 -5.02 118.33 111.33 1nwh n VAL 370 Ca -0.01 -0.41 0.06 0.00 -2.04 0.00 0.00 64.34 61.94 1nwh n VAL 370 Cb 0.50 1.24 0.35 0.00 -1.47 0.00 0.00 33.84 34.47 1nwh n VAL 370 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69