#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 1.68 -0.45 0.03 0.00 -1.26 -5.05 119.66 114.61 1ntr s GLN 2 Ca 0.00 0.42 0.06 0.00 -0.00 0.00 0.00 55.36 55.84 1ntr s GLN 2 Cb 0.00 -1.89 0.18 0.00 0.00 0.00 0.00 33.01 31.30 1ntr s GLN 2 CO 0.00 -1.85 0.57 -0.98 0.00 0.00 0.00 175.29 173.04 1ntr s ARG 3 N -5.26 0.92 -0.42 9.60 1.70 -1.26 -5.06 118.95 119.17 1ntr s ARG 3 Ca 0.62 -1.10 0.02 0.00 -0.47 0.00 0.00 55.73 54.80 1ntr s ARG 3 Cb -0.14 -0.41 0.15 0.00 -0.57 0.00 0.00 34.95 33.98 1ntr s ARG 3 CO 0.53 -1.29 0.26 0.20 -1.08 0.00 0.00 175.30 173.92 1ntr s GLY 4 N 0.98 1.38 -1.02 3.88 0.00 -1.26 -4.86 107.32 106.41 1ntr s GLY 4 Ca 0.26 -2.39 -0.18 0.00 0.00 0.00 0.00 44.72 42.41 1ntr s GLY 4 CO -0.08 1.81 1.26 -0.42 0.00 0.00 0.00 173.10 175.67 1ntr s ILE 5 N 0.43 4.71 -0.39 0.90 -1.09 -1.26 -1.32 121.20 123.19 1ntr s ILE 5 Ca 0.21 -1.79 -0.14 0.00 -2.23 0.00 0.00 60.65 56.71 1ntr s ILE 5 Cb -0.17 -4.85 0.01 0.00 -1.58 0.00 0.00 42.46 35.87 1ntr s ILE 5 CO -0.04 -1.59 0.27 0.54 -1.23 0.00 0.00 174.94 172.88 1ntr s VAL 6 N 2.66 5.15 -0.44 2.92 0.11 -0.87 -1.64 120.40 128.30 1ntr s VAL 6 Ca 0.37 -0.58 -0.14 0.00 -2.93 0.00 0.00 61.98 58.71 1ntr s VAL 6 Cb -0.04 -3.81 0.06 0.00 -1.53 0.00 0.00 36.38 31.06 1ntr s VAL 6 CO -0.06 -0.22 0.33 0.26 -3.33 0.00 0.00 175.10 172.07 1ntr s TRP 7 N 1.67 3.26 0.68 1.54 0.52 -0.30 -1.64 118.94 124.68 1ntr s TRP 7 Ca 0.05 -0.96 -0.06 0.00 0.02 0.00 0.00 56.10 55.15 1ntr s TRP 7 Cb -0.19 -2.91 0.05 0.00 -1.15 0.00 0.00 33.47 29.28 1ntr s TRP 7 CO 0.10 -0.74 0.99 0.54 0.02 0.00 0.00 176.95 177.86 1ntr s VAL 8 N 1.60 2.52 -0.43 4.03 0.11 -0.18 -0.81 120.40 127.24 1ntr s VAL 8 Ca 0.04 -0.22 0.04 0.00 -2.93 0.00 0.00 61.98 58.90 1ntr s VAL 8 Cb -0.22 -3.08 0.12 0.00 -1.53 0.00 0.00 36.38 31.66 1ntr s VAL 8 CO 0.07 -0.09 0.17 -0.69 -3.33 0.00 0.00 175.10 171.23 1ntr s VAL 9 N -3.20 2.28 0.23 2.04 1.01 0.60 -1.94 120.40 121.42 1ntr s VAL 9 Ca 0.59 -2.78 0.00 0.00 0.00 0.00 0.00 61.98 59.79 1ntr s VAL 9 Cb -0.11 -2.63 0.04 0.00 0.00 0.00 0.00 36.38 33.69 1ntr s VAL 9 CO 0.45 -0.72 0.31 0.47 0.00 0.00 0.00 175.10 175.60 1ntr n ASP 10 N 3.68 0.46 0.00 3.32 8.00 -0.27 -2.73 116.55 129.01 1ntr n ASP 10 Ca 0.05 -1.38 0.00 0.00 0.71 0.00 0.00 54.79 54.17 1ntr n ASP 10 Cb 0.37 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1ntr n ASP 10 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ntr n ASP 11 N -2.95 0.03 -3.95 -2.24 2.03 -1.24 -3.72 116.55 104.50 1ntr n ASP 11 Ca 0.05 -0.46 -0.09 0.00 0.52 0.00 0.00 54.79 54.81 1ntr n ASP 11 Cb 0.19 0.86 -0.07 0.00 -0.72 0.00 0.00 41.12 41.38 1ntr n ASP 11 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1ntr s ASP 12 N -0.86 0.06 0.10 1.67 1.01 -1.26 -4.94 116.67 112.45 1ntr s ASP 12 Ca 0.00 -0.85 -0.15 0.00 0.71 0.00 0.00 52.55 52.26 1ntr s ASP 12 Cb 0.00 0.42 -0.08 0.00 1.01 0.00 0.00 42.92 44.26 1ntr s ASP 12 CO 0.00 -0.86 1.42 -1.28 0.21 0.00 0.00 175.17 174.66 1ntr h SER 13 N 2.59 0.75 -0.27 0.27 0.87 -1.97 -2.64 113.55 113.15 1ntr h SER 13 Ca -0.32 -0.47 0.08 0.00 -1.23 0.00 0.00 61.79 59.85 1ntr h SER 13 Cb 1.22 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.96 1ntr h SER 13 CO 0.50 1.06 0.33 0.77 -0.53 0.00 0.00 176.83 178.96 1ntr h SER 14 N 0.45 0.00 -0.19 6.23 4.64 -2.01 0.74 113.55 123.41 1ntr h SER 14 Ca 0.05 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.23 1ntr h SER 14 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1ntr h SER 14 CO 0.07 0.00 -0.40 0.40 -0.87 0.00 0.00 176.83 176.03 1ntr h ILE 15 N 0.00 1.33 -0.69 0.95 1.08 -1.88 -2.52 117.51 115.78 1ntr h ILE 15 Ca 0.13 -1.64 0.08 0.00 -0.39 0.00 0.00 64.86 63.04 1ntr h ILE 15 Cb 0.79 1.89 -0.07 0.00 -3.07 0.00 0.00 36.82 36.37 1ntr h ILE 15 CO -0.00 0.51 0.35 -0.09 -0.69 0.00 0.00 178.15 178.23 1ntr h ARG 16 N 0.28 0.60 0.80 2.37 2.43 -0.85 -2.44 114.38 117.57 1ntr h ARG 16 Ca 0.00 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 1ntr h ARG 16 Cb 1.01 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.43 1ntr h ARG 16 CO 0.09 0.39 -0.39 2.35 -1.51 0.00 0.00 179.97 180.91 1ntr h TRP 17 N 0.61 -1.00 -0.64 2.20 7.01 -1.43 -2.42 115.95 120.29 1ntr h TRP 17 Ca 0.33 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.36 1ntr h TRP 17 Cb 0.31 0.33 -0.08 0.00 -2.10 0.00 0.00 29.16 27.62 1ntr h TRP 17 CO -0.10 -0.62 -0.38 0.28 -2.79 0.00 0.00 178.44 174.83 1ntr n VAL 18 N -5.55 -0.43 0.04 2.65 0.31 -0.94 -1.09 118.33 113.32 1ntr n VAL 18 Ca -0.15 1.80 -0.02 0.00 -0.01 0.00 0.00 64.34 65.96 1ntr n VAL 18 Cb 0.43 -2.25 -0.01 0.00 -0.91 0.00 0.00 33.84 31.10 1ntr n VAL 18 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1ntr h LEU 19 N 0.00 -0.14 -1.26 7.52 5.85 -1.48 -2.20 115.31 123.60 1ntr h LEU 19 Ca 0.10 0.01 0.39 0.00 0.84 0.00 0.00 57.88 59.22 1ntr h LEU 19 Cb 0.26 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 1ntr h LEU 19 CO -0.60 -0.08 0.87 1.21 -0.34 0.00 0.00 178.44 179.50 1ntr n GLU 20 N -2.51 -0.01 0.20 1.25 0.00 -0.85 0.16 120.64 118.87 1ntr n GLU 20 Ca -0.02 0.85 -0.13 0.00 0.00 0.00 0.00 57.16 57.86 1ntr n GLU 20 Cb 0.05 -1.82 -0.08 0.00 0.00 0.00 0.00 31.44 29.60 1ntr n GLU 20 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 1ntr h ARG 21 N 0.00 -0.50 0.00 5.31 9.65 -0.48 0.16 114.38 128.52 1ntr h ARG 21 Ca 0.67 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.58 1ntr h ARG 21 Cb 2.47 0.11 0.00 0.00 -1.39 0.00 0.00 29.97 31.17 1ntr h ARG 21 CO -0.15 -0.19 0.00 0.00 2.80 0.00 0.00 179.97 182.43 1ntr n ALA 22 N -2.53 1.73 0.66 2.80 0.00 0.43 -1.70 120.51 121.90 1ntr n ALA 22 Ca -0.10 -0.06 0.09 0.00 0.00 0.00 0.00 53.44 53.38 1ntr n ALA 22 Cb 0.28 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.41 1ntr n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ntr n LEU 23 N -1.30 0.66 0.12 0.00 7.99 0.31 -4.26 117.00 120.52 1ntr n LEU 23 Ca 0.06 -0.37 -0.24 0.00 -0.01 0.00 0.00 56.01 55.45 1ntr n LEU 23 Cb 0.10 0.00 -0.15 0.00 -0.11 0.00 0.00 43.42 43.26 1ntr n LEU 23 CO 0.10 0.17 -0.16 0.00 -1.51 0.00 0.00 177.39 175.98 1ntr h ALA 24 N 2.45 -0.14 -0.90 -1.18 0.00 0.20 -2.05 119.26 117.65 1ntr h ALA 24 Ca 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 54.91 54.08 1ntr h ALA 24 Cb 0.56 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1ntr h ALA 24 CO 0.00 0.63 0.51 0.78 0.00 0.00 0.00 179.25 181.17 1ntr h GLY 25 N 0.07 1.32 1.76 0.00 0.00 -1.76 -1.97 103.07 102.50 1ntr h GLY 25 Ca -0.23 -0.58 -0.16 0.00 0.00 0.00 0.00 47.33 46.36 1ntr h GLY 25 CO 0.25 0.56 -0.67 0.00 0.00 0.00 0.00 176.54 176.67 1ntr h ALA 26 N 1.31 0.76 -2.29 3.60 0.00 -1.74 -3.48 119.26 117.42 1ntr h ALA 26 Ca 0.32 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ntr h ALA 26 Cb -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1ntr h ALA 26 CO -0.05 0.78 0.00 0.41 0.00 0.00 0.00 179.25 180.38 1ntr n GLY 27 N 0.42 0.31 2.10 0.00 0.00 -0.74 -5.11 105.19 102.18 1ntr n GLY 27 Ca -0.03 -0.36 -0.15 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.90 0.00 -4.29 0.99 4.32 -1.06 -4.83 117.00 111.24 1ntr n LEU 28 Ca 0.00 -2.01 -0.45 0.00 -0.02 0.00 0.00 56.01 53.54 1ntr n LEU 28 Cb 0.38 0.84 0.00 0.00 -1.62 0.00 0.00 43.42 43.02 1ntr n LEU 28 CO 0.00 -0.32 0.90 0.41 -1.22 0.00 0.00 177.39 177.16 1ntr n THR 29 N -0.51 4.68 -2.58 -5.08 -1.04 -0.43 -4.89 114.28 104.44 1ntr n THR 29 Ca 0.00 -5.43 -0.42 0.00 -2.04 0.00 0.00 64.05 56.16 1ntr n THR 29 Cb 0.39 -2.49 -0.01 0.00 -1.82 0.00 0.00 70.33 66.39 1ntr n THR 29 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ntr s THR 31 N 4.53 4.70 -0.13 0.00 2.01 -0.65 -4.71 115.64 121.39 1ntr s THR 31 Ca 0.50 1.21 -0.05 0.00 0.31 0.00 0.00 61.69 63.67 1ntr s THR 31 Cb 0.02 -3.89 0.06 0.00 0.01 0.00 0.00 72.50 68.70 1ntr s THR 31 CO -0.01 0.47 0.25 0.42 -0.69 0.00 0.00 174.62 175.06 1ntr s THR 32 N -1.21 -0.39 -0.18 -0.82 -4.23 -1.26 -1.01 115.64 106.53 1ntr s THR 32 Ca 0.32 0.28 -0.08 0.00 -1.18 0.00 0.00 61.69 61.04 1ntr s THR 32 Cb -0.19 -0.43 -0.04 0.00 1.34 0.00 0.00 72.50 73.18 1ntr s THR 32 CO 0.20 0.11 0.07 -0.36 -0.54 0.00 0.00 174.62 174.10 1ntr s PHE 33 N 2.40 3.26 -1.15 3.99 0.08 -0.82 -4.86 117.98 120.88 1ntr s PHE 33 Ca 0.02 0.08 0.05 0.00 0.12 0.00 0.00 56.93 57.20 1ntr s PHE 33 Cb -0.12 -2.09 0.23 0.00 -0.57 0.00 0.00 43.02 40.47 1ntr s PHE 33 CO -0.08 0.15 1.11 -1.91 -0.10 0.00 0.00 175.22 174.39 1ntr n GLU 34 N 3.56 0.03 -4.05 0.44 0.00 -1.26 -1.11 120.64 118.24 1ntr n GLU 34 Ca -0.16 0.35 -0.17 0.00 0.00 0.00 0.00 57.16 57.18 1ntr n GLU 34 Cb 0.52 -1.50 -0.16 0.00 0.00 0.00 0.00 31.44 30.31 1ntr n GLU 34 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1ntr s ASN 35 N -2.85 0.56 0.10 4.31 2.47 -1.24 -3.68 114.94 114.61 1ntr s ASN 35 Ca 0.03 -0.07 -0.35 0.00 0.42 0.00 0.00 52.86 52.90 1ntr s ASN 35 Cb 0.03 -0.21 -0.15 0.00 -1.45 0.00 0.00 41.25 39.48 1ntr s ASN 35 CO 0.09 -0.03 1.56 1.23 -3.72 0.00 0.00 177.10 176.22 1ntr h GLY 36 N 6.78 -1.16 0.00 1.21 0.00 -1.83 -1.94 103.07 106.13 1ntr h GLY 36 Ca -0.36 0.65 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1ntr h GLY 36 CO 0.49 -0.27 0.00 0.70 0.00 0.00 0.00 176.54 177.46 1ntr n ASN 37 N -5.49 0.00 -0.34 0.19 4.13 -1.26 -0.32 115.26 112.17 1ntr n ASN 37 Ca -0.08 0.83 0.28 0.00 1.68 0.00 0.00 54.58 57.29 1ntr n ASN 37 Cb 0.41 -0.33 0.46 0.00 -1.54 0.00 0.00 39.78 38.78 1ntr n ASN 37 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1ntr n GLU 38 N -2.05 -0.02 0.40 3.52 4.07 -1.15 0.12 120.64 125.54 1ntr n GLU 38 Ca 0.00 0.77 -0.18 0.00 -0.06 0.00 0.00 57.16 57.70 1ntr n GLU 38 Cb 0.00 -1.59 -0.09 0.00 -0.06 0.00 0.00 31.44 29.70 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 0.22 0.00 6.31 2.07 0.14 -1.09 116.25 123.90 1ntr h VAL 39 Ca 0.58 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.99 1ntr h VAL 39 Cb 1.98 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1ntr h VAL 39 CO -0.22 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.38 1ntr n LEU 40 N -5.49 0.29 0.05 2.57 -0.00 0.33 -1.04 117.00 113.72 1ntr n LEU 40 Ca -0.14 0.62 -0.07 0.00 -0.00 0.00 0.00 56.01 56.42 1ntr n LEU 40 Cb 0.41 -0.64 -0.12 0.00 -0.00 0.00 0.00 43.42 43.07 1ntr n LEU 40 CO 0.37 -0.65 0.07 0.00 -0.00 0.00 0.00 177.39 177.17 1ntr h ALA 41 N 2.09 0.38 0.00 1.47 0.00 -0.39 -2.95 119.26 119.86 1ntr h ALA 41 Ca 0.00 -0.96 -0.23 0.00 0.00 0.00 0.00 54.91 53.71 1ntr h ALA 41 Cb 0.07 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1ntr h ALA 41 CO 0.00 1.27 -1.47 0.00 0.00 0.00 0.00 179.25 179.05 1ntr h ALA 42 N 0.98 0.69 -0.19 0.00 0.00 -0.25 -3.29 119.26 117.19 1ntr h ALA 42 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 53.70 1ntr h ALA 42 Cb 1.80 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.91 1ntr h ALA 42 CO 0.13 1.30 0.00 1.28 0.00 0.00 0.00 179.25 181.95 1ntr n LEU 43 N -3.04 1.46 -0.48 0.00 4.77 -0.82 -4.37 117.00 114.52 1ntr n LEU 43 Ca -0.12 -0.65 0.38 0.00 -0.03 0.00 0.00 56.01 55.59 1ntr n LEU 43 Cb 0.96 -0.12 0.59 0.00 -2.33 0.00 0.00 43.42 42.52 1ntr n LEU 43 CO 0.44 0.33 1.17 0.00 -1.33 0.00 0.00 177.39 178.00 1ntr n ALA 44 N 0.22 1.37 0.33 -1.18 0.00 -1.12 0.97 120.51 121.10 1ntr n ALA 44 Ca 0.14 0.47 -0.17 0.00 0.00 0.00 0.00 53.44 53.88 1ntr n ALA 44 Cb 0.28 -0.82 -0.09 0.00 0.00 0.00 0.00 19.45 18.82 1ntr n ALA 44 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ntr h SER 45 N 0.00 -0.70 0.00 0.00 0.87 -1.90 -3.49 113.55 108.33 1ntr h SER 45 Ca 0.68 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 61.23 1ntr h SER 45 Cb 2.92 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 65.06 1ntr h SER 45 CO -0.01 -0.43 0.00 1.17 -0.53 0.00 0.00 176.83 177.03 1ntr n LYS 46 N -5.41 -0.77 -1.88 2.24 4.81 0.27 -5.09 118.16 112.34 1ntr n LYS 46 Ca -0.13 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 56.98 1ntr n LYS 46 Cb 0.35 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.43 1ntr n LYS 46 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1ntr s THR 47 N -3.00 3.28 0.00 3.15 2.01 -1.26 -4.81 115.64 115.00 1ntr s THR 47 Ca 0.00 0.63 0.00 0.00 0.31 0.00 0.00 61.69 62.63 1ntr s THR 47 Cb 0.00 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.35 1ntr s THR 47 CO 0.00 -0.33 0.00 -0.81 -0.69 0.00 0.00 174.62 172.79 1ntr n PRO 48 N -2.16 0.00 0.00 4.92 -0.04 -1.26 -5.10 135.00 131.36 1ntr n PRO 48 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1ntr n PRO 48 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1ntr n PRO 48 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ntr n ASP 49 N 0.00 0.00 -3.78 3.54 9.92 -0.85 -4.96 116.55 120.42 1ntr n ASP 49 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 1ntr n ASP 49 Cb 0.00 -0.23 -0.12 0.00 -0.64 0.00 0.00 41.12 40.12 1ntr n ASP 49 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1ntr s VAL 50 N -0.47 -0.01 -0.38 2.53 1.01 -0.65 -4.47 120.40 117.95 1ntr s VAL 50 Ca 0.00 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.90 1ntr s VAL 50 Cb 0.00 -0.30 0.02 0.00 0.00 0.00 0.00 36.38 36.10 1ntr s VAL 50 CO 0.00 0.02 0.24 -0.76 0.00 0.00 0.00 175.10 174.60 1ntr s LEU 51 N 0.42 4.83 0.57 3.92 1.02 -1.10 -1.15 118.68 127.20 1ntr s LEU 51 Ca -0.03 -0.91 -0.08 0.00 0.02 0.00 0.00 54.13 53.13 1ntr s LEU 51 Cb -0.04 -2.08 -0.03 0.00 0.02 0.00 0.00 46.19 44.06 1ntr s LEU 51 CO -0.02 -0.39 0.92 -0.76 0.02 0.00 0.00 176.35 176.12 1ntr s LEU 52 N 1.61 3.35 -0.17 1.79 1.43 0.01 -1.37 118.68 125.33 1ntr s LEU 52 Ca 0.03 1.10 -0.13 0.00 -1.03 0.00 0.00 54.13 54.10 1ntr s LEU 52 Cb -0.19 -4.06 0.05 0.00 0.03 0.00 0.00 46.19 42.02 1ntr s LEU 52 CO 0.08 -0.83 0.44 -0.44 0.23 0.00 0.00 176.35 175.83 1ntr s SER 53 N -4.19 -0.49 0.00 2.29 0.01 0.41 -0.29 113.70 111.44 1ntr s SER 53 Ca 0.52 0.91 0.00 0.00 1.31 0.00 0.00 55.95 58.69 1ntr s SER 53 Cb -0.11 0.87 0.00 0.00 0.21 0.00 0.00 66.02 66.99 1ntr s SER 53 CO 0.49 -0.17 0.00 -0.90 0.41 0.00 0.00 173.24 173.07 1ntr n ASP 54 N 3.37 0.06 -3.67 2.44 5.68 -1.10 -2.35 116.55 120.98 1ntr n ASP 54 Ca -0.17 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 53.95 1ntr n ASP 54 Cb 0.56 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.39 1ntr n ASP 54 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 1ntr s ILE 55 N 2.10 -0.25 0.00 2.12 -5.25 -1.26 -4.73 121.20 113.94 1ntr s ILE 55 Ca 0.00 0.36 0.00 0.00 -0.99 0.00 0.00 60.65 60.02 1ntr s ILE 55 Cb 0.00 -0.28 0.00 0.00 2.95 0.00 0.00 42.46 45.13 1ntr s ILE 55 CO 0.00 0.15 0.00 -1.14 -1.79 0.00 0.00 174.94 172.16 1ntr n ARG 56 N 5.31 0.00 -1.20 0.37 0.63 -0.83 -5.04 116.66 115.90 1ntr n ARG 56 Ca -0.05 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.02 1ntr n ARG 56 Cb 0.50 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.36 1ntr n ARG 56 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 1ntr n MET 57 N 0.00 -2.28 -2.29 -0.14 2.81 -1.23 -4.20 117.12 109.79 1ntr n MET 57 Ca 0.00 1.70 -0.28 0.00 -1.81 0.00 0.00 57.70 57.31 1ntr n MET 57 Cb 0.00 -2.87 0.02 0.00 -0.71 0.00 0.00 33.22 29.66 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 -3.21 3.33 -0.88 0.03 0.04 -1.26 -4.86 135.00 128.19 1ntr s PRO 58 Ca 0.00 0.32 -0.32 0.00 0.04 0.00 0.00 61.00 61.05 1ntr s PRO 58 Cb 0.00 -2.23 -0.20 0.00 0.04 0.00 0.00 34.50 32.11 1ntr s PRO 58 CO 0.00 -0.51 2.61 0.41 0.04 0.00 0.00 177.00 179.54 1ntr n GLY 59 N -2.55 -0.36 0.02 0.56 0.00 -1.26 -3.72 105.19 97.88 1ntr n GLY 59 Ca 0.04 1.09 0.00 0.00 0.00 0.00 0.00 46.02 47.15 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 8.48 0.00 0.00 1.61 2.00 -1.26 -5.08 117.12 122.87 1ntr n MET 60 Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 57.70 58.31 1ntr n MET 60 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.31 1ntr n MET 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1ntr n ASP 61 N -0.75 0.00 0.00 7.83 9.92 -1.24 -5.08 116.55 127.23 1ntr n ASP 61 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1ntr n ASP 61 Cb 0.00 0.10 0.00 0.00 -0.64 0.00 0.00 41.12 40.58 1ntr n ASP 61 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ntr n GLY 62 N -1.06 2.56 0.70 0.44 0.00 -1.26 -4.98 105.19 101.60 1ntr n GLY 62 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1ntr n GLY 62 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ntr n LEU 63 N 0.00 0.00 -4.39 0.99 -0.00 -1.26 -1.96 117.00 110.38 1ntr n LEU 63 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.64 1ntr n LEU 63 Cb 0.00 0.13 -0.08 0.00 -0.00 0.00 0.00 43.42 43.47 1ntr n LEU 63 CO 0.00 -0.18 -0.26 0.00 -0.00 0.00 0.00 177.39 176.95 1ntr n ALA 64 N -1.53 -1.56 0.00 1.96 0.00 -1.26 -4.73 120.51 113.40 1ntr n ALA 64 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1ntr n ALA 64 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 -4.31 0.00 0.01 0.00 4.77 -1.26 -4.68 117.00 111.53 1ntr n LEU 65 Ca -0.07 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 55.95 1ntr n LEU 65 Cb 0.56 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.87 1ntr n LEU 65 CO 0.90 0.00 0.66 -0.11 -1.33 0.00 0.00 177.39 177.51 1ntr n LEU 66 N -0.94 0.05 0.08 2.23 7.94 -1.26 -1.83 117.00 123.28 1ntr n LEU 66 Ca 0.00 0.52 -0.11 0.00 -1.11 0.00 0.00 56.01 55.31 1ntr n LEU 66 Cb 0.11 -0.51 -0.07 0.00 0.53 0.00 0.00 43.42 43.48 1ntr n LEU 66 CO 0.00 -0.37 0.40 0.11 -1.11 0.00 0.00 177.39 176.42 1ntr h LYS 67 N 0.00 -0.27 0.25 1.96 1.57 -1.87 -3.07 116.57 115.15 1ntr h LYS 67 Ca 0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ntr h LYS 67 Cb 0.16 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ntr h LYS 67 CO 0.00 0.11 -0.12 -0.56 -0.57 0.00 0.00 179.45 178.31 1ntr h GLN 68 N -0.88 -0.32 0.00 3.15 3.07 -1.80 -2.56 115.11 115.77 1ntr h GLN 68 Ca -0.03 0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.73 1ntr h GLN 68 Cb 0.51 0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.14 1ntr h GLN 68 CO 0.05 0.00 0.63 1.51 0.09 0.00 0.00 178.83 181.11 1ntr n ILE 69 N -5.09 0.16 0.00 1.86 3.06 -0.76 -1.90 119.36 116.68 1ntr n ILE 69 Ca -0.09 0.74 0.00 0.00 -2.50 0.00 0.00 62.75 60.90 1ntr n ILE 69 Cb 0.25 -1.74 0.00 0.00 0.54 0.00 0.00 39.64 38.69 1ntr n ILE 69 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 1ntr n LYS 70 N -1.82 0.00 -0.35 9.51 3.00 -1.00 -4.55 118.16 122.95 1ntr n LYS 70 Ca -0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.23 1ntr n LYS 70 Cb 0.63 -0.28 -0.07 0.00 0.00 0.00 0.00 35.03 35.31 1ntr n LYS 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1ntr n GLN 71 N -2.08 -0.35 -0.28 1.64 1.13 -1.00 -0.84 117.38 115.59 1ntr n GLN 71 Ca 0.00 1.28 0.09 0.00 -1.94 0.00 0.00 57.00 56.43 1ntr n GLN 71 Cb 0.00 -1.89 0.18 0.00 0.11 0.00 0.00 30.24 28.64 1ntr n GLN 71 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1ntr n ARG 72 N -5.08 -0.07 -4.35 -1.09 0.00 -0.80 -4.24 116.66 101.02 1ntr n ARG 72 Ca 0.03 1.20 -0.34 0.00 -0.00 0.00 0.00 57.85 58.74 1ntr n ARG 72 Cb 0.24 -1.86 -0.09 0.00 -0.00 0.00 0.00 32.46 30.75 1ntr n ARG 72 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1ntr s HIS 73 N -5.84 3.11 0.00 2.89 3.76 -0.02 -5.04 115.29 114.15 1ntr s HIS 73 Ca -0.11 0.13 0.00 0.00 -0.15 0.00 0.00 55.06 54.93 1ntr s HIS 73 Cb 0.22 -1.73 0.00 0.00 1.11 0.00 0.00 32.58 32.18 1ntr s HIS 73 CO 0.61 0.46 0.19 -0.35 -0.85 0.00 0.00 174.74 174.80 1ntr n PRO 74 N 1.80 0.00 -3.15 8.40 -0.04 -1.26 -4.62 135.00 136.13 1ntr n PRO 74 Ca -0.17 0.19 0.06 0.00 -0.04 0.00 0.00 63.50 63.54 1ntr n PRO 74 Cb 0.53 -0.35 -0.00 0.00 -0.04 0.00 0.00 33.50 33.64 1ntr n PRO 74 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ntr s MET 75 N -1.40 0.12 0.35 0.54 0.23 -1.26 -4.84 119.30 113.05 1ntr s MET 75 Ca 0.00 0.13 0.07 0.00 -1.03 0.00 0.00 55.69 54.86 1ntr s MET 75 Cb 0.00 0.06 -0.07 0.00 -1.53 0.00 0.00 34.83 33.29 1ntr s MET 75 CO 0.00 -0.22 -0.01 -0.48 -2.03 0.00 0.00 175.02 172.28 1ntr s LEU 76 N 2.96 2.60 0.25 0.18 0.05 -1.26 -5.09 118.68 118.37 1ntr s LEU 76 Ca 0.26 -1.31 -0.30 0.00 0.05 0.00 0.00 54.13 52.84 1ntr s LEU 76 Cb -0.02 -0.74 -0.09 0.00 -2.05 0.00 0.00 46.19 43.29 1ntr s LEU 76 CO -0.22 -0.43 1.21 -2.16 -0.55 0.00 0.00 176.35 174.21 1ntr s PRO 77 N -3.74 4.49 0.17 1.48 0.04 -1.26 -4.91 135.00 131.26 1ntr s PRO 77 Ca 0.34 1.96 0.08 0.00 0.04 0.00 0.00 61.00 63.42 1ntr s PRO 77 Cb 0.07 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.39 1ntr s PRO 77 CO 0.16 -0.05 -0.16 0.14 0.04 0.00 0.00 177.00 177.12 1ntr s VAL 78 N -0.58 1.70 0.05 -0.36 -7.23 -1.08 -2.71 120.40 110.19 1ntr s VAL 78 Ca 0.50 -1.95 0.05 0.00 -1.81 0.00 0.00 61.98 58.77 1ntr s VAL 78 Cb -0.35 -1.83 -0.02 0.00 0.56 0.00 0.00 36.38 34.74 1ntr s VAL 78 CO 0.42 -0.41 -0.13 -0.63 -0.31 0.00 0.00 175.10 174.04 1ntr s ILE 79 N -2.30 1.03 -0.21 -0.62 1.01 -0.47 -1.34 121.20 118.30 1ntr s ILE 79 Ca 0.16 -1.09 -0.09 0.00 0.00 0.00 0.00 60.65 59.63 1ntr s ILE 79 Cb -0.04 -0.96 0.08 0.00 0.01 0.00 0.00 42.46 41.54 1ntr s ILE 79 CO 0.06 -0.11 0.48 -0.51 0.00 0.00 0.00 174.94 174.86 1ntr s ILE 80 N -1.02 -0.36 0.06 2.92 1.10 -1.26 -0.44 121.20 122.20 1ntr s ILE 80 Ca -0.01 0.10 -0.31 0.00 -0.51 0.00 0.00 60.65 59.92 1ntr s ILE 80 Cb -0.09 -0.73 -0.08 0.00 0.15 0.00 0.00 42.46 41.72 1ntr s ILE 80 CO 0.01 0.04 1.57 -0.04 -2.11 0.00 0.00 174.94 174.41 1ntr s MET 81 N 2.04 4.23 -1.03 3.50 -1.94 -0.99 -2.49 119.30 122.62 1ntr s MET 81 Ca -0.06 2.23 -0.19 0.00 -1.71 0.00 0.00 55.69 55.96 1ntr s MET 81 Cb -0.10 -3.54 0.12 0.00 2.01 0.00 0.00 34.83 33.32 1ntr s MET 81 CO -0.14 -0.67 1.30 0.95 -0.01 0.00 0.00 175.02 176.44 1ntr s THR 82 N 2.38 4.58 -0.05 2.05 -4.23 -0.56 -4.66 115.64 115.15 1ntr s THR 82 Ca 0.71 -1.65 0.11 0.00 -1.18 0.00 0.00 61.69 59.68 1ntr s THR 82 Cb -0.38 -4.89 -0.17 0.00 1.34 0.00 0.00 72.50 68.40 1ntr s THR 82 CO 0.31 -1.65 0.26 0.00 -0.54 0.00 0.00 174.62 172.99 1ntr n ALA 83 N 6.98 2.49 0.00 3.99 0.00 -1.26 -4.92 120.51 127.79 1ntr n ALA 83 Ca 0.30 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1ntr n ALA 83 Cb 0.48 -0.38 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.84 0.00 -1.09 0.00 -0.00 -1.26 -5.14 115.22 105.88 1ntr n HIS 84 Ca -0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.64 1ntr n HIS 84 Cb 0.28 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.32 1ntr n HIS 84 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 1ntr n SER 85 N 0.00 -0.24 0.00 0.26 7.64 -1.26 -4.19 113.62 115.83 1ntr n SER 85 Ca 0.00 -1.01 0.00 0.00 1.01 0.00 0.00 58.87 58.87 1ntr n SER 85 Cb 0.00 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 1ntr n SER 85 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1ntr n ASP 86 N -3.24 0.00 -0.45 6.43 5.68 -1.26 -4.76 116.55 118.94 1ntr n ASP 86 Ca 0.04 0.00 0.35 0.00 -0.50 0.00 0.00 54.79 54.68 1ntr n ASP 86 Cb 0.13 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 40.67 1ntr n ASP 86 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1ntr n LEU 87 N 0.00 0.05 0.03 -2.12 7.99 -1.26 -0.74 117.00 120.95 1ntr n LEU 87 Ca 0.00 0.80 -0.01 0.00 -0.01 0.00 0.00 56.01 56.79 1ntr n LEU 87 Cb 0.00 -0.40 -0.01 0.00 -0.11 0.00 0.00 43.42 42.91 1ntr n LEU 87 CO 0.00 -0.83 0.25 -0.78 -1.51 0.00 0.00 177.39 174.51 1ntr h ASP 88 N 0.00 -0.06 -1.24 -1.43 3.58 -1.91 -1.04 116.42 114.32 1ntr h ASP 88 Ca 0.66 0.00 0.36 0.00 0.42 0.00 0.00 57.03 58.47 1ntr h ASP 88 Cb 2.49 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 43.50 1ntr h ASP 88 CO -0.11 -0.02 1.18 0.00 -2.88 0.00 0.00 179.24 177.41 1ntr h ALA 89 N -1.91 3.15 -1.38 -0.78 0.00 -1.32 -2.33 119.26 114.69 1ntr h ALA 89 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ntr h ALA 89 Cb 0.06 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ntr h ALA 89 CO 0.01 -1.82 0.00 0.00 0.00 0.00 0.00 179.25 177.45 1ntr n ALA 90 N -2.47 0.00 -0.50 0.00 0.00 -0.96 -4.06 120.51 112.51 1ntr n ALA 90 Ca 0.28 -0.02 0.38 0.00 0.00 0.00 0.00 53.44 54.08 1ntr n ALA 90 Cb 1.56 0.00 0.59 0.00 0.00 0.00 0.00 19.45 21.59 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 -1.40 -0.01 -1.19 0.00 0.31 -0.40 -3.61 118.33 112.02 1ntr n VAL 91 Ca 0.00 1.08 0.00 0.00 -0.01 0.00 0.00 64.34 65.41 1ntr n VAL 91 Cb 0.00 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.13 1ntr n VAL 91 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1ntr n SER 92 N -3.42 0.00 -3.36 4.52 7.64 -0.92 -3.64 113.62 114.44 1ntr n SER 92 Ca 0.32 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 60.10 1ntr n SER 92 Cb 1.43 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.63 1ntr n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ntr n ALA 93 N -3.00 -2.62 -1.02 -0.43 0.00 -1.26 -0.90 120.51 111.28 1ntr n ALA 93 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.32 1ntr n ALA 93 Cb 0.00 -1.24 -0.00 0.00 0.00 0.00 0.00 19.45 18.21 1ntr n ALA 93 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1ntr n TYR 94 N -2.15 0.00 -3.30 0.00 4.19 -1.26 -3.63 117.16 111.00 1ntr n TYR 94 Ca -0.13 0.00 -0.26 0.00 3.31 0.00 0.00 57.90 60.82 1ntr n TYR 94 Cb 0.58 -1.28 0.03 0.00 0.49 0.00 0.00 39.34 39.15 1ntr n TYR 94 CO 0.00 0.00 0.00 0.94 0.91 0.00 0.00 176.86 178.71 1ntr n GLN 95 N -0.62 -1.83 0.00 2.98 0.00 -0.08 -4.71 117.38 113.13 1ntr n GLN 95 Ca -0.01 1.52 0.00 0.00 -0.00 0.00 0.00 57.00 58.51 1ntr n GLN 95 Cb 0.31 -2.70 0.00 0.00 0.00 0.00 0.00 30.24 27.85 1ntr n GLN 95 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1ntr n GLN 96 N 0.07 0.00 0.00 3.69 6.02 -1.23 -4.98 117.38 120.95 1ntr n GLN 96 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 1ntr n GLN 96 Cb 0.58 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.84 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 0.00 1.40 2.29 1.08 0.00 -1.24 -4.28 105.19 104.44 1ntr n GLY 97 Ca 0.00 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 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 7.06 1.65 0.00 4.61 0.00 -1.26 -4.91 120.51 127.65 1ntr n ALA 98 Ca 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 53.44 50.35 1ntr n ALA 98 Cb 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 0.27 0.00 -1.57 0.00 1.16 -1.26 -2.62 117.46 113.44 1ntr n PHE 99 Ca 0.21 0.00 -0.59 0.00 -1.87 0.00 0.00 57.45 55.20 1ntr n PHE 99 Cb 0.67 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.47 1ntr n PHE 99 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 1ntr n ASP 100 N 0.40 0.64 0.00 5.98 5.75 -0.45 -4.78 116.55 124.09 1ntr n ASP 100 Ca 0.00 1.15 0.00 0.00 -0.01 0.00 0.00 54.79 55.93 1ntr n ASP 100 Cb 0.00 -0.98 0.00 0.00 -1.03 0.00 0.00 41.12 39.11 1ntr n ASP 100 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1ntr n TYR 101 N 2.31 0.00 -4.46 2.11 4.01 -1.26 -4.80 117.16 115.08 1ntr n TYR 101 Ca 0.22 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.62 1ntr n TYR 101 Cb 0.08 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.01 1ntr n TYR 101 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1ntr s LEU 102 N 0.00 3.34 0.00 7.72 2.96 -1.04 -4.95 118.68 126.72 1ntr s LEU 102 Ca 0.00 -0.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 1ntr s LEU 102 Cb 0.00 -1.82 0.00 0.00 0.50 0.00 0.00 46.19 44.87 1ntr s LEU 102 CO 0.00 0.33 0.00 -0.81 -1.32 0.00 0.00 176.35 174.55 1ntr n PRO 103 N 1.89 1.76 -3.62 0.98 -0.04 -1.26 -1.50 135.00 133.22 1ntr n PRO 103 Ca -0.17 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.19 1ntr n PRO 103 Cb 0.53 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.95 1ntr n PRO 103 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1ntr s LYS 104 N -0.84 1.14 0.38 0.54 0.00 -1.26 -4.15 119.74 115.54 1ntr s LYS 104 Ca 0.00 -0.70 -0.26 0.00 0.00 0.00 0.00 55.97 55.01 1ntr s LYS 104 Cb 0.00 0.49 -0.09 0.00 0.00 0.00 0.00 37.83 38.23 1ntr s LYS 104 CO 0.00 -0.46 1.12 -1.25 0.00 0.00 0.00 175.35 174.76 1ntr s PRO 105 N -3.81 4.21 0.30 1.78 0.04 -1.26 -5.16 135.00 131.11 1ntr s PRO 105 Ca 0.04 1.73 0.03 0.00 0.04 0.00 0.00 61.00 62.84 1ntr s PRO 105 Cb 0.01 -2.74 -0.06 0.00 0.04 0.00 0.00 34.50 31.76 1ntr s PRO 105 CO -0.11 -0.16 0.06 0.12 0.04 0.00 0.00 177.00 176.96 1ntr s PHE 106 N -1.44 1.85 0.00 0.56 5.36 -1.26 -5.16 117.98 117.89 1ntr s PHE 106 Ca 0.55 -1.00 0.00 0.00 -0.96 0.00 0.00 56.93 55.52 1ntr s PHE 106 Cb -0.28 -1.18 0.00 0.00 -0.34 0.00 0.00 43.02 41.22 1ntr s PHE 106 CO 0.36 -0.07 0.00 -3.47 -1.46 0.00 0.00 175.22 170.58 1ntr n ASP 107 N -0.62 0.00 0.00 6.13 2.03 -1.26 -5.07 116.55 117.76 1ntr n ASP 107 Ca -0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1ntr n ASP 107 Cb 0.66 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.06 1ntr n ASP 107 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1ntr n ILE 108 N 0.00 0.00 -0.14 5.18 5.41 -1.26 -4.65 119.36 123.90 1ntr n ILE 108 Ca 0.00 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.63 1ntr n ILE 108 Cb 0.00 -0.91 -0.01 0.00 -0.71 0.00 0.00 39.64 38.01 1ntr n ILE 108 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1ntr h ASP 109 N 0.00 0.89 -0.58 4.38 3.58 -1.98 -1.55 116.42 121.16 1ntr h ASP 109 Ca 0.00 -0.40 0.12 0.00 0.42 0.00 0.00 57.03 57.17 1ntr h ASP 109 Cb 0.49 -0.24 -0.09 0.00 1.72 0.00 0.00 39.33 41.21 1ntr h ASP 109 CO 0.00 1.09 0.04 -0.08 -2.88 0.00 0.00 179.24 177.41 1ntr h GLU 110 N 0.68 0.15 0.44 0.28 4.57 -2.00 -0.56 114.58 118.14 1ntr h GLU 110 Ca 0.10 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.24 1ntr h GLU 110 Cb 0.74 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.30 1ntr h GLU 110 CO 0.06 0.10 -0.21 0.00 -1.18 0.00 0.00 179.01 177.78 1ntr h ALA 111 N 1.50 -1.06 -1.91 2.92 0.00 -1.76 -2.56 119.26 116.41 1ntr h ALA 111 Ca 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ntr h ALA 111 Cb 0.47 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ntr h ALA 111 CO -0.46 -1.02 0.00 0.28 0.00 0.00 0.00 179.25 178.06 1ntr n VAL 112 N -3.71 0.00 0.00 0.00 0.31 -0.61 -1.31 118.33 113.02 1ntr n VAL 112 Ca -0.07 0.78 0.00 0.00 -0.01 0.00 0.00 64.34 65.04 1ntr n VAL 112 Cb 0.23 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 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 -1.12 0.00 -0.27 3.52 0.00 -0.27 -0.40 120.51 121.97 1ntr n ALA 113 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 1ntr n ALA 113 Cb 0.00 0.47 0.36 0.00 0.00 0.00 0.00 19.45 20.28 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 -2.90 0.10 0.25 0.00 7.94 -0.96 0.25 117.00 121.69 1ntr n LEU 114 Ca 0.00 1.37 -0.12 0.00 -1.11 0.00 0.00 56.01 56.15 1ntr n LEU 114 Cb 0.00 -0.59 -0.06 0.00 0.53 0.00 0.00 43.42 43.30 1ntr n LEU 114 CO 0.00 -1.47 0.36 0.58 -1.11 0.00 0.00 177.39 175.75 1ntr h VAL 115 N 0.00 0.17 -1.62 1.96 2.07 0.62 -1.95 116.25 117.50 1ntr h VAL 115 Ca 0.60 -0.49 0.48 0.00 0.82 0.00 0.00 66.70 68.10 1ntr h VAL 115 Cb 1.44 0.26 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 1ntr h VAL 115 CO -0.70 0.03 1.16 -0.62 0.02 0.00 0.00 177.57 177.46 1ntr n GLU 116 N -5.25 -0.00 -0.05 1.57 1.02 0.14 0.16 120.64 118.23 1ntr n GLU 116 Ca -0.10 0.94 -0.19 0.00 -0.02 0.00 0.00 57.16 57.79 1ntr n GLU 116 Cb 0.30 -2.13 -0.13 0.00 -0.02 0.00 0.00 31.44 29.46 1ntr n GLU 116 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ntr h ARG 117 N 0.00 0.08 0.29 3.49 3.08 -1.31 -3.32 114.38 116.68 1ntr h ARG 117 Ca 0.80 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.70 1ntr h ARG 117 Cb 3.13 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 33.20 1ntr h ARG 117 CO -0.06 1.07 -0.39 0.00 -1.07 0.00 0.00 179.97 179.52 1ntr h ALA 118 N -0.18 -1.01 -0.81 0.04 0.00 0.24 -1.15 119.26 116.40 1ntr h ALA 118 Ca -0.21 -0.13 0.33 0.00 0.00 0.00 0.00 54.91 54.90 1ntr h ALA 118 Cb 1.34 0.67 -0.15 0.00 0.00 0.00 0.00 17.79 19.66 1ntr h ALA 118 CO -0.05 -1.05 0.40 -0.89 0.00 0.00 0.00 179.25 177.66 1ntr n ILE 119 N -4.71 -0.34 -0.04 0.00 5.41 -0.15 0.14 119.36 119.66 1ntr n ILE 119 Ca -0.08 1.66 -0.14 0.00 1.00 0.00 0.00 62.75 65.18 1ntr n ILE 119 Cb 0.34 -2.67 -0.08 0.00 -0.71 0.00 0.00 39.64 36.51 1ntr n ILE 119 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 1ntr h SER 120 N 0.00 0.39 0.00 4.38 0.87 -1.35 -3.35 113.55 114.49 1ntr h SER 120 Ca 0.67 -0.58 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1ntr h SER 120 Cb 1.75 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.60 1ntr h SER 120 CO -0.64 0.90 0.00 1.41 -0.53 0.00 0.00 176.83 177.97 1ntr n HIS 121 N -4.48 0.00 -1.42 2.24 8.25 0.37 -4.32 115.22 115.85 1ntr n HIS 121 Ca -0.07 0.00 -0.57 0.00 -0.26 0.00 0.00 57.72 56.82 1ntr n HIS 121 Cb 0.44 -0.42 -0.09 0.00 1.12 0.00 0.00 29.99 31.03 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 -2.33 1.48 0.00 4.41 4.02 -1.07 -3.76 117.16 119.91 1ntr n TYR 122 Ca 0.00 0.60 0.00 0.00 -0.01 0.00 0.00 57.90 58.49 1ntr n TYR 122 Cb 0.00 -2.39 0.00 0.00 -0.02 0.00 0.00 39.34 36.93 1ntr n TYR 122 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1ntr n GLN 123 N 7.18 0.00 -0.36 -0.72 0.00 -1.26 -4.97 117.38 117.25 1ntr n GLN 123 Ca 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.45 1ntr n GLN 123 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.31 1ntr n GLN 123 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45