#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xcq n ILE 2 N 0.00 0.00 -4.21 5.18 -6.64 -1.26 -4.92 119.36 107.51 1xcq n ILE 2 Ca 0.00 0.00 -0.16 0.00 -1.77 0.00 0.00 62.75 60.82 1xcq n ILE 2 Cb 0.00 0.00 -0.14 0.00 -1.44 0.00 0.00 39.64 38.06 1xcq n ILE 2 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 1xcq s VAL 3 N 0.00 0.56 0.11 7.28 1.01 -1.26 -4.83 120.40 123.27 1xcq s VAL 3 Ca 0.00 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1xcq s VAL 3 Cb 0.00 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1xcq s VAL 3 CO 0.00 0.04 -0.06 -0.04 0.00 0.00 0.00 175.10 175.04 1xcq s MET 4 N -0.48 2.27 -0.15 2.72 -1.94 -1.26 -3.05 119.30 117.41 1xcq s MET 4 Ca 0.00 -0.98 -0.04 0.00 -1.71 0.00 0.00 55.69 52.96 1xcq s MET 4 Cb -0.04 -2.38 0.06 0.00 2.01 0.00 0.00 34.83 34.48 1xcq s MET 4 CO -0.00 0.51 0.11 -1.12 -0.01 0.00 0.00 175.02 174.51 1xcq s SER 5 N -2.30 1.99 -0.08 3.03 0.01 0.21 -4.63 113.70 111.94 1xcq s SER 5 Ca 0.23 -0.43 -0.05 0.00 1.31 0.00 0.00 55.95 57.01 1xcq s SER 5 Cb -0.11 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 1xcq s SER 5 CO 0.16 -0.33 0.13 -1.10 0.41 0.00 0.00 173.24 172.50 1xcq s GLN 6 N 2.17 3.34 -0.23 12.44 -0.21 -1.26 -3.26 119.66 132.66 1xcq s GLN 6 Ca 0.03 -0.25 -0.18 0.00 0.02 0.00 0.00 55.36 54.98 1xcq s GLN 6 Cb -0.15 -3.08 0.06 0.00 1.00 0.00 0.00 33.01 30.84 1xcq s GLN 6 CO -0.08 0.73 0.59 -1.54 -2.12 0.00 0.00 175.29 172.87 1xcq s SER 7 N -1.29 -0.67 0.00 5.90 1.04 0.01 -4.57 113.70 114.12 1xcq s SER 7 Ca 0.18 1.22 0.00 0.00 0.48 0.00 0.00 55.95 57.84 1xcq s SER 7 Cb -0.12 1.19 0.00 0.00 0.10 0.00 0.00 66.02 67.19 1xcq s SER 7 CO 0.08 -0.21 0.00 -0.81 0.98 0.00 0.00 173.24 173.28 1xcq n PRO 8 N 3.28 1.13 0.00 4.02 -0.04 -1.26 -1.21 135.00 140.91 1xcq n PRO 8 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1xcq n PRO 8 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 1xcq n PRO 8 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1xcq n SER 9 N 0.00 0.00 -3.15 3.54 3.41 -1.26 -4.45 113.62 111.71 1xcq n SER 9 Ca 0.00 -0.87 0.05 0.00 -0.26 0.00 0.00 58.87 57.79 1xcq n SER 9 Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1xcq n SER 9 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1xcq s SER 10 N 0.00 -1.04 0.32 4.04 1.04 -1.25 -1.12 113.70 115.69 1xcq s SER 10 Ca 0.00 0.14 0.07 0.00 0.48 0.00 0.00 55.95 56.64 1xcq s SER 10 Cb 0.00 1.67 -0.02 0.00 0.10 0.00 0.00 66.02 67.77 1xcq s SER 10 CO 0.00 -0.19 0.37 -0.76 0.98 0.00 0.00 173.24 173.64 1xcq s LEU 11 N 2.89 3.81 -0.31 2.42 1.43 -0.96 -4.99 118.68 122.97 1xcq s LEU 11 Ca 0.18 -0.32 0.07 0.00 -1.03 0.00 0.00 54.13 53.04 1xcq s LEU 11 Cb -0.06 -2.49 0.45 0.00 0.03 0.00 0.00 46.19 44.12 1xcq s LEU 11 CO -0.24 -0.35 1.18 0.00 0.23 0.00 0.00 176.35 177.16 1xcq n ALA 12 N -1.48 4.98 -2.33 4.21 0.00 -1.26 -2.62 120.51 122.01 1xcq n ALA 12 Ca -0.02 -3.85 -0.40 0.00 0.00 0.00 0.00 53.44 49.17 1xcq n ALA 12 Cb 0.59 -0.37 -0.05 0.00 0.00 0.00 0.00 19.45 19.62 1xcq n ALA 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1xcq s VAL 13 N -4.72 4.62 0.00 0.00 0.11 -1.26 -4.55 120.40 114.59 1xcq s VAL 13 Ca 0.50 1.83 0.00 0.00 -2.93 0.00 0.00 61.98 61.38 1xcq s VAL 13 Cb 0.41 -4.21 0.00 0.00 -1.53 0.00 0.00 36.38 31.05 1xcq s VAL 13 CO 0.00 0.35 0.00 -1.20 -3.33 0.00 0.00 175.10 170.92 1xcq n SER 14 N 2.76 0.00 -4.34 3.54 7.64 -1.26 -2.63 113.62 119.34 1xcq n SER 14 Ca -0.00 0.00 -0.45 0.00 1.01 0.00 0.00 58.87 59.42 1xcq n SER 14 Cb 0.50 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.64 1xcq n SER 14 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xcq s ALA 15 N -2.90 3.62 -0.10 -0.43 0.00 -1.25 -4.07 121.76 116.63 1xcq s ALA 15 Ca 0.00 -2.39 -0.07 0.00 0.00 0.00 0.00 51.96 49.50 1xcq s ALA 15 Cb 0.00 -3.20 0.03 0.00 0.00 0.00 0.00 23.12 19.95 1xcq s ALA 15 CO 0.00 -1.92 0.14 0.41 0.00 0.00 0.00 175.76 174.39 1xcq n GLY 16 N 5.23 -4.72 3.60 0.00 0.00 0.31 -4.89 105.19 104.73 1xcq n GLY 16 Ca -0.13 0.89 -0.05 0.00 0.00 0.00 0.00 46.02 46.73 1xcq n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xcq s GLU 17 N -0.83 0.77 -0.49 1.61 2.02 -1.26 -4.68 118.70 115.84 1xcq s GLU 17 Ca -0.16 -0.35 -0.28 0.00 0.02 0.00 0.00 54.97 54.20 1xcq s GLU 17 Cb 0.01 0.31 0.01 0.00 0.10 0.00 0.00 34.13 34.56 1xcq s GLU 17 CO 0.43 -0.34 1.46 0.21 0.02 0.00 0.00 175.26 177.04 1xcq s LYS 18 N -2.95 3.38 -0.17 1.61 2.36 -1.26 -3.24 119.74 119.47 1xcq s LYS 18 Ca 0.09 0.72 -0.03 0.00 -2.55 0.00 0.00 55.97 54.20 1xcq s LYS 18 Cb -0.00 -4.10 -0.02 0.00 -1.05 0.00 0.00 37.83 32.66 1xcq s LYS 18 CO -0.05 -1.82 -0.06 0.54 1.55 0.00 0.00 175.35 175.51 1xcq s VAL 19 N 6.00 3.48 -0.20 4.02 0.11 -1.22 -5.04 120.40 127.55 1xcq s VAL 19 Ca 0.58 -0.49 -0.02 0.00 -2.93 0.00 0.00 61.98 59.13 1xcq s VAL 19 Cb -0.13 -2.53 0.06 0.00 -1.53 0.00 0.00 36.38 32.25 1xcq s VAL 19 CO 0.29 0.48 0.01 0.28 -3.33 0.00 0.00 175.10 172.82 1xcq s THR 20 N 0.76 0.78 0.08 5.04 -1.32 -1.26 -2.76 115.64 116.95 1xcq s THR 20 Ca -0.03 -0.72 -0.10 0.00 -1.21 0.00 0.00 61.69 59.63 1xcq s THR 20 Cb -0.15 -1.22 -0.06 0.00 -1.51 0.00 0.00 72.50 69.56 1xcq s THR 20 CO 0.02 -0.17 0.40 -0.04 -2.21 0.00 0.00 174.62 172.62 1xcq s MET 21 N 1.74 3.77 -0.10 7.08 -1.94 -1.07 -4.83 119.30 123.96 1xcq s MET 21 Ca -0.02 0.20 0.04 0.00 -1.71 0.00 0.00 55.69 54.19 1xcq s MET 21 Cb -0.17 -3.01 -0.00 0.00 2.01 0.00 0.00 34.83 33.65 1xcq s MET 21 CO -0.07 0.57 -0.22 -1.54 -0.01 0.00 0.00 175.02 173.74 1xcq s SER 22 N -1.72 3.26 -0.33 3.03 1.04 -0.35 -3.34 113.70 115.28 1xcq s SER 22 Ca 0.33 -0.51 0.07 0.00 0.48 0.00 0.00 55.95 56.32 1xcq s SER 22 Cb -0.14 -1.38 0.45 0.00 0.10 0.00 0.00 66.02 65.05 1xcq s SER 22 CO 0.18 0.17 1.16 0.00 0.98 0.00 0.00 173.24 175.73 1xcq n LYS 24 N -0.63 1.03 0.00 0.00 4.81 -1.20 -4.45 118.16 117.71 1xcq n LYS 24 Ca 0.41 0.37 0.00 0.00 -0.87 0.00 0.00 58.31 58.22 1xcq n LYS 24 Cb 0.87 -1.90 0.00 0.00 0.02 0.00 0.00 35.03 34.02 1xcq n LYS 24 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1xcq n SER 25 N 0.52 0.00 0.00 3.14 3.41 0.55 -0.62 113.62 120.62 1xcq n SER 25 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1xcq n SER 25 Cb 0.41 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 1xcq n SER 25 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xcq n SER 26 N 0.00 0.00 0.00 4.04 7.64 -1.17 -4.93 113.62 119.19 1xcq n SER 26 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1xcq n SER 26 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1xcq n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xcq n GLN 27 N 0.00 0.00 0.00 1.43 1.13 -1.26 -4.97 117.38 113.71 1xcq n GLN 27 Ca 0.00 0.78 0.00 0.00 -1.94 0.00 0.00 57.00 55.84 1xcq n GLN 27 Cb 0.00 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 28.92 1xcq n GLN 27 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1xcq n SER 28 N -2.44 0.00 0.00 1.08 2.88 -1.26 -5.02 113.62 108.87 1xcq n SER 28 Ca 0.00 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.57 1xcq n SER 28 Cb 0.00 0.00 0.18 0.00 -0.75 0.00 0.00 64.21 63.64 1xcq n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1xcq n LEU 29 N 0.00 0.00 -4.50 2.46 4.77 0.34 -4.69 117.00 115.38 1xcq n LEU 29 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1xcq n LEU 29 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1xcq n LEU 29 CO 0.00 0.00 0.98 -0.76 -1.33 0.00 0.00 177.39 176.28 1xcq s LEU 30 N -1.32 3.86 -0.22 2.23 1.43 -1.22 -4.07 118.68 119.38 1xcq s LEU 30 Ca 0.09 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.33 1xcq s LEU 30 Cb 0.04 -2.49 0.01 0.00 0.03 0.00 0.00 46.19 43.78 1xcq s LEU 30 CO 0.07 -1.60 -0.09 0.21 0.23 0.00 0.00 176.35 175.18 1xcq s ASN 31 N 3.78 3.98 0.19 2.29 2.47 -1.26 -4.98 114.94 121.40 1xcq s ASN 31 Ca 0.29 -0.57 -0.01 0.00 0.42 0.00 0.00 52.86 52.99 1xcq s ASN 31 Cb -0.12 -1.65 0.09 0.00 -1.45 0.00 0.00 41.25 38.13 1xcq s ASN 31 CO 0.10 -0.04 1.47 0.77 -3.72 0.00 0.00 177.10 175.68 1xcq h SER 32 N 8.04 0.49 0.00 -4.21 4.64 -1.90 0.17 113.55 120.78 1xcq h SER 32 Ca -0.41 -0.30 -0.04 0.00 -0.47 0.00 0.00 61.79 60.57 1xcq h SER 32 Cb 1.14 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.07 1xcq h SER 32 CO 0.61 1.02 0.23 0.54 -0.87 0.00 0.00 176.83 178.36 1xcq n ARG 33 N -3.87 0.48 0.00 4.77 5.12 -1.26 -3.01 116.66 118.89 1xcq n ARG 33 Ca -0.04 -0.22 0.00 0.00 -1.93 0.00 0.00 57.85 55.66 1xcq n ARG 33 Cb 0.67 -1.59 0.00 0.00 -1.16 0.00 0.00 32.46 30.38 1xcq n ARG 33 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1xcq n THR 34 N 2.73 0.00 0.00 0.55 -2.24 -1.16 -5.02 114.28 109.14 1xcq n THR 34 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1xcq n THR 34 Cb 0.22 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 1xcq n THR 34 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1xcq n ARG 35 N 0.00 0.00 -1.12 -0.78 3.00 0.57 -4.91 116.66 113.42 1xcq n ARG 35 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.56 1xcq n ARG 35 Cb 0.00 -0.29 0.16 0.00 0.00 0.00 0.00 32.46 32.33 1xcq n ARG 35 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1xcq s LYS 36 N 0.00 0.81 -0.53 -0.14 -0.14 -1.26 -4.72 119.74 113.76 1xcq s LYS 36 Ca 0.00 0.75 0.00 0.00 -1.36 0.00 0.00 55.97 55.37 1xcq s LYS 36 Cb 0.00 -1.76 0.14 0.00 -1.68 0.00 0.00 37.83 34.53 1xcq s LYS 36 CO 0.00 -2.53 0.31 -0.80 -0.76 0.00 0.00 175.35 171.56 1xcq s ASN 37 N -3.33 4.87 -0.67 2.83 -0.87 -1.23 -4.09 114.94 112.45 1xcq s ASN 37 Ca 0.65 -2.73 -0.04 0.00 -1.57 0.00 0.00 52.86 49.16 1xcq s ASN 37 Cb -0.19 -1.75 -0.04 0.00 -0.02 0.00 0.00 41.25 39.25 1xcq s ASN 37 CO 0.58 -0.34 1.81 -1.22 -2.57 0.00 0.00 177.10 175.35 1xcq n TYR 38 N 3.58 1.00 -4.27 2.20 4.02 -1.26 0.14 117.16 122.56 1xcq n TYR 38 Ca 0.05 -1.57 -0.18 0.00 -0.01 0.00 0.00 57.90 56.19 1xcq n TYR 38 Cb 0.37 -1.38 -0.13 0.00 -0.02 0.00 0.00 39.34 38.18 1xcq n TYR 38 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1xcq s LEU 39 N 0.08 2.18 0.32 7.72 1.98 -1.26 -4.06 118.68 125.63 1xcq s LEU 39 Ca 0.29 -0.45 0.04 0.00 -2.89 0.00 0.00 54.13 51.12 1xcq s LEU 39 Cb 0.07 -0.50 -0.02 0.00 0.66 0.00 0.00 46.19 46.41 1xcq s LEU 39 CO -0.02 -0.01 0.31 0.00 -1.89 0.00 0.00 176.35 174.74 1xcq s ALA 40 N -0.90 1.52 -0.05 5.97 0.00 -1.00 -0.78 121.76 126.52 1xcq s ALA 40 Ca -0.01 -1.90 -0.02 0.00 0.00 0.00 0.00 51.96 50.03 1xcq s ALA 40 Cb -0.08 1.39 0.04 0.00 0.00 0.00 0.00 23.12 24.47 1xcq s ALA 40 CO 0.01 -0.69 0.10 -1.58 0.00 0.00 0.00 175.76 173.60 1xcq s TRP 41 N -3.43 -0.06 -0.12 0.00 0.52 -0.58 -2.96 118.94 112.31 1xcq s TRP 41 Ca 0.38 0.38 -0.01 0.00 0.02 0.00 0.00 56.10 56.87 1xcq s TRP 41 Cb 0.02 -0.29 -0.02 0.00 -1.15 0.00 0.00 33.47 32.03 1xcq s TRP 41 CO 0.24 -0.19 -0.08 0.71 0.02 0.00 0.00 176.95 177.66 1xcq s TYR 42 N 1.77 2.92 -0.01 -1.98 1.51 -1.10 0.33 117.35 120.79 1xcq s TYR 42 Ca -0.01 -0.32 0.05 0.00 -1.01 0.00 0.00 57.07 55.77 1xcq s TYR 42 Cb -0.12 -1.85 -0.03 0.00 -0.11 0.00 0.00 41.96 39.85 1xcq s TYR 42 CO -0.04 0.01 -0.15 -1.14 -1.11 0.00 0.00 175.55 173.12 1xcq s GLN 43 N 0.02 2.35 -0.33 -0.62 0.74 1.16 0.25 119.66 123.22 1xcq s GLN 43 Ca -0.02 -0.81 -0.01 0.00 0.05 0.00 0.00 55.36 54.58 1xcq s GLN 43 Cb -0.14 -2.32 0.13 0.00 1.10 0.00 0.00 33.01 31.78 1xcq s GLN 43 CO 0.03 0.59 0.20 -1.14 -0.55 0.00 0.00 175.29 174.42 1xcq s GLN 44 N -1.10 0.45 0.34 1.67 0.74 0.11 0.15 119.66 122.02 1xcq s GLN 44 Ca 0.14 -1.06 -0.27 0.00 0.05 0.00 0.00 55.36 54.22 1xcq s GLN 44 Cb -0.11 -1.21 -0.09 0.00 1.10 0.00 0.00 33.01 32.71 1xcq s GLN 44 CO 0.03 -1.16 1.07 0.15 -0.55 0.00 0.00 175.29 174.84 1xcq s LYS 45 N 1.40 4.39 -0.18 1.67 1.02 -1.26 -3.08 119.74 123.70 1xcq s LYS 45 Ca 0.15 1.65 -0.40 0.00 0.02 0.00 0.00 55.97 57.39 1xcq s LYS 45 Cb -0.20 -2.85 -0.17 0.00 -0.52 0.00 0.00 37.83 34.08 1xcq s LYS 45 CO -0.10 0.03 1.56 -2.30 -0.92 0.00 0.00 175.35 173.62 1xcq n PRO 46 N 0.54 0.94 -0.73 -1.68 -0.02 -1.26 -1.69 135.00 131.09 1xcq n PRO 46 Ca 0.02 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1xcq n PRO 46 Cb 0.47 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1xcq n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xcq n GLY 47 N 3.49 0.56 3.36 -1.23 0.00 -1.26 -5.03 105.19 105.08 1xcq n GLY 47 Ca 0.24 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 1xcq n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xcq s GLN 48 N -1.23 1.36 0.12 1.61 -1.52 -0.68 -5.12 119.66 114.19 1xcq s GLN 48 Ca 0.00 -1.62 -0.30 0.00 -1.95 0.00 0.00 55.36 51.49 1xcq s GLN 48 Cb 0.00 -1.11 -0.07 0.00 -0.22 0.00 0.00 33.01 31.61 1xcq s GLN 48 CO 0.00 0.15 1.23 0.45 -0.25 0.00 0.00 175.29 176.87 1xcq s SER 49 N -3.33 7.04 0.80 5.90 0.15 -1.26 -4.62 113.70 118.38 1xcq s SER 49 Ca 0.24 2.15 -0.14 0.00 0.70 0.00 0.00 55.95 58.90 1xcq s SER 49 Cb 0.00 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.68 1xcq s SER 49 CO 0.08 -0.46 -0.51 -2.65 1.20 0.00 0.00 173.24 170.90 1xcq n PRO 50 N 3.33 -0.48 -3.57 5.44 -0.02 -1.26 -4.75 135.00 133.69 1xcq n PRO 50 Ca 0.07 -0.14 -0.13 0.00 -2.02 0.00 0.00 63.50 61.28 1xcq n PRO 50 Cb 0.45 -1.12 -0.06 0.00 -0.02 0.00 0.00 33.50 32.75 1xcq n PRO 50 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1xcq s LYS 51 N -2.33 0.77 0.06 -0.52 -0.14 0.40 -4.90 119.74 113.07 1xcq s LYS 51 Ca 0.23 0.29 -0.15 0.00 -1.36 0.00 0.00 55.97 54.98 1xcq s LYS 51 Cb 0.02 0.36 -0.06 0.00 -1.68 0.00 0.00 37.83 36.48 1xcq s LYS 51 CO 0.34 -0.22 0.48 0.54 -0.76 0.00 0.00 175.35 175.72 1xcq s VAL 52 N -0.89 4.93 -0.06 3.17 0.11 -1.26 0.37 120.40 126.76 1xcq s VAL 52 Ca -0.04 0.88 -0.05 0.00 -2.93 0.00 0.00 61.98 59.84 1xcq s VAL 52 Cb -0.01 -3.75 -0.03 0.00 -1.53 0.00 0.00 36.38 31.05 1xcq s VAL 52 CO 0.04 0.47 -0.11 0.18 -3.33 0.00 0.00 175.10 172.35 1xcq n LEU 53 N 1.48 0.82 -4.53 2.54 4.77 1.01 -4.80 117.00 118.29 1xcq n LEU 53 Ca -0.11 0.13 -0.24 0.00 -0.03 0.00 0.00 56.01 55.76 1xcq n LEU 53 Cb 0.52 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 41.19 1xcq n LEU 53 CO 0.40 -0.03 -0.27 -0.63 -1.33 0.00 0.00 177.39 175.53 1xcq s ILE 54 N -2.19 1.42 -0.14 -0.08 -1.09 -1.08 -3.47 121.20 114.57 1xcq s ILE 54 Ca -0.12 -2.00 -0.30 0.00 -2.23 0.00 0.00 60.65 56.00 1xcq s ILE 54 Cb 0.04 -2.81 0.11 0.00 -1.58 0.00 0.00 42.46 38.23 1xcq s ILE 54 CO 0.15 0.00 0.93 -0.72 -1.23 0.00 0.00 174.94 174.07 1xcq s TYR 55 N -3.08 -0.44 -1.13 3.97 1.13 -0.86 -1.53 117.35 115.41 1xcq s TYR 55 Ca 0.34 0.75 0.00 0.00 -1.41 0.00 0.00 57.07 56.74 1xcq s TYR 55 Cb 0.08 0.44 0.00 0.00 -1.10 0.00 0.00 41.96 41.39 1xcq s TYR 55 CO 0.16 -0.40 0.00 0.91 -2.51 0.00 0.00 175.55 173.70 1xcq n TRP 56 N 0.77 0.00 0.00 -3.49 7.02 0.36 -1.57 117.44 120.53 1xcq n TRP 56 Ca -0.12 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 1xcq n TRP 56 Cb 0.58 -2.07 0.00 0.00 -2.42 0.00 0.00 31.31 27.40 1xcq n TRP 56 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1xcq n ALA 57 N 1.20 0.00 -1.11 6.99 0.00 0.34 -3.53 120.51 124.40 1xcq n ALA 57 Ca -0.11 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.42 1xcq n ALA 57 Cb 0.37 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.01 1xcq n ALA 57 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1xcq n SER 58 N 3.86 2.82 -4.69 0.00 7.64 -1.21 -2.94 113.62 119.10 1xcq n SER 58 Ca 0.00 -3.18 -0.39 0.00 1.01 0.00 0.00 58.87 56.31 1xcq n SER 58 Cb 0.00 -0.49 -0.06 0.00 -1.01 0.00 0.00 64.21 62.65 1xcq n SER 58 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xcq s THR 59 N -2.92 5.08 0.32 0.44 2.01 -0.61 -4.36 115.64 115.60 1xcq s THR 59 Ca 0.37 1.16 -0.09 0.00 0.31 0.00 0.00 61.69 63.44 1xcq s THR 59 Cb 0.32 -3.92 -0.06 0.00 0.01 0.00 0.00 72.50 68.84 1xcq s THR 59 CO 0.04 0.21 0.64 -0.13 -0.69 0.00 0.00 174.62 174.69 1xcq s ARG 60 N 1.30 3.76 0.00 4.92 0.52 -1.26 -2.04 118.95 126.15 1xcq s ARG 60 Ca 0.29 0.29 0.00 0.00 -0.52 0.00 0.00 55.73 55.80 1xcq s ARG 60 Cb -0.16 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 32.77 1xcq s ARG 60 CO 0.12 0.15 0.00 -1.91 0.02 0.00 0.00 175.30 173.68 1xcq n GLU 61 N -0.82 1.45 -1.67 3.54 4.07 -1.23 -4.87 120.64 121.12 1xcq n GLU 61 Ca 0.01 0.00 -0.46 0.00 -0.06 0.00 0.00 57.16 56.64 1xcq n GLU 61 Cb 0.53 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.87 1xcq n GLU 61 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1xcq n SER 62 N -1.88 3.62 -0.25 4.31 7.64 -1.26 -3.83 113.62 121.97 1xcq n SER 62 Ca 0.00 0.91 0.00 0.00 1.01 0.00 0.00 58.87 60.79 1xcq n SER 62 Cb 0.00 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 61.78 1xcq n SER 62 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xcq n GLY 63 N 4.56 0.00 2.83 0.23 0.00 -1.26 -4.97 105.19 106.58 1xcq n GLY 63 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 1xcq n GLY 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xcq s VAL 64 N 0.00 -0.47 -0.01 1.61 1.01 -1.25 -5.11 120.40 116.18 1xcq s VAL 64 Ca 0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.79 1xcq s VAL 64 Cb 0.00 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.57 1xcq s VAL 64 CO 0.00 -0.21 0.12 -2.65 0.00 0.00 0.00 175.10 172.36 1xcq n PRO 65 N 5.34 0.00 0.07 2.72 -0.02 -1.26 -4.43 135.00 137.42 1xcq n PRO 65 Ca -0.04 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.47 1xcq n PRO 65 Cb 0.49 -0.14 0.13 0.00 -0.02 0.00 0.00 33.50 33.97 1xcq n PRO 65 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1xcq n ASP 66 N 0.21 0.13 0.03 2.55 -0.08 -1.26 0.58 116.55 118.71 1xcq n ASP 66 Ca 0.02 0.36 -0.12 0.00 -1.51 0.00 0.00 54.79 53.54 1xcq n ASP 66 Cb 0.00 -0.32 -0.09 0.00 2.34 0.00 0.00 41.12 43.05 1xcq n ASP 66 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1xcq h ARG 67 N 0.00 -0.13 -6.60 -0.67 0.11 -1.90 -3.42 114.38 101.77 1xcq h ARG 67 Ca 0.00 0.01 -0.53 0.00 0.10 0.00 0.00 59.98 59.56 1xcq h ARG 67 Cb 0.61 0.03 0.03 0.00 1.11 0.00 0.00 29.97 31.76 1xcq h ARG 67 CO 0.00 0.36 0.76 -0.06 0.10 0.00 0.00 179.97 181.13 1xcq s PHE 68 N -3.76 3.17 -0.20 4.08 0.08 0.20 -2.58 117.98 118.96 1xcq s PHE 68 Ca -0.15 0.91 -0.04 0.00 0.12 0.00 0.00 56.93 57.77 1xcq s PHE 68 Cb 0.01 -3.75 0.09 0.00 -0.57 0.00 0.00 43.02 38.79 1xcq s PHE 68 CO 0.58 -2.62 0.18 0.99 -0.10 0.00 0.00 175.22 174.25 1xcq s THR 69 N 0.85 -0.24 0.57 0.64 2.01 -0.61 -4.92 115.64 113.94 1xcq s THR 69 Ca 0.64 -0.19 -0.20 0.00 0.31 0.00 0.00 61.69 62.25 1xcq s THR 69 Cb -0.39 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 1xcq s THR 69 CO 0.33 -0.28 1.27 -0.83 -0.69 0.00 0.00 174.62 174.43 1xcq s GLY 70 N 2.26 2.83 -0.28 4.40 0.00 -1.26 -2.97 107.32 112.30 1xcq s GLY 70 Ca 0.06 1.16 0.00 0.00 0.00 0.00 0.00 44.72 45.94 1xcq s GLY 70 CO -0.14 1.62 0.40 0.50 0.00 0.00 0.00 173.10 175.47 1xcq s ARG 71 N -3.09 0.39 0.00 2.90 0.52 1.80 -4.16 118.95 117.31 1xcq s ARG 71 Ca 0.74 0.25 0.00 0.00 -0.52 0.00 0.00 55.73 56.21 1xcq s ARG 71 Cb -0.35 -0.37 0.00 0.00 0.52 0.00 0.00 34.95 34.75 1xcq s ARG 71 CO 0.40 -0.91 0.00 0.41 0.02 0.00 0.00 175.30 175.22 1xcq n GLY 72 N 5.36 0.52 0.00 -3.53 0.00 -1.26 0.64 105.19 106.91 1xcq n GLY 72 Ca -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1xcq n GLY 72 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1xcq n SER 73 N -0.06 0.00 0.00 1.61 2.88 -1.14 -4.81 113.62 112.11 1xcq n SER 73 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1xcq n SER 73 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1xcq n SER 73 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xcq n GLY 74 N 0.00 0.82 0.03 0.46 0.00 -1.26 -4.82 105.19 100.41 1xcq n GLY 74 Ca 0.00 -0.57 0.04 0.00 0.00 0.00 0.00 46.02 45.49 1xcq n GLY 74 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xcq n THR 75 N 0.00 0.31 -4.96 2.61 -1.04 -1.26 -0.50 114.28 109.44 1xcq n THR 75 Ca 0.00 -0.48 -0.27 0.00 -2.04 0.00 0.00 64.05 61.26 1xcq n THR 75 Cb 0.00 -0.09 -0.16 0.00 -1.82 0.00 0.00 70.33 68.26 1xcq n THR 75 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1xcq s ASP 76 N -4.30 2.36 0.08 8.00 1.11 -1.26 -0.33 116.67 122.33 1xcq s ASP 76 Ca -0.07 -0.37 -0.03 0.00 0.18 0.00 0.00 52.55 52.25 1xcq s ASP 76 Cb 0.09 -0.42 -0.03 0.00 1.07 0.00 0.00 42.92 43.64 1xcq s ASP 76 CO 0.71 0.22 0.07 -0.36 1.18 0.00 0.00 175.17 176.99 1xcq s PHE 77 N -0.29 0.49 -0.01 4.23 2.99 -1.26 -2.87 117.98 121.26 1xcq s PHE 77 Ca 0.03 -0.96 0.00 0.00 0.00 0.00 0.00 56.93 56.00 1xcq s PHE 77 Cb -0.09 -0.30 0.01 0.00 0.00 0.00 0.00 43.02 42.63 1xcq s PHE 77 CO 0.01 -0.47 -0.01 0.95 -0.00 0.00 0.00 175.22 175.69 1xcq s THR 78 N -3.94 0.12 -0.18 0.64 -4.23 2.81 -2.20 115.64 108.67 1xcq s THR 78 Ca 0.11 -0.01 -0.10 0.00 -1.18 0.00 0.00 61.69 60.51 1xcq s THR 78 Cb 0.07 -0.15 -0.05 0.00 1.34 0.00 0.00 72.50 73.71 1xcq s THR 78 CO -0.07 0.07 0.14 -0.22 -0.54 0.00 0.00 174.62 174.00 1xcq s LEU 79 N 0.29 4.25 -0.07 4.79 2.96 -1.21 0.49 118.68 130.18 1xcq s LEU 79 Ca -0.03 0.30 0.00 0.00 -0.22 0.00 0.00 54.13 54.18 1xcq s LEU 79 Cb -0.05 -2.10 0.02 0.00 0.50 0.00 0.00 46.19 44.56 1xcq s LEU 79 CO -0.01 0.22 -0.05 0.28 -1.32 0.00 0.00 176.35 175.48 1xcq s THR 80 N 0.08 0.69 -0.60 3.68 -1.32 -1.16 -2.59 115.64 114.42 1xcq s THR 80 Ca 0.10 -0.14 -0.17 0.00 -1.21 0.00 0.00 61.69 60.27 1xcq s THR 80 Cb -0.11 -0.73 0.13 0.00 -1.51 0.00 0.00 72.50 70.27 1xcq s THR 80 CO -0.00 0.29 0.63 -0.63 -2.21 0.00 0.00 174.62 172.70 1xcq s ILE 81 N 1.38 5.07 -1.42 5.08 1.01 -1.11 -1.57 121.20 129.63 1xcq s ILE 81 Ca -0.03 -1.38 0.00 0.00 0.00 0.00 0.00 60.65 59.24 1xcq s ILE 81 Cb -0.13 -4.43 0.00 0.00 0.01 0.00 0.00 42.46 37.90 1xcq s ILE 81 CO -0.03 -1.02 0.21 -1.20 0.00 0.00 0.00 174.94 172.91 1xcq n SER 82 N 5.63 0.18 0.00 3.58 7.64 -1.07 -3.40 113.62 126.18 1xcq n SER 82 Ca -0.08 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.20 1xcq n SER 82 Cb 0.42 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1xcq n SER 82 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1xcq n SER 83 N -0.00 0.00 -4.03 6.43 3.41 -1.20 -4.55 113.62 113.67 1xcq n SER 83 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.24 1xcq n SER 83 Cb 0.04 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.04 1xcq n SER 83 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1xcq n VAL 84 N 0.00 0.00 -3.87 -3.33 0.24 -1.24 -4.14 118.33 105.99 1xcq n VAL 84 Ca 0.00 -0.28 -0.04 0.00 -2.04 0.00 0.00 64.34 61.98 1xcq n VAL 84 Cb 0.00 -0.06 0.02 0.00 -1.47 0.00 0.00 33.84 32.33 1xcq n VAL 84 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1xcq s GLN 85 N -2.15 1.43 0.00 7.34 -1.52 -1.26 0.11 119.66 123.61 1xcq s GLN 85 Ca 0.40 -0.92 0.00 0.00 -1.95 0.00 0.00 55.36 52.89 1xcq s GLN 85 Cb -0.07 0.40 0.00 0.00 -0.22 0.00 0.00 33.01 33.12 1xcq s GLN 85 CO 0.75 -0.67 0.42 0.00 -0.25 0.00 0.00 175.29 175.55 1xcq n ALA 86 N -0.67 0.00 0.01 6.09 0.00 -1.26 -2.23 120.51 122.44 1xcq n ALA 86 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1xcq n ALA 86 Cb 0.59 0.21 0.00 0.00 0.00 0.00 0.00 19.45 20.26 1xcq n ALA 86 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1xcq n GLU 87 N -1.35 0.03 0.00 0.00 0.28 -1.26 -1.19 120.64 117.15 1xcq n GLU 87 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1xcq n GLU 87 Cb 0.00 -1.48 0.00 0.00 1.43 0.00 0.00 31.44 31.39 1xcq n GLU 87 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1xcq n ASP 88 N 1.48 1.80 -3.41 -1.84 10.43 -0.95 -4.99 116.55 119.08 1xcq n ASP 88 Ca 0.00 -0.05 -0.16 0.00 2.57 0.00 0.00 54.79 57.16 1xcq n ASP 88 Cb 0.02 0.46 -0.04 0.00 1.84 0.00 0.00 41.12 43.39 1xcq n ASP 88 CO 0.00 0.00 0.00 1.67 -1.07 0.00 0.00 177.20 177.80 1xcq n GLN 89 N -0.64 0.00 0.00 -1.24 0.00 -0.34 -4.66 117.38 110.51 1xcq n GLN 89 Ca 0.00 -0.52 0.00 0.00 -0.00 0.00 0.00 57.00 56.48 1xcq n GLN 89 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 30.24 28.38 1xcq n GLN 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xcq n ALA 90 N 5.76 0.00 -3.49 1.69 0.00 -1.22 -4.52 120.51 118.73 1xcq n ALA 90 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.48 1xcq n ALA 90 Cb 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.53 1xcq n ALA 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xcq s VAL 91 N 3.48 -0.02 -0.20 0.00 1.01 -1.18 -1.32 120.40 122.18 1xcq s VAL 91 Ca 0.00 0.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.98 1xcq s VAL 91 Cb 0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1xcq s VAL 91 CO 0.00 0.02 0.00 -0.31 0.00 0.00 0.00 175.10 174.82 1xcq s TYR 92 N 0.81 3.06 0.48 5.22 1.51 -1.25 -0.71 117.35 126.46 1xcq s TYR 92 Ca -0.05 -0.39 0.05 0.00 -1.01 0.00 0.00 57.07 55.67 1xcq s TYR 92 Cb -0.06 -2.07 -0.02 0.00 -0.11 0.00 0.00 41.96 39.70 1xcq s TYR 92 CO -0.06 -0.18 0.18 0.71 -1.11 0.00 0.00 175.55 175.09 1xcq s TYR 93 N 0.89 2.13 -0.29 2.71 1.51 0.14 -3.83 117.35 120.61 1xcq s TYR 93 Ca 0.01 -0.76 0.01 0.00 -1.01 0.00 0.00 57.07 55.32 1xcq s TYR 93 Cb -0.14 -1.84 0.15 0.00 -0.11 0.00 0.00 41.96 40.02 1xcq s TYR 93 CO 0.02 0.03 0.37 0.00 -1.11 0.00 0.00 175.55 174.86 1xcq s LYS 95 N 2.47 2.78 -0.05 0.00 -2.85 -1.16 -4.37 119.74 116.56 1xcq s LYS 95 Ca 0.10 -0.01 0.01 0.00 -1.00 0.00 0.00 55.97 55.07 1xcq s LYS 95 Cb -0.13 -2.23 0.02 0.00 -2.06 0.00 0.00 37.83 33.43 1xcq s LYS 95 CO -0.31 -0.83 -0.06 1.14 0.10 0.00 0.00 175.35 175.39 1xcq s GLN 96 N -5.07 1.05 -0.07 1.78 1.03 -1.04 -2.37 119.66 114.97 1xcq s GLN 96 Ca 0.55 -0.17 0.11 0.00 0.04 0.00 0.00 55.36 55.89 1xcq s GLN 96 Cb -0.11 -1.01 0.18 0.00 0.03 0.00 0.00 33.01 32.10 1xcq s GLN 96 CO 0.46 -0.08 1.10 0.00 -2.54 0.00 0.00 175.29 174.23 1xcq n ALA 97 N 4.09 2.18 0.08 2.60 0.00 -1.26 -2.93 120.51 125.27 1xcq n ALA 97 Ca -0.23 -1.90 -0.12 0.00 0.00 0.00 0.00 53.44 51.19 1xcq n ALA 97 Cb 0.51 -0.24 -0.05 0.00 0.00 0.00 0.00 19.45 19.67 1xcq n ALA 97 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1xcq h TYR 98 N 0.13 -0.44 -3.21 0.00 3.20 -1.94 -3.40 116.97 111.30 1xcq h TYR 98 Ca 0.00 0.01 -0.53 0.00 3.14 0.00 0.00 58.73 61.35 1xcq h TYR 98 Cb 0.80 0.19 -0.36 0.00 1.54 0.00 0.00 36.73 38.90 1xcq h TYR 98 CO 0.03 -0.25 -0.81 0.42 -1.64 0.00 0.00 178.16 175.91 1xcq s ILE 99 N -6.12 1.08 0.36 1.81 1.01 -1.26 -5.11 121.20 112.96 1xcq s ILE 99 Ca -0.15 -0.34 -0.28 0.00 0.00 0.00 0.00 60.65 59.88 1xcq s ILE 99 Cb 0.08 -1.07 -0.11 0.00 0.01 0.00 0.00 42.46 41.37 1xcq s ILE 99 CO 0.66 0.37 1.49 -2.16 0.00 0.00 0.00 174.94 175.31 1xcq s PRO 100 N 1.54 4.12 0.65 2.79 0.04 -1.26 -4.44 135.00 138.44 1xcq s PRO 100 Ca 0.02 2.56 -0.11 0.00 0.04 0.00 0.00 61.00 63.51 1xcq s PRO 100 Cb -0.13 -2.98 -0.02 0.00 0.04 0.00 0.00 34.50 31.40 1xcq s PRO 100 CO -0.07 -0.53 1.05 -1.25 0.04 0.00 0.00 177.00 176.24 1xcq s PRO 101 N -1.84 3.37 1.06 0.56 0.04 -1.26 -4.99 135.00 131.93 1xcq s PRO 101 Ca 0.54 0.72 -0.13 0.00 0.04 0.00 0.00 61.00 62.18 1xcq s PRO 101 Cb -0.46 -2.06 0.22 0.00 0.04 0.00 0.00 34.50 32.24 1xcq s PRO 101 CO 0.60 -0.73 1.08 -0.51 0.04 0.00 0.00 177.00 177.48 1xcq s LEU 102 N -5.26 1.31 -0.28 -3.56 1.02 -1.26 -4.91 118.68 105.74 1xcq s LEU 102 Ca 0.56 1.23 -0.13 0.00 0.02 0.00 0.00 54.13 55.80 1xcq s LEU 102 Cb -0.11 -3.31 0.10 0.00 0.02 0.00 0.00 46.19 42.88 1xcq s LEU 102 CO 0.54 -3.47 0.66 -0.89 0.02 0.00 0.00 176.35 173.20 1xcq s THR 103 N -2.84 -0.38 0.15 5.49 2.01 -1.15 -4.91 115.64 114.00 1xcq s THR 103 Ca 0.66 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.69 1xcq s THR 103 Cb -0.20 -0.98 0.02 0.00 0.01 0.00 0.00 72.50 71.34 1xcq s THR 103 CO 0.59 0.00 0.14 0.49 -0.69 0.00 0.00 174.62 175.16 1xcq n PHE 104 N 4.75 -1.76 -4.48 4.92 3.01 -1.26 -2.49 117.46 120.14 1xcq n PHE 104 Ca -0.17 -0.59 -0.23 0.00 1.01 0.00 0.00 57.45 57.47 1xcq n PHE 104 Cb 0.55 -0.13 -0.06 0.00 -0.01 0.00 0.00 39.48 39.84 1xcq n PHE 104 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xcq n GLY 105 N 3.23 3.49 0.00 1.37 0.00 -1.26 -4.25 105.19 107.77 1xcq n GLY 105 Ca 0.01 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.86 1xcq n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcq n ALA 106 N -1.50 0.00 0.00 4.61 0.00 -1.26 -4.82 120.51 117.54 1xcq n ALA 106 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1xcq n ALA 106 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1xcq n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcq n GLY 107 N 0.00 3.57 3.39 0.00 0.00 -1.26 -4.81 105.19 106.07 1xcq n GLY 107 Ca 0.00 -0.95 -0.45 0.00 0.00 0.00 0.00 46.02 44.61 1xcq n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xcq s THR 108 N -2.00 5.10 0.30 2.61 2.01 -1.25 -4.37 115.64 118.04 1xcq s THR 108 Ca 0.00 -1.80 -0.30 0.00 0.31 0.00 0.00 61.69 59.90 1xcq s THR 108 Cb 0.00 -4.59 -0.12 0.00 0.01 0.00 0.00 72.50 67.80 1xcq s THR 108 CO 0.00 -1.24 1.59 1.17 -0.69 0.00 0.00 174.62 175.45 1xcq n LYS 109 N 5.49 2.68 -3.48 4.92 4.81 -0.28 -3.84 118.16 128.46 1xcq n LYS 109 Ca 0.13 0.95 -0.43 0.00 -0.87 0.00 0.00 58.31 58.09 1xcq n LYS 109 Cb 0.47 -2.73 -0.10 0.00 0.02 0.00 0.00 35.03 32.69 1xcq n LYS 109 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 1xcq s LEU 110 N -0.55 5.04 0.00 3.14 2.96 -0.43 -2.26 118.68 126.58 1xcq s LEU 110 Ca 0.63 -0.92 0.00 0.00 -0.22 0.00 0.00 54.13 53.62 1xcq s LEU 110 Cb -0.50 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.06 1xcq s LEU 110 CO 0.49 -0.44 0.00 -0.62 -1.32 0.00 0.00 176.35 174.46 1xcq n GLU 111 N 5.13 3.04 -3.65 1.98 1.02 -1.08 -3.42 120.64 123.66 1xcq n GLU 111 Ca -0.11 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.93 1xcq n GLU 111 Cb 0.47 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.84 1xcq n GLU 111 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1xcq s LEU 112 N 0.00 0.32 -0.05 -4.62 1.98 -1.26 -4.60 118.68 110.45 1xcq s LEU 112 Ca 0.00 -0.34 0.04 0.00 -2.89 0.00 0.00 54.13 50.93 1xcq s LEU 112 Cb 0.00 1.90 -0.00 0.00 0.66 0.00 0.00 46.19 48.75 1xcq s LEU 112 CO 0.00 -0.89 -0.16 -0.54 -1.89 0.00 0.00 176.35 172.87 1xcq s LYS 113 N -3.82 1.73 -0.02 1.98 -0.14 -1.08 -4.76 119.74 113.63 1xcq s LYS 113 Ca 0.04 -0.57 -0.15 0.00 -1.36 0.00 0.00 55.97 53.94 1xcq s LYS 113 Cb 0.01 -1.49 0.02 0.00 -1.68 0.00 0.00 37.83 34.70 1xcq s LYS 113 CO -0.10 0.21 0.31 -0.98 -0.76 0.00 0.00 175.35 174.03 1xcq s ARG 114 N 0.13 0.66 0.59 1.68 1.70 -1.26 -3.82 118.95 118.62 1xcq s ARG 114 Ca -0.05 -0.16 -0.18 0.00 -0.47 0.00 0.00 55.73 54.87 1xcq s ARG 114 Cb -0.12 0.29 -0.09 0.00 -0.57 0.00 0.00 34.95 34.46 1xcq s ARG 114 CO 0.02 -0.18 0.37 0.00 -1.08 0.00 0.00 175.30 174.44 1xcq n ALA 115 N 1.34 -1.66 -1.53 7.88 0.00 -1.26 -4.90 120.51 120.39 1xcq n ALA 115 Ca -0.21 -0.07 -0.36 0.00 0.00 0.00 0.00 53.44 52.80 1xcq n ALA 115 Cb 0.56 -1.74 0.08 0.00 0.00 0.00 0.00 19.45 18.36 1xcq n ALA 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xcq s ASP 116 N -1.17 4.38 -0.26 0.00 -0.00 -1.26 -4.85 116.67 113.51 1xcq s ASP 116 Ca 0.65 2.49 -0.16 0.00 -0.00 0.00 0.00 52.55 55.53 1xcq s ASP 116 Cb -0.44 -2.60 0.07 0.00 -0.00 0.00 0.00 42.92 39.95 1xcq s ASP 116 CO 0.58 -2.14 0.64 0.00 -0.00 0.00 0.00 175.17 174.24 1xcq s ALA 117 N -1.70 -1.70 0.44 5.23 0.00 -0.57 -4.88 121.76 118.58 1xcq s ALA 117 Ca 0.78 2.18 -0.25 0.00 0.00 0.00 0.00 51.96 54.68 1xcq s ALA 117 Cb -0.33 -1.28 -0.08 0.00 0.00 0.00 0.00 23.12 21.43 1xcq s ALA 117 CO 0.42 -0.35 1.30 0.00 0.00 0.00 0.00 175.76 177.14 1xcq s ALA 118 N 1.35 3.14 0.09 0.00 0.00 -1.26 -0.52 121.76 124.55 1xcq s ALA 118 Ca -0.08 1.22 -0.31 0.00 0.00 0.00 0.00 51.96 52.80 1xcq s ALA 118 Cb -0.05 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.49 1xcq s ALA 118 CO -0.15 -0.93 1.65 -2.14 0.00 0.00 0.00 175.76 174.20 1xcq s PRO 119 N -2.45 4.20 -0.15 0.00 0.02 -1.26 -4.54 135.00 130.82 1xcq s PRO 119 Ca 0.61 2.35 -0.25 0.00 0.02 0.00 0.00 61.00 63.73 1xcq s PRO 119 Cb -0.37 -3.54 -0.02 0.00 0.02 0.00 0.00 34.50 30.59 1xcq s PRO 119 CO 0.47 -0.72 0.79 0.99 -0.33 0.00 0.00 177.00 178.20 1xcq s THR 120 N 2.43 4.92 0.00 0.99 2.01 0.09 -4.88 115.64 121.20 1xcq s THR 120 Ca 0.74 1.56 0.00 0.00 0.31 0.00 0.00 61.69 64.30 1xcq s THR 120 Cb -0.41 -4.10 0.00 0.00 0.01 0.00 0.00 72.50 68.00 1xcq s THR 120 CO 0.32 0.07 0.00 0.52 -0.69 0.00 0.00 174.62 174.85 1xcq n VAL 121 N 4.56 0.00 -3.59 3.82 0.31 -1.26 -2.17 118.33 120.00 1xcq n VAL 121 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.37 1xcq n VAL 121 Cb 0.49 -1.22 -0.06 0.00 -0.91 0.00 0.00 33.84 32.14 1xcq n VAL 121 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1xcq s SER 122 N -1.00 -0.17 0.23 4.52 1.04 -0.89 -4.91 113.70 112.52 1xcq s SER 122 Ca 0.00 0.26 0.08 0.00 0.48 0.00 0.00 55.95 56.77 1xcq s SER 122 Cb 0.00 1.09 -0.04 0.00 0.10 0.00 0.00 66.02 67.17 1xcq s SER 122 CO 0.00 -0.04 0.10 -0.51 0.98 0.00 0.00 173.24 173.77 1xcq s ILE 123 N 1.25 4.06 -0.21 -1.02 1.10 -1.26 -1.34 121.20 123.77 1xcq s ILE 123 Ca -0.07 -1.51 -0.14 0.00 -0.51 0.00 0.00 60.65 58.42 1xcq s ILE 123 Cb -0.02 -3.15 0.06 0.00 0.15 0.00 0.00 42.46 39.50 1xcq s ILE 123 CO -0.12 -0.29 0.54 -0.36 -2.11 0.00 0.00 174.94 172.60 1xcq s PHE 124 N -2.07 -0.74 0.06 3.50 0.40 -0.12 -4.96 117.98 114.05 1xcq s PHE 124 Ca 0.31 1.60 -0.21 0.00 -0.60 0.00 0.00 56.93 58.03 1xcq s PHE 124 Cb -0.08 0.36 -0.06 0.00 0.51 0.00 0.00 43.02 43.75 1xcq s PHE 124 CO 0.22 -0.38 0.63 -2.14 0.70 0.00 0.00 175.22 174.25 1xcq s PRO 125 N 1.12 4.32 1.03 0.24 0.02 -1.26 -0.41 135.00 140.06 1xcq s PRO 125 Ca -0.07 0.84 -0.22 0.00 0.02 0.00 0.00 61.00 61.57 1xcq s PRO 125 Cb -0.06 -3.28 -0.09 0.00 0.02 0.00 0.00 34.50 31.08 1xcq s PRO 125 CO -0.11 0.52 -0.86 -2.30 -0.33 0.00 0.00 177.00 173.92 1xcq n PRO 126 N 2.09 -0.42 -3.98 5.54 -0.02 -1.23 -4.90 135.00 132.08 1xcq n PRO 126 Ca -0.08 -0.12 -0.21 0.00 -2.02 0.00 0.00 63.50 61.08 1xcq n PRO 126 Cb 0.50 -1.25 -0.02 0.00 -0.02 0.00 0.00 33.50 32.71 1xcq n PRO 126 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1xcq s SER 127 N -1.30 6.24 0.48 2.55 1.04 -1.26 -4.90 113.70 116.55 1xcq s SER 127 Ca 0.44 0.04 0.21 0.00 0.48 0.00 0.00 55.95 57.11 1xcq s SER 127 Cb -0.03 -1.81 1.24 0.00 0.10 0.00 0.00 66.02 65.52 1xcq s SER 127 CO 0.69 -0.07 1.95 0.28 0.98 0.00 0.00 173.24 177.07 1xcq h SER 128 N 1.20 0.19 0.73 7.02 0.02 -1.98 1.25 113.55 121.97 1xcq h SER 128 Ca -0.52 0.01 -0.23 0.00 -0.84 0.00 0.00 61.79 60.21 1xcq h SER 128 Cb 1.23 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 1xcq h SER 128 CO 0.61 0.09 -1.38 -0.33 -1.14 0.00 0.00 176.83 174.68 1xcq h GLU 129 N 0.20 0.00 0.04 3.45 5.08 -1.98 -2.40 114.58 118.96 1xcq h GLU 129 Ca 0.32 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1xcq h GLU 129 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1xcq h GLU 129 CO -0.06 0.59 -0.02 0.37 -1.00 0.00 0.00 179.01 178.89 1xcq h GLN 130 N 0.00 -0.05 -0.90 2.33 4.15 -0.94 -2.85 115.11 116.85 1xcq h GLN 130 Ca -0.17 0.00 0.09 0.00 0.77 0.00 0.00 58.65 59.35 1xcq h GLN 130 Cb 1.83 0.01 -0.12 0.00 0.21 0.00 0.00 27.48 29.41 1xcq h GLN 130 CO 0.09 0.62 -0.55 1.25 -1.93 0.00 0.00 178.83 178.31 1xcq h LEU 131 N -0.86 -1.98 -0.94 -2.39 5.85 0.13 2.58 115.31 117.69 1xcq h LEU 131 Ca -0.01 0.31 0.20 0.00 0.84 0.00 0.00 57.88 59.23 1xcq h LEU 131 Cb 0.69 0.89 -0.18 0.00 0.37 0.00 0.00 40.66 42.43 1xcq h LEU 131 CO 0.01 -0.27 -0.18 0.41 -0.34 0.00 0.00 178.44 178.07 1xcq n THR 132 N -5.31 -0.39 0.00 1.05 -1.04 -0.90 -4.16 114.28 103.52 1xcq n THR 132 Ca 0.02 2.13 0.00 0.00 -2.04 0.00 0.00 64.05 64.16 1xcq n THR 132 Cb 0.30 -2.98 0.00 0.00 -1.82 0.00 0.00 70.33 65.82 1xcq n THR 132 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1xcq n SER 133 N -5.50 0.00 -2.86 8.00 2.88 0.87 -4.98 113.62 112.04 1xcq n SER 133 Ca 0.17 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.59 1xcq n SER 133 Cb 0.53 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.02 1xcq n SER 133 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xcq n GLY 134 N 0.00 0.86 0.00 0.46 0.00 -1.25 -5.01 105.19 100.25 1xcq n GLY 134 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1xcq n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xcq n GLY 135 N 1.33 0.00 3.49 -0.02 0.00 -1.26 -4.88 105.19 103.83 1xcq n GLY 135 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1xcq n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcq n ALA 136 N 0.00 0.64 -2.60 4.61 0.00 -1.26 -4.86 120.51 117.04 1xcq n ALA 136 Ca 0.00 -0.40 -0.38 0.00 0.00 0.00 0.00 53.44 52.66 1xcq n ALA 136 Cb 0.00 -2.62 -0.06 0.00 0.00 0.00 0.00 19.45 16.77 1xcq n ALA 136 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xcq s SER 137 N 9.40 6.69 0.13 0.00 0.01 -1.26 -2.69 113.70 125.98 1xcq s SER 137 Ca 1.17 0.83 -0.07 0.00 1.31 0.00 0.00 55.95 59.19 1xcq s SER 137 Cb -0.84 -2.23 -0.06 0.00 0.21 0.00 0.00 66.02 63.11 1xcq s SER 137 CO 0.43 0.24 0.40 -0.69 0.41 0.00 0.00 173.24 174.03 1xcq s VAL 138 N -0.54 5.13 0.16 3.43 1.01 0.12 -3.49 120.40 126.22 1xcq s VAL 138 Ca 0.22 0.18 0.07 0.00 0.00 0.00 0.00 61.98 62.45 1xcq s VAL 138 Cb -0.15 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1xcq s VAL 138 CO 0.11 0.10 -0.15 -0.69 0.00 0.00 0.00 175.10 174.46 1xcq s VAL 139 N -1.60 1.57 -0.28 2.92 1.01 0.45 -2.51 120.40 121.96 1xcq s VAL 139 Ca 0.39 -1.94 -0.01 0.00 0.00 0.00 0.00 61.98 60.42 1xcq s VAL 139 Cb -0.12 -1.79 0.17 0.00 0.00 0.00 0.00 36.38 34.63 1xcq s VAL 139 CO 0.22 -0.47 0.50 0.00 0.00 0.00 0.00 175.10 175.36 1xcq s PHE 141 N 2.72 3.24 -1.12 0.00 0.08 -0.45 -2.70 117.98 119.74 1xcq s PHE 141 Ca 0.16 0.10 -0.12 0.00 0.12 0.00 0.00 56.93 57.18 1xcq s PHE 141 Cb -0.14 -2.32 0.21 0.00 -0.57 0.00 0.00 43.02 40.20 1xcq s PHE 141 CO -0.21 -0.10 1.23 -0.51 -0.10 0.00 0.00 175.22 175.53 1xcq s LEU 142 N 1.48 5.71 0.26 -0.37 1.43 0.26 -2.10 118.68 125.34 1xcq s LEU 142 Ca 0.07 -3.14 -0.01 0.00 -1.03 0.00 0.00 54.13 50.02 1xcq s LEU 142 Cb -0.15 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 1xcq s LEU 142 CO 0.08 -0.57 0.47 0.20 0.23 0.00 0.00 176.35 176.75 1xcq s ASN 143 N 2.23 6.38 -0.48 2.29 0.01 -0.92 -1.09 114.94 123.36 1xcq s ASN 143 Ca 0.35 0.49 -0.33 0.00 -0.71 0.00 0.00 52.86 52.65 1xcq s ASN 143 Cb -0.06 -2.05 0.05 0.00 0.41 0.00 0.00 41.25 39.60 1xcq s ASN 143 CO -0.05 -0.14 0.64 0.59 -1.51 0.00 0.00 177.10 176.63 1xcq n ASN 144 N -1.00 -5.17 -4.06 -1.22 5.03 -0.96 -0.73 115.26 107.15 1xcq n ASN 144 Ca -0.04 -0.27 -0.18 0.00 0.87 0.00 0.00 54.58 54.96 1xcq n ASN 144 Cb 0.54 -1.53 -0.14 0.00 -1.02 0.00 0.00 39.78 37.64 1xcq n ASN 144 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 1xcq s PHE 145 N -1.61 0.89 0.04 3.10 -0.12 -0.85 -4.39 117.98 115.05 1xcq s PHE 145 Ca 0.32 -0.27 -0.09 0.00 -0.05 0.00 0.00 56.93 56.85 1xcq s PHE 145 Cb -0.03 -0.55 0.00 0.00 -0.63 0.00 0.00 43.02 41.81 1xcq s PHE 145 CO 0.85 -0.01 0.18 -0.47 -0.05 0.00 0.00 175.22 175.72 1xcq s TYR 146 N -0.59 0.08 0.00 3.49 6.14 0.32 -3.00 117.35 123.79 1xcq s TYR 146 Ca 0.01 -0.31 0.00 0.00 0.64 0.00 0.00 57.07 57.40 1xcq s TYR 146 Cb -0.06 -0.05 0.00 0.00 0.42 0.00 0.00 41.96 42.27 1xcq s TYR 146 CO 0.00 -0.42 0.00 -0.35 0.64 0.00 0.00 175.55 175.43 1xcq n PRO 147 N 0.72 1.91 0.00 4.97 -0.04 -1.26 -1.51 135.00 139.79 1xcq n PRO 147 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 1xcq n PRO 147 Cb 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.05 1xcq n PRO 147 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1xcq n LYS 148 N 0.00 0.00 -0.24 0.54 2.85 -1.26 -4.92 118.16 115.13 1xcq n LYS 148 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1xcq n LYS 148 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1xcq n LYS 148 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1xcq n ASP 149 N 0.00 -0.52 -4.02 -5.58 8.00 -1.26 -4.96 116.55 108.21 1xcq n ASP 149 Ca 0.00 0.08 -0.10 0.00 0.71 0.00 0.00 54.79 55.48 1xcq n ASP 149 Cb 0.00 -0.13 -0.07 0.00 -0.02 0.00 0.00 41.12 40.91 1xcq n ASP 149 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1xcq s ILE 150 N 0.00 0.02 -0.26 0.53 2.07 -1.26 -4.97 121.20 117.33 1xcq s ILE 150 Ca 0.00 -1.49 -0.26 0.00 -1.41 0.00 0.00 60.65 57.49 1xcq s ILE 150 Cb 0.00 -2.12 0.11 0.00 0.13 0.00 0.00 42.46 40.58 1xcq s ILE 150 CO 0.00 -0.10 0.95 0.54 -1.91 0.00 0.00 174.94 174.41 1xcq s ASN 151 N -3.02 -0.52 0.07 4.50 2.20 -1.26 -5.16 114.94 111.76 1xcq s ASN 151 Ca 0.23 0.95 0.02 0.00 -0.94 0.00 0.00 52.86 53.13 1xcq s ASN 151 Cb 0.02 0.95 -0.03 0.00 -2.00 0.00 0.00 41.25 40.18 1xcq s ASN 151 CO 0.06 -0.21 -0.08 -0.69 -2.94 0.00 0.00 177.10 173.24 1xcq s VAL 152 N 0.08 0.69 -0.08 3.54 1.01 -1.26 -3.96 120.40 120.43 1xcq s VAL 152 Ca 0.01 -1.52 0.03 0.00 0.00 0.00 0.00 61.98 60.51 1xcq s VAL 152 Cb -0.04 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.14 1xcq s VAL 152 CO -0.03 -0.60 -0.18 -0.75 0.00 0.00 0.00 175.10 173.54 1xcq s LYS 153 N -2.67 2.78 -0.19 2.72 2.20 -1.07 -4.92 119.74 118.60 1xcq s LYS 153 Ca 0.01 -0.77 -0.13 0.00 -0.36 0.00 0.00 55.97 54.73 1xcq s LYS 153 Cb -0.03 -2.38 -0.05 0.00 -1.51 0.00 0.00 37.83 33.87 1xcq s LYS 153 CO -0.02 0.42 0.25 -1.58 -0.36 0.00 0.00 175.35 174.06 1xcq s TRP 154 N -0.21 3.42 -0.26 4.03 0.52 -1.26 0.40 118.94 125.58 1xcq s TRP 154 Ca -0.00 0.48 0.01 0.00 0.02 0.00 0.00 56.10 56.60 1xcq s TRP 154 Cb -0.13 -2.31 0.07 0.00 -1.15 0.00 0.00 33.47 29.95 1xcq s TRP 154 CO 0.03 0.20 -0.01 0.15 0.02 0.00 0.00 176.95 177.35 1xcq s LYS 155 N 0.60 1.38 -0.24 4.98 -0.14 0.28 -2.74 119.74 123.86 1xcq s LYS 155 Ca 0.13 -1.09 -0.21 0.00 -1.36 0.00 0.00 55.97 53.44 1xcq s LYS 155 Cb -0.13 -2.54 -0.02 0.00 -1.68 0.00 0.00 37.83 33.46 1xcq s LYS 155 CO 0.03 -0.72 0.65 0.42 -0.76 0.00 0.00 175.35 174.97 1xcq s ILE 156 N 1.40 4.98 -0.95 2.17 -1.09 0.14 -2.05 121.20 125.78 1xcq s ILE 156 Ca -0.00 1.19 -0.14 0.00 -2.23 0.00 0.00 60.65 59.47 1xcq s ILE 156 Cb -0.18 -3.96 0.02 0.00 -1.58 0.00 0.00 42.46 36.76 1xcq s ILE 156 CO -0.10 0.04 0.26 -0.67 -1.23 0.00 0.00 174.94 173.24 1xcq n ASP 157 N 5.58 -1.25 0.00 3.58 -0.08 0.40 0.12 116.55 124.90 1xcq n ASP 157 Ca -0.00 -0.91 0.00 0.00 -1.51 0.00 0.00 54.79 52.37 1xcq n ASP 157 Cb 0.49 -1.10 0.00 0.00 2.34 0.00 0.00 41.12 42.85 1xcq n ASP 157 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xcq n GLY 158 N -1.92 1.09 3.84 0.27 0.00 -1.26 -4.85 105.19 102.37 1xcq n GLY 158 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1xcq n GLY 158 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xcq s SER 159 N 0.00 6.68 0.40 1.61 1.04 0.33 -4.99 113.70 118.78 1xcq s SER 159 Ca 0.00 1.49 -0.13 0.00 0.48 0.00 0.00 55.95 57.79 1xcq s SER 159 Cb 0.00 -2.47 -0.08 0.00 0.10 0.00 0.00 66.02 63.58 1xcq s SER 159 CO 0.00 -0.48 0.81 -0.70 0.98 0.00 0.00 173.24 173.85 1xcq s GLU 160 N -3.77 3.89 -0.21 4.02 2.12 -1.26 0.24 118.70 123.73 1xcq s GLU 160 Ca 0.58 0.63 -0.04 0.00 0.36 0.00 0.00 54.97 56.50 1xcq s GLU 160 Cb -0.10 -2.35 0.08 0.00 0.26 0.00 0.00 34.13 32.03 1xcq s GLU 160 CO 0.27 -0.03 0.14 1.03 -0.54 0.00 0.00 175.26 176.12 1xcq s ARG 161 N -3.64 0.13 0.00 4.30 1.81 -1.11 -4.84 118.95 115.60 1xcq s ARG 161 Ca 0.54 -0.12 0.00 0.00 -1.72 0.00 0.00 55.73 54.43 1xcq s ARG 161 Cb -0.10 -1.50 0.00 0.00 -0.45 0.00 0.00 34.95 32.90 1xcq s ARG 161 CO 0.27 -0.76 0.02 0.94 -0.68 0.00 0.00 175.30 175.09 1xcq n GLN 162 N 5.28 0.00 -1.29 3.54 7.27 -1.26 -4.70 117.38 126.23 1xcq n GLN 162 Ca -0.06 0.00 -0.36 0.00 0.07 0.00 0.00 57.00 56.64 1xcq n GLN 162 Cb 0.48 -0.39 0.06 0.00 2.41 0.00 0.00 30.24 32.80 1xcq n GLN 162 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1xcq n ASN 163 N -0.02 -1.26 0.00 1.69 3.02 -1.26 -3.80 115.26 113.63 1xcq n ASN 163 Ca 0.00 0.61 0.00 0.00 -0.03 0.00 0.00 54.58 55.16 1xcq n ASN 163 Cb 0.00 -1.20 0.00 0.00 -0.61 0.00 0.00 39.78 37.97 1xcq n ASN 163 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xcq n GLY 164 N 1.70 2.34 3.35 7.41 0.00 -1.26 -4.99 105.19 113.74 1xcq n GLY 164 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1xcq n GLY 164 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1xcq n VAL 165 N -0.37 0.00 -3.27 1.61 3.14 -1.25 -2.55 118.33 115.64 1xcq n VAL 165 Ca 0.00 -0.23 0.03 0.00 -2.96 0.00 0.00 64.34 61.18 1xcq n VAL 165 Cb 0.00 -0.54 -0.02 0.00 -1.06 0.00 0.00 33.84 32.22 1xcq n VAL 165 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1xcq s LEU 166 N 0.02 -1.05 0.37 6.55 0.20 -0.89 -4.89 118.68 118.98 1xcq s LEU 166 Ca 0.55 0.87 0.09 0.00 0.69 0.00 0.00 54.13 56.32 1xcq s LEU 166 Cb -0.20 1.97 -0.07 0.00 -0.43 0.00 0.00 46.19 47.46 1xcq s LEU 166 CO 0.69 -0.20 -0.06 0.20 -0.29 0.00 0.00 176.35 176.70 1xcq s ASN 167 N 2.84 3.80 -0.25 3.68 0.02 -1.26 -0.66 114.94 123.10 1xcq s ASN 167 Ca 0.09 -1.25 -0.26 0.00 -1.02 0.00 0.00 52.86 50.42 1xcq s ASN 167 Cb -0.12 -0.37 0.08 0.00 0.02 0.00 0.00 41.25 40.86 1xcq s ASN 167 CO -0.18 -0.29 0.79 -0.55 0.02 0.00 0.00 177.10 176.89 1xcq s SER 168 N -3.65 -0.66 -0.02 -1.22 0.15 -1.26 -4.93 113.70 102.11 1xcq s SER 168 Ca 0.33 1.22 0.04 0.00 0.70 0.00 0.00 55.95 58.24 1xcq s SER 168 Cb 0.05 1.22 -0.00 0.00 -1.71 0.00 0.00 66.02 65.57 1xcq s SER 168 CO 0.17 -0.27 -0.13 0.26 1.20 0.00 0.00 173.24 174.48 1xcq s TRP 169 N 0.15 1.22 0.27 3.44 0.51 -1.26 -2.27 118.94 121.00 1xcq s TRP 169 Ca -0.00 -0.28 -0.29 0.00 -2.12 0.00 0.00 56.10 53.40 1xcq s TRP 169 Cb -0.04 -0.82 -0.09 0.00 -0.81 0.00 0.00 33.47 31.70 1xcq s TRP 169 CO 0.00 -0.08 1.12 0.95 -0.51 0.00 0.00 176.95 178.44 1xcq s THR 170 N -0.07 3.45 0.37 2.01 -4.23 -1.12 -5.02 115.64 111.04 1xcq s THR 170 Ca 0.01 1.43 -0.28 0.00 -1.18 0.00 0.00 61.69 61.66 1xcq s THR 170 Cb -0.08 -3.91 -0.11 0.00 1.34 0.00 0.00 72.50 69.74 1xcq s THR 170 CO 0.00 0.33 1.49 -1.81 -0.54 0.00 0.00 174.62 174.09 1xcq s ASP 171 N -0.71 6.36 -0.33 3.99 1.01 -1.26 -4.51 116.67 121.21 1xcq s ASP 171 Ca 0.46 3.03 -0.30 0.00 0.71 0.00 0.00 52.55 56.45 1xcq s ASP 171 Cb -0.32 -2.66 -0.13 0.00 1.01 0.00 0.00 42.92 40.81 1xcq s ASP 171 CO 0.41 -0.87 1.25 1.67 0.21 0.00 0.00 175.17 177.85 1xcq n GLN 172 N 0.63 0.00 -1.86 8.23 7.27 -1.26 -4.61 117.38 125.78 1xcq n GLN 172 Ca 0.02 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.66 1xcq n GLN 172 Cb 0.39 -1.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.01 1xcq n GLN 172 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1xcq s ASP 173 N 3.03 5.68 0.66 1.69 3.68 0.35 -4.80 116.67 126.97 1xcq s ASP 173 Ca 0.75 1.45 0.20 0.00 2.13 0.00 0.00 52.55 57.08 1xcq s ASP 173 Cb -1.00 -2.52 1.11 0.00 -1.45 0.00 0.00 42.92 39.06 1xcq s ASP 173 CO 0.49 -1.85 1.63 -1.28 0.13 0.00 0.00 175.17 174.28 1xcq h SER 174 N 13.88 0.00 0.23 -0.34 0.87 -1.86 2.17 113.55 128.50 1xcq h SER 174 Ca -0.35 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.20 1xcq h SER 174 Cb 1.19 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.15 1xcq h SER 174 CO 1.02 0.00 -0.14 0.11 -0.53 0.00 0.00 176.83 177.29 1xcq h LYS 175 N 0.00 -0.34 0.00 2.24 1.57 -1.94 -3.38 116.57 114.73 1xcq h LYS 175 Ca 0.00 0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1xcq h LYS 175 Cb 1.09 0.08 -0.12 0.00 0.08 0.00 0.00 32.23 33.35 1xcq h LYS 175 CO 0.00 -0.23 -0.58 -0.40 -0.57 0.00 0.00 179.45 177.67 1xcq n ASP 176 N -3.10 1.34 -1.87 0.86 5.68 0.04 -4.93 116.55 114.56 1xcq n ASP 176 Ca -0.04 -2.88 -0.05 0.00 -0.50 0.00 0.00 54.79 51.32 1xcq n ASP 176 Cb 0.15 -0.39 -0.01 0.00 -1.14 0.00 0.00 41.12 39.73 1xcq n ASP 176 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1xcq n SER 177 N -0.50 -1.69 -4.87 -1.12 7.64 0.72 -4.82 113.62 108.97 1xcq n SER 177 Ca 0.12 0.26 -0.22 0.00 1.01 0.00 0.00 58.87 60.04 1xcq n SER 177 Cb 0.83 -1.69 -0.03 0.00 -1.01 0.00 0.00 64.21 62.32 1xcq n SER 177 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xcq s THR 178 N -1.85 2.39 0.40 0.44 2.01 -1.16 -4.68 115.64 113.18 1xcq s THR 178 Ca 0.00 -1.39 0.05 0.00 0.31 0.00 0.00 61.69 60.66 1xcq s THR 178 Cb 0.00 -2.78 -0.06 0.00 0.01 0.00 0.00 72.50 69.67 1xcq s THR 178 CO 0.00 0.00 0.03 -0.31 -0.69 0.00 0.00 174.62 173.65 1xcq s TYR 179 N -2.56 2.22 -0.10 4.92 1.51 -1.16 0.13 117.35 122.31 1xcq s TYR 179 Ca 0.45 -0.83 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 1xcq s TYR 179 Cb -0.02 -1.57 0.11 0.00 -0.11 0.00 0.00 41.96 40.36 1xcq s TYR 179 CO 0.26 0.24 0.89 -1.12 -1.11 0.00 0.00 175.55 174.72 1xcq s SER 180 N -3.66 -0.44 -0.02 2.29 0.01 -1.26 -2.00 113.70 108.61 1xcq s SER 180 Ca 0.30 0.41 0.04 0.00 1.31 0.00 0.00 55.95 58.01 1xcq s SER 180 Cb 0.08 0.38 -0.01 0.00 0.21 0.00 0.00 66.02 66.68 1xcq s SER 180 CO 0.15 -0.46 -0.12 -0.32 0.41 0.00 0.00 173.24 172.90 1xcq s MET 181 N -1.48 1.08 -0.51 12.44 1.75 -0.25 -2.77 119.30 129.56 1xcq s MET 181 Ca -0.03 -0.42 0.06 0.00 -1.25 0.00 0.00 55.69 54.05 1xcq s MET 181 Cb -0.00 -1.01 0.23 0.00 2.84 0.00 0.00 34.83 36.88 1xcq s MET 181 CO 0.02 0.22 0.55 0.45 -0.65 0.00 0.00 175.02 175.61 1xcq n SER 182 N 2.95 1.45 -4.77 1.11 2.88 -0.96 0.93 113.62 117.21 1xcq n SER 182 Ca -0.15 -2.92 -0.39 0.00 -1.33 0.00 0.00 58.87 54.08 1xcq n SER 182 Cb 0.55 -0.65 -0.01 0.00 -0.75 0.00 0.00 64.21 63.35 1xcq n SER 182 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1xcq s SER 183 N -1.37 6.44 -0.15 -3.46 0.15 -1.10 -4.05 113.70 110.16 1xcq s SER 183 Ca 0.35 2.53 -0.04 0.00 0.70 0.00 0.00 55.95 59.49 1xcq s SER 183 Cb 0.11 -2.63 0.06 0.00 -1.71 0.00 0.00 66.02 61.86 1xcq s SER 183 CO -0.11 -0.75 0.14 -0.89 1.20 0.00 0.00 173.24 172.84 1xcq s THR 184 N -1.30 -0.20 -0.57 6.45 2.01 0.16 -1.85 115.64 120.34 1xcq s THR 184 Ca 0.56 0.03 -0.25 0.00 0.31 0.00 0.00 61.69 62.33 1xcq s THR 184 Cb -0.35 -0.50 0.04 0.00 0.01 0.00 0.00 72.50 71.69 1xcq s THR 184 CO 0.45 -0.12 1.03 -0.22 -0.69 0.00 0.00 174.62 175.07 1xcq s LEU 185 N 2.24 3.89 -0.95 4.42 2.96 -1.04 -2.10 118.68 128.09 1xcq s LEU 185 Ca 0.04 -0.25 -0.13 0.00 -0.22 0.00 0.00 54.13 53.57 1xcq s LEU 185 Cb -0.15 -2.90 0.22 0.00 0.50 0.00 0.00 46.19 43.87 1xcq s LEU 185 CO -0.09 -1.33 0.96 -0.89 -1.32 0.00 0.00 176.35 173.68 1xcq s THR 186 N 4.31 5.59 0.00 3.68 2.01 -1.06 -0.70 115.64 129.47 1xcq s THR 186 Ca 0.34 -2.66 0.00 0.00 0.31 0.00 0.00 61.69 59.68 1xcq s THR 186 Cb -0.11 -4.58 0.00 0.00 0.01 0.00 0.00 72.50 67.82 1xcq s THR 186 CO 0.20 -1.17 0.00 0.18 -0.69 0.00 0.00 174.62 173.14 1xcq n LEU 187 N 4.01 0.00 -4.16 4.42 4.77 -1.09 -4.88 117.00 120.07 1xcq n LEU 187 Ca 0.20 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.05 1xcq n LEU 187 Cb 0.45 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.45 1xcq n LEU 187 CO 0.41 0.00 -0.11 0.42 -1.33 0.00 0.00 177.39 176.78 1xcq s THR 188 N 0.00 0.00 0.00 -5.08 -4.23 -1.26 -4.63 115.64 100.44 1xcq s THR 188 Ca 0.00 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 1xcq s THR 188 Cb 0.00 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.39 1xcq s THR 188 CO 0.00 0.00 0.00 1.17 -0.54 0.00 0.00 174.62 175.25 1xcq n LYS 189 N -0.35 0.00 0.14 3.99 4.81 -1.26 0.11 118.16 125.60 1xcq n LYS 189 Ca 0.02 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.59 1xcq n LYS 189 Cb 0.64 -0.06 0.39 0.00 0.02 0.00 0.00 35.03 36.02 1xcq n LYS 189 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1xcq h ASP 190 N 0.00 0.00 0.22 3.14 5.19 -1.98 -3.08 116.42 119.90 1xcq h ASP 190 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1xcq h ASP 190 Cb 0.00 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 1xcq h ASP 190 CO 0.00 0.00 -0.22 -0.08 -3.12 0.00 0.00 179.24 175.82 1xcq h GLU 191 N 0.00 -0.46 0.05 3.56 4.57 -1.69 0.40 114.58 121.02 1xcq h GLU 191 Ca 0.00 0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.24 1xcq h GLU 191 Cb 0.73 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.38 1xcq h GLU 191 CO 0.00 -0.31 -0.31 -0.92 -1.18 0.00 0.00 179.01 176.30 1xcq h TYR 192 N -0.48 -0.84 0.00 0.92 3.20 -0.23 -2.58 116.97 116.97 1xcq h TYR 192 Ca -0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 1xcq h TYR 192 Cb 0.45 0.36 -0.00 0.00 1.54 0.00 0.00 36.73 39.08 1xcq h TYR 192 CO -0.16 -0.40 -0.01 0.93 -1.64 0.00 0.00 178.16 176.87 1xcq h GLU 193 N -0.49 0.00 0.00 1.82 4.39 -1.02 -3.26 114.58 116.02 1xcq h GLU 193 Ca 0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1xcq h GLU 193 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1xcq h GLU 193 CO -0.22 0.01 0.00 0.54 -1.16 0.00 0.00 179.01 178.18 1xcq n ARG 194 N -3.17 0.00 0.00 2.33 1.74 0.12 -4.98 116.66 112.70 1xcq n ARG 194 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1xcq n ARG 194 Cb 0.14 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.58 1xcq n ARG 194 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1xcq n HIS 195 N 0.00 0.00 -1.59 -1.55 8.25 -1.19 -5.06 115.22 114.08 1xcq n HIS 195 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1xcq n HIS 195 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1xcq n HIS 195 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1xcq n ASN 196 N 0.00 0.00 -1.56 0.41 5.15 -1.26 -4.93 115.26 113.07 1xcq n ASN 196 Ca 0.00 0.00 -0.04 0.00 -0.60 0.00 0.00 54.58 53.94 1xcq n ASN 196 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1xcq n ASN 196 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1xcq n SER 197 N 0.00 -0.62 -4.62 1.20 3.41 -1.26 0.15 113.62 111.88 1xcq n SER 197 Ca 0.00 -0.04 -0.40 0.00 -0.26 0.00 0.00 58.87 58.17 1xcq n SER 197 Cb 0.00 -0.18 -0.07 0.00 -0.26 0.00 0.00 64.21 63.70 1xcq n SER 197 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1xcq s TYR 198 N -0.55 3.27 -0.14 7.33 2.02 -1.24 -2.00 117.35 126.04 1xcq s TYR 198 Ca 0.04 0.71 -0.13 0.00 -0.37 0.00 0.00 57.07 57.32 1xcq s TYR 198 Cb -0.00 -2.80 0.04 0.00 -0.40 0.00 0.00 41.96 38.80 1xcq s TYR 198 CO 0.10 -0.32 0.38 -0.08 -1.57 0.00 0.00 175.55 174.07 1xcq s THR 199 N 2.42 0.00 -0.21 -0.71 -1.32 -0.87 -3.18 115.64 111.78 1xcq s THR 199 Ca 0.24 -0.02 -0.05 0.00 -1.21 0.00 0.00 61.69 60.65 1xcq s THR 199 Cb -0.16 -0.54 -0.02 0.00 -1.51 0.00 0.00 72.50 70.27 1xcq s THR 199 CO 0.09 -0.01 -0.00 0.00 -2.21 0.00 0.00 174.62 172.49 1xcq s GLU 201 N 1.15 2.99 -0.41 0.00 2.02 1.33 -3.89 118.70 121.90 1xcq s GLU 201 Ca 0.03 -1.62 -0.23 0.00 0.02 0.00 0.00 54.97 53.17 1xcq s GLU 201 Cb -0.14 -4.27 0.02 0.00 0.10 0.00 0.00 34.13 29.83 1xcq s GLU 201 CO 0.01 -1.30 0.75 0.00 0.02 0.00 0.00 175.26 174.74 1xcq s ALA 202 N 1.70 3.35 -0.24 5.21 0.00 -0.49 -2.59 121.76 128.69 1xcq s ALA 202 Ca 0.04 -0.91 -0.05 0.00 0.00 0.00 0.00 51.96 51.04 1xcq s ALA 202 Cb -0.29 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.44 1xcq s ALA 202 CO 0.04 -1.72 0.01 0.99 0.00 0.00 0.00 175.76 175.08 1xcq s THR 203 N 3.12 3.70 0.12 0.00 2.01 -1.25 -0.50 115.64 122.84 1xcq s THR 203 Ca 0.29 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.84 1xcq s THR 203 Cb -0.13 -2.76 -0.04 0.00 0.01 0.00 0.00 72.50 69.58 1xcq s THR 203 CO 0.20 0.32 -0.09 -2.28 -0.69 0.00 0.00 174.62 172.08 1xcq s HIS 204 N 1.51 1.07 -0.78 4.92 2.46 -1.26 -4.45 115.29 118.76 1xcq s HIS 204 Ca 0.05 -0.80 0.24 0.00 0.47 0.00 0.00 55.06 55.02 1xcq s HIS 204 Cb -0.15 -0.58 0.92 0.00 -0.13 0.00 0.00 32.58 32.64 1xcq s HIS 204 CO -0.00 -0.03 1.73 1.63 -2.47 0.00 0.00 174.74 175.60 1xcq n LYS 205 N 0.02 0.13 0.00 2.88 5.02 -1.26 -2.35 118.16 122.60 1xcq n LYS 205 Ca -0.12 0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1xcq n LYS 205 Cb 0.60 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1xcq n LYS 205 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1xcq n THR 206 N -1.93 0.52 -3.65 -0.18 -2.24 -1.26 -4.48 114.28 101.06 1xcq n THR 206 Ca 0.05 0.20 -0.00 0.00 -2.27 0.00 0.00 64.05 62.02 1xcq n THR 206 Cb 0.31 -1.20 -0.06 0.00 -2.10 0.00 0.00 70.33 67.27 1xcq n THR 206 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xcq s SER 207 N -2.06 -0.06 0.00 3.42 0.15 -0.99 -4.86 113.70 109.29 1xcq s SER 207 Ca 0.00 0.11 -0.00 0.00 0.70 0.00 0.00 55.95 56.76 1xcq s SER 207 Cb 0.00 0.62 -0.00 0.00 -1.71 0.00 0.00 66.02 64.92 1xcq s SER 207 CO 0.00 -0.02 1.70 0.35 1.20 0.00 0.00 173.24 176.47 1xcq n THR 208 N 2.42 1.69 -3.38 6.45 -2.24 -1.26 -4.44 114.28 113.51 1xcq n THR 208 Ca -0.14 -0.43 -0.20 0.00 -2.27 0.00 0.00 64.05 61.00 1xcq n THR 208 Cb 0.57 -1.43 -0.09 0.00 -2.10 0.00 0.00 70.33 67.28 1xcq n THR 208 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xcq s SER 209 N 2.00 1.63 -0.44 3.42 0.15 -1.26 -5.12 113.70 114.09 1xcq s SER 209 Ca 0.01 -1.81 -0.40 0.00 0.70 0.00 0.00 55.95 54.46 1xcq s SER 209 Cb 0.00 0.29 -0.17 0.00 -1.71 0.00 0.00 66.02 64.43 1xcq s SER 209 CO 0.00 -0.27 1.77 -2.65 1.20 0.00 0.00 173.24 173.29 1xcq n PRO 210 N 4.12 0.00 -2.28 5.44 -0.02 -1.26 -4.76 135.00 136.24 1xcq n PRO 210 Ca 0.12 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.17 1xcq n PRO 210 Cb 0.43 -1.33 -0.02 0.00 -0.02 0.00 0.00 33.50 32.56 1xcq n PRO 210 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1xcq s ILE 211 N 4.62 4.01 0.22 4.25 1.09 0.35 -4.83 121.20 130.91 1xcq s ILE 211 Ca 1.03 1.20 -0.02 0.00 -1.10 0.00 0.00 60.65 61.76 1xcq s ILE 211 Cb -1.33 -3.85 -0.04 0.00 -1.06 0.00 0.00 42.46 36.17 1xcq s ILE 211 CO 0.62 -0.19 0.43 0.68 -0.10 0.00 0.00 174.94 176.37 1xcq s VAL 212 N 4.02 5.16 -0.28 2.92 -7.23 -1.26 -1.40 120.40 122.34 1xcq s VAL 212 Ca 0.62 -0.27 -0.23 0.00 -1.81 0.00 0.00 61.98 60.29 1xcq s VAL 212 Cb -0.24 -3.73 0.09 0.00 0.56 0.00 0.00 36.38 33.06 1xcq s VAL 212 CO 0.21 -0.20 0.84 -0.54 -0.31 0.00 0.00 175.10 175.10 1xcq s LYS 213 N -3.36 0.68 0.00 4.82 -0.14 -1.25 -4.98 119.74 115.51 1xcq s LYS 213 Ca 0.40 0.88 0.00 0.00 -1.36 0.00 0.00 55.97 55.88 1xcq s LYS 213 Cb -0.11 0.30 0.00 0.00 -1.68 0.00 0.00 37.83 36.34 1xcq s LYS 213 CO 0.29 -0.09 0.00 -1.13 -0.76 0.00 0.00 175.35 173.66 1xcq n SER 214 N 2.83 0.00 -3.44 2.83 3.41 -1.26 -2.47 113.62 115.52 1xcq n SER 214 Ca -0.15 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.49 1xcq n SER 214 Cb 0.56 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 1xcq n SER 214 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1xcq s PHE 215 N -3.48 -0.12 -0.02 7.33 -0.00 -1.19 -4.94 117.98 115.56 1xcq s PHE 215 Ca 0.00 0.23 -0.30 0.00 -0.00 0.00 0.00 56.93 56.86 1xcq s PHE 215 Cb 0.00 0.07 -0.03 0.00 -0.00 0.00 0.00 43.02 43.07 1xcq s PHE 215 CO 0.00 -0.06 0.99 -0.80 -0.00 0.00 0.00 175.22 175.35 1xcq s ASN 216 N 1.54 7.34 -1.15 1.98 0.01 -1.26 -3.63 114.94 119.76 1xcq s ASN 216 Ca -0.04 1.65 -0.10 0.00 -0.71 0.00 0.00 52.86 53.66 1xcq s ASN 216 Cb -0.02 -2.57 0.24 0.00 0.41 0.00 0.00 41.25 39.32 1xcq s ASN 216 CO -0.13 -0.30 1.27 -1.14 -1.51 0.00 0.00 177.10 175.29 1xcq n ARG 217 N 4.10 3.56 -1.53 -0.60 0.63 -1.26 -4.92 116.66 116.63 1xcq n ARG 217 Ca 0.07 -4.25 0.00 0.00 -0.92 0.00 0.00 57.85 52.75 1xcq n ARG 217 Cb 0.50 -2.71 0.00 0.00 0.45 0.00 0.00 32.46 30.70 1xcq n ARG 217 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1xcq n ASN 218 N 3.53 -7.82 0.00 6.15 3.02 -1.26 -4.74 115.26 114.13 1xcq n ASN 218 Ca 0.29 1.07 0.00 0.00 -0.03 0.00 0.00 54.58 55.91 1xcq n ASN 218 Cb 0.40 -3.88 0.00 0.00 -0.61 0.00 0.00 39.78 35.69 1xcq n ASN 218 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1xcq n GLU 219 N 0.56 0.00 0.00 3.52 4.07 -1.26 -4.97 120.64 122.56 1xcq n GLU 219 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1xcq n GLU 219 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1xcq n GLU 219 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07