#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r3p n GLU 2 N 0.00 0.00 0.00 2.12 0.00 -1.26 -0.75 120.64 120.76 2r3p n GLU 2 Ca 0.00 0.46 0.14 0.00 0.00 0.00 0.00 57.16 57.76 2r3p n GLU 2 Cb 0.00 -1.51 0.64 0.00 0.00 0.00 0.00 31.44 30.57 2r3p n GLU 2 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2r3p n ASN 3 N -1.52 0.39 -4.26 -1.84 3.02 -1.26 -4.85 115.26 104.94 2r3p n ASN 3 Ca 0.01 -0.53 -0.25 0.00 -0.03 0.00 0.00 54.58 53.78 2r3p n ASN 3 Cb 0.03 -0.10 -0.13 0.00 -0.61 0.00 0.00 39.78 38.97 2r3p n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2r3p s PHE 4 N -2.47 1.78 -0.20 3.10 0.08 0.07 -0.02 117.98 120.33 2r3p s PHE 4 Ca 0.29 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 56.93 2r3p s PHE 4 Cb 0.20 -1.02 -0.00 0.00 -0.57 0.00 0.00 43.02 41.63 2r3p s PHE 4 CO 0.47 0.15 -0.10 -1.14 -0.10 0.00 0.00 175.22 174.50 2r3p s GLN 5 N -1.53 3.27 0.02 0.44 0.74 -0.13 -4.87 119.66 117.60 2r3p s GLN 5 Ca 0.07 -0.69 -0.30 0.00 0.05 0.00 0.00 55.36 54.49 2r3p s GLN 5 Cb -0.09 -2.85 -0.05 0.00 1.10 0.00 0.00 33.01 31.11 2r3p s GLN 5 CO 0.03 -0.16 1.26 0.15 -0.55 0.00 0.00 175.29 176.02 2r3p s LYS 6 N 1.32 4.37 -0.21 1.67 1.02 -1.26 -0.44 119.74 126.21 2r3p s LYS 6 Ca 0.04 1.82 -0.21 0.00 0.02 0.00 0.00 55.97 57.64 2r3p s LYS 6 Cb -0.14 -3.44 -0.18 0.00 -0.52 0.00 0.00 37.83 33.55 2r3p s LYS 6 CO -0.05 -0.39 0.19 0.28 -0.92 0.00 0.00 175.35 174.45 2r3p h VAL 7 N 4.70 0.86 -1.97 3.17 2.07 -1.13 -3.48 116.25 120.46 2r3p h VAL 7 Ca -0.39 -2.11 0.09 0.00 0.82 0.00 0.00 66.70 65.12 2r3p h VAL 7 Cb 1.19 2.08 -0.18 0.00 -1.52 0.00 0.00 31.29 32.86 2r3p h VAL 7 CO 0.85 0.29 0.51 -1.83 0.02 0.00 0.00 177.57 177.41 2r3p s GLU 8 N -2.36 0.73 -0.09 1.57 -1.05 -1.07 -5.00 118.70 111.45 2r3p s GLU 8 Ca -0.28 -0.10 -0.29 0.00 -0.15 0.00 0.00 54.97 54.15 2r3p s GLU 8 Cb 0.06 0.34 -0.02 0.00 -0.44 0.00 0.00 34.13 34.07 2r3p s GLU 8 CO 0.57 -0.29 0.97 0.21 0.95 0.00 0.00 175.26 177.67 2r3p s LYS 9 N -2.25 4.44 0.00 -4.83 2.20 -1.26 -0.23 119.74 117.81 2r3p s LYS 9 Ca 0.02 1.33 0.18 0.00 -0.36 0.00 0.00 55.97 57.14 2r3p s LYS 9 Cb -0.01 -3.52 -0.02 0.00 -1.51 0.00 0.00 37.83 32.77 2r3p s LYS 9 CO -0.04 -0.24 0.91 0.44 -0.36 0.00 0.00 175.35 176.06 2r3p n ILE 10 N 4.39 0.00 0.00 5.43 -5.35 0.14 -4.89 119.36 119.07 2r3p n ILE 10 Ca 0.07 -0.30 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 2r3p n ILE 10 Cb 0.49 1.19 0.00 0.00 -1.74 0.00 0.00 39.64 39.59 2r3p n ILE 10 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r3p n GLY 11 N 1.24 0.67 3.08 3.28 0.00 -1.15 -4.99 105.19 107.32 2r3p n GLY 11 Ca 0.07 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.59 2r3p n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r3p s GLU 12 N -2.00 2.09 0.38 1.61 2.02 -1.26 -0.65 118.70 120.88 2r3p s GLU 12 Ca 0.00 -1.48 -0.06 0.00 0.02 0.00 0.00 54.97 53.45 2r3p s GLU 12 Cb 0.00 -3.04 0.09 0.00 0.10 0.00 0.00 34.13 31.28 2r3p s GLU 12 CO 0.00 -0.69 0.52 0.41 0.02 0.00 0.00 175.26 175.52 2r3p n GLY 13 N 4.43 -1.26 0.17 -1.39 0.00 0.12 -4.96 105.19 102.30 2r3p n GLY 13 Ca -0.09 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.14 2r3p n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2r3p h THR 14 N -1.29 1.20 0.00 2.61 2.02 -1.98 -3.28 112.91 112.18 2r3p h THR 14 Ca -0.17 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.39 2r3p h THR 14 Cb 0.46 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2r3p h THR 14 CO 0.12 0.21 -0.96 -1.22 0.37 0.00 0.00 175.52 174.04 2r3p n TYR 15 N -4.69 0.78 -2.52 3.16 4.01 -1.26 -2.37 117.16 114.26 2r3p n TYR 15 Ca -0.02 0.23 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 2r3p n TYR 15 Cb 0.16 -0.83 0.00 0.00 -0.31 0.00 0.00 39.34 38.36 2r3p n TYR 15 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2r3p n GLY 16 N 1.24 -1.49 3.78 2.72 0.00 -1.20 -0.72 105.19 109.51 2r3p n GLY 16 Ca 0.01 -1.05 -0.35 0.00 0.00 0.00 0.00 46.02 44.63 2r3p n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r3p s VAL 17 N -2.73 3.47 -0.11 1.61 0.11 -1.25 0.14 120.40 121.64 2r3p s VAL 17 Ca 0.00 1.00 0.02 0.00 -2.93 0.00 0.00 61.98 60.07 2r3p s VAL 17 Cb 0.00 -3.45 -0.01 0.00 -1.53 0.00 0.00 36.38 31.39 2r3p s VAL 17 CO 0.00 -0.11 -0.19 -0.69 -3.33 0.00 0.00 175.10 170.78 2r3p s VAL 18 N -1.76 2.52 0.13 2.04 1.01 0.17 -1.96 120.40 122.56 2r3p s VAL 18 Ca 0.66 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.87 2r3p s VAL 18 Cb -0.22 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2r3p s VAL 18 CO 0.27 0.54 -0.22 -0.31 0.00 0.00 0.00 175.10 175.38 2r3p s TYR 19 N 0.32 1.94 -0.10 5.22 1.51 -0.25 -0.69 117.35 125.30 2r3p s TYR 19 Ca -0.15 -0.41 -0.17 0.00 -1.01 0.00 0.00 57.07 55.33 2r3p s TYR 19 Cb -0.17 -1.04 -0.05 0.00 -0.11 0.00 0.00 41.96 40.60 2r3p s TYR 19 CO 0.07 0.28 0.43 0.21 -1.11 0.00 0.00 175.55 175.43 2r3p s LYS 20 N -2.15 4.25 0.13 -0.62 2.20 0.68 0.12 119.74 124.35 2r3p s LYS 20 Ca 0.11 0.38 -0.05 0.00 -0.36 0.00 0.00 55.97 56.04 2r3p s LYS 20 Cb -0.09 -3.39 -0.02 0.00 -1.51 0.00 0.00 37.83 32.81 2r3p s LYS 20 CO 0.05 0.28 0.15 0.00 -0.36 0.00 0.00 175.35 175.47 2r3p s ALA 21 N 0.26 0.35 -0.10 3.13 0.00 0.10 -0.50 121.76 125.01 2r3p s ALA 21 Ca 0.24 -1.10 0.03 0.00 0.00 0.00 0.00 51.96 51.13 2r3p s ALA 21 Cb -0.15 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.73 2r3p s ALA 21 CO 0.10 -0.54 -0.21 0.50 0.00 0.00 0.00 175.76 175.60 2r3p s ARG 22 N -3.98 2.77 -0.22 0.00 3.52 0.41 -0.63 118.95 120.82 2r3p s ARG 22 Ca 0.17 -0.78 -0.29 0.00 -0.13 0.00 0.00 55.73 54.71 2r3p s ARG 22 Cb 0.06 -2.15 -0.04 0.00 -1.56 0.00 0.00 34.95 31.26 2r3p s ARG 22 CO -0.02 0.11 1.85 1.21 -0.81 0.00 0.00 175.30 177.64 2r3p s ASN 23 N 0.50 6.03 0.07 -2.12 3.84 0.48 -0.96 114.94 122.79 2r3p s ASN 23 Ca -0.16 1.71 0.04 0.00 0.21 0.00 0.00 52.86 54.66 2r3p s ASN 23 Cb -0.17 -2.52 0.20 0.00 -0.55 0.00 0.00 41.25 38.20 2r3p s ASN 23 CO 0.06 -1.53 1.01 0.29 -2.79 0.00 0.00 177.10 174.14 2r3p n LYS 24 N 8.13 0.02 0.00 0.43 5.02 0.98 -1.54 118.16 131.21 2r3p n LYS 24 Ca 0.23 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 2r3p n LYS 24 Cb 0.45 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 2r3p n LYS 24 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2r3p n LEU 25 N -1.55 0.00 0.22 -0.35 4.77 -1.26 -4.72 117.00 114.11 2r3p n LEU 25 Ca -0.00 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.11 2r3p n LEU 25 Cb 0.13 0.00 0.72 0.00 -2.33 0.00 0.00 43.42 41.94 2r3p n LEU 25 CO 0.02 0.00 0.94 0.71 -1.33 0.00 0.00 177.39 177.73 2r3p h THR 26 N 0.00 0.00 0.00 -5.08 1.35 -1.95 -3.44 112.91 103.79 2r3p h THR 26 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2r3p h THR 26 Cb 0.00 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 67.01 2r3p h THR 26 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2r3p n GLY 27 N -1.24 0.83 3.75 5.82 0.00 -0.59 -4.98 105.19 108.78 2r3p n GLY 27 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2r3p n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2r3p n GLU 28 N -2.07 2.51 -3.71 1.61 2.13 -1.26 -4.62 120.64 115.24 2r3p n GLU 28 Ca 0.00 0.88 -0.36 0.00 0.66 0.00 0.00 57.16 58.34 2r3p n GLU 28 Cb 0.01 -2.57 -0.09 0.00 0.27 0.00 0.00 31.44 29.06 2r3p n GLU 28 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2r3p s VAL 29 N -1.01 5.36 0.25 6.31 1.01 -1.26 -0.38 120.40 130.67 2r3p s VAL 29 Ca 0.55 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.72 2r3p s VAL 29 Cb -0.51 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 2r3p s VAL 29 CO 0.62 0.39 0.15 0.68 0.00 0.00 0.00 175.10 176.95 2r3p s VAL 30 N 0.71 0.16 -0.20 2.92 -7.23 0.20 -4.27 120.40 112.69 2r3p s VAL 30 Ca 0.08 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.19 2r3p s VAL 30 Cb -0.12 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 2r3p s VAL 30 CO 0.01 0.00 0.02 0.00 -0.31 0.00 0.00 175.10 174.83 2r3p s ALA 31 N -3.87 3.15 -0.27 1.32 0.00 -0.46 -0.72 121.76 120.91 2r3p s ALA 31 Ca 0.38 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 51.36 2r3p s ALA 31 Cb 0.06 -1.84 0.01 0.00 0.00 0.00 0.00 23.12 21.35 2r3p s ALA 31 CO 0.16 -0.07 0.04 -1.17 0.00 0.00 0.00 175.76 174.72 2r3p s LEU 32 N 0.85 3.59 -0.24 0.00 2.96 0.12 -0.77 118.68 125.19 2r3p s LEU 32 Ca 0.02 -0.66 -0.08 0.00 -0.22 0.00 0.00 54.13 53.19 2r3p s LEU 32 Cb -0.14 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 2r3p s LEU 32 CO 0.02 -0.15 0.09 -0.75 -1.32 0.00 0.00 176.35 174.24 2r3p s LYS 33 N 1.47 3.75 -0.21 1.98 2.20 0.24 -1.10 119.74 128.08 2r3p s LYS 33 Ca 0.03 -0.43 -0.20 0.00 -0.36 0.00 0.00 55.97 55.01 2r3p s LYS 33 Cb -0.17 -3.35 -0.03 0.00 -1.51 0.00 0.00 37.83 32.78 2r3p s LYS 33 CO 0.01 -0.10 0.58 0.21 -0.36 0.00 0.00 175.35 175.68 2r3p s LYS 34 N 1.41 4.18 -0.44 4.03 2.20 -0.83 -0.90 119.74 129.39 2r3p s LYS 34 Ca 0.06 0.51 -0.16 0.00 -0.36 0.00 0.00 55.97 56.02 2r3p s LYS 34 Cb -0.15 -3.59 0.04 0.00 -1.51 0.00 0.00 37.83 32.62 2r3p s LYS 34 CO 0.04 -0.24 0.39 0.42 -0.36 0.00 0.00 175.35 175.60 2r3p s ILE 35 N 1.93 5.18 0.00 5.43 -1.09 0.11 -3.25 121.20 129.51 2r3p s ILE 35 Ca 0.26 -0.69 0.00 0.00 -2.23 0.00 0.00 60.65 57.99 2r3p s ILE 35 Cb -0.16 -4.04 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 2r3p s ILE 35 CO 0.10 -0.45 0.00 -1.14 -1.23 0.00 0.00 174.94 172.21 2r3p n ARG 36 N 5.36 0.00 -3.59 2.79 0.00 0.10 -4.16 116.66 117.16 2r3p n ARG 36 Ca -0.10 0.00 -0.16 0.00 -0.00 0.00 0.00 57.85 57.59 2r3p n ARG 36 Cb 0.46 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.85 2r3p n ARG 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2r3p s VAL 44 N 0.00 0.01 0.14 5.15 1.01 -1.26 -5.55 120.40 119.90 2r3p s VAL 44 Ca 0.00 -0.06 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 2r3p s VAL 44 Cb 0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 36.38 35.36 2r3p s VAL 44 CO 0.00 -0.03 1.58 -2.84 0.00 0.00 0.00 175.10 173.81 2r3p s PRO 45 N -0.78 4.21 0.49 2.72 0.02 -1.26 -4.86 135.00 135.55 2r3p s PRO 45 Ca -0.08 2.34 0.26 0.00 0.02 0.00 0.00 61.00 63.54 2r3p s PRO 45 Cb -0.02 -3.27 1.33 0.00 0.02 0.00 0.00 34.50 32.57 2r3p s PRO 45 CO 0.07 -0.63 1.87 0.77 -0.33 0.00 0.00 177.00 178.75 2r3p h SER 46 N 7.18 0.16 -0.86 2.53 0.02 -2.03 0.21 113.55 120.75 2r3p h SER 46 Ca -0.43 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 60.59 2r3p h SER 46 Cb 1.20 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.68 2r3p h SER 46 CO 0.92 0.06 0.54 0.00 -1.14 0.00 0.00 176.83 177.21 2r3p h THR 47 N 0.15 1.09 -0.18 -2.27 1.03 -1.98 -1.72 112.91 109.04 2r3p h THR 47 Ca 0.45 -0.35 -0.08 0.00 -0.01 0.00 0.00 66.41 66.42 2r3p h THR 47 Cb 1.53 -0.02 -0.00 0.00 -1.07 0.00 0.00 68.15 68.58 2r3p h THR 47 CO -0.08 0.19 -0.22 0.00 -0.01 0.00 0.00 175.52 175.40 2r3p h ALA 48 N 1.38 0.27 -0.29 0.00 0.00 -0.86 -2.78 119.26 116.99 2r3p h ALA 48 Ca 0.36 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2r3p h ALA 48 Cb 0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 2r3p h ALA 48 CO -0.14 0.22 -0.10 0.82 0.00 0.00 0.00 179.25 180.05 2r3p h ILE 49 N 0.11 0.65 -0.58 0.00 1.08 -1.06 -0.14 117.51 117.57 2r3p h ILE 49 Ca 0.02 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.42 2r3p h ILE 49 Cb 0.78 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 2r3p h ILE 49 CO 0.05 0.00 0.09 0.03 -0.69 0.00 0.00 178.15 177.64 2r3p h ARG 50 N -0.04 0.96 -0.26 2.37 3.08 -1.38 -0.77 114.38 118.34 2r3p h ARG 50 Ca 0.14 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 2r3p h ARG 50 Cb 0.26 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2r3p h ARG 50 CO -0.32 0.92 0.08 1.49 -1.07 0.00 0.00 179.97 181.06 2r3p h GLU 51 N 0.86 0.41 -0.74 0.04 4.57 -1.17 -2.10 114.58 116.45 2r3p h GLU 51 Ca 0.18 -0.09 -0.05 0.00 -1.18 0.00 0.00 59.36 58.21 2r3p h GLU 51 Cb 0.42 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.92 2r3p h GLU 51 CO 0.01 0.48 0.25 0.82 -1.18 0.00 0.00 179.01 179.40 2r3p h ILE 52 N 0.26 1.26 -0.33 2.32 1.08 -0.98 -2.30 117.51 118.81 2r3p h ILE 52 Ca 0.08 -0.86 0.01 0.00 -0.39 0.00 0.00 64.86 63.70 2r3p h ILE 52 Cb 0.25 0.42 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 2r3p h ILE 52 CO -0.00 0.34 0.22 0.28 -0.69 0.00 0.00 178.15 178.30 2r3p h SER 53 N 1.09 0.36 0.58 1.72 0.02 -0.86 -0.58 113.55 115.87 2r3p h SER 53 Ca 0.24 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.09 2r3p h SER 53 Cb 0.27 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2r3p h SER 53 CO -0.01 0.25 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.42 2r3p h LEU 54 N 0.42 0.00 -1.69 5.07 3.38 -0.81 -2.91 115.31 118.78 2r3p h LEU 54 Ca 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 2r3p h LEU 54 Cb -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2r3p h LEU 54 CO -0.03 0.44 -0.17 -0.07 0.09 0.00 0.00 178.44 178.71 2r3p h LEU 55 N 0.00 0.00 -2.35 1.67 3.38 -0.91 -2.54 115.31 114.56 2r3p h LEU 55 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2r3p h LEU 55 Cb 0.86 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2r3p h LEU 55 CO 0.06 0.17 -0.01 0.11 0.09 0.00 0.00 178.44 178.86 2r3p h LYS 56 N 0.00 0.00 0.00 1.13 1.57 -1.48 -2.12 116.57 115.67 2r3p h LYS 56 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2r3p h LYS 56 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2r3p h LYS 56 CO 0.02 0.01 -1.19 0.39 -0.57 0.00 0.00 179.45 178.11 2r3p n GLU 57 N -3.13 0.39 -1.72 3.15 1.02 -0.96 -4.65 120.64 114.74 2r3p n GLU 57 Ca -0.02 -0.02 -0.42 0.00 -0.02 0.00 0.00 57.16 56.69 2r3p n GLU 57 Cb 0.17 -1.61 -0.00 0.00 -0.02 0.00 0.00 31.44 29.97 2r3p n GLU 57 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2r3p n LEU 58 N -2.11 6.89 -4.79 -4.62 7.94 -0.80 -4.96 117.00 114.56 2r3p n LEU 58 Ca 0.01 -4.14 -0.37 0.00 -1.11 0.00 0.00 56.01 50.40 2r3p n LEU 58 Cb 0.47 -1.66 -0.07 0.00 0.53 0.00 0.00 43.42 42.70 2r3p n LEU 58 CO 0.41 1.12 -0.07 0.20 -1.11 0.00 0.00 177.39 177.94 2r3p s ASN 59 N 3.19 6.44 -0.08 1.96 0.01 -1.26 -4.97 114.94 120.23 2r3p s ASN 59 Ca 0.47 0.51 -0.30 0.00 -0.71 0.00 0.00 52.86 52.84 2r3p s ASN 59 Cb 0.14 -2.14 0.07 0.00 0.41 0.00 0.00 41.25 39.73 2r3p s ASN 59 CO -0.09 0.24 0.69 -2.28 -1.51 0.00 0.00 177.10 174.14 2r3p s HIS 60 N -0.21 -0.68 0.60 2.20 2.46 -1.26 -5.05 115.29 113.36 2r3p s HIS 60 Ca 0.15 1.25 0.38 0.00 0.47 0.00 0.00 55.06 57.31 2r3p s HIS 60 Cb -0.13 0.39 2.13 0.00 -0.13 0.00 0.00 32.58 34.84 2r3p s HIS 60 CO 0.04 -0.58 2.30 -1.35 -2.47 0.00 0.00 174.74 172.69 2r3p h PRO 61 N 3.30 0.00 -0.50 2.88 0.11 -1.99 -1.79 132.00 134.01 2r3p h PRO 61 Ca -0.27 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.74 2r3p h PRO 61 Cb 1.14 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 2r3p h PRO 61 CO 0.34 0.01 0.09 0.09 -0.21 0.00 0.00 178.00 178.32 2r3p n ASN 62 N -3.38 4.37 -4.00 -2.05 4.13 -1.26 -4.85 115.26 108.22 2r3p n ASN 62 Ca -0.03 -3.18 -0.26 0.00 1.68 0.00 0.00 54.58 52.79 2r3p n ASN 62 Cb 0.09 -0.65 -0.17 0.00 -1.54 0.00 0.00 39.78 37.51 2r3p n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2r3p s ILE 63 N -2.94 1.20 0.05 2.41 -1.09 -0.67 -0.78 121.20 119.38 2r3p s ILE 63 Ca 0.49 -0.47 -0.32 0.00 -2.23 0.00 0.00 60.65 58.12 2r3p s ILE 63 Cb 0.40 -1.13 -0.11 0.00 -1.58 0.00 0.00 42.46 40.04 2r3p s ILE 63 CO 0.11 0.38 1.86 0.52 -1.23 0.00 0.00 174.94 176.58 2r3p n VAL 64 N 4.21 0.50 -2.02 2.92 0.31 -0.46 -4.58 118.33 119.21 2r3p n VAL 64 Ca -0.19 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.63 2r3p n VAL 64 Cb 0.51 -2.06 -0.03 0.00 -0.91 0.00 0.00 33.84 31.35 2r3p n VAL 64 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2r3p s LYS 65 N 3.37 4.24 -0.45 5.55 2.20 -1.26 -4.86 119.74 128.54 2r3p s LYS 65 Ca 0.86 2.25 -0.22 0.00 -0.36 0.00 0.00 55.97 58.50 2r3p s LYS 65 Cb -0.54 -3.31 0.03 0.00 -1.51 0.00 0.00 37.83 32.49 2r3p s LYS 65 CO 0.42 -0.59 0.75 -1.17 -0.36 0.00 0.00 175.35 174.40 2r3p s LEU 66 N 1.56 4.32 -0.09 5.43 2.96 -1.26 -0.86 118.68 130.74 2r3p s LEU 66 Ca 0.69 -0.18 -0.26 0.00 -0.22 0.00 0.00 54.13 54.17 2r3p s LEU 66 Cb -0.40 -2.90 -0.28 0.00 0.50 0.00 0.00 46.19 43.11 2r3p s LEU 66 CO 0.31 -0.88 0.85 -0.07 -1.32 0.00 0.00 176.35 175.24 2r3p h LEU 67 N 10.01 0.22 -7.54 -0.68 3.38 -0.31 -3.45 115.31 116.95 2r3p h LEU 67 Ca -0.25 -0.96 -0.02 0.00 0.09 0.00 0.00 57.88 56.75 2r3p h LEU 67 Cb 1.09 -0.07 -0.10 0.00 0.09 0.00 0.00 40.66 41.66 2r3p h LEU 67 CO 0.94 1.16 0.07 -1.81 0.09 0.00 0.00 178.44 178.89 2r3p s ASP 68 N -6.54 -0.32 -0.10 -0.43 1.01 -0.96 -5.00 116.67 104.33 2r3p s ASP 68 Ca -0.16 -0.38 0.03 0.00 0.71 0.00 0.00 52.55 52.74 2r3p s ASP 68 Cb -0.01 0.59 0.01 0.00 1.01 0.00 0.00 42.92 44.51 2r3p s ASP 68 CO 0.75 -1.04 -0.18 -0.69 0.21 0.00 0.00 175.17 174.22 2r3p s VAL 69 N -3.85 1.68 -0.23 -1.27 1.01 -1.26 -0.85 120.40 115.63 2r3p s VAL 69 Ca 0.07 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2r3p s VAL 69 Cb -0.01 -1.49 0.05 0.00 0.00 0.00 0.00 36.38 34.92 2r3p s VAL 69 CO -0.05 0.48 -0.12 -0.63 0.00 0.00 0.00 175.10 174.78 2r3p s ILE 70 N 0.69 1.93 -0.30 2.22 1.01 0.72 -4.99 121.20 122.48 2r3p s ILE 70 Ca -0.12 -1.29 -0.04 0.00 0.00 0.00 0.00 60.65 59.20 2r3p s ILE 70 Cb -0.16 -1.99 0.03 0.00 0.01 0.00 0.00 42.46 40.35 2r3p s ILE 70 CO 0.03 0.12 0.04 -2.28 0.00 0.00 0.00 174.94 172.84 2r3p s HIS 71 N 1.25 3.19 -0.04 3.97 2.46 -1.26 -0.00 115.29 124.87 2r3p s HIS 71 Ca -0.04 -1.48 -0.07 0.00 0.47 0.00 0.00 55.06 53.94 2r3p s HIS 71 Cb -0.18 -2.18 0.01 0.00 -0.13 0.00 0.00 32.58 30.11 2r3p s HIS 71 CO -0.07 -0.72 0.18 0.95 -2.47 0.00 0.00 174.74 172.61 2r3p s THR 72 N 1.37 0.03 -1.07 0.89 -4.23 0.58 -4.84 115.64 108.36 2r3p s THR 72 Ca -0.01 -0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 2r3p s THR 72 Cb -0.18 -0.35 0.01 0.00 1.34 0.00 0.00 72.50 73.31 2r3p s THR 72 CO 0.00 -0.14 0.05 -0.62 -0.54 0.00 0.00 174.62 173.36 2r3p n GLU 73 N 2.36 -2.37 -1.51 3.99 1.02 -1.26 0.18 120.64 123.05 2r3p n GLU 73 Ca -0.17 0.59 -0.10 0.00 -0.02 0.00 0.00 57.16 57.46 2r3p n GLU 73 Cb 0.57 -5.20 -0.03 0.00 -0.02 0.00 0.00 31.44 26.76 2r3p n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2r3p n ASN 74 N -1.85 -4.05 -4.57 1.62 3.02 -1.26 -5.01 115.26 103.16 2r3p n ASN 74 Ca -0.13 0.19 -0.28 0.00 -0.03 0.00 0.00 54.58 54.32 2r3p n ASN 74 Cb 0.61 -2.66 -0.10 0.00 -0.61 0.00 0.00 39.78 37.02 2r3p n ASN 74 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2r3p s LYS 75 N -3.26 2.07 -0.13 3.52 1.02 0.48 -4.40 119.74 119.05 2r3p s LYS 75 Ca 0.00 -1.14 0.02 0.00 0.02 0.00 0.00 55.97 54.87 2r3p s LYS 75 Cb 0.00 -2.23 0.01 0.00 -0.52 0.00 0.00 37.83 35.09 2r3p s LYS 75 CO 0.00 0.47 -0.18 -1.17 -0.92 0.00 0.00 175.35 173.55 2r3p s LEU 76 N -2.48 1.89 -0.09 3.17 2.96 -1.26 -0.31 118.68 122.56 2r3p s LEU 76 Ca 0.23 -0.51 0.03 0.00 -0.22 0.00 0.00 54.13 53.66 2r3p s LEU 76 Cb -0.10 -1.25 0.01 0.00 0.50 0.00 0.00 46.19 45.35 2r3p s LEU 76 CO 0.14 0.04 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.71 2r3p s TYR 77 N 0.96 2.12 -0.18 5.38 1.51 1.00 -0.71 117.35 127.42 2r3p s TYR 77 Ca -0.06 -0.87 -0.06 0.00 -1.01 0.00 0.00 57.07 55.07 2r3p s TYR 77 Cb -0.15 -1.46 -0.03 0.00 -0.11 0.00 0.00 41.96 40.21 2r3p s TYR 77 CO -0.03 -0.39 0.02 -0.51 -1.11 0.00 0.00 175.55 173.54 2r3p s LEU 78 N 0.55 3.57 -0.24 -1.29 1.43 -0.08 -0.20 118.68 122.42 2r3p s LEU 78 Ca -0.16 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 52.85 2r3p s LEU 78 Cb -0.17 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2r3p s LEU 78 CO 0.05 0.16 0.07 -0.69 0.23 0.00 0.00 176.35 176.18 2r3p s VAL 79 N 0.44 4.40 0.32 -1.59 1.01 -0.03 -0.59 120.40 124.36 2r3p s VAL 79 Ca 0.00 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 61.93 2r3p s VAL 79 Cb -0.13 -3.05 -0.06 0.00 0.00 0.00 0.00 36.38 33.13 2r3p s VAL 79 CO 0.01 0.35 -0.08 -0.36 0.00 0.00 0.00 175.10 175.02 2r3p s PHE 80 N 1.48 2.27 0.43 5.22 0.08 0.05 0.47 117.98 127.99 2r3p s PHE 80 Ca 0.06 -0.56 -0.25 0.00 0.12 0.00 0.00 56.93 56.30 2r3p s PHE 80 Cb -0.15 -1.30 -0.08 0.00 -0.57 0.00 0.00 43.02 40.92 2r3p s PHE 80 CO 0.04 0.49 1.32 -2.00 -0.10 0.00 0.00 175.22 174.97 2r3p s GLU 81 N -3.64 3.81 -0.12 0.44 2.12 -0.04 -1.36 118.70 119.90 2r3p s GLU 81 Ca 0.32 2.17 -0.12 0.00 0.36 0.00 0.00 54.97 57.70 2r3p s GLU 81 Cb 0.03 -2.65 -0.05 0.00 0.26 0.00 0.00 34.13 31.72 2r3p s GLU 81 CO 0.15 -0.63 0.27 0.12 -0.54 0.00 0.00 175.26 174.63 2r3p s PHE 82 N -1.28 3.54 -0.02 5.30 5.36 -1.26 -4.41 117.98 125.21 2r3p s PHE 82 Ca 0.60 0.64 0.06 0.00 -0.96 0.00 0.00 56.93 57.27 2r3p s PHE 82 Cb -0.38 -2.23 -0.02 0.00 -0.34 0.00 0.00 43.02 40.05 2r3p s PHE 82 CO 0.49 0.43 -0.21 -0.51 -1.46 0.00 0.00 175.22 173.95 2r3p s LEU 83 N -0.15 2.04 0.44 6.12 1.02 -1.26 -5.00 118.68 121.88 2r3p s LEU 83 Ca 0.17 -0.38 0.24 0.00 0.02 0.00 0.00 54.13 54.18 2r3p s LEU 83 Cb -0.13 -1.09 0.86 0.00 0.02 0.00 0.00 46.19 45.85 2r3p s LEU 83 CO 0.05 0.26 1.80 0.45 0.02 0.00 0.00 176.35 178.93 2r3p h HIS 84 N 5.61 0.00 -3.46 0.29 3.86 -1.99 -3.47 115.15 115.99 2r3p h HIS 84 Ca -0.39 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.73 2r3p h HIS 84 Cb 1.14 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.45 2r3p h HIS 84 CO 0.39 0.22 -0.27 -1.14 0.86 0.00 0.00 177.93 178.00 2r3p s GLN 85 N -3.58 0.84 0.35 2.45 0.74 -1.22 -5.05 119.66 114.19 2r3p s GLN 85 Ca 0.01 -0.66 0.08 0.00 0.05 0.00 0.00 55.36 54.85 2r3p s GLN 85 Cb 0.10 0.36 -0.05 0.00 1.10 0.00 0.00 33.01 34.52 2r3p s GLN 85 CO 0.64 -0.28 0.12 0.16 -0.55 0.00 0.00 175.29 175.38 2r3p s ASP 86 N -2.37 4.53 0.39 6.67 1.47 -1.26 -0.51 116.67 125.59 2r3p s ASP 86 Ca -0.01 -0.86 0.12 0.00 1.18 0.00 0.00 52.55 52.97 2r3p s ASP 86 Cb 0.01 -0.65 0.79 0.00 -0.34 0.00 0.00 42.92 42.74 2r3p s ASP 86 CO -0.07 -0.32 1.88 0.25 0.68 0.00 0.00 175.17 177.60 2r3p h LEU 87 N 1.59 0.06 0.08 2.11 5.85 -0.29 -2.07 115.31 122.64 2r3p h LEU 87 Ca -0.43 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 2r3p h LEU 87 Cb 1.25 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2r3p h LEU 87 CO 0.65 0.34 -0.04 0.50 -0.34 0.00 0.00 178.44 179.54 2r3p h LYS 88 N 0.05 -0.11 -0.64 1.25 3.64 -1.80 0.22 116.57 119.19 2r3p h LYS 88 Ca 0.01 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2r3p h LYS 88 Cb 0.52 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 2r3p h LYS 88 CO 0.04 0.01 0.30 -0.22 -2.27 0.00 0.00 179.45 177.31 2r3p h LYS 89 N -0.21 0.93 -0.82 1.90 3.64 -1.86 -0.99 116.57 119.16 2r3p h LYS 89 Ca -0.01 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2r3p h LYS 89 Cb 0.17 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 2r3p h LYS 89 CO 0.02 0.75 0.42 0.35 -2.27 0.00 0.00 179.45 178.72 2r3p h PHE 90 N 0.88 1.16 -0.43 1.91 3.57 -1.16 0.31 116.94 123.18 2r3p h PHE 90 Ca 0.22 -0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.54 2r3p h PHE 90 Cb 0.14 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.50 2r3p h PHE 90 CO 0.00 0.83 -0.27 0.52 -2.23 0.00 0.00 178.31 177.16 2r3p h MET 91 N 1.15 0.91 -0.64 1.11 2.86 -0.21 -1.22 114.93 118.89 2r3p h MET 91 Ca 0.28 -0.41 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 2r3p h MET 91 Cb 0.08 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 2r3p h MET 91 CO -0.04 1.07 0.30 -0.44 1.06 0.00 0.00 176.91 178.86 2r3p h ASP 92 N 0.78 0.85 0.62 1.22 3.32 -0.76 -2.08 116.42 120.35 2r3p h ASP 92 Ca 0.09 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 2r3p h ASP 92 Cb 0.84 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 2r3p h ASP 92 CO 0.07 0.74 -0.22 0.00 -1.72 0.00 0.00 179.24 178.12 2r3p h ALA 93 N 1.13 1.16 -0.65 3.45 0.00 -0.71 -2.81 119.26 120.84 2r3p h ALA 93 Ca 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2r3p h ALA 93 Cb 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2r3p h ALA 93 CO -0.03 0.27 0.00 0.43 0.00 0.00 0.00 179.25 179.92 2r3p n SER 94 N -3.59 4.61 -0.36 0.00 7.64 -0.48 -4.61 113.62 116.84 2r3p n SER 94 Ca -0.01 -2.38 0.06 0.00 1.01 0.00 0.00 58.87 57.54 2r3p n SER 94 Cb 0.36 -0.56 0.22 0.00 -1.01 0.00 0.00 64.21 63.22 2r3p n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2r3p h ALA 95 N 4.04 1.45 -0.58 -0.43 0.00 -1.12 0.98 119.26 123.61 2r3p h ALA 95 Ca 0.00 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2r3p h ALA 95 Cb 1.37 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2r3p h ALA 95 CO 0.19 0.26 0.05 -0.07 0.00 0.00 0.00 179.25 179.69 2r3p h LEU 96 N 1.01 0.96 0.00 0.00 3.38 -1.84 -3.34 115.31 115.47 2r3p h LEU 96 Ca 0.47 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2r3p h LEU 96 Cb 0.41 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2r3p h LEU 96 CO -0.24 1.00 -0.66 1.07 0.09 0.00 0.00 178.44 179.69 2r3p n THR 97 N -4.28 0.00 -0.02 0.22 5.66 -1.16 -5.13 114.28 109.57 2r3p n THR 97 Ca 0.03 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.76 2r3p n THR 97 Cb 0.30 0.73 -0.00 0.00 -1.55 0.00 0.00 70.33 69.81 2r3p n THR 97 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2r3p n GLY 98 N 1.61 -2.72 3.71 1.09 0.00 0.34 -4.86 105.19 104.36 2r3p n GLY 98 Ca 0.00 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 2r3p n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r3p s ILE 99 N -3.51 3.49 0.32 -0.61 1.01 -1.26 -4.95 121.20 115.69 2r3p s ILE 99 Ca 0.00 1.03 -0.29 0.00 0.00 0.00 0.00 60.65 61.39 2r3p s ILE 99 Cb 0.00 -3.66 -0.12 0.00 0.01 0.00 0.00 42.46 38.68 2r3p s ILE 99 CO 0.00 0.06 1.40 -2.65 0.00 0.00 0.00 174.94 173.75 2r3p n PRO 100 N 4.28 2.31 -0.28 2.79 -0.02 -1.26 -4.73 135.00 138.08 2r3p n PRO 100 Ca 0.12 0.81 0.10 0.00 -2.02 0.00 0.00 63.50 62.51 2r3p n PRO 100 Cb 0.43 -2.47 0.25 0.00 -0.02 0.00 0.00 33.50 31.69 2r3p n PRO 100 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2r3p h LEU 101 N 3.34 0.17 -1.60 2.45 5.85 -1.99 0.17 115.31 123.70 2r3p h LEU 101 Ca -0.47 0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.45 2r3p h LEU 101 Cb 1.26 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.44 2r3p h LEU 101 CO 0.68 -0.03 0.34 -0.65 -0.34 0.00 0.00 178.44 178.45 2r3p h PRO 102 N 0.33 0.49 0.02 5.25 0.11 -1.99 0.15 132.00 136.36 2r3p h PRO 102 Ca 0.50 -0.03 -0.25 0.00 0.11 0.00 0.00 66.00 66.33 2r3p h PRO 102 Cb 0.91 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 31.92 2r3p h PRO 102 CO -0.53 0.33 -1.02 1.25 -0.21 0.00 0.00 178.00 177.81 2r3p h LEU 103 N 0.51 0.69 -0.10 2.35 5.85 -1.34 -1.54 115.31 121.74 2r3p h LEU 103 Ca 0.22 -0.57 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2r3p h LEU 103 Cb 0.22 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 2r3p h LEU 103 CO -0.06 1.37 0.06 0.40 -0.34 0.00 0.00 178.44 179.88 2r3p h ILE 104 N 0.29 1.04 -0.62 4.05 2.04 -0.57 -0.46 117.51 123.29 2r3p h ILE 104 Ca -0.11 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.67 2r3p h ILE 104 Cb 1.67 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.65 2r3p h ILE 104 CO 0.19 0.04 0.39 0.50 0.00 0.00 0.00 178.15 179.27 2r3p h LYS 105 N 0.11 0.76 -0.44 2.37 3.64 -0.73 -0.25 116.57 122.02 2r3p h LYS 105 Ca 0.04 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2r3p h LYS 105 Cb 0.01 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 2r3p h LYS 105 CO -0.01 0.50 0.19 1.03 -2.27 0.00 0.00 179.45 178.89 2r3p h SER 106 N 0.78 0.60 -0.41 4.20 0.87 -0.99 -1.17 113.55 117.43 2r3p h SER 106 Ca 0.24 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 2r3p h SER 106 Cb -0.02 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.77 2r3p h SER 106 CO -0.08 0.59 0.16 1.88 -0.53 0.00 0.00 176.83 178.85 2r3p h TYR 107 N 0.57 0.63 -0.62 2.24 0.05 -0.75 -1.22 116.97 117.88 2r3p h TYR 107 Ca 0.15 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.87 2r3p h TYR 107 Cb 0.17 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.69 2r3p h TYR 107 CO -0.00 0.56 0.34 1.25 -1.05 0.00 0.00 178.16 179.26 2r3p h LEU 108 N 0.52 0.77 -0.08 3.88 5.85 -0.90 -0.33 115.31 125.02 2r3p h LEU 108 Ca 0.14 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2r3p h LEU 108 Cb 0.20 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 2r3p h LEU 108 CO -0.01 0.64 0.06 0.15 -0.34 0.00 0.00 178.44 178.93 2r3p h PHE 109 N 0.84 0.11 -0.66 1.25 3.57 -0.98 -0.65 116.94 120.42 2r3p h PHE 109 Ca 0.22 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 2r3p h PHE 109 Cb 0.04 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2r3p h PHE 109 CO -0.01 0.07 0.31 1.96 -2.23 0.00 0.00 178.31 178.41 2r3p h GLN 110 N 0.11 0.95 -0.61 1.11 4.20 -1.06 -1.20 115.11 118.61 2r3p h GLN 110 Ca 0.03 -0.14 -0.05 0.00 0.06 0.00 0.00 58.65 58.55 2r3p h GLN 110 Cb -0.01 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 2r3p h GLN 110 CO -0.01 0.76 0.17 -0.07 -0.67 0.00 0.00 178.83 179.01 2r3p h LEU 111 N 0.91 0.86 -1.08 1.46 3.38 -0.82 -1.38 115.31 118.64 2r3p h LEU 111 Ca 0.23 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 2r3p h LEU 111 Cb 0.13 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2r3p h LEU 111 CO -0.03 0.83 -0.12 -0.07 0.09 0.00 0.00 178.44 179.14 2r3p h LEU 112 N 0.90 0.49 -0.43 1.67 3.38 -0.76 -0.74 115.31 119.82 2r3p h LEU 112 Ca 0.20 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2r3p h LEU 112 Cb 0.29 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2r3p h LEU 112 CO -0.01 0.65 0.07 1.56 0.09 0.00 0.00 178.44 180.80 2r3p h GLN 113 N 0.47 0.72 -0.43 1.13 4.20 -0.57 0.21 115.11 120.85 2r3p h GLN 113 Ca 0.09 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 2r3p h GLN 113 Cb 0.49 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2r3p h GLN 113 CO 0.03 0.75 0.22 0.78 -0.67 0.00 0.00 178.83 179.94 2r3p h GLY 114 N 0.58 0.64 1.01 3.46 0.00 -0.88 -2.07 103.07 105.82 2r3p h GLY 114 Ca 0.13 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 2r3p h GLY 114 CO 0.01 0.29 0.11 1.41 0.00 0.00 0.00 176.54 178.36 2r3p h LEU 115 N 0.55 0.89 -0.83 3.11 3.38 -0.89 -1.52 115.31 120.00 2r3p h LEU 115 Ca 0.15 -0.25 0.07 0.00 0.09 0.00 0.00 57.88 57.94 2r3p h LEU 115 Cb 0.08 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.53 2r3p h LEU 115 CO -0.02 0.91 0.50 0.00 0.09 0.00 0.00 178.44 179.92 2r3p h ALA 116 N 1.01 1.16 0.33 1.53 0.00 -0.38 0.18 119.26 123.09 2r3p h ALA 116 Ca 0.18 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2r3p h ALA 116 Cb 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2r3p h ALA 116 CO 0.01 0.19 -0.16 0.35 0.00 0.00 0.00 179.25 179.64 2r3p h PHE 117 N 0.88 -0.41 -0.67 0.00 3.57 -1.05 -1.50 116.94 117.76 2r3p h PHE 117 Ca 0.38 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.87 2r3p h PHE 117 Cb 0.25 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 2r3p h PHE 117 CO -0.05 -0.10 0.41 0.00 -2.23 0.00 0.00 178.31 176.34 2r3p h HIS 119 N 0.91 0.47 0.00 0.00 3.86 -0.66 -1.02 115.15 118.71 2r3p h HIS 119 Ca 0.24 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.39 2r3p h HIS 119 Cb -0.05 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.29 2r3p h HIS 119 CO -0.02 0.52 -0.04 0.66 0.86 0.00 0.00 177.93 179.91 2r3p h SER 120 N 0.43 0.00 -0.61 2.45 4.64 -0.85 0.47 113.55 120.08 2r3p h SER 120 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2r3p h SER 120 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2r3p h SER 120 CO 0.02 0.04 0.00 1.41 -0.87 0.00 0.00 176.83 177.43 2r3p n HIS 121 N -3.35 1.26 -2.70 4.77 8.25 -0.54 -4.95 115.22 117.97 2r3p n HIS 121 Ca -0.02 -0.60 -0.21 0.00 -0.26 0.00 0.00 57.72 56.64 2r3p n HIS 121 Cb 0.18 -0.19 0.01 0.00 1.12 0.00 0.00 29.99 31.12 2r3p n HIS 121 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2r3p n ARG 122 N 1.04 -3.23 -4.39 -0.41 1.74 0.16 -4.99 116.66 106.57 2r3p n ARG 122 Ca 0.24 0.92 -0.34 0.00 -0.77 0.00 0.00 57.85 57.90 2r3p n ARG 122 Cb 0.80 -5.61 -0.13 0.00 -1.02 0.00 0.00 32.46 26.49 2r3p n ARG 122 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2r3p s VAL 123 N -3.08 3.52 0.17 1.55 1.01 -0.50 -5.00 120.40 118.07 2r3p s VAL 123 Ca 0.15 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.71 2r3p s VAL 123 Cb -0.07 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 2r3p s VAL 123 CO 0.19 0.48 0.13 -0.76 0.00 0.00 0.00 175.10 175.14 2r3p s LEU 124 N 0.64 3.77 -0.15 3.92 1.02 -1.26 -3.47 118.68 123.16 2r3p s LEU 124 Ca -0.04 -0.16 -0.12 0.00 0.02 0.00 0.00 54.13 53.84 2r3p s LEU 124 Cb -0.15 -2.38 -0.08 0.00 0.02 0.00 0.00 46.19 43.61 2r3p s LEU 124 CO 0.02 0.06 0.03 -0.74 0.02 0.00 0.00 176.35 175.75 2r3p h HIS 125 N 2.36 0.00 0.00 0.29 2.76 -1.95 -3.29 115.15 115.32 2r3p h HIS 125 Ca -0.48 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.69 2r3p h HIS 125 Cb 1.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.16 2r3p h HIS 125 CO 0.58 0.42 0.00 -2.13 -1.30 0.00 0.00 177.93 175.50 2r3p n ARG 126 N -4.61 0.00 -2.73 5.26 0.63 -1.26 -4.42 116.66 109.52 2r3p n ARG 126 Ca -0.11 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.76 2r3p n ARG 126 Cb 0.32 -1.02 0.04 0.00 0.45 0.00 0.00 32.46 32.26 2r3p n ARG 126 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2r3p n ASP 127 N 0.00 1.25 -4.77 6.15 2.03 -1.26 -5.01 116.55 114.95 2r3p n ASP 127 Ca 0.00 -2.42 -0.41 0.00 0.52 0.00 0.00 54.79 52.48 2r3p n ASP 127 Cb 0.00 -0.40 -0.02 0.00 -0.72 0.00 0.00 41.12 39.98 2r3p n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2r3p s LEU 128 N -3.41 4.38 -0.10 -2.67 1.43 -1.26 -4.94 118.68 112.10 2r3p s LEU 128 Ca 0.26 2.80 -0.30 0.00 -1.03 0.00 0.00 54.13 55.87 2r3p s LEU 128 Cb 0.40 -3.65 0.11 0.00 0.03 0.00 0.00 46.19 43.09 2r3p s LEU 128 CO -0.00 -0.68 0.93 -1.59 0.23 0.00 0.00 176.35 175.24 2r3p s LYS 129 N -1.56 0.71 0.43 1.70 -2.85 -1.26 -4.79 119.74 112.12 2r3p s LYS 129 Ca 0.53 0.03 0.25 0.00 -1.00 0.00 0.00 55.97 55.77 2r3p s LYS 129 Cb -0.42 0.33 1.26 0.00 -2.06 0.00 0.00 37.83 36.94 2r3p s LYS 129 CO 0.54 -0.25 1.74 -1.35 0.10 0.00 0.00 175.35 176.12 2r3p h PRO 130 N 2.44 0.24 0.00 1.78 0.11 -1.95 0.11 132.00 134.73 2r3p h PRO 130 Ca -0.20 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.89 2r3p h PRO 130 Cb 1.18 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2r3p h PRO 130 CO 0.32 0.16 -0.02 0.37 -0.21 0.00 0.00 178.00 178.62 2r3p h GLN 131 N 0.25 0.00 -0.36 1.05 4.15 -1.96 -2.60 115.11 115.65 2r3p h GLN 131 Ca 0.65 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.07 2r3p h GLN 131 Cb 1.93 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.62 2r3p h GLN 131 CO -0.28 0.02 0.00 0.27 -1.93 0.00 0.00 178.83 176.91 2r3p n ASN 132 N -4.44 4.44 -4.27 -0.69 0.23 0.36 -4.82 115.26 106.07 2r3p n ASN 132 Ca -0.03 -2.97 -0.38 0.00 -0.53 0.00 0.00 54.58 50.67 2r3p n ASN 132 Cb 0.11 -0.58 -0.12 0.00 -2.08 0.00 0.00 39.78 37.10 2r3p n ASN 132 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2r3p s LEU 133 N -2.77 4.30 -0.05 -4.53 1.43 -1.00 -0.24 118.68 115.83 2r3p s LEU 133 Ca 0.46 -1.13 -0.01 0.00 -1.03 0.00 0.00 54.13 52.43 2r3p s LEU 133 Cb 0.36 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 2r3p s LEU 133 CO 0.11 -0.32 0.01 -0.76 0.23 0.00 0.00 176.35 175.63 2r3p s LEU 134 N 1.40 3.61 0.20 1.79 1.43 -0.23 -0.08 118.68 126.81 2r3p s LEU 134 Ca -0.02 0.10 0.10 0.00 -1.03 0.00 0.00 54.13 53.28 2r3p s LEU 134 Cb -0.19 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 2r3p s LEU 134 CO 0.03 0.33 -0.20 0.27 0.23 0.00 0.00 176.35 177.01 2r3p s ILE 135 N -1.00 2.08 0.47 -0.59 -4.36 0.33 -0.17 121.20 117.96 2r3p s ILE 135 Ca 0.17 -2.09 0.02 0.00 -0.26 0.00 0.00 60.65 58.49 2r3p s ILE 135 Cb -0.11 -2.04 -0.02 0.00 1.25 0.00 0.00 42.46 41.54 2r3p s ILE 135 CO 0.07 -0.32 0.06 0.54 0.24 0.00 0.00 174.94 175.53 2r3p s ASN 136 N -2.93 3.57 0.55 4.36 2.20 -1.00 -3.46 114.94 118.23 2r3p s ASN 136 Ca 0.21 -1.68 0.34 0.00 -0.94 0.00 0.00 52.86 50.79 2r3p s ASN 136 Cb -0.05 0.55 1.47 0.00 -2.00 0.00 0.00 41.25 41.22 2r3p s ASN 136 CO 0.09 -0.91 2.01 0.71 -2.94 0.00 0.00 177.10 176.07 2r3p h THR 137 N 1.52 0.00 -0.00 0.54 1.35 -1.94 -3.08 112.91 111.30 2r3p h THR 137 Ca -0.40 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.02 2r3p h THR 137 Cb 1.30 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2r3p h THR 137 CO 0.66 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.31 2r3p n GLU 138 N -3.04 1.15 -0.49 4.72 -0.58 -1.26 -4.59 120.64 116.55 2r3p n GLU 138 Ca 0.00 -0.21 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 2r3p n GLU 138 Cb 0.27 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 2r3p n GLU 138 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2r3p n GLY 139 N 1.03 0.75 3.88 0.62 0.00 -1.16 -4.84 105.19 105.46 2r3p n GLY 139 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 2r3p n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r3p s ALA 140 N -2.27 3.34 -0.00 4.61 0.00 -1.26 -4.90 121.76 121.29 2r3p s ALA 140 Ca 0.00 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 51.74 2r3p s ALA 140 Cb 0.00 -2.71 -0.00 0.00 0.00 0.00 0.00 23.12 20.41 2r3p s ALA 140 CO 0.00 -0.06 -0.03 -1.50 0.00 0.00 0.00 175.76 174.17 2r3p s ILE 141 N -2.43 0.25 0.04 0.00 2.07 -1.26 -2.38 121.20 117.49 2r3p s ILE 141 Ca 0.51 -0.16 0.02 0.00 -1.41 0.00 0.00 60.65 59.61 2r3p s ILE 141 Cb -0.10 -0.22 -0.02 0.00 0.13 0.00 0.00 42.46 42.24 2r3p s ILE 141 CO 0.33 0.05 -0.07 -0.54 -1.91 0.00 0.00 174.94 172.80 2r3p s LYS 142 N -0.12 0.51 -0.13 3.50 1.02 0.76 -4.64 119.74 120.64 2r3p s LYS 142 Ca 0.01 -0.72 -0.24 0.00 0.02 0.00 0.00 55.97 55.04 2r3p s LYS 142 Cb -0.01 -0.27 -0.02 0.00 -0.52 0.00 0.00 37.83 37.00 2r3p s LYS 142 CO -0.00 0.05 0.76 -0.51 -0.92 0.00 0.00 175.35 174.73 2r3p s LEU 143 N -1.50 4.23 0.15 3.17 1.02 0.04 -1.07 118.68 124.73 2r3p s LEU 143 Ca -0.10 1.15 0.04 0.00 0.02 0.00 0.00 54.13 55.24 2r3p s LEU 143 Cb -0.10 -3.14 -0.04 0.00 0.02 0.00 0.00 46.19 42.93 2r3p s LEU 143 CO 0.00 -0.27 0.18 0.00 0.02 0.00 0.00 176.35 176.28 2r3p s ALA 144 N 1.59 3.71 -1.47 4.21 0.00 0.67 -1.36 121.76 129.11 2r3p s ALA 144 Ca 0.37 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.19 2r3p s ALA 144 Cb -0.17 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.44 2r3p s ALA 144 CO 0.15 0.53 0.00 -0.25 0.00 0.00 0.00 175.76 176.19 2r3p n ASP 145 N -0.37 -4.88 -4.70 0.00 8.00 -1.26 -4.89 116.55 108.45 2r3p n ASP 145 Ca -0.08 0.08 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 2r3p n ASP 145 Cb 0.54 -3.95 -0.03 0.00 -0.02 0.00 0.00 41.12 37.66 2r3p n ASP 145 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2r3p s PHE 146 N -2.77 2.78 0.00 1.24 2.19 -1.26 -2.86 117.98 117.30 2r3p s PHE 146 Ca 0.00 0.57 0.00 0.00 0.33 0.00 0.00 56.93 57.83 2r3p s PHE 146 Cb 0.00 -3.87 0.00 0.00 -1.31 0.00 0.00 43.02 37.84 2r3p s PHE 146 CO 0.00 -3.32 0.00 0.41 1.83 0.00 0.00 175.22 174.14 2r3p n GLY 147 N 3.80 2.15 0.24 13.12 0.00 -1.24 -4.90 105.19 118.37 2r3p n GLY 147 Ca 0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.18 2r3p n GLY 147 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2r3p h LEU 148 N 0.00 0.24 -0.20 0.99 3.38 -1.82 -2.62 115.31 115.28 2r3p h LEU 148 Ca 0.00 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2r3p h LEU 148 Cb 0.00 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2r3p h LEU 148 CO 0.00 0.39 0.09 0.00 0.09 0.00 0.00 178.44 179.01 2r3p h ALA 149 N 1.64 0.23 -0.04 1.53 0.00 -1.79 0.44 119.26 121.27 2r3p h ALA 149 Ca 0.05 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2r3p h ALA 149 Cb 0.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2r3p h ALA 149 CO 0.02 -0.33 -0.35 -0.09 0.00 0.00 0.00 179.25 178.49 2r3p h ARG 150 N 0.19 0.07 -0.06 0.00 2.43 -1.81 1.89 114.38 117.09 2r3p h ARG 150 Ca 0.08 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 2r3p h ARG 150 Cb 0.03 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2r3p h ARG 150 CO -0.07 0.42 -0.49 0.00 -1.51 0.00 0.00 179.97 178.32 2r3p h ALA 151 N 1.58 0.14 -0.00 2.80 0.00 -0.95 -3.39 119.26 119.44 2r3p h ALA 151 Ca 0.01 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2r3p h ALA 151 Cb 0.66 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2r3p h ALA 151 CO 0.05 0.32 -0.11 1.19 0.00 0.00 0.00 179.25 180.71 2r3p n PHE 152 N -4.28 0.00 0.00 0.00 3.72 0.15 -4.60 117.46 112.45 2r3p n PHE 152 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2r3p n PHE 152 Cb 0.60 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.14 2r3p n PHE 152 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2r3p n GLY 153 N 0.99 -0.71 3.06 1.37 0.00 0.64 -4.89 105.19 105.65 2r3p n GLY 153 Ca 0.01 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.00 2r3p n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r3p s VAL 154 N -1.68 2.30 0.74 1.61 1.01 -1.26 -4.59 120.40 118.53 2r3p s VAL 154 Ca 0.00 -1.89 -0.11 0.00 0.00 0.00 0.00 61.98 59.98 2r3p s VAL 154 Cb 0.00 -2.49 0.03 0.00 0.00 0.00 0.00 36.38 33.93 2r3p s VAL 154 CO 0.00 -0.26 1.09 -2.16 0.00 0.00 0.00 175.10 173.77 2r3p s PRO 155 N 1.04 2.58 0.13 2.72 0.04 -1.26 -4.98 135.00 135.27 2r3p s PRO 155 Ca -0.01 0.56 -0.06 0.00 0.04 0.00 0.00 61.00 61.53 2r3p s PRO 155 Cb -0.20 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 2r3p s PRO 155 CO -0.06 -1.25 1.31 0.28 0.04 0.00 0.00 177.00 177.32 2r3p h VAL 156 N -0.82 1.37 -4.01 -0.36 2.07 -1.96 -3.43 116.25 109.12 2r3p h VAL 156 Ca -0.46 -2.34 -0.51 0.00 0.82 0.00 0.00 66.70 64.22 2r3p h VAL 156 Cb 1.26 2.33 -0.23 0.00 -1.52 0.00 0.00 31.29 33.12 2r3p h VAL 156 CO 0.62 0.70 -0.81 -0.13 0.02 0.00 0.00 177.57 177.97 2r3p s ARG 157 N -3.37 1.08 1.04 1.57 1.81 -1.26 -1.23 118.95 118.59 2r3p s ARG 157 Ca -0.07 -0.99 -0.16 0.00 -1.72 0.00 0.00 55.73 52.79 2r3p s ARG 157 Cb 0.09 -1.21 0.21 0.00 -0.45 0.00 0.00 34.95 33.59 2r3p s ARG 157 CO 0.87 0.29 1.19 0.95 -0.68 0.00 0.00 175.30 177.92 2r3p s THR 158 N -1.04 1.85 0.53 0.02 -4.23 0.70 -4.77 115.64 108.70 2r3p s THR 158 Ca 0.04 0.00 0.38 0.00 -1.18 0.00 0.00 61.69 60.93 2r3p s THR 158 Cb -0.09 -2.73 0.38 0.00 1.34 0.00 0.00 72.50 71.40 2r3p s THR 158 CO 0.03 0.00 2.17 0.10 -0.54 0.00 0.00 174.62 176.38 2r3p h TYR 159 N -1.96 0.00 -0.56 3.99 -0.00 -1.68 0.70 116.97 117.46 2r3p h TYR 159 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.27 2r3p h TYR 159 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.01 2r3p h TYR 159 CO -1.10 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 177.31 2r3p n THR 160 N -2.90 0.74 -0.94 -0.90 -2.24 -1.26 -4.93 114.28 101.85 2r3p n THR 160 Ca -0.03 -0.86 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 2r3p n THR 160 Cb 0.12 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 2r3p n THR 160 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2r3p n HIS 161 N 1.58 0.00 -1.94 4.78 8.25 0.24 -5.00 115.22 123.14 2r3p n HIS 161 Ca 0.22 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.28 2r3p n HIS 161 Cb 0.62 -0.34 0.01 0.00 1.12 0.00 0.00 29.99 31.39 2r3p n HIS 161 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2r3p s GLU 162 N -0.28 3.82 0.11 -0.41 2.12 -1.26 -4.53 118.70 118.27 2r3p s GLU 162 Ca 0.00 2.27 -0.30 0.00 0.36 0.00 0.00 54.97 57.29 2r3p s GLU 162 Cb 0.00 -2.70 -0.07 0.00 0.26 0.00 0.00 34.13 31.63 2r3p s GLU 162 CO 0.00 -0.65 1.21 0.08 -0.54 0.00 0.00 175.26 175.36 2r3p s VAL 163 N -1.24 3.83 0.03 3.70 1.01 -1.26 -0.21 120.40 126.25 2r3p s VAL 163 Ca 0.59 1.38 -0.30 0.00 0.00 0.00 0.00 61.98 63.65 2r3p s VAL 163 Cb -0.40 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2r3p s VAL 163 CO 0.52 0.14 1.06 -0.69 0.00 0.00 0.00 175.10 176.13 2r3p s VAL 164 N 0.70 4.54 0.36 2.92 1.01 -0.37 -4.89 120.40 124.67 2r3p s VAL 164 Ca 0.57 1.83 -0.28 0.00 0.00 0.00 0.00 61.98 64.11 2r3p s VAL 164 Cb -0.31 -4.17 -0.10 0.00 0.00 0.00 0.00 36.38 31.80 2r3p s VAL 164 CO 0.32 0.15 1.32 0.28 0.00 0.00 0.00 175.10 177.17 2r3p s THR 165 N 0.97 2.62 -1.28 3.92 -1.32 -1.26 -4.92 115.64 114.36 2r3p s THR 165 Ca 0.54 0.60 0.15 0.00 -1.21 0.00 0.00 61.69 61.77 2r3p s THR 165 Cb -0.24 -3.37 -0.03 0.00 -1.51 0.00 0.00 72.50 67.34 2r3p s THR 165 CO 0.29 0.13 0.79 0.18 -2.21 0.00 0.00 174.62 173.80 2r3p n LEU 166 N 0.55 1.42 -0.16 9.08 4.77 -1.26 -4.68 117.00 126.72 2r3p n LEU 166 Ca 0.01 -0.72 0.23 0.00 -0.03 0.00 0.00 56.01 55.50 2r3p n LEU 166 Cb 0.42 0.00 0.64 0.00 -2.33 0.00 0.00 43.42 42.15 2r3p n LEU 166 CO 0.59 0.28 1.23 -0.50 -1.33 0.00 0.00 177.39 177.66 2r3p h TRP 167 N 1.42 0.20 -0.40 -1.77 4.06 -1.81 -1.98 115.95 115.66 2r3p h TRP 167 Ca 0.00 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.96 2r3p h TRP 167 Cb 0.49 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 28.59 2r3p h TRP 167 CO 0.00 0.05 0.00 0.66 -3.56 0.00 0.00 178.44 175.59 2r3p n TYR 168 N -4.38 0.53 -2.50 0.49 4.01 -1.26 -4.53 117.16 109.52 2r3p n TYR 168 Ca 0.17 -0.44 -0.42 0.00 -0.16 0.00 0.00 57.90 57.05 2r3p n TYR 168 Cb 0.79 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.77 2r3p n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2r3p s ARG 169 N -1.03 4.48 0.55 -0.72 3.52 -0.75 -3.83 118.95 121.18 2r3p s ARG 169 Ca 0.29 1.69 -0.20 0.00 -0.13 0.00 0.00 55.73 57.37 2r3p s ARG 169 Cb 0.15 -3.37 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 2r3p s ARG 169 CO 0.20 -0.18 1.20 0.00 -0.81 0.00 0.00 175.30 175.71 2r3p s ALA 170 N 0.93 2.69 0.38 6.12 0.00 -1.26 -4.90 121.76 125.71 2r3p s ALA 170 Ca 0.56 0.98 0.05 0.00 0.00 0.00 0.00 51.96 53.56 2r3p s ALA 170 Cb -0.28 -3.43 0.75 0.00 0.00 0.00 0.00 23.12 20.17 2r3p s ALA 170 CO 0.29 -0.99 2.01 -1.00 0.00 0.00 0.00 175.76 176.07 2r3p h PRO 171 N 1.25 0.61 0.00 0.00 0.13 -1.95 -1.68 132.00 130.36 2r3p h PRO 171 Ca -0.50 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 64.54 2r3p h PRO 171 Cb 1.28 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 2r3p h PRO 171 CO 0.57 0.45 -0.16 1.05 -0.23 0.00 0.00 178.00 179.67 2r3p h GLU 172 N 0.62 0.00 -0.07 0.86 9.09 -1.92 0.17 114.58 123.34 2r3p h GLU 172 Ca 0.16 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.50 2r3p h GLU 172 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 2r3p h GLU 172 CO -0.03 0.16 -0.25 0.82 0.05 0.00 0.00 179.01 179.77 2r3p h ILE 173 N 0.00 1.43 -0.09 -1.06 2.04 -1.69 -3.01 117.51 115.14 2r3p h ILE 173 Ca -0.00 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 2r3p h ILE 173 Cb 0.32 2.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 2r3p h ILE 173 CO 0.02 0.47 0.00 -0.07 0.00 0.00 0.00 178.15 178.57 2r3p h LEU 174 N -0.22 0.10 -0.58 1.44 3.38 -1.16 -1.53 115.31 116.74 2r3p h LEU 174 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2r3p h LEU 174 Cb 0.88 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2r3p h LEU 174 CO 0.05 0.13 0.00 0.18 0.09 0.00 0.00 178.44 178.89 2r3p n LEU 175 N -4.46 0.89 -0.26 1.67 4.77 0.54 -4.86 117.00 115.29 2r3p n LEU 175 Ca -0.02 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 2r3p n LEU 175 Cb 0.13 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2r3p n LEU 175 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 2r3p n GLY 176 N 1.04 -0.76 0.00 -0.72 0.00 -0.58 -0.51 105.19 103.66 2r3p n GLY 176 Ca 0.18 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2r3p n GLY 176 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2r3p n LYS 178 N 1.73 0.02 -2.13 1.61 5.02 -1.26 -4.66 118.16 118.49 2r3p n LYS 178 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 2r3p n LYS 178 Cb 0.00 -0.50 0.02 0.00 -0.02 0.00 0.00 35.03 34.53 2r3p n LYS 178 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2r3p n TYR 179 N -0.92 3.17 -0.74 2.13 4.01 -1.26 -5.04 117.16 118.50 2r3p n TYR 179 Ca 0.00 -2.74 -0.30 0.00 -0.16 0.00 0.00 57.90 54.70 2r3p n TYR 179 Cb 0.00 -0.59 0.18 0.00 -0.31 0.00 0.00 39.34 38.63 2r3p n TYR 179 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 2r3p s TYR 180 N -3.74 1.68 0.00 -0.72 -0.85 -1.26 -5.03 117.35 107.43 2r3p s TYR 180 Ca 0.51 1.56 0.00 0.00 -0.52 0.00 0.00 57.07 58.62 2r3p s TYR 180 Cb 0.42 -3.23 0.00 0.00 0.38 0.00 0.00 41.96 39.53 2r3p s TYR 180 CO -0.21 -3.00 0.00 0.45 -1.52 0.00 0.00 175.55 171.28 2r3p n SER 181 N -4.34 0.51 0.14 -0.18 2.88 -1.26 -5.01 113.62 106.35 2r3p n SER 181 Ca 0.09 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.82 2r3p n SER 181 Cb 0.53 0.00 0.74 0.00 -0.75 0.00 0.00 64.21 64.73 2r3p n SER 181 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2r3p h THR 182 N 0.00 0.27 0.00 2.46 1.35 -1.96 -1.53 112.91 113.51 2r3p h THR 182 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2r3p h THR 182 Cb 0.00 0.61 -0.00 0.00 -1.73 0.00 0.00 68.15 67.03 2r3p h THR 182 CO 0.00 0.00 -0.02 0.00 -0.25 0.00 0.00 175.52 175.25 2r3p h ALA 183 N 1.40 1.45 -0.49 6.62 0.00 -1.94 -1.97 119.26 124.32 2r3p h ALA 183 Ca 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2r3p h ALA 183 Cb 1.08 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2r3p h ALA 183 CO -0.00 0.02 0.22 -0.39 0.00 0.00 0.00 179.25 179.10 2r3p h VAL 184 N 0.00 1.17 -0.10 0.00 -1.51 -1.67 -1.73 116.25 112.41 2r3p h VAL 184 Ca -0.00 -0.49 -0.15 0.00 -1.23 0.00 0.00 66.70 64.83 2r3p h VAL 184 Cb 0.04 0.56 -0.01 0.00 -2.13 0.00 0.00 31.29 29.75 2r3p h VAL 184 CO 0.00 0.20 -0.60 0.44 -1.23 0.00 0.00 177.57 176.38 2r3p h ASP 185 N 0.68 0.40 -0.44 4.19 3.32 -1.57 -2.27 116.42 120.73 2r3p h ASP 185 Ca 0.17 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 2r3p h ASP 185 Cb 0.09 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2r3p h ASP 185 CO -0.02 0.91 0.12 0.40 -1.72 0.00 0.00 179.24 178.92 2r3p h ILE 186 N 0.26 1.23 0.12 0.35 1.08 -1.44 -0.76 117.51 118.35 2r3p h ILE 186 Ca -0.01 -0.78 0.01 0.00 -0.39 0.00 0.00 64.86 63.70 2r3p h ILE 186 Cb 1.12 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 35.75 2r3p h ILE 186 CO 0.10 0.28 -0.22 -0.25 -0.69 0.00 0.00 178.15 177.37 2r3p h TRP 187 N 0.57 -0.58 -0.52 1.37 2.91 -1.24 -0.28 115.95 118.18 2r3p h TRP 187 Ca 0.14 0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.25 2r3p h TRP 187 Cb 0.30 0.24 -0.06 0.00 -0.51 0.00 0.00 29.16 29.12 2r3p h TRP 187 CO 0.02 -0.31 0.16 0.77 -1.03 0.00 0.00 178.44 178.04 2r3p h SER 188 N -0.41 0.13 0.18 2.65 0.02 -1.19 -1.07 113.55 113.86 2r3p h SER 188 Ca 0.03 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.98 2r3p h SER 188 Cb 0.43 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2r3p h SER 188 CO -0.12 0.10 -0.26 0.25 -1.14 0.00 0.00 176.83 175.65 2r3p h LEU 189 N 0.32 0.14 -0.50 5.07 5.85 -0.87 -1.68 115.31 123.64 2r3p h LEU 189 Ca 0.26 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 2r3p h LEU 189 Cb 0.31 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2r3p h LEU 189 CO -0.28 0.41 0.10 1.23 -0.34 0.00 0.00 178.44 179.55 2r3p h GLY 190 N 0.92 0.88 1.01 3.75 0.00 0.16 0.33 103.07 110.13 2r3p h GLY 190 Ca 0.02 -0.58 -0.00 0.00 0.00 0.00 0.00 47.33 46.77 2r3p h GLY 190 CO 0.04 0.53 0.50 0.00 0.00 0.00 0.00 176.54 177.61 2r3p h ILE 192 N 1.14 1.27 -0.02 0.00 2.04 -0.98 -2.00 117.51 118.96 2r3p h ILE 192 Ca 0.30 -1.39 0.02 0.00 1.00 0.00 0.00 64.86 64.79 2r3p h ILE 192 Cb -0.04 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2r3p h ILE 192 CO -0.06 0.48 -0.11 0.15 0.00 0.00 0.00 178.15 178.61 2r3p h PHE 193 N 0.82 -0.27 -0.82 1.37 3.57 -0.60 0.39 116.94 121.40 2r3p h PHE 193 Ca 0.10 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.66 2r3p h PHE 193 Cb 0.81 0.13 -0.05 0.00 2.79 0.00 0.00 35.95 39.62 2r3p h PHE 193 CO 0.06 -0.16 0.51 0.00 -2.23 0.00 0.00 178.31 176.48 2r3p h ALA 194 N 0.82 1.10 -0.58 2.41 0.00 -1.17 -2.09 119.26 119.75 2r3p h ALA 194 Ca 0.05 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2r3p h ALA 194 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2r3p h ALA 194 CO -0.13 0.28 0.04 1.49 0.00 0.00 0.00 179.25 180.94 2r3p h GLU 195 N 0.96 0.96 -0.65 0.00 4.81 -0.79 -0.60 114.58 119.27 2r3p h GLU 195 Ca 0.34 -0.27 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 2r3p h GLU 195 Cb 0.10 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2r3p h GLU 195 CO -0.15 0.93 0.15 0.52 -0.73 0.00 0.00 179.01 179.73 2r3p h MET 196 N 0.90 1.04 -0.05 1.92 2.86 -0.33 0.10 114.93 121.36 2r3p h MET 196 Ca 0.17 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 2r3p h MET 196 Cb 0.47 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 2r3p h MET 196 CO 0.02 0.93 -0.06 0.28 1.06 0.00 0.00 176.91 179.13 2r3p h VAL 197 N 0.99 1.39 0.00 -2.22 2.07 -1.07 -3.35 116.25 114.06 2r3p h VAL 197 Ca 0.21 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.46 2r3p h VAL 197 Cb 0.36 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 2r3p h VAL 197 CO 0.00 0.35 -0.60 0.71 0.02 0.00 0.00 177.57 178.05 2r3p h THR 198 N -0.33 0.00 -1.00 2.57 1.35 -1.13 -3.46 112.91 110.92 2r3p h THR 198 Ca 0.01 -0.93 -0.20 0.00 -0.55 0.00 0.00 66.41 64.74 2r3p h THR 198 Cb 0.59 1.62 -0.04 0.00 -1.73 0.00 0.00 68.15 68.59 2r3p h THR 198 CO 0.02 0.00 -0.22 0.54 -0.25 0.00 0.00 175.52 175.60 2r3p n ARG 199 N -2.74 -0.75 -3.74 4.72 1.74 0.02 -5.01 116.66 110.89 2r3p n ARG 199 Ca 0.02 0.65 -0.13 0.00 -0.77 0.00 0.00 57.85 57.62 2r3p n ARG 199 Cb 0.53 -4.64 -0.10 0.00 -1.02 0.00 0.00 32.46 27.22 2r3p n ARG 199 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2r3p s ARG 200 N -3.76 0.43 0.34 5.56 3.52 -1.23 -5.07 118.95 118.75 2r3p s ARG 200 Ca 0.00 0.52 -0.28 0.00 -0.13 0.00 0.00 55.73 55.84 2r3p s ARG 200 Cb 0.00 0.20 -0.12 0.00 -1.56 0.00 0.00 34.95 33.47 2r3p s ARG 200 CO 0.00 -0.06 1.40 0.00 -0.81 0.00 0.00 175.30 175.83 2r3p n ALA 201 N 2.93 1.80 0.01 6.12 0.00 -1.26 -4.23 120.51 125.88 2r3p n ALA 201 Ca -0.13 0.36 -0.13 0.00 0.00 0.00 0.00 53.44 53.54 2r3p n ALA 201 Cb 0.57 -2.34 -0.10 0.00 0.00 0.00 0.00 19.45 17.59 2r3p n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2r3p h LEU 202 N 3.02 -0.06 -6.46 0.00 5.85 -1.92 -3.40 115.31 112.34 2r3p h LEU 202 Ca -0.48 -0.48 -0.59 0.00 0.84 0.00 0.00 57.88 57.17 2r3p h LEU 202 Cb 1.26 0.02 -0.40 0.00 0.37 0.00 0.00 40.66 41.91 2r3p h LEU 202 CO 0.65 0.47 -0.82 0.49 -0.34 0.00 0.00 178.44 178.89 2r3p n PHE 203 N -4.87 1.16 -1.71 1.25 3.72 -1.26 -5.02 117.46 110.73 2r3p n PHE 203 Ca -0.09 -3.79 -0.41 0.00 -0.05 0.00 0.00 57.45 53.11 2r3p n PHE 203 Cb 0.27 -0.26 -0.01 0.00 -0.94 0.00 0.00 39.48 38.55 2r3p n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2r3p n PRO 204 N 1.94 3.12 -2.41 -1.08 -0.04 -1.26 -4.34 135.00 130.93 2r3p n PRO 204 Ca 0.25 -2.63 -0.36 0.00 -0.04 0.00 0.00 63.50 60.73 2r3p n PRO 204 Cb 0.44 -3.15 -0.02 0.00 -0.04 0.00 0.00 33.50 30.73 2r3p n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2r3p s GLY 205 N 2.74 2.67 -0.10 0.55 0.00 -1.26 -4.97 107.32 106.95 2r3p s GLY 205 Ca 0.51 0.77 0.13 0.00 0.00 0.00 0.00 44.72 46.13 2r3p s GLY 205 CO -0.08 1.16 1.16 2.09 0.00 0.00 0.00 173.10 177.44 2r3p n ASP 206 N -0.66 2.56 -3.56 1.64 5.75 -1.26 -4.60 116.55 116.42 2r3p n ASP 206 Ca 0.08 -2.72 -0.07 0.00 -0.01 0.00 0.00 54.79 52.07 2r3p n ASP 206 Cb 0.50 -0.32 -0.02 0.00 -1.03 0.00 0.00 41.12 40.25 2r3p n ASP 206 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2r3p s SER 207 N -2.10 -0.32 0.24 -1.12 1.04 -1.26 -4.99 113.70 105.19 2r3p s SER 207 Ca 0.25 -0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.52 2r3p s SER 207 Cb 0.21 0.41 0.26 0.00 0.10 0.00 0.00 66.02 67.00 2r3p s SER 207 CO 0.04 -0.69 1.85 -0.33 0.98 0.00 0.00 173.24 175.09 2r3p h GLU 208 N 2.00 1.17 -0.18 4.02 5.08 -1.99 0.67 114.58 125.36 2r3p h GLU 208 Ca -0.23 -0.15 -0.20 0.00 -1.00 0.00 0.00 59.36 57.78 2r3p h GLU 208 Cb 1.24 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2r3p h GLU 208 CO 0.30 0.88 -0.67 0.97 -1.00 0.00 0.00 179.01 179.49 2r3p h ILE 209 N 1.17 1.30 -0.53 3.13 6.09 -1.97 -1.57 117.51 125.13 2r3p h ILE 209 Ca 0.29 -1.91 -0.08 0.00 -1.37 0.00 0.00 64.86 61.79 2r3p h ILE 209 Cb 0.08 1.88 -0.02 0.00 0.47 0.00 0.00 36.82 39.22 2r3p h ILE 209 CO -0.04 0.60 0.02 -0.78 -3.07 0.00 0.00 178.15 174.88 2r3p h ASP 210 N 0.51 0.85 0.04 2.19 3.58 -1.89 0.75 116.42 122.46 2r3p h ASP 210 Ca -0.02 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.22 2r3p h ASP 210 Cb 1.27 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 42.10 2r3p h ASP 210 CO 0.13 0.90 -0.02 -0.61 -2.88 0.00 0.00 179.24 176.77 2r3p h GLN 211 N 0.82 -0.06 -0.15 0.28 5.75 -0.71 -0.34 115.11 120.71 2r3p h GLN 211 Ca 0.16 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.68 2r3p h GLN 211 Cb 0.46 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.01 2r3p h GLN 211 CO 0.02 0.08 0.05 -0.07 -2.65 0.00 0.00 178.83 176.27 2r3p h LEU 212 N -0.18 0.06 -1.67 -2.39 3.38 -1.06 -1.95 115.31 111.50 2r3p h LEU 212 Ca -0.01 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2r3p h LEU 212 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2r3p h LEU 212 CO 0.01 0.06 -0.18 -0.26 0.09 0.00 0.00 178.44 178.16 2r3p h PHE 213 N 0.13 0.00 -0.39 1.13 -1.00 -0.75 0.21 116.94 116.26 2r3p h PHE 213 Ca 0.06 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.71 2r3p h PHE 213 Cb 0.03 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.59 2r3p h PHE 213 CO -0.11 0.18 -0.27 0.00 -1.61 0.00 0.00 178.31 176.50 2r3p h ARG 214 N 0.00 0.87 -0.21 1.51 3.08 -0.66 -0.50 114.38 118.48 2r3p h ARG 214 Ca -0.00 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.62 2r3p h ARG 214 Cb 0.32 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 2r3p h ARG 214 CO 0.02 1.07 0.09 0.82 -1.07 0.00 0.00 179.97 180.90 2r3p h ILE 215 N 0.69 1.15 -0.77 2.04 2.04 -0.58 -2.96 117.51 119.12 2r3p h ILE 215 Ca 0.08 -0.46 0.01 0.00 1.00 0.00 0.00 64.86 65.49 2r3p h ILE 215 Cb 0.85 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 2r3p h ILE 215 CO 0.07 0.15 0.51 -0.26 0.00 0.00 0.00 178.15 178.62 2r3p h PHE 216 N 0.19 0.96 -0.13 1.37 0.04 -0.80 0.88 116.94 119.45 2r3p h PHE 216 Ca 0.07 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.86 2r3p h PHE 216 Cb 0.15 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 2r3p h PHE 216 CO -0.02 0.59 0.05 0.00 -0.60 0.00 0.00 178.31 178.33 2r3p h ARG 217 N 1.02 0.17 0.00 1.51 -0.00 -0.98 0.47 114.38 116.57 2r3p h ARG 217 Ca 0.29 -0.01 -0.26 0.00 -0.50 0.00 0.00 59.98 59.50 2r3p h ARG 217 Cb -0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 29.97 29.80 2r3p h ARG 217 CO -0.07 0.15 -1.42 2.41 0.00 0.00 0.00 179.97 181.04 2r3p n THR 218 N -4.48 1.53 1.13 2.04 -1.04 -1.01 -4.53 114.28 107.92 2r3p n THR 218 Ca -0.01 -0.07 0.12 0.00 -2.04 0.00 0.00 64.05 62.05 2r3p n THR 218 Cb 0.11 -2.03 0.19 0.00 -1.82 0.00 0.00 70.33 66.78 2r3p n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2r3p n LEU 219 N -4.41 1.67 0.00 -4.42 4.77 0.27 -0.52 117.00 114.37 2r3p n LEU 219 Ca -0.34 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 2r3p n LEU 219 Cb 0.69 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 2r3p n LEU 219 CO 0.16 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2r3p n GLY 220 N 1.37 -0.15 3.69 -0.72 0.00 0.16 -4.46 105.19 105.07 2r3p n GLY 220 Ca 0.11 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 2r3p n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r3p s THR 221 N -2.61 3.22 0.46 2.61 2.01 -0.65 -4.56 115.64 116.11 2r3p s THR 221 Ca 0.00 0.62 -0.23 0.00 0.31 0.00 0.00 61.69 62.40 2r3p s THR 221 Cb 0.00 -3.40 -0.07 0.00 0.01 0.00 0.00 72.50 69.04 2r3p s THR 221 CO 0.00 -0.01 1.18 -2.16 -0.69 0.00 0.00 174.62 172.94 2r3p s PRO 222 N 2.70 3.73 0.16 4.92 0.04 -1.26 -4.88 135.00 140.42 2r3p s PRO 222 Ca 0.72 1.81 0.03 0.00 0.04 0.00 0.00 61.00 63.60 2r3p s PRO 222 Cb -0.38 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.74 2r3p s PRO 222 CO 0.31 -0.58 0.12 -0.40 0.04 0.00 0.00 177.00 176.48 2r3p n ASP 223 N -0.49 0.00 0.27 6.66 5.68 -1.26 -4.97 116.55 122.43 2r3p n ASP 223 Ca 0.07 -2.02 0.18 0.00 -0.50 0.00 0.00 54.79 52.52 2r3p n ASP 223 Cb 0.48 0.71 0.79 0.00 -1.14 0.00 0.00 41.12 41.96 2r3p n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2r3p h GLU 224 N 0.00 0.00 0.20 0.11 4.39 -1.97 -1.48 114.58 115.83 2r3p h GLU 224 Ca -0.12 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 2r3p h GLU 224 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2r3p h GLU 224 CO 0.18 0.00 -0.09 0.28 -1.16 0.00 0.00 179.01 178.21 2r3p h VAL 225 N 0.00 0.86 0.00 3.13 2.07 -1.99 -3.12 116.25 117.20 2r3p h VAL 225 Ca 0.00 -0.93 -0.06 0.00 0.82 0.00 0.00 66.70 66.54 2r3p h VAL 225 Cb 0.33 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2r3p h VAL 225 CO 0.00 0.19 -0.54 -0.37 0.02 0.00 0.00 177.57 176.87 2r3p h VAL 226 N -0.77 0.34 -2.08 2.57 -1.51 -1.95 -3.41 116.25 109.43 2r3p h VAL 226 Ca -0.03 -1.52 -0.48 0.00 -1.23 0.00 0.00 66.70 63.44 2r3p h VAL 226 Cb 0.51 2.04 -0.33 0.00 -2.13 0.00 0.00 31.29 31.38 2r3p h VAL 226 CO 0.04 0.19 -0.84 0.86 -1.23 0.00 0.00 177.57 176.59 2r3p s TRP 227 N -3.12 0.38 0.18 5.19 -0.11 -0.56 -4.29 118.94 116.61 2r3p s TRP 227 Ca 0.03 -1.76 -0.33 0.00 1.22 0.00 0.00 56.10 55.26 2r3p s TRP 227 Cb 0.07 -0.62 -0.14 0.00 -1.50 0.00 0.00 33.47 31.28 2r3p s TRP 227 CO 0.74 -0.93 1.56 -2.30 -4.62 0.00 0.00 176.95 171.40 2r3p n PRO 228 N 3.13 2.20 0.00 5.86 -0.02 -1.18 -1.40 135.00 143.60 2r3p n PRO 228 Ca 0.24 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 2r3p n PRO 228 Cb 0.48 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2r3p n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r3p n GLY 229 N 3.19 1.49 0.24 -1.23 0.00 -1.26 -4.96 105.19 102.65 2r3p n GLY 229 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2r3p n GLY 229 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2r3p h VAL 230 N 0.00 0.79 0.00 1.61 3.04 -1.54 -1.73 116.25 118.43 2r3p h VAL 230 Ca 0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 2r3p h VAL 230 Cb 0.00 0.31 0.00 0.00 -2.01 0.00 0.00 31.29 29.59 2r3p h VAL 230 CO 0.00 0.08 0.00 0.35 -1.01 0.00 0.00 177.57 176.99 2r3p n THR 231 N -4.97 1.54 1.01 3.17 -2.24 -1.26 -1.68 114.28 109.85 2r3p n THR 231 Ca 0.09 0.38 0.11 0.00 -2.27 0.00 0.00 64.05 62.36 2r3p n THR 231 Cb 0.27 -1.30 0.00 0.00 -2.10 0.00 0.00 70.33 67.20 2r3p n THR 231 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2r3p n SER 232 N -1.47 1.94 -4.76 3.42 7.64 -0.65 -4.88 113.62 114.86 2r3p n SER 232 Ca 0.01 -1.47 -0.39 0.00 1.01 0.00 0.00 58.87 58.04 2r3p n SER 232 Cb 0.06 0.50 0.02 0.00 -1.01 0.00 0.00 64.21 63.78 2r3p n SER 232 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2r3p s MET 233 N -2.51 3.53 0.26 1.43 -1.94 -0.68 -4.91 119.30 114.48 2r3p s MET 233 Ca 0.18 2.29 -0.07 0.00 -1.71 0.00 0.00 55.69 56.38 2r3p s MET 233 Cb 0.18 -2.51 0.46 0.00 2.01 0.00 0.00 34.83 34.97 2r3p s MET 233 CO 0.59 -0.90 1.60 -1.35 -0.01 0.00 0.00 175.02 174.95 2r3p h PRO 234 N 2.05 0.04 -0.68 2.03 0.11 -1.82 -2.00 132.00 131.72 2r3p h PRO 234 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2r3p h PRO 234 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2r3p h PRO 234 CO 0.60 0.03 0.00 -0.25 -0.21 0.00 0.00 178.00 178.16 2r3p n ASP 235 N -5.46 4.44 -4.74 -2.05 8.00 0.33 -4.95 116.55 112.12 2r3p n ASP 235 Ca 0.15 -2.26 -0.41 0.00 0.71 0.00 0.00 54.79 52.98 2r3p n ASP 235 Cb 0.51 -0.54 -0.05 0.00 -0.02 0.00 0.00 41.12 41.02 2r3p n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2r3p s TYR 236 N -1.50 3.74 -0.09 1.24 5.04 -0.75 -4.94 117.35 120.09 2r3p s TYR 236 Ca 0.50 1.75 0.02 0.00 -2.44 0.00 0.00 57.07 56.90 2r3p s TYR 236 Cb 0.30 -3.16 0.02 0.00 0.35 0.00 0.00 41.96 39.47 2r3p s TYR 236 CO 0.28 -0.15 -0.13 0.15 -1.34 0.00 0.00 175.55 174.36 2r3p s LYS 237 N -0.78 1.89 0.65 4.97 -0.14 -1.26 -4.92 119.74 120.14 2r3p s LYS 237 Ca 0.45 -0.45 0.37 0.00 -1.36 0.00 0.00 55.97 54.98 2r3p s LYS 237 Cb -0.28 -1.62 2.02 0.00 -1.68 0.00 0.00 37.83 36.27 2r3p s LYS 237 CO 0.35 -0.05 2.19 -1.35 -0.76 0.00 0.00 175.35 175.73 2r3p h PRO 238 N 7.31 0.00 -0.00 -1.68 0.11 -1.96 -0.27 132.00 135.51 2r3p h PRO 238 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2r3p h PRO 238 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2r3p h PRO 238 CO 0.47 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.13 2r3p n SER 239 N -3.21 0.12 -4.72 -2.05 3.41 -1.26 -4.87 113.62 101.03 2r3p n SER 239 Ca -0.02 -1.04 -0.42 0.00 -0.26 0.00 0.00 58.87 57.13 2r3p n SER 239 Cb 0.21 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.15 2r3p n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2r3p n PHE 240 N -0.91 2.54 -1.70 7.33 3.72 -0.11 -4.93 117.46 123.40 2r3p n PHE 240 Ca 0.24 0.47 -0.35 0.00 -0.05 0.00 0.00 57.45 57.76 2r3p n PHE 240 Cb 0.13 -2.48 0.06 0.00 -0.94 0.00 0.00 39.48 36.26 2r3p n PHE 240 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2r3p s PRO 241 N -1.61 2.56 -0.44 -1.08 0.02 -1.26 -4.97 135.00 128.23 2r3p s PRO 241 Ca 0.57 1.72 -0.09 0.00 0.02 0.00 0.00 61.00 63.22 2r3p s PRO 241 Cb -0.54 -1.89 0.09 0.00 0.02 0.00 0.00 34.50 32.18 2r3p s PRO 241 CO 0.60 -1.50 0.29 0.15 -0.33 0.00 0.00 177.00 176.20 2r3p s LYS 242 N -3.74 2.58 0.06 5.54 1.02 -1.26 -4.81 119.74 119.14 2r3p s LYS 242 Ca 0.74 -1.55 0.00 0.00 0.02 0.00 0.00 55.97 55.19 2r3p s LYS 242 Cb -0.28 -3.84 -0.04 0.00 -0.52 0.00 0.00 37.83 33.15 2r3p s LYS 242 CO 0.40 -1.03 0.18 -1.58 -0.92 0.00 0.00 175.35 172.41 2r3p s TRP 243 N 1.41 3.46 0.42 3.18 0.51 -1.26 -4.94 118.94 121.72 2r3p s TRP 243 Ca 0.04 0.22 -0.11 0.00 -2.12 0.00 0.00 56.10 54.13 2r3p s TRP 243 Cb -0.24 -1.74 -0.06 0.00 -0.81 0.00 0.00 33.47 30.62 2r3p s TRP 243 CO 0.01 0.58 0.80 0.00 -0.51 0.00 0.00 176.95 177.83 2r3p s ALA 244 N -1.48 3.31 0.29 0.98 0.00 -1.26 -1.64 121.76 121.97 2r3p s ALA 244 Ca 0.34 -0.16 -0.28 0.00 0.00 0.00 0.00 51.96 51.85 2r3p s ALA 244 Cb -0.13 -2.76 -0.09 0.00 0.00 0.00 0.00 23.12 20.14 2r3p s ALA 244 CO 0.26 -0.06 1.04 0.50 0.00 0.00 0.00 175.76 177.50 2r3p s ARG 245 N -3.92 4.61 0.19 0.00 3.52 -1.26 -4.01 118.95 118.08 2r3p s ARG 245 Ca 0.52 1.64 -0.04 0.00 -0.13 0.00 0.00 55.73 57.72 2r3p s ARG 245 Cb -0.10 -3.07 -0.05 0.00 -1.56 0.00 0.00 34.95 30.16 2r3p s ARG 245 CO 0.32 0.24 0.43 -0.65 -0.81 0.00 0.00 175.30 174.83 2r3p s GLN 246 N -1.61 3.61 0.22 5.12 -0.21 0.33 -4.90 119.66 122.22 2r3p s GLN 246 Ca 0.46 -0.11 -0.30 0.00 0.02 0.00 0.00 55.36 55.44 2r3p s GLN 246 Cb -0.28 -2.79 -0.09 0.00 1.00 0.00 0.00 33.01 30.86 2r3p s GLN 246 CO 0.35 0.39 1.15 -0.51 -2.12 0.00 0.00 175.29 174.55 2r3p s ASP 247 N -2.77 7.17 0.62 5.90 1.01 -1.26 -4.88 116.67 122.47 2r3p s ASP 247 Ca 0.41 2.23 0.39 0.00 0.71 0.00 0.00 52.55 56.30 2r3p s ASP 247 Cb -0.11 -2.61 2.08 0.00 1.01 0.00 0.00 42.92 43.28 2r3p s ASP 247 CO 0.27 -0.27 2.27 -0.26 0.21 0.00 0.00 175.17 177.38 2r3p h PHE 248 N 4.67 0.00 0.00 4.23 -1.00 -1.97 0.46 116.94 123.33 2r3p h PHE 248 Ca -0.45 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.30 2r3p h PHE 248 Cb 1.21 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.77 2r3p h PHE 248 CO 0.61 0.01 -0.12 0.66 -1.61 0.00 0.00 178.31 177.86 2r3p h SER 249 N 0.00 0.00 0.99 2.17 4.64 -1.95 -0.96 113.55 118.45 2r3p h SER 249 Ca -0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2r3p h SER 249 Cb 0.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 2r3p h SER 249 CO 0.00 0.12 -1.07 0.50 -0.87 0.00 0.00 176.83 175.51 2r3p h LYS 250 N 0.00 0.00 0.14 4.77 3.64 -1.29 -3.32 116.57 120.51 2r3p h LYS 250 Ca -0.00 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 2r3p h LYS 250 Cb 0.24 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2r3p h LYS 250 CO 0.02 0.25 -0.97 0.28 -2.27 0.00 0.00 179.45 176.76 2r3p h VAL 251 N 0.00 1.40 -0.98 2.00 2.07 -0.92 -3.41 116.25 116.42 2r3p h VAL 251 Ca -0.09 -2.52 -0.45 0.00 0.82 0.00 0.00 66.70 64.46 2r3p h VAL 251 Cb 1.38 3.09 -0.41 0.00 -1.52 0.00 0.00 31.29 33.83 2r3p h VAL 251 CO 0.04 0.72 -0.94 1.33 0.02 0.00 0.00 177.57 178.73 2r3p n VAL 252 N -4.07 1.86 -2.08 2.57 0.24 -0.57 -4.99 118.33 111.30 2r3p n VAL 252 Ca -0.16 -3.90 -0.39 0.00 -2.04 0.00 0.00 64.34 57.85 2r3p n VAL 252 Cb 0.85 -0.26 -0.00 0.00 -1.47 0.00 0.00 33.84 32.96 2r3p n VAL 252 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2r3p s PRO 253 N -3.51 3.80 -0.64 7.34 0.04 -1.25 -0.38 135.00 140.40 2r3p s PRO 253 Ca 0.40 2.05 0.02 0.00 0.04 0.00 0.00 61.00 63.50 2r3p s PRO 253 Cb 0.40 -2.59 0.39 0.00 0.04 0.00 0.00 34.50 32.73 2r3p s PRO 253 CO -0.05 -0.59 1.55 -0.35 0.04 0.00 0.00 177.00 177.60 2r3p n PRO 254 N -0.19 3.12 -1.83 0.56 -0.04 -1.26 -4.76 135.00 130.59 2r3p n PRO 254 Ca 0.06 -4.04 -0.41 0.00 -0.04 0.00 0.00 63.50 59.07 2r3p n PRO 254 Cb 0.45 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 2r3p n PRO 254 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2r3p s LEU 255 N -3.80 4.28 0.91 1.53 2.96 0.49 -4.97 118.68 120.07 2r3p s LEU 255 Ca 0.50 2.99 -0.12 0.00 -0.22 0.00 0.00 54.13 57.28 2r3p s LEU 255 Cb 0.42 -3.73 0.13 0.00 0.50 0.00 0.00 46.19 43.51 2r3p s LEU 255 CO -0.30 -0.91 1.10 1.51 -1.32 0.00 0.00 176.35 176.43 2r3p s ASP 256 N -0.26 3.46 0.35 3.68 1.47 -1.26 -4.70 116.67 119.42 2r3p s ASP 256 Ca 0.54 1.24 0.09 0.00 1.18 0.00 0.00 52.55 55.60 2r3p s ASP 256 Cb -0.45 -1.90 0.81 0.00 -0.34 0.00 0.00 42.92 41.04 2r3p s ASP 256 CO 0.61 -2.61 1.88 -0.08 0.68 0.00 0.00 175.17 175.64 2r3p h GLU 257 N -1.53 0.68 -0.22 2.11 4.57 -1.98 0.21 114.58 118.41 2r3p h GLU 257 Ca -0.51 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 57.61 2r3p h GLU 257 Cb 1.30 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 2r3p h GLU 257 CO 0.58 0.45 0.04 -0.44 -1.18 0.00 0.00 179.01 178.46 2r3p h ASP 258 N 0.70 0.34 -0.48 1.04 3.32 -1.98 -0.52 116.42 118.84 2r3p h ASP 258 Ca 0.44 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 2r3p h ASP 258 Cb 0.68 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2r3p h ASP 258 CO -0.20 0.50 0.15 1.23 -1.72 0.00 0.00 179.24 179.20 2r3p h GLY 259 N 0.16 0.80 1.08 2.75 0.00 -1.64 -1.58 103.07 104.64 2r3p h GLY 259 Ca 0.07 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 2r3p h GLY 259 CO 0.00 0.44 0.27 3.21 0.00 0.00 0.00 176.54 180.47 2r3p h ARG 260 N 0.64 1.16 -0.19 4.80 3.08 -0.94 0.10 114.38 123.03 2r3p h ARG 260 Ca 0.15 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 2r3p h ARG 260 Cb 0.27 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2r3p h ARG 260 CO -0.00 0.96 0.10 1.03 -1.07 0.00 0.00 179.97 180.99 2r3p h SER 261 N 1.12 0.24 -0.19 7.04 0.87 -0.87 -0.70 113.55 121.07 2r3p h SER 261 Ca 0.25 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 2r3p h SER 261 Cb 0.26 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2r3p h SER 261 CO -0.02 0.26 0.10 0.25 -0.53 0.00 0.00 176.83 176.90 2r3p h LEU 262 N 0.20 0.23 -0.63 2.23 5.85 -0.98 -2.47 115.31 119.73 2r3p h LEU 262 Ca 0.07 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2r3p h LEU 262 Cb 0.08 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2r3p h LEU 262 CO -0.01 0.25 0.35 0.25 -0.34 0.00 0.00 178.44 178.93 2r3p h LEU 263 N 0.20 0.51 -0.75 2.25 5.85 -0.63 -1.61 115.31 121.13 2r3p h LEU 263 Ca 0.07 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.86 2r3p h LEU 263 Cb 0.07 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 2r3p h LEU 263 CO -0.01 0.34 0.46 -1.28 -0.34 0.00 0.00 178.44 177.60 2r3p h SER 264 N 0.65 0.73 0.47 1.25 0.87 -0.92 -1.33 113.55 115.26 2r3p h SER 264 Ca 0.28 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.80 2r3p h SER 264 Cb 0.17 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 2r3p h SER 264 CO -0.18 0.48 -0.24 1.56 -0.53 0.00 0.00 176.83 177.93 2r3p h GLN 265 N 0.86 0.00 0.00 2.24 4.20 -0.87 -2.05 115.11 119.49 2r3p h GLN 265 Ca 0.31 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.02 2r3p h GLN 265 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2r3p h GLN 265 CO -0.14 0.24 -0.18 0.52 -0.67 0.00 0.00 178.83 178.60 2r3p h MET 266 N 0.00 0.00 -0.38 1.46 2.86 -0.47 -1.10 114.93 117.30 2r3p h MET 266 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2r3p h MET 266 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 2r3p h MET 266 CO 0.03 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.28 2r3p n LEU 267 N -2.83 4.02 -4.77 1.22 4.77 -0.59 -3.72 117.00 115.11 2r3p n LEU 267 Ca 0.04 -2.69 -0.41 0.00 -0.03 0.00 0.00 56.01 52.92 2r3p n LEU 267 Cb 0.51 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2r3p n LEU 267 CO 0.34 0.70 1.16 -1.00 -1.33 0.00 0.00 177.39 177.27 2r3p s HIS 268 N -2.25 2.64 0.05 -1.77 3.76 -0.93 -4.92 115.29 111.86 2r3p s HIS 268 Ca 0.41 1.07 -0.27 0.00 -0.15 0.00 0.00 55.06 56.12 2r3p s HIS 268 Cb 0.30 -4.03 -0.17 0.00 1.11 0.00 0.00 32.58 29.79 2r3p s HIS 268 CO 0.14 -3.14 1.51 1.88 -0.85 0.00 0.00 174.74 174.28 2r3p h TYR 269 N 3.51 -0.34 -2.61 1.40 0.05 -1.91 -3.42 116.97 113.65 2r3p h TYR 269 Ca -0.50 -0.01 -0.57 0.00 0.05 0.00 0.00 58.73 57.70 2r3p h TYR 269 Cb 1.23 0.11 -0.02 0.00 1.01 0.00 0.00 36.73 39.06 2r3p h TYR 269 CO 0.55 -0.11 1.26 0.34 -1.05 0.00 0.00 178.16 179.15 2r3p s ASP 270 N -4.99 5.98 0.55 3.88 -1.08 -1.26 -4.86 116.67 114.89 2r3p s ASP 270 Ca -0.15 1.50 0.25 0.00 -0.52 0.00 0.00 52.55 53.63 2r3p s ASP 270 Cb 0.04 -2.53 1.46 0.00 -1.46 0.00 0.00 42.92 40.43 2r3p s ASP 270 CO 0.61 -1.60 2.06 -0.65 0.52 0.00 0.00 175.17 176.11 2r3p h PRO 271 N 12.51 0.00 0.00 4.34 0.11 -1.96 0.12 132.00 147.13 2r3p h PRO 271 Ca -0.35 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.71 2r3p h PRO 271 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2r3p h PRO 271 CO 1.01 0.00 -0.24 -0.97 -0.21 0.00 0.00 178.00 177.59 2r3p h ASN 272 N 0.00 0.00 0.49 -2.05 -1.24 -1.95 -3.11 115.58 107.72 2r3p h ASN 272 Ca 0.15 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.15 2r3p h ASN 272 Cb 0.65 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.70 2r3p h ASN 272 CO -0.00 0.24 -1.51 0.29 -1.29 0.00 0.00 177.43 175.16 2r3p n LYS 273 N -3.29 0.63 -1.75 6.67 4.76 0.28 -4.94 118.16 120.52 2r3p n LYS 273 Ca 0.01 -0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 55.00 2r3p n LYS 273 Cb 0.51 -1.68 -0.00 0.00 -1.84 0.00 0.00 35.03 32.02 2r3p n LYS 273 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2r3p n ARG 274 N -2.48 2.51 -1.81 1.97 0.63 -0.34 -4.91 116.66 112.23 2r3p n ARG 274 Ca -0.03 0.88 -0.39 0.00 -0.92 0.00 0.00 57.85 57.39 2r3p n ARG 274 Cb 0.58 -2.56 0.03 0.00 0.45 0.00 0.00 32.46 30.95 2r3p n ARG 274 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 2r3p s ILE 275 N -1.11 2.11 0.61 5.15 2.07 -0.42 -5.01 121.20 124.61 2r3p s ILE 275 Ca 0.54 0.09 -0.07 0.00 -1.41 0.00 0.00 60.65 59.80 2r3p s ILE 275 Cb -0.50 -3.05 0.01 0.00 0.13 0.00 0.00 42.46 39.05 2r3p s ILE 275 CO 0.63 0.00 0.93 -0.94 -1.91 0.00 0.00 174.94 173.66 2r3p s SER 276 N -0.82 5.57 0.15 4.50 1.04 -1.26 -4.89 113.70 117.99 2r3p s SER 276 Ca 0.68 0.77 -0.15 0.00 0.48 0.00 0.00 55.95 57.73 2r3p s SER 276 Cb -0.41 -1.73 0.03 0.00 0.10 0.00 0.00 66.02 64.01 2r3p s SER 276 CO 0.50 -1.11 1.73 0.00 0.98 0.00 0.00 173.24 175.34 2r3p h ALA 277 N -0.24 0.61 -0.16 5.32 0.00 -1.93 -0.82 119.26 122.04 2r3p h ALA 277 Ca -0.45 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.36 2r3p h ALA 277 Cb 1.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2r3p h ALA 277 CO 0.61 0.18 0.02 -0.22 0.00 0.00 0.00 179.25 179.84 2r3p h LYS 278 N 0.62 0.07 -0.28 0.00 3.64 -1.92 -1.96 116.57 116.74 2r3p h LYS 278 Ca 0.16 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2r3p h LYS 278 Cb 0.13 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2r3p h LYS 278 CO -0.02 0.05 -0.13 0.00 -2.27 0.00 0.00 179.45 177.08 2r3p h ALA 279 N 1.12 1.27 -0.52 5.00 0.00 -1.92 -2.78 119.26 121.42 2r3p h ALA 279 Ca 0.07 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2r3p h ALA 279 Cb 0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2r3p h ALA 279 CO -0.11 0.48 0.18 0.00 0.00 0.00 0.00 179.25 179.81 2r3p h ALA 280 N 1.44 1.35 0.00 0.00 0.00 -0.61 -1.94 119.26 119.48 2r3p h ALA 280 Ca 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2r3p h ALA 280 Cb 0.48 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2r3p h ALA 280 CO 0.03 0.48 -0.06 -0.07 0.00 0.00 0.00 179.25 179.63 2r3p h LEU 281 N 0.75 0.00 -0.89 0.00 3.38 -1.08 -1.83 115.31 115.64 2r3p h LEU 281 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2r3p h LEU 281 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2r3p h LEU 281 CO -0.01 0.06 -0.07 0.00 0.09 0.00 0.00 178.44 178.50 2r3p n ALA 282 N -2.31 2.72 -1.76 1.53 0.00 -0.74 -4.84 120.51 115.10 2r3p n ALA 282 Ca -0.02 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.59 2r3p n ALA 282 Cb 0.16 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.49 2r3p n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2r3p s HIS 283 N -2.14 2.59 0.63 0.00 5.04 -0.69 -4.89 115.29 115.84 2r3p s HIS 283 Ca 0.34 1.45 0.33 0.00 -1.54 0.00 0.00 55.06 55.63 2r3p s HIS 283 Cb 0.20 -3.60 1.84 0.00 0.04 0.00 0.00 32.58 31.06 2r3p s HIS 283 CO 0.39 -2.22 2.11 -1.35 -2.34 0.00 0.00 174.74 171.33 2r3p h PRO 284 N 1.83 0.00 -0.58 2.88 0.11 -1.92 -1.77 132.00 132.56 2r3p h PRO 284 Ca -0.50 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.74 2r3p h PRO 284 Cb 1.27 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 2r3p h PRO 284 CO 0.59 0.00 0.40 0.35 -0.21 0.00 0.00 178.00 179.13 2r3p h PHE 285 N 0.00 0.23 -0.32 0.65 3.57 -1.90 -1.74 116.94 117.43 2r3p h PHE 285 Ca 0.04 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2r3p h PHE 285 Cb 0.43 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.10 2r3p h PHE 285 CO 0.00 0.10 0.00 1.19 -2.23 0.00 0.00 178.31 177.37 2r3p n PHE 286 N -4.43 0.42 -0.35 0.41 3.72 -0.66 -4.37 117.46 112.19 2r3p n PHE 286 Ca 0.10 -0.21 0.11 0.00 -0.05 0.00 0.00 57.45 57.40 2r3p n PHE 286 Cb 0.50 0.00 0.30 0.00 -0.94 0.00 0.00 39.48 39.34 2r3p n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2r3p h GLN 287 N 3.09 0.81 -0.48 -1.08 -0.00 -1.46 -1.67 115.11 114.31 2r3p h GLN 287 Ca 0.00 -0.05 -0.19 0.00 -0.00 0.00 0.00 58.65 58.41 2r3p h GLN 287 Cb 0.69 -0.18 -0.12 0.00 0.00 0.00 0.00 27.48 27.87 2r3p h GLN 287 CO 0.00 0.53 0.10 -0.40 0.00 0.00 0.00 178.83 179.06 2r3p n ASP 288 N -4.69 3.33 -4.77 -0.69 5.75 -1.26 -5.03 116.55 109.18 2r3p n ASP 288 Ca 0.21 -3.49 -0.40 0.00 -0.01 0.00 0.00 54.79 51.10 2r3p n ASP 288 Cb 0.50 -0.66 0.01 0.00 -1.03 0.00 0.00 41.12 39.94 2r3p n ASP 288 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2r3p s VAL 289 N -3.12 2.24 0.24 2.12 0.11 -0.63 -5.02 120.40 116.34 2r3p s VAL 289 Ca 0.47 0.21 0.04 0.00 -2.93 0.00 0.00 61.98 59.78 2r3p s VAL 289 Cb 0.41 -3.12 -0.02 0.00 -1.53 0.00 0.00 36.38 32.12 2r3p s VAL 289 CO 0.05 0.03 0.16 0.35 -3.33 0.00 0.00 175.10 172.36 2r3p n THR 290 N -0.16 0.00 -3.65 5.04 -2.24 -1.26 -5.09 114.28 106.91 2r3p n THR 290 Ca 0.05 -1.62 -0.28 0.00 -2.27 0.00 0.00 64.05 59.93 2r3p n THR 290 Cb 0.43 0.73 -0.11 0.00 -2.10 0.00 0.00 70.33 69.27 2r3p n THR 290 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2r3p s LYS 291 N -2.96 1.66 0.78 -0.78 2.20 -1.26 -4.38 119.74 115.00 2r3p s LYS 291 Ca 0.22 -2.69 -0.11 0.00 -0.36 0.00 0.00 55.97 53.03 2r3p s LYS 291 Cb 0.01 -2.41 0.06 0.00 -1.51 0.00 0.00 37.83 33.97 2r3p s LYS 291 CO 0.16 -1.33 1.09 -2.14 -0.36 0.00 0.00 175.35 172.76 2r3p s PRO 292 N -0.65 2.25 -0.21 4.03 0.02 -1.26 -4.98 135.00 134.20 2r3p s PRO 292 Ca 0.28 1.06 -0.13 0.00 0.02 0.00 0.00 61.00 62.23 2r3p s PRO 292 Cb -0.02 -1.90 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2r3p s PRO 292 CO -0.17 -1.62 0.26 0.08 -0.33 0.00 0.00 177.00 175.22 2r3p s VAL 293 N -2.95 5.30 0.58 3.83 1.01 -1.26 -4.49 120.40 122.43 2r3p s VAL 293 Ca 0.61 0.43 -0.11 0.00 0.00 0.00 0.00 61.98 62.90 2r3p s VAL 293 Cb -0.17 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 2r3p s VAL 293 CO 0.56 0.34 0.99 -2.16 0.00 0.00 0.00 175.10 174.82 2r3p s PRO 294 N 0.92 3.66 -0.45 2.72 0.04 -1.26 -5.00 135.00 135.62 2r3p s PRO 294 Ca 0.13 0.71 -0.17 0.00 0.04 0.00 0.00 61.00 61.71 2r3p s PRO 294 Cb -0.13 -2.13 0.04 0.00 0.04 0.00 0.00 34.50 32.31 2r3p s PRO 294 CO 0.05 -0.46 0.47 -1.58 0.04 0.00 0.00 177.00 175.51 2r3p s HIS 295 N -3.01 3.16 -0.13 0.56 2.46 -1.26 -4.94 115.29 112.13 2r3p s HIS 295 Ca 0.55 -0.54 -0.04 0.00 0.47 0.00 0.00 55.06 55.50 2r3p s HIS 295 Cb -0.11 -3.08 -0.03 0.00 -0.13 0.00 0.00 32.58 29.23 2r3p s HIS 295 CO 0.49 -0.79 0.00 -0.51 -2.47 0.00 0.00 174.74 171.46 2r3p s LEU 296 N 2.12 3.53 -0.37 8.88 1.43 -1.26 -5.07 118.68 127.95 2r3p s LEU 296 Ca 0.11 0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.23 2r3p s LEU 296 Cb -0.19 -1.84 0.08 0.00 0.03 0.00 0.00 46.19 44.27 2r3p s LEU 296 CO 0.12 0.27 0.13 -0.60 0.23 0.00 0.00 176.35 176.50 2r3p s ARG 297 N -0.22 2.20 0.00 1.70 3.00 -1.26 -5.12 118.95 119.25 2r3p s ARG 297 Ca 0.06 -1.58 0.25 0.00 -1.00 0.00 0.00 55.73 53.45 2r3p s ARG 297 Cb -0.12 -3.45 0.30 0.00 0.00 0.00 0.00 34.95 31.68 2r3p s ARG 297 CO 0.02 -0.89 1.32 1.28 0.00 0.00 0.00 175.30 177.03