#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 3.79 -0.04 0.03 8.01 -1.26 -5.00 118.70 124.23 2x8n s GLU 2 Ca 0.00 -0.41 -0.06 0.00 0.01 0.00 0.00 54.97 54.51 2x8n s GLU 2 Cb 0.00 -3.40 -0.03 0.00 -4.31 0.00 0.00 34.13 26.39 2x8n s GLU 2 CO 0.00 -0.11 -0.13 1.33 0.01 0.00 0.00 175.26 176.36 2x8n n VAL 3 N 4.73 1.08 -2.92 2.63 0.24 -1.26 -5.02 118.33 117.81 2x8n n VAL 3 Ca -0.16 0.15 0.03 0.00 -2.04 0.00 0.00 64.34 62.33 2x8n n VAL 3 Cb 0.52 -1.80 0.00 0.00 -1.47 0.00 0.00 33.84 31.09 2x8n n VAL 3 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2x8n s SER 4 N -5.96 -0.44 0.00 -1.34 0.15 -1.26 -5.00 113.70 99.85 2x8n s SER 4 Ca -0.12 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.40 2x8n s SER 4 Cb 0.03 0.79 0.00 0.00 -1.71 0.00 0.00 66.02 65.13 2x8n s SER 4 CO 0.17 -0.06 0.00 0.00 1.20 0.00 0.00 173.24 174.55 2x8n n ALA 5 N 4.20 0.19 -2.04 5.45 0.00 -1.26 -4.92 120.51 122.13 2x8n n ALA 5 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.33 2x8n n ALA 5 Cb 0.61 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.02 2x8n n ALA 5 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2x8n n ASN 6 N 0.00 -5.12 0.13 0.00 4.13 -1.26 -4.89 115.26 108.25 2x8n n ASN 6 Ca 0.00 0.22 0.12 0.00 1.68 0.00 0.00 54.58 56.60 2x8n n ASN 6 Cb 0.12 -4.40 0.48 0.00 -1.54 0.00 0.00 39.78 34.44 2x8n n ASN 6 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 2x8n n GLU 7 N -2.64 0.21 0.18 3.52 0.28 -1.26 -1.52 120.64 119.40 2x8n n GLU 7 Ca -0.20 0.39 0.05 0.00 -0.16 0.00 0.00 57.16 57.23 2x8n n GLU 7 Cb 0.64 -1.87 0.30 0.00 1.43 0.00 0.00 31.44 31.95 2x8n n GLU 7 CO 0.00 0.00 0.00 1.37 -0.16 0.00 0.00 177.13 178.34 2x8n h LEU 8 N 0.00 0.00 1.22 -1.84 8.10 -1.95 -3.48 115.31 117.36 2x8n h LEU 8 Ca 0.00 0.00 -0.16 0.00 0.11 0.00 0.00 57.88 57.83 2x8n h LEU 8 Cb 0.44 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.60 2x8n h LEU 8 CO 0.00 0.40 -0.15 -1.84 -4.11 0.00 0.00 178.44 172.74 2x8n n GLU 9 N -3.53 -1.39 0.27 0.17 0.28 -0.58 -4.82 120.64 111.05 2x8n n GLU 9 Ca -0.00 0.44 0.15 0.00 -0.16 0.00 0.00 57.16 57.59 2x8n n GLU 9 Cb 0.53 -4.66 0.78 0.00 1.43 0.00 0.00 31.44 29.53 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 1.22 1.18 -0.06 -1.84 0.00 -1.92 -0.62 119.26 117.23 2x8n h ALA 10 Ca -0.16 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2x8n h ALA 10 Cb 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2x8n h ALA 10 CO 0.23 0.11 -0.19 0.00 0.00 0.00 0.00 179.25 179.40 2x8n h ALA 11 N 1.91 0.10 -0.30 0.00 0.00 -1.96 -0.68 119.26 118.33 2x8n h ALA 11 Ca -0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2x8n h ALA 11 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2x8n h ALA 11 CO 0.01 0.06 0.12 1.03 0.00 0.00 0.00 179.25 180.47 2x8n h SER 12 N -0.28 0.42 -0.32 0.00 0.87 -1.70 -2.31 113.55 110.23 2x8n h SER 12 Ca -0.01 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.34 2x8n h SER 12 Cb 0.81 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.64 2x8n h SER 12 CO 0.04 0.47 0.04 -1.28 -0.53 0.00 0.00 176.83 175.58 2x8n h SER 13 N 0.34 0.59 -0.07 6.23 0.87 -1.25 -2.80 113.55 117.47 2x8n h SER 13 Ca 0.10 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2x8n h SER 13 Cb 0.18 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2x8n h SER 13 CO -0.01 0.63 0.04 -0.09 -0.53 0.00 0.00 176.83 176.87 2x8n h ARG 14 N 0.61 0.10 -0.34 2.24 9.65 -0.85 -1.18 114.38 124.62 2x8n h ARG 14 Ca 0.13 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.06 2x8n h ARG 14 Cb 0.32 -0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 28.82 2x8n h ARG 14 CO 0.01 0.17 -0.02 0.52 2.80 0.00 0.00 179.97 183.44 2x8n h MET 15 N 0.01 0.07 -0.27 0.20 2.86 -1.22 0.17 114.93 116.76 2x8n h MET 15 Ca 0.03 -0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 2x8n h MET 15 Cb 0.09 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 2x8n h MET 15 CO -0.00 0.05 0.10 1.49 1.06 0.00 0.00 176.91 179.60 2x8n h GLU 16 N 0.07 0.21 -0.40 1.72 4.81 -1.42 -2.82 114.58 116.77 2x8n h GLU 16 Ca 0.16 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 2x8n h GLU 16 Cb 0.23 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2x8n h GLU 16 CO -0.29 0.14 -0.04 0.52 -0.73 0.00 0.00 179.01 178.61 2x8n h MET 17 N 0.22 0.65 -0.49 1.92 2.86 -0.58 -2.82 114.93 116.69 2x8n h MET 17 Ca 0.12 -0.17 -0.07 0.00 -2.06 0.00 0.00 59.70 57.51 2x8n h MET 17 Cb 0.08 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2x8n h MET 17 CO -0.12 0.70 0.01 -0.07 1.06 0.00 0.00 176.91 178.49 2x8n h LEU 18 N 0.61 0.78 -0.13 1.22 3.38 -0.47 0.33 115.31 121.03 2x8n h LEU 18 Ca 0.12 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2x8n h LEU 18 Cb 0.44 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2x8n h LEU 18 CO 0.02 0.85 0.08 1.56 0.09 0.00 0.00 178.44 181.03 2x8n h GLN 19 N 0.76 0.19 -0.00 1.13 4.20 -1.26 -2.55 115.11 117.58 2x8n h GLN 19 Ca 0.15 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2x8n h GLN 19 Cb 0.45 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.19 2x8n h GLN 19 CO 0.02 0.20 -0.45 2.89 -0.67 0.00 0.00 178.83 180.81 2x8n n ARG 20 N -4.95 0.28 -0.06 1.46 1.85 -1.04 -3.38 116.66 110.82 2x8n n ARG 20 Ca -0.05 -0.17 -0.05 0.00 -1.00 0.00 0.00 57.85 56.58 2x8n n ARG 20 Cb 0.07 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 29.96 2x8n n ARG 20 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 2x8n n GLU 21 N -1.21 0.38 0.00 2.89 2.13 0.11 -4.89 120.64 120.05 2x8n n GLU 21 Ca 0.08 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.27 2x8n n GLU 21 Cb 0.34 -1.42 0.00 0.00 0.27 0.00 0.00 31.44 30.63 2x8n n GLU 21 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2x8n n TYR 22 N -4.12 0.00 0.00 4.31 0.53 -0.97 -5.08 117.16 111.84 2x8n n TYR 22 Ca -0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.81 2x8n n TYR 22 Cb 0.28 -0.16 0.00 0.00 -1.03 0.00 0.00 39.34 38.42 2x8n n TYR 22 CO 0.00 0.00 0.00 -1.13 -1.02 0.00 0.00 176.86 174.71 2x8n n SER 23 N -1.67 0.00 -4.97 7.72 3.41 -1.18 -4.97 113.62 111.96 2x8n n SER 23 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 2x8n n SER 23 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 2x8n n SER 23 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2x8n s THR 24 N -2.00 2.01 -0.22 6.66 -4.23 -1.25 -4.33 115.64 112.28 2x8n s THR 24 Ca 0.00 -1.23 -0.08 0.00 -1.18 0.00 0.00 61.69 59.20 2x8n s THR 24 Cb 0.00 -2.24 -0.04 0.00 1.34 0.00 0.00 72.50 71.55 2x8n s THR 24 CO 0.00 0.00 0.10 -0.22 -0.54 0.00 0.00 174.62 173.96 2x8n s LEU 25 N -4.45 3.82 -0.17 4.79 2.96 -0.73 -0.78 118.68 124.11 2x8n s LEU 25 Ca 0.49 0.02 -0.05 0.00 -0.22 0.00 0.00 54.13 54.37 2x8n s LEU 25 Cb -0.04 -2.00 -0.23 0.00 0.50 0.00 0.00 46.19 44.42 2x8n s LEU 25 CO 0.30 0.09 0.15 -2.11 -1.32 0.00 0.00 176.35 173.47 2x8n n ARG 26 N 4.11 0.71 -3.67 1.98 1.85 -0.83 -4.83 116.66 115.99 2x8n n ARG 26 Ca -0.16 0.24 -0.13 0.00 -1.00 0.00 0.00 57.85 56.80 2x8n n ARG 26 Cb 0.52 -1.65 -0.07 0.00 -1.05 0.00 0.00 32.46 30.22 2x8n n ARG 26 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2x8n s SER 27 N -6.89 -0.29 0.00 2.89 0.01 -1.02 -5.00 113.70 103.41 2x8n s SER 27 Ca -0.27 0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.07 2x8n s SER 27 Cb 0.08 0.41 -0.01 0.00 0.21 0.00 0.00 66.02 66.71 2x8n s SER 27 CO 0.70 -0.62 -0.06 -0.69 0.41 0.00 0.00 173.24 172.97 2x8n s VAL 28 N -2.20 0.50 -0.10 3.43 1.01 -1.26 -0.55 120.40 121.23 2x8n s VAL 28 Ca -0.07 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.48 2x8n s VAL 28 Cb -0.01 -0.44 0.04 0.00 0.00 0.00 0.00 36.38 35.97 2x8n s VAL 28 CO -0.00 0.06 0.23 0.00 0.00 0.00 0.00 175.10 175.39 2x8n s GLN 29 N -0.36 0.19 -0.37 2.72 -2.07 -0.53 -5.00 119.66 114.25 2x8n s GLN 29 Ca 0.01 0.50 -0.27 0.00 -1.82 0.00 0.00 55.36 53.78 2x8n s GLN 29 Cb -0.03 -0.12 0.02 0.00 -1.09 0.00 0.00 33.01 31.78 2x8n s GLN 29 CO -0.00 -0.16 0.98 -0.47 -1.32 0.00 0.00 175.29 174.32 2x8n s TYR 30 N 1.21 3.06 -0.68 9.60 6.14 -1.25 -0.98 117.35 134.46 2x8n s TYR 30 Ca -0.09 0.84 -0.20 0.00 0.64 0.00 0.00 57.07 58.26 2x8n s TYR 30 Cb -0.10 -3.75 0.10 0.00 0.42 0.00 0.00 41.96 38.63 2x8n s TYR 30 CO -0.08 -0.87 0.87 1.03 0.64 0.00 0.00 175.55 177.14 2x8n s ARG 31 N 3.63 3.17 0.54 4.97 0.52 -0.09 -4.89 118.95 126.80 2x8n s ARG 31 Ca 0.41 -1.25 0.35 0.00 -0.52 0.00 0.00 55.73 54.72 2x8n s ARG 31 Cb -0.11 -4.36 1.64 0.00 0.52 0.00 0.00 34.95 32.64 2x8n s ARG 31 CO 0.20 -1.67 2.05 1.03 0.02 0.00 0.00 175.30 176.93 2x8n h SER 32 N 9.23 0.00 -0.75 0.23 0.87 -1.94 0.66 113.55 121.85 2x8n h SER 32 Ca -0.21 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.43 2x8n h SER 32 Cb 1.07 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.96 2x8n h SER 32 CO 1.12 0.00 0.42 -0.33 -0.53 0.00 0.00 176.83 177.51 2x8n h GLU 33 N 0.00 0.71 0.00 2.24 5.08 -1.93 -3.02 114.58 117.66 2x8n h GLU 33 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2x8n h GLU 33 Cb 0.31 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2x8n h GLU 33 CO 0.00 0.47 -1.61 0.39 -1.00 0.00 0.00 179.01 177.26 2x8n n GLU 34 N -4.77 0.62 -2.14 2.33 -0.58 -1.05 -5.00 120.64 110.05 2x8n n GLU 34 Ca 0.11 -0.13 -0.07 0.00 -0.42 0.00 0.00 57.16 56.65 2x8n n GLU 34 Cb 0.23 -1.45 -0.00 0.00 -0.57 0.00 0.00 31.44 29.65 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 1.40 0.08 3.34 0.62 0.00 0.15 -5.05 105.19 105.72 2x8n n GLY 35 Ca -0.01 -0.59 -0.19 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.36 1.74 -0.24 1.61 -7.23 -0.73 -4.42 120.40 108.77 2x8n s VAL 36 Ca 0.00 -2.10 -0.11 0.00 -1.81 0.00 0.00 61.98 57.96 2x8n s VAL 36 Cb -0.00 -1.95 -0.05 0.00 0.56 0.00 0.00 36.38 34.94 2x8n s VAL 36 CO 0.00 -0.50 0.19 -0.63 -0.31 0.00 0.00 175.10 173.85 2x8n s ILE 37 N -2.65 5.34 -0.38 -0.62 1.01 -0.23 -0.91 121.20 122.76 2x8n s ILE 37 Ca 0.20 0.24 -0.11 0.00 0.00 0.00 0.00 60.65 60.97 2x8n s ILE 37 Cb -0.02 -3.53 0.03 0.00 0.01 0.00 0.00 42.46 38.94 2x8n s ILE 37 CO 0.07 0.32 0.22 -0.69 0.00 0.00 0.00 174.94 174.85 2x8n s VAL 38 N 1.18 4.64 -0.74 2.92 1.01 -0.15 -2.09 120.40 127.17 2x8n s VAL 38 Ca 0.09 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.05 2x8n s VAL 38 Cb -0.14 -3.59 0.13 0.00 0.00 0.00 0.00 36.38 32.78 2x8n s VAL 38 CO 0.06 -0.24 0.85 -0.36 0.00 0.00 0.00 175.10 175.41 2x8n s PHE 39 N 1.57 3.15 -0.38 5.22 0.08 -0.22 -1.45 117.98 125.94 2x8n s PHE 39 Ca 0.02 -1.25 -0.29 0.00 0.12 0.00 0.00 56.93 55.53 2x8n s PHE 39 Cb -0.19 -4.07 0.00 0.00 -0.57 0.00 0.00 43.02 38.19 2x8n s PHE 39 CO 0.07 -1.32 1.46 0.42 -0.10 0.00 0.00 175.22 175.75 2x8n s ILE 40 N 2.30 3.86 1.14 0.64 1.01 0.29 -1.46 121.20 128.98 2x8n s ILE 40 Ca 0.19 0.89 -0.13 0.00 0.00 0.00 0.00 60.65 61.60 2x8n s ILE 40 Cb -0.16 -4.11 0.26 0.00 0.01 0.00 0.00 42.46 38.46 2x8n s ILE 40 CO -0.01 -0.67 1.04 -0.76 0.00 0.00 0.00 174.94 174.54 2x8n s LEU 41 N 5.50 0.90 0.45 2.97 1.43 -0.27 -1.96 118.68 127.69 2x8n s LEU 41 Ca 0.63 1.30 0.14 0.00 -1.03 0.00 0.00 54.13 55.18 2x8n s LEU 41 Cb -0.15 -3.25 1.00 0.00 0.03 0.00 0.00 46.19 43.82 2x8n s LEU 41 CO 0.32 -3.96 2.00 0.00 0.23 0.00 0.00 176.35 174.95 2x8n h ALA 42 N -2.46 1.71 -0.29 4.21 0.00 -1.28 0.44 119.26 121.60 2x8n h ALA 42 Ca -0.59 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.18 2x8n h ALA 42 Cb 1.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2x8n h ALA 42 CO 0.52 0.22 0.00 0.27 0.00 0.00 0.00 179.25 180.25 2x8n n ASN 43 N -4.35 1.81 -0.42 0.00 0.23 -1.26 -4.94 115.26 106.33 2x8n n ASN 43 Ca -0.02 -1.90 -0.05 0.00 -0.53 0.00 0.00 54.58 52.07 2x8n n ASN 43 Cb 0.22 -0.19 -0.02 0.00 -2.08 0.00 0.00 39.78 37.71 2x8n n ASN 43 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2x8n n ASP 44 N 0.46 -4.00 -4.72 0.53 8.00 0.15 -5.02 116.55 111.96 2x8n n ASP 44 Ca 0.13 0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.35 2x8n n ASP 44 Cb 0.31 -1.98 -0.03 0.00 -0.02 0.00 0.00 41.12 39.40 2x8n n ASP 44 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2x8n s ARG 45 N -2.08 4.49 -0.67 -1.24 3.52 -1.26 -4.65 118.95 117.06 2x8n s ARG 45 Ca 0.00 1.66 -0.25 0.00 -0.13 0.00 0.00 55.73 57.01 2x8n s ARG 45 Cb 0.00 -3.37 0.05 0.00 -1.56 0.00 0.00 34.95 30.07 2x8n s ARG 45 CO 0.00 -0.15 1.10 -1.21 -0.81 0.00 0.00 175.30 174.22 2x8n s GLU 46 N 0.85 3.20 -0.47 5.12 8.01 -1.26 -1.11 118.70 133.03 2x8n s GLU 46 Ca 0.56 -0.45 -0.29 0.00 0.01 0.00 0.00 54.97 54.79 2x8n s GLU 46 Cb -0.27 -4.17 0.03 0.00 -4.31 0.00 0.00 34.13 25.41 2x8n s GLU 46 CO 0.30 -1.89 1.12 -0.51 0.01 0.00 0.00 175.26 174.28 2x8n s LEU 47 N 4.74 3.68 -0.42 1.80 1.43 -0.53 -4.88 118.68 124.50 2x8n s LEU 47 Ca 0.30 0.45 -0.12 0.00 -1.03 0.00 0.00 54.13 53.73 2x8n s LEU 47 Cb -0.12 -3.51 0.06 0.00 0.03 0.00 0.00 46.19 42.64 2x8n s LEU 47 CO 0.14 -1.22 0.28 -0.75 0.23 0.00 0.00 176.35 175.03 2x8n s LYS 48 N 4.36 2.80 -0.01 1.70 2.20 -1.26 -1.06 119.74 128.47 2x8n s LYS 48 Ca 0.47 -1.28 -0.00 0.00 -0.36 0.00 0.00 55.97 54.80 2x8n s LYS 48 Cb -0.08 -3.88 0.01 0.00 -1.51 0.00 0.00 37.83 32.38 2x8n s LYS 48 CO 0.31 -0.88 0.03 -0.06 -0.36 0.00 0.00 175.35 174.38 2x8n s PHE 49 N 1.54 -0.00 0.82 4.03 0.08 -0.89 -4.99 117.98 118.57 2x8n s PHE 49 Ca 0.03 0.09 -0.11 0.00 0.12 0.00 0.00 56.93 57.06 2x8n s PHE 49 Cb -0.22 -0.09 0.08 0.00 -0.57 0.00 0.00 43.02 42.22 2x8n s PHE 49 CO 0.05 -0.04 1.09 1.03 -0.10 0.00 0.00 175.22 177.25 2x8n s ARG 50 N 0.46 1.88 0.13 0.44 0.52 -1.26 -1.07 118.95 120.05 2x8n s ARG 50 Ca -0.04 0.88 -0.20 0.00 -0.52 0.00 0.00 55.73 55.86 2x8n s ARG 50 Cb -0.05 -1.88 -0.04 0.00 0.52 0.00 0.00 34.95 33.50 2x8n s ARG 50 CO -0.01 -1.82 1.74 -1.35 0.02 0.00 0.00 175.30 173.87 2x8n h PRO 51 N -1.25 0.11 0.00 3.54 0.11 -1.81 -2.79 132.00 129.91 2x8n h PRO 51 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2x8n h PRO 51 Cb 1.26 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2x8n h PRO 51 CO 0.55 0.07 0.00 -0.25 -0.21 0.00 0.00 178.00 178.16 2x8n n ASP 52 N -5.09 0.00 -0.05 -2.05 8.00 -1.26 -1.99 116.55 114.11 2x8n n ASP 52 Ca -0.03 0.29 -0.22 0.00 0.71 0.00 0.00 54.79 55.54 2x8n n ASP 52 Cb 0.09 -0.39 -0.13 0.00 -0.02 0.00 0.00 41.12 40.68 2x8n n ASP 52 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2x8n n ASP 53 N -1.39 2.00 -4.90 -2.24 2.03 -1.12 -4.07 116.55 106.87 2x8n n ASP 53 Ca 0.05 0.30 -0.30 0.00 0.52 0.00 0.00 54.79 55.36 2x8n n ASP 53 Cb 0.13 -0.90 -0.04 0.00 -0.72 0.00 0.00 41.12 39.58 2x8n n ASP 53 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2x8n s LEU 54 N -7.42 4.19 0.22 -2.67 1.43 -0.84 -4.64 118.68 108.95 2x8n s LEU 54 Ca -0.26 0.66 -0.00 0.00 -1.03 0.00 0.00 54.13 53.50 2x8n s LEU 54 Cb 0.07 -3.42 0.20 0.00 0.03 0.00 0.00 46.19 43.06 2x8n s LEU 54 CO 0.68 -0.05 1.55 -0.61 0.23 0.00 0.00 176.35 178.15 2x8n h GLN 55 N 2.36 0.45 -0.67 1.70 4.15 -1.68 -1.66 115.11 119.75 2x8n h GLN 55 Ca -0.47 -0.27 0.04 0.00 0.77 0.00 0.00 58.65 58.72 2x8n h GLN 55 Cb 1.18 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.85 2x8n h GLN 55 CO 0.70 0.86 0.44 0.00 -1.93 0.00 0.00 178.83 178.90 2x8n h ALA 56 N 1.08 1.65 0.00 3.38 0.00 -1.82 -3.32 119.26 120.24 2x8n h ALA 56 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2x8n h ALA 56 Cb 1.04 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2x8n h ALA 56 CO 0.09 0.27 -0.24 0.25 0.00 0.00 0.00 179.25 179.63 2x8n n THR 57 N -4.46 1.05 -1.77 0.00 -2.24 -1.15 -4.82 114.28 100.87 2x8n n THR 57 Ca 0.09 -1.28 -0.33 0.00 -2.27 0.00 0.00 64.05 60.26 2x8n n THR 57 Cb 0.15 0.10 -0.04 0.00 -2.10 0.00 0.00 70.33 68.44 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 -1.59 1.35 -0.53 4.78 5.04 -0.64 -1.03 117.35 124.73 2x8n s TYR 58 Ca 0.18 1.26 -0.01 0.00 -2.44 0.00 0.00 57.07 56.06 2x8n s TYR 58 Cb 0.16 -3.78 0.00 0.00 0.35 0.00 0.00 41.96 38.69 2x8n s TYR 58 CO 0.01 -2.27 0.19 0.41 -1.34 0.00 0.00 175.55 172.55 2x8n n GLY 59 N 6.07 0.26 3.87 8.97 0.00 -1.26 -4.97 105.19 118.12 2x8n n GLY 59 Ca 0.32 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.71 3.53 0.37 4.61 0.00 -0.20 -5.08 121.76 122.28 2x8n s ALA 60 Ca 0.09 -0.20 -0.18 0.00 0.00 0.00 0.00 51.96 51.66 2x8n s ALA 60 Cb -0.04 -2.50 -0.10 0.00 0.00 0.00 0.00 23.12 20.48 2x8n s ALA 60 CO 0.12 0.47 0.85 0.95 0.00 0.00 0.00 175.76 178.15 2x8n s THR 61 N -1.81 4.52 0.55 0.00 -4.23 -1.26 -4.97 115.64 108.44 2x8n s THR 61 Ca 0.48 1.26 0.25 0.00 -1.18 0.00 0.00 61.69 62.50 2x8n s THR 61 Cb -0.11 -3.63 0.37 0.00 1.34 0.00 0.00 72.50 70.46 2x8n s THR 61 CO 0.20 -0.22 2.04 1.55 -0.54 0.00 0.00 174.62 177.65 2x8n h PRO 62 N 2.17 0.00 -0.08 3.99 0.13 -1.98 -1.70 132.00 134.53 2x8n h PRO 62 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 2x8n h PRO 62 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2x8n h PRO 62 CO 0.63 0.00 -0.20 1.05 -0.23 0.00 0.00 178.00 179.25 2x8n h GLU 63 N 0.00 0.13 0.00 0.86 4.11 -2.02 -2.39 114.58 115.27 2x8n h GLU 63 Ca 0.16 -0.03 -0.05 0.00 0.07 0.00 0.00 59.36 59.50 2x8n h GLU 63 Cb 0.73 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2x8n h GLU 63 CO -0.00 0.34 -0.26 1.96 0.07 0.00 0.00 179.01 181.12 2x8n h GLN 64 N 0.13 0.00 -0.64 1.06 4.20 -1.70 -3.23 115.11 114.93 2x8n h GLN 64 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2x8n h GLN 64 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2x8n h GLN 64 CO 0.03 0.26 0.00 1.28 -0.67 0.00 0.00 178.83 179.73 2x8n n LEU 65 N -3.16 5.06 -0.10 1.46 4.77 -0.91 -3.03 117.00 121.09 2x8n n LEU 65 Ca 0.03 -2.57 -0.20 0.00 -0.03 0.00 0.00 56.01 53.24 2x8n n LEU 65 Cb 0.63 -0.66 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 2x8n n LEU 65 CO 0.37 0.58 -1.22 0.54 -1.33 0.00 0.00 177.39 176.33 2x8n n ARG 66 N 0.55 0.66 -2.77 3.23 1.74 -1.16 -3.93 116.66 114.98 2x8n n ARG 66 Ca 0.24 0.20 -0.43 0.00 -0.77 0.00 0.00 57.85 57.09 2x8n n ARG 66 Cb 1.06 -1.57 -0.01 0.00 -1.02 0.00 0.00 32.46 30.92 2x8n n ARG 66 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2x8n s GLU 67 N -2.52 3.82 0.03 5.56 2.02 -1.17 -4.94 118.70 121.50 2x8n s GLU 67 Ca -0.33 -1.90 0.04 0.00 0.02 0.00 0.00 54.97 52.80 2x8n s GLU 67 Cb 0.09 -5.19 -0.02 0.00 0.10 0.00 0.00 34.13 29.11 2x8n s GLU 67 CO 0.62 -1.97 -0.11 0.42 0.02 0.00 0.00 175.26 174.24 2x8n s ILE 68 N 3.23 0.85 0.03 -1.63 1.01 -1.26 -3.80 121.20 119.63 2x8n s ILE 68 Ca 0.43 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 60.22 2x8n s ILE 68 Cb -0.01 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 2x8n s ILE 68 CO -0.03 -0.06 -0.05 -0.70 0.00 0.00 0.00 174.94 174.10 2x8n s GLU 69 N -1.04 0.43 0.59 2.79 2.12 -0.93 -4.99 118.70 117.68 2x8n s GLU 69 Ca -0.01 -0.74 -0.18 0.00 0.36 0.00 0.00 54.97 54.39 2x8n s GLU 69 Cb -0.07 -0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.24 2x8n s GLU 69 CO 0.01 -0.02 1.17 0.42 -0.54 0.00 0.00 175.26 176.30 2x8n s ILE 70 N -1.72 2.85 0.78 -3.70 -1.09 -1.26 -0.60 121.20 116.46 2x8n s ILE 70 Ca -0.11 0.50 -0.15 0.00 -2.23 0.00 0.00 60.65 58.66 2x8n s ILE 70 Cb -0.08 -3.16 -0.00 0.00 -1.58 0.00 0.00 42.46 37.64 2x8n s ILE 70 CO -0.01 -0.14 0.65 -1.54 -1.23 0.00 0.00 174.94 172.66 2x8n n SER 71 N -1.67 -0.88 0.11 3.58 3.41 -0.86 -4.32 113.62 112.98 2x8n n SER 71 Ca 0.13 0.55 0.10 0.00 -0.26 0.00 0.00 58.87 59.39 2x8n n SER 71 Cb 0.50 -1.28 0.46 0.00 -0.26 0.00 0.00 64.21 63.64 2x8n n SER 71 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2x8n n PRO 72 N -1.40 0.15 0.03 4.33 -0.04 -1.26 -1.32 135.00 135.48 2x8n n PRO 72 Ca 0.10 0.46 -0.06 0.00 -0.04 0.00 0.00 63.50 63.96 2x8n n PRO 72 Cb 0.51 -1.83 -0.11 0.00 -0.04 0.00 0.00 33.50 32.03 2x8n n PRO 72 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2x8n h SER 73 N 0.00 0.00 0.00 3.54 0.02 -1.96 -3.48 113.55 111.66 2x8n h SER 73 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2x8n h SER 73 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2x8n h SER 73 CO 0.00 0.91 0.00 0.61 -1.14 0.00 0.00 176.83 177.21 2x8n n GLY 74 N 1.44 1.11 0.00 -3.77 0.00 -0.44 -4.97 105.19 98.56 2x8n n GLY 74 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 1.15 0.00 0.99 4.77 -1.26 -3.54 117.00 119.11 2x8n n LEU 75 Ca 0.00 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2x8n n LEU 75 Cb 0.00 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2x8n n LEU 75 CO 0.00 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 2x8n n GLY 76 N 0.82 0.58 3.25 -0.72 0.00 -1.26 -1.77 105.19 106.09 2x8n n GLY 76 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 2.52 0.39 -0.18 1.61 0.11 -0.35 -2.04 120.40 122.47 2x8n s VAL 77 Ca 0.00 -1.98 -0.04 0.00 -2.93 0.00 0.00 61.98 57.03 2x8n s VAL 77 Cb 0.00 -2.39 0.08 0.00 -1.53 0.00 0.00 36.38 32.54 2x8n s VAL 77 CO 0.00 -0.19 0.20 -0.47 -3.33 0.00 0.00 175.10 171.31 2x8n s TYR 78 N -3.87 -0.22 -0.42 1.54 6.14 0.23 -2.39 117.35 118.36 2x8n s TYR 78 Ca 0.33 0.25 -0.22 0.00 0.64 0.00 0.00 57.07 58.07 2x8n s TYR 78 Cb 0.07 -0.37 0.02 0.00 0.42 0.00 0.00 41.96 42.10 2x8n s TYR 78 CO 0.09 -0.54 0.72 -0.06 0.64 0.00 0.00 175.55 176.40 2x8n s PHE 79 N 2.31 3.06 0.08 4.97 0.08 0.48 -2.19 117.98 126.76 2x8n s PHE 79 Ca 0.06 0.19 -0.16 0.00 0.12 0.00 0.00 56.93 57.14 2x8n s PHE 79 Cb -0.15 -3.45 -0.11 0.00 -0.57 0.00 0.00 43.02 38.74 2x8n s PHE 79 CO -0.11 -0.86 1.38 1.49 -0.10 0.00 0.00 175.22 177.03 2x8n h GLU 80 N 8.79 0.61 0.00 0.44 4.81 -1.81 0.18 114.58 127.61 2x8n h GLU 80 Ca -0.25 -0.34 -0.01 0.00 -0.13 0.00 0.00 59.36 58.63 2x8n h GLU 80 Cb 1.09 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 2x8n h GLU 80 CO 0.91 0.94 -0.05 1.15 -0.73 0.00 0.00 179.01 181.24 2x8n h THR 81 N 0.31 0.85 0.00 0.32 2.02 -1.86 -1.21 112.91 113.35 2x8n h THR 81 Ca 0.03 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.04 2x8n h THR 81 Cb 0.85 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 2x8n h THR 81 CO 0.07 0.04 -1.29 0.18 0.37 0.00 0.00 175.52 174.90 2x8n n LEU 82 N -4.22 0.55 -2.63 2.58 4.77 -1.12 -4.97 117.00 111.96 2x8n n LEU 82 Ca -0.03 0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 55.91 2x8n n LEU 82 Cb 0.13 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2x8n n LEU 82 CO 0.32 -0.07 -0.15 -0.62 -1.33 0.00 0.00 177.39 175.54 2x8n n GLU 83 N -2.36 -2.63 -4.69 3.23 1.02 -0.02 -5.00 120.64 110.18 2x8n n GLU 83 Ca -0.01 0.77 -0.32 0.00 -0.02 0.00 0.00 57.16 57.58 2x8n n GLU 83 Cb 0.52 -5.45 -0.07 0.00 -0.02 0.00 0.00 31.44 26.42 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 -5.26 2.19 0.06 3.49 0.41 -0.75 -5.00 118.70 113.84 2x8n s GLU 84 Ca 0.10 -2.36 -0.09 0.00 -0.41 0.00 0.00 54.97 52.21 2x8n s GLU 84 Cb -0.05 -1.58 -0.00 0.00 -1.78 0.00 0.00 34.13 30.72 2x8n s GLU 84 CO 0.12 -0.37 0.18 0.16 -0.49 0.00 0.00 175.26 174.87 2x8n s ASP 85 N -3.90 0.08 -0.22 -0.19 -4.77 -1.26 -0.39 116.67 106.03 2x8n s ASP 85 Ca 0.09 -0.49 0.02 0.00 -3.30 0.00 0.00 52.55 48.86 2x8n s ASP 85 Cb 0.02 0.30 0.05 0.00 -1.09 0.00 0.00 42.92 42.19 2x8n s ASP 85 CO 0.05 -0.62 -0.12 -0.69 0.70 0.00 0.00 175.17 174.49 2x8n s VAL 86 N -3.07 1.89 0.06 2.11 1.01 -1.01 -4.15 120.40 117.26 2x8n s VAL 86 Ca -0.01 -1.22 -0.31 0.00 0.00 0.00 0.00 61.98 60.44 2x8n s VAL 86 Cb 0.01 -1.94 -0.08 0.00 0.00 0.00 0.00 36.38 34.37 2x8n s VAL 86 CO -0.07 0.16 1.62 -0.55 0.00 0.00 0.00 175.10 176.26 2x8n s SER 87 N 1.28 6.63 0.18 3.32 0.15 -1.26 -1.21 113.70 122.78 2x8n s SER 87 Ca -0.03 2.44 -0.11 0.00 0.70 0.00 0.00 55.95 58.95 2x8n s SER 87 Cb -0.17 -2.56 0.08 0.00 -1.71 0.00 0.00 66.02 61.66 2x8n s SER 87 CO -0.08 -0.87 1.71 0.25 1.20 0.00 0.00 173.24 175.45 2x8n h LEU 88 N 8.51 0.90 -0.88 3.45 5.85 -1.89 -1.91 115.31 129.33 2x8n h LEU 88 Ca -0.42 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.04 2x8n h LEU 88 Cb 1.20 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 2x8n h LEU 88 CO 0.93 0.87 0.24 0.40 -0.34 0.00 0.00 178.44 180.53 2x8n h ILE 89 N 0.89 1.25 -0.91 4.05 1.08 -1.92 -1.55 117.51 120.40 2x8n h ILE 89 Ca 0.20 -0.83 0.05 0.00 -0.39 0.00 0.00 64.86 63.89 2x8n h ILE 89 Cb 0.29 0.46 -0.06 0.00 -3.07 0.00 0.00 36.82 34.44 2x8n h ILE 89 CO -0.01 0.33 0.59 1.23 -0.69 0.00 0.00 178.15 179.60 2x8n h GLY 90 N 1.08 1.31 1.63 5.37 0.00 -1.69 0.30 103.07 111.08 2x8n h GLY 90 Ca 0.23 -0.43 -0.09 0.00 0.00 0.00 0.00 47.33 47.04 2x8n h GLY 90 CO -0.01 0.33 -0.26 1.41 0.00 0.00 0.00 176.54 178.02 2x8n h LEU 91 N 1.07 0.44 0.00 3.11 3.38 -0.52 0.54 115.31 123.32 2x8n h LEU 91 Ca 0.38 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2x8n h LEU 91 Cb 0.13 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2x8n h LEU 91 CO -0.13 0.69 -0.03 -0.07 0.09 0.00 0.00 178.44 178.99 2x8n h LEU 92 N 0.39 0.00 0.00 1.67 3.38 -0.67 -3.22 115.31 116.85 2x8n h LEU 92 Ca 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2x8n h LEU 92 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2x8n h LEU 92 CO 0.05 0.01 -1.93 -0.62 0.09 0.00 0.00 178.44 176.03 2x8n n GLU 93 N -2.30 0.66 -0.88 1.13 -0.58 0.02 -4.97 120.64 113.72 2x8n n GLU 93 Ca 0.05 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 2x8n n GLU 93 Cb 0.44 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.76 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 1.27 0.70 2.66 0.62 0.00 0.15 -4.98 105.19 105.62 2x8n n GLY 94 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 2x8n n GLY 94 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2x8n n ARG 95 N -2.57 2.96 0.29 1.61 3.00 0.17 -4.74 116.66 117.38 2x8n n ARG 95 Ca 0.00 -2.49 0.16 0.00 -0.00 0.00 0.00 57.85 55.52 2x8n n ARG 95 Cb 0.00 -3.18 0.88 0.00 0.00 0.00 0.00 32.46 30.15 2x8n n ARG 95 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.63 177.70 2x8n h ARG 96 N 5.88 0.00 0.00 -0.14 0.11 -1.90 -3.39 114.38 114.94 2x8n h ARG 96 Ca 0.62 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.70 2x8n h ARG 96 Cb 0.57 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.65 2x8n h ARG 96 CO 1.87 0.05 0.00 0.41 0.10 0.00 0.00 179.97 182.41 2x8n n GLY 97 N -0.83 2.85 3.74 0.08 0.00 -1.26 -2.00 105.19 107.76 2x8n n GLY 97 Ca -0.02 -0.94 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 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 0.73 4.74 0.17 1.61 0.01 -1.26 -4.85 113.70 114.85 2x8n s SER 98 Ca 0.00 2.47 -0.13 0.00 1.31 0.00 0.00 55.95 59.60 2x8n s SER 98 Cb 0.00 -2.60 0.06 0.00 0.21 0.00 0.00 66.02 63.69 2x8n s SER 98 CO 0.00 -1.90 1.76 0.00 0.41 0.00 0.00 173.24 173.51 2x8n h ALA 99 N 0.49 0.71 -0.60 1.44 0.00 -1.99 -0.15 119.26 119.16 2x8n h ALA 99 Ca -0.50 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.32 2x8n h ALA 99 Cb 1.31 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2x8n h ALA 99 CO 0.53 0.26 0.37 1.57 0.00 0.00 0.00 179.25 181.98 2x8n h LYS 100 N 0.74 0.71 -0.79 0.00 2.10 -2.00 -2.56 116.57 114.77 2x8n h LYS 100 Ca 0.19 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.78 2x8n h LYS 100 Cb 0.09 -0.16 -0.04 0.00 -0.90 0.00 0.00 32.23 31.22 2x8n h LYS 100 CO -0.03 0.47 0.41 2.35 -2.00 0.00 0.00 179.45 180.65 2x8n h TRP 101 N 0.73 1.10 0.00 0.07 7.01 -1.76 -1.91 115.95 121.20 2x8n h TRP 101 Ca 0.24 -0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 2x8n h TRP 101 Cb 0.01 -0.35 -0.00 0.00 -2.10 0.00 0.00 29.16 26.72 2x8n h TRP 101 CO -0.05 0.78 -0.02 0.52 -2.79 0.00 0.00 178.44 176.88 2x8n h MET 102 N 1.11 0.00 0.11 2.65 2.86 -0.77 0.38 114.93 121.29 2x8n h MET 102 Ca 0.28 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.64 2x8n h MET 102 Cb 0.07 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.74 2x8n h MET 102 CO -0.04 0.02 -1.20 0.00 1.06 0.00 0.00 176.91 176.75 2x8n h ALA 103 N 1.98 0.12 0.00 6.32 0.00 -0.97 -3.26 119.26 123.45 2x8n h ALA 103 Ca -0.00 -0.83 -0.28 0.00 0.00 0.00 0.00 54.91 53.80 2x8n h ALA 103 Cb 0.64 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 2x8n h ALA 103 CO 0.00 0.88 -1.89 0.39 0.00 0.00 0.00 179.25 178.63 2x8n n GLU 104 N -3.63 0.65 -3.09 0.00 1.02 -0.91 -4.69 120.64 109.98 2x8n n GLU 104 Ca -0.09 0.16 -0.19 0.00 -0.02 0.00 0.00 57.16 57.02 2x8n n GLU 104 Cb 0.99 -1.69 -0.03 0.00 -0.02 0.00 0.00 31.44 30.69 2x8n n GLU 104 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2x8n n HIS 105 N -2.88 -0.76 -2.02 -0.32 8.25 0.13 -5.09 115.22 112.53 2x8n n HIS 105 Ca -0.20 -3.31 -0.28 0.00 -0.26 0.00 0.00 57.72 53.66 2x8n n HIS 105 Cb 1.03 0.04 0.14 0.00 1.12 0.00 0.00 29.99 32.31 2x8n n HIS 105 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2x8n s PRO 106 N -1.28 1.26 0.20 -0.41 0.04 -1.23 -4.49 135.00 129.10 2x8n s PRO 106 Ca 0.35 -0.33 -0.30 0.00 0.04 0.00 0.00 61.00 60.76 2x8n s PRO 106 Cb 0.25 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.75 2x8n s PRO 106 CO -0.11 -1.97 1.11 -1.17 0.04 0.00 0.00 177.00 174.90 2x8n s LEU 107 N -5.66 4.50 -1.19 -3.56 2.96 -1.26 -4.91 118.68 109.57 2x8n s LEU 107 Ca 0.69 2.14 -0.20 0.00 -0.22 0.00 0.00 54.13 56.54 2x8n s LEU 107 Cb -0.07 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 2x8n s LEU 107 CO 0.50 -0.21 1.91 0.00 -1.32 0.00 0.00 176.35 177.23 2x8n n ALA 108 N 2.11 3.17 -1.91 5.97 0.00 -1.26 -5.08 120.51 123.51 2x8n n ALA 108 Ca 0.02 -3.46 0.00 0.00 0.00 0.00 0.00 53.44 50.00 2x8n n ALA 108 Cb 0.46 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.35 2x8n n ALA 108 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95