#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r94 s GLU 22 N 0.00 3.74 -0.42 0.03 2.02 -0.22 -4.88 118.70 118.96 2r94 s GLU 22 Ca 0.00 0.16 -0.15 0.00 0.02 0.00 0.00 54.97 55.00 2r94 s GLU 22 Cb 0.00 -2.67 0.03 0.00 0.10 0.00 0.00 34.13 31.59 2r94 s GLU 22 CO 0.00 0.31 0.32 0.42 0.02 0.00 0.00 175.26 176.33 2r94 s ILE 23 N -1.86 5.23 -0.18 -1.63 1.01 -1.26 -1.83 121.20 120.67 2r94 s ILE 23 Ca 0.46 -0.77 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 2r94 s ILE 23 Cb -0.11 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 2r94 s ILE 23 CO 0.24 -0.38 0.13 -0.69 0.00 0.00 0.00 174.94 174.24 2r94 s VAL 24 N 1.67 5.39 -0.28 2.92 1.01 0.28 -0.12 120.40 131.26 2r94 s VAL 24 Ca 0.05 0.18 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 2r94 s VAL 24 Cb -0.20 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2r94 s VAL 24 CO 0.09 0.49 0.26 0.00 0.00 0.00 0.00 175.10 175.93 2r94 s ALA 25 N 0.01 3.54 -0.87 5.51 0.00 0.12 -2.47 121.76 127.59 2r94 s ALA 25 Ca 0.09 -1.02 -0.22 0.00 0.00 0.00 0.00 51.96 50.81 2r94 s ALA 25 Cb -0.11 -2.58 0.08 0.00 0.00 0.00 0.00 23.12 20.51 2r94 s ALA 25 CO -0.00 -0.62 1.21 -1.25 0.00 0.00 0.00 175.76 175.10 2r94 s PRO 26 N 1.87 3.43 0.39 0.00 0.04 -1.26 -0.25 135.00 139.22 2r94 s PRO 26 Ca 0.10 -1.15 -0.25 0.00 0.04 0.00 0.00 61.00 59.74 2r94 s PRO 26 Cb -0.16 -4.81 -0.09 0.00 0.04 0.00 0.00 34.50 29.49 2r94 s PRO 26 CO 0.11 -1.97 1.12 0.14 0.04 0.00 0.00 177.00 176.43 2r94 s VAL 27 N 4.13 3.38 0.88 -0.36 -7.23 -0.99 -4.49 120.40 115.71 2r94 s VAL 27 Ca 0.35 1.14 -0.11 0.00 -1.81 0.00 0.00 61.98 61.55 2r94 s VAL 27 Cb -0.06 -3.63 0.12 0.00 0.56 0.00 0.00 36.38 33.37 2r94 s VAL 27 CO -0.02 0.09 1.10 0.27 -0.31 0.00 0.00 175.10 176.22 2r94 s ILE 28 N -1.48 2.71 -0.26 -0.62 -4.36 -1.26 -3.49 121.20 112.45 2r94 s ILE 28 Ca 0.56 0.23 -0.06 0.00 -0.26 0.00 0.00 60.65 61.12 2r94 s ILE 28 Cb -0.28 -2.60 -0.01 0.00 1.25 0.00 0.00 42.46 40.82 2r94 s ILE 28 CO 0.35 -0.30 0.04 -0.89 0.24 0.00 0.00 174.94 174.38 2r94 s THR 29 N -2.84 3.89 -0.58 8.37 2.01 -1.26 -4.89 115.64 120.34 2r94 s THR 29 Ca 0.64 -0.49 -0.18 0.00 0.31 0.00 0.00 61.69 61.96 2r94 s THR 29 Cb -0.19 -2.89 0.10 0.00 0.01 0.00 0.00 72.50 69.54 2r94 s THR 29 CO 0.57 0.25 0.66 0.42 -0.69 0.00 0.00 174.62 175.84 2r94 s THR 30 N 1.53 4.90 0.28 -0.82 -4.23 -1.26 -4.66 115.64 111.38 2r94 s THR 30 Ca 0.05 -1.05 -0.16 0.00 -1.18 0.00 0.00 61.69 59.35 2r94 s THR 30 Cb -0.16 -4.45 -0.09 0.00 1.34 0.00 0.00 72.50 69.15 2r94 s THR 30 CO 0.01 -1.05 0.71 -0.36 -0.54 0.00 0.00 174.62 173.39 2r94 s PHE 31 N 2.48 3.45 -0.08 3.99 0.08 -0.74 -1.10 117.98 126.07 2r94 s PHE 31 Ca 0.10 1.23 -0.11 0.00 0.12 0.00 0.00 56.93 58.26 2r94 s PHE 31 Cb -0.25 -2.53 0.03 0.00 -0.57 0.00 0.00 43.02 39.70 2r94 s PHE 31 CO 0.06 0.18 0.29 -0.98 -0.10 0.00 0.00 175.22 174.67 2r94 s ARG 32 N -2.68 0.44 3.34 0.44 1.70 -0.05 -0.38 118.95 121.76 2r94 s ARG 32 Ca 0.50 0.21 0.00 0.00 -0.47 0.00 0.00 55.73 55.97 2r94 s ARG 32 Cb -0.12 0.20 0.00 0.00 -0.57 0.00 0.00 34.95 34.46 2r94 s ARG 32 CO 0.19 -0.08 0.00 0.41 -1.08 0.00 0.00 175.30 174.73 2r94 n GLY 33 N 2.41 0.79 0.38 3.88 0.00 -1.26 -2.59 105.19 108.80 2r94 n GLY 33 Ca -0.16 -0.78 0.14 0.00 0.00 0.00 0.00 46.02 45.23 2r94 n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r94 n GLY 34 N 0.00 -0.22 3.40 -0.02 0.00 -1.26 -4.93 105.19 102.16 2r94 n GLY 34 Ca 0.00 -0.40 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 2r94 n GLY 34 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2r94 s ARG 35 N -2.02 1.47 0.10 1.61 1.70 -1.07 -5.04 118.95 115.70 2r94 s ARG 35 Ca 0.39 -1.60 -0.33 0.00 -0.47 0.00 0.00 55.73 53.72 2r94 s ARG 35 Cb 0.21 -1.51 -0.12 0.00 -0.57 0.00 0.00 34.95 32.96 2r94 s ARG 35 CO 0.35 0.29 1.73 -0.11 -1.08 0.00 0.00 175.30 176.48 2r94 n LEU 36 N -0.22 3.51 -4.18 -1.89 7.94 -1.26 -0.87 117.00 120.02 2r94 n LEU 36 Ca -0.09 1.03 -0.40 0.00 -1.11 0.00 0.00 56.01 55.44 2r94 n LEU 36 Cb 0.59 -1.46 -0.08 0.00 0.53 0.00 0.00 43.42 43.00 2r94 n LEU 36 CO 0.34 -0.07 0.08 -0.62 -1.11 0.00 0.00 177.39 176.01 2r94 s ASP 37 N 2.17 5.71 0.00 1.96 -1.08 -0.26 -4.83 116.67 120.33 2r94 s ASP 37 Ca 0.83 -2.45 0.16 0.00 -0.52 0.00 0.00 52.55 50.56 2r94 s ASP 37 Cb -0.61 -1.98 0.93 0.00 -1.46 0.00 0.00 42.92 39.80 2r94 s ASP 37 CO 0.40 -0.53 1.39 -0.81 0.52 0.00 0.00 175.17 176.14 2r94 n PRO 38 N 4.13 0.45 -0.01 4.34 -0.04 -1.26 -2.50 135.00 140.11 2r94 n PRO 38 Ca 0.03 0.03 -0.21 0.00 -0.04 0.00 0.00 63.50 63.31 2r94 n PRO 38 Cb 0.41 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.23 2r94 n PRO 38 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2r94 n GLU 39 N -1.06 0.75 -0.10 0.54 -0.58 -1.26 -2.47 120.64 116.47 2r94 n GLU 39 Ca 0.11 0.26 -0.06 0.00 -0.42 0.00 0.00 57.16 57.06 2r94 n GLU 39 Cb 0.07 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.25 2r94 n GLU 39 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2r94 h LEU 40 N 0.03 -0.44 -0.39 -4.62 5.85 -1.90 -0.03 115.31 113.81 2r94 h LEU 40 Ca -0.44 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 2r94 h LEU 40 Cb 2.00 0.26 -0.02 0.00 0.37 0.00 0.00 40.66 43.28 2r94 h LEU 40 CO 0.06 -0.16 0.21 0.15 -0.34 0.00 0.00 178.44 178.37 2r94 h PHE 41 N -0.06 0.54 -0.56 1.25 3.57 -1.58 -0.13 116.94 119.98 2r94 h PHE 41 Ca 0.17 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.57 2r94 h PHE 41 Cb 0.32 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 2r94 h PHE 41 CO -0.35 0.42 0.01 0.00 -2.23 0.00 0.00 178.31 176.16 2r94 h ALA 42 N 1.07 0.75 -0.72 2.41 0.00 -1.38 -0.54 119.26 120.85 2r94 h ALA 42 Ca 0.14 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2r94 h ALA 42 Cb 0.06 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2r94 h ALA 42 CO -0.02 0.57 0.45 -0.97 0.00 0.00 0.00 179.25 179.28 2r94 h ASN 43 N 0.86 0.84 -0.21 0.00 -1.24 -0.57 -0.35 115.58 114.93 2r94 h ASN 43 Ca 0.16 -0.03 -0.04 0.00 0.71 0.00 0.00 56.30 57.09 2r94 h ASN 43 Cb 0.53 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.36 2r94 h ASN 43 CO 0.03 0.63 -0.03 -0.74 -1.29 0.00 0.00 177.43 176.02 2r94 h HIS 44 N 0.98 0.44 -0.40 0.67 2.76 -0.71 -0.46 115.15 118.42 2r94 h HIS 44 Ca 0.26 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 2r94 h HIS 44 Cb -0.08 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 28.76 2r94 h HIS 44 CO 0.00 0.62 0.25 0.28 -1.30 0.00 0.00 177.93 177.79 2r94 h VAL 45 N 0.13 1.12 -0.19 5.26 2.07 -0.78 -2.01 116.25 121.85 2r94 h VAL 45 Ca 0.05 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.35 2r94 h VAL 45 Cb 0.47 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2r94 h VAL 45 CO 0.02 0.12 0.01 0.11 0.02 0.00 0.00 177.57 177.85 2r94 h LYS 46 N 0.54 0.07 -0.86 1.57 1.57 -0.96 -1.06 116.57 117.43 2r94 h LYS 46 Ca 0.15 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2r94 h LYS 46 Cb -0.02 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 2r94 h LYS 46 CO -0.03 0.05 0.54 -0.97 -0.57 0.00 0.00 179.45 178.47 2r94 h ASN 47 N 0.08 1.02 0.82 0.86 -1.24 -0.75 -2.29 115.58 114.07 2r94 h ASN 47 Ca 0.09 -0.05 -0.21 0.00 0.71 0.00 0.00 56.30 56.84 2r94 h ASN 47 Cb 0.10 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 38.86 2r94 h ASN 47 CO -0.14 0.76 -1.28 0.16 -1.29 0.00 0.00 177.43 175.65 2r94 h ILE 48 N 1.18 0.95 0.00 2.57 3.07 -1.06 -2.85 117.51 121.38 2r94 h ILE 48 Ca 0.31 -2.60 0.00 0.00 1.55 0.00 0.00 64.86 64.13 2r94 h ILE 48 Cb -0.09 2.41 0.00 0.00 -0.27 0.00 0.00 36.82 38.87 2r94 h ILE 48 CO -0.06 0.54 0.00 0.71 -1.05 0.00 0.00 178.15 178.29 2r94 h THR 49 N 0.00 0.00 -0.00 0.16 1.35 -1.19 -1.81 112.91 111.42 2r94 h THR 49 Ca -0.14 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 2r94 h THR 49 Cb 1.74 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 69.52 2r94 h THR 49 CO 0.08 0.00 -0.07 -1.54 -0.25 0.00 0.00 175.52 173.74 2r94 n SER 50 N -2.68 0.53 -0.12 5.36 3.41 -0.87 -3.87 113.62 115.38 2r94 n SER 50 Ca 0.02 -0.79 0.03 0.00 -0.26 0.00 0.00 58.87 57.87 2r94 n SER 50 Cb 0.32 -0.05 0.05 0.00 -0.26 0.00 0.00 64.21 64.26 2r94 n SER 50 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r94 n LYS 51 N -0.80 1.30 0.00 4.33 5.02 -0.90 -4.98 118.16 122.13 2r94 n LYS 51 Ca 0.17 -1.61 0.00 0.00 -2.02 0.00 0.00 58.31 54.85 2r94 n LYS 51 Cb 0.26 -0.99 0.00 0.00 -0.02 0.00 0.00 35.03 34.28 2r94 n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r94 n GLY 52 N -0.64 1.23 3.71 0.72 0.00 -1.13 -3.82 105.19 105.25 2r94 n GLY 52 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2r94 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r94 s VAL 53 N -1.60 3.37 -0.25 1.61 1.01 -0.73 -4.57 120.40 119.25 2r94 s VAL 53 Ca 0.00 0.97 0.04 0.00 0.00 0.00 0.00 61.98 62.98 2r94 s VAL 53 Cb 0.00 -3.62 -0.18 0.00 0.00 0.00 0.00 36.38 32.58 2r94 s VAL 53 CO 0.00 0.07 -0.17 0.47 0.00 0.00 0.00 175.10 175.47 2r94 n ASP 54 N 4.08 1.75 -4.16 3.32 8.00 0.83 -4.43 116.55 125.94 2r94 n ASP 54 Ca 0.12 -0.11 -0.22 0.00 0.71 0.00 0.00 54.79 55.29 2r94 n ASP 54 Cb 0.43 -0.26 -0.14 0.00 -0.02 0.00 0.00 41.12 41.13 2r94 n ASP 54 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2r94 s VAL 55 N -2.52 1.25 -0.22 2.53 1.01 -1.12 -4.57 120.40 116.76 2r94 s VAL 55 Ca -0.31 -0.94 -0.08 0.00 0.00 0.00 0.00 61.98 60.65 2r94 s VAL 55 Cb 0.09 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2r94 s VAL 55 CO 0.63 0.14 0.08 -0.69 0.00 0.00 0.00 175.10 175.27 2r94 s VAL 56 N -0.70 4.63 -0.39 2.92 1.01 0.38 -0.70 120.40 127.56 2r94 s VAL 56 Ca 0.04 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 61.89 2r94 s VAL 56 Cb -0.07 -3.13 0.08 0.00 0.00 0.00 0.00 36.38 33.26 2r94 s VAL 56 CO 0.01 0.39 0.18 0.12 0.00 0.00 0.00 175.10 175.79 2r94 s PHE 57 N 1.05 3.41 0.10 5.22 5.36 0.66 -0.00 117.98 133.77 2r94 s PHE 57 Ca 0.04 -1.91 -0.16 0.00 -0.96 0.00 0.00 56.93 53.94 2r94 s PHE 57 Cb -0.14 -2.85 -0.07 0.00 -0.34 0.00 0.00 43.02 39.63 2r94 s PHE 57 CO 0.03 -0.88 0.54 0.54 -1.46 0.00 0.00 175.22 173.99 2r94 s VAL 58 N 1.29 4.83 -1.23 3.12 0.11 0.38 -2.36 120.40 126.54 2r94 s VAL 58 Ca 0.03 0.97 -0.04 0.00 -2.93 0.00 0.00 61.98 60.01 2r94 s VAL 58 Cb -0.22 -3.79 0.00 0.00 -1.53 0.00 0.00 36.38 30.84 2r94 s VAL 58 CO -0.01 0.40 0.53 0.00 -3.33 0.00 0.00 175.10 172.69 2r94 n ALA 59 N 1.28 -0.80 -1.42 1.54 0.00 -1.26 -1.00 120.51 118.85 2r94 n ALA 59 Ca -0.08 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2r94 n ALA 59 Cb 0.51 -3.33 0.00 0.00 0.00 0.00 0.00 19.45 16.63 2r94 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r94 n GLY 60 N -1.40 0.50 0.09 0.00 0.00 -1.26 -3.75 105.19 99.38 2r94 n GLY 60 Ca -0.08 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 44.05 2r94 n GLY 60 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2r94 h THR 61 N 0.00 1.11 -0.18 2.61 2.02 -1.95 0.30 112.91 116.83 2r94 h THR 61 Ca 0.00 -0.33 0.05 0.00 0.77 0.00 0.00 66.41 66.91 2r94 h THR 61 Cb 0.00 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 2r94 h THR 61 CO 0.00 0.11 0.13 0.74 0.37 0.00 0.00 175.52 176.87 2r94 h THR 62 N 0.11 0.89 -0.11 3.16 2.02 -1.89 0.18 112.91 117.27 2r94 h THR 62 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.23 2r94 h THR 62 Cb 0.10 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2r94 h THR 62 CO -0.01 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.49 2r94 n GLY 63 N -1.57 -0.15 2.34 2.16 0.00 -0.39 -4.40 105.19 103.18 2r94 n GLY 63 Ca 0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 2r94 n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2r94 n LEU 64 N -0.05 -1.40 0.00 0.99 4.32 0.05 -4.30 117.00 116.62 2r94 n LEU 64 Ca 0.15 0.15 0.00 0.00 -0.02 0.00 0.00 56.01 56.29 2r94 n LEU 64 Cb 0.23 -2.18 0.00 0.00 -1.62 0.00 0.00 43.42 39.86 2r94 n LEU 64 CO 0.12 -0.42 0.15 0.61 -1.22 0.00 0.00 177.39 176.63 2r94 n GLY 65 N -1.09 -1.21 0.13 -0.72 0.00 0.91 0.47 105.19 103.68 2r94 n GLY 65 Ca -0.16 0.24 0.07 0.00 0.00 0.00 0.00 46.02 46.16 2r94 n GLY 65 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2r94 n PRO 66 N -1.86 0.08 0.00 1.61 -0.02 -1.26 -0.39 135.00 133.17 2r94 n PRO 66 Ca 0.00 0.55 0.11 0.00 -2.02 0.00 0.00 63.50 62.14 2r94 n PRO 66 Cb 0.00 -1.94 0.13 0.00 -0.02 0.00 0.00 33.50 31.66 2r94 n PRO 66 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r94 n ALA 67 N -1.59 3.76 -2.69 3.55 0.00 0.18 -4.94 120.51 118.78 2r94 n ALA 67 Ca -0.01 -0.49 -0.36 0.00 0.00 0.00 0.00 53.44 52.58 2r94 n ALA 67 Cb 0.19 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 2r94 n ALA 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r94 s LEU 68 N -2.77 4.40 0.71 0.00 1.43 0.48 -5.10 118.68 117.83 2r94 s LEU 68 Ca 0.15 0.68 -0.11 0.00 -1.03 0.00 0.00 54.13 53.82 2r94 s LEU 68 Cb 0.18 -2.57 0.02 0.00 0.03 0.00 0.00 46.19 43.84 2r94 s LEU 68 CO 0.67 0.29 1.08 -0.94 0.23 0.00 0.00 176.35 177.69 2r94 s SER 69 N -1.41 5.37 0.34 2.29 1.04 -1.26 -4.87 113.70 115.20 2r94 s SER 69 Ca 0.25 1.28 0.11 0.00 0.48 0.00 0.00 55.95 58.06 2r94 s SER 69 Cb -0.14 -2.12 0.88 0.00 0.10 0.00 0.00 66.02 64.75 2r94 s SER 69 CO 0.13 -1.41 1.78 0.25 0.98 0.00 0.00 173.24 174.97 2r94 h LEU 70 N -0.70 0.65 -0.32 2.42 5.85 -1.98 -1.50 115.31 119.74 2r94 h LEU 70 Ca -0.45 0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.22 2r94 h LEU 70 Cb 1.24 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 2r94 h LEU 70 CO 0.62 0.20 -0.36 1.56 -0.34 0.00 0.00 178.44 180.12 2r94 h GLN 71 N 0.61 0.80 -0.92 1.25 7.50 -1.99 -0.10 115.11 122.27 2r94 h GLN 71 Ca 0.57 -0.44 0.02 0.00 0.50 0.00 0.00 58.65 59.30 2r94 h GLN 71 Cb 1.10 0.02 -0.05 0.00 0.05 0.00 0.00 27.48 28.61 2r94 h GLN 71 CO -0.35 1.07 0.61 0.93 -1.50 0.00 0.00 178.83 179.59 2r94 h GLU 72 N 0.57 1.17 -0.13 1.46 5.08 -1.67 -1.18 114.58 119.89 2r94 h GLU 72 Ca 0.05 -0.07 -0.19 0.00 -1.00 0.00 0.00 59.36 58.15 2r94 h GLU 72 Cb 0.94 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 2r94 h GLU 72 CO 0.09 0.78 -0.68 0.87 -1.00 0.00 0.00 179.01 179.06 2r94 h LYS 73 N 1.21 0.55 -0.71 2.33 1.57 -0.65 -0.95 116.57 119.92 2r94 h LYS 73 Ca 0.35 -0.41 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2r94 h LYS 73 Cb -0.09 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 2r94 h LYS 73 CO -0.09 1.04 0.39 0.52 -0.57 0.00 0.00 179.45 180.74 2r94 h MET 74 N 0.39 0.99 -0.43 3.15 2.86 -0.93 0.58 114.93 121.54 2r94 h MET 74 Ca -0.02 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 2r94 h MET 74 Cb 1.26 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.71 2r94 h MET 74 CO 0.13 0.74 0.20 1.49 1.06 0.00 0.00 176.91 180.53 2r94 h GLU 75 N 0.98 0.63 -0.43 1.72 4.81 -1.08 0.17 114.58 121.38 2r94 h GLU 75 Ca 0.25 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 59.28 2r94 h GLU 75 Cb 0.03 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2r94 h GLU 75 CO -0.04 0.56 -0.13 -0.07 -0.73 0.00 0.00 179.01 178.60 2r94 h LEU 76 N 0.56 0.79 -0.83 1.64 3.38 -0.96 -0.57 115.31 119.31 2r94 h LEU 76 Ca 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2r94 h LEU 76 Cb 0.14 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2r94 h LEU 76 CO -0.02 0.93 0.50 0.74 0.09 0.00 0.00 178.44 180.68 2r94 h THR 77 N 0.71 1.23 0.54 0.22 2.02 0.99 -0.64 112.91 117.98 2r94 h THR 77 Ca 0.12 -0.51 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 2r94 h THR 77 Cb 0.62 0.07 0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2r94 h THR 77 CO 0.04 0.24 -0.26 0.44 0.37 0.00 0.00 175.52 176.36 2r94 h ASP 78 N 1.14 -0.61 -0.34 4.18 3.32 -0.39 -2.20 116.42 121.53 2r94 h ASP 78 Ca 0.30 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 2r94 h ASP 78 Cb -0.04 0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2r94 h ASP 78 CO -0.06 -0.30 0.21 0.00 -1.72 0.00 0.00 179.24 177.38 2r94 h ALA 79 N -0.61 1.71 0.06 3.45 0.00 -1.05 -1.77 119.26 121.06 2r94 h ALA 79 Ca -0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2r94 h ALA 79 Cb 0.62 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2r94 h ALA 79 CO 0.12 0.26 -0.03 0.00 0.00 0.00 0.00 179.25 179.60 2r94 h ALA 80 N 1.75 -0.08 0.00 0.00 0.00 -1.11 -2.02 119.26 117.81 2r94 h ALA 80 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2r94 h ALA 80 Cb -0.02 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2r94 h ALA 80 CO -0.02 -0.25 0.00 1.79 0.00 0.00 0.00 179.25 180.76 2r94 h THR 81 N -0.68 0.00 0.00 0.00 1.35 -1.30 -1.02 112.91 111.27 2r94 h THR 81 Ca -0.01 -0.17 -0.23 0.00 -0.55 0.00 0.00 66.41 65.45 2r94 h THR 81 Cb 0.57 0.90 -0.04 0.00 -1.73 0.00 0.00 68.15 67.85 2r94 h THR 81 CO 0.01 0.00 -1.19 0.28 -0.25 0.00 0.00 175.52 174.37 2r94 h SER 82 N 0.00 0.00 -0.01 5.36 0.02 -1.13 -3.37 113.55 114.42 2r94 h SER 82 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2r94 h SER 82 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2r94 h SER 82 CO 0.00 1.00 -0.47 0.00 -1.14 0.00 0.00 176.83 176.22 2r94 n ALA 83 N -2.40 3.49 -3.19 3.77 0.00 -0.59 -4.97 120.51 116.61 2r94 n ALA 83 Ca -0.05 -0.54 -0.13 0.00 0.00 0.00 0.00 53.44 52.72 2r94 n ALA 83 Cb 0.97 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 19.70 2r94 n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r94 s ALA 84 N -2.17 -0.68 -0.21 0.00 0.00 -0.49 -4.49 121.76 113.71 2r94 s ALA 84 Ca 0.13 0.47 0.20 0.00 0.00 0.00 0.00 51.96 52.76 2r94 s ALA 84 Cb 0.14 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 23.09 2r94 s ALA 84 CO 0.50 -0.20 1.08 0.00 0.00 0.00 0.00 175.76 177.14 2r94 h ARG 85 N 4.75 0.00 -4.61 0.00 3.08 -1.86 -3.40 114.38 112.33 2r94 h ARG 85 Ca -0.28 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.14 2r94 h ARG 85 Cb 1.19 0.00 -0.37 0.00 0.08 0.00 0.00 29.97 30.86 2r94 h ARG 85 CO 0.37 0.14 -0.80 1.03 -1.07 0.00 0.00 179.97 179.64 2r94 s ARG 86 N -3.16 2.01 -0.05 0.04 0.52 -1.26 -4.89 118.95 112.16 2r94 s ARG 86 Ca -0.00 -1.03 0.01 0.00 -0.52 0.00 0.00 55.73 54.19 2r94 s ARG 86 Cb 0.09 -2.61 0.02 0.00 0.52 0.00 0.00 34.95 32.97 2r94 s ARG 86 CO 0.78 -0.51 -0.06 0.08 0.02 0.00 0.00 175.30 175.61 2r94 s VAL 87 N 1.31 0.66 -0.10 3.52 1.01 -1.26 -0.47 120.40 125.07 2r94 s VAL 87 Ca -0.05 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.75 2r94 s VAL 87 Cb -0.18 -0.66 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 2r94 s VAL 87 CO -0.07 0.25 -0.12 -0.63 0.00 0.00 0.00 175.10 174.53 2r94 s ILE 88 N 0.84 3.18 -0.16 2.22 1.01 1.00 -0.36 121.20 128.92 2r94 s ILE 88 Ca -0.12 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 2r94 s ILE 88 Cb -0.15 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.99 2r94 s ILE 88 CO 0.01 0.55 -0.05 -0.69 0.00 0.00 0.00 174.94 174.76 2r94 s VAL 89 N -0.10 3.72 -0.15 2.92 1.01 -0.91 -0.47 120.40 126.41 2r94 s VAL 89 Ca -0.01 -0.41 -0.21 0.00 0.00 0.00 0.00 61.98 61.35 2r94 s VAL 89 Cb -0.14 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 2r94 s VAL 89 CO 0.03 0.48 0.60 -1.58 0.00 0.00 0.00 175.10 174.64 2r94 s GLN 90 N 0.54 4.29 0.00 2.72 -0.44 -0.17 -0.98 119.66 125.62 2r94 s GLN 90 Ca -0.04 0.62 0.04 0.00 -2.50 0.00 0.00 55.36 53.48 2r94 s GLN 90 Cb -0.15 -3.52 0.06 0.00 -1.64 0.00 0.00 33.01 27.76 2r94 s GLN 90 CO 0.03 -0.08 0.78 1.33 0.50 0.00 0.00 175.29 177.85 2r94 n VAL 91 N 4.25 0.33 -1.85 1.34 0.24 0.12 -4.75 118.33 118.01 2r94 n VAL 91 Ca -0.03 -0.66 -0.39 0.00 -2.04 0.00 0.00 64.34 61.22 2r94 n VAL 91 Cb 0.51 0.89 0.03 0.00 -1.47 0.00 0.00 33.84 33.79 2r94 n VAL 91 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r94 s ALA 92 N -0.55 2.93 -0.06 2.33 0.00 -1.26 -4.27 121.76 120.89 2r94 s ALA 92 Ca 0.06 1.31 -0.23 0.00 0.00 0.00 0.00 51.96 53.10 2r94 s ALA 92 Cb 0.04 -3.55 0.05 0.00 0.00 0.00 0.00 23.12 19.66 2r94 s ALA 92 CO 0.05 -1.24 0.51 0.45 0.00 0.00 0.00 175.76 175.53 2r94 s SER 93 N -0.91 -0.45 0.00 0.00 0.15 -1.26 -4.77 113.70 106.46 2r94 s SER 93 Ca 0.68 0.51 0.15 0.00 0.70 0.00 0.00 55.95 57.98 2r94 s SER 93 Cb -0.40 0.52 0.71 0.00 -1.71 0.00 0.00 66.02 65.15 2r94 s SER 93 CO 0.48 -0.48 1.48 0.18 1.20 0.00 0.00 173.24 176.10 2r94 n LEU 94 N 1.32 0.63 -4.18 3.45 4.77 -1.26 -3.99 117.00 117.74 2r94 n LEU 94 Ca -0.19 -0.28 -0.38 0.00 -0.03 0.00 0.00 56.01 55.13 2r94 n LEU 94 Cb 0.56 -0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 2r94 n LEU 94 CO 0.21 0.14 -0.16 0.21 -1.33 0.00 0.00 177.39 176.46 2r94 s ASN 95 N -1.40 5.37 0.49 -1.43 3.84 -1.26 -5.00 114.94 115.55 2r94 s ASN 95 Ca 0.23 -1.76 0.22 0.00 0.21 0.00 0.00 52.86 51.76 2r94 s ASN 95 Cb 0.11 -1.88 1.27 0.00 -0.55 0.00 0.00 41.25 40.20 2r94 s ASN 95 CO 0.18 -0.52 1.95 0.00 -2.79 0.00 0.00 177.10 175.91 2r94 h ALA 96 N 8.19 2.40 -0.72 1.71 0.00 -2.01 0.04 119.26 128.88 2r94 h ALA 96 Ca -0.18 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.74 2r94 h ALA 96 Cb 1.06 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 2r94 h ALA 96 CO 0.71 -0.59 0.48 -0.44 0.00 0.00 0.00 179.25 179.41 2r94 h ASP 97 N 0.17 0.81 0.46 0.00 3.32 -1.94 -0.85 116.42 118.38 2r94 h ASP 97 Ca 0.33 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.26 2r94 h ASP 97 Cb 1.07 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 2r94 h ASP 97 CO -0.05 0.58 -0.48 -0.33 -1.72 0.00 0.00 179.24 177.23 2r94 h GLU 98 N 0.95 0.02 -0.32 3.56 5.08 -1.36 -0.63 114.58 121.88 2r94 h GLU 98 Ca 0.27 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.52 2r94 h GLU 98 Cb -0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2r94 h GLU 98 CO -0.07 0.49 -0.21 0.00 -1.00 0.00 0.00 179.01 178.23 2r94 h ALA 99 N 1.50 0.46 -0.29 3.43 0.00 -1.11 -1.33 119.26 121.91 2r94 h ALA 99 Ca -0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 2r94 h ALA 99 Cb 0.85 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2r94 h ALA 99 CO 0.06 0.41 0.05 0.82 0.00 0.00 0.00 179.25 180.59 2r94 h ILE 100 N 0.47 1.23 -0.29 0.00 2.04 -0.89 -0.39 117.51 119.67 2r94 h ILE 100 Ca 0.07 -0.79 0.05 0.00 1.00 0.00 0.00 64.86 65.19 2r94 h ILE 100 Cb 0.75 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 2r94 h ILE 100 CO 0.06 0.26 -0.01 0.00 0.00 0.00 0.00 178.15 178.45 2r94 h ALA 101 N 0.88 0.25 -0.77 1.87 0.00 -1.10 -1.17 119.26 119.22 2r94 h ALA 101 Ca 0.09 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2r94 h ALA 101 Cb 0.34 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2r94 h ALA 101 CO 0.01 -0.42 0.30 1.25 0.00 0.00 0.00 179.25 180.39 2r94 h LEU 102 N 0.07 1.07 0.24 0.00 5.85 -1.07 -0.43 115.31 121.04 2r94 h LEU 102 Ca 0.14 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2r94 h LEU 102 Cb 0.19 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2r94 h LEU 102 CO -0.25 0.95 -0.26 0.00 -0.34 0.00 0.00 178.44 178.55 2r94 h ALA 103 N 1.16 -0.52 -0.87 1.25 0.00 -0.30 0.42 119.26 120.39 2r94 h ALA 103 Ca 0.26 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2r94 h ALA 103 Cb 0.22 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 2r94 h ALA 103 CO -0.02 -0.83 0.57 0.87 0.00 0.00 0.00 179.25 179.84 2r94 h LYS 104 N -0.54 0.96 -0.09 0.00 1.57 -1.07 0.24 116.57 117.65 2r94 h LYS 104 Ca -0.00 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.56 2r94 h LYS 104 Cb 0.51 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2r94 h LYS 104 CO -0.07 0.64 -0.65 -0.92 -0.57 0.00 0.00 179.45 177.88 2r94 h TYR 105 N 0.99 0.44 -0.05 -1.35 3.20 -0.35 -2.06 116.97 117.79 2r94 h TYR 105 Ca 0.37 -0.18 -0.00 0.00 3.14 0.00 0.00 58.73 62.06 2r94 h TYR 105 Cb 0.19 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 2r94 h TYR 105 CO -0.00 0.89 0.02 0.00 -1.64 0.00 0.00 178.16 177.43 2r94 h ALA 106 N 1.06 0.07 -0.48 1.82 0.00 0.19 -2.38 119.26 119.54 2r94 h ALA 106 Ca -0.01 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.90 2r94 h ALA 106 Cb 1.19 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.87 2r94 h ALA 106 CO 0.11 -0.35 -0.15 1.49 0.00 0.00 0.00 179.25 180.35 2r94 h GLU 107 N -0.08 -0.04 0.00 0.00 4.81 -0.47 -1.82 114.58 116.98 2r94 h GLU 107 Ca 0.02 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2r94 h GLU 107 Cb 0.17 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 2r94 h GLU 107 CO -0.00 -0.03 -0.05 0.66 -0.73 0.00 0.00 179.01 178.87 2r94 h SER 108 N -0.04 0.00 -0.40 1.04 4.64 -1.10 0.36 113.55 118.05 2r94 h SER 108 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2r94 h SER 108 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2r94 h SER 108 CO -0.51 0.05 0.00 0.54 -0.87 0.00 0.00 176.83 176.04 2r94 n ARG 109 N -3.39 2.22 -0.63 4.77 5.12 -0.75 -4.94 116.66 119.07 2r94 n ARG 109 Ca -0.02 -1.87 0.00 0.00 -1.93 0.00 0.00 57.85 54.03 2r94 n ARG 109 Cb 0.18 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.03 2r94 n ARG 109 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2r94 n GLY 110 N 1.36 0.62 3.67 -0.13 0.00 0.11 -4.87 105.19 105.96 2r94 n GLY 110 Ca 0.18 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 2r94 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r94 n ALA 111 N -0.12 0.92 0.39 4.61 0.00 -0.79 -4.74 120.51 120.77 2r94 n ALA 111 Ca 0.00 0.22 0.12 0.00 0.00 0.00 0.00 53.44 53.79 2r94 n ALA 111 Cb 0.00 -2.21 0.25 0.00 0.00 0.00 0.00 19.45 17.49 2r94 n ALA 111 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2r94 h GLU 112 N 1.75 0.00 -2.09 0.00 4.11 -1.04 -3.44 114.58 113.87 2r94 h GLU 112 Ca -0.47 0.00 0.17 0.00 0.07 0.00 0.00 59.36 59.13 2r94 h GLU 112 Cb 1.31 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.42 2r94 h GLU 112 CO 0.58 0.00 0.57 0.00 0.07 0.00 0.00 179.01 180.23 2r94 s ALA 113 N -3.17 -1.86 0.18 1.06 0.00 -1.23 -4.10 121.76 112.64 2r94 s ALA 113 Ca 0.08 0.87 0.10 0.00 0.00 0.00 0.00 51.96 53.01 2r94 s ALA 113 Cb 0.09 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.54 2r94 s ALA 113 CO 0.65 -0.79 -0.17 0.14 0.00 0.00 0.00 175.76 175.59 2r94 s VAL 114 N -2.99 2.77 0.12 0.00 -7.23 -0.23 -2.14 120.40 110.69 2r94 s VAL 114 Ca 0.08 -1.80 0.07 0.00 -1.81 0.00 0.00 61.98 58.52 2r94 s VAL 114 Cb -0.01 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 2r94 s VAL 114 CO -0.05 -0.08 -0.17 0.00 -0.31 0.00 0.00 175.10 174.49 2r94 s ALA 115 N -1.61 1.63 -0.00 1.32 0.00 -0.15 0.05 121.76 123.00 2r94 s ALA 115 Ca 0.22 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2r94 s ALA 115 Cb -0.09 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.90 2r94 s ALA 115 CO 0.12 0.20 0.01 0.45 0.00 0.00 0.00 175.76 176.54 2r94 s SER 116 N -2.26 0.01 0.59 0.00 0.15 -0.67 -0.70 113.70 110.83 2r94 s SER 116 Ca 0.08 0.01 -0.19 0.00 0.70 0.00 0.00 55.95 56.55 2r94 s SER 116 Cb -0.07 -0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.18 2r94 s SER 116 CO 0.04 -0.02 1.06 0.18 1.20 0.00 0.00 173.24 175.70 2r94 n LEU 117 N 3.29 4.19 -4.69 3.45 4.77 -1.25 -1.49 117.00 125.28 2r94 n LEU 117 Ca -0.15 0.84 -0.30 0.00 -0.03 0.00 0.00 56.01 56.37 2r94 n LEU 117 Cb 0.58 -1.43 0.15 0.00 -2.33 0.00 0.00 43.42 40.39 2r94 n LEU 117 CO 0.25 -1.57 0.66 -2.84 -1.33 0.00 0.00 177.39 172.56 2r94 s PRO 118 N -2.82 1.09 -0.22 3.23 0.02 -1.25 -4.76 135.00 130.27 2r94 s PRO 118 Ca 0.76 0.98 -0.38 0.00 0.02 0.00 0.00 61.00 62.38 2r94 s PRO 118 Cb -0.42 -1.78 -0.14 0.00 0.02 0.00 0.00 34.50 32.18 2r94 s PRO 118 CO 0.47 -2.40 1.81 -2.30 -0.33 0.00 0.00 177.00 174.24 2r94 n PRO 119 N -4.02 1.48 -3.57 5.54 -0.02 -1.26 -4.94 135.00 128.21 2r94 n PRO 119 Ca 0.07 0.54 -0.24 0.00 -2.02 0.00 0.00 63.50 61.86 2r94 n PRO 119 Cb 0.54 -2.29 0.02 0.00 -0.02 0.00 0.00 33.50 31.75 2r94 n PRO 119 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2r94 n TYR 120 N 5.97 -1.05 0.00 6.00 0.18 -1.26 -4.84 117.16 122.16 2r94 n TYR 120 Ca 0.26 -2.24 0.00 0.00 1.88 0.00 0.00 57.90 57.80 2r94 n TYR 120 Cb 0.18 -0.47 0.00 0.00 -0.38 0.00 0.00 39.34 38.67 2r94 n TYR 120 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 2r94 n TYR 121 N -1.90 0.00 -2.15 -3.48 9.36 -1.21 -4.88 117.16 112.89 2r94 n TYR 121 Ca 0.03 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.82 2r94 n TYR 121 Cb 0.61 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.30 2r94 n TYR 121 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2r94 s PHE 122 N 0.00 2.25 -0.10 2.98 0.08 -1.26 -4.87 117.98 117.06 2r94 s PHE 122 Ca 0.00 0.53 0.29 0.00 0.12 0.00 0.00 56.93 57.86 2r94 s PHE 122 Cb 0.00 -3.84 0.93 0.00 -0.57 0.00 0.00 43.02 39.54 2r94 s PHE 122 CO 0.00 -2.96 1.83 -1.35 -0.10 0.00 0.00 175.22 172.63 2r94 h PRO 123 N 9.64 0.00 -2.33 0.24 0.11 -1.96 -3.39 132.00 134.31 2r94 h PRO 123 Ca -0.34 0.00 -0.80 0.00 0.11 0.00 0.00 66.00 64.97 2r94 h PRO 123 Cb 1.15 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.98 2r94 h PRO 123 CO 0.98 0.03 0.95 0.54 -0.21 0.00 0.00 178.00 180.28 2r94 n ARG 124 N -3.12 5.26 -4.82 1.05 5.12 -1.26 -4.96 116.66 113.94 2r94 n ARG 124 Ca 0.02 -4.66 -0.28 0.00 -1.93 0.00 0.00 57.85 50.99 2r94 n ARG 124 Cb 0.41 -2.47 -0.15 0.00 -1.16 0.00 0.00 32.46 29.09 2r94 n ARG 124 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2r94 s LEU 125 N -4.13 2.16 0.24 0.55 1.43 -1.26 -5.14 118.68 112.53 2r94 s LEU 125 Ca 0.38 -0.55 0.03 0.00 -1.03 0.00 0.00 54.13 52.96 2r94 s LEU 125 Cb 0.18 -1.15 -0.03 0.00 0.03 0.00 0.00 46.19 45.21 2r94 s LEU 125 CO -0.10 0.22 0.38 -0.94 0.23 0.00 0.00 176.35 176.14 2r94 s SER 126 N -1.16 6.33 0.37 2.29 1.04 -1.26 -4.97 113.70 116.34 2r94 s SER 126 Ca 0.10 0.20 0.08 0.00 0.48 0.00 0.00 55.95 56.81 2r94 s SER 126 Cb -0.09 -1.92 0.79 0.00 0.10 0.00 0.00 66.02 64.90 2r94 s SER 126 CO 0.02 -0.08 1.93 -0.33 0.98 0.00 0.00 173.24 175.76 2r94 h GLU 127 N 1.40 0.68 -0.70 4.02 5.08 -2.00 -1.51 114.58 121.56 2r94 h GLU 127 Ca -0.50 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 57.84 2r94 h GLU 127 Cb 1.22 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 2r94 h GLU 127 CO 0.63 0.45 0.44 -0.09 -1.00 0.00 0.00 179.01 179.45 2r94 h ARG 128 N 0.71 0.85 -0.18 2.33 1.12 -1.98 0.20 114.38 117.43 2r94 h ARG 128 Ca 0.35 -0.05 -0.17 0.00 -1.11 0.00 0.00 59.98 59.00 2r94 h ARG 128 Cb 0.43 -0.19 -0.00 0.00 -0.01 0.00 0.00 29.97 30.19 2r94 h ARG 128 CO -0.13 0.56 -0.58 1.96 -3.11 0.00 0.00 179.97 178.67 2r94 h GLN 129 N 0.88 0.57 -0.13 0.20 4.20 -1.69 0.65 115.11 119.78 2r94 h GLN 129 Ca 0.27 -0.38 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 2r94 h GLN 129 Cb -0.01 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 2r94 h GLN 129 CO -0.09 0.99 -0.15 0.82 -0.67 0.00 0.00 178.83 179.73 2r94 h ILE 130 N 0.43 1.36 -0.25 2.54 2.04 -0.99 -2.16 117.51 120.47 2r94 h ILE 130 Ca 0.00 -1.33 0.05 0.00 1.00 0.00 0.00 64.86 64.59 2r94 h ILE 130 Cb 1.14 1.93 -0.05 0.00 -0.74 0.00 0.00 36.82 39.10 2r94 h ILE 130 CO 0.11 0.39 -0.07 0.00 0.00 0.00 0.00 178.15 178.57 2r94 h ALA 131 N 0.59 0.15 -0.76 1.87 0.00 -0.57 -2.30 119.26 118.24 2r94 h ALA 131 Ca 0.02 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.08 2r94 h ALA 131 Cb 0.68 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 2r94 h ALA 131 CO 0.04 -0.48 0.46 -0.22 0.00 0.00 0.00 179.25 179.05 2r94 h LYS 132 N -0.01 0.83 -0.02 0.00 3.64 -0.84 -0.09 116.57 120.07 2r94 h LYS 132 Ca 0.12 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.47 2r94 h LYS 132 Cb 0.20 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2r94 h LYS 132 CO -0.27 0.55 -0.08 -0.92 -2.27 0.00 0.00 179.45 176.46 2r94 h TYR 133 N 0.85 -0.21 -0.44 1.91 3.20 -0.96 0.28 116.97 121.60 2r94 h TYR 133 Ca 0.33 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 62.07 2r94 h TYR 133 Cb 0.14 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 2r94 h TYR 133 CO -0.05 -0.13 -0.26 0.74 -1.64 0.00 0.00 178.16 176.82 2r94 h PHE 134 N -0.13 1.10 -0.85 -3.82 0.04 -1.03 -2.40 116.94 109.84 2r94 h PHE 134 Ca 0.04 -0.28 -0.02 0.00 2.80 0.00 0.00 57.97 60.51 2r94 h PHE 134 Cb 0.19 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 38.05 2r94 h PHE 134 CO -0.16 1.09 0.44 0.00 -0.60 0.00 0.00 178.31 179.08 2r94 h ARG 135 N 0.81 1.21 0.00 1.51 3.08 -0.73 0.42 114.38 120.67 2r94 h ARG 135 Ca 0.10 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 2r94 h ARG 135 Cb 0.84 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 2r94 h ARG 135 CO 0.07 0.91 -0.16 -0.44 -1.07 0.00 0.00 179.97 179.28 2r94 h ASP 136 N 1.20 0.00 -0.07 7.04 3.32 -0.85 0.63 116.42 127.69 2r94 h ASP 136 Ca 0.30 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.28 2r94 h ASP 136 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2r94 h ASP 136 CO -0.04 0.16 -0.22 0.25 -1.72 0.00 0.00 179.24 177.66 2r94 h LEU 137 N 0.00 0.32 -1.02 1.55 5.85 -0.50 -2.67 115.31 118.84 2r94 h LEU 137 Ca -0.00 -0.61 0.03 0.00 0.84 0.00 0.00 57.88 58.13 2r94 h LEU 137 Cb 0.38 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 2r94 h LEU 137 CO 0.02 0.88 0.66 0.00 -0.34 0.00 0.00 178.44 179.66 2r94 h SER 139 N 1.30 0.00 1.53 0.00 0.02 -0.87 -3.02 113.55 112.50 2r94 h SER 139 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 2r94 h SER 139 Cb -0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2r94 h SER 139 CO -0.11 0.17 0.00 0.00 -1.14 0.00 0.00 176.83 175.75 2r94 h ALA 140 N 1.83 1.00 -2.53 3.77 0.00 -0.96 -3.47 119.26 118.91 2r94 h ALA 140 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2r94 h ALA 140 Cb 0.36 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.01 2r94 h ALA 140 CO 0.02 0.00 -0.57 0.14 0.00 0.00 0.00 179.25 178.84 2r94 s VAL 141 N -3.22 0.06 -0.02 0.00 -7.23 -1.14 -4.71 120.40 104.13 2r94 s VAL 141 Ca 0.08 -1.86 0.13 0.00 -1.81 0.00 0.00 61.98 58.52 2r94 s VAL 141 Cb 0.09 -2.19 -0.20 0.00 0.56 0.00 0.00 36.38 34.64 2r94 s VAL 141 CO 0.59 -0.26 0.29 -1.20 -0.31 0.00 0.00 175.10 174.21 2r94 n SER 142 N -0.18 2.04 -4.82 4.85 7.64 -1.26 -4.89 113.62 117.00 2r94 n SER 142 Ca -0.03 -0.01 -0.31 0.00 1.01 0.00 0.00 58.87 59.53 2r94 n SER 142 Cb 0.64 1.58 0.06 0.00 -1.01 0.00 0.00 64.21 65.48 2r94 n SER 142 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2r94 s ILE 143 N -2.89 3.83 0.60 0.44 -4.36 -1.26 -5.00 121.20 112.56 2r94 s ILE 143 Ca -0.05 0.59 -0.18 0.00 -0.26 0.00 0.00 60.65 60.76 2r94 s ILE 143 Cb 0.08 -3.35 -0.03 0.00 1.25 0.00 0.00 42.46 40.41 2r94 s ILE 143 CO 0.54 -0.78 1.17 -2.84 0.24 0.00 0.00 174.94 173.27 2r94 s PRO 144 N -5.08 2.99 -0.24 0.37 0.02 -1.26 -4.82 135.00 126.98 2r94 s PRO 144 Ca 0.59 1.71 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 2r94 s PRO 144 Cb -0.14 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.46 2r94 s PRO 144 CO 0.55 -1.16 -0.07 0.08 -0.33 0.00 0.00 177.00 176.07 2r94 s VAL 145 N -1.77 2.86 0.10 3.83 1.01 -1.26 -1.07 120.40 124.11 2r94 s VAL 145 Ca 0.75 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 61.56 2r94 s VAL 145 Cb -0.27 -2.42 -0.07 0.00 0.00 0.00 0.00 36.38 33.61 2r94 s VAL 145 CO 0.33 0.24 0.61 -0.36 0.00 0.00 0.00 175.10 175.92 2r94 s PHE 146 N 1.33 3.80 0.08 5.22 0.40 0.11 -1.59 117.98 127.33 2r94 s PHE 146 Ca 0.01 1.32 -0.30 0.00 -0.60 0.00 0.00 56.93 57.35 2r94 s PHE 146 Cb -0.16 -2.53 -0.05 0.00 0.51 0.00 0.00 43.02 40.78 2r94 s PHE 146 CO -0.05 0.55 1.09 -1.17 0.70 0.00 0.00 175.22 176.35 2r94 s LEU 147 N -1.24 4.41 -0.52 -0.37 2.96 -0.59 -1.67 118.68 121.66 2r94 s LEU 147 Ca 0.32 1.92 -0.04 0.00 -0.22 0.00 0.00 54.13 56.10 2r94 s LEU 147 Cb -0.19 -3.58 0.14 0.00 0.50 0.00 0.00 46.19 43.05 2r94 s LEU 147 CO 0.20 -0.32 0.34 -0.47 -1.32 0.00 0.00 176.35 174.79 2r94 s TYR 148 N 0.64 3.50 -0.01 5.38 5.04 -0.56 -0.21 117.35 131.13 2r94 s TYR 148 Ca 0.54 -2.46 -0.22 0.00 -2.44 0.00 0.00 57.07 52.48 2r94 s TYR 148 Cb -0.27 -3.27 -0.05 0.00 0.35 0.00 0.00 41.96 38.73 2r94 s TYR 148 CO 0.30 -0.92 0.67 1.21 -1.34 0.00 0.00 175.55 175.47 2r94 s ASN 149 N 1.46 7.03 -0.50 4.32 3.04 0.13 -3.76 114.94 126.66 2r94 s ASN 149 Ca 0.12 1.23 0.07 0.00 0.04 0.00 0.00 52.86 54.32 2r94 s ASN 149 Cb -0.22 -2.40 0.21 0.00 -1.54 0.00 0.00 41.25 37.30 2r94 s ASN 149 CO -0.04 0.01 0.79 0.00 -3.04 0.00 0.00 177.10 174.83 2r94 n TYR 150 N 3.08 -3.52 -0.36 0.43 -0.00 -1.26 -0.82 117.16 114.71 2r94 n TYR 150 Ca -0.04 -1.61 0.04 0.00 -0.00 0.00 0.00 57.90 56.29 2r94 n TYR 150 Cb 0.51 1.47 0.19 0.00 -0.00 0.00 0.00 39.34 41.51 2r94 n TYR 150 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.86 175.51 2r94 h PRO 151 N 4.55 1.05 -0.19 2.98 0.11 -1.75 0.20 132.00 138.95 2r94 h PRO 151 Ca -0.03 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.95 2r94 h PRO 151 Cb 1.07 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 2r94 h PRO 151 CO 0.17 0.69 -0.18 0.00 -0.21 0.00 0.00 178.00 178.48 2r94 h ALA 152 N 1.48 1.35 0.15 -0.75 0.00 -1.88 0.99 119.26 120.60 2r94 h ALA 152 Ca 0.45 -0.26 -0.35 0.00 0.00 0.00 0.00 54.91 54.74 2r94 h ALA 152 Cb 0.28 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2r94 h ALA 152 CO -0.21 0.44 -1.84 0.00 0.00 0.00 0.00 179.25 177.64 2r94 h ALA 153 N 1.52 0.30 0.00 0.00 0.00 -1.80 -3.40 119.26 115.88 2r94 h ALA 153 Ca 0.05 -1.26 -0.18 0.00 0.00 0.00 0.00 54.91 53.53 2r94 h ALA 153 Cb 0.49 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2r94 h ALA 153 CO 0.03 1.17 -0.92 0.28 0.00 0.00 0.00 179.25 179.81 2r94 h VAL 154 N 0.09 1.22 0.00 0.00 2.07 -0.43 -3.44 116.25 115.76 2r94 h VAL 154 Ca -0.37 -2.80 0.00 0.00 0.82 0.00 0.00 66.70 64.35 2r94 h VAL 154 Cb 2.07 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 34.42 2r94 h VAL 154 CO 0.14 0.70 0.00 0.61 0.02 0.00 0.00 177.57 179.04 2r94 n GLY 155 N 1.33 0.75 3.59 2.17 0.00 0.33 -3.35 105.19 110.00 2r94 n GLY 155 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 2r94 n GLY 155 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2r94 s ARG 156 N -0.49 0.89 -0.11 1.61 3.52 -1.23 -5.04 118.95 118.09 2r94 s ARG 156 Ca 0.00 0.80 0.01 0.00 -0.13 0.00 0.00 55.73 56.41 2r94 s ARG 156 Cb 0.00 0.43 -0.02 0.00 -1.56 0.00 0.00 34.95 33.80 2r94 s ARG 156 CO 0.00 -0.16 -0.14 0.34 -0.81 0.00 0.00 175.30 174.53 2r94 s ASP 157 N -0.03 3.95 -0.59 -2.12 2.15 -1.26 -4.09 116.67 114.67 2r94 s ASP 157 Ca -0.03 -0.31 -0.07 0.00 0.43 0.00 0.00 52.55 52.58 2r94 s ASP 157 Cb -0.04 -1.39 0.15 0.00 -0.30 0.00 0.00 42.92 41.34 2r94 s ASP 157 CO 0.03 0.21 0.45 -0.69 -0.17 0.00 0.00 175.17 175.00 2r94 s VAL 158 N 0.07 4.14 0.62 1.11 1.01 -1.26 -5.07 120.40 121.01 2r94 s VAL 158 Ca -0.06 -2.46 -0.10 0.00 0.00 0.00 0.00 61.98 59.36 2r94 s VAL 158 Cb -0.15 -3.68 0.14 0.00 0.00 0.00 0.00 36.38 32.69 2r94 s VAL 158 CO 0.05 -0.86 0.80 -0.90 0.00 0.00 0.00 175.10 174.19 2r94 n ASP 159 N 4.08 -0.12 -0.17 3.32 5.68 -1.26 -4.57 116.55 123.51 2r94 n ASP 159 Ca 0.03 -1.25 -0.05 0.00 -0.50 0.00 0.00 54.79 53.02 2r94 n ASP 159 Cb 0.41 -0.62 0.14 0.00 -1.14 0.00 0.00 41.12 39.90 2r94 n ASP 159 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2r94 h ALA 160 N -1.93 1.11 -0.26 2.12 0.00 -1.87 0.34 119.26 118.76 2r94 h ALA 160 Ca -0.26 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2r94 h ALA 160 Cb 0.73 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2r94 h ALA 160 CO 0.18 0.59 -0.03 -0.09 0.00 0.00 0.00 179.25 179.90 2r94 h ARG 161 N 0.89 0.48 -0.66 0.00 2.43 -1.91 -0.44 114.38 115.17 2r94 h ARG 161 Ca 0.19 -0.17 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 2r94 h ARG 161 Cb 0.34 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 2r94 h ARG 161 CO 0.00 0.68 0.11 0.00 -1.51 0.00 0.00 179.97 179.25 2r94 h ALA 162 N 0.79 0.94 -0.76 2.80 0.00 -1.78 -1.38 119.26 119.87 2r94 h ALA 162 Ca 0.07 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2r94 h ALA 162 Cb 0.48 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2r94 h ALA 162 CO 0.02 0.66 0.26 0.00 0.00 0.00 0.00 179.25 180.19 2r94 h ALA 163 N 1.09 1.03 -0.59 0.00 0.00 -0.05 -2.77 119.26 117.96 2r94 h ALA 163 Ca 0.20 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2r94 h ALA 163 Cb 0.43 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2r94 h ALA 163 CO 0.01 0.66 0.04 -0.22 0.00 0.00 0.00 179.25 179.75 2r94 h LYS 164 N 1.12 1.02 -0.45 0.00 3.64 -0.70 -2.84 116.57 118.36 2r94 h LYS 164 Ca 0.25 -0.30 0.13 0.00 -1.27 0.00 0.00 60.65 59.45 2r94 h LYS 164 Cb 0.28 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 2r94 h LYS 164 CO -0.01 0.99 0.38 1.49 -2.27 0.00 0.00 179.45 180.02 2r94 h GLU 165 N 0.92 0.00 0.00 1.90 4.57 -1.04 -1.21 114.58 119.71 2r94 h GLU 165 Ca 0.17 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 2r94 h GLU 165 Cb 0.50 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 2r94 h GLU 165 CO 0.02 0.00 -0.35 -0.07 -1.18 0.00 0.00 179.01 177.43 2r94 h LEU 166 N 0.00 0.00 0.00 1.64 3.38 -1.23 -3.47 115.31 115.63 2r94 h LEU 166 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2r94 h LEU 166 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2r94 h LEU 166 CO -0.00 0.35 0.00 0.61 0.09 0.00 0.00 178.44 179.49 2r94 n GLY 167 N 0.19 0.85 0.00 0.83 0.00 -0.46 -4.81 105.19 101.80 2r94 n GLY 167 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2r94 n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r94 s ILE 169 N 0.00 4.21 -1.52 0.00 -1.09 -1.26 -4.62 121.20 116.91 2r94 s ILE 169 Ca 0.00 1.53 0.15 0.00 -2.23 0.00 0.00 60.65 60.10 2r94 s ILE 169 Cb 0.00 -3.98 0.31 0.00 -1.58 0.00 0.00 42.46 37.20 2r94 s ILE 169 CO 0.00 -0.02 1.21 0.54 -1.23 0.00 0.00 174.94 175.44 2r94 n ARG 170 N 5.42 2.17 -3.60 2.79 1.74 -0.62 -4.85 116.66 119.72 2r94 n ARG 170 Ca 0.12 -1.93 -0.04 0.00 -0.77 0.00 0.00 57.85 55.22 2r94 n ARG 170 Cb 0.46 -1.34 -0.02 0.00 -1.02 0.00 0.00 32.46 30.54 2r94 n ARG 170 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2r94 s GLY 171 N -1.11 -0.35 -0.11 -0.13 0.00 -1.24 -2.49 107.32 101.89 2r94 s GLY 171 Ca 0.27 1.05 -0.06 0.00 0.00 0.00 0.00 44.72 45.97 2r94 s GLY 171 CO 0.21 0.32 0.27 0.14 0.00 0.00 0.00 173.10 174.03 2r94 s VAL 172 N -2.69 -0.03 -0.19 1.40 1.01 0.42 -1.54 120.40 118.78 2r94 s VAL 172 Ca 0.10 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 62.17 2r94 s VAL 172 Cb 0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 2r94 s VAL 172 CO -0.04 0.05 -0.07 -0.75 0.00 0.00 0.00 175.10 174.28 2r94 s LYS 173 N 1.09 3.37 -0.30 2.72 2.20 0.70 -1.13 119.74 128.40 2r94 s LYS 173 Ca -0.08 -0.65 0.03 0.00 -0.36 0.00 0.00 55.97 54.92 2r94 s LYS 173 Cb -0.09 -2.88 0.07 0.00 -1.51 0.00 0.00 37.83 33.43 2r94 s LYS 173 CO -0.08 -0.07 -0.03 0.34 -0.36 0.00 0.00 175.35 175.15 2r94 s ASP 174 N 1.12 4.62 -0.74 1.43 2.15 -0.62 0.21 116.67 124.85 2r94 s ASP 174 Ca 0.01 -1.68 -0.23 0.00 0.43 0.00 0.00 52.55 51.09 2r94 s ASP 174 Cb -0.15 -1.60 0.07 0.00 -0.30 0.00 0.00 42.92 40.95 2r94 s ASP 174 CO -0.01 -0.27 1.07 -0.89 -0.17 0.00 0.00 175.17 174.89 2r94 s THR 175 N 1.04 4.27 -0.29 1.71 2.01 -0.00 0.14 115.64 124.52 2r94 s THR 175 Ca -0.01 -0.48 -0.14 0.00 0.31 0.00 0.00 61.69 61.37 2r94 s THR 175 Cb -0.20 -4.76 0.10 0.00 0.01 0.00 0.00 72.50 67.65 2r94 s THR 175 CO -0.06 -1.56 0.70 0.21 -0.69 0.00 0.00 174.62 173.22 2r94 s ASN 176 N 3.78 -0.98 0.25 3.53 3.84 -1.26 -4.31 114.94 119.79 2r94 s ASN 176 Ca 0.27 1.49 0.22 0.00 0.21 0.00 0.00 52.86 55.05 2r94 s ASN 176 Cb -0.12 1.65 0.98 0.00 -0.55 0.00 0.00 41.25 43.21 2r94 s ASN 176 CO 0.06 -0.23 1.66 -0.62 -2.79 0.00 0.00 177.10 175.19 2r94 n GLU 177 N 4.62 0.16 -2.95 0.43 -0.58 -1.26 -4.40 120.64 116.67 2r94 n GLU 177 Ca -0.17 0.47 -0.44 0.00 -0.42 0.00 0.00 57.16 56.60 2r94 n GLU 177 Cb 0.56 -1.86 -0.04 0.00 -0.57 0.00 0.00 31.44 29.53 2r94 n GLU 177 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2r94 s SER 178 N -4.08 6.22 0.53 1.62 0.15 -1.26 -4.86 113.70 112.02 2r94 s SER 178 Ca 0.02 -1.23 0.21 0.00 0.70 0.00 0.00 55.95 55.65 2r94 s SER 178 Cb 0.08 -2.38 1.34 0.00 -1.71 0.00 0.00 66.02 63.35 2r94 s SER 178 CO 0.32 -1.30 2.07 0.25 1.20 0.00 0.00 173.24 175.77 2r94 h LEU 179 N 10.82 0.00 -0.41 3.45 5.85 -2.01 -1.88 115.31 131.13 2r94 h LEU 179 Ca -0.25 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.36 2r94 h LEU 179 Cb 1.07 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 2r94 h LEU 179 CO 1.15 0.00 -0.18 0.00 -0.34 0.00 0.00 178.44 179.07 2r94 h ALA 180 N 1.85 0.57 -0.59 1.25 0.00 -1.95 -0.78 119.26 119.61 2r94 h ALA 180 Ca 0.14 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.77 2r94 h ALA 180 Cb 0.56 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 2r94 h ALA 180 CO -0.00 0.52 0.22 1.25 0.00 0.00 0.00 179.25 181.24 2r94 h HIS 181 N 0.66 0.38 -0.27 0.00 -0.00 -1.76 0.77 115.15 114.93 2r94 h HIS 181 Ca 0.09 0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.40 2r94 h HIS 181 Cb 0.74 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 28.06 2r94 h HIS 181 CO 0.06 0.10 -0.18 1.15 -0.00 0.00 0.00 177.93 179.05 2r94 h THR 182 N 0.40 1.30 -0.23 6.26 2.02 -1.16 -2.04 112.91 119.46 2r94 h THR 182 Ca 0.30 -1.31 0.05 0.00 0.77 0.00 0.00 66.41 66.21 2r94 h THR 182 Cb 0.36 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 2r94 h THR 182 CO -0.30 0.41 0.16 -0.07 0.37 0.00 0.00 175.52 176.10 2r94 h LEU 183 N 0.34 0.10 -2.08 2.58 3.38 -0.81 -2.12 115.31 116.71 2r94 h LEU 183 Ca 0.05 -0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.10 2r94 h LEU 183 Cb 0.72 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2r94 h LEU 183 CO 0.05 0.07 0.21 0.00 0.09 0.00 0.00 178.44 178.86 2r94 h ALA 184 N 1.88 2.13 0.00 1.53 0.00 -0.08 -0.25 119.26 124.46 2r94 h ALA 184 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2r94 h ALA 184 Cb 0.28 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2r94 h ALA 184 CO -0.01 -0.35 -0.42 1.88 0.00 0.00 0.00 179.25 180.35 2r94 h TYR 185 N 0.00 0.00 -0.01 0.00 0.05 -1.45 -1.13 116.97 114.43 2r94 h TYR 185 Ca 0.13 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.74 2r94 h TYR 185 Cb 0.55 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.28 2r94 h TYR 185 CO 0.00 0.42 -0.77 0.87 -1.05 0.00 0.00 178.16 177.63 2r94 h LYS 186 N 0.00 0.11 -0.10 4.88 1.57 -1.17 0.21 116.57 122.06 2r94 h LYS 186 Ca -0.00 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 2r94 h LYS 186 Cb 1.02 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.35 2r94 h LYS 186 CO 0.05 0.82 -0.06 -0.09 -0.57 0.00 0.00 179.45 179.61 2r94 h ARG 187 N 0.06 0.23 0.00 3.15 2.43 -1.33 -2.80 114.38 116.12 2r94 h ARG 187 Ca -0.02 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 58.93 2r94 h ARG 187 Cb 1.35 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.88 2r94 h ARG 187 CO 0.11 0.59 -0.65 1.88 -1.51 0.00 0.00 179.97 180.39 2r94 h TYR 188 N -0.14 0.00 -2.42 2.20 -1.99 -1.22 -3.39 116.97 110.02 2r94 h TYR 188 Ca 0.02 0.00 -0.59 0.00 2.00 0.00 0.00 58.73 60.16 2r94 h TYR 188 Cb 0.53 0.00 -0.39 0.00 2.00 0.00 0.00 36.73 38.87 2r94 h TYR 188 CO 0.07 0.50 -0.91 1.28 -0.00 0.00 0.00 178.16 179.10 2r94 n LEU 189 N -3.16 0.46 0.29 3.88 4.77 0.74 -4.87 117.00 119.11 2r94 n LEU 189 Ca 0.00 -4.63 0.15 0.00 -0.03 0.00 0.00 56.01 51.50 2r94 n LEU 189 Cb 0.75 0.27 0.86 0.00 -2.33 0.00 0.00 43.42 42.97 2r94 n LEU 189 CO 0.41 1.89 1.06 -0.65 -1.33 0.00 0.00 177.39 178.77 2r94 h PRO 190 N 5.22 0.00 0.00 3.23 0.11 -1.69 -2.06 132.00 136.81 2r94 h PRO 190 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 2r94 h PRO 190 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2r94 h PRO 190 CO 0.47 0.06 -0.86 1.04 -0.21 0.00 0.00 178.00 178.50 2r94 n GLN 191 N -3.64 0.13 -2.31 1.05 1.13 -1.26 -4.94 117.38 107.54 2r94 n GLN 191 Ca -0.02 -0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.66 2r94 n GLN 191 Cb 0.16 -1.54 -0.02 0.00 0.11 0.00 0.00 30.24 28.95 2r94 n GLN 191 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2r94 s ALA 192 N -3.09 3.05 -0.15 -1.58 0.00 -0.78 -4.98 121.76 114.23 2r94 s ALA 192 Ca 0.07 0.91 -0.29 0.00 0.00 0.00 0.00 51.96 52.65 2r94 s ALA 192 Cb 0.16 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 2r94 s ALA 192 CO 0.79 -0.56 1.21 1.03 0.00 0.00 0.00 175.76 178.23 2r94 s ARG 193 N -2.54 4.26 -0.13 0.00 0.52 -1.04 -4.92 118.95 115.11 2r94 s ARG 193 Ca 0.61 1.61 0.03 0.00 -0.52 0.00 0.00 55.73 57.45 2r94 s ARG 193 Cb -0.28 -3.70 0.00 0.00 0.52 0.00 0.00 34.95 31.49 2r94 s ARG 193 CO 0.35 -0.64 -0.21 0.08 0.02 0.00 0.00 175.30 174.90 2r94 s VAL 194 N 3.18 2.18 0.03 3.52 1.01 -1.26 -0.44 120.40 128.62 2r94 s VAL 194 Ca 0.53 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.63 2r94 s VAL 194 Cb -0.21 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 2r94 s VAL 194 CO 0.15 0.55 -0.21 -0.31 0.00 0.00 0.00 175.10 175.27 2r94 s TYR 195 N 0.63 1.86 -0.14 5.22 2.02 -0.28 -0.88 117.35 125.78 2r94 s TYR 195 Ca -0.11 -0.37 -0.11 0.00 -0.37 0.00 0.00 57.07 56.11 2r94 s TYR 195 Cb -0.16 -1.13 -0.05 0.00 -0.40 0.00 0.00 41.96 40.22 2r94 s TYR 195 CO 0.02 0.06 0.20 1.21 -1.57 0.00 0.00 175.55 175.48 2r94 s ASN 196 N -0.99 6.39 -0.04 2.29 3.84 -1.01 -1.58 114.94 123.83 2r94 s ASN 196 Ca 0.08 0.45 0.12 0.00 0.21 0.00 0.00 52.86 53.72 2r94 s ASN 196 Cb -0.09 -2.12 0.42 0.00 -0.55 0.00 0.00 41.25 38.91 2r94 s ASN 196 CO 0.01 0.25 1.30 0.61 -2.79 0.00 0.00 177.10 176.48 2r94 n GLY 197 N 2.83 1.48 3.61 1.21 0.00 0.12 -1.26 105.19 113.18 2r94 n GLY 197 Ca -0.16 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 2r94 n GLY 197 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2r94 s SER 198 N -0.83 5.41 0.42 1.61 0.15 -1.26 -4.67 113.70 114.53 2r94 s SER 198 Ca 0.30 0.04 0.14 0.00 0.70 0.00 0.00 55.95 57.14 2r94 s SER 198 Cb 0.18 -1.89 0.91 0.00 -1.71 0.00 0.00 66.02 63.51 2r94 s SER 198 CO 0.17 0.19 1.93 0.44 1.20 0.00 0.00 173.24 177.17 2r94 h ASP 199 N 6.58 0.00 0.44 5.45 3.32 -1.91 -2.02 116.42 128.27 2r94 h ASP 199 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 2r94 h ASP 199 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2r94 h ASP 199 CO 0.68 0.25 0.00 -1.54 -1.72 0.00 0.00 179.24 176.91 2r94 n SER 200 N -4.20 0.00 -0.24 6.45 3.41 -1.26 -3.47 113.62 114.31 2r94 n SER 200 Ca -0.02 -0.20 0.10 0.00 -0.26 0.00 0.00 58.87 58.48 2r94 n SER 200 Cb 0.31 -0.25 0.16 0.00 -0.26 0.00 0.00 64.21 64.18 2r94 n SER 200 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r94 n LEU 201 N -1.25 2.66 0.34 1.04 4.77 -0.76 -4.77 117.00 119.03 2r94 n LEU 201 Ca 0.14 -3.09 -0.17 0.00 -0.03 0.00 0.00 56.01 52.86 2r94 n LEU 201 Cb 0.20 -0.45 -0.09 0.00 -2.33 0.00 0.00 43.42 40.75 2r94 n LEU 201 CO 0.20 0.71 0.59 0.58 -1.33 0.00 0.00 177.39 178.14 2r94 h VAL 202 N 0.37 0.34 -0.42 4.08 2.07 -1.61 0.25 116.25 121.32 2r94 h VAL 202 Ca 0.00 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.45 2r94 h VAL 202 Cb 1.09 0.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.16 2r94 h VAL 202 CO 0.04 0.02 -0.33 0.15 0.02 0.00 0.00 177.57 177.48 2r94 h PHE 203 N -0.94 -0.91 -0.94 1.57 3.57 -1.87 -1.81 116.94 115.61 2r94 h PHE 203 Ca -0.09 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.54 2r94 h PHE 203 Cb 0.68 0.46 -0.06 0.00 2.79 0.00 0.00 35.95 39.82 2r94 h PHE 203 CO -0.01 -0.38 0.61 0.00 -2.23 0.00 0.00 178.31 176.29 2r94 h ALA 204 N 0.78 1.48 -0.38 2.41 0.00 -1.83 -1.74 119.26 119.99 2r94 h ALA 204 Ca 0.18 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 2r94 h ALA 204 Cb 0.54 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2r94 h ALA 204 CO -0.56 0.38 -0.35 0.77 0.00 0.00 0.00 179.25 179.49 2r94 h SER 205 N 1.07 0.91 -0.64 0.00 0.02 0.28 -1.04 113.55 114.16 2r94 h SER 205 Ca 0.41 -0.40 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 2r94 h SER 205 Cb 0.20 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 2r94 h SER 205 CO -0.16 1.17 0.10 -0.26 -1.14 0.00 0.00 176.83 176.54 2r94 h PHE 206 N 0.72 1.14 -0.38 3.45 0.04 -1.09 -1.40 116.94 119.42 2r94 h PHE 206 Ca 0.07 -0.16 -0.05 0.00 2.80 0.00 0.00 57.97 60.63 2r94 h PHE 206 Cb 0.92 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.74 2r94 h PHE 206 CO 0.05 0.97 0.03 0.00 -0.60 0.00 0.00 178.31 178.76 2r94 h ALA 207 N 1.04 1.34 -0.06 2.45 0.00 -0.84 -1.15 119.26 122.04 2r94 h ALA 207 Ca 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2r94 h ALA 207 Cb 0.44 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2r94 h ALA 207 CO 0.01 0.46 0.00 1.33 0.00 0.00 0.00 179.25 181.05 2r94 n VAL 208 N -4.28 0.05 -3.32 0.00 0.24 -0.44 -4.97 118.33 105.62 2r94 n VAL 208 Ca 0.02 -0.38 -0.17 0.00 -2.04 0.00 0.00 64.34 61.77 2r94 n VAL 208 Cb 0.24 0.89 0.08 0.00 -1.47 0.00 0.00 33.84 33.57 2r94 n VAL 208 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2r94 n ARG 209 N 0.70 -6.17 -0.57 7.34 1.74 -0.43 -5.02 116.66 114.25 2r94 n ARG 209 Ca 0.17 0.73 -0.28 0.00 -0.77 0.00 0.00 57.85 57.70 2r94 n ARG 209 Cb 0.46 -5.43 0.26 0.00 -1.02 0.00 0.00 32.46 26.72 2r94 n ARG 209 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2r94 s LEU 210 N -6.03 0.65 0.18 0.55 1.43 -0.60 -4.90 118.68 109.96 2r94 s LEU 210 Ca 0.18 1.42 0.23 0.00 -1.03 0.00 0.00 54.13 54.93 2r94 s LEU 210 Cb -0.08 -3.29 0.90 0.00 0.03 0.00 0.00 46.19 43.75 2r94 s LEU 210 CO 0.63 -4.28 1.69 0.47 0.23 0.00 0.00 176.35 175.09 2r94 n ASP 211 N -4.97 0.52 0.00 2.29 8.00 -0.06 -4.86 116.55 117.48 2r94 n ASP 211 Ca 0.03 0.60 0.00 0.00 0.71 0.00 0.00 54.79 56.13 2r94 n ASP 211 Cb 0.55 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 2r94 n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r94 n GLY 212 N 0.36 -1.20 3.22 0.44 0.00 -1.23 -1.06 105.19 105.72 2r94 n GLY 212 Ca 0.03 -1.27 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 2r94 n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2r94 s VAL 213 N -2.94 1.56 -0.39 1.61 -7.23 -0.76 -2.41 120.40 109.84 2r94 s VAL 213 Ca 0.00 -1.04 -0.03 0.00 -1.81 0.00 0.00 61.98 59.10 2r94 s VAL 213 Cb 0.00 -1.34 0.10 0.00 0.56 0.00 0.00 36.38 35.70 2r94 s VAL 213 CO 0.00 0.26 0.17 -0.69 -0.31 0.00 0.00 175.10 174.54 2r94 s VAL 214 N -0.68 3.30 -0.12 1.32 1.01 -0.39 -0.56 120.40 124.28 2r94 s VAL 214 Ca 0.07 -1.90 0.02 0.00 0.00 0.00 0.00 61.98 60.17 2r94 s VAL 214 Cb -0.08 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.12 2r94 s VAL 214 CO 0.01 -0.58 -0.20 0.00 0.00 0.00 0.00 175.10 174.33 2r94 s ALA 215 N 1.18 2.00 0.47 5.51 0.00 -1.03 -4.13 121.76 125.75 2r94 s ALA 215 Ca 0.06 -0.92 0.24 0.00 0.00 0.00 0.00 51.96 51.34 2r94 s ALA 215 Cb -0.22 -0.89 1.26 0.00 0.00 0.00 0.00 23.12 23.28 2r94 s ALA 215 CO -0.03 0.02 1.85 0.66 0.00 0.00 0.00 175.76 178.25 2r94 h SER 216 N 7.23 0.24 0.67 0.00 4.64 -1.87 0.25 113.55 124.71 2r94 h SER 216 Ca -0.30 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2r94 h SER 216 Cb 1.19 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2r94 h SER 216 CO 0.51 0.08 0.00 -1.54 -0.87 0.00 0.00 176.83 175.01 2r94 n SER 217 N -4.42 0.18 0.27 4.97 3.41 -1.26 -1.64 113.62 115.13 2r94 n SER 217 Ca 0.21 0.54 0.19 0.00 -0.26 0.00 0.00 58.87 59.54 2r94 n SER 217 Cb 0.87 -0.58 0.96 0.00 -0.26 0.00 0.00 64.21 65.20 2r94 n SER 217 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r94 h ALA 218 N 2.53 1.00 -0.16 7.33 0.00 -0.77 0.35 119.26 129.54 2r94 h ALA 218 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2r94 h ALA 218 Cb 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2r94 h ALA 218 CO 0.00 0.00 -0.45 -0.91 0.00 0.00 0.00 179.25 177.89 2r94 h ASN 219 N 0.00 0.43 0.00 0.00 2.35 -1.50 -3.33 115.58 113.53 2r94 h ASN 219 Ca 0.00 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2r94 h ASN 219 Cb 0.07 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2r94 h ASN 219 CO 0.00 0.82 -0.97 0.00 -1.65 0.00 0.00 177.43 175.63 2r94 n TYR 220 N -4.00 0.00 -3.00 1.19 0.18 -0.66 -4.79 117.16 106.09 2r94 n TYR 220 Ca -0.02 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.61 2r94 n TYR 220 Cb 0.52 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.47 2r94 n TYR 220 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2r94 n LEU 221 N -1.59 1.19 0.25 -3.48 4.77 0.12 -4.41 117.00 113.85 2r94 n LEU 221 Ca 0.00 -4.60 0.09 0.00 -0.03 0.00 0.00 56.01 51.47 2r94 n LEU 221 Cb 0.14 0.57 0.65 0.00 -2.33 0.00 0.00 43.42 42.45 2r94 n LEU 221 CO 0.00 2.05 1.08 1.55 -1.33 0.00 0.00 177.39 180.73 2r94 h PRO 222 N 2.99 0.00 0.00 3.23 0.13 -1.67 -1.87 132.00 134.81 2r94 h PRO 222 Ca 0.04 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.03 2r94 h PRO 222 Cb 1.03 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 2r94 h PRO 222 CO 0.51 0.00 -0.65 1.05 -0.23 0.00 0.00 178.00 178.68 2r94 h GLU 223 N 0.00 0.00 -0.02 0.86 9.09 -1.91 0.10 114.58 122.69 2r94 h GLU 223 Ca 0.01 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.42 2r94 h GLU 223 Cb 0.03 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.13 2r94 h GLU 223 CO -0.00 0.65 0.01 1.25 0.05 0.00 0.00 179.01 180.97 2r94 h LEU 224 N 0.00 0.03 -0.60 3.06 6.46 -1.72 0.11 115.31 122.64 2r94 h LEU 224 Ca -0.01 -0.13 0.06 0.00 -0.12 0.00 0.00 57.88 57.68 2r94 h LEU 224 Cb 1.34 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 41.21 2r94 h LEU 224 CO 0.08 0.15 0.32 -0.07 -0.62 0.00 0.00 178.44 178.31 2r94 h LEU 225 N -0.09 0.46 -0.90 2.25 3.38 -1.18 -0.29 115.31 118.93 2r94 h LEU 225 Ca 0.01 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2r94 h LEU 225 Cb 0.13 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2r94 h LEU 225 CO -0.00 0.30 0.43 0.00 0.09 0.00 0.00 178.44 179.26 2r94 h ALA 226 N 1.32 1.15 -0.85 1.53 0.00 -0.88 -0.76 119.26 120.77 2r94 h ALA 226 Ca 0.27 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.08 2r94 h ALA 226 Cb 0.18 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 2r94 h ALA 226 CO -0.18 0.66 0.56 0.78 0.00 0.00 0.00 179.25 181.06 2r94 h GLY 227 N 1.22 1.22 1.22 0.00 0.00 -0.13 0.25 103.07 106.85 2r94 h GLY 227 Ca 0.30 -0.40 -0.17 0.00 0.00 0.00 0.00 47.33 47.05 2r94 h GLY 227 CO -0.04 0.32 -0.50 -2.22 0.00 0.00 0.00 176.54 174.10 2r94 h ILE 228 N 1.01 1.28 -0.21 2.60 2.04 -0.27 -0.88 117.51 123.08 2r94 h ILE 228 Ca 0.35 -1.69 -0.05 0.00 1.00 0.00 0.00 64.86 64.47 2r94 h ILE 228 Cb 0.12 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 2r94 h ILE 228 CO -0.12 0.55 -0.05 -0.09 0.00 0.00 0.00 178.15 178.45 2r94 h ARG 229 N 0.65 0.40 -0.35 2.37 2.43 -0.32 -0.67 114.38 118.88 2r94 h ARG 229 Ca 0.03 -0.15 0.05 0.00 -0.81 0.00 0.00 59.98 59.10 2r94 h ARG 229 Cb 1.09 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.57 2r94 h ARG 229 CO 0.11 0.64 0.08 -0.44 -1.51 0.00 0.00 179.97 178.85 2r94 h ASP 230 N 0.12 0.03 -0.41 -3.80 3.32 -0.45 -1.31 116.42 113.92 2r94 h ASP 230 Ca 0.05 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.17 2r94 h ASP 230 Cb 0.50 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 2r94 h ASP 230 CO 0.02 0.05 0.25 0.00 -1.72 0.00 0.00 179.24 177.84 2r94 h ALA 231 N 1.26 0.52 -0.59 3.45 0.00 -0.93 0.49 119.26 123.47 2r94 h ALA 231 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2r94 h ALA 231 Cb 0.18 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2r94 h ALA 231 CO -0.21 -0.07 0.32 0.28 0.00 0.00 0.00 179.25 179.57 2r94 h VAL 232 N 0.51 1.19 -0.36 0.00 2.07 -0.69 0.32 116.25 119.30 2r94 h VAL 232 Ca 0.16 -0.50 -0.09 0.00 0.82 0.00 0.00 66.70 67.09 2r94 h VAL 232 Cb -0.02 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 2r94 h VAL 232 CO -0.06 0.21 -0.15 0.00 0.02 0.00 0.00 177.57 177.59 2r94 h ALA 233 N 1.15 1.06 0.00 1.67 0.00 -0.44 -1.46 119.26 121.24 2r94 h ALA 233 Ca 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2r94 h ALA 233 Cb 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2r94 h ALA 233 CO -0.03 0.57 0.00 0.00 0.00 0.00 0.00 179.25 179.79 2r94 n ALA 234 N -2.49 2.28 -1.43 0.00 0.00 0.17 -4.81 120.51 114.23 2r94 n ALA 234 Ca 0.01 -0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.24 2r94 n ALA 234 Cb 0.37 -1.14 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 2r94 n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r94 n GLY 235 N 0.31 1.44 2.74 0.00 0.00 -0.55 -4.88 105.19 104.25 2r94 n GLY 235 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2r94 n GLY 235 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2r94 n ASP 236 N -1.17 6.00 -0.27 1.61 -0.08 0.11 -4.77 116.55 117.97 2r94 n ASP 236 Ca -0.15 -3.11 0.09 0.00 -1.51 0.00 0.00 54.79 50.11 2r94 n ASP 236 Cb 0.62 -1.45 0.34 0.00 2.34 0.00 0.00 41.12 42.97 2r94 n ASP 236 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2r94 h ILE 237 N 3.40 0.91 -0.46 5.18 1.08 -1.89 -1.70 117.51 124.03 2r94 h ILE 237 Ca 0.49 -0.27 -0.06 0.00 -0.39 0.00 0.00 64.86 64.63 2r94 h ILE 237 Cb 0.53 0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 34.32 2r94 h ILE 237 CO 1.59 0.14 0.03 -0.33 -0.69 0.00 0.00 178.15 178.89 2r94 h GLU 238 N 0.78 0.73 -0.11 2.37 3.07 -1.94 -0.78 114.58 118.69 2r94 h GLU 238 Ca 0.42 -0.18 -0.10 0.00 -0.50 0.00 0.00 59.36 59.00 2r94 h GLU 238 Cb 0.53 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 2r94 h GLU 238 CO -0.18 0.73 -0.33 -0.09 -1.40 0.00 0.00 179.01 177.74 2r94 h ARG 239 N 0.69 0.43 -0.78 2.33 2.43 -1.72 -2.22 114.38 115.54 2r94 h ARG 239 Ca 0.14 -0.30 0.18 0.00 -0.81 0.00 0.00 59.98 59.19 2r94 h ARG 239 Cb 0.39 0.05 -0.14 0.00 -0.42 0.00 0.00 29.97 29.85 2r94 h ARG 239 CO 0.01 0.92 -0.00 0.00 -1.51 0.00 0.00 179.97 179.39 2r94 h ALA 240 N 0.50 0.81 0.02 2.80 0.00 -1.11 0.15 119.26 122.44 2r94 h ALA 240 Ca -0.01 0.25 -0.26 0.00 0.00 0.00 0.00 54.91 54.90 2r94 h ALA 240 Cb 0.95 0.44 0.01 0.00 0.00 0.00 0.00 17.79 19.20 2r94 h ALA 240 CO 0.07 -0.43 -1.04 -0.09 0.00 0.00 0.00 179.25 177.76 2r94 h ARG 241 N 0.09 0.55 -0.02 0.00 2.43 -1.12 -1.20 114.38 115.11 2r94 h ARG 241 Ca 0.43 -0.62 -0.13 0.00 -0.81 0.00 0.00 59.98 58.85 2r94 h ARG 241 Cb 0.76 0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 2r94 h ARG 241 CO -0.70 1.24 -0.58 1.03 -1.51 0.00 0.00 179.97 179.46 2r94 h SER 242 N 0.29 0.08 -0.24 -3.80 0.87 -0.74 -0.43 113.55 109.59 2r94 h SER 242 Ca -0.12 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.28 2r94 h SER 242 Cb 1.69 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 63.63 2r94 h SER 242 CO 0.19 0.64 -0.30 -0.07 -0.53 0.00 0.00 176.83 176.77 2r94 h LEU 243 N 0.06 0.67 -0.97 2.23 3.38 -0.58 -2.54 115.31 117.55 2r94 h LEU 243 Ca -0.00 -0.50 0.12 0.00 0.09 0.00 0.00 57.88 57.58 2r94 h LEU 243 Cb 1.03 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.51 2r94 h LEU 243 CO 0.08 1.04 0.60 -0.61 0.09 0.00 0.00 178.44 179.64 2r94 h GLN 244 N 0.32 0.93 -0.03 1.13 5.75 -0.78 0.12 115.11 122.56 2r94 h GLN 244 Ca 0.03 -0.06 -0.15 0.00 -0.15 0.00 0.00 58.65 58.32 2r94 h GLN 244 Cb 0.87 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 29.20 2r94 h GLN 244 CO 0.07 0.61 -0.68 0.74 -2.65 0.00 0.00 178.83 176.92 2r94 h PHE 245 N 0.96 0.18 -0.03 3.99 0.04 -1.01 0.13 116.94 121.20 2r94 h PHE 245 Ca 0.48 -0.08 -0.00 0.00 2.80 0.00 0.00 57.97 61.17 2r94 h PHE 245 Cb 0.47 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 2r94 h PHE 245 CO -0.01 0.77 0.01 1.25 -0.60 0.00 0.00 178.31 179.72 2r94 h LEU 246 N 0.09 0.04 -0.78 1.54 6.46 -0.93 -1.84 115.31 119.89 2r94 h LEU 246 Ca -0.01 -0.23 0.11 0.00 -0.12 0.00 0.00 57.88 57.63 2r94 h LEU 246 Cb 1.21 -0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 41.05 2r94 h LEU 246 CO 0.10 0.26 0.40 0.25 -0.62 0.00 0.00 178.44 178.83 2r94 h LEU 247 N -0.18 0.52 -1.08 2.25 5.85 -0.30 -2.44 115.31 119.93 2r94 h LEU 247 Ca 0.01 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 2r94 h LEU 247 Cb 0.24 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 2r94 h LEU 247 CO 0.00 0.28 0.29 0.44 -0.34 0.00 0.00 178.44 179.11 2r94 h ASP 248 N 0.65 0.86 -0.50 1.25 3.32 -0.29 -0.95 116.42 120.76 2r94 h ASP 248 Ca 0.40 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.28 2r94 h ASP 248 Cb 0.46 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 2r94 h ASP 248 CO -0.30 0.74 0.09 -0.33 -1.72 0.00 0.00 179.24 177.72 2r94 h GLU 249 N 0.93 0.88 -0.03 3.56 5.08 -0.88 0.17 114.58 124.29 2r94 h GLU 249 Ca 0.23 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2r94 h GLU 249 Cb 0.13 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2r94 h GLU 249 CO -0.03 0.83 -0.10 0.82 -1.00 0.00 0.00 179.01 179.53 2r94 h ILE 250 N 0.84 1.46 -0.76 3.13 2.04 -1.01 -2.51 117.51 120.70 2r94 h ILE 250 Ca 0.17 -1.50 0.12 0.00 1.00 0.00 0.00 64.86 64.65 2r94 h ILE 250 Cb 0.38 2.38 -0.08 0.00 -0.74 0.00 0.00 36.82 38.75 2r94 h ILE 250 CO 0.01 0.41 0.37 0.58 0.00 0.00 0.00 178.15 179.51 2r94 h VAL 251 N -0.44 0.78 -0.54 1.67 2.07 -1.02 -1.60 116.25 117.17 2r94 h VAL 251 Ca -0.00 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 2r94 h VAL 251 Cb 0.71 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2r94 h VAL 251 CO 0.02 0.11 0.12 -0.33 0.02 0.00 0.00 177.57 177.51 2r94 h GLU 252 N 0.58 0.83 -0.02 1.57 5.08 -0.62 0.14 114.58 122.14 2r94 h GLU 252 Ca 0.39 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2r94 h GLU 252 Cb 0.49 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2r94 h GLU 252 CO -0.32 0.75 0.00 0.77 -1.00 0.00 0.00 179.01 179.22 2r94 h SER 253 N 0.80 0.03 -0.98 1.42 0.02 -0.95 -2.48 113.55 111.41 2r94 h SER 253 Ca 0.17 -0.22 0.11 0.00 -0.84 0.00 0.00 61.79 61.02 2r94 h SER 253 Cb 0.31 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.76 2r94 h SER 253 CO 0.00 0.24 0.61 0.00 -1.14 0.00 0.00 176.83 176.54 2r94 h ALA 254 N 0.79 1.47 -0.69 3.77 0.00 -0.90 -2.02 119.26 121.67 2r94 h ALA 254 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2r94 h ALA 254 Cb 0.22 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2r94 h ALA 254 CO -0.00 0.22 0.38 0.00 0.00 0.00 0.00 179.25 179.85 2r94 h ARG 255 N 0.98 0.96 -0.95 0.00 3.08 -0.54 -2.43 114.38 115.47 2r94 h ARG 255 Ca 0.48 -0.10 0.04 0.00 0.07 0.00 0.00 59.98 60.47 2r94 h ARG 255 Cb 0.46 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 30.26 2r94 h ARG 255 CO -0.26 0.70 0.62 1.25 -1.07 0.00 0.00 179.97 181.21 2r94 h HIS 256 N 0.97 1.15 -0.03 3.04 2.76 -0.90 -3.03 115.15 119.12 2r94 h HIS 256 Ca 0.25 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.44 2r94 h HIS 256 Cb 0.03 -0.38 0.00 0.00 1.55 0.00 0.00 27.41 28.60 2r94 h HIS 256 CO 0.01 0.65 -0.03 0.44 -1.30 0.00 0.00 177.93 177.69 2r94 n ILE 257 N -4.49 0.00 0.00 6.26 -6.64 -0.95 -4.97 119.36 108.57 2r94 n ILE 257 Ca 0.13 -0.43 0.00 0.00 -1.77 0.00 0.00 62.75 60.68 2r94 n ILE 257 Cb 0.11 1.26 0.00 0.00 -1.44 0.00 0.00 39.64 39.57 2r94 n ILE 257 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2r94 n GLY 258 N 1.32 1.99 0.18 3.28 0.00 -0.99 -4.91 105.19 106.06 2r94 n GLY 258 Ca 0.15 -0.68 -0.08 0.00 0.00 0.00 0.00 46.02 45.41 2r94 n GLY 258 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2r94 h TYR 259 N 0.00 0.54 -0.69 1.61 3.20 -1.71 -0.42 116.97 119.50 2r94 h TYR 259 Ca 0.00 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 61.98 2r94 h TYR 259 Cb 0.00 -0.18 -0.08 0.00 1.54 0.00 0.00 36.73 38.01 2r94 h TYR 259 CO 0.00 0.39 0.29 0.00 -1.64 0.00 0.00 178.16 177.20 2r94 h ALA 260 N 1.10 0.94 0.05 1.82 0.00 -1.96 0.11 119.26 121.33 2r94 h ALA 260 Ca 0.14 0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.91 2r94 h ALA 260 Cb 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2r94 h ALA 260 CO -0.03 -0.15 -1.06 0.00 0.00 0.00 0.00 179.25 178.01 2r94 h ALA 261 N 1.47 0.29 0.00 0.00 0.00 -1.82 -3.31 119.26 115.88 2r94 h ALA 261 Ca 0.36 -0.84 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 2r94 h ALA 261 Cb 0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2r94 h ALA 261 CO -0.33 1.02 -0.39 0.00 0.00 0.00 0.00 179.25 179.55 2r94 h ALA 262 N 0.81 1.02 -0.56 0.00 0.00 0.71 -2.95 119.26 118.28 2r94 h ALA 262 Ca -0.07 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.57 2r94 h ALA 262 Cb 1.77 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.42 2r94 h ALA 262 CO 0.16 0.49 0.15 0.28 0.00 0.00 0.00 179.25 180.34 2r94 h VAL 263 N 0.00 0.72 -0.48 0.00 2.07 -1.20 -1.19 116.25 116.18 2r94 h VAL 263 Ca -0.00 -0.10 0.09 0.00 0.82 0.00 0.00 66.70 67.51 2r94 h VAL 263 Cb 0.89 0.39 -0.09 0.00 -1.52 0.00 0.00 31.29 30.96 2r94 h VAL 263 CO 0.05 0.06 -0.06 1.88 0.02 0.00 0.00 177.57 179.51 2r94 h TYR 264 N 0.30 -0.15 -0.06 1.57 0.05 -1.73 -0.33 116.97 116.62 2r94 h TYR 264 Ca 0.29 0.04 -0.06 0.00 0.05 0.00 0.00 58.73 59.05 2r94 h TYR 264 Cb 0.38 0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 2r94 h TYR 264 CO -0.21 -0.16 -0.24 1.49 -1.05 0.00 0.00 178.16 177.99 2r94 h GLU 265 N 0.05 0.10 0.00 4.88 4.57 -1.44 -1.73 114.58 121.00 2r94 h GLU 265 Ca 0.23 -0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.27 2r94 h GLU 265 Cb 0.36 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 2r94 h GLU 265 CO -0.45 0.34 -0.54 -0.07 -1.18 0.00 0.00 179.01 177.10 2r94 h LEU 266 N 0.09 0.00 -0.31 1.64 3.38 0.06 0.18 115.31 120.35 2r94 h LEU 266 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2r94 h LEU 266 Cb 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2r94 h LEU 266 CO 0.03 0.54 0.16 0.58 0.09 0.00 0.00 178.44 179.85 2r94 h VAL 267 N 0.00 1.14 0.08 1.22 2.07 -0.35 0.30 116.25 120.71 2r94 h VAL 267 Ca -0.01 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 2r94 h VAL 267 Cb 0.97 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2r94 h VAL 267 CO 0.07 0.15 -0.04 -0.33 0.02 0.00 0.00 177.57 177.44 2r94 h GLU 268 N 0.37 -0.10 -0.31 1.57 5.08 -1.02 0.82 114.58 120.99 2r94 h GLU 268 Ca 0.11 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.54 2r94 h GLU 268 Cb 0.09 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 2r94 h GLU 268 CO -0.02 0.07 -0.08 0.82 -1.00 0.00 0.00 179.01 178.81 2r94 h ILE 269 N -0.25 0.69 0.00 3.13 2.04 -0.92 -1.21 117.51 120.99 2r94 h ILE 269 Ca -0.01 -0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.65 2r94 h ILE 269 Cb 0.22 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2r94 h ILE 269 CO 0.02 0.00 -1.88 0.49 0.00 0.00 0.00 178.15 176.78 2r94 n PHE 270 N -5.26 0.43 -0.04 1.37 3.72 0.09 -4.44 117.46 113.34 2r94 n PHE 270 Ca 0.00 0.14 0.04 0.00 -0.05 0.00 0.00 57.45 57.59 2r94 n PHE 270 Cb 0.18 -0.92 -0.16 0.00 -0.94 0.00 0.00 39.48 37.64 2r94 n PHE 270 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2r94 n GLN 271 N -2.70 0.71 -0.18 -1.08 1.13 0.28 -5.01 117.38 110.53 2r94 n GLN 271 Ca -0.16 -0.13 0.00 0.00 -1.94 0.00 0.00 57.00 54.77 2r94 n GLN 271 Cb 0.88 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.75 2r94 n GLN 271 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2r94 n GLY 272 N 1.49 0.75 3.53 1.08 0.00 -0.46 -5.00 105.19 106.58 2r94 n GLY 272 Ca -0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 2r94 n GLY 272 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2r94 s TYR 273 N -2.19 2.00 -0.18 1.61 -0.85 -1.26 -5.03 117.35 111.46 2r94 s TYR 273 Ca 0.00 -0.98 -0.29 0.00 -0.52 0.00 0.00 57.07 55.28 2r94 s TYR 273 Cb 0.00 -1.38 -0.01 0.00 0.38 0.00 0.00 41.96 40.96 2r94 s TYR 273 CO 0.00 0.04 1.15 -2.00 -1.52 0.00 0.00 175.55 173.22 2r94 s GLU 274 N -3.82 4.26 0.00 -3.49 2.56 -1.26 -3.91 118.70 113.05 2r94 s GLU 274 Ca 0.30 1.52 0.26 0.00 0.00 0.00 0.00 54.97 57.05 2r94 s GLU 274 Cb 0.07 -3.68 0.61 0.00 2.00 0.00 0.00 34.13 33.12 2r94 s GLU 274 CO 0.14 -0.63 1.48 0.00 -0.56 0.00 0.00 175.26 175.69 2r94 n ALA 275 N 6.29 3.03 -0.34 6.30 0.00 -1.26 -5.03 120.51 129.51 2r94 n ALA 275 Ca 0.13 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2r94 n ALA 275 Cb 0.46 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2r94 n ALA 275 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r94 n GLY 276 N 1.33 0.12 3.50 0.00 0.00 -1.26 -4.64 105.19 104.24 2r94 n GLY 276 Ca 0.13 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 2r94 n GLY 276 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2r94 s GLU 277 N 0.00 1.18 0.00 1.61 -1.05 0.49 -4.88 118.70 116.05 2r94 s GLU 277 Ca 0.00 -0.47 0.00 0.00 -0.15 0.00 0.00 54.97 54.35 2r94 s GLU 277 Cb 0.00 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.21 2r94 s GLU 277 CO 0.00 -0.52 0.00 -0.35 0.95 0.00 0.00 175.26 175.34 2r94 n PRO 278 N -0.35 0.26 -3.90 -4.83 -0.04 -1.26 -1.79 135.00 123.09 2r94 n PRO 278 Ca -0.13 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.19 2r94 n PRO 278 Cb 0.63 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.94 2r94 n PRO 278 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2r94 s ARG 279 N -2.00 0.14 0.14 0.54 3.52 -0.99 -4.58 118.95 115.71 2r94 s ARG 279 Ca 0.00 0.04 -0.33 0.00 -0.13 0.00 0.00 55.73 55.31 2r94 s ARG 279 Cb 0.00 -0.26 -0.13 0.00 -1.56 0.00 0.00 34.95 33.00 2r94 s ARG 279 CO 0.00 -0.07 1.65 0.41 -0.81 0.00 0.00 175.30 176.49 2r94 n GLY 280 N 3.65 1.26 0.27 8.12 0.00 -1.26 -1.70 105.19 115.53 2r94 n GLY 280 Ca -0.21 0.68 0.11 0.00 0.00 0.00 0.00 46.02 46.60 2r94 n GLY 280 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2r94 n PRO 281 N 4.02 0.70 -2.28 1.61 -0.04 -1.26 -4.88 135.00 132.87 2r94 n PRO 281 Ca 0.18 -0.54 -0.43 0.00 -0.04 0.00 0.00 63.50 62.67 2r94 n PRO 281 Cb 0.30 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 2r94 n PRO 281 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2r94 n VAL 282 N -0.68 4.04 -2.27 0.52 0.31 -0.69 -4.99 118.33 114.58 2r94 n VAL 282 Ca 0.08 -4.03 -0.37 0.00 -0.01 0.00 0.00 64.34 60.02 2r94 n VAL 282 Cb 0.39 -2.44 -0.01 0.00 -0.91 0.00 0.00 33.84 30.87 2r94 n VAL 282 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2r94 s TYR 283 N 1.71 2.85 0.57 3.52 2.02 -1.26 -2.35 117.35 124.41 2r94 s TYR 283 Ca 0.43 1.54 -0.20 0.00 -0.37 0.00 0.00 57.07 58.47 2r94 s TYR 283 Cb 0.09 -3.35 -0.04 0.00 -0.40 0.00 0.00 41.96 38.26 2r94 s TYR 283 CO -0.02 -1.48 1.31 -2.14 -1.57 0.00 0.00 175.55 171.66 2r94 s PRO 284 N -2.81 3.00 0.32 -1.71 0.02 -1.26 -4.78 135.00 127.78 2r94 s PRO 284 Ca 0.65 2.11 -0.27 0.00 0.02 0.00 0.00 61.00 63.52 2r94 s PRO 284 Cb -0.27 -2.12 -0.13 0.00 0.02 0.00 0.00 34.50 32.00 2r94 s PRO 284 CO 0.33 -1.26 0.93 1.28 -0.33 0.00 0.00 177.00 177.95 2r94 n LEU 285 N -1.29 1.56 -4.94 -5.54 4.77 -1.26 -4.98 117.00 105.31 2r94 n LEU 285 Ca 0.12 1.12 -0.27 0.00 -0.03 0.00 0.00 56.01 56.95 2r94 n LEU 285 Cb 0.47 -1.26 0.11 0.00 -2.33 0.00 0.00 43.42 40.40 2r94 n LEU 285 CO 0.50 -1.67 0.69 1.51 -1.33 0.00 0.00 177.39 177.08 2r94 s ASP 286 N -0.66 4.24 0.39 -1.43 1.47 -1.26 -4.84 116.67 114.58 2r94 s ASP 286 Ca 0.60 0.27 0.10 0.00 1.18 0.00 0.00 52.55 54.70 2r94 s ASP 286 Cb -0.68 -0.69 0.79 0.00 -0.34 0.00 0.00 42.92 42.00 2r94 s ASP 286 CO 0.59 -1.98 1.91 -0.65 0.68 0.00 0.00 175.17 175.73 2r94 h PRO 287 N -0.90 0.21 -0.43 2.11 0.11 -2.00 -1.65 132.00 129.46 2r94 h PRO 287 Ca -0.43 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 2r94 h PRO 287 Cb 1.29 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 2r94 h PRO 287 CO 0.51 0.36 -0.19 0.93 -0.21 0.00 0.00 178.00 179.40 2r94 h GLU 288 N 0.20 0.83 -0.35 1.05 3.07 -1.99 -1.67 114.58 115.72 2r94 h GLU 288 Ca 0.04 -0.32 -0.12 0.00 -0.50 0.00 0.00 59.36 58.45 2r94 h GLU 288 Cb 0.39 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 2r94 h GLU 288 CO 0.02 0.95 -0.28 0.93 -1.40 0.00 0.00 179.01 179.24 2r94 h GLU 289 N 0.73 0.73 -0.61 2.33 5.08 -1.83 0.36 114.58 121.37 2r94 h GLU 289 Ca 0.11 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 58.09 2r94 h GLU 289 Cb 0.71 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 2r94 h GLU 289 CO 0.05 0.93 0.15 0.87 -1.00 0.00 0.00 179.01 180.01 2r94 h LYS 290 N 0.63 0.98 -0.45 2.33 1.57 -1.16 -0.86 116.57 119.60 2r94 h LYS 290 Ca 0.08 -0.23 -0.12 0.00 -1.87 0.00 0.00 60.65 58.51 2r94 h LYS 290 Cb 0.79 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 2r94 h LYS 290 CO 0.07 0.89 -0.17 0.00 -0.57 0.00 0.00 179.45 179.67 2r94 h ALA 291 N 1.04 0.63 0.12 3.86 0.00 -1.09 -0.69 119.26 123.12 2r94 h ALA 291 Ca 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2r94 h ALA 291 Cb 0.35 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2r94 h ALA 291 CO 0.00 0.58 -0.06 2.35 0.00 0.00 0.00 179.25 182.12 2r94 h TRP 292 N 0.75 -0.15 -0.88 0.00 7.01 -0.78 -2.63 115.95 119.28 2r94 h TRP 292 Ca 0.11 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.11 2r94 h TRP 292 Cb 0.73 0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 27.80 2r94 h TRP 292 CO 0.05 -0.01 0.58 1.25 -2.79 0.00 0.00 178.44 177.52 2r94 h LEU 293 N -0.25 1.01 -0.57 0.65 5.85 -1.04 0.16 115.31 121.12 2r94 h LEU 293 Ca -0.02 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2r94 h LEU 293 Cb 0.20 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2r94 h LEU 293 CO 0.03 0.73 0.32 0.03 -0.34 0.00 0.00 178.44 179.21 2r94 h ARG 294 N 1.19 0.79 -0.10 1.25 3.08 -0.99 -1.28 114.38 118.32 2r94 h ARG 294 Ca 0.32 -0.09 -0.14 0.00 0.07 0.00 0.00 59.98 60.15 2r94 h ARG 294 Cb -0.14 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.74 2r94 h ARG 294 CO -0.07 0.60 -0.55 0.00 -1.07 0.00 0.00 179.97 178.88 2r94 h ALA 295 N 1.15 0.88 -0.41 0.04 0.00 -1.05 -2.49 119.26 117.39 2r94 h ALA 295 Ca 0.20 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 2r94 h ALA 295 Cb 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2r94 h ALA 295 CO -0.03 0.69 -0.10 0.00 0.00 0.00 0.00 179.25 179.81 2r94 h ALA 296 N 1.20 1.05 -0.00 0.00 0.00 -0.44 -2.85 119.26 118.22 2r94 h ALA 296 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2r94 h ALA 296 Cb 1.04 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2r94 h ALA 296 CO 0.09 0.58 -0.37 1.33 0.00 0.00 0.00 179.25 180.88 2r94 n VAL 297 N -4.18 0.00 -0.04 0.00 0.24 -0.53 -4.37 118.33 109.44 2r94 n VAL 297 Ca 0.01 -0.04 -0.09 0.00 -2.04 0.00 0.00 64.34 62.19 2r94 n VAL 297 Cb 0.35 0.20 -0.03 0.00 -1.47 0.00 0.00 33.84 32.89 2r94 n VAL 297 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r94 h ALA 298 N 3.21 0.22 -0.19 2.33 0.00 -1.19 0.49 119.26 124.14 2r94 h ALA 298 Ca 0.00 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2r94 h ALA 298 Cb 0.49 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 2r94 h ALA 298 CO 0.00 -0.36 -0.48 -0.22 0.00 0.00 0.00 179.25 178.19 2r94 h LYS 299 N 0.16 -0.49 0.00 0.00 3.64 -1.76 -1.46 116.57 116.67 2r94 h LYS 299 Ca 0.09 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 2r94 h LYS 299 Cb 0.06 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2r94 h LYS 299 CO -0.09 -0.32 -0.17 0.00 -2.27 0.00 0.00 179.45 176.59 2r94 h ALA 300 N -0.01 1.23 -0.27 5.00 0.00 -1.78 -3.15 119.26 120.27 2r94 h ALA 300 Ca 0.07 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2r94 h ALA 300 Cb 0.65 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2r94 h ALA 300 CO -0.45 0.21 -0.08 -0.22 0.00 0.00 0.00 179.25 178.71 2r94 h LYS 301 N 0.00 0.54 0.00 0.00 3.64 0.97 -3.06 116.57 118.66 2r94 h LYS 301 Ca -0.00 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2r94 h LYS 301 Cb 0.47 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2r94 h LYS 301 CO 0.02 0.76 0.00 -1.13 -2.27 0.00 0.00 179.45 176.83 2r94 n SER 302 N -4.50 0.32 -2.12 4.20 3.41 -0.68 -3.48 113.62 110.77 2r94 n SER 302 Ca -0.03 0.58 -0.18 0.00 -0.26 0.00 0.00 58.87 58.98 2r94 n SER 302 Cb 0.32 -0.65 0.22 0.00 -0.26 0.00 0.00 64.21 63.84 2r94 n SER 302 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r94 n GLN 303 N -1.86 2.70 0.00 4.33 6.02 -1.16 -5.14 117.38 122.28 2r94 n GLN 303 Ca 0.03 -3.04 0.13 0.00 -0.01 0.00 0.00 57.00 54.10 2r94 n GLN 303 Cb 0.19 -2.18 0.39 0.00 1.02 0.00 0.00 30.24 29.65 2r94 n GLN 303 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33