#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 -0.03 -1.51 5.18 5.41 -1.26 -4.87 119.36 122.28 1xcq n ILE 2 Ca 0.00 -0.58 -0.41 0.00 1.00 0.00 0.00 62.75 62.76 1xcq n ILE 2 Cb 0.00 -2.04 0.01 0.00 -0.71 0.00 0.00 39.64 36.90 1xcq n ILE 2 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1xcq n VAL 3 N 8.20 2.08 -3.98 1.39 0.24 -1.26 -4.76 118.33 120.25 1xcq n VAL 3 Ca 0.46 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.34 62.17 1xcq n VAL 3 Cb 0.43 -0.74 -0.11 0.00 -1.47 0.00 0.00 33.84 31.94 1xcq n VAL 3 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1xcq s MET 4 N -1.78 0.31 -0.28 7.34 1.00 -1.26 -3.85 119.30 120.78 1xcq s MET 4 Ca 0.64 -0.58 -0.21 0.00 0.00 0.00 0.00 55.69 55.54 1xcq s MET 4 Cb -0.58 0.08 0.09 0.00 0.00 0.00 0.00 34.83 34.42 1xcq s MET 4 CO 0.57 -0.04 0.77 -1.54 0.00 0.00 0.00 175.02 174.78 1xcq s SER 5 N -1.38 -0.76 0.41 3.03 1.04 -1.26 -4.53 113.70 110.26 1xcq s SER 5 Ca -0.15 1.35 0.07 0.00 0.48 0.00 0.00 55.95 57.70 1xcq s SER 5 Cb -0.09 1.35 -0.07 0.00 0.10 0.00 0.00 66.02 67.30 1xcq s SER 5 CO -0.01 -0.22 0.07 -1.10 0.98 0.00 0.00 173.24 172.96 1xcq s GLN 6 N 0.89 2.06 -0.18 4.02 -0.21 -1.26 -2.72 119.66 122.26 1xcq s GLN 6 Ca -0.04 -2.02 -0.29 0.00 0.02 0.00 0.00 55.36 53.03 1xcq s GLN 6 Cb -0.05 -1.76 0.12 0.00 1.00 0.00 0.00 33.01 32.32 1xcq s GLN 6 CO -0.09 -0.08 0.96 0.45 -2.12 0.00 0.00 175.29 174.40 1xcq s SER 7 N -3.79 -0.44 1.15 5.90 0.15 -0.70 -4.62 113.70 111.35 1xcq s SER 7 Ca 0.36 0.61 -0.12 0.00 0.70 0.00 0.00 55.95 57.51 1xcq s SER 7 Cb 0.08 0.53 0.17 0.00 -1.71 0.00 0.00 66.02 65.09 1xcq s SER 7 CO 0.19 -0.32 0.59 -0.81 1.20 0.00 0.00 173.24 174.10 1xcq n PRO 8 N 1.23 -2.34 -0.13 5.44 -0.04 -1.26 0.34 135.00 138.23 1xcq n PRO 8 Ca -0.12 -0.95 0.09 0.00 -0.04 0.00 0.00 63.50 62.47 1xcq n PRO 8 Cb 0.57 -0.92 0.28 0.00 -0.04 0.00 0.00 33.50 33.38 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 -4.09 1.86 -3.65 3.54 3.41 -1.26 -4.31 113.62 109.11 1xcq n SER 9 Ca 0.08 -1.85 -0.02 0.00 -0.26 0.00 0.00 58.87 56.83 1xcq n SER 9 Cb 0.33 -0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.09 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 -1.31 -0.13 -0.29 4.04 1.04 -1.23 -2.87 113.70 112.95 1xcq s SER 10 Ca 0.29 -0.19 -0.19 0.00 0.48 0.00 0.00 55.95 56.35 1xcq s SER 10 Cb 0.16 0.28 0.13 0.00 0.10 0.00 0.00 66.02 66.69 1xcq s SER 10 CO 0.22 -0.51 0.97 -0.76 0.98 0.00 0.00 173.24 174.15 1xcq s LEU 11 N -2.81 -0.52 -0.56 2.42 1.43 0.30 -4.74 118.68 114.20 1xcq s LEU 11 Ca 0.12 0.87 0.06 0.00 -1.03 0.00 0.00 54.13 54.16 1xcq s LEU 11 Cb 0.02 1.82 0.32 0.00 0.03 0.00 0.00 46.19 48.38 1xcq s LEU 11 CO -0.03 -0.14 0.87 0.00 0.23 0.00 0.00 176.35 177.29 1xcq n ALA 12 N 3.33 4.18 -1.34 4.21 0.00 -1.26 0.19 120.51 129.82 1xcq n ALA 12 Ca -0.17 -4.53 -0.15 0.00 0.00 0.00 0.00 53.44 48.60 1xcq n ALA 12 Cb 0.57 -0.79 0.16 0.00 0.00 0.00 0.00 19.45 19.40 1xcq n ALA 12 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1xcq n VAL 13 N 0.07 0.00 -4.32 0.00 0.24 -1.25 -4.06 118.33 109.01 1xcq n VAL 13 Ca 0.30 -0.51 -0.22 0.00 -2.04 0.00 0.00 64.34 61.87 1xcq n VAL 13 Cb 0.43 -1.40 -0.11 0.00 -1.47 0.00 0.00 33.84 31.29 1xcq n VAL 13 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1xcq s SER 14 N -4.01 2.64 -0.47 -1.34 0.01 -1.26 -0.22 113.70 109.06 1xcq s SER 14 Ca 0.52 -0.84 -0.42 0.00 1.31 0.00 0.00 55.95 56.52 1xcq s SER 14 Cb -0.03 -0.15 -0.18 0.00 0.21 0.00 0.00 66.02 65.87 1xcq s SER 14 CO 0.38 -0.03 2.00 0.00 0.41 0.00 0.00 173.24 176.00 1xcq n ALA 15 N 0.39 0.14 -0.02 1.44 0.00 -1.26 -1.60 120.51 119.60 1xcq n ALA 15 Ca -0.14 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1xcq n ALA 15 Cb 0.57 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1xcq n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xcq n GLY 16 N 6.93 0.28 3.94 0.00 0.00 -1.25 -4.93 105.19 110.15 1xcq n GLY 16 Ca 0.51 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.95 1.74 -0.04 1.61 2.02 -0.63 -2.69 118.70 119.77 1xcq s GLU 17 Ca 0.00 -0.42 0.06 0.00 0.02 0.00 0.00 54.97 54.63 1xcq s GLU 17 Cb 0.00 -2.11 -0.02 0.00 0.10 0.00 0.00 34.13 32.10 1xcq s GLU 17 CO 0.00 -1.56 -0.20 0.21 0.02 0.00 0.00 175.26 173.73 1xcq s LYS 18 N -5.39 2.38 0.18 1.61 2.20 -1.26 0.37 119.74 119.83 1xcq s LYS 18 Ca 0.64 -0.82 0.11 0.00 -0.36 0.00 0.00 55.97 55.55 1xcq s LYS 18 Cb -0.08 -2.22 -0.04 0.00 -1.51 0.00 0.00 37.83 33.97 1xcq s LYS 18 CO 0.47 0.55 -0.25 0.54 -0.36 0.00 0.00 175.35 176.30 1xcq s VAL 19 N -0.57 2.34 -0.32 4.02 0.11 -1.15 -4.96 120.40 119.86 1xcq s VAL 19 Ca 0.08 -1.97 -0.02 0.00 -2.93 0.00 0.00 61.98 57.15 1xcq s VAL 19 Cb -0.11 -2.10 0.11 0.00 -1.53 0.00 0.00 36.38 32.75 1xcq s VAL 19 CO 0.00 -0.07 0.15 -0.89 -3.33 0.00 0.00 175.10 170.97 1xcq s THR 20 N -1.53 0.27 0.21 5.04 2.01 -1.26 -3.19 115.64 117.19 1xcq s THR 20 Ca 0.19 -1.26 0.05 0.00 0.31 0.00 0.00 61.69 60.98 1xcq s THR 20 Cb -0.08 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 1xcq s THR 20 CO 0.09 -0.80 0.30 0.00 -0.69 0.00 0.00 174.62 173.52 1xcq s MET 21 N 1.62 3.33 0.40 4.92 0.23 -1.12 -4.73 119.30 123.94 1xcq s MET 21 Ca 0.12 -0.76 0.07 0.00 -1.03 0.00 0.00 55.69 54.09 1xcq s MET 21 Cb -0.19 -2.85 0.00 0.00 -1.53 0.00 0.00 34.83 30.27 1xcq s MET 21 CO -0.22 0.46 0.55 0.45 -2.03 0.00 0.00 175.02 174.22 1xcq s SER 22 N -3.67 5.75 -0.30 -1.18 0.15 1.03 -0.82 113.70 114.65 1xcq s SER 22 Ca 0.34 -0.30 -0.12 0.00 0.70 0.00 0.00 55.95 56.56 1xcq s SER 22 Cb -0.10 -0.89 0.18 0.00 -1.71 0.00 0.00 66.02 63.50 1xcq s SER 22 CO 0.28 -0.67 1.01 0.00 1.20 0.00 0.00 173.24 175.07 1xcq s LYS 24 N 2.94 2.59 0.00 0.00 0.00 -1.10 -2.26 119.74 121.91 1xcq s LYS 24 Ca 0.01 -1.10 0.00 0.00 0.00 0.00 0.00 55.97 54.87 1xcq s LYS 24 Cb -0.11 -2.74 0.00 0.00 0.00 0.00 0.00 37.83 34.99 1xcq s LYS 24 CO -0.12 -0.40 0.00 -1.13 0.00 0.00 0.00 175.35 173.70 1xcq n SER 25 N 4.52 0.00 0.00 0.03 3.41 -1.26 -4.05 113.62 116.28 1xcq n SER 25 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 1xcq n SER 25 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1xcq n SER 25 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1xcq n SER 26 N 0.00 0.00 -2.75 4.04 2.88 -1.25 -4.67 113.62 111.87 1xcq n SER 26 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 1xcq n SER 26 Cb 0.00 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 63.54 1xcq n SER 26 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xcq n GLN 27 N -0.91 1.12 -0.28 -1.46 10.64 -1.26 -4.89 117.38 120.34 1xcq n GLN 27 Ca 0.00 -2.36 0.00 0.00 -1.83 0.00 0.00 57.00 52.81 1xcq n GLN 27 Cb 0.00 -0.72 0.00 0.00 -0.86 0.00 0.00 30.24 28.66 1xcq n GLN 27 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1xcq n SER 28 N -0.17 -2.26 0.00 2.61 2.88 -1.26 -5.01 113.62 110.41 1xcq n SER 28 Ca 0.05 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1xcq n SER 28 Cb 0.79 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 64.22 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 -1.05 0.02 -4.58 2.46 4.77 -0.68 -4.96 117.00 112.99 1xcq n LEU 29 Ca 0.00 -0.16 -0.41 0.00 -0.03 0.00 0.00 56.01 55.41 1xcq n LEU 29 Cb 0.01 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1xcq n LEU 29 CO 0.00 0.01 1.48 -0.22 -1.33 0.00 0.00 177.39 177.33 1xcq s LEU 30 N -0.55 3.41 -0.28 2.23 2.96 -1.26 -3.01 118.68 122.18 1xcq s LEU 30 Ca 0.00 0.69 -0.24 0.00 -0.22 0.00 0.00 54.13 54.36 1xcq s LEU 30 Cb 0.00 -3.04 -0.00 0.00 0.50 0.00 0.00 46.19 43.65 1xcq s LEU 30 CO 0.00 -1.95 0.83 0.21 -1.32 0.00 0.00 176.35 174.12 1xcq s ASN 31 N 6.39 6.76 0.19 3.68 3.04 -1.22 -4.93 114.94 128.84 1xcq s ASN 31 Ca 0.68 0.85 -0.16 0.00 0.04 0.00 0.00 52.86 54.28 1xcq s ASN 31 Cb -0.16 -2.43 0.16 0.00 -1.54 0.00 0.00 41.25 37.28 1xcq s ASN 31 CO 0.27 -0.59 1.64 0.77 -3.04 0.00 0.00 177.10 176.14 1xcq h SER 32 N 7.93 -0.55 -1.26 -4.21 4.64 -1.91 -1.19 113.55 117.00 1xcq h SER 32 Ca -0.23 0.16 0.36 0.00 -0.47 0.00 0.00 61.79 61.61 1xcq h SER 32 Cb 1.09 0.34 -0.05 0.00 -0.31 0.00 0.00 62.40 63.47 1xcq h SER 32 CO 0.89 -0.19 0.99 0.03 -0.87 0.00 0.00 176.83 177.68 1xcq h ARG 33 N -0.03 0.00 0.00 4.77 3.08 -1.98 -3.23 114.38 117.00 1xcq h ARG 33 Ca 0.24 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.25 1xcq h ARG 33 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1xcq h ARG 33 CO -0.54 0.00 -1.15 2.41 -1.07 0.00 0.00 179.97 179.62 1xcq n THR 34 N -3.94 0.16 -1.87 2.04 -1.04 -0.76 -5.00 114.28 103.86 1xcq n THR 34 Ca 0.27 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 1xcq n THR 34 Cb 1.39 -0.62 0.00 0.00 -1.82 0.00 0.00 70.33 69.28 1xcq n THR 34 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1xcq n ARG 35 N -2.55 0.00 -4.11 -2.82 1.74 -0.52 -5.03 116.66 103.37 1xcq n ARG 35 Ca -0.05 0.03 -0.15 0.00 -0.77 0.00 0.00 57.85 56.91 1xcq n ARG 35 Cb 0.55 -3.42 -0.14 0.00 -1.02 0.00 0.00 32.46 28.43 1xcq n ARG 35 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1xcq s LYS 36 N -3.76 0.36 -0.26 5.56 -0.14 -1.25 -5.02 119.74 115.22 1xcq s LYS 36 Ca 0.00 -0.15 -0.19 0.00 -1.36 0.00 0.00 55.97 54.27 1xcq s LYS 36 Cb 0.00 -0.35 -0.02 0.00 -1.68 0.00 0.00 37.83 35.78 1xcq s LYS 36 CO 0.00 0.08 0.59 -0.80 -0.76 0.00 0.00 175.35 174.46 1xcq s ASN 37 N -0.05 6.52 -0.04 2.83 -0.87 -1.26 -3.42 114.94 118.66 1xcq s ASN 37 Ca 0.01 0.62 -0.06 0.00 -1.57 0.00 0.00 52.86 51.86 1xcq s ASN 37 Cb -0.02 -2.32 -0.23 0.00 -0.02 0.00 0.00 41.25 38.66 1xcq s ASN 37 CO -0.00 -0.35 3.49 -1.22 -2.57 0.00 0.00 177.10 176.45 1xcq n TYR 38 N 5.67 0.13 -3.36 2.20 0.53 -1.16 -2.73 117.16 118.44 1xcq n TYR 38 Ca -0.02 -1.51 -0.38 0.00 -1.02 0.00 0.00 57.90 54.96 1xcq n TYR 38 Cb 0.49 -1.54 -0.06 0.00 -1.03 0.00 0.00 39.34 37.21 1xcq n TYR 38 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 1xcq s LEU 39 N -0.17 4.48 -0.00 7.72 1.98 -1.26 -2.37 118.68 129.06 1xcq s LEU 39 Ca 0.63 1.11 -0.01 0.00 -2.89 0.00 0.00 54.13 52.98 1xcq s LEU 39 Cb 0.31 -2.77 -0.00 0.00 0.66 0.00 0.00 46.19 44.39 1xcq s LEU 39 CO -0.02 0.26 0.02 0.00 -1.89 0.00 0.00 176.35 174.72 1xcq s ALA 40 N -0.89 -0.03 -0.06 5.97 0.00 -0.95 -3.13 121.76 122.66 1xcq s ALA 40 Ca 0.27 -0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.16 1xcq s ALA 40 Cb -0.18 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 1xcq s ALA 40 CO 0.16 -0.05 -0.10 -1.58 0.00 0.00 0.00 175.76 174.19 1xcq s TRP 41 N -0.36 2.85 -0.05 0.00 0.52 -0.68 -0.99 118.94 120.23 1xcq s TRP 41 Ca -0.04 -0.06 0.04 0.00 0.02 0.00 0.00 56.10 56.05 1xcq s TRP 41 Cb -0.03 -1.69 0.00 0.00 -1.15 0.00 0.00 33.47 30.61 1xcq s TRP 41 CO -0.00 0.26 -0.15 0.71 0.02 0.00 0.00 176.95 177.79 1xcq s TYR 42 N -0.73 1.58 -0.36 -1.98 1.51 -0.18 0.17 117.35 117.37 1xcq s TYR 42 Ca 0.11 -0.49 -0.09 0.00 -1.01 0.00 0.00 57.07 55.60 1xcq s TYR 42 Cb -0.11 -1.09 0.03 0.00 -0.11 0.00 0.00 41.96 40.68 1xcq s TYR 42 CO 0.01 -0.19 0.16 -1.14 -1.11 0.00 0.00 175.55 173.28 1xcq s GLN 43 N 0.21 2.74 -0.41 -0.62 0.74 0.46 -0.98 119.66 121.80 1xcq s GLN 43 Ca -0.07 -1.12 -0.05 0.00 0.05 0.00 0.00 55.36 54.17 1xcq s GLN 43 Cb -0.12 -3.60 0.10 0.00 1.10 0.00 0.00 33.01 30.49 1xcq s GLN 43 CO 0.03 -0.68 0.21 -1.14 -0.55 0.00 0.00 175.29 173.16 1xcq s GLN 44 N 1.48 2.27 1.06 1.67 0.74 -0.39 -1.91 119.66 124.58 1xcq s GLN 44 Ca 0.00 -1.66 -0.14 0.00 0.05 0.00 0.00 55.36 53.62 1xcq s GLN 44 Cb -0.19 -3.63 0.22 0.00 1.10 0.00 0.00 33.01 30.50 1xcq s GLN 44 CO 0.05 -1.01 1.09 0.15 -0.55 0.00 0.00 175.29 175.02 1xcq s LYS 45 N 1.26 -0.08 0.03 1.67 1.02 -1.26 -2.63 119.74 119.74 1xcq s LYS 45 Ca 0.05 0.38 -0.30 0.00 0.02 0.00 0.00 55.97 56.12 1xcq s LYS 45 Cb -0.23 -1.69 -0.07 0.00 -0.52 0.00 0.00 37.83 35.32 1xcq s LYS 45 CO -0.02 -3.05 1.50 -1.25 -0.92 0.00 0.00 175.35 171.62 1xcq s PRO 46 N -5.03 4.25 0.00 -1.68 0.04 -1.26 -3.76 135.00 127.56 1xcq s PRO 46 Ca 0.67 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.82 1xcq s PRO 46 Cb -0.17 -3.57 0.00 0.00 0.04 0.00 0.00 34.50 30.80 1xcq s PRO 46 CO 0.58 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.39 1xcq n GLY 47 N 3.78 2.25 3.26 0.56 0.00 -1.26 -5.05 105.19 108.73 1xcq n GLY 47 Ca 0.14 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 1xcq n GLY 47 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xcq n GLN 48 N 0.00 -1.83 -3.52 1.61 1.13 -1.25 -5.01 117.38 108.51 1xcq n GLN 48 Ca 0.00 -0.52 -0.26 0.00 -1.94 0.00 0.00 57.00 54.28 1xcq n GLN 48 Cb 0.00 -1.70 -0.02 0.00 0.11 0.00 0.00 30.24 28.62 1xcq n GLN 48 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1xcq s SER 49 N -1.90 6.36 1.24 1.08 0.15 -1.26 -4.75 113.70 114.61 1xcq s SER 49 Ca 0.55 0.46 -0.16 0.00 0.70 0.00 0.00 55.95 57.50 1xcq s SER 49 Cb -0.12 -2.03 0.28 0.00 -1.71 0.00 0.00 66.02 62.45 1xcq s SER 49 CO 0.63 -0.18 0.79 -2.65 1.20 0.00 0.00 173.24 173.03 1xcq n PRO 50 N -1.22 -2.93 -3.75 5.44 -0.02 -1.26 -4.74 135.00 126.52 1xcq n PRO 50 Ca -0.04 -0.84 -0.14 0.00 -2.02 0.00 0.00 63.50 60.45 1xcq n PRO 50 Cb 0.55 -2.01 -0.15 0.00 -0.02 0.00 0.00 33.50 31.87 1xcq n PRO 50 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1xcq s LYS 51 N -4.31 0.06 0.31 -0.52 2.20 -0.80 -4.91 119.74 111.75 1xcq s LYS 51 Ca 0.65 0.34 -0.27 0.00 -0.36 0.00 0.00 55.97 56.33 1xcq s LYS 51 Cb -0.20 -0.20 -0.10 0.00 -1.51 0.00 0.00 37.83 35.82 1xcq s LYS 51 CO 0.63 -0.17 0.95 0.54 -0.36 0.00 0.00 175.35 176.93 1xcq s VAL 52 N 1.20 4.17 -0.18 4.02 0.11 -1.26 -0.40 120.40 128.05 1xcq s VAL 52 Ca -0.09 1.87 0.01 0.00 -2.93 0.00 0.00 61.98 60.85 1xcq s VAL 52 Cb -0.12 -4.07 -0.12 0.00 -1.53 0.00 0.00 36.38 30.54 1xcq s VAL 52 CO -0.05 0.21 -0.16 0.18 -3.33 0.00 0.00 175.10 171.95 1xcq n LEU 53 N 0.74 2.98 -4.03 2.54 4.77 0.45 -4.90 117.00 119.56 1xcq n LEU 53 Ca 0.01 -0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.77 1xcq n LEU 53 Cb 0.49 -0.64 -0.12 0.00 -2.33 0.00 0.00 43.42 40.83 1xcq n LEU 53 CO 0.46 0.81 -0.40 -0.63 -1.33 0.00 0.00 177.39 176.30 1xcq s ILE 54 N -2.37 0.45 0.29 -0.08 1.01 -1.21 -2.66 121.20 116.64 1xcq s ILE 54 Ca -0.25 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.50 1xcq s ILE 54 Cb 0.06 -0.51 0.01 0.00 0.01 0.00 0.00 42.46 42.03 1xcq s ILE 54 CO 0.42 -0.33 0.11 0.00 0.00 0.00 0.00 174.94 175.15 1xcq n TYR 55 N 1.71 -0.20 -0.76 3.97 -0.00 0.33 -1.69 117.16 120.52 1xcq n TYR 55 Ca -0.21 -1.32 0.00 0.00 -0.00 0.00 0.00 57.90 56.37 1xcq n TYR 55 Cb 0.55 -0.21 0.00 0.00 -0.00 0.00 0.00 39.34 39.68 1xcq n TYR 55 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.86 177.77 1xcq n TRP 56 N -0.95 -0.76 0.00 -3.48 8.01 -1.20 -0.29 117.44 118.77 1xcq n TRP 56 Ca -0.06 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.13 1xcq n TRP 56 Cb 0.35 -0.84 0.00 0.00 -2.01 0.00 0.00 31.31 28.81 1xcq n TRP 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1xcq n ALA 57 N -0.76 0.00 -0.02 6.99 0.00 -1.10 -4.00 120.51 121.61 1xcq n ALA 57 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1xcq n ALA 57 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 1.26 3.83 -4.69 0.00 7.64 0.60 -3.72 113.62 118.55 1xcq n SER 58 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1xcq n SER 58 Cb 0.00 0.74 -0.03 0.00 -1.01 0.00 0.00 64.21 63.91 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 -2.16 2.90 -0.17 0.44 2.01 -0.44 -4.23 115.64 113.99 1xcq s THR 59 Ca -0.02 0.35 -0.08 0.00 0.31 0.00 0.00 61.69 62.25 1xcq s THR 59 Cb 0.02 -3.22 -0.04 0.00 0.01 0.00 0.00 72.50 69.26 1xcq s THR 59 CO 0.20 -0.00 0.09 -0.60 -0.69 0.00 0.00 174.62 173.61 1xcq s ARG 60 N 2.77 3.86 0.76 4.92 3.52 -1.26 0.12 118.95 133.64 1xcq s ARG 60 Ca 0.76 -0.28 -0.12 0.00 -0.13 0.00 0.00 55.73 55.96 1xcq s ARG 60 Cb -0.42 -3.23 0.05 0.00 -1.56 0.00 0.00 34.95 29.80 1xcq s ARG 60 CO 0.34 0.40 1.11 -2.00 -0.81 0.00 0.00 175.30 174.33 1xcq s GLU 61 N 0.04 2.26 -0.86 5.12 2.56 -1.09 -4.92 118.70 121.81 1xcq s GLU 61 Ca 0.07 1.29 -0.25 0.00 0.00 0.00 0.00 54.97 56.08 1xcq s GLU 61 Cb -0.12 -1.89 -0.02 0.00 2.00 0.00 0.00 34.13 34.10 1xcq s GLU 61 CO 0.00 -1.65 1.80 0.45 -0.56 0.00 0.00 175.26 175.30 1xcq s SER 62 N -3.06 5.48 0.00 -1.70 0.15 -1.26 -2.65 113.70 110.67 1xcq s SER 62 Ca 0.64 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.68 1xcq s SER 62 Cb -0.19 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 1xcq s SER 62 CO 0.52 -2.39 0.00 0.61 1.20 0.00 0.00 173.24 173.18 1xcq n GLY 63 N 6.54 1.09 3.74 9.45 0.00 -1.26 -5.10 105.19 119.65 1xcq n GLY 63 Ca 0.33 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.94 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 3.69 0.11 1.61 1.01 -1.08 -4.95 120.40 120.79 1xcq s VAL 64 Ca 0.00 1.44 -0.31 0.00 0.00 0.00 0.00 61.98 63.12 1xcq s VAL 64 Cb 0.00 -3.92 -0.10 0.00 0.00 0.00 0.00 36.38 32.36 1xcq s VAL 64 CO 0.00 0.24 1.78 -2.16 0.00 0.00 0.00 175.10 174.96 1xcq s PRO 65 N -0.32 4.15 0.07 2.72 0.04 -1.26 -4.82 135.00 135.58 1xcq s PRO 65 Ca 0.51 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.08 1xcq s PRO 65 Cb -0.31 -3.58 0.00 0.00 0.04 0.00 0.00 34.50 30.65 1xcq s PRO 65 CO 0.36 -0.81 0.54 -3.47 0.04 0.00 0.00 177.00 173.66 1xcq n ASP 66 N 5.59 0.00 -1.27 6.66 -0.08 -1.26 -0.60 116.55 125.59 1xcq n ASP 66 Ca 0.17 0.05 0.09 0.00 -1.51 0.00 0.00 54.79 53.59 1xcq n ASP 66 Cb 0.39 0.00 0.30 0.00 2.34 0.00 0.00 41.12 44.14 1xcq n ASP 66 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1xcq n ARG 67 N -1.14 3.25 -4.19 -0.67 1.85 -1.26 -4.82 116.66 109.68 1xcq n ARG 67 Ca 0.00 -2.66 -0.30 0.00 -1.00 0.00 0.00 57.85 53.89 1xcq n ARG 67 Cb 0.54 -1.68 -0.09 0.00 -1.05 0.00 0.00 32.46 30.18 1xcq n ARG 67 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1xcq s PHE 68 N -1.57 2.84 -0.18 2.89 0.08 0.23 -3.51 117.98 118.76 1xcq s PHE 68 Ca 0.44 -0.11 -0.05 0.00 0.12 0.00 0.00 56.93 57.33 1xcq s PHE 68 Cb 0.27 -1.47 0.09 0.00 -0.57 0.00 0.00 43.02 41.34 1xcq s PHE 68 CO 0.23 0.45 0.32 0.99 -0.10 0.00 0.00 175.22 177.12 1xcq s THR 69 N -1.29 -0.51 -0.39 0.64 2.01 -0.62 -4.91 115.64 110.58 1xcq s THR 69 Ca 0.23 0.13 -0.08 0.00 0.31 0.00 0.00 61.69 62.29 1xcq s THR 69 Cb -0.11 -0.61 0.07 0.00 0.01 0.00 0.00 72.50 71.86 1xcq s THR 69 CO 0.16 0.02 0.20 -0.83 -0.69 0.00 0.00 174.62 173.48 1xcq s GLY 70 N 2.49 1.93 0.25 4.40 0.00 -1.26 0.92 107.32 116.04 1xcq s GLY 70 Ca 0.04 -2.05 0.02 0.00 0.00 0.00 0.00 44.72 42.73 1xcq s GLY 70 CO -0.12 0.91 0.14 0.54 0.00 0.00 0.00 173.10 174.57 1xcq n ARG 71 N 4.85 1.20 0.00 2.90 1.74 0.13 -3.36 116.66 124.12 1xcq n ARG 71 Ca -0.10 -1.64 0.00 0.00 -0.77 0.00 0.00 57.85 55.34 1xcq n ARG 71 Cb 0.43 0.26 0.00 0.00 -1.02 0.00 0.00 32.46 32.13 1xcq n ARG 71 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xcq n GLY 72 N 1.98 2.98 3.62 -0.13 0.00 -1.26 -1.93 105.19 110.45 1xcq n GLY 72 Ca -0.04 -1.89 -0.06 0.00 0.00 0.00 0.00 46.02 44.04 1xcq n GLY 72 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xcq s SER 73 N 0.00 -0.20 0.00 1.61 0.15 -1.25 -4.78 113.70 109.24 1xcq s SER 73 Ca 0.00 0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.92 1xcq s SER 73 Cb 0.00 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 1xcq s SER 73 CO 0.00 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.91 1xcq n GLY 74 N 0.97 2.12 0.19 9.45 0.00 -1.26 -3.61 105.19 113.06 1xcq n GLY 74 Ca -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1xcq n GLY 74 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1xcq n THR 75 N 0.00 0.00 -3.35 2.61 5.66 -1.26 -1.68 114.28 116.26 1xcq n THR 75 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 1xcq n THR 75 Cb 0.00 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.70 1xcq n THR 75 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1xcq s ASP 76 N 0.00 1.44 0.00 1.09 -0.00 -1.24 -4.16 116.67 113.81 1xcq s ASP 76 Ca 0.00 -2.00 -0.01 0.00 -0.00 0.00 0.00 52.55 50.54 1xcq s ASP 76 Cb 0.00 0.26 -0.04 0.00 -0.00 0.00 0.00 42.92 43.14 1xcq s ASP 76 CO 0.00 -0.24 0.12 -0.36 -0.00 0.00 0.00 175.17 174.69 1xcq s PHE 77 N 1.06 3.37 -0.04 4.23 0.08 -0.96 -3.74 117.98 121.98 1xcq s PHE 77 Ca 0.21 0.25 -0.04 0.00 0.12 0.00 0.00 56.93 57.46 1xcq s PHE 77 Cb -0.13 -1.76 0.01 0.00 -0.57 0.00 0.00 43.02 40.57 1xcq s PHE 77 CO -0.05 0.58 0.12 0.99 -0.10 0.00 0.00 175.22 176.76 1xcq s THR 78 N -1.27 -0.00 -0.12 0.64 2.01 -0.81 -2.48 115.64 113.62 1xcq s THR 78 Ca 0.25 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.28 1xcq s THR 78 Cb -0.12 -0.17 -0.01 0.00 0.01 0.00 0.00 72.50 72.21 1xcq s THR 78 CO 0.17 0.00 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.70 1xcq s LEU 79 N 0.08 2.42 -0.05 4.42 2.96 -0.00 0.18 118.68 128.69 1xcq s LEU 79 Ca -0.00 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1xcq s LEU 79 Cb -0.01 -1.51 0.02 0.00 0.50 0.00 0.00 46.19 45.19 1xcq s LEU 79 CO 0.00 0.16 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.27 1xcq s THR 80 N 0.34 0.52 -0.57 3.68 2.01 0.26 -2.81 115.64 119.08 1xcq s THR 80 Ca -0.15 -0.08 -0.06 0.00 0.31 0.00 0.00 61.69 61.71 1xcq s THR 80 Cb -0.17 -0.57 0.15 0.00 0.01 0.00 0.00 72.50 71.92 1xcq s THR 80 CO 0.07 0.24 0.41 -0.63 -0.69 0.00 0.00 174.62 174.02 1xcq s ILE 81 N 1.13 3.97 0.77 1.82 1.01 -1.19 -1.58 121.20 127.12 1xcq s ILE 81 Ca -0.08 -2.45 -0.11 0.00 0.00 0.00 0.00 60.65 58.02 1xcq s ILE 81 Cb -0.14 -3.59 0.05 0.00 0.01 0.00 0.00 42.46 38.79 1xcq s ILE 81 CO -0.01 -0.83 1.09 -0.94 0.00 0.00 0.00 174.94 174.24 1xcq s SER 82 N 1.56 4.58 -0.66 3.58 1.04 -1.23 -2.96 113.70 119.61 1xcq s SER 82 Ca 0.13 1.80 -0.00 0.00 0.48 0.00 0.00 55.95 58.35 1xcq s SER 82 Cb -0.21 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.40 1xcq s SER 82 CO -0.04 -1.98 0.48 -1.20 0.98 0.00 0.00 173.24 171.48 1xcq n SER 83 N -3.49 -3.82 -4.55 7.02 7.64 0.16 -4.64 113.62 111.94 1xcq n SER 83 Ca 0.09 -0.79 -0.31 0.00 1.01 0.00 0.00 58.87 58.87 1xcq n SER 83 Cb 0.53 -1.27 -0.04 0.00 -1.01 0.00 0.00 64.21 62.42 1xcq n SER 83 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1xcq s VAL 84 N -2.79 3.02 0.61 0.44 1.01 -0.53 -4.61 120.40 117.54 1xcq s VAL 84 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.82 1xcq s VAL 84 Cb -0.00 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 1xcq s VAL 84 CO 0.72 -0.04 1.10 -1.10 0.00 0.00 0.00 175.10 175.78 1xcq s GLN 85 N 8.39 3.07 0.30 2.72 -1.52 -1.26 -3.88 119.66 127.48 1xcq s GLN 85 Ca 0.95 1.42 0.05 0.00 -1.95 0.00 0.00 55.36 55.83 1xcq s GLN 85 Cb -0.16 -1.98 0.70 0.00 -0.22 0.00 0.00 33.01 31.34 1xcq s GLN 85 CO 0.21 -1.04 1.79 0.00 -0.25 0.00 0.00 175.29 176.01 1xcq h ALA 86 N 0.46 1.64 -0.13 6.09 0.00 -1.97 -1.15 119.26 124.21 1xcq h ALA 86 Ca -0.48 0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.54 1xcq h ALA 86 Cb 1.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1xcq h ALA 86 CO 0.56 0.02 0.13 1.05 0.00 0.00 0.00 179.25 181.00 1xcq h GLU 87 N 0.82 0.00 0.00 0.00 4.11 -1.89 -2.16 114.58 115.46 1xcq h GLU 87 Ca 0.56 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.99 1xcq h GLU 87 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1xcq h GLU 87 CO -0.35 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.48 1xcq n ASP 88 N -3.93 0.00 -4.35 3.06 10.43 -0.43 -4.53 116.55 116.80 1xcq n ASP 88 Ca 0.00 -0.12 -0.37 0.00 2.57 0.00 0.00 54.79 56.87 1xcq n ASP 88 Cb 0.24 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.17 1xcq n ASP 88 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1xcq n GLN 89 N -0.51 2.33 -2.08 -1.24 6.02 -0.81 -4.70 117.38 116.39 1xcq n GLN 89 Ca 0.00 -2.70 -0.01 0.00 -0.01 0.00 0.00 57.00 54.28 1xcq n GLN 89 Cb 0.00 -3.48 -0.00 0.00 1.02 0.00 0.00 30.24 27.77 1xcq n GLN 89 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xcq n ALA 90 N 10.26 0.02 -2.34 -1.58 0.00 -1.23 -4.67 120.51 120.97 1xcq n ALA 90 Ca 0.48 -0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.54 1xcq n ALA 90 Cb 0.45 0.04 -0.15 0.00 0.00 0.00 0.00 19.45 19.79 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 -1.27 2.22 -0.08 0.00 1.01 -1.08 -2.79 120.40 118.41 1xcq s VAL 91 Ca 0.00 -1.14 0.04 0.00 0.00 0.00 0.00 61.98 60.88 1xcq s VAL 91 Cb 0.00 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 1xcq s VAL 91 CO 0.00 0.52 -0.22 -0.31 0.00 0.00 0.00 175.10 175.09 1xcq s TYR 92 N -0.69 2.55 0.39 5.22 1.51 0.10 -1.27 117.35 125.17 1xcq s TYR 92 Ca 0.11 -0.71 0.08 0.00 -1.01 0.00 0.00 57.07 55.54 1xcq s TYR 92 Cb -0.10 -1.66 -0.08 0.00 -0.11 0.00 0.00 41.96 40.01 1xcq s TYR 92 CO 0.00 -0.21 -0.02 0.71 -1.11 0.00 0.00 175.55 174.93 1xcq s TYR 93 N -0.05 2.47 0.07 2.71 1.51 -0.16 0.13 117.35 124.02 1xcq s TYR 93 Ca -0.06 -0.63 -0.06 0.00 -1.01 0.00 0.00 57.07 55.30 1xcq s TYR 93 Cb -0.15 -1.66 -0.01 0.00 -0.11 0.00 0.00 41.96 40.04 1xcq s TYR 93 CO 0.05 0.47 0.12 0.00 -1.11 0.00 0.00 175.55 175.08 1xcq s LYS 95 N -3.55 0.66 0.26 0.00 2.20 -0.17 -0.07 119.74 119.06 1xcq s LYS 95 Ca 0.03 -1.19 0.11 0.00 -0.36 0.00 0.00 55.97 54.57 1xcq s LYS 95 Cb 0.04 0.23 -0.05 0.00 -1.51 0.00 0.00 37.83 36.55 1xcq s LYS 95 CO -0.09 -0.14 -0.20 1.14 -0.36 0.00 0.00 175.35 175.70 1xcq s GLN 96 N -3.91 1.62 0.00 4.03 1.03 -0.83 -2.25 119.66 119.35 1xcq s GLN 96 Ca 0.07 -1.71 0.00 0.00 0.04 0.00 0.00 55.36 53.76 1xcq s GLN 96 Cb 0.07 -1.72 0.00 0.00 0.03 0.00 0.00 33.01 31.40 1xcq s GLN 96 CO -0.10 0.33 0.01 0.00 -2.54 0.00 0.00 175.29 172.99 1xcq n ALA 97 N -0.46 0.12 0.22 2.60 0.00 -1.00 -3.42 120.51 118.58 1xcq n ALA 97 Ca -0.06 -0.01 0.18 0.00 0.00 0.00 0.00 53.44 53.54 1xcq n ALA 97 Cb 0.59 0.00 0.86 0.00 0.00 0.00 0.00 19.45 20.90 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 0.00 0.00 -2.45 0.00 3.20 -1.90 -3.37 116.97 112.45 1xcq h TYR 98 Ca 0.00 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 1xcq h TYR 98 Cb 0.12 0.00 -0.28 0.00 1.54 0.00 0.00 36.73 38.11 1xcq h TYR 98 CO 0.00 0.00 -0.40 -1.50 -1.64 0.00 0.00 178.16 174.62 1xcq s ILE 99 N -4.56 -0.63 0.74 1.81 2.07 -1.26 -5.05 121.20 114.32 1xcq s ILE 99 Ca -0.05 0.14 -0.14 0.00 -1.41 0.00 0.00 60.65 59.20 1xcq s ILE 99 Cb 0.15 -0.67 0.04 0.00 0.13 0.00 0.00 42.46 42.11 1xcq s ILE 99 CO 0.52 0.05 1.17 -2.16 -1.91 0.00 0.00 174.94 172.60 1xcq s PRO 100 N 2.59 2.17 0.52 3.50 0.04 -1.26 -4.33 135.00 138.22 1xcq s PRO 100 Ca 0.01 1.59 -0.04 0.00 0.04 0.00 0.00 61.00 62.60 1xcq s PRO 100 Cb -0.13 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 1xcq s PRO 100 CO -0.13 -1.78 0.80 -1.25 0.04 0.00 0.00 177.00 174.69 1xcq s PRO 101 N -4.13 3.13 0.50 0.56 0.04 -1.26 -4.70 135.00 129.14 1xcq s PRO 101 Ca 0.70 -0.09 -0.21 0.00 0.04 0.00 0.00 61.00 61.45 1xcq s PRO 101 Cb -0.25 -2.38 -0.07 0.00 0.04 0.00 0.00 34.50 31.84 1xcq s PRO 101 CO 0.47 -0.44 1.12 -0.51 0.04 0.00 0.00 177.00 177.68 1xcq s LEU 102 N -4.80 3.87 -0.02 -3.56 1.43 -1.26 -4.55 118.68 109.79 1xcq s LEU 102 Ca 0.50 2.17 -0.01 0.00 -1.03 0.00 0.00 54.13 55.77 1xcq s LEU 102 Cb -0.10 -4.45 0.01 0.00 0.03 0.00 0.00 46.19 41.68 1xcq s LEU 102 CO 0.43 -1.02 0.03 0.42 0.23 0.00 0.00 176.35 176.44 1xcq s THR 103 N -1.72 -0.03 0.58 5.49 -4.23 -1.22 -5.00 115.64 109.52 1xcq s THR 103 Ca 0.68 0.09 0.08 0.00 -1.18 0.00 0.00 61.69 61.37 1xcq s THR 103 Cb -0.24 -0.07 0.09 0.00 1.34 0.00 0.00 72.50 73.62 1xcq s THR 103 CO 0.28 0.04 0.80 -0.36 -0.54 0.00 0.00 174.62 174.84 1xcq s PHE 104 N 0.48 1.52 0.18 3.99 0.40 -1.25 -1.96 117.98 121.35 1xcq s PHE 104 Ca -0.04 -0.64 0.05 0.00 -0.60 0.00 0.00 56.93 55.70 1xcq s PHE 104 Cb -0.06 -2.32 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 1xcq s PHE 104 CO -0.01 -1.18 0.18 0.20 0.70 0.00 0.00 175.22 175.11 1xcq s GLY 105 N -4.65 1.62 0.24 4.36 0.00 0.89 -4.69 107.32 105.09 1xcq s GLY 105 Ca 0.62 -1.23 0.12 0.00 0.00 0.00 0.00 44.72 44.23 1xcq s GLY 105 CO 0.39 -1.25 1.27 0.00 0.00 0.00 0.00 173.10 173.51 1xcq n ALA 106 N -0.61 0.74 0.00 3.20 0.00 -1.26 -4.68 120.51 117.91 1xcq n ALA 106 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1xcq n ALA 106 Cb 0.55 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.30 -0.28 3.42 0.00 0.00 -1.26 -5.01 105.19 100.76 1xcq n GLY 107 Ca -0.01 -1.38 -0.34 0.00 0.00 0.00 0.00 46.02 44.29 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 -1.44 3.68 -0.17 2.61 2.01 0.34 -4.68 115.64 117.99 1xcq s THR 108 Ca 0.00 -0.41 -0.27 0.00 0.31 0.00 0.00 61.69 61.32 1xcq s THR 108 Cb 0.00 -2.64 -0.01 0.00 0.01 0.00 0.00 72.50 69.86 1xcq s THR 108 CO 0.00 0.46 0.90 -0.75 -0.69 0.00 0.00 174.62 174.53 1xcq s LYS 109 N 0.83 4.31 -0.37 4.92 2.20 -1.14 0.02 119.74 130.52 1xcq s LYS 109 Ca -0.01 1.13 -0.01 0.00 -0.36 0.00 0.00 55.97 56.72 1xcq s LYS 109 Cb -0.15 -3.58 0.09 0.00 -1.51 0.00 0.00 37.83 32.69 1xcq s LYS 109 CO 0.02 -0.38 0.12 -1.17 -0.36 0.00 0.00 175.35 173.58 1xcq s LEU 110 N 2.32 4.81 0.00 5.43 2.96 -1.12 0.11 118.68 133.19 1xcq s LEU 110 Ca 0.41 -1.87 0.00 0.00 -0.22 0.00 0.00 54.13 52.45 1xcq s LEU 110 Cb -0.17 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.77 1xcq s LEU 110 CO 0.12 -0.44 0.00 -0.62 -1.32 0.00 0.00 176.35 174.09 1xcq n GLU 111 N 4.53 0.59 -3.81 1.98 1.02 0.49 -3.47 120.64 121.97 1xcq n GLU 111 Ca -0.04 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 56.99 1xcq n GLU 111 Cb 0.42 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.75 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 1.18 0.00 -4.62 0.20 -1.26 -3.75 118.68 110.44 1xcq s LEU 112 Ca 0.00 -0.17 0.04 0.00 0.69 0.00 0.00 54.13 54.69 1xcq s LEU 112 Cb 0.00 1.04 0.04 0.00 -0.43 0.00 0.00 46.19 46.84 1xcq s LEU 112 CO 0.00 -0.49 0.31 0.29 -0.29 0.00 0.00 176.35 176.17 1xcq n LYS 113 N 1.03 0.88 -3.80 1.98 5.02 0.70 -4.89 118.16 119.08 1xcq n LYS 113 Ca -0.21 -2.56 0.00 0.00 -2.02 0.00 0.00 58.31 53.53 1xcq n LYS 113 Cb 0.57 0.27 0.00 0.00 -0.02 0.00 0.00 35.03 35.85 1xcq n LYS 113 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1xcq n ARG 114 N -1.47 -1.83 -2.08 1.97 1.85 -1.26 -4.61 116.66 109.23 1xcq n ARG 114 Ca -0.01 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.43 1xcq n ARG 114 Cb 0.47 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.85 1xcq n ARG 114 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1xcq s ALA 115 N -1.01 3.55 1.05 2.89 0.00 -1.26 -4.97 121.76 122.01 1xcq s ALA 115 Ca 0.00 1.28 -0.13 0.00 0.00 0.00 0.00 51.96 53.11 1xcq s ALA 115 Cb 0.00 -3.51 0.22 0.00 0.00 0.00 0.00 23.12 19.82 1xcq s ALA 115 CO 0.00 -0.68 1.08 -0.51 0.00 0.00 0.00 175.76 175.65 1xcq s ASP 116 N -0.07 2.17 0.00 0.00 -0.00 -1.26 -4.69 116.67 112.82 1xcq s ASP 116 Ca 0.54 1.17 0.00 0.00 -0.00 0.00 0.00 52.55 54.26 1xcq s ASP 116 Cb -0.40 -1.84 0.00 0.00 -0.00 0.00 0.00 42.92 40.68 1xcq s ASP 116 CO 0.48 -3.41 0.00 0.00 -0.00 0.00 0.00 175.17 172.24 1xcq n ALA 117 N -4.36 0.00 -0.58 5.23 0.00 -0.10 -4.89 120.51 115.81 1xcq n ALA 117 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.20 1xcq n ALA 117 Cb 0.57 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.21 1xcq n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xcq n ALA 118 N 0.00 -3.56 -2.19 0.00 0.00 -1.26 -3.54 120.51 109.95 1xcq n ALA 118 Ca 0.00 -1.31 -0.18 0.00 0.00 0.00 0.00 53.44 51.94 1xcq n ALA 118 Cb 0.00 -1.47 0.13 0.00 0.00 0.00 0.00 19.45 18.11 1xcq n ALA 118 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1xcq n PRO 119 N -2.75 -0.46 -3.73 0.00 -0.04 -1.26 -4.70 135.00 122.07 1xcq n PRO 119 Ca 0.03 -1.99 -0.29 0.00 -0.04 0.00 0.00 63.50 61.21 1xcq n PRO 119 Cb 0.57 -0.80 -0.13 0.00 -0.04 0.00 0.00 33.50 33.10 1xcq n PRO 119 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1xcq s THR 120 N -2.88 1.61 -0.29 0.52 2.01 -1.14 -4.93 115.64 110.54 1xcq s THR 120 Ca 0.57 -2.88 -0.29 0.00 0.31 0.00 0.00 61.69 59.40 1xcq s THR 120 Cb -0.02 -2.11 0.01 0.00 0.01 0.00 0.00 72.50 70.38 1xcq s THR 120 CO 0.39 -0.94 1.15 -0.69 -0.69 0.00 0.00 174.62 173.84 1xcq s VAL 121 N 0.00 4.41 -0.15 3.82 1.01 -1.18 -1.61 120.40 126.69 1xcq s VAL 121 Ca 0.20 1.63 -0.00 0.00 0.00 0.00 0.00 61.98 63.81 1xcq s VAL 121 Cb -0.19 -4.29 -0.01 0.00 0.00 0.00 0.00 36.38 31.89 1xcq s VAL 121 CO -0.04 -0.41 -0.13 -0.94 0.00 0.00 0.00 175.10 173.57 1xcq s SER 122 N 1.93 3.84 -0.11 3.32 1.04 0.25 -4.91 113.70 119.06 1xcq s SER 122 Ca 0.49 -0.41 -0.00 0.00 0.48 0.00 0.00 55.95 56.50 1xcq s SER 122 Cb -0.15 -1.60 -0.02 0.00 0.10 0.00 0.00 66.02 64.35 1xcq s SER 122 CO 0.16 0.10 -0.09 -0.51 0.98 0.00 0.00 173.24 173.89 1xcq s ILE 123 N 0.73 3.51 0.05 -1.02 2.07 -1.26 -0.34 121.20 124.94 1xcq s ILE 123 Ca -0.06 -0.52 0.07 0.00 -1.41 0.00 0.00 60.65 58.72 1xcq s ILE 123 Cb -0.15 -2.47 -0.03 0.00 0.13 0.00 0.00 42.46 39.94 1xcq s ILE 123 CO 0.01 0.55 -0.18 -0.36 -1.91 0.00 0.00 174.94 173.05 1xcq s PHE 124 N -0.16 1.58 0.46 3.50 0.40 0.74 -4.97 117.98 119.53 1xcq s PHE 124 Ca 0.01 -0.38 -0.00 0.00 -0.60 0.00 0.00 56.93 55.96 1xcq s PHE 124 Cb -0.13 -0.92 -0.00 0.00 0.51 0.00 0.00 43.02 42.47 1xcq s PHE 124 CO 0.03 0.09 0.69 -2.14 0.70 0.00 0.00 175.22 174.59 1xcq s PRO 125 N -1.32 3.05 -0.11 0.24 0.02 -1.26 0.17 135.00 135.79 1xcq s PRO 125 Ca 0.05 -0.45 -0.29 0.00 0.02 0.00 0.00 61.00 60.33 1xcq s PRO 125 Cb -0.09 -2.53 -0.05 0.00 0.02 0.00 0.00 34.50 31.85 1xcq s PRO 125 CO 0.02 -0.31 1.74 -2.14 -0.33 0.00 0.00 177.00 175.99 1xcq s PRO 126 N -4.59 3.94 0.66 5.54 0.02 -1.11 -4.70 135.00 134.76 1xcq s PRO 126 Ca 0.49 2.06 -0.17 0.00 0.02 0.00 0.00 61.00 63.39 1xcq s PRO 126 Cb -0.10 -4.07 -0.01 0.00 0.02 0.00 0.00 34.50 30.35 1xcq s PRO 126 CO 0.38 -1.14 1.22 -1.13 -0.33 0.00 0.00 177.00 176.00 1xcq n SER 127 N 8.09 1.69 -0.07 2.53 3.41 -1.26 -4.65 113.62 123.35 1xcq n SER 127 Ca 0.19 0.79 -0.14 0.00 -0.26 0.00 0.00 58.87 59.46 1xcq n SER 127 Cb 0.44 -1.52 -0.10 0.00 -0.26 0.00 0.00 64.21 62.77 1xcq n SER 127 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1xcq h SER 128 N 0.34 -1.73 0.00 4.04 4.64 -1.99 -0.42 113.55 118.43 1xcq h SER 128 Ca -0.50 0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1xcq h SER 128 Cb 1.34 0.69 0.00 0.00 -0.31 0.00 0.00 62.40 64.12 1xcq h SER 128 CO 0.52 -0.43 0.00 -0.62 -0.87 0.00 0.00 176.83 175.43 1xcq n GLU 129 N -5.29 0.00 -0.33 4.77 4.71 -1.26 0.54 120.64 123.77 1xcq n GLU 129 Ca -0.05 0.46 0.28 0.00 -0.01 0.00 0.00 57.16 57.84 1xcq n GLU 129 Cb 0.35 -1.04 0.54 0.00 -1.01 0.00 0.00 31.44 30.27 1xcq n GLU 129 CO 0.00 0.00 0.00 0.37 0.09 0.00 0.00 177.13 177.59 1xcq h GLN 130 N 0.00 0.16 -0.38 3.49 4.15 -1.74 1.94 115.11 122.73 1xcq h GLN 130 Ca 0.00 -0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.52 1xcq h GLN 130 Cb 0.00 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 1xcq h GLN 130 CO 0.00 0.11 0.72 -0.07 -1.93 0.00 0.00 178.83 177.65 1xcq h LEU 131 N 0.17 0.00 -8.16 -2.39 3.38 0.18 -2.69 115.31 105.80 1xcq h LEU 131 Ca 0.79 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 58.16 1xcq h LEU 131 Cb 1.99 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.63 1xcq h LEU 131 CO -0.67 0.00 1.22 -0.89 0.09 0.00 0.00 178.44 178.19 1xcq s THR 132 N -4.32 4.04 0.00 0.22 2.01 0.66 -4.83 115.64 113.42 1xcq s THR 132 Ca -0.03 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1xcq s THR 132 Cb 0.10 -4.95 0.00 0.00 0.01 0.00 0.00 72.50 67.66 1xcq s THR 132 CO 0.35 -1.81 0.00 -1.20 -0.69 0.00 0.00 174.62 171.27 1xcq n SER 133 N 8.53 0.00 -4.57 3.53 7.64 -1.02 -5.05 113.62 122.69 1xcq n SER 133 Ca 0.22 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.72 1xcq n SER 133 Cb 0.50 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 1xcq n SER 133 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1xcq s GLY 134 N 0.00 1.11 0.00 0.23 0.00 -1.26 -4.31 107.32 103.08 1xcq s GLY 134 Ca 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 44.72 42.34 1xcq s GLY 134 CO 0.00 2.93 0.00 0.61 0.00 0.00 0.00 173.10 176.64 1xcq n GLY 135 N 6.21 4.37 3.09 0.20 0.00 -1.26 -4.69 105.19 113.12 1xcq n GLY 135 Ca 0.41 -1.24 -0.18 0.00 0.00 0.00 0.00 46.02 45.02 1xcq n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xcq s ALA 136 N -1.26 0.92 -0.06 4.61 0.00 0.66 -4.55 121.76 122.07 1xcq s ALA 136 Ca 0.00 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.29 1xcq s ALA 136 Cb 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.00 1xcq s ALA 136 CO 0.00 0.15 -0.14 -1.12 0.00 0.00 0.00 175.76 174.66 1xcq s SER 137 N -1.01 1.89 0.08 0.00 0.01 -1.26 -0.74 113.70 112.68 1xcq s SER 137 Ca -0.01 -0.32 -0.01 0.00 1.31 0.00 0.00 55.95 56.92 1xcq s SER 137 Cb -0.07 -0.77 -0.04 0.00 0.21 0.00 0.00 66.02 65.35 1xcq s SER 137 CO 0.01 0.07 0.26 -0.69 0.41 0.00 0.00 173.24 173.30 1xcq s VAL 138 N 0.46 5.32 -0.03 3.43 1.01 0.23 -2.76 120.40 128.06 1xcq s VAL 138 Ca -0.11 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 61.65 1xcq s VAL 138 Cb -0.14 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1xcq s VAL 138 CO 0.03 0.11 -0.15 -0.69 0.00 0.00 0.00 175.10 174.40 1xcq s VAL 139 N -1.55 1.27 0.06 2.92 1.01 0.45 -2.83 120.40 121.72 1xcq s VAL 139 Ca 0.37 -0.65 0.09 0.00 0.00 0.00 0.00 61.98 61.79 1xcq s VAL 139 Cb -0.13 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 1xcq s VAL 139 CO 0.27 0.37 -0.25 0.00 0.00 0.00 0.00 175.10 175.49 1xcq s PHE 141 N -0.87 1.93 -0.81 0.00 0.08 0.53 -3.73 117.98 115.12 1xcq s PHE 141 Ca 0.11 -0.84 0.02 0.00 0.12 0.00 0.00 56.93 56.34 1xcq s PHE 141 Cb -0.10 -1.37 0.27 0.00 -0.57 0.00 0.00 43.02 41.25 1xcq s PHE 141 CO 0.03 -0.41 1.01 1.28 -0.10 0.00 0.00 175.22 177.03 1xcq n LEU 142 N 3.97 4.74 -4.57 -0.37 4.77 -1.23 0.86 117.00 125.15 1xcq n LEU 142 Ca -0.20 -5.36 -0.29 0.00 -0.03 0.00 0.00 56.01 50.13 1xcq n LEU 142 Cb 0.52 -0.90 0.21 0.00 -2.33 0.00 0.00 43.42 40.92 1xcq n LEU 142 CO 0.25 1.91 0.59 0.20 -1.33 0.00 0.00 177.39 179.01 1xcq s ASN 143 N -2.17 1.85 0.00 -1.43 0.01 -0.63 -2.56 114.94 110.01 1xcq s ASN 143 Ca 0.36 1.75 0.00 0.00 -0.71 0.00 0.00 52.86 54.26 1xcq s ASN 143 Cb 0.11 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.38 1xcq s ASN 143 CO 0.03 -3.70 0.00 0.59 -1.51 0.00 0.00 177.10 172.51 1xcq n ASN 144 N -4.60 0.00 -3.63 -1.22 3.02 -1.21 -2.90 115.26 104.71 1xcq n ASN 144 Ca 0.06 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.50 1xcq n ASN 144 Cb 0.54 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.64 1xcq n ASN 144 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1xcq s PHE 145 N 0.00 -0.62 -0.16 3.10 -0.12 0.43 -4.50 117.98 116.11 1xcq s PHE 145 Ca 0.00 1.49 -0.02 0.00 -0.05 0.00 0.00 56.93 58.35 1xcq s PHE 145 Cb 0.00 0.32 -0.01 0.00 -0.63 0.00 0.00 43.02 42.70 1xcq s PHE 145 CO 0.00 -0.31 -0.09 -0.47 -0.05 0.00 0.00 175.22 174.30 1xcq s TYR 146 N 0.22 2.89 0.31 3.49 6.14 -1.23 -0.17 117.35 128.99 1xcq s TYR 146 Ca 0.01 -0.67 0.07 0.00 0.64 0.00 0.00 57.07 57.12 1xcq s TYR 146 Cb -0.05 -1.94 -0.03 0.00 0.42 0.00 0.00 41.96 40.37 1xcq s TYR 146 CO -0.02 -0.28 0.29 -1.25 0.64 0.00 0.00 175.55 174.93 1xcq s PRO 147 N 0.67 2.86 0.08 4.97 0.04 -1.26 -0.92 135.00 141.43 1xcq s PRO 147 Ca -0.05 -1.17 -0.03 0.00 0.04 0.00 0.00 61.00 59.79 1xcq s PRO 147 Cb -0.15 -2.56 0.12 0.00 0.04 0.00 0.00 34.50 31.95 1xcq s PRO 147 CO 0.02 0.20 0.46 1.17 0.04 0.00 0.00 177.00 178.89 1xcq n LYS 148 N -1.35 -0.04 -1.63 4.56 4.81 -1.26 -4.22 118.16 119.03 1xcq n LYS 148 Ca -0.04 0.46 -0.38 0.00 -0.87 0.00 0.00 58.31 57.49 1xcq n LYS 148 Cb 0.59 -0.69 -0.03 0.00 0.02 0.00 0.00 35.03 34.92 1xcq n LYS 148 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1xcq s ASP 149 N -5.09 4.74 0.40 3.14 1.01 -1.26 -4.88 116.67 114.73 1xcq s ASP 149 Ca -0.04 1.17 0.05 0.00 0.71 0.00 0.00 52.55 54.43 1xcq s ASP 149 Cb 0.07 -2.51 -0.02 0.00 1.01 0.00 0.00 42.92 41.48 1xcq s ASP 149 CO 0.23 -2.63 0.18 -0.51 0.21 0.00 0.00 175.17 172.64 1xcq s ILE 150 N 11.04 0.39 0.13 0.77 2.07 -1.26 -4.63 121.20 129.70 1xcq s ILE 150 Ca 0.95 -2.00 0.02 0.00 -1.41 0.00 0.00 60.65 58.21 1xcq s ILE 150 Cb -0.20 -2.35 -0.01 0.00 0.13 0.00 0.00 42.46 40.03 1xcq s ILE 150 CO 0.27 0.00 0.08 -3.20 -1.91 0.00 0.00 174.94 170.19 1xcq n ASN 151 N -1.44 0.18 -3.72 4.50 2.85 0.39 -4.94 115.26 113.07 1xcq n ASN 151 Ca -0.02 -1.77 -0.10 0.00 -0.11 0.00 0.00 54.58 52.57 1xcq n ASN 151 Cb 0.64 0.52 -0.05 0.00 1.24 0.00 0.00 39.78 42.13 1xcq n ASN 151 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1xcq s VAL 152 N -2.35 0.07 -0.29 3.44 1.01 -1.26 -3.44 120.40 117.58 1xcq s VAL 152 Ca 0.12 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 1xcq s VAL 152 Cb 0.01 -1.36 0.13 0.00 0.00 0.00 0.00 36.38 35.16 1xcq s VAL 152 CO 0.08 -0.31 0.80 -0.75 0.00 0.00 0.00 175.10 174.92 1xcq s LYS 153 N -3.85 0.51 0.75 2.72 2.20 -0.02 -4.91 119.74 117.15 1xcq s LYS 153 Ca 0.06 1.09 -0.08 0.00 -0.36 0.00 0.00 55.97 56.68 1xcq s LYS 153 Cb 0.02 0.45 0.08 0.00 -1.51 0.00 0.00 37.83 36.87 1xcq s LYS 153 CO -0.08 -0.14 1.08 -1.58 -0.36 0.00 0.00 175.35 174.26 1xcq s TRP 154 N 2.20 2.70 -0.24 4.03 0.52 -1.26 -2.57 118.94 124.33 1xcq s TRP 154 Ca -0.07 0.44 -0.08 0.00 0.02 0.00 0.00 56.10 56.42 1xcq s TRP 154 Cb -0.07 -3.34 0.11 0.00 -1.15 0.00 0.00 33.47 29.01 1xcq s TRP 154 CO -0.18 -1.63 0.51 0.15 0.02 0.00 0.00 176.95 175.81 1xcq s LYS 155 N -5.37 0.42 -0.73 4.98 1.02 -1.21 -3.46 119.74 115.39 1xcq s LYS 155 Ca 0.62 1.19 -0.15 0.00 0.02 0.00 0.00 55.97 57.65 1xcq s LYS 155 Cb -0.10 0.53 0.18 0.00 -0.52 0.00 0.00 37.83 37.92 1xcq s LYS 155 CO 0.46 -0.24 0.71 0.42 -0.92 0.00 0.00 175.35 175.78 1xcq s ILE 156 N 2.72 5.37 -0.12 2.17 1.01 0.34 -3.02 121.20 129.66 1xcq s ILE 156 Ca -0.03 -2.00 -0.09 0.00 0.00 0.00 0.00 60.65 58.54 1xcq s ILE 156 Cb -0.12 -4.46 0.03 0.00 0.01 0.00 0.00 42.46 37.93 1xcq s ILE 156 CO -0.15 -1.03 0.18 0.47 0.00 0.00 0.00 174.94 174.41 1xcq n ASP 157 N 4.73 -2.97 -1.42 3.58 8.00 -0.43 -3.78 116.55 124.26 1xcq n ASP 157 Ca 0.04 1.46 -0.03 0.00 0.71 0.00 0.00 54.79 56.97 1xcq n ASP 157 Cb 0.45 -5.13 -0.01 0.00 -0.02 0.00 0.00 41.12 36.41 1xcq n ASP 157 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xcq n GLY 158 N 1.70 -0.12 2.81 0.44 0.00 -1.26 -4.79 105.19 103.96 1xcq n GLY 158 Ca -0.30 0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 1xcq n GLY 158 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xcq s SER 159 N -0.86 1.08 -0.24 1.61 0.01 -1.25 -5.10 113.70 108.95 1xcq s SER 159 Ca 0.07 0.06 -0.29 0.00 1.31 0.00 0.00 55.95 57.10 1xcq s SER 159 Cb -0.04 0.34 -0.03 0.00 0.21 0.00 0.00 66.02 66.51 1xcq s SER 159 CO 0.08 -0.29 1.70 -0.70 0.41 0.00 0.00 173.24 174.45 1xcq s GLU 160 N 2.31 3.67 -0.32 12.44 2.12 -1.24 0.13 118.70 137.80 1xcq s GLU 160 Ca 0.04 1.66 -0.15 0.00 0.36 0.00 0.00 54.97 56.89 1xcq s GLU 160 Cb -0.14 -4.10 -0.02 0.00 0.26 0.00 0.00 34.13 30.13 1xcq s GLU 160 CO -0.09 -1.45 0.34 0.50 -0.54 0.00 0.00 175.26 174.02 1xcq s ARG 161 N 4.98 3.69 0.00 4.30 6.06 -1.23 -4.94 118.95 131.81 1xcq s ARG 161 Ca 0.76 -0.33 0.24 0.00 -2.50 0.00 0.00 55.73 53.90 1xcq s ARG 161 Cb -0.25 -3.76 0.48 0.00 0.06 0.00 0.00 34.95 31.48 1xcq s ARG 161 CO 0.31 -0.44 1.42 1.04 -2.50 0.00 0.00 175.30 175.14 1xcq n GLN 162 N 5.33 2.20 -3.34 5.12 6.02 -1.26 -4.45 117.38 127.01 1xcq n GLN 162 Ca -0.10 -1.78 -0.39 0.00 -0.01 0.00 0.00 57.00 54.72 1xcq n GLN 162 Cb 0.50 -1.47 -0.08 0.00 1.02 0.00 0.00 30.24 30.21 1xcq n GLN 162 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1xcq s ASN 163 N -1.77 6.36 0.00 1.08 2.47 -1.26 -4.46 114.94 117.37 1xcq s ASN 163 Ca 0.34 0.43 0.00 0.00 0.42 0.00 0.00 52.86 54.05 1xcq s ASN 163 Cb 0.21 -2.24 0.00 0.00 -1.45 0.00 0.00 41.25 37.77 1xcq s ASN 163 CO 0.31 -0.19 0.00 0.61 -3.72 0.00 0.00 177.10 174.10 1xcq n GLY 164 N 4.39 0.89 3.88 1.21 0.00 -1.26 -4.85 105.19 109.45 1xcq n GLY 164 Ca -0.07 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.50 1xcq n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xcq s VAL 165 N -2.00 4.96 -0.18 1.61 0.11 -1.26 -1.78 120.40 121.85 1xcq s VAL 165 Ca 0.00 -0.86 -0.05 0.00 -2.93 0.00 0.00 61.98 58.15 1xcq s VAL 165 Cb 0.00 -3.54 0.07 0.00 -1.53 0.00 0.00 36.38 31.38 1xcq s VAL 165 CO 0.00 -0.10 0.13 -0.76 -3.33 0.00 0.00 175.10 171.04 1xcq s LEU 166 N -3.17 0.21 -0.02 2.54 1.02 -1.25 -4.91 118.68 113.09 1xcq s LEU 166 Ca 0.33 -0.51 -0.01 0.00 0.02 0.00 0.00 54.13 53.96 1xcq s LEU 166 Cb -0.11 -0.06 -0.04 0.00 0.02 0.00 0.00 46.19 46.01 1xcq s LEU 166 CO 0.26 -0.35 0.07 0.20 0.02 0.00 0.00 176.35 176.55 1xcq s ASN 167 N 2.19 5.61 -0.20 2.29 -0.87 -1.22 0.17 114.94 122.91 1xcq s ASN 167 Ca 0.04 0.15 -0.05 0.00 -1.57 0.00 0.00 52.86 51.43 1xcq s ASN 167 Cb -0.16 -1.61 0.08 0.00 -0.02 0.00 0.00 41.25 39.54 1xcq s ASN 167 CO -0.11 0.30 0.12 -0.55 -2.57 0.00 0.00 177.10 174.30 1xcq s SER 168 N -1.55 2.40 0.23 -1.22 0.15 0.82 -4.86 113.70 109.66 1xcq s SER 168 Ca 0.21 -0.69 -0.29 0.00 0.70 0.00 0.00 55.95 55.88 1xcq s SER 168 Cb -0.12 -0.14 -0.09 0.00 -1.71 0.00 0.00 66.02 63.96 1xcq s SER 168 CO 0.11 -0.36 0.90 0.26 1.20 0.00 0.00 173.24 175.35 1xcq s TRP 169 N 2.17 3.96 0.00 3.44 0.51 -1.26 0.17 118.94 127.93 1xcq s TRP 169 Ca 0.04 1.85 0.00 0.00 -2.12 0.00 0.00 56.10 55.87 1xcq s TRP 169 Cb -0.16 -2.93 0.00 0.00 -0.81 0.00 0.00 33.47 29.57 1xcq s TRP 169 CO -0.16 0.46 0.00 0.25 -0.51 0.00 0.00 176.95 177.00 1xcq n THR 170 N 1.47 0.00 -4.35 2.01 -2.24 -0.73 -4.93 114.28 105.51 1xcq n THR 170 Ca -0.03 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.41 1xcq n THR 170 Cb 0.47 -1.76 -0.09 0.00 -2.10 0.00 0.00 70.33 66.85 1xcq n THR 170 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1xcq s ASP 171 N -1.00 5.23 -0.18 3.42 1.01 -1.26 -4.95 116.67 118.94 1xcq s ASP 171 Ca 0.00 0.12 -0.38 0.00 0.71 0.00 0.00 52.55 53.00 1xcq s ASP 171 Cb 0.00 -1.45 -0.18 0.00 1.01 0.00 0.00 42.92 42.30 1xcq s ASP 171 CO 0.00 0.36 1.14 1.67 0.21 0.00 0.00 175.17 178.55 1xcq n GLN 172 N 1.98 0.00 -0.64 8.23 7.27 -1.26 -4.75 117.38 128.21 1xcq n GLN 172 Ca -0.18 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.58 1xcq n GLN 172 Cb 0.53 -1.34 0.19 0.00 2.41 0.00 0.00 30.24 32.03 1xcq n GLN 172 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1xcq n ASP 173 N 2.23 -2.10 0.11 1.69 2.03 0.12 -4.85 116.55 115.77 1xcq n ASP 173 Ca 0.22 -0.06 -0.04 0.00 0.52 0.00 0.00 54.79 55.43 1xcq n ASP 173 Cb 0.02 -1.08 0.10 0.00 -0.72 0.00 0.00 41.12 39.44 1xcq n ASP 173 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1xcq h SER 174 N -2.16 0.12 0.00 1.67 0.02 -1.90 -3.40 113.55 107.91 1xcq h SER 174 Ca -0.54 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1xcq h SER 174 Cb 1.34 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1xcq h SER 174 CO 0.41 0.78 -0.03 1.17 -1.14 0.00 0.00 176.83 178.01 1xcq n LYS 175 N -3.75 0.00 0.00 3.45 3.00 -1.26 -4.57 118.16 115.03 1xcq n LYS 175 Ca -0.02 -0.45 0.00 0.00 -0.00 0.00 0.00 58.31 57.84 1xcq n LYS 175 Cb 0.68 -0.42 0.00 0.00 0.00 0.00 0.00 35.03 35.29 1xcq n LYS 175 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1xcq n ASP 176 N 0.00 0.18 -2.36 3.14 3.85 -1.26 -5.00 116.55 115.10 1xcq n ASP 176 Ca 0.00 -0.72 -0.13 0.00 -0.71 0.00 0.00 54.79 53.23 1xcq n ASP 176 Cb 0.51 0.08 0.05 0.00 -1.35 0.00 0.00 41.12 40.41 1xcq n ASP 176 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1xcq n SER 177 N -0.08 -3.84 -3.15 -1.12 7.64 -1.26 -5.01 113.62 106.80 1xcq n SER 177 Ca 0.00 -0.33 -0.13 0.00 1.01 0.00 0.00 58.87 59.42 1xcq n SER 177 Cb 0.13 -3.19 -0.02 0.00 -1.01 0.00 0.00 64.21 60.11 1xcq n SER 177 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1xcq n THR 178 N -3.65 0.00 -3.91 0.44 -2.24 -1.26 -4.80 114.28 98.86 1xcq n THR 178 Ca -0.05 -0.97 -0.09 0.00 -2.27 0.00 0.00 64.05 60.67 1xcq n THR 178 Cb 0.55 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.72 1xcq n THR 178 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1xcq s TYR 179 N -1.51 0.29 0.06 4.78 1.51 0.76 0.14 117.35 123.37 1xcq s TYR 179 Ca 0.05 -0.66 -0.26 0.00 -1.01 0.00 0.00 57.07 55.19 1xcq s TYR 179 Cb -0.00 0.00 0.07 0.00 -0.11 0.00 0.00 41.96 41.92 1xcq s TYR 179 CO 0.03 -0.71 0.63 -1.12 -1.11 0.00 0.00 175.55 173.27 1xcq s SER 180 N -2.94 -0.60 -0.04 2.29 0.01 -1.26 0.16 113.70 111.32 1xcq s SER 180 Ca 0.14 0.32 -0.13 0.00 1.31 0.00 0.00 55.95 57.59 1xcq s SER 180 Cb 0.03 0.57 0.02 0.00 0.21 0.00 0.00 66.02 66.85 1xcq s SER 180 CO -0.02 -0.80 0.30 0.00 0.41 0.00 0.00 173.24 173.12 1xcq s MET 181 N -2.57 0.57 -0.18 12.44 0.23 -1.06 -1.78 119.30 126.95 1xcq s MET 181 Ca -0.05 -0.03 -0.02 0.00 -1.03 0.00 0.00 55.69 54.56 1xcq s MET 181 Cb -0.01 0.26 -0.01 0.00 -1.53 0.00 0.00 34.83 33.54 1xcq s MET 181 CO -0.02 -0.14 -0.08 0.45 -2.03 0.00 0.00 175.02 173.20 1xcq s SER 182 N -0.92 4.17 -0.26 -1.18 0.15 0.46 -3.58 113.70 112.54 1xcq s SER 182 Ca -0.10 -0.37 -0.07 0.00 0.70 0.00 0.00 55.95 56.11 1xcq s SER 182 Cb -0.05 -1.69 -0.02 0.00 -1.71 0.00 0.00 66.02 62.56 1xcq s SER 182 CO 0.03 0.06 0.07 -0.55 1.20 0.00 0.00 173.24 174.04 1xcq s SER 183 N 1.02 5.08 -0.77 5.45 0.15 -1.19 -0.13 113.70 123.31 1xcq s SER 183 Ca -0.00 -0.34 0.03 0.00 0.70 0.00 0.00 55.95 56.34 1xcq s SER 183 Cb -0.15 -1.90 0.27 0.00 -1.71 0.00 0.00 66.02 62.53 1xcq s SER 183 CO -0.01 -0.07 1.00 0.41 1.20 0.00 0.00 173.24 175.77 1xcq n THR 184 N 4.91 3.37 -1.68 6.45 -1.04 0.45 -3.22 114.28 123.51 1xcq n THR 184 Ca -0.16 -5.48 -0.50 0.00 -2.04 0.00 0.00 64.05 55.87 1xcq n THR 184 Cb 0.51 -2.03 -0.05 0.00 -1.82 0.00 0.00 70.33 66.93 1xcq n THR 184 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1xcq n LEU 185 N 0.88 3.17 -4.28 -4.42 7.94 -1.13 -3.96 117.00 115.20 1xcq n LEU 185 Ca 0.29 1.01 -0.20 0.00 -1.11 0.00 0.00 56.01 56.00 1xcq n LEU 185 Cb 0.38 -1.33 -0.11 0.00 0.53 0.00 0.00 43.42 42.89 1xcq n LEU 185 CO 0.50 -0.17 -0.47 0.42 -1.11 0.00 0.00 177.39 176.55 1xcq s THR 186 N 3.61 1.57 -0.25 1.96 -4.23 -0.73 0.77 115.64 118.34 1xcq s THR 186 Ca 0.92 -1.75 -0.27 0.00 -1.18 0.00 0.00 61.69 59.42 1xcq s THR 186 Cb -0.77 -1.63 0.13 0.00 1.34 0.00 0.00 72.50 71.56 1xcq s THR 186 CO 0.53 -0.31 1.05 -1.48 -0.54 0.00 0.00 174.62 173.87 1xcq s LEU 187 N -2.41 -0.40 0.45 4.79 2.34 0.08 -4.70 118.68 118.83 1xcq s LEU 187 Ca 0.11 0.68 -0.25 0.00 0.06 0.00 0.00 54.13 54.72 1xcq s LEU 187 Cb -0.06 1.82 -0.08 0.00 -0.56 0.00 0.00 46.19 47.30 1xcq s LEU 187 CO 0.05 -0.20 1.44 0.42 -1.06 0.00 0.00 176.35 177.00 1xcq s THR 188 N -0.19 2.01 0.25 5.48 -4.23 -1.26 0.24 115.64 117.94 1xcq s THR 188 Ca 0.02 0.01 -0.13 0.00 -1.18 0.00 0.00 61.69 60.41 1xcq s THR 188 Cb -0.04 -3.01 0.33 0.00 1.34 0.00 0.00 72.50 71.13 1xcq s THR 188 CO -0.05 0.00 1.55 1.17 -0.54 0.00 0.00 174.62 176.75 1xcq n LYS 189 N -0.19 -0.17 0.18 3.99 4.81 -1.26 -1.65 118.16 123.87 1xcq n LYS 189 Ca 0.05 1.54 -0.08 0.00 -0.87 0.00 0.00 58.31 58.96 1xcq n LYS 189 Cb 0.41 -2.29 -0.04 0.00 0.02 0.00 0.00 35.03 33.14 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 -0.44 -0.46 3.14 3.32 -1.91 3.96 116.42 124.04 1xcq h ASP 190 Ca 0.40 0.02 0.13 0.00 0.02 0.00 0.00 57.03 57.60 1xcq h ASP 190 Cb 0.65 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 1xcq h ASP 190 CO -1.00 -0.29 0.82 -0.62 -1.72 0.00 0.00 179.24 176.43 1xcq n GLU 191 N -3.36 0.01 -0.07 3.56 1.02 -0.66 0.37 120.64 121.52 1xcq n GLU 191 Ca -0.06 0.72 -0.15 0.00 -0.02 0.00 0.00 57.16 57.65 1xcq n GLU 191 Cb 0.19 -1.85 -0.05 0.00 -0.02 0.00 0.00 31.44 29.71 1xcq n GLU 191 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1xcq n TYR 192 N -2.40 0.00 0.08 -0.32 9.36 -0.87 -4.15 117.16 118.85 1xcq n TYR 192 Ca 0.10 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.38 1xcq n TYR 192 Cb 0.96 -0.51 0.28 0.00 -0.63 0.00 0.00 39.34 39.44 1xcq n TYR 192 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1xcq n GLU 193 N -3.62 0.07 0.00 2.98 -0.58 1.30 -4.20 120.64 116.59 1xcq n GLU 193 Ca -0.28 0.57 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 1xcq n GLU 193 Cb 0.70 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.85 1xcq n GLU 193 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1xcq n ARG 194 N -1.86 0.00 -0.65 3.49 0.63 0.32 -4.94 116.66 113.64 1xcq n ARG 194 Ca -0.01 0.00 -0.22 0.00 -0.92 0.00 0.00 57.85 56.71 1xcq n ARG 194 Cb 0.02 -0.23 0.12 0.00 0.45 0.00 0.00 32.46 32.81 1xcq n ARG 194 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1xcq n HIS 195 N 0.00 -1.87 0.00 -0.14 8.25 -1.26 -5.03 115.22 115.18 1xcq n HIS 195 Ca 0.00 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 1xcq n HIS 195 Cb 0.00 -1.42 0.00 0.00 1.12 0.00 0.00 29.99 29.69 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 -0.07 0.98 -4.48 0.41 2.85 -1.26 -4.95 115.26 108.74 1xcq n ASN 196 Ca 0.03 0.00 -0.43 0.00 -0.11 0.00 0.00 54.58 54.07 1xcq n ASN 196 Cb 0.42 0.19 -0.05 0.00 1.24 0.00 0.00 39.78 41.58 1xcq n ASN 196 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1xcq s SER 197 N -0.46 6.27 -0.43 1.20 1.04 -1.26 -0.40 113.70 119.65 1xcq s SER 197 Ca 0.00 -0.70 -0.14 0.00 0.48 0.00 0.00 55.95 55.59 1xcq s SER 197 Cb 0.00 -2.37 0.05 0.00 0.10 0.00 0.00 66.02 63.80 1xcq s SER 197 CO 0.00 -1.11 0.31 -0.31 0.98 0.00 0.00 173.24 173.12 1xcq s TYR 198 N 3.36 3.26 0.28 5.02 2.02 -0.51 -1.32 117.35 129.46 1xcq s TYR 198 Ca 0.22 -0.94 0.07 0.00 -0.37 0.00 0.00 57.07 56.04 1xcq s TYR 198 Cb -0.16 -2.85 -0.06 0.00 -0.40 0.00 0.00 41.96 38.49 1xcq s TYR 198 CO 0.15 -0.72 -0.06 0.95 -1.57 0.00 0.00 175.55 174.29 1xcq s THR 199 N 1.60 1.63 -0.49 -0.71 -4.23 -1.17 0.28 115.64 112.56 1xcq s THR 199 Ca 0.04 -2.12 0.04 0.00 -1.18 0.00 0.00 61.69 58.46 1xcq s THR 199 Cb -0.22 -2.44 0.17 0.00 1.34 0.00 0.00 72.50 71.35 1xcq s THR 199 CO 0.07 -0.31 0.36 0.00 -0.54 0.00 0.00 174.62 174.21 1xcq s GLU 201 N -0.25 3.87 -0.44 0.00 2.02 -1.06 -3.63 118.70 119.21 1xcq s GLU 201 Ca 0.29 0.69 -0.00 0.00 0.02 0.00 0.00 54.97 55.96 1xcq s GLU 201 Cb -0.02 -3.81 0.12 0.00 0.10 0.00 0.00 34.13 30.52 1xcq s GLU 201 CO -0.16 -1.01 0.20 0.00 0.02 0.00 0.00 175.26 174.31 1xcq s ALA 202 N 3.68 3.17 0.38 5.21 0.00 -1.15 -0.84 121.76 132.22 1xcq s ALA 202 Ca 0.41 -2.74 -0.27 0.00 0.00 0.00 0.00 51.96 49.37 1xcq s ALA 202 Cb -0.11 -2.30 -0.09 0.00 0.00 0.00 0.00 23.12 20.62 1xcq s ALA 202 CO 0.20 -1.84 1.28 0.99 0.00 0.00 0.00 175.76 176.38 1xcq s THR 203 N 0.71 2.75 0.00 0.00 2.01 -1.22 -4.10 115.64 115.79 1xcq s THR 203 Ca 0.11 0.68 0.00 0.00 0.31 0.00 0.00 61.69 62.80 1xcq s THR 203 Cb -0.22 -3.41 0.00 0.00 0.01 0.00 0.00 72.50 68.88 1xcq s THR 203 CO -0.05 0.11 0.00 1.57 -0.69 0.00 0.00 174.62 175.56 1xcq n HIS 204 N 0.30 0.00 -0.25 4.92 -0.00 -1.26 0.15 115.22 119.07 1xcq n HIS 204 Ca 0.03 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.21 1xcq n HIS 204 Cb 0.44 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.31 1xcq n HIS 204 CO 0.00 0.00 0.00 0.36 0.46 0.00 0.00 176.34 177.16 1xcq n LYS 205 N 0.00 0.00 0.28 1.57 -0.00 -1.26 -4.80 118.16 113.95 1xcq n LYS 205 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 58.31 58.49 1xcq n LYS 205 Cb 0.00 0.00 0.76 0.00 -0.00 0.00 0.00 35.03 35.79 1xcq n LYS 205 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 1xcq h THR 206 N 0.00 0.00 -2.01 0.58 1.35 -1.94 -3.43 112.91 107.45 1xcq h THR 206 Ca 0.00 -0.39 -0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1xcq h THR 206 Cb 0.00 1.36 -0.21 0.00 -1.73 0.00 0.00 68.15 67.57 1xcq h THR 206 CO 0.00 0.00 0.05 -0.55 -0.25 0.00 0.00 175.52 174.77 1xcq s SER 207 N -5.46 -0.87 0.61 5.36 0.15 -1.26 -4.97 113.70 107.27 1xcq s SER 207 Ca 0.00 1.48 0.29 0.00 0.70 0.00 0.00 55.95 58.43 1xcq s SER 207 Cb 0.10 1.41 1.56 0.00 -1.71 0.00 0.00 66.02 67.37 1xcq s SER 207 CO 0.50 -0.24 1.94 0.71 1.20 0.00 0.00 173.24 177.35 1xcq h THR 208 N 4.65 0.27 -3.32 6.45 1.35 -1.99 -3.37 112.91 116.95 1xcq h THR 208 Ca -0.30 0.00 -0.64 0.00 -0.55 0.00 0.00 66.41 64.92 1xcq h THR 208 Cb 1.20 0.67 -0.23 0.00 -1.73 0.00 0.00 68.15 68.07 1xcq h THR 208 CO 0.12 0.00 -0.70 -0.94 -0.25 0.00 0.00 175.52 173.75 1xcq s SER 209 N -5.07 4.53 0.82 5.36 1.04 -1.26 -5.09 113.70 114.03 1xcq s SER 209 Ca -0.04 -0.19 -0.10 0.00 0.48 0.00 0.00 55.95 56.10 1xcq s SER 209 Cb 0.13 -1.70 0.09 0.00 0.10 0.00 0.00 66.02 64.64 1xcq s SER 209 CO 0.46 0.18 1.10 -2.16 0.98 0.00 0.00 173.24 173.80 1xcq s PRO 210 N 0.30 1.83 -0.27 4.02 0.04 -1.26 -5.00 135.00 134.66 1xcq s PRO 210 Ca -0.06 1.23 -0.18 0.00 0.04 0.00 0.00 61.00 62.03 1xcq s PRO 210 Cb -0.15 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 1xcq s PRO 210 CO 0.04 -1.97 0.53 0.42 0.04 0.00 0.00 177.00 176.06 1xcq s ILE 211 N -2.84 5.05 -0.16 0.56 1.01 -1.26 -5.02 121.20 118.55 1xcq s ILE 211 Ca 0.63 0.87 -0.05 0.00 0.00 0.00 0.00 60.65 62.10 1xcq s ILE 211 Cb -0.19 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1xcq s ILE 211 CO 0.57 0.05 0.01 -0.69 0.00 0.00 0.00 174.94 174.88 1xcq s VAL 212 N 2.35 4.36 -0.13 2.92 1.01 -1.26 -2.92 120.40 126.73 1xcq s VAL 212 Ca 0.22 -0.20 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1xcq s VAL 212 Cb -0.16 -2.92 0.05 0.00 0.00 0.00 0.00 36.38 33.35 1xcq s VAL 212 CO 0.09 0.50 0.10 -0.54 0.00 0.00 0.00 175.10 175.25 1xcq s LYS 213 N 0.17 0.03 0.03 2.72 -0.14 -1.24 -4.99 119.74 116.33 1xcq s LYS 213 Ca 0.01 0.12 0.00 0.00 -1.36 0.00 0.00 55.97 54.74 1xcq s LYS 213 Cb -0.13 -1.30 0.00 0.00 -1.68 0.00 0.00 37.83 34.72 1xcq s LYS 213 CO 0.02 -0.55 0.02 -1.13 -0.76 0.00 0.00 175.35 172.95 1xcq n SER 214 N 5.29 1.24 -2.87 2.83 3.41 -1.26 0.23 113.62 122.49 1xcq n SER 214 Ca -0.06 -1.12 0.03 0.00 -0.26 0.00 0.00 58.87 57.47 1xcq n SER 214 Cb 0.49 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.45 1xcq n SER 214 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1xcq s PHE 215 N -0.30 -0.13 -0.70 7.33 5.36 0.81 -4.84 117.98 125.52 1xcq s PHE 215 Ca 0.02 0.04 -0.20 0.00 -0.96 0.00 0.00 56.93 55.83 1xcq s PHE 215 Cb -0.00 0.02 0.11 0.00 -0.34 0.00 0.00 43.02 42.81 1xcq s PHE 215 CO 0.01 -0.08 0.88 -0.80 -1.46 0.00 0.00 175.22 173.77 1xcq s ASN 216 N 2.37 6.32 0.00 6.13 0.01 -1.26 -1.43 114.94 127.09 1xcq s ASN 216 Ca 0.21 -1.53 0.00 0.00 -0.71 0.00 0.00 52.86 50.83 1xcq s ASN 216 Cb 0.03 -2.35 0.00 0.00 0.41 0.00 0.00 41.25 39.34 1xcq s ASN 216 CO -0.19 -1.16 0.00 -1.14 -1.51 0.00 0.00 177.10 173.10 1xcq n ARG 217 N 6.62 0.00 0.00 -0.60 0.63 0.47 -0.30 116.66 123.48 1xcq n ARG 217 Ca 0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1xcq n ARG 217 Cb 0.45 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.36 1xcq n ARG 217 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 1xcq n ASN 218 N -3.36 1.68 0.00 6.15 6.94 -1.26 -2.53 115.26 122.88 1xcq n ASN 218 Ca 0.00 -1.91 0.00 0.00 -0.02 0.00 0.00 54.58 52.65 1xcq n ASN 218 Cb 0.00 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 36.94 1xcq n ASN 218 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1xcq n GLU 219 N 0.21 4.15 0.00 -3.83 1.02 0.59 -5.25 120.64 117.53 1xcq n GLU 219 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1xcq n GLU 219 Cb 0.33 -0.57 0.00 0.00 -0.02 0.00 0.00 31.44 31.18 1xcq n GLU 219 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31