#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x8n s GLU 2 N 0.00 0.43 0.22 3.17 2.02 -1.26 -5.16 118.70 118.12 2x8n s GLU 2 Ca 0.00 -0.34 0.12 0.00 0.02 0.00 0.00 54.97 54.77 2x8n s GLU 2 Cb 0.00 -0.35 -0.05 0.00 0.10 0.00 0.00 34.13 33.84 2x8n s GLU 2 CO 0.00 0.09 -0.23 0.14 0.02 0.00 0.00 175.26 175.28 2x8n s VAL 3 N -0.47 2.40 -0.44 2.63 -7.23 -1.26 -5.05 120.40 110.97 2x8n s VAL 3 Ca -0.02 -2.13 0.26 0.00 -1.81 0.00 0.00 61.98 58.28 2x8n s VAL 3 Cb -0.04 -2.18 0.32 0.00 0.56 0.00 0.00 36.38 35.03 2x8n s VAL 3 CO -0.00 -0.20 1.75 0.77 -0.31 0.00 0.00 175.10 177.12 2x8n h SER 4 N 2.94 0.00 -2.96 4.85 4.64 -2.07 -3.44 113.55 117.50 2x8n h SER 4 Ca -0.45 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.33 2x8n h SER 4 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2x8n h SER 4 CO 0.51 0.00 0.79 0.00 -0.87 0.00 0.00 176.83 177.26 2x8n s ALA 5 N -3.28 3.55 -2.00 5.18 0.00 -1.26 -4.92 121.76 119.03 2x8n s ALA 5 Ca 0.07 0.84 0.16 0.00 0.00 0.00 0.00 51.96 53.02 2x8n s ALA 5 Cb 0.09 -3.57 0.94 0.00 0.00 0.00 0.00 23.12 20.58 2x8n s ALA 5 CO 0.57 -0.84 1.53 0.09 0.00 0.00 0.00 175.76 177.11 2x8n n ASN 6 N 5.18 0.00 0.26 0.00 3.02 -1.26 -3.80 115.26 118.66 2x8n n ASN 6 Ca 0.12 -1.31 0.14 0.00 -0.03 0.00 0.00 54.58 53.50 2x8n n ASN 6 Cb 0.44 0.00 0.70 0.00 -0.61 0.00 0.00 39.78 40.31 2x8n n ASN 6 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 2x8n h GLU 7 N 0.00 0.00 0.00 3.52 -0.00 -1.96 -1.26 114.58 114.88 2x8n h GLU 7 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2x8n h GLU 7 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2x8n h GLU 7 CO 0.00 0.12 0.00 1.37 -0.00 0.00 0.00 179.01 180.50 2x8n h LEU 8 N 0.00 0.00 0.83 3.06 8.10 -1.96 -3.47 115.31 121.87 2x8n h LEU 8 Ca -0.00 0.00 -0.33 0.00 0.11 0.00 0.00 57.88 57.65 2x8n h LEU 8 Cb 0.43 0.00 -0.09 0.00 -0.44 0.00 0.00 40.66 40.56 2x8n h LEU 8 CO 0.02 0.00 -0.49 -1.84 -4.11 0.00 0.00 178.44 172.02 2x8n n GLU 9 N -2.63 -2.98 0.28 0.17 0.28 -0.48 -4.85 120.64 110.44 2x8n n GLU 9 Ca 0.00 0.41 0.19 0.00 -0.16 0.00 0.00 57.16 57.59 2x8n n GLU 9 Cb 0.18 -5.06 0.92 0.00 1.43 0.00 0.00 31.44 28.90 2x8n n GLU 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2x8n h ALA 10 N 0.97 1.00 0.01 -1.84 0.00 -1.91 -1.13 119.26 116.36 2x8n h ALA 10 Ca -0.37 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.55 2x8n h ALA 10 Cb 1.25 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2x8n h ALA 10 CO 0.47 0.00 -0.12 0.00 0.00 0.00 0.00 179.25 179.61 2x8n h ALA 11 N 2.02 -0.14 -0.10 0.00 0.00 -1.91 -0.58 119.26 118.55 2x8n h ALA 11 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2x8n h ALA 11 Cb 0.19 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2x8n h ALA 11 CO 0.00 -0.61 0.03 1.03 0.00 0.00 0.00 179.25 179.70 2x8n h SER 12 N -0.20 0.02 -0.86 0.00 0.87 -1.60 -2.61 113.55 109.17 2x8n h SER 12 Ca 0.04 0.01 0.12 0.00 -1.23 0.00 0.00 61.79 60.73 2x8n h SER 12 Cb 0.25 0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 62.14 2x8n h SER 12 CO -0.11 0.03 0.49 -1.28 -0.53 0.00 0.00 176.83 175.43 2x8n h SER 13 N 0.07 0.66 0.61 6.23 0.87 -1.40 -1.99 113.55 118.60 2x8n h SER 13 Ca 0.04 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 2x8n h SER 13 Cb 0.03 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2x8n h SER 13 CO -0.05 0.34 -0.45 0.03 -0.53 0.00 0.00 176.83 176.17 2x8n h ARG 14 N 0.76 -0.98 -0.62 2.24 2.47 -0.82 -2.07 114.38 115.36 2x8n h ARG 14 Ca 0.44 0.07 0.07 0.00 -1.26 0.00 0.00 59.98 59.30 2x8n h ARG 14 Cb 0.51 0.22 -0.06 0.00 -1.65 0.00 0.00 29.97 28.99 2x8n h ARG 14 CO -0.30 -0.66 0.31 0.52 0.56 0.00 0.00 179.97 180.40 2x8n h MET 15 N -1.02 0.55 -0.15 0.04 2.86 -1.05 0.45 114.93 116.61 2x8n h MET 15 Ca -0.07 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2x8n h MET 15 Cb 0.85 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 2x8n h MET 15 CO 0.03 0.36 0.10 0.93 1.06 0.00 0.00 176.91 179.39 2x8n h GLU 16 N 0.56 0.20 0.00 1.72 5.08 -1.39 -1.98 114.58 118.77 2x8n h GLU 16 Ca 0.29 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.53 2x8n h GLU 16 Cb 0.24 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2x8n h GLU 16 CO -0.21 0.15 -0.47 0.52 -1.00 0.00 0.00 179.01 178.00 2x8n h MET 17 N 0.20 0.00 -0.12 2.33 2.86 -0.58 -2.67 114.93 116.94 2x8n h MET 17 Ca 0.06 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.55 2x8n h MET 17 Cb -0.01 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2x8n h MET 17 CO -0.01 0.47 -0.55 -0.07 1.06 0.00 0.00 176.91 177.81 2x8n h LEU 18 N 0.00 0.41 -0.18 1.22 3.38 -0.72 -0.87 115.31 118.55 2x8n h LEU 18 Ca -0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 2x8n h LEU 18 Cb 0.85 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 2x8n h LEU 18 CO 0.06 0.88 0.02 1.56 0.09 0.00 0.00 178.44 181.05 2x8n h GLN 19 N 0.28 0.31 0.00 1.13 4.20 -1.04 -2.50 115.11 117.48 2x8n h GLN 19 Ca 0.00 -0.09 -0.18 0.00 0.06 0.00 0.00 58.65 58.44 2x8n h GLN 19 Cb 1.06 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.77 2x8n h GLN 19 CO 0.09 0.48 -1.14 0.07 -0.67 0.00 0.00 178.83 177.67 2x8n h ARG 20 N 0.09 0.00 0.00 1.46 0.11 -1.48 -2.80 114.38 111.76 2x8n h ARG 20 Ca 0.06 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.13 2x8n h ARG 20 Cb 0.32 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.40 2x8n h ARG 20 CO 0.00 0.54 -0.01 1.49 0.10 0.00 0.00 179.97 182.09 2x8n h GLU 21 N 0.00 0.00 0.00 0.08 4.57 -1.26 -3.44 114.58 114.53 2x8n h GLU 21 Ca -0.11 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 2x8n h GLU 21 Cb 1.65 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.24 2x8n h GLU 21 CO 0.08 0.57 0.00 0.66 -1.18 0.00 0.00 179.01 179.14 2x8n n TYR 22 N -4.68 0.00 0.00 0.92 4.02 -0.95 -5.09 117.16 111.38 2x8n n TYR 22 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 2x8n n TYR 22 Cb 0.28 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 2x8n n TYR 22 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2x8n n SER 23 N -1.31 0.00 -4.95 7.72 2.88 -1.06 -4.91 113.62 111.99 2x8n n SER 23 Ca 0.00 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 2x8n n SER 23 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2x8n n SER 23 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2x8n s THR 24 N -2.00 3.92 -0.33 2.46 -4.23 -1.21 -4.31 115.64 109.94 2x8n s THR 24 Ca 0.00 -1.11 -0.17 0.00 -1.18 0.00 0.00 61.69 59.22 2x8n s THR 24 Cb 0.00 -3.34 -0.01 0.00 1.34 0.00 0.00 72.50 70.48 2x8n s THR 24 CO 0.00 -0.16 0.48 -0.22 -0.54 0.00 0.00 174.62 174.18 2x8n s LEU 25 N -4.11 4.27 -0.03 4.79 2.96 0.09 -0.60 118.68 126.05 2x8n s LEU 25 Ca 0.44 0.07 -0.14 0.00 -0.22 0.00 0.00 54.13 54.27 2x8n s LEU 25 Cb -0.08 -2.55 -0.32 0.00 0.50 0.00 0.00 46.19 43.74 2x8n s LEU 25 CO 0.30 -0.40 0.78 0.08 -1.32 0.00 0.00 176.35 175.78 2x8n h ARG 26 N 8.36 0.41 -3.39 1.98 0.11 -1.65 -3.47 114.38 116.74 2x8n h ARG 26 Ca -0.29 -0.70 -0.03 0.00 0.10 0.00 0.00 59.98 59.06 2x8n h ARG 26 Cb 1.13 0.26 -0.10 0.00 1.11 0.00 0.00 29.97 32.38 2x8n h ARG 26 CO 0.74 1.34 -0.02 -1.12 0.10 0.00 0.00 179.97 181.01 2x8n s SER 27 N -7.32 -0.21 0.01 0.08 0.01 -1.04 -5.05 113.70 100.19 2x8n s SER 27 Ca -0.14 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.55 2x8n s SER 27 Cb 0.04 0.57 -0.01 0.00 0.21 0.00 0.00 66.02 66.83 2x8n s SER 27 CO 0.87 -1.05 -0.03 -0.69 0.41 0.00 0.00 173.24 172.74 2x8n s VAL 28 N -3.90 0.17 -0.18 3.43 1.01 -1.26 -0.83 120.40 118.84 2x8n s VAL 28 Ca 0.11 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.47 2x8n s VAL 28 Cb -0.01 -0.24 0.06 0.00 0.00 0.00 0.00 36.38 36.20 2x8n s VAL 28 CO -0.01 -0.26 0.10 0.00 0.00 0.00 0.00 175.10 174.93 2x8n s GLN 29 N -0.87 0.07 -0.38 2.72 -2.07 -0.26 -4.95 119.66 113.92 2x8n s GLN 29 Ca -0.08 -0.12 -0.29 0.00 -1.82 0.00 0.00 55.36 53.05 2x8n s GLN 29 Cb -0.06 -1.76 0.01 0.00 -1.09 0.00 0.00 33.01 30.11 2x8n s GLN 29 CO -0.00 -0.70 1.35 -0.47 -1.32 0.00 0.00 175.29 174.14 2x8n s TYR 30 N 2.14 2.53 -0.75 9.60 6.14 -1.26 -1.54 117.35 134.21 2x8n s TYR 30 Ca 0.03 0.74 -0.25 0.00 0.64 0.00 0.00 57.07 58.22 2x8n s TYR 30 Cb -0.16 -4.20 0.04 0.00 0.42 0.00 0.00 41.96 38.06 2x8n s TYR 30 CO -0.12 -1.83 1.21 1.03 0.64 0.00 0.00 175.55 176.49 2x8n s ARG 31 N 4.65 3.22 0.45 4.97 0.52 0.17 -4.85 118.95 128.08 2x8n s ARG 31 Ca 0.58 -0.51 0.30 0.00 -0.52 0.00 0.00 55.73 55.58 2x8n s ARG 31 Cb -0.14 -4.31 1.23 0.00 0.52 0.00 0.00 34.95 32.25 2x8n s ARG 31 CO 0.30 -2.06 1.89 0.66 0.02 0.00 0.00 175.30 176.11 2x8n h SER 32 N 9.86 0.00 -0.06 0.23 4.64 -1.94 0.10 113.55 126.38 2x8n h SER 32 Ca -0.23 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.98 2x8n h SER 32 Cb 1.05 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 2x8n h SER 32 CO 1.26 0.00 -0.31 -0.33 -0.87 0.00 0.00 176.83 176.58 2x8n h GLU 33 N 0.00 0.53 0.00 4.77 3.07 -1.94 -3.21 114.58 117.81 2x8n h GLU 33 Ca 0.00 -0.23 -0.03 0.00 -0.50 0.00 0.00 59.36 58.60 2x8n h GLU 33 Cb 0.46 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2x8n h GLU 33 CO 0.00 0.78 -1.86 0.39 -1.40 0.00 0.00 179.01 176.93 2x8n n GLU 34 N -4.08 0.62 -2.94 2.33 -0.58 -1.14 -5.01 120.64 109.83 2x8n n GLU 34 Ca -0.01 -0.15 -0.10 0.00 -0.42 0.00 0.00 57.16 56.49 2x8n n GLU 34 Cb 0.45 -1.43 0.03 0.00 -0.57 0.00 0.00 31.44 29.93 2x8n n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2x8n n GLY 35 N 1.54 0.34 3.13 0.62 0.00 0.25 -5.07 105.19 105.99 2x8n n GLY 35 Ca -0.06 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.50 2x8n n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2x8n s VAL 36 N -3.13 0.92 -0.30 1.61 -7.23 -0.54 -4.26 120.40 107.47 2x8n s VAL 36 Ca 0.24 -1.17 -0.16 0.00 -1.81 0.00 0.00 61.98 59.08 2x8n s VAL 36 Cb -0.11 -0.90 -0.02 0.00 0.56 0.00 0.00 36.38 35.91 2x8n s VAL 36 CO 0.30 -0.23 0.43 -0.63 -0.31 0.00 0.00 175.10 174.65 2x8n s ILE 37 N -1.22 5.12 -0.39 -0.62 1.01 0.27 -0.65 121.20 124.72 2x8n s ILE 37 Ca -0.04 0.50 -0.13 0.00 0.00 0.00 0.00 60.65 60.98 2x8n s ILE 37 Cb -0.09 -3.80 0.02 0.00 0.01 0.00 0.00 42.46 38.59 2x8n s ILE 37 CO 0.02 0.02 0.25 -0.69 0.00 0.00 0.00 174.94 174.54 2x8n s VAL 38 N 2.18 4.96 -0.50 2.92 1.01 -0.59 -2.47 120.40 127.91 2x8n s VAL 38 Ca 0.17 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 61.20 2x8n s VAL 38 Cb -0.16 -3.75 0.04 0.00 0.00 0.00 0.00 36.38 32.51 2x8n s VAL 38 CO 0.11 -0.26 0.81 -0.36 0.00 0.00 0.00 175.10 175.40 2x8n s PHE 39 N 1.63 2.92 -0.44 5.22 0.08 0.13 -1.10 117.98 126.42 2x8n s PHE 39 Ca 0.04 -0.07 -0.28 0.00 0.12 0.00 0.00 56.93 56.74 2x8n s PHE 39 Cb -0.19 -3.79 0.03 0.00 -0.57 0.00 0.00 43.02 38.50 2x8n s PHE 39 CO 0.09 -1.14 1.07 0.42 -0.10 0.00 0.00 175.22 175.55 2x8n s ILE 40 N 3.40 4.34 0.84 0.64 1.01 -0.01 -1.45 121.20 129.97 2x8n s ILE 40 Ca 0.27 1.21 -0.11 0.00 0.00 0.00 0.00 60.65 62.02 2x8n s ILE 40 Cb -0.14 -4.52 0.10 0.00 0.01 0.00 0.00 42.46 37.91 2x8n s ILE 40 CO 0.19 -0.85 1.09 -0.76 0.00 0.00 0.00 174.94 174.61 2x8n s LEU 41 N 4.11 2.69 0.44 2.97 1.43 -0.14 -2.11 118.68 128.07 2x8n s LEU 41 Ca 0.45 1.73 0.17 0.00 -1.03 0.00 0.00 54.13 55.45 2x8n s LEU 41 Cb -0.09 -4.28 1.00 0.00 0.03 0.00 0.00 46.19 42.85 2x8n s LEU 41 CO 0.27 -2.40 1.94 0.00 0.23 0.00 0.00 176.35 176.40 2x8n h ALA 42 N -1.38 1.46 -0.16 4.21 0.00 -1.18 0.57 119.26 122.78 2x8n h ALA 42 Ca -0.46 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2x8n h ALA 42 Cb 1.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2x8n h ALA 42 CO 0.52 0.30 0.00 0.27 0.00 0.00 0.00 179.25 180.33 2x8n n ASN 43 N -4.04 1.35 0.00 0.00 0.23 -1.26 -4.91 115.26 106.63 2x8n n ASN 43 Ca -0.02 -2.08 0.00 0.00 -0.53 0.00 0.00 54.58 51.95 2x8n n ASN 43 Cb 0.31 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 2x8n n ASN 43 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2x8n n ASP 44 N 0.06 -1.89 -4.78 0.53 2.03 0.19 -5.00 116.55 107.69 2x8n n ASP 44 Ca 0.06 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.99 2x8n n ASP 44 Cb 0.26 -0.96 -0.06 0.00 -0.72 0.00 0.00 41.12 39.64 2x8n n ASP 44 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2x8n s ARG 45 N -0.39 4.52 -0.26 -0.67 3.52 -1.26 -4.71 118.95 119.71 2x8n s ARG 45 Ca 0.00 1.14 -0.17 0.00 -0.13 0.00 0.00 55.73 56.57 2x8n s ARG 45 Cb 0.00 -3.12 -0.03 0.00 -1.56 0.00 0.00 34.95 30.24 2x8n s ARG 45 CO 0.00 0.49 0.46 -1.21 -0.81 0.00 0.00 175.30 174.24 2x8n s GLU 46 N -1.45 4.05 -0.31 5.12 2.02 -1.26 -0.97 118.70 125.91 2x8n s GLU 46 Ca 0.40 0.22 -0.14 0.00 0.02 0.00 0.00 54.97 55.46 2x8n s GLU 46 Cb -0.21 -3.65 -0.03 0.00 0.10 0.00 0.00 34.13 30.34 2x8n s GLU 46 CO 0.25 -0.32 0.34 -0.51 0.02 0.00 0.00 175.26 175.04 2x8n s LEU 47 N 2.22 4.23 -0.31 1.80 1.43 -0.53 -4.95 118.68 122.57 2x8n s LEU 47 Ca 0.19 -0.02 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 2x8n s LEU 47 Cb -0.16 -2.33 0.05 0.00 0.03 0.00 0.00 46.19 43.78 2x8n s LEU 47 CO 0.09 -0.24 0.01 -0.75 0.23 0.00 0.00 176.35 175.70 2x8n s LYS 48 N 1.99 2.45 0.01 1.70 2.20 -1.26 -0.69 119.74 126.13 2x8n s LYS 48 Ca 0.12 -1.26 0.02 0.00 -0.36 0.00 0.00 55.97 54.48 2x8n s LYS 48 Cb -0.16 -3.22 -0.01 0.00 -1.51 0.00 0.00 37.83 32.93 2x8n s LYS 48 CO 0.11 -0.63 -0.05 -0.06 -0.36 0.00 0.00 175.35 174.36 2x8n s PHE 49 N 1.27 0.45 0.67 4.03 0.08 -1.03 -5.01 117.98 118.44 2x8n s PHE 49 Ca -0.05 -0.17 -0.15 0.00 0.12 0.00 0.00 56.93 56.69 2x8n s PHE 49 Cb -0.20 -0.29 0.00 0.00 -0.57 0.00 0.00 43.02 41.97 2x8n s PHE 49 CO -0.01 -0.03 1.11 1.03 -0.10 0.00 0.00 175.22 177.22 2x8n s ARG 50 N -0.42 2.78 0.18 0.44 0.52 -1.26 -0.56 118.95 120.63 2x8n s ARG 50 Ca -0.01 1.37 -0.14 0.00 -0.52 0.00 0.00 55.73 56.43 2x8n s ARG 50 Cb -0.04 -1.95 0.18 0.00 0.52 0.00 0.00 34.95 33.66 2x8n s ARG 50 CO -0.00 -1.26 1.69 -1.35 0.02 0.00 0.00 175.30 174.39 2x8n h PRO 51 N -0.05 0.11 0.00 3.54 0.11 -1.85 -2.13 132.00 131.74 2x8n h PRO 51 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2x8n h PRO 51 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2x8n h PRO 51 CO 0.54 0.08 0.00 -0.44 -0.21 0.00 0.00 178.00 177.97 2x8n h ASP 52 N 0.12 0.00 0.40 -2.05 3.32 -1.93 -1.82 116.42 114.46 2x8n h ASP 52 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2x8n h ASP 52 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2x8n h ASP 52 CO -0.40 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 177.59 2x8n n ASP 53 N -3.03 0.00 -4.22 6.45 10.43 -0.80 -4.76 116.55 120.62 2x8n n ASP 53 Ca -0.00 0.04 -0.23 0.00 2.57 0.00 0.00 54.79 57.17 2x8n n ASP 53 Cb 0.25 -0.30 -0.14 0.00 1.84 0.00 0.00 41.12 42.77 2x8n n ASP 53 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2x8n s LEU 54 N -2.61 2.19 0.13 0.64 1.43 -0.69 -4.80 118.68 114.97 2x8n s LEU 54 Ca 0.18 -0.53 -0.23 0.00 -1.03 0.00 0.00 54.13 52.53 2x8n s LEU 54 Cb 0.13 -0.83 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 2x8n s LEU 54 CO 0.31 0.10 1.66 -0.61 0.23 0.00 0.00 176.35 178.04 2x8n h GLN 55 N 4.76 -0.21 -0.16 1.70 5.75 -1.54 -1.23 115.11 124.17 2x8n h GLN 55 Ca -0.42 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.14 2x8n h GLN 55 Cb 1.17 0.05 -0.05 0.00 1.07 0.00 0.00 27.48 29.72 2x8n h GLN 55 CO 0.43 -0.14 -0.16 0.00 -2.65 0.00 0.00 178.83 176.31 2x8n h ALA 56 N 0.80 -0.05 -0.40 3.38 0.00 -1.85 -3.24 119.26 117.90 2x8n h ALA 56 Ca 0.09 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2x8n h ALA 56 Cb 0.35 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 2x8n h ALA 56 CO -0.24 -0.60 0.05 0.25 0.00 0.00 0.00 179.25 178.71 2x8n n THR 57 N -5.30 2.52 -2.30 0.00 -2.24 -1.15 -4.76 114.28 101.04 2x8n n THR 57 Ca -0.02 -2.08 -0.35 0.00 -2.27 0.00 0.00 64.05 59.33 2x8n n THR 57 Cb 0.22 -0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 2x8n n THR 57 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2x8n s TYR 58 N -3.00 2.29 0.00 4.78 5.04 -0.48 -2.22 117.35 123.77 2x8n s TYR 58 Ca 0.46 -0.39 0.00 0.00 -2.44 0.00 0.00 57.07 54.69 2x8n s TYR 58 Cb 0.38 -4.34 0.00 0.00 0.35 0.00 0.00 41.96 38.35 2x8n s TYR 58 CO 0.07 -1.55 0.00 0.41 -1.34 0.00 0.00 175.55 173.15 2x8n n GLY 59 N 5.87 1.16 3.84 8.97 0.00 -1.26 -5.04 105.19 118.73 2x8n n GLY 59 Ca 0.45 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.14 2x8n n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x8n s ALA 60 N -2.00 3.06 0.20 4.61 0.00 -0.94 -5.08 121.76 121.61 2x8n s ALA 60 Ca 0.00 0.22 -0.09 0.00 0.00 0.00 0.00 51.96 52.09 2x8n s ALA 60 Cb 0.00 -3.12 -0.07 0.00 0.00 0.00 0.00 23.12 19.93 2x8n s ALA 60 CO 0.00 -0.17 0.52 0.95 0.00 0.00 0.00 175.76 177.06 2x8n s THR 61 N -2.54 4.97 0.55 0.00 -4.23 -1.26 -5.01 115.64 108.12 2x8n s THR 61 Ca 0.59 0.44 0.27 0.00 -1.18 0.00 0.00 61.69 61.82 2x8n s THR 61 Cb -0.10 -3.63 0.33 0.00 1.34 0.00 0.00 72.50 70.44 2x8n s THR 61 CO 0.28 -0.01 2.21 1.55 -0.54 0.00 0.00 174.62 178.11 2x8n h PRO 62 N 2.72 0.00 -0.56 3.99 0.13 -1.98 -2.24 132.00 134.07 2x8n h PRO 62 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2x8n h PRO 62 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 2x8n h PRO 62 CO 0.69 0.02 0.28 1.05 -0.23 0.00 0.00 178.00 179.81 2x8n h GLU 63 N 0.00 0.78 0.00 0.86 4.11 -2.01 -1.97 114.58 116.35 2x8n h GLU 63 Ca -0.00 -0.09 0.00 0.00 0.07 0.00 0.00 59.36 59.34 2x8n h GLU 63 Cb 0.06 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2x8n h GLU 63 CO 0.00 0.59 0.00 1.96 0.07 0.00 0.00 179.01 181.64 2x8n h GLN 64 N 0.78 0.00 -0.65 1.06 4.20 -1.73 -2.82 115.11 115.95 2x8n h GLN 64 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 2x8n h GLN 64 Cb 0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 2x8n h GLN 64 CO -0.03 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.41 2x8n n LEU 65 N -2.99 4.18 -0.09 1.46 4.77 -0.75 -3.82 117.00 119.76 2x8n n LEU 65 Ca 0.02 -2.11 -0.11 0.00 -0.03 0.00 0.00 56.01 53.79 2x8n n LEU 65 Cb 0.41 -0.53 -0.12 0.00 -2.33 0.00 0.00 43.42 40.85 2x8n n LEU 65 CO 0.30 0.76 -1.10 0.54 -1.33 0.00 0.00 177.39 176.56 2x8n n ARG 66 N 1.08 0.99 -3.61 3.23 1.74 -1.06 -4.42 116.66 114.60 2x8n n ARG 66 Ca 0.23 0.04 -0.39 0.00 -0.77 0.00 0.00 57.85 56.96 2x8n n ARG 66 Cb 0.77 -1.42 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 2x8n n ARG 66 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2x8n s GLU 67 N -2.41 3.46 -0.07 5.56 -1.05 -1.24 -5.09 118.70 117.86 2x8n s GLU 67 Ca -0.16 -0.65 -0.04 0.00 -0.15 0.00 0.00 54.97 53.97 2x8n s GLU 67 Cb 0.06 -3.64 0.03 0.00 -0.44 0.00 0.00 34.13 30.14 2x8n s GLU 67 CO 0.60 -0.39 0.17 0.42 0.95 0.00 0.00 175.26 177.01 2x8n s ILE 68 N 1.66 -0.03 0.22 1.83 1.01 -1.26 -4.71 121.20 119.92 2x8n s ILE 68 Ca 0.05 0.11 0.08 0.00 0.00 0.00 0.00 60.65 60.89 2x8n s ILE 68 Cb -0.17 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 2x8n s ILE 68 CO 0.08 0.05 0.06 -0.70 0.00 0.00 0.00 174.94 174.43 2x8n s GLU 69 N 0.81 2.55 0.65 2.79 2.56 -0.93 -5.03 118.70 122.09 2x8n s GLU 69 Ca -0.06 -1.17 -0.11 0.00 0.00 0.00 0.00 54.97 53.63 2x8n s GLU 69 Cb -0.08 -2.37 -0.02 0.00 2.00 0.00 0.00 34.13 33.66 2x8n s GLU 69 CO -0.04 0.41 1.04 0.42 -0.56 0.00 0.00 175.26 176.53 2x8n s ILE 70 N -2.03 4.43 0.58 -3.70 -1.09 -1.26 -0.71 121.20 117.42 2x8n s ILE 70 Ca 0.30 0.79 -0.18 0.00 -2.23 0.00 0.00 60.65 59.34 2x8n s ILE 70 Cb -0.08 -3.70 -0.08 0.00 -1.58 0.00 0.00 42.46 37.01 2x8n s ILE 70 CO 0.21 -1.03 0.54 -1.20 -1.23 0.00 0.00 174.94 172.23 2x8n n SER 71 N -2.88 -0.98 0.20 3.58 7.64 -0.97 -3.79 113.62 116.42 2x8n n SER 71 Ca 0.06 0.73 0.15 0.00 1.01 0.00 0.00 58.87 60.82 2x8n n SER 71 Cb 0.54 -1.19 0.62 0.00 -1.01 0.00 0.00 64.21 63.17 2x8n n SER 71 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2x8n h PRO 72 N 0.20 0.00 -0.01 1.43 0.13 -1.94 -1.44 132.00 130.37 2x8n h PRO 72 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2x8n h PRO 72 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2x8n h PRO 72 CO 0.47 0.00 -0.21 0.43 -0.23 0.00 0.00 178.00 178.46 2x8n n SER 73 N -2.63 1.18 0.00 1.44 7.64 -1.26 -4.97 113.62 115.03 2x8n n SER 73 Ca 0.01 -1.05 0.00 0.00 1.01 0.00 0.00 58.87 58.84 2x8n n SER 73 Cb 0.24 0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 2x8n n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x8n n GLY 74 N 1.31 0.30 0.00 0.23 0.00 -0.54 -4.87 105.19 101.62 2x8n n GLY 74 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2x8n n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x8n n LEU 75 N 0.00 2.32 0.00 0.99 4.77 -1.26 -3.86 117.00 119.96 2x8n n LEU 75 Ca 0.00 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2x8n n LEU 75 Cb 0.03 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2x8n n LEU 75 CO 0.00 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.59 2x8n n GLY 76 N 2.16 0.60 3.34 -0.72 0.00 -1.26 -0.73 105.19 108.59 2x8n n GLY 76 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2x8n n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x8n s VAL 77 N 1.87 0.95 -0.27 1.61 0.11 -0.58 -2.29 120.40 121.80 2x8n s VAL 77 Ca 0.00 -2.02 -0.02 0.00 -2.93 0.00 0.00 61.98 57.02 2x8n s VAL 77 Cb 0.00 -2.47 0.12 0.00 -1.53 0.00 0.00 36.38 32.50 2x8n s VAL 77 CO 0.00 -0.21 0.27 -0.47 -3.33 0.00 0.00 175.10 171.37 2x8n s TYR 78 N -3.48 -0.40 -0.63 1.54 6.14 0.11 -2.20 117.35 118.43 2x8n s TYR 78 Ca 0.32 -0.07 -0.25 0.00 0.64 0.00 0.00 57.07 57.71 2x8n s TYR 78 Cb 0.07 -0.44 0.05 0.00 0.42 0.00 0.00 41.96 42.06 2x8n s TYR 78 CO 0.11 -0.83 1.06 -0.06 0.64 0.00 0.00 175.55 176.46 2x8n s PHE 79 N 2.35 2.61 0.36 4.97 0.08 0.48 -2.19 117.98 126.64 2x8n s PHE 79 Ca 0.09 -0.14 0.09 0.00 0.12 0.00 0.00 56.93 57.09 2x8n s PHE 79 Cb -0.15 -4.33 0.70 0.00 -0.57 0.00 0.00 43.02 38.68 2x8n s PHE 79 CO -0.28 -1.65 1.87 1.49 -0.10 0.00 0.00 175.22 176.56 2x8n h GLU 80 N 9.59 0.25 0.00 0.44 4.81 -1.84 -0.85 114.58 126.98 2x8n h GLU 80 Ca -0.27 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 58.86 2x8n h GLU 80 Cb 1.06 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 2x8n h GLU 80 CO 1.17 0.44 -0.13 1.15 -0.73 0.00 0.00 179.01 180.91 2x8n h THR 81 N 0.23 0.51 -0.00 0.32 2.02 -1.88 -2.39 112.91 111.73 2x8n h THR 81 Ca 0.04 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.57 2x8n h THR 81 Cb 0.46 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 2x8n h THR 81 CO 0.03 0.13 -0.03 0.00 0.37 0.00 0.00 175.52 176.02 2x8n n LEU 82 N -3.53 1.14 -2.09 2.58 -0.00 -1.08 -5.01 117.00 109.01 2x8n n LEU 82 Ca -0.01 -0.91 -0.20 0.00 -0.00 0.00 0.00 56.01 54.88 2x8n n LEU 82 Cb 0.28 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.66 2x8n n LEU 82 CO 0.30 0.25 -0.23 -0.62 -0.00 0.00 0.00 177.39 177.09 2x8n n GLU 83 N 0.00 -1.62 -4.30 1.47 1.02 -0.37 -4.98 120.64 111.86 2x8n n GLU 83 Ca 0.02 1.06 -0.23 0.00 -0.02 0.00 0.00 57.16 58.00 2x8n n GLU 83 Cb 0.10 -5.61 -0.12 0.00 -0.02 0.00 0.00 31.44 25.78 2x8n n GLU 83 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2x8n s GLU 84 N -4.53 1.18 0.18 3.49 0.41 -0.92 -4.99 118.70 113.52 2x8n s GLU 84 Ca 0.00 -1.27 0.11 0.00 -0.41 0.00 0.00 54.97 53.40 2x8n s GLU 84 Cb 0.00 -1.33 -0.04 0.00 -1.78 0.00 0.00 34.13 30.98 2x8n s GLU 84 CO 0.00 0.29 -0.24 0.16 -0.49 0.00 0.00 175.26 174.98 2x8n s ASP 85 N -2.28 3.39 -0.33 -0.19 -4.77 -1.26 -0.39 116.67 110.84 2x8n s ASP 85 Ca 0.11 -0.85 -0.05 0.00 -3.30 0.00 0.00 52.55 48.46 2x8n s ASP 85 Cb -0.08 -0.25 0.04 0.00 -1.09 0.00 0.00 42.92 41.55 2x8n s ASP 85 CO 0.05 0.12 0.07 -0.69 0.70 0.00 0.00 175.17 175.43 2x8n s VAL 86 N -1.60 3.51 0.08 2.11 1.01 -0.93 -3.78 120.40 120.79 2x8n s VAL 86 Ca 0.20 -1.23 -0.31 0.00 0.00 0.00 0.00 61.98 60.64 2x8n s VAL 86 Cb -0.08 -3.00 -0.09 0.00 0.00 0.00 0.00 36.38 33.21 2x8n s VAL 86 CO 0.09 -0.16 1.74 -0.55 0.00 0.00 0.00 175.10 176.22 2x8n s SER 87 N 1.36 6.53 0.05 3.32 0.15 -1.26 -1.52 113.70 122.33 2x8n s SER 87 Ca -0.03 2.58 -0.21 0.00 0.70 0.00 0.00 55.95 58.99 2x8n s SER 87 Cb -0.20 -2.56 -0.13 0.00 -1.71 0.00 0.00 66.02 61.42 2x8n s SER 87 CO 0.01 -0.94 1.46 0.25 1.20 0.00 0.00 173.24 175.22 2x8n h LEU 88 N 8.83 0.25 -1.17 3.45 5.85 -1.90 -1.89 115.31 128.72 2x8n h LEU 88 Ca -0.44 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 57.93 2x8n h LEU 88 Cb 1.21 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 2x8n h LEU 88 CO 0.94 0.53 0.40 0.40 -0.34 0.00 0.00 178.44 180.37 2x8n h ILE 89 N -0.03 1.21 -0.96 4.05 1.08 -1.93 -1.35 117.51 119.57 2x8n h ILE 89 Ca 0.04 -0.50 0.03 0.00 -0.39 0.00 0.00 64.86 64.04 2x8n h ILE 89 Cb 0.41 0.24 -0.05 0.00 -3.07 0.00 0.00 36.82 34.35 2x8n h ILE 89 CO 0.01 0.23 0.63 1.23 -0.69 0.00 0.00 178.15 179.56 2x8n h GLY 90 N 1.02 1.39 1.10 5.37 0.00 -1.71 0.47 103.07 110.72 2x8n h GLY 90 Ca 0.25 -0.48 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 2x8n h GLY 90 CO -0.04 0.42 0.01 1.41 0.00 0.00 0.00 176.54 178.34 2x8n h LEU 91 N 1.22 1.05 -0.97 3.11 3.38 -0.46 0.33 115.31 122.98 2x8n h LEU 91 Ca 0.38 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 2x8n h LEU 91 Cb -0.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2x8n h LEU 91 CO -0.11 1.09 -0.34 -0.07 0.09 0.00 0.00 178.44 179.09 2x8n h LEU 92 N 0.98 0.00 -0.06 1.67 3.38 -0.62 -2.87 115.31 117.79 2x8n h LEU 92 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2x8n h LEU 92 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2x8n h LEU 92 CO 0.03 0.34 -0.93 -0.62 0.09 0.00 0.00 178.44 177.35 2x8n n GLU 93 N -3.51 0.08 -0.44 1.13 -0.58 0.09 -4.98 120.64 112.43 2x8n n GLU 93 Ca -0.00 -0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 2x8n n GLU 93 Cb 0.49 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.86 2x8n n GLU 93 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2x8n n GLY 94 N 1.49 1.80 3.50 0.62 0.00 0.29 -4.97 105.19 107.92 2x8n n GLY 94 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 2x8n n GLY 94 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2x8n s ARG 95 N -0.11 4.01 0.00 1.61 3.52 0.92 -4.87 118.95 124.02 2x8n s ARG 95 Ca 0.00 -2.32 0.00 0.00 -0.13 0.00 0.00 55.73 53.28 2x8n s ARG 95 Cb 0.00 -5.19 0.00 0.00 -1.56 0.00 0.00 34.95 28.20 2x8n s ARG 95 CO 0.00 -1.91 0.91 2.89 -0.81 0.00 0.00 175.30 176.38 2x8n n ARG 96 N 6.55 0.92 -1.53 5.12 1.85 -1.25 -4.35 116.66 123.97 2x8n n ARG 96 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.24 2x8n n ARG 96 Cb 0.44 -1.05 0.00 0.00 -1.05 0.00 0.00 32.46 30.80 2x8n n ARG 96 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2x8n n GLY 97 N 0.53 -0.52 3.83 2.89 0.00 -1.26 -1.47 105.19 109.18 2x8n n GLY 97 Ca 0.00 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 2x8n n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x8n s SER 98 N -4.00 6.86 0.20 1.61 0.01 -1.26 -4.99 113.70 112.13 2x8n s SER 98 Ca 0.00 1.63 -0.11 0.00 1.31 0.00 0.00 55.95 58.78 2x8n s SER 98 Cb 0.00 -2.52 0.13 0.00 0.21 0.00 0.00 66.02 63.84 2x8n s SER 98 CO 0.00 -0.39 1.83 0.00 0.41 0.00 0.00 173.24 175.08 2x8n h ALA 99 N 1.73 0.91 -0.47 1.44 0.00 -2.00 -1.94 119.26 118.93 2x8n h ALA 99 Ca -0.48 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2x8n h ALA 99 Cb 1.18 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2x8n h ALA 99 CO 0.61 0.40 0.30 1.57 0.00 0.00 0.00 179.25 182.14 2x8n h LYS 100 N 0.97 0.62 -0.85 0.00 2.10 -1.99 -2.67 116.57 114.75 2x8n h LYS 100 Ca 0.25 -0.04 0.08 0.00 -2.00 0.00 0.00 60.65 58.94 2x8n h LYS 100 Cb -0.00 -0.14 -0.07 0.00 -0.90 0.00 0.00 32.23 31.12 2x8n h LYS 100 CO -0.04 0.42 0.51 2.35 -2.00 0.00 0.00 179.45 180.69 2x8n h TRP 101 N 0.63 0.92 0.00 0.07 7.01 -1.83 0.04 115.95 122.80 2x8n h TRP 101 Ca 0.17 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.17 2x8n h TRP 101 Cb -0.06 -0.29 -0.00 0.00 -2.10 0.00 0.00 29.16 26.71 2x8n h TRP 101 CO -0.04 0.41 -0.15 0.52 -2.79 0.00 0.00 178.44 176.39 2x8n h MET 102 N 0.87 0.00 0.10 2.65 2.86 -1.17 0.75 114.93 121.00 2x8n h MET 102 Ca 0.40 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.74 2x8n h MET 102 Cb 0.30 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 2x8n h MET 102 CO -0.22 0.15 -1.49 0.00 1.06 0.00 0.00 176.91 176.41 2x8n h ALA 103 N 1.85 0.30 0.04 6.32 0.00 -0.73 -3.35 119.26 123.70 2x8n h ALA 103 Ca -0.00 -1.11 -0.26 0.00 0.00 0.00 0.00 54.91 53.54 2x8n h ALA 103 Cb 0.67 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 2x8n h ALA 103 CO 0.02 1.17 -1.36 0.93 0.00 0.00 0.00 179.25 180.01 2x8n h GLU 104 N 0.06 0.09 -3.66 0.00 5.08 -0.96 -3.40 114.58 111.79 2x8n h GLU 104 Ca -0.22 -0.15 -0.65 0.00 -1.00 0.00 0.00 59.36 57.34 2x8n h GLU 104 Cb 1.99 0.06 -0.41 0.00 0.50 0.00 0.00 28.75 30.90 2x8n h GLU 104 CO 0.16 0.92 -0.64 -1.01 -1.00 0.00 0.00 179.01 177.43 2x8n s HIS 105 N -2.65 3.31 0.76 4.33 3.76 0.25 -5.09 115.29 119.96 2x8n s HIS 105 Ca -0.04 -3.13 -0.15 0.00 -0.15 0.00 0.00 55.06 51.59 2x8n s HIS 105 Cb 0.08 -2.85 0.05 0.00 1.11 0.00 0.00 32.58 30.97 2x8n s HIS 105 CO 0.83 -0.79 1.16 -0.35 -0.85 0.00 0.00 174.74 174.75 2x8n n PRO 106 N 3.35 0.41 -4.16 8.40 -0.04 -1.26 -4.37 135.00 137.34 2x8n n PRO 106 Ca 0.05 0.21 -0.15 0.00 -0.04 0.00 0.00 63.50 63.56 2x8n n PRO 106 Cb 0.34 -2.40 -0.13 0.00 -0.04 0.00 0.00 33.50 31.27 2x8n n PRO 106 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2x8n s LEU 107 N -4.83 2.13 -1.14 1.53 2.96 -1.26 -5.06 118.68 113.01 2x8n s LEU 107 Ca 0.75 -0.34 -0.21 0.00 -0.22 0.00 0.00 54.13 54.11 2x8n s LEU 107 Cb -0.32 -0.28 -0.06 0.00 0.50 0.00 0.00 46.19 46.02 2x8n s LEU 107 CO 0.49 -0.05 1.91 0.00 -1.32 0.00 0.00 176.35 177.39 2x8n n ALA 108 N 2.18 2.79 -1.52 5.97 0.00 -1.26 -5.20 120.51 123.47 2x8n n ALA 108 Ca -0.18 -3.32 0.00 0.00 0.00 0.00 0.00 53.44 49.94 2x8n n ALA 108 Cb 0.56 -3.55 0.00 0.00 0.00 0.00 0.00 19.45 16.46 2x8n n ALA 108 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93