#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntr s GLN 2 N 0.00 0.56 -0.68 2.12 -2.07 -1.26 -4.44 119.66 113.90 1ntr s GLN 2 Ca 0.00 0.62 -0.01 0.00 -1.82 0.00 0.00 55.36 54.15 1ntr s GLN 2 Cb 0.00 0.29 0.41 0.00 -1.09 0.00 0.00 33.01 32.63 1ntr s GLN 2 CO 0.00 -0.98 1.88 -2.13 -1.32 0.00 0.00 175.29 172.74 1ntr n ARG 3 N 5.42 2.86 0.00 9.60 3.00 -0.69 -4.95 116.66 131.90 1ntr n ARG 3 Ca 0.04 -3.55 0.00 0.00 -0.00 0.00 0.00 57.85 54.34 1ntr n ARG 3 Cb 0.53 -2.28 0.00 0.00 0.00 0.00 0.00 32.46 30.72 1ntr n ARG 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ntr n GLY 4 N -0.74 2.34 2.77 5.14 0.00 -1.26 -4.92 105.19 108.52 1ntr n GLY 4 Ca 0.56 -1.53 -0.16 0.00 0.00 0.00 0.00 46.02 44.89 1ntr n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ntr s ILE 5 N -1.89 -0.40 -0.30 -0.61 1.01 -1.26 -1.37 121.20 116.37 1ntr s ILE 5 Ca 0.00 -0.62 -0.11 0.00 0.00 0.00 0.00 60.65 59.92 1ntr s ILE 5 Cb 0.00 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 1ntr s ILE 5 CO 0.00 -0.49 0.20 0.54 0.00 0.00 0.00 174.94 175.20 1ntr s VAL 6 N 2.11 5.27 -0.46 2.92 0.11 -0.51 -2.37 120.40 127.48 1ntr s VAL 6 Ca 0.12 0.05 -0.12 0.00 -2.93 0.00 0.00 61.98 59.09 1ntr s VAL 6 Cb -0.14 -3.57 0.08 0.00 -1.53 0.00 0.00 36.38 31.22 1ntr s VAL 6 CO -0.24 0.18 0.34 0.26 -3.33 0.00 0.00 175.10 172.31 1ntr s TRP 7 N 1.74 3.30 0.06 1.54 0.52 -0.95 -2.39 118.94 122.77 1ntr s TRP 7 Ca 0.07 -1.27 -0.04 0.00 0.02 0.00 0.00 56.10 54.87 1ntr s TRP 7 Cb -0.16 -3.16 -0.05 0.00 -1.15 0.00 0.00 33.47 28.95 1ntr s TRP 7 CO 0.11 -0.85 0.29 0.08 0.02 0.00 0.00 176.95 176.59 1ntr s VAL 8 N 1.53 5.28 -0.09 4.03 1.01 0.09 -1.26 120.40 131.00 1ntr s VAL 8 Ca 0.04 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.02 1ntr s VAL 8 Cb -0.24 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.54 1ntr s VAL 8 CO 0.04 0.20 -0.19 0.54 0.00 0.00 0.00 175.10 175.70 1ntr s VAL 9 N -1.47 1.65 0.00 2.92 0.11 -0.50 -1.03 120.40 122.08 1ntr s VAL 9 Ca 0.34 -0.77 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 1ntr s VAL 9 Cb -0.13 -1.45 0.00 0.00 -1.53 0.00 0.00 36.38 33.27 1ntr s VAL 9 CO 0.22 0.47 0.00 -0.67 -3.33 0.00 0.00 175.10 171.79 1ntr n ASP 10 N 3.71 0.00 0.00 3.54 2.03 -1.04 -1.87 116.55 122.92 1ntr n ASP 10 Ca -0.21 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.10 1ntr n ASP 10 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 1ntr n ASP 10 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1ntr n ASP 11 N -1.43 0.00 -4.79 1.67 2.03 -1.25 -4.71 116.55 108.07 1ntr n ASP 11 Ca 0.00 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.00 1ntr n ASP 11 Cb 0.00 0.19 -0.06 0.00 -0.72 0.00 0.00 41.12 40.53 1ntr n ASP 11 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1ntr s ASP 12 N -2.45 4.24 0.50 1.67 2.15 -1.26 -4.21 116.67 117.31 1ntr s ASP 12 Ca 0.00 -1.55 0.26 0.00 0.43 0.00 0.00 52.55 51.69 1ntr s ASP 12 Cb 0.00 0.46 1.32 0.00 -0.30 0.00 0.00 42.92 44.39 1ntr s ASP 12 CO 0.00 -0.89 2.01 0.77 -0.17 0.00 0.00 175.17 176.89 1ntr h SER 13 N 1.23 0.00 0.19 -0.34 4.64 -1.96 -1.75 113.55 115.55 1ntr h SER 13 Ca -0.42 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1ntr h SER 13 Cb 1.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1ntr h SER 13 CO 0.71 0.15 -0.07 0.77 -0.87 0.00 0.00 176.83 177.52 1ntr h SER 14 N 0.00 0.00 0.22 4.97 4.64 -1.98 0.55 113.55 121.96 1ntr h SER 14 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1ntr h SER 14 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 1ntr h SER 14 CO 0.02 0.07 -0.30 0.40 -0.87 0.00 0.00 176.83 176.15 1ntr h ILE 15 N 0.00 1.24 -0.08 0.95 5.03 -1.70 -2.48 117.51 120.48 1ntr h ILE 15 Ca -0.00 -1.14 -0.00 0.00 -0.12 0.00 0.00 64.86 63.60 1ntr h ILE 15 Cb 0.18 1.52 -0.00 0.00 -3.03 0.00 0.00 36.82 35.49 1ntr h ILE 15 CO 0.01 0.34 0.04 -0.09 -0.68 0.00 0.00 178.15 177.77 1ntr h ARG 16 N 0.11 0.11 -0.05 2.37 2.43 -1.00 -2.42 114.38 115.93 1ntr h ARG 16 Ca 0.02 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1ntr h ARG 16 Cb 0.59 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 1ntr h ARG 16 CO 0.04 0.16 -0.24 2.35 -1.51 0.00 0.00 179.97 180.77 1ntr h TRP 17 N 0.04 -0.70 0.00 2.20 7.01 -1.40 -0.41 115.95 122.68 1ntr h TRP 17 Ca 0.03 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.05 1ntr h TRP 17 Cb 0.08 0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.45 1ntr h TRP 17 CO -0.05 -0.24 0.00 0.28 -2.79 0.00 0.00 178.44 175.64 1ntr n VAL 18 N -3.81 0.00 0.00 2.65 0.31 -1.10 -1.46 118.33 114.92 1ntr n VAL 18 Ca -0.03 1.44 0.00 0.00 -0.01 0.00 0.00 64.34 65.75 1ntr n VAL 18 Cb 0.17 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.17 1ntr n VAL 18 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1ntr n LEU 19 N -2.92 0.00 -0.21 7.52 -0.00 -0.92 -1.19 117.00 119.29 1ntr n LEU 19 Ca 0.00 0.75 0.19 0.00 -0.00 0.00 0.00 56.01 56.95 1ntr n LEU 19 Cb 0.00 -0.25 0.35 0.00 -0.00 0.00 0.00 43.42 43.53 1ntr n LEU 19 CO 0.00 -0.25 0.66 1.21 -0.00 0.00 0.00 177.39 179.01 1ntr n GLU 20 N -1.81 -0.04 0.32 1.96 2.13 -0.18 0.11 120.64 123.13 1ntr n GLU 20 Ca 0.00 0.89 -0.17 0.00 0.66 0.00 0.00 57.16 58.53 1ntr n GLU 20 Cb 0.00 -1.57 -0.09 0.00 0.27 0.00 0.00 31.44 30.05 1ntr n GLU 20 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ntr h ARG 21 N 0.00 -0.86 0.00 5.31 3.08 0.01 0.18 114.38 122.09 1ntr h ARG 21 Ca 0.52 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.63 1ntr h ARG 21 Cb 1.36 0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.60 1ntr h ARG 21 CO -0.50 -0.57 0.00 0.00 -1.07 0.00 0.00 179.97 177.83 1ntr n ALA 22 N -2.60 1.71 0.75 0.04 0.00 0.30 -1.59 120.51 119.13 1ntr n ALA 22 Ca -0.12 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.37 1ntr n ALA 22 Cb 0.39 -1.20 -0.08 0.00 0.00 0.00 0.00 19.45 18.56 1ntr n ALA 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ntr n LEU 23 N -1.32 0.72 -0.03 0.00 -0.00 -0.02 -3.92 117.00 112.43 1ntr n LEU 23 Ca 0.05 -0.30 -0.14 0.00 -0.00 0.00 0.00 56.01 55.62 1ntr n LEU 23 Cb 0.11 -0.03 -0.09 0.00 -0.00 0.00 0.00 43.42 43.40 1ntr n LEU 23 CO 0.10 0.16 0.48 0.00 -0.00 0.00 0.00 177.39 178.14 1ntr h ALA 24 N 2.75 0.11 -0.25 1.96 0.00 0.26 -0.11 119.26 123.97 1ntr h ALA 24 Ca 0.00 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 1ntr h ALA 24 Cb 0.63 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1ntr h ALA 24 CO 0.00 0.10 -0.08 0.78 0.00 0.00 0.00 179.25 180.05 1ntr h GLY 25 N -0.24 0.43 2.00 0.00 0.00 -1.75 -0.97 103.07 102.54 1ntr h GLY 25 Ca -0.01 -0.27 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1ntr h GLY 25 CO 0.05 0.25 -0.32 0.00 0.00 0.00 0.00 176.54 176.52 1ntr h ALA 26 N 1.54 0.95 -4.29 3.60 0.00 -1.65 -3.48 119.26 115.93 1ntr h ALA 26 Ca 0.08 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1ntr h ALA 26 Cb 0.38 -0.05 0.08 0.00 0.00 0.00 0.00 17.79 18.19 1ntr h ALA 26 CO 0.02 0.40 -0.33 0.41 0.00 0.00 0.00 179.25 179.75 1ntr n GLY 27 N 0.40 -0.36 2.18 0.00 0.00 -0.08 -4.80 105.19 102.52 1ntr n GLY 27 Ca 0.00 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1ntr n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ntr n LEU 28 N -2.13 0.00 -4.41 0.99 4.32 -1.08 -1.71 117.00 112.98 1ntr n LEU 28 Ca -0.03 -2.07 -0.44 0.00 -0.02 0.00 0.00 56.01 53.46 1ntr n LEU 28 Cb 0.55 1.28 -0.04 0.00 -1.62 0.00 0.00 43.42 43.58 1ntr n LEU 28 CO 0.30 -0.38 0.52 -0.89 -1.22 0.00 0.00 177.39 175.73 1ntr s THR 29 N -2.85 4.66 -0.91 -5.08 2.01 -0.47 -4.86 115.64 108.14 1ntr s THR 29 Ca 0.25 -0.73 -0.15 0.00 0.31 0.00 0.00 61.69 61.37 1ntr s THR 29 Cb 0.01 -4.54 0.19 0.00 0.01 0.00 0.00 72.50 68.17 1ntr s THR 29 CO 0.18 -1.20 0.97 0.00 -0.69 0.00 0.00 174.62 173.88 1ntr s THR 31 N 1.12 5.45 0.22 0.00 2.01 -1.00 -4.63 115.64 118.81 1ntr s THR 31 Ca 0.26 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.44 1ntr s THR 31 Cb -0.08 -3.46 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 1ntr s THR 31 CO -0.09 0.54 0.05 0.42 -0.69 0.00 0.00 174.62 174.85 1ntr s THR 32 N -1.11 0.63 0.22 -0.82 -4.23 -1.26 -0.73 115.64 108.34 1ntr s THR 32 Ca 0.19 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 1ntr s THR 32 Cb -0.12 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 1ntr s THR 32 CO 0.08 -0.24 0.16 -0.36 -0.54 0.00 0.00 174.62 173.73 1ntr s PHE 33 N -3.70 1.26 -0.51 3.99 0.08 -0.19 -4.92 117.98 113.99 1ntr s PHE 33 Ca 0.31 -1.43 0.16 0.00 0.12 0.00 0.00 56.93 56.09 1ntr s PHE 33 Cb 0.07 -0.58 -0.20 0.00 -0.57 0.00 0.00 43.02 41.74 1ntr s PHE 33 CO 0.09 -0.69 0.57 -0.85 -0.10 0.00 0.00 175.22 174.24 1ntr n GLU 34 N -0.34 1.38 -3.98 0.44 0.28 -1.26 -2.50 120.64 114.67 1ntr n GLU 34 Ca 0.03 -0.05 -0.14 0.00 -0.16 0.00 0.00 57.16 56.84 1ntr n GLU 34 Cb 0.65 -1.29 -0.15 0.00 1.43 0.00 0.00 31.44 32.09 1ntr n GLU 34 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1ntr s ASN 35 N -2.93 0.30 0.14 -1.84 0.01 -1.26 -3.97 114.94 105.38 1ntr s ASN 35 Ca 0.02 -0.04 -0.19 0.00 -0.71 0.00 0.00 52.86 51.95 1ntr s ASN 35 Cb 0.11 -0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.70 1ntr s ASN 35 CO 0.66 -0.01 1.70 1.23 -1.51 0.00 0.00 177.10 179.17 1ntr h GLY 36 N 6.40 0.20 0.00 0.66 0.00 -1.90 -2.59 103.07 105.84 1ntr h GLY 36 Ca -0.30 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1ntr h GLY 36 CO 0.50 -0.08 -0.03 -0.57 0.00 0.00 0.00 176.54 176.36 1ntr h ASN 37 N 0.03 -0.10 -0.80 0.19 -1.24 -1.95 -1.29 115.58 110.41 1ntr h ASN 37 Ca 0.12 0.01 0.30 0.00 0.71 0.00 0.00 56.30 57.44 1ntr h ASN 37 Cb 0.17 0.04 -0.15 0.00 0.73 0.00 0.00 38.32 39.11 1ntr h ASN 37 CO -0.24 -0.03 0.30 1.21 -1.29 0.00 0.00 177.43 177.38 1ntr n GLU 38 N -2.65 -0.05 0.01 6.67 4.07 -1.15 0.84 120.64 128.37 1ntr n GLU 38 Ca -0.00 1.14 -0.10 0.00 -0.06 0.00 0.00 57.16 58.14 1ntr n GLU 38 Cb 0.02 -1.97 -0.03 0.00 -0.06 0.00 0.00 31.44 29.41 1ntr n GLU 38 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1ntr h VAL 39 N 0.00 0.43 0.00 6.31 2.07 -0.83 0.60 116.25 124.82 1ntr h VAL 39 Ca 0.62 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 68.12 1ntr h VAL 39 Cb 1.55 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1ntr h VAL 39 CO -0.66 0.00 -0.09 -0.07 0.02 0.00 0.00 177.57 176.77 1ntr h LEU 40 N -0.31 0.00 -1.44 2.57 3.38 0.62 0.17 115.31 120.30 1ntr h LEU 40 Ca 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1ntr h LEU 40 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1ntr h LEU 40 CO -0.30 0.09 0.22 0.00 0.09 0.00 0.00 178.44 178.54 1ntr h ALA 41 N 1.91 1.57 -0.42 1.53 0.00 0.12 -0.72 119.26 123.26 1ntr h ALA 41 Ca -0.00 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1ntr h ALA 41 Cb 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ntr h ALA 41 CO 0.01 0.35 -0.28 0.00 0.00 0.00 0.00 179.25 179.33 1ntr h ALA 42 N 1.64 0.60 -0.32 0.00 0.00 0.18 -3.20 119.26 118.15 1ntr h ALA 42 Ca 0.15 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ntr h ALA 42 Cb 0.05 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 1ntr h ALA 42 CO -0.02 0.63 -0.27 1.25 0.00 0.00 0.00 179.25 180.84 1ntr h LEU 43 N 0.76 -0.94 0.00 0.00 6.46 -0.59 -3.35 115.31 117.65 1ntr h LEU 43 Ca 0.08 0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 1ntr h LEU 43 Cb 0.86 0.40 0.00 0.00 -0.73 0.00 0.00 40.66 41.19 1ntr h LEU 43 CO 0.08 -0.15 0.00 0.00 -0.62 0.00 0.00 178.44 177.75 1ntr n ALA 44 N -3.00 0.00 0.50 1.25 0.00 -1.14 0.26 120.51 118.38 1ntr n ALA 44 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1ntr n ALA 44 Cb 0.14 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.65 1ntr n ALA 44 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ntr n SER 45 N 0.00 2.89 0.00 0.00 3.41 -1.26 -4.93 113.62 113.73 1ntr n SER 45 Ca 0.00 -2.34 0.00 0.00 -0.26 0.00 0.00 58.87 56.27 1ntr n SER 45 Cb 0.00 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.38 1ntr n SER 45 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ntr n LYS 46 N 0.12 0.00 0.00 4.33 4.01 0.72 -5.03 118.16 122.31 1ntr n LYS 46 Ca 0.12 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.92 1ntr n LYS 46 Cb 0.70 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.22 1ntr n LYS 46 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1ntr n THR 47 N -0.30 0.00 0.00 -0.18 -2.24 -1.26 -4.74 114.28 105.56 1ntr n THR 47 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1ntr n THR 47 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1ntr n THR 47 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1ntr n PRO 48 N 0.00 0.00 -0.04 -0.78 -0.04 -1.26 -5.04 135.00 127.84 1ntr n PRO 48 Ca 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1ntr n PRO 48 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 1ntr n PRO 48 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ntr n ASP 49 N -0.61 0.62 -3.76 3.54 5.75 -1.10 -4.96 116.55 116.03 1ntr n ASP 49 Ca 0.00 0.10 -0.13 0.00 -0.01 0.00 0.00 54.79 54.75 1ntr n ASP 49 Cb 0.00 -0.25 -0.09 0.00 -1.03 0.00 0.00 41.12 39.75 1ntr n ASP 49 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ntr s VAL 50 N -2.15 0.05 0.18 2.12 1.01 -1.00 -4.62 120.40 116.00 1ntr s VAL 50 Ca -0.11 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.47 1ntr s VAL 50 Cb 0.04 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.78 1ntr s VAL 50 CO 0.14 -0.24 0.29 -0.22 0.00 0.00 0.00 175.10 175.06 1ntr s LEU 51 N -1.21 4.24 -0.05 3.92 0.20 -1.05 -2.23 118.68 122.50 1ntr s LEU 51 Ca -0.13 0.08 -0.01 0.00 0.69 0.00 0.00 54.13 54.77 1ntr s LEU 51 Cb -0.05 -2.81 0.03 0.00 -0.43 0.00 0.00 46.19 42.93 1ntr s LEU 51 CO 0.04 0.01 0.01 -0.76 -0.29 0.00 0.00 176.35 175.36 1ntr s LEU 52 N -3.48 0.80 -0.11 -0.68 1.43 -0.39 -0.12 118.68 116.14 1ntr s LEU 52 Ca 0.34 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.42 1ntr s LEU 52 Cb -0.10 -0.29 -0.02 0.00 0.03 0.00 0.00 46.19 45.81 1ntr s LEU 52 CO 0.28 -0.15 -0.13 -0.44 0.23 0.00 0.00 176.35 176.14 1ntr s SER 53 N 1.52 4.07 0.00 2.29 0.01 -1.01 -1.40 113.70 119.18 1ntr s SER 53 Ca -0.03 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 56.96 1ntr s SER 53 Cb -0.13 -1.39 0.00 0.00 0.21 0.00 0.00 66.02 64.71 1ntr s SER 53 CO -0.03 0.22 0.00 -0.90 0.41 0.00 0.00 173.24 172.94 1ntr n ASP 54 N 3.14 0.00 -2.77 2.44 5.75 -0.78 -2.43 116.55 121.91 1ntr n ASP 54 Ca -0.18 0.00 -0.00 0.00 -0.01 0.00 0.00 54.79 54.60 1ntr n ASP 54 Cb 0.53 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.63 1ntr n ASP 54 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 1ntr s ILE 55 N 0.00 -0.31 0.00 2.12 -1.16 -1.26 -4.68 121.20 115.91 1ntr s ILE 55 Ca 0.00 -0.12 0.00 0.00 -0.51 0.00 0.00 60.65 60.02 1ntr s ILE 55 Cb 0.00 0.00 0.00 0.00 0.61 0.00 0.00 42.46 43.07 1ntr s ILE 55 CO 0.00 0.00 0.00 -2.11 -2.81 0.00 0.00 174.94 170.02 1ntr n ARG 56 N 3.33 0.00 -0.71 3.50 1.85 -1.26 -4.95 116.66 118.41 1ntr n ARG 56 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.94 1ntr n ARG 56 Cb 0.63 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.04 1ntr n ARG 56 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 1ntr n MET 57 N 0.00 -2.01 -2.68 2.89 2.81 -1.26 -4.26 117.12 112.61 1ntr n MET 57 Ca 0.00 1.45 -0.43 0.00 -1.81 0.00 0.00 57.70 56.92 1ntr n MET 57 Cb 0.00 -1.60 -0.03 0.00 -0.71 0.00 0.00 33.22 30.88 1ntr n MET 57 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1ntr s PRO 58 N -3.48 3.47 0.00 0.03 0.04 -1.26 -4.74 135.00 129.07 1ntr s PRO 58 Ca 0.00 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.14 1ntr s PRO 58 Cb 0.00 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.53 1ntr s PRO 58 CO 0.00 -1.56 0.00 0.41 0.04 0.00 0.00 177.00 175.89 1ntr n GLY 59 N 5.06 0.12 0.00 0.56 0.00 -1.26 -5.06 105.19 104.61 1ntr n GLY 59 Ca 0.06 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1ntr n GLY 59 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ntr n MET 60 N 0.00 2.60 -0.03 1.61 2.81 -1.26 -4.52 117.12 118.33 1ntr n MET 60 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1ntr n MET 60 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 1ntr n MET 60 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1ntr n ASP 61 N -0.90 0.00 0.00 7.83 2.03 -1.26 -4.62 116.55 119.64 1ntr n ASP 61 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1ntr n ASP 61 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1ntr n ASP 61 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ntr n GLY 62 N -2.00 0.00 1.98 0.27 0.00 -1.26 -4.39 105.19 99.79 1ntr n GLY 62 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1ntr n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ntr n LEU 63 N -2.55 0.00 -1.73 0.99 4.77 -1.26 -4.49 117.00 112.73 1ntr n LEU 63 Ca 0.00 -1.40 -0.20 0.00 -0.03 0.00 0.00 56.01 54.38 1ntr n LEU 63 Cb 0.16 -0.10 -0.07 0.00 -2.33 0.00 0.00 43.42 41.08 1ntr n LEU 63 CO 0.00 -0.50 -0.20 0.00 -1.33 0.00 0.00 177.39 175.36 1ntr n ALA 64 N -2.51 -0.37 0.00 -1.18 0.00 -1.26 -4.72 120.51 110.47 1ntr n ALA 64 Ca -0.08 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1ntr n ALA 64 Cb 0.32 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.79 1ntr n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ntr n LEU 65 N -2.43 0.00 0.24 0.00 4.77 -1.26 -4.78 117.00 113.55 1ntr n LEU 65 Ca -0.20 -0.28 -0.10 0.00 -0.03 0.00 0.00 56.01 55.40 1ntr n LEU 65 Cb 0.65 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.69 1ntr n LEU 65 CO 0.29 0.00 0.49 -0.07 -1.33 0.00 0.00 177.39 176.77 1ntr h LEU 66 N 0.00 -0.53 -1.25 2.23 3.38 -1.86 -2.62 115.31 114.67 1ntr h LEU 66 Ca 0.00 0.02 0.37 0.00 0.09 0.00 0.00 57.88 58.36 1ntr h LEU 66 Cb 0.00 0.14 -0.13 0.00 0.09 0.00 0.00 40.66 40.75 1ntr h LEU 66 CO 0.00 -0.36 0.71 0.50 0.09 0.00 0.00 178.44 179.38 1ntr h LYS 67 N -0.65 0.20 0.06 1.13 1.63 -1.89 0.41 116.57 117.47 1ntr h LYS 67 Ca -0.06 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 59.74 1ntr h LYS 67 Cb 0.48 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 1ntr h LYS 67 CO 0.10 0.13 -0.15 0.37 -3.45 0.00 0.00 179.45 176.46 1ntr h GLN 68 N 0.21 -0.27 -0.76 1.90 4.15 -1.78 -1.76 115.11 116.80 1ntr h GLN 68 Ca 0.75 0.02 0.10 0.00 0.77 0.00 0.00 58.65 60.29 1ntr h GLN 68 Cb 2.08 0.06 -0.11 0.00 0.21 0.00 0.00 27.48 29.72 1ntr h GLN 68 CO -0.48 -0.18 -0.36 -0.89 -1.93 0.00 0.00 178.83 175.00 1ntr n ILE 69 N -5.27 -0.45 0.07 2.39 -0.00 0.14 -1.17 119.36 115.08 1ntr n ILE 69 Ca -0.06 1.80 -0.12 0.00 -0.00 0.00 0.00 62.75 64.38 1ntr n ILE 69 Cb 0.19 -2.32 -0.08 0.00 -0.00 0.00 0.00 39.64 37.43 1ntr n ILE 69 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.55 176.66 1ntr h LYS 70 N 0.00 -0.23 -0.62 0.38 1.79 -1.57 -1.10 116.57 115.22 1ntr h LYS 70 Ca 0.21 0.02 0.20 0.00 -2.18 0.00 0.00 60.65 58.89 1ntr h LYS 70 Cb 0.40 0.05 -0.11 0.00 -1.58 0.00 0.00 32.23 30.98 1ntr h LYS 70 CO -0.74 0.18 0.12 1.04 -1.08 0.00 0.00 179.45 178.98 1ntr n GLN 71 N -4.96 -0.05 -0.06 3.15 1.13 -0.31 0.03 117.38 116.30 1ntr n GLN 71 Ca -0.08 0.91 -0.22 0.00 -1.94 0.00 0.00 57.00 55.66 1ntr n GLN 71 Cb 0.26 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 28.99 1ntr n GLN 71 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1ntr n ARG 72 N -4.67 0.66 -0.90 -1.09 3.00 -0.95 -4.93 116.66 107.77 1ntr n ARG 72 Ca 0.18 0.38 -0.34 0.00 -0.00 0.00 0.00 57.85 58.06 1ntr n ARG 72 Cb 0.59 -1.69 0.09 0.00 0.00 0.00 0.00 32.46 31.45 1ntr n ARG 72 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1ntr n HIS 73 N -3.91 -2.73 -0.02 -0.14 8.25 0.10 -4.95 115.22 111.83 1ntr n HIS 73 Ca -0.35 0.15 -0.00 0.00 -0.26 0.00 0.00 57.72 57.26 1ntr n HIS 73 Cb 0.89 -1.67 -0.00 0.00 1.12 0.00 0.00 29.99 30.32 1ntr n HIS 73 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1ntr h PRO 74 N -1.26 0.00 0.00 -0.41 0.13 -1.89 -3.46 132.00 125.10 1ntr h PRO 74 Ca -0.44 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.59 1ntr h PRO 74 Cb 1.30 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.33 1ntr h PRO 74 CO 0.31 0.00 0.12 0.00 -0.23 0.00 0.00 178.00 178.20 1ntr n MET 75 N -3.06 0.26 -4.33 0.86 0.00 -1.26 -5.07 117.12 104.53 1ntr n MET 75 Ca -0.00 -0.81 -0.25 0.00 0.00 0.00 0.00 57.70 56.64 1ntr n MET 75 Cb 0.01 -0.06 -0.09 0.00 0.00 0.00 0.00 33.22 33.08 1ntr n MET 75 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 175.97 175.49 1ntr s LEU 76 N -2.06 2.98 0.65 3.17 0.05 -1.26 -5.10 118.68 117.11 1ntr s LEU 76 Ca 0.08 -0.69 -0.17 0.00 0.05 0.00 0.00 54.13 53.41 1ntr s LEU 76 Cb 0.14 -1.57 -0.00 0.00 -2.05 0.00 0.00 46.19 42.70 1ntr s LEU 76 CO -0.06 0.05 1.22 -2.16 -0.55 0.00 0.00 176.35 174.85 1ntr s PRO 77 N -3.26 2.62 -0.30 1.48 0.04 -1.26 -4.90 135.00 129.42 1ntr s PRO 77 Ca 0.28 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 63.12 1ntr s PRO 77 Cb -0.07 -1.89 0.12 0.00 0.04 0.00 0.00 34.50 32.70 1ntr s PRO 77 CO 0.17 -1.48 0.21 0.14 0.04 0.00 0.00 177.00 176.08 1ntr s VAL 78 N -1.74 -0.17 1.12 -0.36 -7.23 -0.77 -2.52 120.40 108.74 1ntr s VAL 78 Ca 0.77 -0.82 -0.12 0.00 -1.81 0.00 0.00 61.98 60.00 1ntr s VAL 78 Cb -0.30 -0.98 0.26 0.00 0.56 0.00 0.00 36.38 35.92 1ntr s VAL 78 CO 0.39 -0.67 1.05 -0.38 -0.31 0.00 0.00 175.10 175.18 1ntr n ILE 79 N 5.03 0.00 -3.64 -0.62 5.41 0.83 -4.64 119.36 121.74 1ntr n ILE 79 Ca -0.01 -0.35 -0.09 0.00 1.00 0.00 0.00 62.75 63.30 1ntr n ILE 79 Cb 0.43 -1.00 -0.07 0.00 -0.71 0.00 0.00 39.64 38.29 1ntr n ILE 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1ntr s ILE 80 N -2.46 0.00 0.81 1.39 1.10 -1.22 -2.40 121.20 118.43 1ntr s ILE 80 Ca 0.68 0.00 -0.12 0.00 -0.51 0.00 0.00 60.65 60.71 1ntr s ILE 80 Cb -0.25 -1.00 0.09 0.00 0.15 0.00 0.00 42.46 41.44 1ntr s ILE 80 CO 0.64 0.00 1.15 -0.32 -2.11 0.00 0.00 174.94 174.29 1ntr s MET 81 N 1.11 1.74 0.13 3.50 1.75 -1.02 -1.28 119.30 125.23 1ntr s MET 81 Ca -0.06 1.51 -0.01 0.00 -1.25 0.00 0.00 55.69 55.88 1ntr s MET 81 Cb -0.05 -1.81 -0.04 0.00 2.84 0.00 0.00 34.83 35.77 1ntr s MET 81 CO -0.12 -2.09 0.31 -0.08 -0.65 0.00 0.00 175.02 172.39 1ntr s THR 82 N -2.50 5.28 0.00 10.11 -1.32 -0.79 -4.55 115.64 121.87 1ntr s THR 82 Ca 0.68 -0.30 0.00 0.00 -1.21 0.00 0.00 61.69 60.85 1ntr s THR 82 Cb -0.23 -3.67 0.00 0.00 -1.51 0.00 0.00 72.50 67.09 1ntr s THR 82 CO 0.53 0.01 0.00 0.00 -2.21 0.00 0.00 174.62 172.95 1ntr n ALA 83 N -0.09 0.00 -2.66 11.08 0.00 -1.26 -4.95 120.51 122.63 1ntr n ALA 83 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 1ntr n ALA 83 Cb 0.52 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.07 1ntr n ALA 83 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1ntr n HIS 84 N -0.68 -0.24 0.00 0.00 -0.00 -1.26 -5.01 115.22 108.03 1ntr n HIS 84 Ca 0.00 -0.61 0.00 0.00 0.46 0.00 0.00 57.72 57.57 1ntr n HIS 84 Cb 0.00 1.09 0.00 0.00 -0.12 0.00 0.00 29.99 30.96 1ntr n HIS 84 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 1ntr n SER 85 N 1.04 0.00 0.07 0.26 3.41 -1.26 -4.94 113.62 112.20 1ntr n SER 85 Ca -0.03 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.71 1ntr n SER 85 Cb 0.74 0.00 0.61 0.00 -0.26 0.00 0.00 64.21 65.30 1ntr n SER 85 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1ntr h ASP 86 N 0.00 0.11 -1.33 4.04 3.32 -1.95 -2.79 116.42 117.82 1ntr h ASP 86 Ca 0.00 0.00 0.39 0.00 0.02 0.00 0.00 57.03 57.44 1ntr h ASP 86 Cb 0.00 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 39.47 1ntr h ASP 86 CO 0.00 0.07 1.04 -0.11 -1.72 0.00 0.00 179.24 178.52 1ntr n LEU 87 N -4.46 0.00 -0.11 1.55 -0.00 -1.26 -0.44 117.00 112.29 1ntr n LEU 87 Ca 0.05 0.71 -0.19 0.00 -0.00 0.00 0.00 56.01 56.57 1ntr n LEU 87 Cb 0.35 -0.33 -0.08 0.00 -0.00 0.00 0.00 43.42 43.35 1ntr n LEU 87 CO 0.35 -0.71 -0.74 -0.67 -0.00 0.00 0.00 177.39 175.62 1ntr n ASP 88 N -3.29 1.88 0.00 1.96 -0.08 -1.05 -3.34 116.55 112.64 1ntr n ASP 88 Ca 0.30 0.43 0.08 0.00 -1.51 0.00 0.00 54.79 54.09 1ntr n ASP 88 Cb 1.44 -0.89 0.45 0.00 2.34 0.00 0.00 41.12 44.46 1ntr n ASP 88 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ntr n ALA 89 N -3.77 2.03 -0.50 -1.67 0.00 0.11 -3.27 120.51 113.44 1ntr n ALA 89 Ca -0.31 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1ntr n ALA 89 Cb 0.64 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1ntr n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ntr n ALA 90 N -1.08 0.88 -0.45 0.00 0.00 0.42 -4.58 120.51 115.70 1ntr n ALA 90 Ca 0.11 -0.08 0.35 0.00 0.00 0.00 0.00 53.44 53.82 1ntr n ALA 90 Cb 0.08 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.08 1ntr n ALA 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ntr n VAL 91 N -1.91 -0.07 -1.41 0.00 0.31 -1.21 -3.77 118.33 110.27 1ntr n VAL 91 Ca 0.00 1.17 0.00 0.00 -0.01 0.00 0.00 64.34 65.50 1ntr n VAL 91 Cb 0.00 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.00 1ntr n VAL 91 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ntr n SER 92 N -3.67 0.00 0.00 4.52 2.88 -1.20 -4.37 113.62 111.77 1ntr n SER 92 Ca 0.31 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 1ntr n SER 92 Cb 1.35 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.81 1ntr n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ntr n ALA 93 N -3.00 0.00 -3.33 -1.46 0.00 -1.26 -2.37 120.51 109.09 1ntr n ALA 93 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 1ntr n ALA 93 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1ntr n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ntr n TYR 94 N 0.00 1.90 0.32 0.00 4.02 -1.26 -4.90 117.16 117.25 1ntr n TYR 94 Ca 0.00 -3.90 0.20 0.00 -0.01 0.00 0.00 57.90 54.19 1ntr n TYR 94 Cb 0.00 -0.46 1.11 0.00 -0.02 0.00 0.00 39.34 39.97 1ntr n TYR 94 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1ntr h GLN 95 N 4.14 0.00 0.00 -0.72 -0.00 -1.56 -3.39 115.11 113.58 1ntr h GLN 95 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.80 1ntr h GLN 95 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.24 1ntr h GLN 95 CO 0.67 0.00 0.00 1.04 0.00 0.00 0.00 178.83 180.55 1ntr n GLN 96 N -3.31 -0.13 -1.54 1.69 6.02 -1.26 -4.73 117.38 114.13 1ntr n GLN 96 Ca -0.03 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.61 1ntr n GLN 96 Cb 0.09 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.29 1ntr n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ntr n GLY 97 N 2.45 0.01 0.70 1.08 0.00 -1.26 -4.34 105.19 103.84 1ntr n GLY 97 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1ntr n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ntr n ALA 98 N 14.86 1.59 0.00 4.61 0.00 -1.26 -4.93 120.51 135.38 1ntr n ALA 98 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1ntr n ALA 98 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1ntr n ALA 98 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1ntr n PHE 99 N -1.85 0.00 -2.31 0.00 1.16 -1.26 -1.84 117.46 111.36 1ntr n PHE 99 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 1ntr n PHE 99 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 1ntr n PHE 99 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1ntr n ASP 100 N 0.00 0.41 -4.79 5.98 9.92 -1.26 -4.93 116.55 121.88 1ntr n ASP 100 Ca 0.00 -0.11 -0.31 0.00 -0.53 0.00 0.00 54.79 53.84 1ntr n ASP 100 Cb 0.00 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.42 1ntr n ASP 100 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1ntr s TYR 101 N 1.66 3.22 -0.26 1.24 2.02 -1.26 -3.38 117.35 120.60 1ntr s TYR 101 Ca 0.00 0.10 -0.04 0.00 -0.37 0.00 0.00 57.07 56.76 1ntr s TYR 101 Cb 0.00 -1.64 0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1ntr s TYR 101 CO 0.00 0.53 -0.01 -0.51 -1.57 0.00 0.00 175.55 173.98 1ntr s LEU 102 N -2.35 3.31 0.15 -1.29 1.43 -0.40 -4.84 118.68 114.69 1ntr s LEU 102 Ca 0.29 -0.71 -0.07 0.00 -1.03 0.00 0.00 54.13 52.61 1ntr s LEU 102 Cb -0.12 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.29 1ntr s LEU 102 CO 0.22 -0.12 0.43 -2.16 0.23 0.00 0.00 176.35 174.94 1ntr s PRO 103 N 1.41 3.70 0.06 1.29 0.04 -1.26 -1.88 135.00 138.37 1ntr s PRO 103 Ca 0.02 0.07 0.01 0.00 0.04 0.00 0.00 61.00 61.14 1ntr s PRO 103 Cb -0.16 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 1ntr s PRO 103 CO -0.02 0.45 0.16 0.15 0.04 0.00 0.00 177.00 177.78 1ntr s LYS 104 N -2.52 3.25 0.26 4.56 1.02 -1.26 -2.95 119.74 122.10 1ntr s LYS 104 Ca 0.41 -0.52 -0.29 0.00 0.02 0.00 0.00 55.97 55.58 1ntr s LYS 104 Cb -0.12 -2.94 -0.09 0.00 -0.52 0.00 0.00 37.83 34.16 1ntr s LYS 104 CO 0.22 0.60 0.98 -1.25 -0.92 0.00 0.00 175.35 174.98 1ntr s PRO 105 N -2.44 4.76 0.43 -1.68 0.04 -1.26 -5.18 135.00 129.67 1ntr s PRO 105 Ca 0.33 1.56 0.06 0.00 0.04 0.00 0.00 61.00 62.99 1ntr s PRO 105 Cb -0.13 -3.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.17 1ntr s PRO 105 CO 0.26 0.40 0.12 0.12 0.04 0.00 0.00 177.00 177.94 1ntr s PHE 106 N -1.22 2.43 -0.35 0.56 5.36 -1.15 -5.11 117.98 118.50 1ntr s PHE 106 Ca 0.43 -0.67 -0.12 0.00 -0.96 0.00 0.00 56.93 55.61 1ntr s PHE 106 Cb -0.27 -1.87 0.00 0.00 -0.34 0.00 0.00 43.02 40.55 1ntr s PHE 106 CO 0.34 0.23 0.22 0.34 -1.46 0.00 0.00 175.22 174.88 1ntr s ASP 107 N -3.87 5.85 0.52 6.13 -1.08 -1.26 -4.94 116.67 118.02 1ntr s ASP 107 Ca 0.35 -0.66 0.24 0.00 -0.52 0.00 0.00 52.55 51.96 1ntr s ASP 107 Cb 0.05 -2.08 1.37 0.00 -1.46 0.00 0.00 42.92 40.80 1ntr s ASP 107 CO 0.19 -0.29 2.00 -0.29 0.52 0.00 0.00 175.17 177.30 1ntr h ILE 108 N 5.65 0.76 0.03 4.11 6.09 -1.99 -0.51 117.51 131.64 1ntr h ILE 108 Ca -0.30 -0.01 -0.14 0.00 -1.37 0.00 0.00 64.86 63.05 1ntr h ILE 108 Cb 1.14 0.72 0.01 0.00 0.47 0.00 0.00 36.82 39.16 1ntr h ILE 108 CO 0.65 0.01 -0.56 -0.78 -3.07 0.00 0.00 178.15 174.40 1ntr h ASP 109 N 0.03 0.44 -0.95 2.19 3.58 -1.92 -1.50 116.42 118.28 1ntr h ASP 109 Ca 0.25 -0.82 0.24 0.00 0.42 0.00 0.00 57.03 57.11 1ntr h ASP 109 Cb 0.94 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.79 1ntr h ASP 109 CO -0.01 1.20 0.64 -0.08 -2.88 0.00 0.00 179.24 178.11 1ntr h GLU 110 N -0.28 0.31 0.00 0.28 4.81 -1.53 -1.06 114.58 117.10 1ntr h GLU 110 Ca -0.08 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1ntr h GLU 110 Cb 1.32 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1ntr h GLU 110 CO 0.11 0.20 0.00 0.00 -0.73 0.00 0.00 179.01 178.59 1ntr n ALA 111 N -2.55 -0.06 -0.26 2.92 0.00 -0.67 -1.91 120.51 117.98 1ntr n ALA 111 Ca 0.21 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.78 1ntr n ALA 111 Cb 0.82 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.52 1ntr n ALA 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ntr n VAL 112 N -1.55 -0.32 0.00 0.00 0.31 -0.58 -1.24 118.33 114.95 1ntr n VAL 112 Ca 0.00 1.66 0.00 0.00 -0.01 0.00 0.00 64.34 65.99 1ntr n VAL 112 Cb 0.00 -2.46 0.00 0.00 -0.91 0.00 0.00 33.84 30.47 1ntr n VAL 112 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ntr n ALA 113 N -3.17 -0.12 -0.30 3.52 0.00 -0.42 -2.23 120.51 117.79 1ntr n ALA 113 Ca 0.19 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.59 1ntr n ALA 113 Cb 0.64 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.07 1ntr n ALA 113 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ntr n LEU 114 N -1.56 -0.63 0.02 0.00 7.94 -0.80 0.17 117.00 122.14 1ntr n LEU 114 Ca 0.00 1.30 -0.14 0.00 -1.11 0.00 0.00 56.01 56.06 1ntr n LEU 114 Cb 0.00 -0.23 -0.08 0.00 0.53 0.00 0.00 43.42 43.64 1ntr n LEU 114 CO 0.00 -1.11 0.55 0.58 -1.11 0.00 0.00 177.39 176.30 1ntr h VAL 115 N 0.00 0.07 -0.79 1.96 2.07 -1.31 0.04 116.25 118.29 1ntr h VAL 115 Ca 0.18 0.00 0.31 0.00 0.82 0.00 0.00 66.70 68.02 1ntr h VAL 115 Cb 0.37 0.07 -0.14 0.00 -1.52 0.00 0.00 31.29 30.07 1ntr h VAL 115 CO -0.71 0.00 0.36 1.21 0.02 0.00 0.00 177.57 178.45 1ntr n GLU 116 N -5.45 -0.05 0.09 1.57 4.07 0.46 0.12 120.64 121.45 1ntr n GLU 116 Ca -0.05 1.10 -0.19 0.00 -0.06 0.00 0.00 57.16 57.96 1ntr n GLU 116 Cb 0.38 -1.94 -0.15 0.00 -0.06 0.00 0.00 31.44 29.68 1ntr n GLU 116 CO 0.00 0.00 0.00 0.07 -0.06 0.00 0.00 177.13 177.14 1ntr h ARG 117 N 0.00 0.33 0.70 5.31 0.11 -0.55 -3.31 114.38 116.96 1ntr h ARG 117 Ca 0.64 -0.56 -0.03 0.00 0.10 0.00 0.00 59.98 60.12 1ntr h ARG 117 Cb 1.63 0.21 0.01 0.00 1.11 0.00 0.00 29.97 32.93 1ntr h ARG 117 CO -0.63 1.23 -0.33 0.00 0.10 0.00 0.00 179.97 180.34 1ntr h ALA 118 N 0.41 -1.18 -0.73 0.08 0.00 0.21 -2.59 119.26 115.46 1ntr h ALA 118 Ca -0.23 -0.20 0.29 0.00 0.00 0.00 0.00 54.91 54.77 1ntr h ALA 118 Cb 2.04 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 20.08 1ntr h ALA 118 CO 0.20 -1.12 0.41 -0.89 0.00 0.00 0.00 179.25 177.85 1ntr n ILE 119 N -4.65 -0.27 0.00 0.00 5.41 -0.13 -3.31 119.36 116.41 1ntr n ILE 119 Ca -0.12 1.37 0.00 0.00 1.00 0.00 0.00 62.75 65.00 1ntr n ILE 119 Cb 0.37 -2.23 0.00 0.00 -0.71 0.00 0.00 39.64 37.07 1ntr n ILE 119 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1ntr n SER 120 N -4.47 0.00 0.00 4.38 2.88 -0.98 -4.46 113.62 110.97 1ntr n SER 120 Ca 0.26 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 1ntr n SER 120 Cb 0.92 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.38 1ntr n SER 120 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1ntr n HIS 121 N -0.53 0.00 -2.47 0.66 8.25 -1.21 -4.84 115.22 115.08 1ntr n HIS 121 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 1ntr n HIS 121 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1ntr n HIS 121 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ntr n TYR 122 N 0.00 -1.47 0.50 4.41 4.02 -1.26 -4.65 117.16 118.72 1ntr n TYR 122 Ca 0.00 0.11 0.07 0.00 -0.01 0.00 0.00 57.90 58.07 1ntr n TYR 122 Cb 0.00 -0.94 0.30 0.00 -0.02 0.00 0.00 39.34 38.68 1ntr n TYR 122 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1ntr n GLN 123 N -2.27 0.03 -0.54 -0.72 6.02 -1.26 -5.25 117.38 113.39 1ntr n GLN 123 Ca 0.02 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1ntr n GLN 123 Cb 0.39 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.15 1ntr n GLN 123 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44