#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oca n VAL 2 N 0.00 0.00 -0.68 3.17 0.24 -1.26 -4.41 118.33 115.39 1oca n VAL 2 Ca 0.00 -0.39 -0.17 0.00 -2.04 0.00 0.00 64.34 61.74 1oca n VAL 2 Cb 0.00 -0.80 -0.07 0.00 -1.47 0.00 0.00 33.84 31.50 1oca n VAL 2 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1oca n ASN 3 N -3.34 -0.01 -4.76 -1.34 3.02 -1.26 -4.81 115.26 102.77 1oca n ASN 3 Ca 0.01 0.02 -0.41 0.00 -0.03 0.00 0.00 54.58 54.18 1oca n ASN 3 Cb 0.58 -0.39 -0.02 0.00 -0.61 0.00 0.00 39.78 39.35 1oca n ASN 3 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1oca s PRO 4 N 3.93 4.20 0.01 3.52 0.04 -1.14 -4.70 135.00 140.86 1oca s PRO 4 Ca 0.61 2.44 -0.04 0.00 0.04 0.00 0.00 61.00 64.05 1oca s PRO 4 Cb -0.54 -3.05 -0.04 0.00 0.04 0.00 0.00 34.50 30.91 1oca s PRO 4 CO 0.23 -0.48 0.24 0.99 0.04 0.00 0.00 177.00 178.01 1oca s THR 5 N -0.39 5.35 -0.03 1.26 2.01 -1.26 -1.28 115.64 121.31 1oca s THR 5 Ca 0.58 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.59 1oca s THR 5 Cb -0.45 -3.56 0.01 0.00 0.01 0.00 0.00 72.50 68.51 1oca s THR 5 CO 0.50 0.31 -0.05 0.68 -0.69 0.00 0.00 174.62 175.37 1oca s VAL 6 N -1.35 0.52 0.43 3.82 -7.23 -0.55 -0.93 120.40 115.11 1oca s VAL 6 Ca 0.29 -0.18 -0.06 0.00 -1.81 0.00 0.00 61.98 60.21 1oca s VAL 6 Cb -0.13 -0.50 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 1oca s VAL 6 CO 0.18 0.19 0.74 0.72 -0.31 0.00 0.00 175.10 176.63 1oca s PHE 7 N 0.48 3.52 0.06 2.82 -0.12 0.69 -0.88 117.98 124.56 1oca s PHE 7 Ca -0.06 0.84 0.04 0.00 -0.05 0.00 0.00 56.93 57.69 1oca s PHE 7 Cb -0.10 -2.30 -0.03 0.00 -0.63 0.00 0.00 43.02 39.97 1oca s PHE 7 CO 0.00 -0.15 -0.12 -0.06 -0.05 0.00 0.00 175.22 174.84 1oca s PHE 8 N -2.53 1.02 -0.40 3.49 0.40 -0.17 -2.70 117.98 117.10 1oca s PHE 8 Ca 0.48 -0.46 0.01 0.00 -0.60 0.00 0.00 56.93 56.36 1oca s PHE 8 Cb -0.10 -0.59 0.12 0.00 0.51 0.00 0.00 43.02 42.96 1oca s PHE 8 CO 0.39 0.01 0.19 0.34 0.70 0.00 0.00 175.22 176.84 1oca s ASP 9 N -1.63 3.84 0.29 1.36 -1.08 0.31 -0.33 116.67 119.43 1oca s ASP 9 Ca -0.04 -2.33 -0.28 0.00 -0.52 0.00 0.00 52.55 49.38 1oca s ASP 9 Cb -0.10 -1.03 -0.09 0.00 -1.46 0.00 0.00 42.92 40.23 1oca s ASP 9 CO 0.02 -0.31 1.02 -0.63 0.52 0.00 0.00 175.17 175.78 1oca s ILE 10 N 0.73 3.82 0.23 4.11 -1.09 -0.22 -0.55 121.20 128.22 1oca s ILE 10 Ca 0.15 1.71 0.08 0.00 -2.23 0.00 0.00 60.65 60.36 1oca s ILE 10 Cb -0.22 -4.04 -0.05 0.00 -1.58 0.00 0.00 42.46 36.57 1oca s ILE 10 CO -0.07 0.32 -0.14 0.00 -1.23 0.00 0.00 174.94 173.82 1oca s ALA 11 N -1.32 2.15 -0.21 9.38 0.00 -0.45 -0.50 121.76 130.82 1oca s ALA 11 Ca 0.46 -1.73 0.01 0.00 0.00 0.00 0.00 51.96 50.70 1oca s ALA 11 Cb -0.26 -0.06 0.05 0.00 0.00 0.00 0.00 23.12 22.85 1oca s ALA 11 CO 0.33 0.07 -0.08 0.08 0.00 0.00 0.00 175.76 176.16 1oca s VAL 12 N -2.93 1.57 -0.92 0.00 1.01 0.27 -1.44 120.40 117.97 1oca s VAL 12 Ca 0.24 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 61.18 1oca s VAL 12 Cb -0.00 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1oca s VAL 12 CO 0.09 0.08 0.00 0.47 0.00 0.00 0.00 175.10 175.74 1oca n ASP 13 N 4.69 -5.41 0.00 3.32 8.00 -0.16 -0.85 116.55 126.14 1oca n ASP 13 Ca -0.14 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.58 1oca n ASP 13 Cb 0.46 -3.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.69 1oca n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oca n GLY 14 N 0.36 0.54 3.61 0.44 0.00 -1.26 -5.06 105.19 103.82 1oca n GLY 14 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1oca n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1oca s GLU 15 N -0.73 3.89 -0.01 1.61 2.12 -0.03 -5.01 118.70 120.54 1oca s GLU 15 Ca 0.00 0.60 -0.32 0.00 0.36 0.00 0.00 54.97 55.61 1oca s GLU 15 Cb 0.00 -3.77 -0.10 0.00 0.26 0.00 0.00 34.13 30.51 1oca s GLU 15 CO 0.00 -0.84 1.93 -0.35 -0.54 0.00 0.00 175.26 175.46 1oca n PRO 16 N 6.56 2.57 0.04 4.30 -0.04 -1.26 -0.57 135.00 146.60 1oca n PRO 16 Ca 0.06 0.94 -0.21 0.00 -0.04 0.00 0.00 63.50 64.25 1oca n PRO 16 Cb 0.48 -2.85 -0.14 0.00 -0.04 0.00 0.00 33.50 30.94 1oca n PRO 16 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1oca h LEU 17 N 9.93 0.48 0.00 1.53 5.85 -1.10 -3.47 115.31 128.54 1oca h LEU 17 Ca -0.49 -0.90 0.00 0.00 0.84 0.00 0.00 57.88 57.32 1oca h LEU 17 Cb 1.25 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1oca h LEU 17 CO 0.94 1.55 0.00 0.61 -0.34 0.00 0.00 178.44 181.20 1oca n GLY 18 N 1.72 2.92 3.81 3.75 0.00 -1.12 -5.01 105.19 111.26 1oca n GLY 18 Ca -0.20 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 1oca n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1oca s ARG 19 N -2.00 3.77 0.06 1.61 3.52 -1.26 -1.05 118.95 123.60 1oca s ARG 19 Ca 0.00 1.18 -0.02 0.00 -0.13 0.00 0.00 55.73 56.76 1oca s ARG 19 Cb 0.00 -2.10 -0.03 0.00 -1.56 0.00 0.00 34.95 31.26 1oca s ARG 19 CO 0.00 -0.43 0.02 0.08 -0.81 0.00 0.00 175.30 174.16 1oca s VAL 20 N -2.30 0.20 0.02 7.11 1.01 0.55 -4.76 120.40 122.23 1oca s VAL 20 Ca 0.63 -1.70 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 1oca s VAL 20 Cb -0.13 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1oca s VAL 20 CO 0.26 -0.89 0.07 -0.55 0.00 0.00 0.00 175.10 173.99 1oca s SER 21 N -2.92 0.17 0.04 3.32 0.15 -0.81 -0.99 113.70 112.65 1oca s SER 21 Ca 0.08 -0.45 0.03 0.00 0.70 0.00 0.00 55.95 56.30 1oca s SER 21 Cb 0.07 0.19 -0.02 0.00 -1.71 0.00 0.00 66.02 64.55 1oca s SER 21 CO -0.09 -0.42 -0.09 -0.36 1.20 0.00 0.00 173.24 173.48 1oca s PHE 22 N -2.01 0.74 -0.10 3.44 0.40 -0.05 -0.76 117.98 119.63 1oca s PHE 22 Ca -0.10 -0.41 -0.04 0.00 -0.60 0.00 0.00 56.93 55.78 1oca s PHE 22 Cb -0.05 -0.44 -0.04 0.00 0.51 0.00 0.00 43.02 43.00 1oca s PHE 22 CO -0.02 -0.04 0.04 -2.00 0.70 0.00 0.00 175.22 173.90 1oca s GLU 23 N -1.30 3.17 -0.07 0.44 2.12 -0.08 -1.48 118.70 121.51 1oca s GLU 23 Ca -0.06 -0.33 0.04 0.00 0.36 0.00 0.00 54.97 54.98 1oca s GLU 23 Cb -0.08 -2.93 0.00 0.00 0.26 0.00 0.00 34.13 31.38 1oca s GLU 23 CO 0.01 0.70 -0.18 -0.51 -0.54 0.00 0.00 175.26 174.73 1oca s LEU 24 N -0.85 1.88 -0.53 2.70 1.43 -0.40 -0.78 118.68 122.13 1oca s LEU 24 Ca 0.13 -0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 52.76 1oca s LEU 24 Cb -0.12 -1.09 -0.10 0.00 0.03 0.00 0.00 46.19 44.91 1oca s LEU 24 CO 0.03 0.12 3.14 0.49 0.23 0.00 0.00 176.35 180.36 1oca n PHE 25 N 3.50 1.12 0.30 0.29 3.72 0.35 -2.88 117.46 123.86 1oca n PHE 25 Ca -0.20 -2.02 0.20 0.00 -0.05 0.00 0.00 57.45 55.38 1oca n PHE 25 Cb 0.52 -1.70 1.06 0.00 -0.94 0.00 0.00 39.48 38.43 1oca n PHE 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1oca h ALA 26 N 3.48 1.00 -0.02 4.37 0.00 -1.85 0.21 119.26 126.46 1oca h ALA 26 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1oca h ALA 26 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1oca h ALA 26 CO 0.79 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.64 1oca n ASP 27 N -2.91 0.93 0.00 0.00 5.68 -1.26 -2.31 116.55 116.68 1oca n ASP 27 Ca -0.02 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.94 1oca n ASP 27 Cb 0.08 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1oca n ASP 27 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1oca n LYS 28 N -0.27 2.31 -3.36 0.11 5.02 0.00 -4.88 118.16 117.10 1oca n LYS 28 Ca 0.21 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.24 1oca n LYS 28 Cb 0.26 -0.79 -0.08 0.00 -0.02 0.00 0.00 35.03 34.40 1oca n LYS 28 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1oca n VAL 29 N -1.34 0.25 -0.28 -0.18 0.24 0.53 -4.83 118.33 112.72 1oca n VAL 29 Ca 0.00 -4.31 0.01 0.00 -2.04 0.00 0.00 64.34 57.99 1oca n VAL 29 Cb 0.27 -1.97 0.14 0.00 -1.47 0.00 0.00 33.84 30.81 1oca n VAL 29 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1oca h PRO 30 N 4.47 0.79 0.33 7.34 0.11 -1.65 -1.68 132.00 141.71 1oca h PRO 30 Ca 0.15 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 1oca h PRO 30 Cb 0.81 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.75 1oca h PRO 30 CO 0.57 0.52 -0.16 -0.22 -0.21 0.00 0.00 178.00 178.50 1oca h LYS 31 N 0.82 -0.43 -0.10 1.05 1.63 -1.95 -1.30 116.57 116.28 1oca h LYS 31 Ca 0.36 0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 60.18 1oca h LYS 31 Cb 0.24 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1oca h LYS 31 CO -0.20 -0.22 0.05 1.15 -3.45 0.00 0.00 179.45 176.78 1oca h THR 32 N -0.54 1.11 -0.20 1.00 2.02 -1.96 -1.05 112.91 113.28 1oca h THR 32 Ca -0.05 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 66.79 1oca h THR 32 Cb 0.40 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1oca h THR 32 CO 0.07 0.09 -0.03 0.00 0.37 0.00 0.00 175.52 176.03 1oca h ALA 33 N 0.93 0.27 -0.38 6.16 0.00 -1.29 -1.07 119.26 123.90 1oca h ALA 33 Ca 0.04 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 1oca h ALA 33 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1oca h ALA 33 CO -0.00 0.02 -0.24 1.49 0.00 0.00 0.00 179.25 180.52 1oca h GLU 34 N 0.11 0.76 0.11 0.00 4.22 -1.23 0.12 114.58 118.67 1oca h GLU 34 Ca 0.05 -0.31 0.01 0.00 0.08 0.00 0.00 59.36 59.19 1oca h GLU 34 Cb 0.45 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1oca h GLU 34 CO 0.02 0.93 -0.18 -0.97 -2.18 0.00 0.00 179.01 176.62 1oca h ASN 35 N 0.66 -0.50 0.04 1.04 -1.24 -1.10 -2.50 115.58 111.98 1oca h ASN 35 Ca 0.09 0.06 -0.07 0.00 0.71 0.00 0.00 56.30 57.08 1oca h ASN 35 Cb 0.75 0.19 -0.01 0.00 0.73 0.00 0.00 38.32 39.98 1oca h ASN 35 CO 0.06 -0.26 -0.21 0.15 -1.29 0.00 0.00 177.43 175.88 1oca h PHE 36 N -0.35 0.33 0.11 0.67 3.57 -0.90 -2.21 116.94 118.16 1oca h PHE 36 Ca 0.02 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1oca h PHE 36 Cb 0.37 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1oca h PHE 36 CO -0.18 0.51 -0.32 -0.09 -2.23 0.00 0.00 178.31 175.99 1oca h ARG 37 N 0.28 -0.47 -0.12 1.11 2.43 -0.35 0.12 114.38 117.37 1oca h ARG 37 Ca 0.05 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1oca h ARG 37 Cb 0.54 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1oca h ARG 37 CO 0.04 -0.32 0.08 0.00 -1.51 0.00 0.00 179.97 178.26 1oca h ALA 38 N -0.98 1.96 -0.09 2.80 0.00 -1.42 -1.41 119.26 120.12 1oca h ALA 38 Ca -0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1oca h ALA 38 Cb 0.48 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1oca h ALA 38 CO -0.15 0.02 -0.57 -0.07 0.00 0.00 0.00 179.25 178.48 1oca h LEU 39 N 0.12 0.30 0.10 0.00 3.38 -0.87 -2.88 115.31 115.46 1oca h LEU 39 Ca 0.05 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1oca h LEU 39 Cb 0.04 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1oca h LEU 39 CO -0.01 0.80 -0.05 0.77 0.09 0.00 0.00 178.44 180.04 1oca h SER 40 N 0.20 -0.12 -0.16 -0.43 4.64 0.34 0.16 113.55 118.18 1oca h SER 40 Ca -0.00 -0.23 -0.05 0.00 -0.47 0.00 0.00 61.79 61.04 1oca h SER 40 Cb 1.06 0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.16 1oca h SER 40 CO 0.09 0.17 -0.03 0.71 -0.87 0.00 0.00 176.83 176.90 1oca h THR 41 N -0.42 1.18 0.00 2.95 1.35 -1.54 -3.38 112.91 113.06 1oca h THR 41 Ca -0.01 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1oca h THR 41 Cb 0.35 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1oca h THR 41 CO 0.02 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 176.15 1oca n GLY 42 N -0.91 0.77 0.28 5.82 0.00 -1.09 -4.74 105.19 105.32 1oca n GLY 42 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 1oca n GLY 42 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1oca h GLU 43 N 2.50 0.00 0.00 1.61 4.11 -1.76 -0.02 114.58 121.01 1oca h GLU 43 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1oca h GLU 43 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1oca h GLU 43 CO 0.00 0.07 0.00 1.63 0.07 0.00 0.00 179.01 180.78 1oca n LYS 44 N -3.63 0.40 -0.97 1.06 4.76 -1.26 -4.82 118.16 113.71 1oca n LYS 44 Ca -0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 1oca n LYS 44 Cb 0.17 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 1oca n LYS 44 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1oca n GLY 45 N -0.18 0.60 3.63 0.72 0.00 -0.02 -4.97 105.19 104.96 1oca n GLY 45 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1oca n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1oca s PHE 46 N -2.54 0.46 -5.00 1.61 -0.12 -1.22 -5.12 117.98 106.05 1oca s PHE 46 Ca 0.00 -0.86 0.00 0.00 -0.05 0.00 0.00 56.93 56.02 1oca s PHE 46 Cb 0.00 0.28 0.00 0.00 -0.63 0.00 0.00 43.02 42.67 1oca s PHE 46 CO 0.00 -1.16 0.00 0.41 -0.05 0.00 0.00 175.22 174.42 1oca n GLY 47 N -0.47 0.03 0.15 1.99 0.00 -1.26 -4.20 105.19 101.44 1oca n GLY 47 Ca -0.02 -1.49 0.13 0.00 0.00 0.00 0.00 46.02 44.64 1oca n GLY 47 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1oca h TYR 48 N 0.00 0.00 -1.72 1.61 3.20 -0.90 -3.40 116.97 115.76 1oca h TYR 48 Ca 0.00 0.00 -0.47 0.00 3.14 0.00 0.00 58.73 61.40 1oca h TYR 48 Cb 0.00 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1oca h TYR 48 CO 0.00 0.00 1.56 0.21 -1.64 0.00 0.00 178.16 178.29 1oca s LYS 49 N -3.38 2.24 -0.39 1.82 2.20 -1.26 -1.65 119.74 119.33 1oca s LYS 49 Ca 0.03 1.19 0.00 0.00 -0.36 0.00 0.00 55.97 56.83 1oca s LYS 49 Cb 0.09 -4.53 0.00 0.00 -1.51 0.00 0.00 37.83 31.88 1oca s LYS 49 CO 0.40 -3.13 0.00 0.41 -0.36 0.00 0.00 175.35 172.67 1oca n GLY 50 N 5.92 0.65 0.08 5.54 0.00 -0.81 -4.95 105.19 111.62 1oca n GLY 50 Ca 0.32 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 1oca n GLY 50 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1oca h SER 51 N 0.00 0.14 -2.32 1.61 4.64 -1.53 -3.46 113.55 112.63 1oca h SER 51 Ca -0.07 -0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1oca h SER 51 Cb 0.34 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1oca h SER 51 CO 0.11 0.32 0.00 0.00 -0.87 0.00 0.00 176.83 176.39 1oca s PHE 53 N -1.46 3.77 -0.02 0.00 0.08 -1.13 -4.31 117.98 114.92 1oca s PHE 53 Ca 0.00 1.45 0.00 0.00 0.12 0.00 0.00 56.93 58.50 1oca s PHE 53 Cb 0.00 -2.75 -0.00 0.00 -0.57 0.00 0.00 43.02 39.70 1oca s PHE 53 CO 0.00 0.36 0.01 -2.39 -0.10 0.00 0.00 175.22 173.11 1oca n HIS 54 N 2.45 0.00 -3.72 0.36 1.44 -0.89 -4.78 115.22 110.08 1oca n HIS 54 Ca -0.04 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.45 1oca n HIS 54 Cb 0.50 -0.00 -0.18 0.00 0.12 0.00 0.00 29.99 30.43 1oca n HIS 54 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 1oca s ARG 55 N -1.05 0.29 -0.19 -1.40 3.00 -1.00 -4.64 118.95 113.95 1oca s ARG 55 Ca 0.00 0.21 -0.02 0.00 0.00 0.00 0.00 55.73 55.92 1oca s ARG 55 Cb 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 34.95 34.18 1oca s ARG 55 CO 0.01 -0.34 0.01 0.42 0.00 0.00 0.00 175.30 175.41 1oca s ILE 56 N 2.06 0.78 -0.48 1.52 1.01 -0.19 -0.09 121.20 125.81 1oca s ILE 56 Ca 0.05 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.03 1oca s ILE 56 Cb -0.12 -1.20 0.13 0.00 0.01 0.00 0.00 42.46 41.28 1oca s ILE 56 CO -0.04 -0.14 0.25 -0.63 0.00 0.00 0.00 174.94 174.37 1oca s ILE 57 N 1.74 2.96 -0.07 2.92 1.01 -0.14 -1.95 121.20 127.67 1oca s ILE 57 Ca -0.02 -2.73 -0.34 0.00 0.00 0.00 0.00 60.65 57.56 1oca s ILE 57 Cb -0.17 -3.04 -0.12 0.00 0.01 0.00 0.00 42.46 39.14 1oca s ILE 57 CO -0.07 -0.75 1.85 -0.81 0.00 0.00 0.00 174.94 175.16 1oca n PRO 58 N 3.79 2.15 -1.41 2.79 -0.04 -1.26 -1.50 135.00 139.51 1oca n PRO 58 Ca 0.04 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.29 1oca n PRO 58 Cb 0.38 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 1oca n PRO 58 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1oca n GLY 59 N 4.31 0.55 2.00 0.55 0.00 -1.26 -4.90 105.19 106.43 1oca n GLY 59 Ca 0.22 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1oca n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1oca n PHE 60 N -3.33 -0.70 -3.50 1.61 7.35 -0.57 -4.66 117.46 113.67 1oca n PHE 60 Ca 0.00 0.08 -0.11 0.00 -0.76 0.00 0.00 57.45 56.66 1oca n PHE 60 Cb 0.27 0.58 -0.02 0.00 0.35 0.00 0.00 39.48 40.66 1oca n PHE 60 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1oca s MET 61 N -1.12 1.29 -0.18 -4.13 0.23 -1.01 -3.48 119.30 110.90 1oca s MET 61 Ca 0.00 -0.52 0.01 0.00 -1.03 0.00 0.00 55.69 54.14 1oca s MET 61 Cb 0.00 0.56 0.03 0.00 -1.53 0.00 0.00 34.83 33.89 1oca s MET 61 CO 0.00 -0.57 -0.13 0.00 -2.03 0.00 0.00 175.02 172.29 1oca s GLN 63 N 1.41 2.47 0.14 0.00 0.74 0.87 -0.16 119.66 125.13 1oca s GLN 63 Ca 0.02 -0.77 -0.24 0.00 0.05 0.00 0.00 55.36 54.42 1oca s GLN 63 Cb -0.15 -1.99 0.07 0.00 1.10 0.00 0.00 33.01 32.04 1oca s GLN 63 CO -0.10 0.23 0.66 0.20 -0.55 0.00 0.00 175.29 175.73 1oca s GLY 64 N 0.18 -0.57 0.00 2.59 0.00 -0.83 -2.10 107.32 106.59 1oca s GLY 64 Ca -0.11 0.54 0.00 0.00 0.00 0.00 0.00 44.72 45.15 1oca s GLY 64 CO 0.05 0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.94 1oca n GLY 65 N -0.36 0.00 2.74 0.20 0.00 -1.26 -1.45 105.19 105.06 1oca n GLY 65 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 1oca n GLY 65 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1oca s ASP 66 N 0.00 1.41 -0.01 1.61 -4.77 -1.26 -1.93 116.67 111.71 1oca s ASP 66 Ca 0.00 -0.12 0.02 0.00 -3.30 0.00 0.00 52.55 49.15 1oca s ASP 66 Cb 0.00 0.16 0.03 0.00 -1.09 0.00 0.00 42.92 42.02 1oca s ASP 66 CO 0.00 -0.30 0.82 2.22 0.70 0.00 0.00 175.17 178.61 1oca n PHE 67 N 5.31 0.00 0.01 2.11 1.16 -1.26 -4.69 117.46 120.11 1oca n PHE 67 Ca -0.05 -0.30 0.00 0.00 -1.87 0.00 0.00 57.45 55.23 1oca n PHE 67 Cb 0.50 -0.04 0.00 0.00 -1.61 0.00 0.00 39.48 38.32 1oca n PHE 67 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 1oca n THR 68 N -0.35 0.22 -0.01 1.97 -2.24 -1.26 -4.97 114.28 107.64 1oca n THR 68 Ca 0.02 0.07 0.07 0.00 -2.27 0.00 0.00 64.05 61.95 1oca n THR 68 Cb 0.44 -0.97 -0.12 0.00 -2.10 0.00 0.00 70.33 67.58 1oca n THR 68 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oca n ARG 69 N -2.71 0.48 -0.32 -0.78 1.74 -1.26 -5.02 116.66 108.79 1oca n ARG 69 Ca 0.00 -0.14 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 1oca n ARG 69 Cb 0.00 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1oca n ARG 69 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1oca n HIS 70 N -2.04 0.00 0.34 -1.55 8.25 -1.26 -4.61 115.22 114.35 1oca n HIS 70 Ca -0.03 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.48 1oca n HIS 70 Cb 0.40 -1.28 0.05 0.00 1.12 0.00 0.00 29.99 30.28 1oca n HIS 70 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1oca n ASN 71 N 0.00 1.88 0.00 0.41 0.23 -1.26 -4.97 115.26 111.55 1oca n ASN 71 Ca 0.00 -1.45 0.00 0.00 -0.53 0.00 0.00 54.58 52.60 1oca n ASN 71 Cb 0.00 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 1oca n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1oca n GLY 72 N 0.51 1.85 0.89 4.83 0.00 -1.26 -4.98 105.19 107.04 1oca n GLY 72 Ca 0.06 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.09 1oca n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oca n THR 73 N -0.11 0.78 -3.79 2.61 -2.24 -1.26 -4.89 114.28 105.37 1oca n THR 73 Ca 0.00 -0.38 -0.09 0.00 -2.27 0.00 0.00 64.05 61.31 1oca n THR 73 Cb 0.00 -0.46 -0.04 0.00 -2.10 0.00 0.00 70.33 67.73 1oca n THR 73 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1oca s GLY 74 N -0.17 0.00 0.00 3.38 0.00 -1.26 -4.77 107.32 104.50 1oca s GLY 74 Ca 0.14 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 44.53 1oca s GLY 74 CO 0.04 -0.29 0.00 0.61 0.00 0.00 0.00 173.10 173.46 1oca n GLY 75 N -0.36 3.64 3.10 0.20 0.00 -1.26 -4.58 105.19 105.92 1oca n GLY 75 Ca -0.08 -1.24 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 1oca n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oca s LYS 76 N -5.59 0.53 0.93 1.61 -2.85 -1.26 -4.44 119.74 108.67 1oca s LYS 76 Ca 0.00 -0.64 -0.12 0.00 -1.00 0.00 0.00 55.97 54.21 1oca s LYS 76 Cb 0.00 0.21 0.15 0.00 -2.06 0.00 0.00 37.83 36.13 1oca s LYS 76 CO 0.00 -0.13 1.11 -1.54 0.10 0.00 0.00 175.35 174.89 1oca s SER 77 N -1.84 3.27 0.53 0.03 1.04 0.30 -4.11 113.70 112.92 1oca s SER 77 Ca -0.09 1.15 0.35 0.00 0.48 0.00 0.00 55.95 57.84 1oca s SER 77 Cb -0.04 -1.79 1.72 0.00 0.10 0.00 0.00 66.02 66.01 1oca s SER 77 CO -0.02 -2.72 2.06 0.16 0.98 0.00 0.00 173.24 173.70 1oca h ILE 78 N -1.61 0.00 -0.01 -1.02 3.07 -1.84 -3.16 117.51 112.94 1oca h ILE 78 Ca -0.52 -0.21 0.00 0.00 1.55 0.00 0.00 64.86 65.68 1oca h ILE 78 Cb 1.32 1.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.98 1oca h ILE 78 CO 0.59 0.00 -0.56 -1.22 -1.05 0.00 0.00 178.15 175.91 1oca n TYR 79 N -2.87 0.00 0.00 0.16 4.01 -1.26 -5.01 117.16 112.19 1oca n TYR 79 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1oca n TYR 79 Cb 0.17 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 1oca n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oca n GLY 80 N 1.43 -1.00 0.00 2.72 0.00 -1.19 -5.11 105.19 102.04 1oca n GLY 80 Ca 0.08 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1oca n GLY 80 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1oca n GLU 81 N 0.00 0.88 -2.19 1.61 0.28 -1.26 -4.36 120.64 115.60 1oca n GLU 81 Ca 0.00 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.67 1oca n GLU 81 Cb 0.00 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 32.86 1oca n GLU 81 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1oca s LYS 82 N 4.78 3.53 0.44 3.44 1.02 -1.26 -0.54 119.74 131.15 1oca s LYS 82 Ca 0.00 1.15 0.03 0.00 0.02 0.00 0.00 55.97 57.17 1oca s LYS 82 Cb 0.00 -2.07 -0.03 0.00 -0.52 0.00 0.00 37.83 35.22 1oca s LYS 82 CO 0.00 -0.63 0.07 -0.59 -0.92 0.00 0.00 175.35 173.28 1oca s PHE 83 N -2.46 1.87 0.98 3.18 -0.12 -0.18 -4.95 117.98 116.30 1oca s PHE 83 Ca 0.63 -1.10 -0.13 0.00 -0.05 0.00 0.00 56.93 56.28 1oca s PHE 83 Cb -0.14 -1.37 0.18 0.00 -0.63 0.00 0.00 43.02 41.05 1oca s PHE 83 CO 0.34 -0.04 1.11 -1.83 -0.05 0.00 0.00 175.22 174.76 1oca s GLU 84 N -3.79 0.59 -0.44 1.99 -1.05 -1.26 -3.07 118.70 111.67 1oca s GLU 84 Ca 0.19 0.37 -0.28 0.00 -0.15 0.00 0.00 54.97 55.10 1oca s GLU 84 Cb 0.03 -1.77 -0.02 0.00 -0.44 0.00 0.00 34.13 31.94 1oca s GLU 84 CO 0.11 -2.59 1.77 0.34 0.95 0.00 0.00 175.26 175.84 1oca s ASP 85 N -3.72 5.73 0.13 0.83 2.15 -1.26 -4.80 116.67 115.73 1oca s ASP 85 Ca 0.65 0.89 -0.16 0.00 0.43 0.00 0.00 52.55 54.36 1oca s ASP 85 Cb -0.17 -2.53 -0.01 0.00 -0.30 0.00 0.00 42.92 39.92 1oca s ASP 85 CO 0.56 -1.91 1.66 1.05 -0.17 0.00 0.00 175.17 176.36 1oca h GLU 86 N 13.33 0.61 -1.33 4.34 4.11 -1.99 -3.46 114.58 130.18 1oca h GLU 86 Ca -0.30 -0.12 0.21 0.00 0.07 0.00 0.00 59.36 59.22 1oca h GLU 86 Cb 1.16 -0.09 -0.23 0.00 0.50 0.00 0.00 28.75 30.08 1oca h GLU 86 CO 1.11 0.59 0.81 0.54 0.07 0.00 0.00 179.01 182.13 1oca s ASN 87 N -5.90 -0.15 -0.12 3.06 6.03 -1.26 -5.06 114.94 111.53 1oca s ASN 87 Ca -0.13 0.11 0.18 0.00 -1.03 0.00 0.00 52.86 51.98 1oca s ASN 87 Cb 0.10 0.14 0.70 0.00 -3.03 0.00 0.00 41.25 39.16 1oca s ASN 87 CO 0.76 -0.18 1.61 0.49 -2.03 0.00 0.00 177.10 177.75 1oca n PHE 88 N 0.34 1.45 -0.31 1.54 3.72 -1.26 -4.64 117.46 118.30 1oca n PHE 88 Ca -0.02 -0.63 0.13 0.00 -0.05 0.00 0.00 57.45 56.87 1oca n PHE 88 Cb 0.58 -0.26 0.25 0.00 -0.94 0.00 0.00 39.48 39.11 1oca n PHE 88 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1oca n ILE 89 N 0.95 -0.37 -3.25 4.37 5.41 -1.26 -4.16 119.36 121.06 1oca n ILE 89 Ca 0.25 1.94 -0.40 0.00 1.00 0.00 0.00 62.75 65.54 1oca n ILE 89 Cb 0.89 -2.82 -0.07 0.00 -0.71 0.00 0.00 39.64 36.93 1oca n ILE 89 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1oca s LEU 90 N -10.58 4.09 0.46 1.39 1.43 -1.26 -5.07 118.68 109.15 1oca s LEU 90 Ca -0.12 0.59 0.05 0.00 -1.03 0.00 0.00 54.13 53.62 1oca s LEU 90 Cb 0.26 -2.68 0.02 0.00 0.03 0.00 0.00 46.19 43.82 1oca s LEU 90 CO 0.69 -0.23 0.64 -0.54 0.23 0.00 0.00 176.35 177.13 1oca s LYS 91 N 1.99 2.76 -1.25 1.70 1.02 -1.26 -4.11 119.74 120.59 1oca s LYS 91 Ca 0.22 -1.01 -0.17 0.00 0.02 0.00 0.00 55.97 55.02 1oca s LYS 91 Cb -0.15 -2.65 0.09 0.00 -0.52 0.00 0.00 37.83 34.59 1oca s LYS 91 CO 0.09 -0.41 1.64 -1.01 -0.92 0.00 0.00 175.35 174.75 1oca s HIS 92 N -2.50 2.93 -0.38 3.18 3.76 -1.26 -4.83 115.29 116.18 1oca s HIS 92 Ca 0.55 -1.68 0.22 0.00 -0.15 0.00 0.00 55.06 54.00 1oca s HIS 92 Cb -0.10 -4.65 0.33 0.00 1.11 0.00 0.00 32.58 29.26 1oca s HIS 92 CO 0.35 -1.72 1.60 1.79 -0.85 0.00 0.00 174.74 175.90 1oca h THR 93 N 5.46 0.13 0.00 1.30 1.35 -1.94 -3.35 112.91 115.86 1oca h THR 93 Ca 0.40 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 1oca h THR 93 Cb 0.88 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1oca h THR 93 CO 1.40 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 177.36 1oca n GLY 94 N 1.09 0.17 3.74 5.82 0.00 -1.26 -4.83 105.19 109.92 1oca n GLY 94 Ca 0.04 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 1oca n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1oca s PRO 95 N -2.00 4.25 0.00 1.61 0.04 -1.08 -2.76 135.00 135.06 1oca s PRO 95 Ca 0.00 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.36 1oca s PRO 95 Cb 0.00 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.43 1oca s PRO 95 CO 0.00 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.00 1oca n GLY 96 N 2.31 1.13 3.84 0.56 0.00 0.61 -4.89 105.19 108.75 1oca n GLY 96 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1oca n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oca s ILE 97 N -2.06 4.00 -0.07 -0.61 -1.09 -1.11 -0.27 121.20 119.99 1oca s ILE 97 Ca 0.00 0.65 0.04 0.00 -2.23 0.00 0.00 60.65 59.11 1oca s ILE 97 Cb 0.00 -3.50 0.00 0.00 -1.58 0.00 0.00 42.46 37.39 1oca s ILE 97 CO 0.00 -0.85 -0.19 -0.76 -1.23 0.00 0.00 174.94 171.91 1oca s LEU 98 N -5.45 1.92 0.03 2.97 1.02 0.45 -0.07 118.68 119.54 1oca s LEU 98 Ca 0.58 -0.43 -0.03 0.00 0.02 0.00 0.00 54.13 54.27 1oca s LEU 98 Cb -0.13 -1.13 -0.02 0.00 0.02 0.00 0.00 46.19 44.94 1oca s LEU 98 CO 0.54 0.14 0.04 -0.55 0.02 0.00 0.00 176.35 176.54 1oca s SER 99 N 0.28 0.23 0.18 2.29 0.15 -0.51 -1.19 113.70 115.13 1oca s SER 99 Ca -0.12 -0.56 -0.30 0.00 0.70 0.00 0.00 55.95 55.68 1oca s SER 99 Cb -0.15 0.18 -0.08 0.00 -1.71 0.00 0.00 66.02 64.26 1oca s SER 99 CO 0.05 -0.44 0.94 -0.04 1.20 0.00 0.00 173.24 174.95 1oca s MET 100 N -2.28 4.78 -0.15 5.44 -1.94 -0.39 -0.36 119.30 124.39 1oca s MET 100 Ca -0.08 1.46 -0.26 0.00 -1.71 0.00 0.00 55.69 55.10 1oca s MET 100 Cb -0.03 -3.32 -0.02 0.00 2.01 0.00 0.00 34.83 33.47 1oca s MET 100 CO -0.03 0.39 0.86 0.00 -0.01 0.00 0.00 175.02 176.22 1oca s ALA 101 N -0.67 3.49 0.06 3.03 0.00 -0.01 -4.17 121.76 123.48 1oca s ALA 101 Ca 0.43 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.53 1oca s ALA 101 Cb -0.25 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 1oca s ALA 101 CO 0.31 -0.61 -0.10 0.54 0.00 0.00 0.00 175.76 175.89 1oca s ASN 102 N 1.13 1.23 -0.05 0.00 4.22 -1.26 -4.48 114.94 115.73 1oca s ASN 102 Ca 0.40 -0.61 0.09 0.00 -2.14 0.00 0.00 52.86 50.61 1oca s ASN 102 Cb -0.17 0.00 0.35 0.00 1.28 0.00 0.00 41.25 42.71 1oca s ASN 102 CO 0.14 -0.16 1.20 0.00 -2.04 0.00 0.00 177.10 176.23 1oca n ALA 103 N 1.29 2.74 0.00 3.54 0.00 -1.25 -4.94 120.51 121.89 1oca n ALA 103 Ca -0.21 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1oca n ALA 103 Cb 0.55 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1oca n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oca n GLY 104 N 0.76 0.20 3.62 0.00 0.00 -1.26 -5.06 105.19 103.46 1oca n GLY 104 Ca 0.13 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 1oca n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1oca s PRO 105 N -2.00 0.41 -1.09 1.61 0.04 -1.26 -4.15 135.00 128.56 1oca s PRO 105 Ca 0.00 1.09 -0.02 0.00 0.04 0.00 0.00 61.00 62.11 1oca s PRO 105 Cb 0.00 -1.69 0.02 0.00 0.04 0.00 0.00 34.50 32.87 1oca s PRO 105 CO 0.00 -2.90 0.05 0.27 0.04 0.00 0.00 177.00 174.46 1oca n ASN 106 N -4.37 0.41 -1.57 6.66 0.23 -1.26 -4.82 115.26 110.53 1oca n ASN 106 Ca 0.07 -0.87 0.04 0.00 -0.53 0.00 0.00 54.58 53.29 1oca n ASN 106 Cb 0.54 -1.08 0.03 0.00 -2.08 0.00 0.00 39.78 37.18 1oca n ASN 106 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1oca n THR 107 N -3.38 0.21 -3.16 5.53 -2.24 -1.20 -4.47 114.28 105.58 1oca n THR 107 Ca -0.19 -1.27 -0.33 0.00 -2.27 0.00 0.00 64.05 60.00 1oca n THR 107 Cb 0.45 0.96 -0.06 0.00 -2.10 0.00 0.00 70.33 69.58 1oca n THR 107 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oca s ASN 108 N -2.21 6.77 0.18 3.42 2.20 -1.17 -3.80 114.94 120.33 1oca s ASN 108 Ca 0.34 1.25 0.00 0.00 -0.94 0.00 0.00 52.86 53.51 1oca s ASN 108 Cb 0.38 -2.36 0.00 0.00 -2.00 0.00 0.00 41.25 37.27 1oca s ASN 108 CO -0.15 -0.18 0.00 0.61 -2.94 0.00 0.00 177.10 174.43 1oca n GLY 109 N -0.29 -1.52 0.00 0.45 0.00 -1.26 -1.01 105.19 101.55 1oca n GLY 109 Ca 0.03 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1oca n GLY 109 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1oca n SER 110 N -2.88 0.00 -4.71 1.61 2.88 -1.26 -3.18 113.62 106.08 1oca n SER 110 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1oca n SER 110 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1oca n SER 110 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1oca s GLN 111 N -0.89 4.15 0.32 -1.46 -0.21 -0.81 -4.41 119.66 116.36 1oca s GLN 111 Ca 0.00 2.53 0.03 0.00 0.02 0.00 0.00 55.36 57.94 1oca s GLN 111 Cb 0.00 -3.27 -0.04 0.00 1.00 0.00 0.00 33.01 30.70 1oca s GLN 111 CO 0.00 -0.74 0.15 -0.59 -2.12 0.00 0.00 175.29 171.99 1oca s PHE 112 N 1.71 1.66 0.02 0.91 -0.12 -0.53 -0.83 117.98 120.80 1oca s PHE 112 Ca 0.75 -1.34 0.00 0.00 -0.05 0.00 0.00 56.93 56.30 1oca s PHE 112 Cb -0.47 -0.93 -0.02 0.00 -0.63 0.00 0.00 43.02 40.98 1oca s PHE 112 CO 0.33 -0.46 -0.03 -0.59 -0.05 0.00 0.00 175.22 174.41 1oca s PHE 113 N -3.52 0.30 -0.31 3.49 -0.71 0.52 -1.97 117.98 115.77 1oca s PHE 113 Ca 0.34 -0.51 -0.26 0.00 -1.04 0.00 0.00 56.93 55.45 1oca s PHE 113 Cb 0.05 -0.21 0.01 0.00 -1.21 0.00 0.00 43.02 41.66 1oca s PHE 113 CO 0.17 -0.17 0.94 0.42 -1.34 0.00 0.00 175.22 175.23 1oca s ILE 114 N -1.41 4.65 -0.37 -4.49 1.01 0.78 -1.42 121.20 119.94 1oca s ILE 114 Ca -0.15 1.47 -0.28 0.00 0.00 0.00 0.00 60.65 61.69 1oca s ILE 114 Cb -0.10 -4.28 -0.02 0.00 0.01 0.00 0.00 42.46 38.07 1oca s ILE 114 CO -0.01 -0.36 1.84 0.00 0.00 0.00 0.00 174.94 176.41 1oca n THR 116 N 7.41 3.02 -3.83 0.00 -2.24 -1.23 -0.28 114.28 117.13 1oca n THR 116 Ca 0.23 -2.00 -0.07 0.00 -2.27 0.00 0.00 64.05 59.94 1oca n THR 116 Cb 0.48 -0.41 0.01 0.00 -2.10 0.00 0.00 70.33 68.30 1oca n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oca s ALA 117 N -3.22 -1.06 -1.02 6.98 0.00 -1.24 -3.85 121.76 118.34 1oca s ALA 117 Ca 0.54 -0.50 -0.23 0.00 0.00 0.00 0.00 51.96 51.77 1oca s ALA 117 Cb 0.46 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 24.27 1oca s ALA 117 CO 0.10 -1.02 1.86 0.21 0.00 0.00 0.00 175.76 176.91 1oca s LYS 118 N -2.79 2.77 0.00 0.00 2.20 -1.26 -2.64 119.74 118.01 1oca s LYS 118 Ca 0.15 -0.76 -0.00 0.00 -0.36 0.00 0.00 55.97 55.00 1oca s LYS 118 Cb -0.05 -5.18 -0.01 0.00 -1.51 0.00 0.00 37.83 31.08 1oca s LYS 118 CO 0.09 -3.32 1.58 0.25 -0.36 0.00 0.00 175.35 173.58 1oca n THR 119 N 7.63 1.54 0.33 3.43 -2.24 -1.26 -4.65 114.28 119.06 1oca n THR 119 Ca 0.41 -0.42 0.21 0.00 -2.27 0.00 0.00 64.05 61.98 1oca n THR 119 Cb 0.47 -1.41 1.16 0.00 -2.10 0.00 0.00 70.33 68.46 1oca n THR 119 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1oca h GLU 120 N 1.90 0.00 0.00 -0.78 4.11 -1.89 0.40 114.58 118.32 1oca h GLU 120 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1oca h GLU 120 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1oca h GLU 120 CO 0.02 0.00 0.00 0.11 0.07 0.00 0.00 179.01 179.21 1oca h TRP 121 N 0.00 0.00 -0.02 2.06 0.09 -1.94 -2.21 115.95 113.93 1oca h TRP 121 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1oca h TRP 121 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.25 1oca h TRP 121 CO 0.00 0.00 -0.25 1.28 0.09 0.00 0.00 178.44 179.56 1oca n LEU 122 N -2.38 1.85 -4.72 0.11 4.77 0.13 -4.93 117.00 111.84 1oca n LEU 122 Ca 0.01 -0.62 -0.32 0.00 -0.03 0.00 0.00 56.01 55.05 1oca n LEU 122 Cb 0.21 -0.03 0.11 0.00 -2.33 0.00 0.00 43.42 41.38 1oca n LEU 122 CO 0.19 0.33 0.73 1.51 -1.33 0.00 0.00 177.39 178.82 1oca s ASP 123 N -2.32 3.90 0.00 -1.43 1.47 -0.83 -1.43 116.67 116.02 1oca s ASP 123 Ca 0.25 2.15 0.00 0.00 1.18 0.00 0.00 52.55 56.13 1oca s ASP 123 Cb 0.19 -2.56 0.00 0.00 -0.34 0.00 0.00 42.92 40.21 1oca s ASP 123 CO 0.47 -2.45 0.00 0.61 0.68 0.00 0.00 175.17 174.48 1oca n GLY 124 N -0.11 0.42 1.16 2.12 0.00 -1.26 -4.61 105.19 102.92 1oca n GLY 124 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1oca n GLY 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oca n LYS 125 N -2.00 0.00 -4.50 1.61 5.02 -1.16 -5.07 118.16 112.06 1oca n LYS 125 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 1oca n LYS 125 Cb 0.00 -0.37 -0.11 0.00 -0.02 0.00 0.00 35.03 34.53 1oca n LYS 125 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1oca s HIS 126 N -1.90 2.68 -0.57 2.13 3.76 -0.52 -4.89 115.29 115.98 1oca s HIS 126 Ca 0.00 -0.18 -0.19 0.00 -0.15 0.00 0.00 55.06 54.54 1oca s HIS 126 Cb 0.00 -1.49 0.10 0.00 1.11 0.00 0.00 32.58 32.30 1oca s HIS 126 CO 0.00 0.33 0.66 0.08 -0.85 0.00 0.00 174.74 174.96 1oca s VAL 127 N -1.01 4.88 0.10 -0.90 1.01 -1.26 -4.80 120.40 118.41 1oca s VAL 127 Ca 0.17 -0.97 -0.31 0.00 0.00 0.00 0.00 61.98 60.86 1oca s VAL 127 Cb -0.11 -4.44 -0.09 0.00 0.00 0.00 0.00 36.38 31.75 1oca s VAL 127 CO 0.08 -1.04 1.61 -0.69 0.00 0.00 0.00 175.10 175.06 1oca s VAL 128 N 2.54 2.95 0.00 2.92 1.01 -1.26 -1.26 120.40 127.30 1oca s VAL 128 Ca 0.11 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1oca s VAL 128 Cb -0.24 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1oca s VAL 128 CO 0.07 0.01 0.15 2.22 0.00 0.00 0.00 175.10 177.55 1oca n PHE 129 N 5.01 0.00 -3.49 5.22 -1.74 -0.33 -4.71 117.46 117.42 1oca n PHE 129 Ca 0.15 -0.01 -0.01 0.00 -0.56 0.00 0.00 57.45 57.02 1oca n PHE 129 Cb 0.40 -0.00 0.01 0.00 1.52 0.00 0.00 39.48 41.41 1oca n PHE 129 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1oca n GLY 130 N -0.01 1.24 3.28 4.97 0.00 -1.02 -0.50 105.19 113.16 1oca n GLY 130 Ca 0.00 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 1oca n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oca s LYS 131 N -2.02 0.99 -0.11 1.61 -2.85 0.04 -0.42 119.74 116.98 1oca s LYS 131 Ca 0.07 -0.89 -0.31 0.00 -1.00 0.00 0.00 55.97 53.84 1oca s LYS 131 Cb -0.01 0.40 -0.08 0.00 -2.06 0.00 0.00 37.83 36.08 1oca s LYS 131 CO 0.02 -0.35 2.06 0.28 0.10 0.00 0.00 175.35 177.46 1oca n VAL 132 N -0.15 0.54 -0.03 1.79 0.31 0.63 -0.90 118.33 120.52 1oca n VAL 132 Ca -0.14 -0.26 -0.13 0.00 -0.01 0.00 0.00 64.34 63.80 1oca n VAL 132 Cb 0.63 -2.27 -0.11 0.00 -0.91 0.00 0.00 33.84 31.18 1oca n VAL 132 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1oca h LYS 133 N 12.07 0.01 -3.22 5.55 3.64 -1.24 -3.45 116.57 129.92 1oca h LYS 133 Ca -0.45 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.88 1oca h LYS 133 Cb 1.25 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.94 1oca h LYS 133 CO 0.96 0.64 0.00 -1.83 -2.27 0.00 0.00 179.45 176.94 1oca s GLU 134 N -3.68 1.10 0.00 1.90 -1.05 -1.00 -5.00 118.70 110.97 1oca s GLU 134 Ca -0.17 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 1oca s GLU 134 Cb 0.00 0.49 0.00 0.00 -0.44 0.00 0.00 34.13 34.19 1oca s GLU 134 CO 0.68 -0.44 0.00 0.41 0.95 0.00 0.00 175.26 176.86 1oca n GLY 135 N -0.16 1.12 0.36 -3.83 0.00 -1.26 -1.92 105.19 99.51 1oca n GLY 135 Ca -0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.93 1oca n GLY 135 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1oca h MET 136 N 0.00 0.92 0.00 1.61 -1.53 -1.95 -0.68 114.93 113.31 1oca h MET 136 Ca 0.00 -0.06 -0.01 0.00 -3.44 0.00 0.00 59.70 56.19 1oca h MET 136 Cb 0.00 -0.21 -0.00 0.00 -0.55 0.00 0.00 31.60 30.84 1oca h MET 136 CO 0.00 0.61 -0.06 -2.95 0.14 0.00 0.00 176.91 174.65 1oca h ASN 137 N 0.95 0.00 -0.07 1.39 7.08 -1.98 0.14 115.58 123.10 1oca h ASN 137 Ca 0.49 0.00 -0.11 0.00 -3.08 0.00 0.00 56.30 53.60 1oca h ASN 137 Cb 0.52 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.76 1oca h ASN 137 CO -0.25 0.06 -0.39 0.40 -2.08 0.00 0.00 177.43 175.17 1oca h ILE 138 N 0.00 1.41 -0.48 6.14 1.08 -1.51 -0.15 117.51 124.00 1oca h ILE 138 Ca -0.00 -1.78 0.07 0.00 -0.39 0.00 0.00 64.86 62.76 1oca h ILE 138 Cb 0.12 2.32 -0.06 0.00 -3.07 0.00 0.00 36.82 36.14 1oca h ILE 138 CO 0.01 0.52 0.14 0.58 -0.69 0.00 0.00 178.15 178.71 1oca h VAL 139 N -0.09 0.80 0.00 1.67 2.07 -0.93 0.20 116.25 119.97 1oca h VAL 139 Ca -0.03 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 1oca h VAL 139 Cb 1.04 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1oca h VAL 139 CO 0.08 0.06 -0.18 -0.33 0.02 0.00 0.00 177.57 177.21 1oca h GLU 140 N 0.30 0.00 -0.08 1.57 5.08 -0.69 -0.67 114.58 120.09 1oca h GLU 140 Ca 0.23 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.45 1oca h GLU 140 Cb 0.27 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.53 1oca h GLU 140 CO -0.26 0.18 -0.51 0.00 -1.00 0.00 0.00 179.01 177.43 1oca h ALA 141 N 1.82 0.17 -0.76 3.43 0.00 -0.07 -1.91 119.26 121.94 1oca h ALA 141 Ca -0.00 -0.51 0.07 0.00 0.00 0.00 0.00 54.91 54.47 1oca h ALA 141 Cb 0.53 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1oca h ALA 141 CO 0.02 0.36 0.43 0.52 0.00 0.00 0.00 179.25 180.59 1oca h MET 142 N 0.06 0.75 -0.64 0.00 2.86 -0.06 -0.59 114.93 117.31 1oca h MET 142 Ca -0.04 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1oca h MET 142 Cb 1.16 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.62 1oca h MET 142 CO 0.10 0.50 0.31 0.93 1.06 0.00 0.00 176.91 179.82 1oca h GLU 143 N 0.78 0.91 0.00 1.72 5.08 -1.16 -1.65 114.58 120.26 1oca h GLU 143 Ca 0.34 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1oca h GLU 143 Cb 0.23 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1oca h GLU 143 CO -0.20 0.70 -0.08 0.07 -1.00 0.00 0.00 179.01 178.50 1oca h ARG 144 N 0.91 0.00 -0.28 2.33 0.11 -0.29 -0.26 114.38 116.90 1oca h ARG 144 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 1oca h ARG 144 Cb 0.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 1oca h ARG 144 CO -0.03 0.08 0.00 1.19 0.10 0.00 0.00 179.97 181.31 1oca n PHE 145 N -3.19 0.36 -1.89 4.08 3.72 -0.72 -4.89 117.46 114.94 1oca n PHE 145 Ca 0.01 -0.18 -0.07 0.00 -0.05 0.00 0.00 57.45 57.16 1oca n PHE 145 Cb 0.38 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.96 1oca n PHE 145 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oca n GLY 146 N 1.26 -0.08 3.39 1.37 0.00 -0.11 -0.52 105.19 110.50 1oca n GLY 146 Ca 0.17 -1.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 1oca n GLY 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oca s SER 147 N -2.16 -0.12 0.52 1.61 1.04 -0.82 -4.47 113.70 109.29 1oca s SER 147 Ca 0.18 -0.58 0.21 0.00 0.48 0.00 0.00 55.95 56.24 1oca s SER 147 Cb -0.01 0.49 1.37 0.00 0.10 0.00 0.00 66.02 67.97 1oca s SER 147 CO 0.13 -0.93 2.12 0.03 0.98 0.00 0.00 173.24 175.57 1oca h ARG 148 N 2.40 0.00 0.00 4.02 3.08 -1.89 0.11 114.38 122.09 1oca h ARG 148 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1oca h ARG 148 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1oca h ARG 148 CO 0.45 0.07 0.00 -2.95 -1.07 0.00 0.00 179.97 176.47 1oca h ASN 149 N 0.00 0.00 0.00 7.04 7.08 -1.97 -3.46 115.58 124.27 1oca h ASN 149 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1oca h ASN 149 Cb 0.15 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.39 1oca h ASN 149 CO 0.01 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.97 1oca n GLY 150 N 0.23 2.30 3.72 9.14 0.00 0.37 -5.00 105.19 115.95 1oca n GLY 150 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1oca n GLY 150 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oca s LYS 151 N -0.18 4.30 0.27 1.61 2.36 -1.26 -1.02 119.74 125.81 1oca s LYS 151 Ca 0.00 2.14 -0.29 0.00 -2.55 0.00 0.00 55.97 55.27 1oca s LYS 151 Cb 0.00 -3.22 -0.09 0.00 -1.05 0.00 0.00 37.83 33.47 1oca s LYS 151 CO 0.00 -0.45 1.22 0.95 1.55 0.00 0.00 175.35 178.62 1oca s THR 152 N 0.95 3.20 0.42 3.43 -4.23 -1.26 -2.77 115.64 115.39 1oca s THR 152 Ca 0.65 1.13 0.13 0.00 -1.18 0.00 0.00 61.69 62.42 1oca s THR 152 Cb -0.38 -3.72 0.17 0.00 1.34 0.00 0.00 72.50 69.90 1oca s THR 152 CO 0.32 0.24 1.96 0.77 -0.54 0.00 0.00 174.62 177.37 1oca h SER 153 N 4.19 0.06 -2.70 3.99 4.64 -1.03 -3.45 113.55 119.25 1oca h SER 153 Ca -0.47 -0.01 -0.53 0.00 -0.47 0.00 0.00 61.79 60.31 1oca h SER 153 Cb 1.22 -0.02 -0.14 0.00 -0.31 0.00 0.00 62.40 63.16 1oca h SER 153 CO 0.70 0.25 -0.60 -0.54 -0.87 0.00 0.00 176.83 175.77 1oca s LYS 154 N -4.63 1.77 -1.02 4.77 1.02 -1.25 -5.08 119.74 115.32 1oca s LYS 154 Ca -0.04 -2.00 -0.19 0.00 0.02 0.00 0.00 55.97 53.76 1oca s LYS 154 Cb 0.16 -1.10 0.12 0.00 -0.52 0.00 0.00 37.83 36.48 1oca s LYS 154 CO 0.71 -0.16 1.28 0.21 -0.92 0.00 0.00 175.35 176.47 1oca s LYS 155 N -3.83 3.70 -0.17 1.68 2.47 -1.26 -4.96 119.74 117.38 1oca s LYS 155 Ca 0.35 -1.78 -0.29 0.00 -1.56 0.00 0.00 55.97 52.68 1oca s LYS 155 Cb 0.09 -5.07 -0.01 0.00 -1.46 0.00 0.00 37.83 31.37 1oca s LYS 155 CO 0.16 -1.89 1.24 0.42 0.16 0.00 0.00 175.35 175.44 1oca s ILE 156 N 3.07 4.31 0.25 5.43 -1.09 -1.26 -0.99 121.20 130.91 1oca s ILE 156 Ca 0.38 1.58 -0.01 0.00 -2.23 0.00 0.00 60.65 60.37 1oca s ILE 156 Cb -0.03 -4.02 -0.03 0.00 -1.58 0.00 0.00 42.46 36.80 1oca s ILE 156 CO -0.07 -0.14 0.25 0.42 -1.23 0.00 0.00 174.94 174.18 1oca s THR 157 N 3.44 0.00 -0.33 2.92 -4.23 -0.52 -2.82 115.64 114.09 1oca s THR 157 Ca 0.54 -1.86 -0.10 0.00 -1.18 0.00 0.00 61.69 59.08 1oca s THR 157 Cb -0.21 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.16 1oca s THR 157 CO 0.14 0.00 0.18 -0.63 -0.54 0.00 0.00 174.62 173.77 1oca s ILE 158 N -3.87 4.64 0.08 2.99 1.09 -1.26 -1.35 121.20 123.53 1oca s ILE 158 Ca 0.36 -0.55 -0.32 0.00 -1.10 0.00 0.00 60.65 59.03 1oca s ILE 158 Cb 0.04 -3.44 -0.16 0.00 -1.06 0.00 0.00 42.46 37.84 1oca s ILE 158 CO 0.16 -0.04 1.61 0.00 -0.10 0.00 0.00 174.94 176.57 1oca h ALA 159 N 8.39 -0.86 -2.93 9.38 0.00 -1.13 -2.16 119.26 129.95 1oca h ALA 159 Ca -0.30 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1oca h ALA 159 Cb 1.13 0.46 -0.09 0.00 0.00 0.00 0.00 17.79 19.29 1oca h ALA 159 CO 0.63 -1.00 0.11 0.16 0.00 0.00 0.00 179.25 179.16 1oca s ASP 160 N -4.48 -0.31 0.11 0.00 -4.77 -1.23 -4.33 116.67 101.66 1oca s ASP 160 Ca -0.17 -0.45 -0.03 0.00 -3.30 0.00 0.00 52.55 48.60 1oca s ASP 160 Cb 0.05 0.63 -0.03 0.00 -1.09 0.00 0.00 42.92 42.47 1oca s ASP 160 CO 0.62 -1.13 0.08 0.00 0.70 0.00 0.00 175.17 175.45 1oca s GLY 162 N -2.99 -0.14 0.57 0.00 0.00 -1.10 -4.38 107.32 99.28 1oca s GLY 162 Ca 0.18 0.02 -0.15 0.00 0.00 0.00 0.00 44.72 44.76 1oca s GLY 162 CO -0.02 0.68 1.02 1.20 0.00 0.00 0.00 173.10 175.97 1oca s GLN 163 N -2.89 3.66 -0.29 2.90 -0.21 -1.26 -0.22 119.66 121.35 1oca s GLN 163 Ca 0.15 0.97 0.19 0.00 0.02 0.00 0.00 55.36 56.69 1oca s GLN 163 Cb -0.01 -2.09 0.49 0.00 1.00 0.00 0.00 33.01 32.39 1oca s GLN 163 CO 0.03 -0.51 1.08 1.28 -2.12 0.00 0.00 175.29 175.04 1oca n LEU 164 N -2.03 2.09 0.00 2.90 4.77 -0.11 -4.62 117.00 120.00 1oca n LEU 164 Ca 0.07 -3.51 0.05 0.00 -0.03 0.00 0.00 56.01 52.59 1oca n LEU 164 Cb 0.54 0.32 0.28 0.00 -2.33 0.00 0.00 43.42 42.23 1oca n LEU 164 CO 0.50 1.35 0.50 -0.62 -1.33 0.00 0.00 177.39 177.79