#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fsq s SER 7 N 0.00 4.89 0.26 4.52 1.04 -1.26 -4.88 113.70 118.26 2fsq s SER 7 Ca 0.00 1.89 -0.02 0.00 0.48 0.00 0.00 55.95 58.30 2fsq s SER 7 Cb 0.00 -2.53 0.45 0.00 0.10 0.00 0.00 66.02 64.04 2fsq s SER 7 CO 0.00 -1.78 1.82 0.11 0.98 0.00 0.00 173.24 174.37 2fsq h LYS 8 N -0.51 0.82 -0.43 4.02 1.79 -2.05 -2.39 116.57 117.82 2fsq h LYS 8 Ca -0.45 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 57.96 2fsq h LYS 8 Cb 1.24 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.68 2fsq h LYS 8 CO 0.53 0.54 0.25 0.22 -1.08 0.00 0.00 179.45 179.91 2fsq h ASP 9 N 0.85 0.53 0.16 0.86 1.82 -2.01 -3.08 116.42 115.56 2fsq h ASP 9 Ca 0.43 -0.08 -0.14 0.00 -0.39 0.00 0.00 57.03 56.86 2fsq h ASP 9 Cb 0.41 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.28 2fsq h ASP 9 CO -0.26 0.46 -0.50 0.25 -1.61 0.00 0.00 179.24 177.58 2fsq h LEU 10 N 0.57 0.42 -1.55 2.28 5.85 -1.89 -3.16 115.31 117.83 2fsq h LEU 10 Ca 0.15 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2fsq h LEU 10 Cb 0.03 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2fsq h LEU 10 CO -0.03 0.85 0.00 -0.78 -0.34 0.00 0.00 178.44 178.14 2fsq h ASP 11 N 0.30 0.00 -0.76 1.25 3.58 -1.34 -2.77 116.42 116.68 2fsq h ASP 11 Ca 0.01 0.00 0.13 0.00 0.42 0.00 0.00 57.03 57.59 2fsq h ASP 11 Cb 0.99 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.99 2fsq h ASP 11 CO 0.09 0.00 0.50 0.22 -2.88 0.00 0.00 179.24 177.17 2fsq h TYR 12 N 0.00 0.58 -0.18 0.28 3.20 -1.59 -2.59 116.97 116.67 2fsq h TYR 12 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2fsq h TYR 12 Cb 0.09 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.18 2fsq h TYR 12 CO 0.00 0.24 0.00 0.44 -1.64 0.00 0.00 178.16 177.20 2fsq n ILE 13 N -4.49 0.23 -2.15 1.81 -5.35 -1.05 -4.77 119.36 103.59 2fsq n ILE 13 Ca 0.14 -0.35 -0.38 0.00 -0.27 0.00 0.00 62.75 61.89 2fsq n ILE 13 Cb 0.46 0.33 -0.01 0.00 -1.74 0.00 0.00 39.64 38.69 2fsq n ILE 13 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2fsq s SER 14 N -1.51 6.22 0.45 7.28 0.15 -0.98 -0.91 113.70 124.39 2fsq s SER 14 Ca 0.31 2.48 0.16 0.00 0.70 0.00 0.00 55.95 59.60 2fsq s SER 14 Cb 0.17 -2.62 1.10 0.00 -1.71 0.00 0.00 66.02 62.96 2fsq s SER 14 CO 0.25 -0.90 1.96 0.71 1.20 0.00 0.00 173.24 176.46 2fsq h THR 15 N 2.15 0.83 0.00 6.45 1.35 -1.41 -1.33 112.91 120.94 2fsq h THR 15 Ca -0.49 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 2fsq h THR 15 Cb 1.25 0.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 2fsq h THR 15 CO 0.61 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.95 2fsq h ALA 16 N 1.68 1.00 -0.55 6.62 0.00 -1.91 -2.93 119.26 123.17 2fsq h ALA 16 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2fsq h ALA 16 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2fsq h ALA 16 CO -0.08 0.00 0.00 -1.71 0.00 0.00 0.00 179.25 177.46 2fsq n ASN 17 N -2.32 3.22 -3.81 0.00 5.15 -0.50 -4.98 115.26 112.02 2fsq n ASN 17 Ca 0.00 -1.98 -0.12 0.00 -0.60 0.00 0.00 54.58 51.88 2fsq n ASN 17 Cb 0.15 -0.36 -0.10 0.00 -0.53 0.00 0.00 39.78 38.93 2fsq n ASN 17 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2fsq s HIS 18 N -1.28 -0.14 -0.09 1.20 3.76 -1.11 -5.04 115.29 112.61 2fsq s HIS 18 Ca 0.40 0.28 0.07 0.00 -0.15 0.00 0.00 55.06 55.67 2fsq s HIS 18 Cb 0.21 0.04 0.12 0.00 1.11 0.00 0.00 32.58 34.07 2fsq s HIS 18 CO 0.29 -0.24 1.07 -0.40 -0.85 0.00 0.00 174.74 174.61 2fsq n ASP 19 N 2.06 2.20 -3.47 1.40 5.75 -1.26 -5.00 116.55 118.23 2fsq n ASP 19 Ca -0.18 -2.39 -0.13 0.00 -0.01 0.00 0.00 54.79 52.09 2fsq n ASP 19 Cb 0.57 -0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 40.46 2fsq n ASP 19 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2fsq s GLN 20 N -1.67 1.11 1.04 0.11 -2.07 -1.26 -5.17 119.66 111.74 2fsq s GLN 20 Ca 0.13 -0.24 -0.12 0.00 -1.82 0.00 0.00 55.36 53.31 2fsq s GLN 20 Cb 0.11 0.51 0.21 0.00 -1.09 0.00 0.00 33.01 32.75 2fsq s GLN 20 CO 0.02 -0.45 1.07 -1.25 -1.32 0.00 0.00 175.29 173.36 2fsq s PRO 21 N -2.90 0.09 0.21 9.60 0.04 -1.26 -4.90 135.00 135.88 2fsq s PRO 21 Ca -0.01 0.69 -0.31 0.00 0.04 0.00 0.00 61.00 61.40 2fsq s PRO 21 Cb -0.01 -1.68 -0.15 0.00 0.04 0.00 0.00 34.50 32.70 2fsq s PRO 21 CO -0.06 -3.01 1.14 -2.30 0.04 0.00 0.00 177.00 172.81 2fsq n PRO 22 N -4.39 1.30 0.11 0.56 -0.02 -1.26 -4.84 135.00 126.46 2fsq n PRO 22 Ca 0.05 0.46 0.11 0.00 -2.02 0.00 0.00 63.50 62.10 2fsq n PRO 22 Cb 0.56 -1.94 0.47 0.00 -0.02 0.00 0.00 33.50 32.57 2fsq n PRO 22 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2fsq n ARG 23 N 1.49 0.17 0.10 -0.52 1.85 -1.26 -1.58 116.66 116.91 2fsq n ARG 23 Ca 0.13 0.40 0.13 0.00 -1.00 0.00 0.00 57.85 57.51 2fsq n ARG 23 Cb 0.27 -1.83 0.36 0.00 -1.05 0.00 0.00 32.46 30.22 2fsq n ARG 23 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2fsq n HIS 24 N -2.15 0.90 -1.90 2.89 8.25 -1.26 -4.80 115.22 117.16 2fsq n HIS 24 Ca 0.02 0.26 -0.42 0.00 -0.26 0.00 0.00 57.72 57.32 2fsq n HIS 24 Cb 0.23 -0.91 -0.03 0.00 1.12 0.00 0.00 29.99 30.40 2fsq n HIS 24 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2fsq s LEU 25 N -4.53 4.37 0.00 2.41 2.96 -0.61 -0.92 118.68 122.35 2fsq s LEU 25 Ca 0.10 2.56 0.00 0.00 -0.22 0.00 0.00 54.13 56.57 2fsq s LEU 25 Cb 0.12 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.24 2fsq s LEU 25 CO 0.62 -0.89 0.00 0.61 -1.32 0.00 0.00 176.35 175.37 2fsq n GLY 26 N 3.97 2.33 0.20 7.98 0.00 0.26 -4.84 105.19 115.09 2fsq n GLY 26 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 2fsq n GLY 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fsq n SER 27 N 0.00 3.12 -0.04 1.61 3.41 -0.63 -4.81 113.62 116.28 2fsq n SER 27 Ca 0.00 -0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 2fsq n SER 27 Cb 0.00 -0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 63.78 2fsq n SER 27 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2fsq n ARG 28 N -2.65 0.68 -3.69 4.33 0.63 -0.10 -4.65 116.66 111.21 2fsq n ARG 28 Ca -0.03 0.22 -0.11 0.00 -0.92 0.00 0.00 57.85 57.01 2fsq n ARG 28 Cb 0.53 -1.69 -0.06 0.00 0.45 0.00 0.00 32.46 31.69 2fsq n ARG 28 CO 0.00 0.00 0.00 -0.59 -2.51 0.00 0.00 177.63 174.53 2fsq s PHE 29 N -2.56 -0.17 0.86 -0.14 -0.12 -1.23 -0.85 117.98 113.77 2fsq s PHE 29 Ca -0.15 -0.02 -0.13 0.00 -0.05 0.00 0.00 56.93 56.58 2fsq s PHE 29 Cb 0.07 0.17 0.12 0.00 -0.63 0.00 0.00 43.02 42.76 2fsq s PHE 29 CO 0.78 -0.59 1.22 -1.54 -0.05 0.00 0.00 175.22 175.04 2fsq s SER 30 N -2.35 4.02 0.65 1.98 1.04 0.30 -0.57 113.70 118.76 2fsq s SER 30 Ca -0.02 0.57 0.42 0.00 0.48 0.00 0.00 55.95 57.40 2fsq s SER 30 Cb 0.01 -0.91 2.25 0.00 0.10 0.00 0.00 66.02 67.47 2fsq s SER 30 CO -0.06 -2.19 2.32 0.00 0.98 0.00 0.00 173.24 174.29 2fsq h ALA 31 N -1.24 1.06 -0.44 5.32 0.00 -1.96 0.03 119.26 122.03 2fsq h ALA 31 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2fsq h ALA 31 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2fsq h ALA 31 CO 0.56 0.01 0.00 0.39 0.00 0.00 0.00 179.25 180.20 2fsq n GLU 32 N -3.17 2.20 -1.44 0.00 4.71 -1.26 -4.94 120.64 116.74 2fsq n GLU 32 Ca -0.03 -1.85 -0.04 0.00 -0.01 0.00 0.00 57.16 55.24 2fsq n GLU 32 Cb 0.10 -1.43 -0.01 0.00 -1.01 0.00 0.00 31.44 29.09 2fsq n GLU 32 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2fsq n GLY 33 N 1.35 0.52 3.72 0.62 0.00 -0.00 -5.02 105.19 106.36 2fsq n GLY 33 Ca 0.18 -0.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 2fsq n GLY 33 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fsq s GLU 34 N -2.95 4.30 0.27 1.61 2.02 -1.26 -4.68 118.70 118.01 2fsq s GLU 34 Ca 0.00 0.34 -0.29 0.00 0.02 0.00 0.00 54.97 55.04 2fsq s GLU 34 Cb 0.00 -3.45 -0.09 0.00 0.10 0.00 0.00 34.13 30.69 2fsq s GLU 34 CO 0.00 0.14 1.20 -0.06 0.02 0.00 0.00 175.26 176.56 2fsq s PHE 35 N 0.71 3.36 0.26 1.61 0.08 -1.26 -0.54 117.98 122.19 2fsq s PHE 35 Ca 0.23 1.52 0.08 0.00 0.12 0.00 0.00 56.93 58.88 2fsq s PHE 35 Cb -0.15 -3.46 -0.04 0.00 -0.57 0.00 0.00 43.02 38.80 2fsq s PHE 35 CO 0.08 -1.20 0.13 -0.51 -0.10 0.00 0.00 175.22 173.63 2fsq s LEU 36 N -1.23 3.58 0.11 -0.37 1.43 -0.03 -4.90 118.68 117.27 2fsq s LEU 36 Ca 0.48 -0.41 -0.31 0.00 -1.03 0.00 0.00 54.13 52.87 2fsq s LEU 36 Cb -0.35 -2.11 -0.10 0.00 0.03 0.00 0.00 46.19 43.66 2fsq s LEU 36 CO 0.44 -0.04 1.82 -2.84 0.23 0.00 0.00 176.35 175.96 2fsq s PRO 37 N -3.79 4.14 -0.47 1.29 0.02 -1.26 -4.64 135.00 130.29 2fsq s PRO 37 Ca 0.33 2.57 0.06 0.00 0.02 0.00 0.00 61.00 63.98 2fsq s PRO 37 Cb -0.07 -3.64 0.26 0.00 0.02 0.00 0.00 34.50 31.07 2fsq s PRO 37 CO 0.23 -0.84 0.90 -1.91 -0.33 0.00 0.00 177.00 175.05 2fsq n GLU 38 N 5.81 0.82 -2.35 5.54 2.13 0.03 -4.95 120.64 127.66 2fsq n GLU 38 Ca 0.18 -1.92 -0.34 0.00 0.66 0.00 0.00 57.16 55.73 2fsq n GLU 38 Cb 0.39 -1.37 -0.01 0.00 0.27 0.00 0.00 31.44 30.71 2fsq n GLU 38 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2fsq s PRO 39 N 0.40 3.52 0.00 5.31 0.02 -1.21 -4.34 135.00 138.71 2fsq s PRO 39 Ca 0.31 1.48 0.00 0.00 0.02 0.00 0.00 61.00 62.80 2fsq s PRO 39 Cb 0.24 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.72 2fsq s PRO 39 CO -0.20 -0.68 0.00 0.41 -0.33 0.00 0.00 177.00 176.20 2fsq n GLY 40 N -0.09 1.51 3.27 0.52 0.00 -0.55 -0.54 105.19 109.31 2fsq n GLY 40 Ca 0.10 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 2fsq n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fsq s ASN 41 N 0.17 0.13 -0.13 1.61 2.20 -0.30 -1.56 114.94 117.06 2fsq s ASN 41 Ca 0.00 -1.19 -0.33 0.00 -0.94 0.00 0.00 52.86 50.39 2fsq s ASN 41 Cb 0.00 0.40 0.13 0.00 -2.00 0.00 0.00 41.25 39.78 2fsq s ASN 41 CO 0.00 -0.87 1.17 0.28 -2.94 0.00 0.00 177.10 174.74 2fsq s THR 42 N -4.08 0.00 -0.22 0.54 -1.32 -0.48 -2.12 115.64 107.97 2fsq s THR 42 Ca 0.30 -0.05 -0.04 0.00 -1.21 0.00 0.00 61.69 60.68 2fsq s THR 42 Cb 0.05 -1.18 -0.01 0.00 -1.51 0.00 0.00 72.50 69.85 2fsq s THR 42 CO 0.07 0.00 -0.02 -0.69 -2.21 0.00 0.00 174.62 171.77 2fsq s VAL 43 N -2.53 3.59 0.10 5.08 1.01 -0.13 0.10 120.40 127.62 2fsq s VAL 43 Ca 0.10 -0.43 -0.00 0.00 0.00 0.00 0.00 61.98 61.65 2fsq s VAL 43 Cb -0.00 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 2fsq s VAL 43 CO -0.05 0.42 -0.01 0.68 0.00 0.00 0.00 175.10 176.14 2fsq s VAL 44 N 1.35 0.36 -0.29 2.92 -7.23 -0.39 -0.31 120.40 116.82 2fsq s VAL 44 Ca 0.04 -1.89 -0.05 0.00 -1.81 0.00 0.00 61.98 58.28 2fsq s VAL 44 Cb -0.14 -1.76 0.03 0.00 0.56 0.00 0.00 36.38 35.06 2fsq s VAL 44 CO -0.01 -0.77 0.03 0.00 -0.31 0.00 0.00 175.10 174.04 2fsq s HIS 46 N 1.40 2.96 0.81 0.00 3.76 -1.26 -4.34 115.29 118.61 2fsq s HIS 46 Ca -0.00 1.30 -0.11 0.00 -0.15 0.00 0.00 55.06 56.10 2fsq s HIS 46 Cb -0.18 -3.00 0.08 0.00 1.11 0.00 0.00 32.58 30.59 2fsq s HIS 46 CO 0.00 -1.51 1.09 -0.51 -0.85 0.00 0.00 174.74 172.96 2fsq s LEU 47 N -5.67 2.73 -0.34 0.89 1.43 -1.10 -0.28 118.68 116.34 2fsq s LEU 47 Ca 0.59 1.63 -0.22 0.00 -1.03 0.00 0.00 54.13 55.10 2fsq s LEU 47 Cb -0.14 -4.24 0.00 0.00 0.03 0.00 0.00 46.19 41.84 2fsq s LEU 47 CO 0.55 -2.17 0.70 -0.69 0.23 0.00 0.00 176.35 174.96 2fsq s VAL 48 N -2.96 4.84 0.12 -1.59 1.01 -1.26 -4.59 120.40 115.97 2fsq s VAL 48 Ca 0.62 0.83 -0.34 0.00 0.00 0.00 0.00 61.98 63.09 2fsq s VAL 48 Cb -0.17 -4.11 -0.13 0.00 0.00 0.00 0.00 36.38 31.97 2fsq s VAL 48 CO 0.56 -0.30 1.65 -1.84 0.00 0.00 0.00 175.10 175.17 2fsq n GLU 49 N 6.14 2.22 -0.30 2.72 0.00 -1.26 -1.83 120.64 128.34 2fsq n GLU 49 Ca 0.01 0.80 0.00 0.00 0.00 0.00 0.00 57.16 57.97 2fsq n GLU 49 Cb 0.48 -2.60 0.00 0.00 0.00 0.00 0.00 31.44 29.33 2fsq n GLU 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2fsq n GLY 50 N 3.65 1.80 3.81 -1.84 0.00 -1.26 -5.03 105.19 106.31 2fsq n GLY 50 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2fsq n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fsq s SER 51 N -3.35 5.12 0.29 1.61 1.04 -0.76 -4.87 113.70 112.77 2fsq s SER 51 Ca 0.00 1.66 -0.00 0.00 0.48 0.00 0.00 55.95 58.08 2fsq s SER 51 Cb 0.00 -2.48 0.49 0.00 0.10 0.00 0.00 66.02 64.12 2fsq s SER 51 CO 0.00 -1.62 1.90 1.56 0.98 0.00 0.00 173.24 176.06 2fsq h GLN 52 N -0.84 1.05 -0.24 4.02 7.50 -1.96 -1.93 115.11 122.71 2fsq h GLN 52 Ca -0.44 -0.06 0.02 0.00 0.50 0.00 0.00 58.65 58.67 2fsq h GLN 52 Cb 1.22 -0.24 -0.02 0.00 0.05 0.00 0.00 27.48 28.49 2fsq h GLN 52 CO 0.55 0.70 0.10 1.15 -1.50 0.00 0.00 178.83 179.83 2fsq h THR 53 N 1.08 0.97 -0.39 -0.54 2.02 -1.91 -0.28 112.91 113.86 2fsq h THR 53 Ca 0.41 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.49 2fsq h THR 53 Cb 0.19 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2fsq h THR 53 CO -0.16 0.04 0.19 -0.08 0.37 0.00 0.00 175.52 175.89 2fsq h GLU 54 N 0.23 0.56 -0.99 6.66 4.81 -1.67 -1.47 114.58 122.71 2fsq h GLU 54 Ca 0.10 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2fsq h GLU 54 Cb 0.05 -0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 2fsq h GLU 54 CO -0.09 0.49 0.65 0.77 -0.73 0.00 0.00 179.01 180.10 2fsq h SER 55 N 0.49 1.09 -0.52 1.04 0.02 -1.06 0.32 113.55 114.92 2fsq h SER 55 Ca 0.13 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2fsq h SER 55 Cb 0.11 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 2fsq h SER 55 CO -0.02 0.76 0.26 0.00 -1.14 0.00 0.00 176.83 176.69 2fsq h ALA 56 N 1.39 0.67 -0.35 3.77 0.00 -0.70 -1.26 119.26 122.79 2fsq h ALA 56 Ca 0.39 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 2fsq h ALA 56 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2fsq h ALA 56 CO -0.11 0.22 -0.30 0.82 0.00 0.00 0.00 179.25 179.88 2fsq h ILE 57 N 0.70 1.28 -0.50 0.00 2.04 -0.69 -2.11 117.51 118.22 2fsq h ILE 57 Ca 0.18 -1.43 -0.06 0.00 1.00 0.00 0.00 64.86 64.55 2fsq h ILE 57 Cb 0.09 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2fsq h ILE 57 CO -0.03 0.47 0.05 0.58 0.00 0.00 0.00 178.15 179.23 2fsq h VAL 58 N 0.64 1.23 -0.19 1.67 2.07 -0.77 0.07 116.25 120.97 2fsq h VAL 58 Ca 0.08 -0.91 0.01 0.00 0.82 0.00 0.00 66.70 66.69 2fsq h VAL 58 Cb 0.82 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2fsq h VAL 58 CO 0.07 0.33 0.11 -1.28 0.02 0.00 0.00 177.57 176.82 2fsq h SER 59 N 0.75 0.19 -0.20 0.57 0.87 -0.83 0.11 113.55 115.00 2fsq h SER 59 Ca 0.16 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.74 2fsq h SER 59 Cb 0.38 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 2fsq h SER 59 CO 0.01 0.14 0.05 0.74 -0.53 0.00 0.00 176.83 177.24 2fsq h THR 60 N 0.24 0.92 -0.19 2.23 2.02 -0.86 -2.15 112.91 115.13 2fsq h THR 60 Ca 0.07 -0.05 0.04 0.00 0.77 0.00 0.00 66.41 67.25 2fsq h THR 60 Cb -0.01 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 2fsq h THR 60 CO -0.03 0.03 -0.07 -0.09 0.37 0.00 0.00 175.52 175.72 2fsq h ARG 61 N 0.14 -0.04 -0.30 6.66 2.43 -0.81 -2.26 114.38 120.20 2fsq h ARG 61 Ca 0.09 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2fsq h ARG 61 Cb 0.08 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 2fsq h ARG 61 CO -0.11 -0.03 0.20 1.96 -1.51 0.00 0.00 179.97 180.49 2fsq h GLN 62 N -0.04 0.37 0.02 0.20 1.08 -0.48 -1.13 115.11 115.14 2fsq h GLN 62 Ca 0.10 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2fsq h GLN 62 Cb 0.19 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 2fsq h GLN 62 CO -0.21 0.25 -0.01 -0.09 -0.95 0.00 0.00 178.83 177.81 2fsq h ARG 63 N 0.38 -0.03 -0.84 1.46 9.65 -1.00 -2.31 114.38 121.71 2fsq h ARG 63 Ca 0.11 0.00 0.21 0.00 -1.10 0.00 0.00 59.98 59.21 2fsq h ARG 63 Cb -0.01 0.01 -0.14 0.00 -1.39 0.00 0.00 29.97 28.44 2fsq h ARG 63 CO -0.03 0.38 0.16 0.74 2.80 0.00 0.00 179.97 184.03 2fsq h PHE 64 N -0.44 0.23 0.00 2.20 -1.00 -0.86 0.25 116.94 117.32 2fsq h PHE 64 Ca -0.00 0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.83 2fsq h PHE 64 Cb 0.42 0.03 -0.00 0.00 3.61 0.00 0.00 35.95 40.01 2fsq h PHE 64 CO 0.07 -0.21 -0.01 -0.07 -1.61 0.00 0.00 178.31 176.47 2fsq h LEU 65 N 0.18 0.00 -4.97 1.54 3.38 -1.01 -3.40 115.31 111.03 2fsq h LEU 65 Ca 0.50 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.43 2fsq h LEU 65 Cb 0.97 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2fsq h LEU 65 CO -0.65 0.01 0.51 0.47 0.09 0.00 0.00 178.44 178.87 2fsq n ASP 66 N -4.39 0.99 -0.09 -0.43 8.00 0.86 -4.74 116.55 116.76 2fsq n ASP 66 Ca -0.03 -1.73 -0.11 0.00 0.71 0.00 0.00 54.79 53.63 2fsq n ASP 66 Cb 0.10 -0.31 -0.12 0.00 -0.02 0.00 0.00 41.12 40.77 2fsq n ASP 66 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2fsq n PRO 68 N 3.18 1.00 0.00 -0.24 -0.04 -1.26 -4.99 135.00 132.64 2fsq n PRO 68 Ca 0.08 0.04 0.10 0.00 -0.04 0.00 0.00 63.50 63.69 2fsq n PRO 68 Cb 0.14 -1.42 0.60 0.00 -0.04 0.00 0.00 33.50 32.77 2fsq n PRO 68 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2fsq n GLU 69 N -2.81 0.56 0.19 0.54 4.71 -1.26 -2.50 120.64 120.06 2fsq n GLU 69 Ca -0.31 0.03 0.17 0.00 -0.01 0.00 0.00 57.16 57.04 2fsq n GLU 69 Cb 0.98 -1.50 0.80 0.00 -1.01 0.00 0.00 31.44 30.72 2fsq n GLU 69 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2fsq h ALA 70 N 3.22 1.89 0.00 0.62 0.00 -1.85 0.38 119.26 123.52 2fsq h ALA 70 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fsq h ALA 70 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2fsq h ALA 70 CO 0.00 -0.32 0.00 0.66 0.00 0.00 0.00 179.25 179.59 2fsq h SER 71 N 0.00 0.00 -0.65 0.00 4.64 -1.85 -1.85 113.55 113.84 2fsq h SER 71 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2fsq h SER 71 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2fsq h SER 71 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2fsq n GLN 72 N -2.49 2.72 -4.68 4.77 6.02 0.12 -4.94 117.38 118.90 2fsq n GLN 72 Ca -0.00 -2.55 -0.27 0.00 -0.01 0.00 0.00 57.00 54.16 2fsq n GLN 72 Cb 0.13 -1.53 -0.14 0.00 1.02 0.00 0.00 30.24 29.72 2fsq n GLN 72 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2fsq s LEU 73 N -1.04 2.20 -0.40 1.08 1.43 -0.70 -0.65 118.68 120.60 2fsq s LEU 73 Ca 0.45 -0.59 -0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2fsq s LEU 73 Cb 0.24 -1.11 0.08 0.00 0.03 0.00 0.00 46.19 45.43 2fsq s LEU 73 CO 0.31 0.19 0.22 0.00 0.23 0.00 0.00 176.35 177.30 2fsq s ALA 74 N -0.87 3.22 0.11 4.21 0.00 0.30 -4.89 121.76 123.85 2fsq s ALA 74 Ca 0.10 -2.17 -0.25 0.00 0.00 0.00 0.00 51.96 49.63 2fsq s ALA 74 Cb -0.09 -2.54 -0.07 0.00 0.00 0.00 0.00 23.12 20.42 2fsq s ALA 74 CO 0.03 -1.64 0.77 -0.06 0.00 0.00 0.00 175.76 174.86 2fsq s PHE 75 N 1.36 3.83 0.51 0.00 0.08 -1.26 -0.89 117.98 121.61 2fsq s PHE 75 Ca 0.03 1.56 -0.07 0.00 0.12 0.00 0.00 56.93 58.57 2fsq s PHE 75 Cb -0.23 -2.79 -0.04 0.00 -0.57 0.00 0.00 43.02 39.40 2fsq s PHE 75 CO 0.01 0.41 0.84 0.95 -0.10 0.00 0.00 175.22 177.33 2fsq s THR 76 N -0.65 4.86 0.55 0.64 -4.23 -1.13 -5.01 115.64 110.67 2fsq s THR 76 Ca 0.37 0.36 -0.21 0.00 -1.18 0.00 0.00 61.69 61.03 2fsq s THR 76 Cb -0.22 -3.86 -0.05 0.00 1.34 0.00 0.00 72.50 69.71 2fsq s THR 76 CO 0.25 -0.91 1.26 -2.84 -0.54 0.00 0.00 174.62 171.84 2fsq s PRO 77 N -4.82 3.15 0.28 3.99 0.02 -1.26 -4.90 135.00 131.44 2fsq s PRO 77 Ca 0.49 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.51 2fsq s PRO 77 Cb -0.10 -2.14 0.52 0.00 0.02 0.00 0.00 34.50 32.80 2fsq s PRO 77 CO 0.47 -1.11 1.84 0.28 -0.33 0.00 0.00 177.00 178.14 2fsq h VAL 78 N 1.25 0.94 0.00 3.83 2.07 -1.96 -1.13 116.25 121.25 2fsq h VAL 78 Ca -0.50 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2fsq h VAL 78 Cb 1.29 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2fsq h VAL 78 CO 0.57 0.18 0.00 -1.54 0.02 0.00 0.00 177.57 176.80 2fsq n SER 79 N -4.62 0.09 -0.10 0.57 3.41 -1.26 -2.13 113.62 109.58 2fsq n SER 79 Ca 0.18 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.43 2fsq n SER 79 Cb 0.33 -0.54 0.26 0.00 -0.26 0.00 0.00 64.21 63.99 2fsq n SER 79 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fsq n SER 80 N -1.60 0.77 -4.74 4.04 3.41 -0.43 -4.93 113.62 110.15 2fsq n SER 80 Ca 0.03 -0.57 -0.42 0.00 -0.26 0.00 0.00 58.87 57.66 2fsq n SER 80 Cb 0.18 0.27 -0.02 0.00 -0.26 0.00 0.00 64.21 64.38 2fsq n SER 80 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2fsq s LEU 81 N -2.81 4.35 0.00 1.04 1.43 -0.90 -4.91 118.68 116.88 2fsq s LEU 81 Ca 0.16 2.90 0.00 0.00 -1.03 0.00 0.00 54.13 56.16 2fsq s LEU 81 Cb 0.18 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2fsq s LEU 81 CO 0.65 -0.92 0.00 0.00 0.23 0.00 0.00 176.35 176.31 2fsq n HIS 82 N 2.74 0.00 -4.37 0.29 1.44 -1.26 -2.71 115.22 111.35 2fsq n HIS 82 Ca 0.10 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.61 2fsq n HIS 82 Cb 0.37 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.32 2fsq n HIS 82 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2fsq s THR 84 N 0.48 0.76 -0.23 0.61 2.01 -1.26 -4.16 115.64 113.86 2fsq s THR 84 Ca 0.00 -0.33 -0.06 0.00 0.31 0.00 0.00 61.69 61.61 2fsq s THR 84 Cb 0.00 -0.69 -0.18 0.00 0.01 0.00 0.00 72.50 71.64 2fsq s THR 84 CO 0.00 0.25 -0.10 0.52 -0.69 0.00 0.00 174.62 174.59 2fsq n VAL 85 N 3.44 1.56 -3.66 3.82 0.31 0.58 -4.78 118.33 119.61 2fsq n VAL 85 Ca -0.20 -0.48 -0.09 0.00 -0.01 0.00 0.00 64.34 63.56 2fsq n VAL 85 Cb 0.54 -1.66 -0.10 0.00 -0.91 0.00 0.00 33.84 31.70 2fsq n VAL 85 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2fsq s PHE 86 N -2.51 -0.77 0.25 3.52 5.36 -0.95 -4.85 117.98 118.03 2fsq s PHE 86 Ca -0.33 1.49 -0.30 0.00 -0.96 0.00 0.00 56.93 56.83 2fsq s PHE 86 Cb 0.10 0.28 -0.10 0.00 -0.34 0.00 0.00 43.02 42.96 2fsq s PHE 86 CO 0.60 -0.47 1.40 -0.65 -1.46 0.00 0.00 175.22 174.64 2fsq s GLN 87 N 2.59 4.30 0.00 10.12 -0.21 -1.26 -0.96 119.66 134.24 2fsq s GLN 87 Ca -0.02 2.25 0.00 0.00 0.02 0.00 0.00 55.36 57.61 2fsq s GLN 87 Cb -0.12 -3.12 0.00 0.00 1.00 0.00 0.00 33.01 30.77 2fsq s GLN 87 CO -0.12 -0.37 0.00 0.41 -2.12 0.00 0.00 175.29 173.09 2fsq n GLY 88 N 2.11 1.24 3.94 3.09 0.00 -0.90 -4.86 105.19 109.81 2fsq n GLY 88 Ca 0.06 -1.72 -0.24 0.00 0.00 0.00 0.00 46.02 44.11 2fsq n GLY 88 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fsq s VAL 89 N 1.39 3.94 -0.04 1.61 -7.23 -1.18 -4.83 120.40 114.06 2fsq s VAL 89 Ca 0.00 -0.29 -0.13 0.00 -1.81 0.00 0.00 61.98 59.75 2fsq s VAL 89 Cb 0.00 -3.49 0.02 0.00 0.56 0.00 0.00 36.38 33.47 2fsq s VAL 89 CO 0.00 -0.41 0.28 -0.51 -0.31 0.00 0.00 175.10 174.16 2fsq s ILE 90 N -2.71 0.04 0.43 -0.62 2.07 -1.26 -1.15 121.20 118.01 2fsq s ILE 90 Ca 0.50 -0.37 0.14 0.00 -1.41 0.00 0.00 60.65 59.51 2fsq s ILE 90 Cb -0.10 -0.54 0.33 0.00 0.13 0.00 0.00 42.46 42.29 2fsq s ILE 90 CO 0.41 -0.20 1.96 -0.08 -1.91 0.00 0.00 174.94 175.12 2fsq h GLU 91 N 4.44 0.41 -0.00 3.50 4.57 -1.08 -1.57 114.58 124.85 2fsq h GLU 91 Ca -0.29 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 2fsq h GLU 91 Cb 1.18 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 2fsq h GLU 91 CO 0.38 0.27 -0.00 -1.13 -1.18 0.00 0.00 179.01 177.35 2fsq n SER 92 N -4.47 0.24 -3.14 1.04 3.41 -1.26 -4.28 113.62 105.16 2fsq n SER 92 Ca 0.11 -1.03 -0.21 0.00 -0.26 0.00 0.00 58.87 57.48 2fsq n SER 92 Cb 0.41 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.30 2fsq n SER 92 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2fsq n ARG 93 N -0.83 0.76 -2.52 4.33 0.63 -0.59 -5.02 116.66 113.43 2fsq n ARG 93 Ca 0.23 -3.07 -0.43 0.00 -0.92 0.00 0.00 57.85 53.66 2fsq n ARG 93 Cb 0.16 -1.31 0.00 0.00 0.45 0.00 0.00 32.46 31.76 2fsq n ARG 93 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2fsq n ARG 94 N 1.23 3.60 -3.61 -0.14 1.74 -1.26 -4.63 116.66 113.59 2fsq n ARG 94 Ca 0.20 -3.66 -0.16 0.00 -0.77 0.00 0.00 57.85 53.47 2fsq n ARG 94 Cb 0.56 -2.93 -0.07 0.00 -1.02 0.00 0.00 32.46 29.00 2fsq n ARG 94 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2fsq s ALA 95 N 0.50 -1.49 0.47 7.54 0.00 -1.26 -4.96 121.76 122.56 2fsq s ALA 95 Ca 0.40 1.24 -0.22 0.00 0.00 0.00 0.00 51.96 53.37 2fsq s ALA 95 Cb 0.06 -0.29 -0.07 0.00 0.00 0.00 0.00 23.12 22.82 2fsq s ALA 95 CO 0.01 -0.32 1.13 -0.51 0.00 0.00 0.00 175.76 176.07 2fsq s LEU 96 N -0.76 3.97 -0.31 0.00 1.43 -1.26 -0.78 118.68 120.98 2fsq s LEU 96 Ca -0.08 2.22 0.02 0.00 -1.03 0.00 0.00 54.13 55.26 2fsq s LEU 96 Cb -0.02 -4.31 0.42 0.00 0.03 0.00 0.00 46.19 42.30 2fsq s LEU 96 CO 0.06 -0.90 1.64 -0.81 0.23 0.00 0.00 176.35 176.58 2fsq n PRO 97 N -0.60 1.84 -0.52 1.29 -0.04 -1.26 -4.91 135.00 130.81 2fsq n PRO 97 Ca 0.08 -1.97 0.09 0.00 -0.04 0.00 0.00 63.50 61.66 2fsq n PRO 97 Cb 0.49 -1.77 0.31 0.00 -0.04 0.00 0.00 33.50 32.49 2fsq n PRO 97 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2fsq n TYR 98 N -0.52 1.23 -3.76 0.54 4.02 0.04 -4.07 117.16 114.65 2fsq n TYR 98 Ca 0.39 -0.64 -0.13 0.00 -0.01 0.00 0.00 57.90 57.51 2fsq n TYR 98 Cb 1.19 -0.22 -0.09 0.00 -0.02 0.00 0.00 39.34 40.20 2fsq n TYR 98 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 2fsq s TRP 99 N -1.87 -0.23 0.10 -0.72 -0.11 -1.14 -4.67 118.94 110.31 2fsq s TRP 99 Ca 0.45 0.44 -0.31 0.00 1.22 0.00 0.00 56.10 57.90 2fsq s TRP 99 Cb 0.30 0.10 -0.07 0.00 -1.50 0.00 0.00 33.47 32.30 2fsq s TRP 99 CO 0.21 -0.33 1.31 -1.25 -4.62 0.00 0.00 176.95 172.27 2fsq s PRO 100 N -0.90 4.37 0.62 5.86 0.04 -1.26 -4.69 135.00 139.04 2fsq s PRO 100 Ca -0.10 1.96 0.39 0.00 0.04 0.00 0.00 61.00 63.29 2fsq s PRO 100 Cb -0.04 -3.28 2.05 0.00 0.04 0.00 0.00 34.50 33.26 2fsq s PRO 100 CO 0.03 -0.36 2.25 0.37 0.04 0.00 0.00 177.00 179.33 2fsq h GLN 101 N 6.75 0.00 0.00 4.56 4.15 -1.92 -2.04 115.11 126.60 2fsq h GLN 101 Ca -0.42 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.00 2fsq h GLN 101 Cb 1.21 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.90 2fsq h GLN 101 CO 0.84 0.02 0.00 0.25 -1.93 0.00 0.00 178.83 178.01 2fsq n THR 102 N -3.24 0.80 -4.84 2.39 -2.24 -1.26 -4.76 114.28 101.12 2fsq n THR 102 Ca -0.02 0.17 -0.33 0.00 -2.27 0.00 0.00 64.05 61.60 2fsq n THR 102 Cb 0.14 -0.97 -0.13 0.00 -2.10 0.00 0.00 70.33 67.27 2fsq n THR 102 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2fsq s LEU 103 N -3.64 2.76 0.39 3.22 1.43 -0.77 -5.10 118.68 116.97 2fsq s LEU 103 Ca 0.07 -0.22 -0.26 0.00 -1.03 0.00 0.00 54.13 52.69 2fsq s LEU 103 Cb 0.11 -1.58 -0.11 0.00 0.03 0.00 0.00 46.19 44.64 2fsq s LEU 103 CO 0.37 0.30 1.08 -2.65 0.23 0.00 0.00 176.35 175.67 2fsq n PRO 104 N 2.64 1.53 0.30 1.29 -0.02 -1.26 -4.84 135.00 134.64 2fsq n PRO 104 Ca -0.17 0.55 0.19 0.00 -2.02 0.00 0.00 63.50 62.04 2fsq n PRO 104 Cb 0.52 -2.09 0.90 0.00 -0.02 0.00 0.00 33.50 32.82 2fsq n PRO 104 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2fsq h LEU 105 N 1.83 0.00 -3.09 2.45 3.38 -1.92 -2.20 115.31 115.76 2fsq h LEU 105 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2fsq h LEU 105 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2fsq h LEU 105 CO 0.59 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.22 2fsq n ASP 106 N -3.04 4.67 -4.72 -0.43 5.75 -1.26 -4.85 116.55 112.65 2fsq n ASP 106 Ca -0.01 -2.39 -0.42 0.00 -0.01 0.00 0.00 54.79 51.97 2fsq n ASP 106 Cb 0.20 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 39.70 2fsq n ASP 106 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2fsq s THR 107 N -1.73 2.08 0.35 2.12 2.01 -0.83 -4.92 115.64 114.72 2fsq s THR 107 Ca 0.51 0.06 -0.28 0.00 0.31 0.00 0.00 61.69 62.29 2fsq s THR 107 Cb 0.32 -3.04 -0.12 0.00 0.01 0.00 0.00 72.50 69.67 2fsq s THR 107 CO 0.26 0.01 1.26 -2.65 -0.69 0.00 0.00 174.62 172.80 2fsq n PRO 108 N 3.67 2.03 -0.30 4.92 -0.02 -1.26 -4.83 135.00 139.21 2fsq n PRO 108 Ca 0.14 0.71 0.10 0.00 -2.02 0.00 0.00 63.50 62.44 2fsq n PRO 108 Cb 0.36 -2.29 0.26 0.00 -0.02 0.00 0.00 33.50 31.81 2fsq n PRO 108 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2fsq h ILE 109 N 2.45 0.61 -0.44 4.25 1.08 -1.95 -1.43 117.51 122.08 2fsq h ILE 109 Ca -0.46 -0.18 -0.02 0.00 -0.39 0.00 0.00 64.86 63.81 2fsq h ILE 109 Cb 1.29 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 35.07 2fsq h ILE 109 CO 0.62 0.09 0.18 0.44 -0.69 0.00 0.00 178.15 178.79 2fsq h ASP 110 N 0.52 0.56 0.13 1.72 3.32 -1.98 -1.10 116.42 119.60 2fsq h ASP 110 Ca 0.51 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 57.38 2fsq h ASP 110 Cb 0.84 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2fsq h ASP 110 CO -0.44 0.51 -0.40 0.00 -1.72 0.00 0.00 179.24 177.19 2fsq h ALA 111 N 1.58 1.01 -0.46 3.45 0.00 -1.63 -1.75 119.26 121.46 2fsq h ALA 111 Ca 0.15 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 2fsq h ALA 111 Cb 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2fsq h ALA 111 CO -0.02 0.61 -0.00 0.28 0.00 0.00 0.00 179.25 180.12 2fsq h VAL 112 N 0.30 1.26 -0.67 0.00 2.07 -0.86 -1.93 116.25 116.42 2fsq h VAL 112 Ca 0.03 -1.06 0.08 0.00 0.82 0.00 0.00 66.70 66.57 2fsq h VAL 112 Cb 0.84 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.58 2fsq h VAL 112 CO 0.07 0.37 0.34 0.74 0.02 0.00 0.00 177.57 179.10 2fsq h THR 113 N 0.67 0.90 -0.50 2.57 2.02 -1.07 -1.14 112.91 116.35 2fsq h THR 113 Ca 0.13 -0.21 -0.03 0.00 0.77 0.00 0.00 66.41 67.08 2fsq h THR 113 Cb 0.50 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 2fsq h THR 113 CO 0.02 0.11 0.21 0.44 0.37 0.00 0.00 175.52 176.67 2fsq h ASP 114 N 0.61 0.69 -0.60 4.18 3.32 -1.14 0.12 116.42 123.59 2fsq h ASP 114 Ca 0.31 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 57.25 2fsq h ASP 114 Cb 0.28 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.60 2fsq h ASP 114 CO -0.23 0.66 0.34 0.22 -1.72 0.00 0.00 179.24 178.51 2fsq h TYR 115 N 0.67 0.63 -0.15 4.55 3.20 -0.87 -2.11 116.97 122.89 2fsq h TYR 115 Ca 0.17 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.89 2fsq h TYR 115 Cb 0.18 -0.19 0.01 0.00 1.54 0.00 0.00 36.73 38.26 2fsq h TYR 115 CO 0.00 0.32 -0.57 1.88 -1.64 0.00 0.00 178.16 178.15 2fsq h TYR 116 N 0.65 0.87 -0.98 -3.82 0.05 -1.01 -1.50 116.97 111.22 2fsq h TYR 116 Ca 0.26 -0.36 0.14 0.00 0.05 0.00 0.00 58.73 58.81 2fsq h TYR 116 Cb 0.12 -0.14 -0.09 0.00 1.01 0.00 0.00 36.73 37.62 2fsq h TYR 116 CO -0.08 1.16 0.61 -0.09 -1.05 0.00 0.00 178.16 178.71 2fsq h ARG 117 N 0.33 0.88 -0.06 4.88 2.43 -0.60 0.43 114.38 122.68 2fsq h ARG 117 Ca -0.03 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 2fsq h ARG 117 Cb 1.20 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2fsq h ARG 117 CO 0.12 0.58 -0.03 0.22 -1.51 0.00 0.00 179.97 179.35 2fsq h ASP 118 N 0.91 0.13 -0.60 -3.80 3.58 -1.33 -3.05 116.42 112.25 2fsq h ASP 118 Ca 0.51 -0.42 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 2fsq h ASP 118 Cb 0.58 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 2fsq h ASP 118 CO -0.30 0.52 0.24 0.03 -2.88 0.00 0.00 179.24 176.85 2fsq h ARG 119 N -0.27 0.94 0.00 0.28 3.08 -0.58 -2.65 114.38 115.18 2fsq h ARG 119 Ca 0.01 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2fsq h ARG 119 Cb 0.47 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2fsq h ARG 119 CO 0.01 0.78 0.00 1.28 -1.07 0.00 0.00 179.97 180.97 2fsq n LEU 120 N -4.30 0.00 0.08 3.04 4.77 0.15 -3.43 117.00 117.30 2fsq n LEU 120 Ca 0.05 0.13 0.06 0.00 -0.03 0.00 0.00 56.01 56.23 2fsq n LEU 120 Cb 0.18 -0.13 0.51 0.00 -2.33 0.00 0.00 43.42 41.64 2fsq n LEU 120 CO 0.39 -0.01 1.14 0.77 -1.33 0.00 0.00 177.39 178.35 2fsq h SER 121 N 0.00 0.30 -0.57 -1.43 4.64 -1.35 -2.58 113.55 112.55 2fsq h SER 121 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2fsq h SER 121 Cb 0.12 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2fsq h SER 121 CO 0.00 0.21 0.00 0.35 -0.87 0.00 0.00 176.83 176.52 2fsq n THR 122 N -4.49 2.01 -1.70 2.95 -2.24 -1.22 -5.00 114.28 104.59 2fsq n THR 122 Ca 0.02 -1.30 -0.44 0.00 -2.27 0.00 0.00 64.05 60.06 2fsq n THR 122 Cb 0.11 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 2fsq n THR 122 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2fsq n PHE 123 N 0.82 2.48 -1.65 4.78 7.35 -0.97 -4.95 117.46 125.31 2fsq n PHE 123 Ca 0.25 0.23 -0.31 0.00 -0.76 0.00 0.00 57.45 56.86 2fsq n PHE 123 Cb 0.92 -2.57 0.04 0.00 0.35 0.00 0.00 39.48 38.22 2fsq n PHE 123 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2fsq s PRO 124 N 0.50 2.99 -0.12 -7.13 0.04 -1.26 -4.98 135.00 125.04 2fsq s PRO 124 Ca 0.73 1.01 -0.29 0.00 0.04 0.00 0.00 61.00 62.49 2fsq s PRO 124 Cb -0.60 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 31.92 2fsq s PRO 124 CO 0.40 -1.06 1.34 0.99 0.04 0.00 0.00 177.00 178.71 2fsq s THR 125 N -2.93 4.10 0.21 1.26 2.01 -1.26 -5.03 115.64 114.01 2fsq s THR 125 Ca 0.59 1.36 0.11 0.00 0.31 0.00 0.00 61.69 64.06 2fsq s THR 125 Cb -0.14 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2fsq s THR 125 CO 0.51 -0.10 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.40 2fsq s LEU 126 N 3.37 2.61 0.63 4.42 1.43 -1.26 -5.12 118.68 124.77 2fsq s LEU 126 Ca 0.59 -0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 52.69 2fsq s LEU 126 Cb -0.25 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.67 2fsq s LEU 126 CO 0.19 0.10 1.20 -2.84 0.23 0.00 0.00 176.35 175.23 2fsq s PRO 127 N -2.91 2.77 0.66 1.29 0.02 -1.26 -4.99 135.00 130.58 2fsq s PRO 127 Ca 0.24 1.79 -0.15 0.00 0.02 0.00 0.00 61.00 62.89 2fsq s PRO 127 Cb -0.07 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.54 2fsq s PRO 127 CO 0.12 -1.36 1.14 0.00 -0.33 0.00 0.00 177.00 176.58 2fsq s ALA 128 N -1.72 2.41 0.10 -1.55 0.00 -1.26 -4.94 121.76 114.79 2fsq s ALA 128 Ca 0.76 0.66 0.04 0.00 0.00 0.00 0.00 51.96 53.43 2fsq s ALA 128 Cb -0.30 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 2fsq s ALA 128 CO 0.36 -1.37 -0.11 -0.59 0.00 0.00 0.00 175.76 174.06 2fsq s PHE 129 N -2.18 1.13 0.53 0.00 -0.12 -1.26 -5.01 117.98 111.07 2fsq s PHE 129 Ca 0.69 -0.63 0.02 0.00 -0.05 0.00 0.00 56.93 56.96 2fsq s PHE 129 Cb -0.23 -0.61 0.01 0.00 -0.63 0.00 0.00 43.02 41.56 2fsq s PHE 129 CO 0.41 0.03 0.11 -0.80 -0.05 0.00 0.00 175.22 174.92 2fsq s ASN 130 N -2.42 4.28 -0.16 1.98 0.01 -1.26 -5.08 114.94 112.29 2fsq s ASN 130 Ca 0.06 -1.59 -0.31 0.00 -0.71 0.00 0.00 52.86 50.31 2fsq s ASN 130 Cb -0.04 0.61 0.14 0.00 0.41 0.00 0.00 41.25 42.38 2fsq s ASN 130 CO 0.01 -0.97 1.10 0.00 -1.51 0.00 0.00 177.10 175.72 2fsq s ARG 132 N -4.01 0.46 0.28 -0.60 1.70 0.68 -0.57 118.95 116.90 2fsq s ARG 132 Ca 0.10 -0.02 -0.29 0.00 -0.47 0.00 0.00 55.73 55.05 2fsq s ARG 132 Cb -0.00 0.22 -0.09 0.00 -0.57 0.00 0.00 34.95 34.50 2fsq s ARG 132 CO 0.06 -0.17 0.98 0.08 -1.08 0.00 0.00 175.30 175.16 2fsq s VAL 133 N -1.78 3.98 0.00 4.99 1.01 -1.26 -0.97 120.40 126.36 2fsq s VAL 133 Ca 0.04 1.87 0.00 0.00 0.00 0.00 0.00 61.98 63.90 2fsq s VAL 133 Cb -0.01 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.23 2fsq s VAL 133 CO -0.04 0.36 0.00 0.35 0.00 0.00 0.00 175.10 175.77 2fsq n THR 134 N 1.11 0.00 -3.51 3.92 -2.24 0.21 -4.89 114.28 108.88 2fsq n THR 134 Ca -0.00 -0.18 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 2fsq n THR 134 Cb 0.47 0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 69.36 2fsq n THR 134 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2fsq s GLY 135 N -1.06 -0.48 -0.01 3.38 0.00 -1.12 -4.98 107.32 103.05 2fsq s GLY 135 Ca 0.00 0.28 0.03 0.00 0.00 0.00 0.00 44.72 45.03 2fsq s GLY 135 CO 0.00 0.02 -0.09 1.08 0.00 0.00 0.00 173.10 174.11 2fsq s LEU 136 N -2.78 1.96 0.18 0.66 1.43 -1.26 -0.88 118.68 117.99 2fsq s LEU 136 Ca 0.03 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.98 2fsq s LEU 136 Cb -0.01 -0.47 -0.05 0.00 0.03 0.00 0.00 46.19 45.69 2fsq s LEU 136 CO -0.11 0.10 0.00 -0.13 0.23 0.00 0.00 176.35 176.44 2fsq s ARG 137 N -0.11 1.14 0.54 1.70 0.52 -0.11 -4.96 118.95 117.65 2fsq s ARG 137 Ca 0.02 -1.55 0.27 0.00 -0.52 0.00 0.00 55.73 53.95 2fsq s ARG 137 Cb -0.05 -0.30 1.42 0.00 0.52 0.00 0.00 34.95 36.54 2fsq s ARG 137 CO -0.00 -0.13 1.97 -1.35 0.02 0.00 0.00 175.30 175.81 2fsq h PRO 138 N 2.67 0.00 0.00 3.54 0.11 -1.97 -1.09 132.00 135.26 2fsq h PRO 138 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2fsq h PRO 138 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2fsq h PRO 138 CO 0.63 0.00 -0.09 1.33 -0.21 0.00 0.00 178.00 179.66 2fsq n VAL 139 N -4.32 0.16 0.00 3.15 0.24 -1.26 -4.46 118.33 111.84 2fsq n VAL 139 Ca 0.11 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 2fsq n VAL 139 Cb 0.68 -0.42 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 2fsq n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fsq n GLY 140 N 1.45 0.39 3.31 7.63 0.00 -0.42 -0.01 105.19 117.53 2fsq n GLY 140 Ca 0.06 -0.12 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2fsq n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fsq s VAL 142 N 0.00 0.07 0.00 1.61 1.01 -0.06 -0.94 120.40 122.10 2fsq s VAL 142 Ca 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.54 2fsq s VAL 142 Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.53 2fsq s VAL 142 CO 0.00 -0.33 0.00 0.29 0.00 0.00 0.00 175.10 175.06 2fsq n LYS 144 N -0.19 0.00 -1.71 2.72 5.02 -0.15 -0.62 118.16 123.23 2fsq n LYS 144 Ca -0.07 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.81 2fsq n LYS 144 Cb 0.63 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.65 2fsq n LYS 144 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fsq n GLY 145 N -0.24 0.66 0.36 0.72 0.00 -1.26 -0.23 105.19 105.20 2fsq n GLY 145 Ca 0.00 0.22 0.03 0.00 0.00 0.00 0.00 46.02 46.26 2fsq n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fsq h ALA 146 N 2.24 1.49 -2.14 4.61 0.00 -1.17 -3.41 119.26 120.88 2fsq h ALA 146 Ca -0.48 -0.04 -0.46 0.00 0.00 0.00 0.00 54.91 53.94 2fsq h ALA 146 Cb 1.29 -0.29 -0.14 0.00 0.00 0.00 0.00 17.79 18.64 2fsq h ALA 146 CO 0.61 0.42 -0.69 0.95 0.00 0.00 0.00 179.25 180.53 2fsq s THR 147 N -5.90 1.55 0.40 0.00 -4.23 -1.26 -4.93 115.64 101.28 2fsq s THR 147 Ca -0.11 -2.13 0.09 0.00 -1.18 0.00 0.00 61.69 58.36 2fsq s THR 147 Cb 0.19 -2.29 0.30 0.00 1.34 0.00 0.00 72.50 72.04 2fsq s THR 147 CO 0.79 -0.41 1.99 0.00 -0.54 0.00 0.00 174.62 176.46 2fsq h ALA 148 N 2.41 1.83 -0.71 3.99 0.00 -1.99 -0.70 119.26 124.08 2fsq h ALA 148 Ca -0.39 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 2fsq h ALA 148 Cb 1.23 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2fsq h ALA 148 CO 0.65 0.07 0.34 1.49 0.00 0.00 0.00 179.25 181.80 2fsq h GLU 149 N 0.57 1.02 -0.88 0.00 4.81 -1.96 -2.51 114.58 115.62 2fsq h GLU 149 Ca 0.26 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2fsq h GLU 149 Cb 0.29 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.43 2fsq h GLU 149 CO -0.08 0.79 0.58 -0.44 -0.73 0.00 0.00 179.01 179.12 2fsq h ASP 150 N 1.01 0.94 -0.80 1.04 3.32 -1.45 -1.17 116.42 119.31 2fsq h ASP 150 Ca 0.25 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.32 2fsq h ASP 150 Cb 0.11 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.39 2fsq h ASP 150 CO -0.03 0.64 0.51 0.44 -1.72 0.00 0.00 179.24 179.08 2fsq h ASP 151 N 1.08 0.83 -0.61 6.45 3.32 -1.24 -0.76 116.42 125.49 2fsq h ASP 151 Ca 0.35 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.31 2fsq h ASP 151 Cb 0.04 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2fsq h ASP 151 CO -0.11 0.57 0.04 -1.28 -1.72 0.00 0.00 179.24 176.74 2fsq h SER 152 N 0.98 1.03 -0.12 6.45 0.87 -1.19 -1.57 113.55 119.99 2fsq h SER 152 Ca 0.32 -0.27 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 2fsq h SER 152 Cb 0.04 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.72 2fsq h SER 152 CO -0.12 1.05 0.01 0.40 -0.53 0.00 0.00 176.83 177.64 2fsq h ILE 153 N 0.98 1.24 -0.01 2.23 2.04 -0.74 -2.10 117.51 121.14 2fsq h ILE 153 Ca 0.18 -0.76 -0.08 0.00 1.00 0.00 0.00 64.86 65.20 2fsq h ILE 153 Cb 0.51 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2fsq h ILE 153 CO 0.02 0.22 -0.36 1.62 0.00 0.00 0.00 178.15 179.65 2fsq h VAL 154 N -0.05 1.27 -0.38 1.67 3.04 -1.12 -1.40 116.25 119.28 2fsq h VAL 154 Ca 0.03 -1.27 -0.06 0.00 -1.01 0.00 0.00 66.70 64.39 2fsq h VAL 154 Cb 0.33 1.67 -0.02 0.00 -2.01 0.00 0.00 31.29 31.26 2fsq h VAL 154 CO 0.00 0.36 -0.03 0.00 -1.01 0.00 0.00 177.57 176.90 2fsq h ALA 155 N 1.61 1.24 -0.42 3.17 0.00 -1.11 -1.58 119.26 122.18 2fsq h ALA 155 Ca -0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 2fsq h ALA 155 Cb 0.66 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2fsq h ALA 155 CO 0.05 0.50 0.06 1.25 0.00 0.00 0.00 179.25 181.11 2fsq h LEU 156 N 0.58 0.67 -0.47 0.00 5.85 -0.57 0.12 115.31 121.48 2fsq h LEU 156 Ca 0.12 -0.26 0.08 0.00 0.84 0.00 0.00 57.88 58.66 2fsq h LEU 156 Cb 0.42 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 2fsq h LEU 156 CO 0.02 0.76 0.06 -0.50 -0.34 0.00 0.00 178.44 178.44 2fsq h TRP 157 N 0.54 0.08 -0.49 1.25 4.06 -0.98 -1.08 115.95 119.35 2fsq h TRP 157 Ca 0.13 0.03 -0.12 0.00 2.06 0.00 0.00 58.89 60.99 2fsq h TRP 157 Cb 0.38 0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.56 2fsq h TRP 157 CO 0.03 -0.04 -0.16 0.00 -3.56 0.00 0.00 178.44 174.70 2fsq h ARG 158 N 0.18 0.97 -0.66 0.49 3.08 -1.00 0.49 114.38 117.94 2fsq h ARG 158 Ca 0.24 -0.39 -0.05 0.00 0.07 0.00 0.00 59.98 59.85 2fsq h ARG 158 Cb 0.33 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 2fsq h ARG 158 CO -0.34 1.06 0.23 -0.44 -1.07 0.00 0.00 179.97 179.41 2fsq h ASP 159 N 0.82 0.91 -0.35 7.04 3.32 -0.80 -0.41 116.42 126.96 2fsq h ASP 159 Ca 0.12 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 56.91 2fsq h ASP 159 Cb 0.73 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 2fsq h ASP 159 CO 0.06 0.84 -0.22 0.74 -1.72 0.00 0.00 179.24 178.94 2fsq h THR 160 N 0.96 1.29 -0.67 0.35 2.02 -0.84 -2.78 112.91 113.24 2fsq h THR 160 Ca 0.22 -1.36 0.01 0.00 0.77 0.00 0.00 66.41 66.05 2fsq h THR 160 Cb 0.24 1.40 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 2fsq h THR 160 CO -0.01 0.45 0.44 -0.26 0.37 0.00 0.00 175.52 176.51 2fsq h PHE 161 N 0.55 0.83 -0.91 3.16 0.04 -0.50 -1.99 116.94 118.11 2fsq h PHE 161 Ca 0.07 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.87 2fsq h PHE 161 Cb 0.77 -0.28 -0.05 0.00 2.20 0.00 0.00 35.95 38.60 2fsq h PHE 161 CO 0.06 0.52 0.60 0.00 -0.60 0.00 0.00 178.31 178.89 2fsq h ALA 162 N 1.59 1.34 -0.39 2.45 0.00 -0.82 0.27 119.26 123.70 2fsq h ALA 162 Ca 0.25 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2fsq h ALA 162 Cb -0.08 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 2fsq h ALA 162 CO -0.06 0.61 0.16 -0.44 0.00 0.00 0.00 179.25 179.53 2fsq h ASP 163 N 1.24 0.53 -0.38 0.00 3.32 -1.13 0.46 116.42 120.46 2fsq h ASP 163 Ca 0.33 -0.16 -0.15 0.00 0.02 0.00 0.00 57.03 57.08 2fsq h ASP 163 Cb -0.13 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 2fsq h ASP 163 CO -0.07 0.54 -0.32 -0.26 -1.72 0.00 0.00 179.24 177.41 2fsq h PHE 164 N 0.49 1.08 0.00 4.55 -1.00 -0.91 -3.23 116.94 117.91 2fsq h PHE 164 Ca 0.13 -0.30 -0.10 0.00 2.81 0.00 0.00 57.97 60.51 2fsq h PHE 164 Cb 0.17 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.48 2fsq h PHE 164 CO -0.00 1.11 -0.49 0.74 -1.61 0.00 0.00 178.31 178.06 2fsq h PHE 165 N 0.76 0.00 -0.22 -0.55 0.04 -0.46 -3.48 116.94 113.03 2fsq h PHE 165 Ca 0.08 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.81 2fsq h PHE 165 Cb 0.90 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.04 2fsq h PHE 165 CO 0.06 0.49 -0.05 0.41 -0.60 0.00 0.00 178.31 178.62 2fsq n GLY 166 N 1.19 0.38 3.67 -1.45 0.00 0.15 -4.45 105.19 104.66 2fsq n GLY 166 Ca 0.02 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 45.08 2fsq n GLY 166 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2fsq s TYR 167 N -2.09 -0.11 -0.11 1.61 -0.85 -1.20 -4.20 117.35 110.39 2fsq s TYR 167 Ca 0.00 -0.28 -0.06 0.00 -0.52 0.00 0.00 57.07 56.21 2fsq s TYR 167 Cb 0.00 0.51 0.05 0.00 0.38 0.00 0.00 41.96 42.90 2fsq s TYR 167 CO 0.00 -1.06 0.27 -0.98 -1.52 0.00 0.00 175.55 172.26 2fsq s ARG 168 N -3.91 0.24 0.78 -3.49 1.70 -1.26 -4.59 118.95 108.43 2fsq s ARG 168 Ca 0.11 0.55 -0.10 0.00 -0.47 0.00 0.00 55.73 55.82 2fsq s ARG 168 Cb -0.03 -0.09 0.06 0.00 -0.57 0.00 0.00 34.95 34.33 2fsq s ARG 168 CO 0.02 -0.15 1.09 -1.01 -1.08 0.00 0.00 175.30 174.18 2fsq s HIS 169 N 1.18 2.52 0.41 5.89 3.76 -1.26 -4.89 115.29 122.91 2fsq s HIS 169 Ca -0.09 1.56 0.15 0.00 -0.15 0.00 0.00 55.06 56.54 2fsq s HIS 169 Cb -0.09 -3.06 1.03 0.00 1.11 0.00 0.00 32.58 31.56 2fsq s HIS 169 CO -0.08 -1.87 1.89 -1.35 -0.85 0.00 0.00 174.74 172.48 2fsq h PRO 170 N -1.18 0.44 -0.68 8.40 0.11 -2.02 -1.39 132.00 135.67 2fsq h PRO 170 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2fsq h PRO 170 Cb 1.23 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2fsq h PRO 170 CO 0.51 0.29 0.00 -0.40 -0.21 0.00 0.00 178.00 178.19 2fsq n ASP 171 N -4.50 3.04 -0.18 -2.05 5.75 -1.26 -4.63 116.55 112.71 2fsq n ASP 171 Ca 0.17 -2.35 -0.01 0.00 -0.01 0.00 0.00 54.79 52.58 2fsq n ASP 171 Cb 0.59 -0.51 0.06 0.00 -1.03 0.00 0.00 41.12 40.23 2fsq n ASP 171 CO 0.00 0.00 0.00 -0.74 -0.11 0.00 0.00 177.20 176.35 2fsq h HIS 172 N 2.06 -0.19 0.00 2.11 2.76 -1.60 0.02 115.15 120.30 2fsq h HIS 172 Ca 0.00 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2fsq h HIS 172 Cb 1.06 0.17 0.00 0.00 1.55 0.00 0.00 27.41 30.19 2fsq h HIS 172 CO 0.48 -0.20 -0.24 -0.25 -1.30 0.00 0.00 177.93 176.41 2fsq n ASP 173 N -5.34 0.50 -0.67 3.26 8.00 -1.26 -3.58 116.55 117.46 2fsq n ASP 173 Ca 0.06 0.29 0.06 0.00 0.71 0.00 0.00 54.79 55.91 2fsq n ASP 173 Cb 0.30 -0.29 0.20 0.00 -0.02 0.00 0.00 41.12 41.32 2fsq n ASP 173 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2fsq n THR 174 N -1.87 2.22 -1.71 -3.53 -2.24 -0.35 -5.07 114.28 101.74 2fsq n THR 174 Ca 0.05 -2.40 -0.43 0.00 -2.27 0.00 0.00 64.05 59.00 2fsq n THR 174 Cb 0.39 -0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.32 2fsq n THR 174 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fsq n TYR 175 N -1.03 2.61 -3.25 4.78 9.36 -0.15 -4.96 117.16 124.52 2fsq n TYR 175 Ca 0.22 0.18 -0.43 0.00 3.32 0.00 0.00 57.90 61.19 2fsq n TYR 175 Cb 0.82 -2.61 -0.08 0.00 -0.63 0.00 0.00 39.34 36.85 2fsq n TYR 175 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2fsq s GLU 176 N 0.59 3.18 0.38 2.98 2.12 -1.26 -5.06 118.70 121.63 2fsq s GLU 176 Ca 0.73 -0.61 -0.26 0.00 0.36 0.00 0.00 54.97 55.19 2fsq s GLU 176 Cb -0.56 -3.96 -0.09 0.00 0.26 0.00 0.00 34.13 29.79 2fsq s GLU 176 CO 0.39 -0.90 1.20 -0.06 -0.54 0.00 0.00 175.26 175.35 2fsq s PHE 177 N 2.38 3.06 0.13 5.30 0.08 -1.26 -5.03 117.98 122.64 2fsq s PHE 177 Ca 0.16 1.53 -0.24 0.00 0.12 0.00 0.00 56.93 58.49 2fsq s PHE 177 Cb -0.16 -3.46 0.08 0.00 -0.57 0.00 0.00 43.02 38.91 2fsq s PHE 177 CO 0.15 -1.44 0.67 -3.38 -0.10 0.00 0.00 175.22 171.13 2fsq s HIS 178 N -1.34 -0.48 -0.19 0.36 -3.43 -1.26 -4.55 115.29 104.39 2fsq s HIS 178 Ca 0.55 0.28 -0.02 0.00 -0.80 0.00 0.00 55.06 55.07 2fsq s HIS 178 Cb -0.33 0.56 -0.01 0.00 -1.43 0.00 0.00 32.58 31.38 2fsq s HIS 178 CO 0.42 -0.79 -0.09 0.42 -2.00 0.00 0.00 174.74 172.70 2fsq s ILE 179 N -3.61 3.11 -0.09 -5.38 1.01 -1.26 -4.07 121.20 110.92 2fsq s ILE 179 Ca 0.02 -0.59 -0.30 0.00 0.00 0.00 0.00 60.65 59.78 2fsq s ILE 179 Cb -0.01 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 2fsq s ILE 179 CO -0.11 0.47 1.06 -0.89 0.00 0.00 0.00 174.94 175.46 2fsq s THR 180 N 1.17 4.65 -0.17 2.92 2.01 -1.26 -4.36 115.64 120.59 2fsq s THR 180 Ca 0.02 1.93 0.17 0.00 0.31 0.00 0.00 61.69 64.12 2fsq s THR 180 Cb -0.14 -4.24 -0.25 0.00 0.01 0.00 0.00 72.50 67.88 2fsq s THR 180 CO -0.03 0.00 0.17 0.18 -0.69 0.00 0.00 174.62 174.26 2fsq n LEU 181 N 5.05 0.13 -3.82 4.42 4.77 0.98 -4.77 117.00 123.75 2fsq n LEU 181 Ca 0.09 0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 56.05 2fsq n LEU 181 Cb 0.48 0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 41.98 2fsq n LEU 181 CO 0.53 0.47 0.40 -0.94 -1.33 0.00 0.00 177.39 176.51 2fsq s SER 182 N -5.54 -0.27 0.01 -1.43 1.04 -0.91 -2.85 113.70 103.76 2fsq s SER 182 Ca -0.09 -0.58 0.05 0.00 0.48 0.00 0.00 55.95 55.81 2fsq s SER 182 Cb 0.07 0.68 -0.03 0.00 0.10 0.00 0.00 66.02 66.84 2fsq s SER 182 CO 0.83 -1.25 -0.14 -0.31 0.98 0.00 0.00 173.24 173.35 2fsq s TYR 183 N -3.91 2.67 -0.13 5.02 2.02 -0.07 -4.54 117.35 118.41 2fsq s TYR 183 Ca 0.11 -0.18 -0.29 0.00 -0.37 0.00 0.00 57.07 56.34 2fsq s TYR 183 Cb -0.04 -1.54 -0.02 0.00 -0.40 0.00 0.00 41.96 39.96 2fsq s TYR 183 CO 0.04 0.27 1.30 0.42 -1.57 0.00 0.00 175.55 176.01 2fsq s ILE 184 N -0.90 4.17 -0.13 2.71 -1.09 -1.26 -0.54 121.20 124.14 2fsq s ILE 184 Ca 0.15 1.43 -0.07 0.00 -2.23 0.00 0.00 60.65 59.94 2fsq s ILE 184 Cb -0.11 -3.92 -0.25 0.00 -1.58 0.00 0.00 42.46 36.60 2fsq s ILE 184 CO 0.05 -0.10 0.31 0.52 -1.23 0.00 0.00 174.94 174.49 2fsq n VAL 185 N 5.23 1.75 -3.91 2.92 0.31 0.18 -4.80 118.33 120.01 2fsq n VAL 185 Ca 0.14 -0.63 -0.11 0.00 -0.01 0.00 0.00 64.34 63.73 2fsq n VAL 185 Cb 0.45 -1.72 -0.12 0.00 -0.91 0.00 0.00 33.84 31.53 2fsq n VAL 185 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2fsq s SER 186 N -7.00 0.09 0.63 4.52 1.04 -1.15 -4.56 113.70 107.27 2fsq s SER 186 Ca -0.24 -0.20 -0.17 0.00 0.48 0.00 0.00 55.95 55.82 2fsq s SER 186 Cb 0.07 0.07 -0.02 0.00 0.10 0.00 0.00 66.02 66.24 2fsq s SER 186 CO 0.75 -0.15 1.19 0.26 0.98 0.00 0.00 173.24 176.27 2fsq s TRP 187 N -0.67 2.37 0.07 5.02 0.52 -1.26 -4.89 118.94 120.10 2fsq s TRP 187 Ca -0.07 1.54 -0.23 0.00 0.02 0.00 0.00 56.10 57.36 2fsq s TRP 187 Cb -0.05 -3.42 -0.06 0.00 -1.15 0.00 0.00 33.47 28.79 2fsq s TRP 187 CO -0.00 -2.18 0.69 -0.06 0.02 0.00 0.00 176.95 175.41 2fsq s PHE 188 N -1.79 3.78 0.35 -1.98 0.40 -0.09 -4.68 117.98 113.96 2fsq s PHE 188 Ca 0.75 1.42 -0.28 0.00 -0.60 0.00 0.00 56.93 58.21 2fsq s PHE 188 Cb -0.28 -2.70 -0.11 0.00 0.51 0.00 0.00 43.02 40.44 2fsq s PHE 188 CO 0.36 0.41 1.44 -1.21 0.70 0.00 0.00 175.22 176.93 2fsq s GLU 189 N -0.57 4.19 0.56 0.44 0.41 -1.26 -1.16 118.70 121.31 2fsq s GLU 189 Ca 0.34 2.46 0.24 0.00 -0.41 0.00 0.00 54.97 57.61 2fsq s GLU 189 Cb -0.20 -3.01 1.58 0.00 -1.78 0.00 0.00 34.13 30.72 2fsq s GLU 189 CO 0.22 -0.44 2.18 -1.00 -0.49 0.00 0.00 175.26 175.73 2fsq h PRO 190 N 3.36 0.00 -0.98 0.39 0.13 -1.96 -3.06 132.00 129.87 2fsq h PRO 190 Ca -0.50 0.00 0.19 0.00 -0.87 0.00 0.00 66.00 64.82 2fsq h PRO 190 Cb 1.23 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.25 2fsq h PRO 190 CO 0.66 0.00 0.58 1.49 -0.23 0.00 0.00 178.00 180.50 2fsq h GLU 191 N 0.00 0.69 -0.00 0.86 4.81 -2.05 -1.90 114.58 116.98 2fsq h GLU 191 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2fsq h GLU 191 Cb 0.13 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2fsq h GLU 191 CO -0.00 0.46 -0.15 0.00 -0.73 0.00 0.00 179.01 178.59 2fsq h LEU 193 N 0.59 0.69 -1.43 0.00 3.38 -1.51 -2.39 115.31 114.64 2fsq h LEU 193 Ca 0.00 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.73 2fsq h LEU 193 Cb 0.40 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2fsq h LEU 193 CO 0.00 0.81 0.44 -0.65 0.09 0.00 0.00 178.44 179.14 2fsq h PRO 194 N 0.54 0.69 -0.19 1.13 0.11 -1.78 0.11 132.00 132.62 2fsq h PRO 194 Ca 0.12 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.16 2fsq h PRO 194 Cb 0.45 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 2fsq h PRO 194 CO 0.02 0.46 0.02 -0.09 -0.21 0.00 0.00 178.00 178.19 2fsq h ARG 195 N 0.71 0.33 -0.65 1.05 2.43 -1.80 -1.28 114.38 115.16 2fsq h ARG 195 Ca 0.28 -0.10 0.05 0.00 -0.81 0.00 0.00 59.98 59.40 2fsq h ARG 195 Cb 0.22 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 2fsq h ARG 195 CO -0.09 0.51 0.37 -1.49 -1.51 0.00 0.00 179.97 177.76 2fsq h TRP 196 N 0.10 0.69 -0.76 2.20 4.06 -0.91 -2.57 115.95 118.76 2fsq h TRP 196 Ca 0.06 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.03 2fsq h TRP 196 Cb 0.35 -0.22 -0.04 0.00 -1.00 0.00 0.00 29.16 28.26 2fsq h TRP 196 CO 0.03 0.36 0.48 0.37 -3.56 0.00 0.00 178.44 176.12 2fsq h GLN 197 N 0.71 1.01 -0.66 0.49 5.75 -0.56 0.19 115.11 122.03 2fsq h GLN 197 Ca 0.28 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.71 2fsq h GLN 197 Cb 0.12 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 28.45 2fsq h GLN 197 CO -0.15 0.69 0.00 0.00 -2.65 0.00 0.00 178.83 176.72 2fsq n ALA 198 N -2.32 1.39 0.00 3.38 0.00 -0.50 -1.17 120.51 121.28 2fsq n ALA 198 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2fsq n ALA 198 Cb 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2fsq n ALA 198 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2fsq n LEU 200 N 0.56 0.00 -0.04 0.00 4.77 0.65 -1.90 117.00 121.04 2fsq n LEU 200 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 2fsq n LEU 200 Cb 0.06 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 2fsq n LEU 200 CO 0.00 0.00 0.82 0.44 -1.33 0.00 0.00 177.39 177.32 2fsq h ASP 201 N 0.00 0.22 -0.38 -1.43 3.32 -1.38 0.11 116.42 116.88 2fsq h ASP 201 Ca 0.00 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 2fsq h ASP 201 Cb 0.00 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2fsq h ASP 201 CO 0.00 0.35 0.05 -0.08 -1.72 0.00 0.00 179.24 177.84 2fsq h GLU 202 N 0.08 0.64 -0.08 3.56 4.81 -1.63 -2.75 114.58 119.21 2fsq h GLU 202 Ca 0.05 -0.18 -0.14 0.00 -0.13 0.00 0.00 59.36 58.97 2fsq h GLU 202 Cb 0.21 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2fsq h GLU 202 CO -0.00 0.71 -0.55 0.93 -0.73 0.00 0.00 179.01 179.36 2fsq h GLU 203 N 0.48 0.23 -0.29 1.92 4.39 -1.80 -2.29 114.58 117.21 2fsq h GLU 203 Ca 0.11 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 2fsq h GLU 203 Cb 0.39 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 2fsq h GLU 203 CO 0.01 0.72 0.18 1.25 -1.16 0.00 0.00 179.01 180.01 2fsq h LEU 204 N 0.18 0.34 -0.31 1.33 5.85 -0.87 0.67 115.31 122.50 2fsq h LEU 204 Ca 0.00 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2fsq h LEU 204 Cb 1.03 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 2fsq h LEU 204 CO 0.09 0.28 0.16 -0.08 -0.34 0.00 0.00 178.44 178.55 2fsq h GLU 205 N 0.38 0.43 -0.75 1.25 4.57 -1.34 -0.65 114.58 118.47 2fsq h GLU 205 Ca 0.10 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2fsq h GLU 205 Cb -0.00 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.47 2fsq h GLU 205 CO -0.02 0.38 0.49 -0.22 -1.18 0.00 0.00 179.01 178.47 2fsq h LYS 206 N 0.37 0.98 -0.40 1.92 3.64 -1.23 -2.06 116.57 119.79 2fsq h LYS 206 Ca 0.11 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 2fsq h LYS 206 Cb 0.08 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2fsq h LYS 206 CO -0.02 0.65 -0.05 1.25 -2.27 0.00 0.00 179.45 179.01 2fsq h LEU 207 N 1.01 0.73 -1.46 5.20 5.85 -0.61 -1.52 115.31 124.51 2fsq h LEU 207 Ca 0.28 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2fsq h LEU 207 Cb -0.11 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2fsq h LEU 207 CO -0.06 0.90 0.36 0.03 -0.34 0.00 0.00 178.44 179.32 2fsq h ARG 208 N 0.56 0.72 -0.12 1.25 3.08 -0.79 0.24 114.38 119.31 2fsq h ARG 208 Ca 0.11 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.96 2fsq h ARG 208 Cb 0.55 -0.16 0.01 0.00 0.08 0.00 0.00 29.97 30.45 2fsq h ARG 208 CO 0.03 0.48 -0.53 0.28 -1.07 0.00 0.00 179.97 179.16 2fsq h VAL 209 N 0.74 1.35 0.00 2.04 2.07 -1.24 -2.74 116.25 118.47 2fsq h VAL 209 Ca 0.20 -1.83 -0.13 0.00 0.82 0.00 0.00 66.70 65.76 2fsq h VAL 209 Cb -0.08 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 2fsq h VAL 209 CO -0.04 0.56 -0.64 0.00 0.02 0.00 0.00 177.57 177.47 2fsq h ALA 210 N 0.50 0.87 -2.04 1.67 0.00 -0.85 -3.37 119.26 116.04 2fsq h ALA 210 Ca -0.03 -0.58 -0.56 0.00 0.00 0.00 0.00 54.91 53.74 2fsq h ALA 210 Cb 1.17 -0.10 -0.38 0.00 0.00 0.00 0.00 17.79 18.48 2fsq h ALA 210 CO 0.11 0.80 -1.07 0.00 0.00 0.00 0.00 179.25 179.09 2fsq n ALA 211 N -2.39 2.45 0.28 0.00 0.00 0.81 -4.76 120.51 116.90 2fsq n ALA 211 Ca -0.01 -3.31 0.15 0.00 0.00 0.00 0.00 53.44 50.28 2fsq n ALA 211 Cb 0.65 -0.81 0.77 0.00 0.00 0.00 0.00 19.45 20.07 2fsq n ALA 211 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2fsq h PRO 212 N 4.32 0.00 -6.86 0.00 0.13 -1.66 -3.39 132.00 124.54 2fsq h PRO 212 Ca 0.11 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.55 2fsq h PRO 212 Cb 0.89 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 31.79 2fsq h PRO 212 CO 0.44 0.08 -0.87 0.54 -0.23 0.00 0.00 178.00 177.96 2fsq s VAL 213 N -4.00 2.22 -0.63 1.56 0.11 -1.26 -4.71 120.40 113.69 2fsq s VAL 213 Ca -0.02 -1.71 -0.18 0.00 -2.93 0.00 0.00 61.98 57.14 2fsq s VAL 213 Cb 0.12 -1.96 0.12 0.00 -1.53 0.00 0.00 36.38 33.13 2fsq s VAL 213 CO 0.55 0.11 0.69 -0.63 -3.33 0.00 0.00 175.10 172.49 2fsq s ILE 214 N -1.04 4.99 0.82 7.04 -1.09 -1.26 -4.92 121.20 125.74 2fsq s ILE 214 Ca 0.13 -1.32 -0.13 0.00 -2.23 0.00 0.00 60.65 57.11 2fsq s ILE 214 Cb -0.10 -4.47 0.09 0.00 -1.58 0.00 0.00 42.46 36.40 2fsq s ILE 214 CO 0.06 -1.08 1.18 -1.58 -1.23 0.00 0.00 174.94 172.28 2fsq s GLN 215 N 2.15 1.62 0.45 2.79 0.74 -1.26 -4.94 119.66 121.22 2fsq s GLN 215 Ca 0.11 1.65 -0.04 0.00 0.05 0.00 0.00 55.36 57.14 2fsq s GLN 215 Cb -0.23 -1.78 -0.03 0.00 1.10 0.00 0.00 33.01 32.07 2fsq s GLN 215 CO 0.03 -2.20 0.73 1.03 -0.55 0.00 0.00 175.29 174.32 2fsq s ARG 217 N -4.29 3.46 0.78 1.67 1.81 0.62 -4.16 118.95 118.83 2fsq s ARG 217 Ca 0.71 0.02 -0.14 0.00 -1.72 0.00 0.00 55.73 54.60 2fsq s ARG 217 Cb -0.26 -2.45 0.07 0.00 -0.45 0.00 0.00 34.95 31.86 2fsq s ARG 217 CO 0.52 -0.16 1.19 -2.14 -0.68 0.00 0.00 175.30 174.03 2fsq s PRO 218 N -4.65 1.84 0.47 3.54 0.02 -1.26 -4.58 135.00 130.39 2fsq s PRO 218 Ca 0.46 1.70 -0.24 0.00 0.02 0.00 0.00 61.00 62.94 2fsq s PRO 218 Cb -0.10 -1.80 -0.08 0.00 0.02 0.00 0.00 34.50 32.54 2fsq s PRO 218 CO 0.42 -2.05 1.38 -2.30 -0.33 0.00 0.00 177.00 174.13 2fsq n PRO 219 N -3.13 2.04 -3.84 5.54 -0.02 -1.26 -4.68 135.00 129.65 2fsq n PRO 219 Ca 0.13 0.73 -0.12 0.00 -2.02 0.00 0.00 63.50 62.22 2fsq n PRO 219 Cb 0.51 -2.57 -0.14 0.00 -0.02 0.00 0.00 33.50 31.28 2fsq n PRO 219 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fsq s ALA 220 N -1.22 -0.14 -0.07 3.55 0.00 -0.32 -0.56 121.76 123.00 2fsq s ALA 220 Ca 0.64 0.21 -0.30 0.00 0.00 0.00 0.00 51.96 52.52 2fsq s ALA 220 Cb -0.45 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 2fsq s ALA 220 CO 0.55 -0.04 1.05 0.12 0.00 0.00 0.00 175.76 177.44 2fsq s PHE 221 N 0.17 3.47 0.14 0.00 5.36 0.64 -1.26 117.98 126.51 2fsq s PHE 221 Ca -0.01 1.52 0.05 0.00 -0.96 0.00 0.00 56.93 57.53 2fsq s PHE 221 Cb -0.02 -3.24 -0.04 0.00 -0.34 0.00 0.00 43.02 39.38 2fsq s PHE 221 CO -0.00 -0.47 -0.12 0.00 -1.46 0.00 0.00 175.22 173.16 2fsq s GLU 223 N -3.29 1.95 -0.00 0.00 -1.05 -0.61 -1.38 118.70 114.32 2fsq s GLU 223 Ca 0.14 -1.45 -0.11 0.00 -0.15 0.00 0.00 54.97 53.40 2fsq s GLU 223 Cb -0.01 -2.03 0.01 0.00 -0.44 0.00 0.00 34.13 31.67 2fsq s GLU 223 CO 0.02 0.39 0.23 -0.59 0.95 0.00 0.00 175.26 176.26 2fsq s PHE 224 N -2.01 -0.07 -0.22 4.83 -0.12 -0.60 -1.00 117.98 118.78 2fsq s PHE 224 Ca 0.27 0.07 0.22 0.00 -0.05 0.00 0.00 56.93 57.44 2fsq s PHE 224 Cb -0.07 0.03 -0.16 0.00 -0.63 0.00 0.00 43.02 42.19 2fsq s PHE 224 CO 0.15 -0.35 0.77 0.36 -0.05 0.00 0.00 175.22 176.11 2fsq n LYS 225 N 1.33 0.56 0.00 1.99 2.85 -1.26 -1.48 118.16 122.15 2fsq n LYS 225 Ca -0.22 -0.05 0.00 0.00 -1.05 0.00 0.00 58.31 56.99 2fsq n LYS 225 Cb 0.56 -1.64 0.00 0.00 -0.65 0.00 0.00 35.03 33.30 2fsq n LYS 225 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2fsq n ASP 226 N -2.33 0.00 0.00 -5.58 5.68 -1.26 -0.79 116.55 112.27 2fsq n ASP 226 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.28 2fsq n ASP 226 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 2fsq n ASP 226 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2fsq n ASN 228 N 0.00 0.00 -3.63 -1.12 5.03 -1.26 -4.82 115.26 109.45 2fsq n ASN 228 Ca 0.00 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.33 2fsq n ASN 228 Cb 0.00 -0.37 -0.07 0.00 -1.02 0.00 0.00 39.78 38.32 2fsq n ASN 228 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 2fsq s HIS 229 N -0.10 -0.83 -0.25 3.10 5.04 -1.26 -4.45 115.29 116.54 2fsq s HIS 229 Ca 0.00 1.91 0.01 0.00 -1.54 0.00 0.00 55.06 55.44 2fsq s HIS 229 Cb 0.00 0.37 0.07 0.00 0.04 0.00 0.00 32.58 33.06 2fsq s HIS 229 CO 0.00 -0.41 -0.04 -0.06 -2.34 0.00 0.00 174.74 171.90 2fsq s PHE 230 N 0.71 2.48 -0.22 3.88 0.08 -1.26 -4.37 117.98 119.28 2fsq s PHE 230 Ca -0.03 -1.86 -0.23 0.00 0.12 0.00 0.00 56.93 54.93 2fsq s PHE 230 Cb -0.05 -1.70 -0.01 0.00 -0.57 0.00 0.00 43.02 40.69 2fsq s PHE 230 CO -0.05 -0.80 0.75 0.21 -0.10 0.00 0.00 175.22 175.23 2fsq s LYS 231 N 1.36 4.19 0.02 0.44 2.20 -0.17 -4.89 119.74 122.90 2fsq s LYS 231 Ca -0.04 0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 56.07 2fsq s LYS 231 Cb -0.19 -3.62 -0.05 0.00 -1.51 0.00 0.00 37.83 32.46 2fsq s LYS 231 CO -0.07 -0.41 1.30 -1.21 -0.36 0.00 0.00 175.35 174.60 2fsq s GLU 232 N 2.46 4.34 -0.14 4.03 2.02 -1.26 -1.57 118.70 128.58 2fsq s GLU 232 Ca 0.32 1.87 -0.02 0.00 0.02 0.00 0.00 54.97 57.16 2fsq s GLU 232 Cb -0.16 -3.46 -0.08 0.00 0.10 0.00 0.00 34.13 30.54 2fsq s GLU 232 CO 0.09 -0.44 -0.14 1.28 0.02 0.00 0.00 175.26 176.07 2fsq n LEU 233 N 4.72 2.34 -3.81 1.80 4.77 0.91 -4.98 117.00 122.75 2fsq n LEU 233 Ca 0.11 0.01 -0.24 0.00 -0.03 0.00 0.00 56.01 55.86 2fsq n LEU 233 Cb 0.45 -0.46 -0.17 0.00 -2.33 0.00 0.00 43.42 40.90 2fsq n LEU 233 CO 0.57 0.59 -0.40 -0.69 -1.33 0.00 0.00 177.39 176.13 2fsq s VAL 234 N -2.27 0.59 -0.16 4.08 1.01 -0.91 -4.99 120.40 117.74 2fsq s VAL 234 Ca -0.19 -0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 2fsq s VAL 234 Cb 0.06 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.67 2fsq s VAL 234 CO 0.29 0.28 0.20 -0.69 0.00 0.00 0.00 175.10 175.18 2fsq s VAL 235 N 1.88 5.37 -1.05 2.92 1.01 -1.26 -0.26 120.40 129.02 2fsq s VAL 235 Ca 0.05 0.35 -0.03 0.00 0.00 0.00 0.00 61.98 62.35 2fsq s VAL 235 Cb -0.13 -3.53 0.31 0.00 0.00 0.00 0.00 36.38 33.04 2fsq s VAL 235 CO -0.06 0.46 1.51 0.49 0.00 0.00 0.00 175.10 177.49 2fsq n PHE 236 N 3.23 2.40 0.80 5.22 3.72 0.28 -5.01 117.46 128.10 2fsq n PHE 236 Ca -0.15 -2.65 0.10 0.00 -0.05 0.00 0.00 57.45 54.70 2fsq n PHE 236 Cb 0.52 -1.20 0.08 0.00 -0.94 0.00 0.00 39.48 37.94 2fsq n PHE 236 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31