#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n4c s PRO 2 N 0.00 4.32 1.03 1.61 0.04 -1.26 -5.03 135.00 135.72 1n4c s PRO 2 Ca 0.00 1.59 -0.14 0.00 0.04 0.00 0.00 61.00 62.49 1n4c s PRO 2 Cb 0.00 -2.75 0.19 0.00 0.04 0.00 0.00 34.50 31.98 1n4c s PRO 2 CO 0.00 -0.02 0.39 1.47 0.04 0.00 0.00 177.00 178.89 1n4c n LEU 3 N 0.34 -1.22 -3.16 -3.56 -0.00 -1.26 -5.02 117.00 103.13 1n4c n LEU 3 Ca 0.03 -0.43 0.03 0.00 -0.00 0.00 0.00 56.01 55.64 1n4c n LEU 3 Cb 0.48 -0.78 -0.00 0.00 -0.00 0.00 0.00 43.42 43.12 1n4c n LEU 3 CO 0.48 -3.36 0.14 -0.83 -0.00 0.00 0.00 177.39 173.81 1n4c s GLY 4 N -2.07 -1.25 0.47 1.47 0.00 -1.26 -5.15 107.32 99.53 1n4c s GLY 4 Ca 0.37 0.91 -0.21 0.00 0.00 0.00 0.00 44.72 45.80 1n4c s GLY 4 CO 0.33 3.73 1.03 -0.56 0.00 0.00 0.00 173.10 177.64 1n4c s SER 5 N 2.55 6.44 -0.82 1.64 0.01 -1.26 -4.94 113.70 117.31 1n4c s SER 5 Ca 0.13 1.93 -0.25 0.00 1.31 0.00 0.00 55.95 59.07 1n4c s SER 5 Cb -0.07 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.59 1n4c s SER 5 CO -0.20 -0.71 1.71 -2.16 0.41 0.00 0.00 173.24 172.29 1n4c s PRO 6 N -3.12 2.90 0.00 12.44 0.04 -1.26 -4.94 135.00 141.06 1n4c s PRO 6 Ca 0.66 -0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.48 1n4c s PRO 6 Cb -0.17 -4.81 0.00 0.00 0.04 0.00 0.00 34.50 29.57 1n4c s PRO 6 CO 0.21 -2.76 0.00 0.39 0.04 0.00 0.00 177.00 174.87 1n4c n GLU 7 N 9.04 0.00 0.00 4.56 -0.58 -1.26 -4.97 120.64 127.42 1n4c n GLU 7 Ca 0.27 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 1n4c n GLU 7 Cb 0.49 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.36 1n4c n GLU 7 CO 0.00 0.00 0.00 1.97 -0.48 0.00 0.00 177.13 178.62 1n4c n PHE 8 N 0.00 0.00 -0.32 -0.32 -1.74 -1.26 -4.96 117.46 108.86 1n4c n PHE 8 Ca 0.00 0.00 -0.02 0.00 -0.56 0.00 0.00 57.45 56.87 1n4c n PHE 8 Cb 0.00 0.08 -0.02 0.00 1.52 0.00 0.00 39.48 41.05 1n4c n PHE 8 CO 0.00 0.00 0.00 0.43 -0.56 0.00 0.00 176.76 176.63 1n4c n SER 9 N 0.00 2.66 -4.82 5.98 7.64 -1.26 -4.84 113.62 118.98 1n4c n SER 9 Ca 0.00 -1.78 -0.33 0.00 1.01 0.00 0.00 58.87 57.77 1n4c n SER 9 Cb 0.26 -0.60 -0.04 0.00 -1.01 0.00 0.00 64.21 62.82 1n4c n SER 9 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1n4c s MET 10 N 1.27 3.91 0.00 1.43 -1.94 -1.26 -5.06 119.30 117.65 1n4c s MET 10 Ca 0.09 1.17 0.00 0.00 -1.71 0.00 0.00 55.69 55.24 1n4c s MET 10 Cb 0.04 -2.12 0.00 0.00 2.01 0.00 0.00 34.83 34.76 1n4c s MET 10 CO 0.00 -0.32 0.00 -0.35 -0.01 0.00 0.00 175.02 174.34 1n4c n PRO 11 N -1.15 0.70 0.04 2.03 -0.04 -1.26 -4.92 135.00 130.39 1n4c n PRO 11 Ca 0.08 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.43 1n4c n PRO 11 Cb 0.53 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.92 1n4c n PRO 11 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1n4c h HIS 12 N -0.54 -1.12 0.00 0.54 -0.00 -2.02 -3.41 115.15 108.61 1n4c h HIS 12 Ca 0.00 0.04 -0.17 0.00 -0.00 0.00 0.00 60.37 60.24 1n4c h HIS 12 Cb 0.00 0.49 -0.13 0.00 -0.00 0.00 0.00 27.41 27.77 1n4c h HIS 12 CO 0.00 -0.40 -0.15 0.43 -0.00 0.00 0.00 177.93 177.80 1n4c n SER 13 N -4.58 -1.64 -4.38 3.26 7.64 -1.26 -5.10 113.62 107.56 1n4c n SER 13 Ca -0.05 -2.22 -0.52 0.00 1.01 0.00 0.00 58.87 57.09 1n4c n SER 13 Cb 0.28 1.06 -0.11 0.00 -1.01 0.00 0.00 64.21 64.43 1n4c n SER 13 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1n4c n SER 14 N -0.50 1.14 -4.41 6.43 2.88 -1.26 -4.81 113.62 113.08 1n4c n SER 14 Ca -0.11 0.42 -0.40 0.00 -1.33 0.00 0.00 58.87 57.45 1n4c n SER 14 Cb 0.77 -1.05 0.02 0.00 -0.75 0.00 0.00 64.21 63.20 1n4c n SER 14 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1n4c n PRO 15 N 8.01 0.42 -3.63 -1.46 -0.02 -1.26 -5.01 135.00 132.05 1n4c n PRO 15 Ca 0.52 0.16 -0.11 0.00 -2.02 0.00 0.00 63.50 62.06 1n4c n PRO 15 Cb 0.09 -1.45 -0.07 0.00 -0.02 0.00 0.00 33.50 32.05 1n4c n PRO 15 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1n4c s GLN 16 N -1.59 0.76 -0.18 -0.52 -2.07 -1.26 -5.13 119.66 109.67 1n4c s GLN 16 Ca 0.64 1.05 -0.29 0.00 -1.82 0.00 0.00 55.36 54.94 1n4c s GLN 16 Cb -0.54 0.29 0.00 0.00 -1.09 0.00 0.00 33.01 31.66 1n4c s GLN 16 CO 0.59 -0.12 1.02 -0.80 -1.32 0.00 0.00 175.29 174.66 1n4c s ASN 17 N 0.88 7.16 -0.38 12.60 0.02 -1.26 -4.88 114.94 129.07 1n4c s ASN 17 Ca -0.04 1.44 0.05 0.00 -1.02 0.00 0.00 52.86 53.29 1n4c s ASN 17 Cb -0.05 -2.54 0.32 0.00 0.02 0.00 0.00 41.25 39.00 1n4c s ASN 17 CO -0.08 -0.57 1.28 -2.11 0.02 0.00 0.00 177.10 175.64 1n4c n ARG 18 N 5.75 0.53 0.00 -0.60 1.85 -1.26 -4.98 116.66 117.95 1n4c n ARG 18 Ca 0.10 -1.25 0.00 0.00 -1.00 0.00 0.00 57.85 55.70 1n4c n ARG 18 Cb 0.47 -0.55 0.00 0.00 -1.05 0.00 0.00 32.46 31.33 1n4c n ARG 18 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1n4c n PRO 19 N 0.45 0.00 0.00 2.89 -0.04 -1.26 -4.94 135.00 132.10 1n4c n PRO 19 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1n4c n PRO 19 Cb 0.73 -0.07 0.00 0.00 -0.04 0.00 0.00 33.50 34.12 1n4c n PRO 19 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1n4c n ASN 20 N 0.00 -1.45 -3.80 3.54 5.15 -1.26 -4.89 115.26 112.54 1n4c n ASN 20 Ca 0.00 0.00 -0.23 0.00 -0.60 0.00 0.00 54.58 53.75 1n4c n ASN 20 Cb 0.00 0.00 0.14 0.00 -0.53 0.00 0.00 39.78 39.39 1n4c n ASN 20 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n4c n TYR 21 N -2.60 -2.02 -1.49 1.20 9.36 -1.26 -4.78 117.16 115.56 1n4c n TYR 21 Ca 0.00 0.09 -0.39 0.00 3.32 0.00 0.00 57.90 60.92 1n4c n TYR 21 Cb 0.00 -1.43 0.03 0.00 -0.63 0.00 0.00 39.34 37.32 1n4c n TYR 21 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1n4c n ASN 22 N -0.93 -0.64 -4.51 2.98 3.02 -1.26 -4.82 115.26 109.11 1n4c n ASN 22 Ca 0.04 0.79 -0.40 0.00 -0.03 0.00 0.00 54.58 54.98 1n4c n ASN 22 Cb 0.44 -1.20 0.03 0.00 -0.61 0.00 0.00 39.78 38.44 1n4c n ASN 22 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1n4c n VAL 23 N -1.50 2.34 -3.56 2.41 3.14 -1.26 -4.98 118.33 114.92 1n4c n VAL 23 Ca 0.12 -0.50 -0.08 0.00 -2.96 0.00 0.00 64.34 60.92 1n4c n VAL 23 Cb 0.46 -0.79 -0.03 0.00 -1.06 0.00 0.00 33.84 32.42 1n4c n VAL 23 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1n4c s SER 24 N -1.04 -0.30 0.15 6.55 0.15 -1.26 -5.01 113.70 112.93 1n4c s SER 24 Ca 0.67 0.15 0.25 0.00 0.70 0.00 0.00 55.95 57.72 1n4c s SER 24 Cb -0.50 0.29 0.93 0.00 -1.71 0.00 0.00 66.02 65.03 1n4c s SER 24 CO 0.55 -0.41 1.78 0.49 1.20 0.00 0.00 173.24 176.84 1n4c n PHE 25 N 0.18 0.60 -3.82 3.44 3.72 -1.26 -4.89 117.46 115.43 1n4c n PHE 25 Ca -0.07 0.19 -0.08 0.00 -0.05 0.00 0.00 57.45 57.44 1n4c n PHE 25 Cb 0.59 -0.81 0.02 0.00 -0.94 0.00 0.00 39.48 38.34 1n4c n PHE 25 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1n4c s SER 26 N -3.97 -0.03 0.00 4.37 0.01 -1.26 -5.03 113.70 107.80 1n4c s SER 26 Ca 0.10 -1.04 0.23 0.00 1.31 0.00 0.00 55.95 56.55 1n4c s SER 26 Cb 0.13 0.80 0.42 0.00 0.21 0.00 0.00 66.02 67.59 1n4c s SER 26 CO 0.51 -1.58 1.39 -1.20 0.41 0.00 0.00 173.24 172.77 1n4c n SER 27 N -1.28 3.46 0.04 2.44 7.64 -1.26 -4.35 113.62 120.30 1n4c n SER 27 Ca -0.07 -1.99 -0.12 0.00 1.01 0.00 0.00 58.87 57.70 1n4c n SER 27 Cb 0.60 -0.25 -0.01 0.00 -1.01 0.00 0.00 64.21 63.53 1n4c n SER 27 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1n4c h MET 28 N 4.40 0.50 -5.75 1.43 2.86 -2.00 -3.43 114.93 112.94 1n4c h MET 28 Ca 0.00 -0.43 -0.55 0.00 -2.06 0.00 0.00 59.70 56.66 1n4c h MET 28 Cb 0.98 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 1n4c h MET 28 CO 0.00 1.07 1.56 -2.30 1.06 0.00 0.00 176.91 178.30 1n4c n PRO 29 N -3.84 1.21 -2.75 -0.22 -0.02 -1.26 -4.83 135.00 123.29 1n4c n PRO 29 Ca -0.06 0.22 -0.04 0.00 -2.02 0.00 0.00 63.50 61.60 1n4c n PRO 29 Cb 0.75 -2.98 0.01 0.00 -0.02 0.00 0.00 33.50 31.26 1n4c n PRO 29 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n4c n GLY 30 N 6.12 -0.73 0.00 -1.23 0.00 -1.26 -5.07 105.19 103.02 1n4c n GLY 30 Ca 0.39 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.99 1n4c n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n4c n GLY 31 N 2.88 -2.05 3.39 -0.02 0.00 -1.26 -5.15 105.19 102.98 1n4c n GLY 31 Ca 0.17 1.01 -0.33 0.00 0.00 0.00 0.00 46.02 46.87 1n4c n GLY 31 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1n4c n GLN 32 N 0.00 -0.47 -0.88 1.61 6.02 -1.26 -4.91 117.38 117.49 1n4c n GLN 32 Ca 0.00 -0.10 -0.31 0.00 -0.01 0.00 0.00 57.00 56.58 1n4c n GLN 32 Cb 0.00 -1.83 0.15 0.00 1.02 0.00 0.00 30.24 29.58 1n4c n GLN 32 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1n4c s ASN 33 N -1.99 3.32 -0.55 1.08 0.01 -1.26 -4.88 114.94 110.68 1n4c s ASN 33 Ca 0.57 2.02 -0.28 0.00 -0.71 0.00 0.00 52.86 54.46 1n4c s ASN 33 Cb -0.20 -2.53 0.01 0.00 0.41 0.00 0.00 41.25 38.94 1n4c s ASN 33 CO 0.67 -2.82 1.49 -1.61 -1.51 0.00 0.00 177.10 173.32 1n4c s GLU 34 N -4.73 3.23 -1.14 -0.60 0.41 -1.26 -4.91 118.70 109.69 1n4c s GLU 34 Ca 0.65 0.54 -0.21 0.00 -0.41 0.00 0.00 54.97 55.54 1n4c s GLU 34 Cb -0.21 -4.16 0.02 0.00 -1.78 0.00 0.00 34.13 28.00 1n4c s GLU 34 CO 0.58 -2.02 1.72 1.03 -0.49 0.00 0.00 175.26 176.07 1n4c s ARG 35 N 5.69 3.41 0.00 1.61 1.81 -1.26 -4.71 118.95 125.50 1n4c s ARG 35 Ca 0.56 -1.36 0.00 0.00 -1.72 0.00 0.00 55.73 53.20 1n4c s ARG 35 Cb -0.12 -5.37 0.00 0.00 -0.45 0.00 0.00 34.95 29.01 1n4c s ARG 35 CO 0.25 -2.71 0.00 0.41 -0.68 0.00 0.00 175.30 172.57 1n4c n GLY 36 N 6.11 0.98 2.37 -3.53 0.00 -1.26 -5.02 105.19 104.83 1n4c n GLY 36 Ca 0.42 0.55 -0.37 0.00 0.00 0.00 0.00 46.02 46.62 1n4c n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n4c n LYS 37 N 0.00 3.44 -1.53 1.61 4.76 -1.26 -4.88 118.16 120.29 1n4c n LYS 37 Ca 0.00 -2.10 -0.25 0.00 -2.87 0.00 0.00 58.31 53.09 1n4c n LYS 37 Cb 0.00 -2.76 -0.12 0.00 -1.84 0.00 0.00 35.03 30.31 1n4c n LYS 37 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1n4c n ALA 38 N 3.76 0.63 -1.67 7.82 0.00 -1.26 -4.80 120.51 124.99 1n4c n ALA 38 Ca 0.73 -0.97 -0.53 0.00 0.00 0.00 0.00 53.44 52.67 1n4c n ALA 38 Cb 0.22 -2.88 -0.06 0.00 0.00 0.00 0.00 19.45 16.73 1n4c n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c n ALA 39 N 13.41 0.05 -1.00 0.00 0.00 -1.26 -4.94 120.51 126.76 1n4c n ALA 39 Ca 0.53 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.37 1n4c n ALA 39 Cb 0.32 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.50 1n4c n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c n ALA 40 N 4.87 0.00 -1.79 0.00 0.00 -1.26 -4.96 120.51 117.37 1n4c n ALA 40 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.36 1n4c n ALA 40 Cb 0.20 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.68 1n4c n ALA 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1n4c s ASN 41 N -1.74 5.69 0.21 0.00 4.22 -1.26 -4.93 114.94 117.14 1n4c s ASN 41 Ca 0.00 1.37 0.00 0.00 -2.14 0.00 0.00 52.86 52.09 1n4c s ASN 41 Cb 0.00 -2.29 0.00 0.00 1.28 0.00 0.00 41.25 40.24 1n4c s ASN 41 CO 0.00 -1.21 0.00 -0.11 -2.04 0.00 0.00 177.10 173.74 1n4c n LEU 42 N -2.96 -1.84 -3.96 3.54 -0.00 -1.26 -5.00 117.00 105.52 1n4c n LEU 42 Ca 0.07 0.56 -0.39 0.00 -0.00 0.00 0.00 56.01 56.24 1n4c n LEU 42 Cb 0.55 1.94 -0.05 0.00 -0.00 0.00 0.00 43.42 45.86 1n4c n LEU 42 CO 0.57 0.07 2.01 -1.84 -0.00 0.00 0.00 177.39 178.20 1n4c n GLU 43 N -2.96 1.80 0.00 1.96 0.28 -1.26 -4.72 120.64 115.74 1n4c n GLU 43 Ca 0.00 -2.20 0.00 0.00 -0.16 0.00 0.00 57.16 54.80 1n4c n GLU 43 Cb 0.00 -3.21 0.00 0.00 1.43 0.00 0.00 31.44 29.66 1n4c n GLU 43 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1n4c n GLY 44 N 4.87 -2.63 0.00 -1.84 0.00 -1.26 -4.85 105.19 99.48 1n4c n GLY 44 Ca 0.49 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1n4c n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n4c n LYS 45 N -1.38 0.00 -2.50 1.61 5.02 -1.26 -4.62 118.16 115.03 1n4c n LYS 45 Ca 0.00 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.89 1n4c n LYS 45 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1n4c n LYS 45 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1n4c s GLN 46 N 0.00 3.59 0.00 1.97 2.00 -1.26 -4.82 119.66 121.14 1n4c s GLN 46 Ca 0.00 -1.39 -0.04 0.00 -2.00 0.00 0.00 55.36 51.93 1n4c s GLN 46 Cb 0.00 -5.40 -0.20 0.00 0.80 0.00 0.00 33.01 28.21 1n4c s GLN 46 CO 0.00 -2.43 3.17 1.63 -0.50 0.00 0.00 175.29 177.16 1n4c n LYS 47 N 8.67 1.72 -2.04 1.67 4.76 -1.26 -3.53 118.16 128.14 1n4c n LYS 47 Ca 0.40 -0.75 -0.04 0.00 -2.87 0.00 0.00 58.31 55.06 1n4c n LYS 47 Cb 0.49 -1.76 0.06 0.00 -1.84 0.00 0.00 35.03 31.97 1n4c n LYS 47 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1n4c n ALA 48 N 2.28 2.92 0.00 7.82 0.00 -1.26 -4.93 120.51 127.34 1n4c n ALA 48 Ca 0.32 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1n4c n ALA 48 Cb 0.80 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1n4c n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c n ALA 49 N -0.96 1.23 -1.37 0.00 0.00 -1.23 -3.33 120.51 114.85 1n4c n ALA 49 Ca -0.20 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 52.97 1n4c n ALA 49 Cb 0.79 -0.91 -0.08 0.00 0.00 0.00 0.00 19.45 19.26 1n4c n ALA 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1n4c n ASP 50 N -1.09 6.81 -2.70 0.00 8.00 -1.26 -4.35 116.55 121.95 1n4c n ASP 50 Ca 0.00 -2.81 -0.06 0.00 0.71 0.00 0.00 54.79 52.63 1n4c n ASP 50 Cb 0.01 -1.39 0.06 0.00 -0.02 0.00 0.00 41.12 39.79 1n4c n ASP 50 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1n4c n PHE 51 N 2.15 -1.66 0.00 1.24 -0.00 -1.21 -4.99 117.46 112.99 1n4c n PHE 51 Ca 0.56 -1.10 0.00 0.00 -0.00 0.00 0.00 57.45 56.90 1n4c n PHE 51 Cb 0.56 1.28 0.00 0.00 -0.00 0.00 0.00 39.48 41.32 1n4c n PHE 51 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 1n4c n GLU 52 N 1.63 0.00 -3.22 -4.13 0.00 -1.26 -5.07 120.64 108.59 1n4c n GLU 52 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 57.16 57.19 1n4c n GLU 52 Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 32.09 1n4c n GLU 52 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1n4c s ASP 53 N -0.52 -0.86 0.00 4.31 2.15 -1.26 -4.99 116.67 115.49 1n4c s ASP 53 Ca 0.00 -0.25 0.00 0.00 0.43 0.00 0.00 52.55 52.73 1n4c s ASP 53 Cb 0.00 1.67 0.00 0.00 -0.30 0.00 0.00 42.92 44.29 1n4c s ASP 53 CO 0.00 -0.29 0.00 -0.11 -0.17 0.00 0.00 175.17 174.60 1n4c n LEU 54 N 5.16 0.00 -0.36 -1.34 7.94 -1.26 -4.89 117.00 122.25 1n4c n LEU 54 Ca 0.05 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 55.03 1n4c n LEU 54 Cb 0.53 0.37 0.31 0.00 0.53 0.00 0.00 43.42 45.15 1n4c n LEU 54 CO -0.03 -0.37 0.72 0.18 -1.11 0.00 0.00 177.39 176.79 1n4c n LEU 55 N -2.30 1.07 0.18 -1.96 4.77 -1.26 -4.26 117.00 113.23 1n4c n LEU 55 Ca 0.00 -0.48 -0.07 0.00 -0.03 0.00 0.00 56.01 55.43 1n4c n LEU 55 Cb 0.00 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1n4c n LEU 55 CO 0.00 0.24 0.47 0.77 -1.33 0.00 0.00 177.39 177.54 1n4c h SER 56 N 1.31 -0.38 0.00 -1.43 4.64 -1.95 -3.12 113.55 112.63 1n4c h SER 56 Ca 0.00 0.01 -0.50 0.00 -0.47 0.00 0.00 61.79 60.83 1n4c h SER 56 Cb 0.29 0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.49 1n4c h SER 56 CO 0.00 -0.26 2.73 0.61 -0.87 0.00 0.00 176.83 179.04 1n4c n GLY 57 N -0.95 3.71 2.37 -0.77 0.00 -1.26 -4.74 105.19 103.54 1n4c n GLY 57 Ca -0.06 -1.28 -0.23 0.00 0.00 0.00 0.00 46.02 44.45 1n4c n GLY 57 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1n4c n GLN 58 N 3.48 2.39 0.00 1.61 7.27 -1.18 -4.21 117.38 126.74 1n4c n GLN 58 Ca 0.63 -1.46 0.00 0.00 0.07 0.00 0.00 57.00 56.25 1n4c n GLN 58 Cb 0.34 -2.37 0.00 0.00 2.41 0.00 0.00 30.24 30.61 1n4c n GLN 58 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1n4c n GLY 59 N 3.35 -2.32 3.58 1.69 0.00 -1.26 -5.02 105.19 105.20 1n4c n GLY 59 Ca 0.51 0.80 -0.21 0.00 0.00 0.00 0.00 46.02 47.12 1n4c n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1n4c n PHE 60 N -0.25 1.80 0.00 1.61 7.35 -1.26 -4.84 117.46 121.86 1n4c n PHE 60 Ca 0.00 -0.81 0.00 0.00 -0.76 0.00 0.00 57.45 55.88 1n4c n PHE 60 Cb 0.00 -2.61 0.00 0.00 0.35 0.00 0.00 39.48 37.22 1n4c n PHE 60 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1n4c n ASN 61 N 17.20 0.00 -3.64 -2.13 4.05 -1.26 -4.99 115.26 124.49 1n4c n ASN 61 Ca 0.43 0.00 -0.08 0.00 0.45 0.00 0.00 54.58 55.38 1n4c n ASN 61 Cb 0.47 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.41 1n4c n ASN 61 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1n4c s ALA 62 N -3.10 -2.01 -0.49 5.20 0.00 -1.26 -5.09 121.76 115.01 1n4c s ALA 62 Ca 0.00 1.82 -0.27 0.00 0.00 0.00 0.00 51.96 53.52 1n4c s ALA 62 Cb 0.00 -1.45 -0.05 0.00 0.00 0.00 0.00 23.12 21.63 1n4c s ALA 62 CO 0.00 -0.22 2.16 -3.38 0.00 0.00 0.00 175.76 174.32 1n4c s HIS 63 N 0.09 1.33 -0.30 0.00 -3.43 -1.26 -4.86 115.29 106.86 1n4c s HIS 63 Ca 0.04 1.15 -0.38 0.00 -0.80 0.00 0.00 55.06 55.06 1n4c s HIS 63 Cb -0.05 -3.82 -0.14 0.00 -1.43 0.00 0.00 32.58 27.14 1n4c s HIS 63 CO -0.07 -2.62 1.93 1.63 -2.00 0.00 0.00 174.74 173.60 1n4c n LYS 64 N 9.00 1.15 -2.73 -0.38 5.02 -1.26 -4.81 118.16 124.16 1n4c n LYS 64 Ca 0.30 0.39 -0.09 0.00 -2.02 0.00 0.00 58.31 56.89 1n4c n LYS 64 Cb 0.52 -2.23 0.09 0.00 -0.02 0.00 0.00 35.03 33.40 1n4c n LYS 64 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1n4c n ASP 65 N 7.06 -2.30 0.00 4.39 5.68 -1.26 -5.07 116.55 125.05 1n4c n ASP 65 Ca 0.33 -3.60 0.00 0.00 -0.50 0.00 0.00 54.79 51.02 1n4c n ASP 65 Cb 0.16 1.88 0.00 0.00 -1.14 0.00 0.00 41.12 42.02 1n4c n ASP 65 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1n4c n LYS 66 N 0.32 0.00 -2.08 0.11 4.81 -1.26 -3.81 118.16 116.25 1n4c n LYS 66 Ca 0.05 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 57.14 1n4c n LYS 66 Cb 0.71 -0.45 -0.04 0.00 0.02 0.00 0.00 35.03 35.27 1n4c n LYS 66 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1n4c s LYS 67 N 0.00 2.65 0.04 1.64 1.02 -1.26 -4.96 119.74 118.87 1n4c s LYS 67 Ca 0.00 0.29 -0.01 0.00 0.02 0.00 0.00 55.97 56.27 1n4c s LYS 67 Cb 0.00 -4.58 0.01 0.00 -0.52 0.00 0.00 37.83 32.74 1n4c s LYS 67 CO 0.00 -2.87 0.03 0.41 -0.92 0.00 0.00 175.35 172.00 1n4c n GLY 68 N 6.02 -2.33 2.57 -3.33 0.00 -1.25 -4.99 105.19 101.88 1n4c n GLY 68 Ca 0.25 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 1n4c n GLY 68 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1n4c n PRO 69 N -1.56 -0.13 -3.32 1.61 -0.02 -1.26 -5.02 135.00 125.30 1n4c n PRO 69 Ca 0.00 -0.42 -0.11 0.00 -2.02 0.00 0.00 63.50 60.95 1n4c n PRO 69 Cb 0.02 -1.15 -0.06 0.00 -0.02 0.00 0.00 33.50 32.28 1n4c n PRO 69 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1n4c s ARG 70 N -2.77 0.51 -0.10 -0.52 0.52 -1.26 -5.12 118.95 110.22 1n4c s ARG 70 Ca 0.19 -0.23 -0.01 0.00 -0.52 0.00 0.00 55.73 55.16 1n4c s ARG 70 Cb -0.03 -0.42 0.03 0.00 0.52 0.00 0.00 34.95 35.05 1n4c s ARG 70 CO 0.16 -1.10 -0.01 0.95 0.02 0.00 0.00 175.30 175.32 1n4c s THR 71 N 2.13 0.56 -1.55 0.02 -4.23 -1.26 -4.98 115.64 106.32 1n4c s THR 71 Ca 0.12 -0.06 0.09 0.00 -1.18 0.00 0.00 61.69 60.67 1n4c s THR 71 Cb -0.12 -0.72 0.18 0.00 1.34 0.00 0.00 72.50 73.18 1n4c s THR 71 CO -0.20 0.24 1.13 -0.38 -0.54 0.00 0.00 174.62 174.86 1n4c n ILE 72 N 5.08 0.63 0.84 2.99 2.08 -1.26 -1.95 119.36 127.78 1n4c n ILE 72 Ca -0.09 0.16 0.13 0.00 0.56 0.00 0.00 62.75 63.51 1n4c n ILE 72 Cb 0.50 -1.01 0.33 0.00 -0.75 0.00 0.00 39.64 38.71 1n4c n ILE 72 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1n4c n ALA 73 N -1.22 2.96 0.01 -1.39 0.00 -1.26 -4.08 120.51 115.53 1n4c n ALA 73 Ca 0.05 -0.23 -0.18 0.00 0.00 0.00 0.00 53.44 53.08 1n4c n ALA 73 Cb 0.06 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.12 1n4c n ALA 73 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1n4c h GLU 74 N 0.00 0.22 -0.64 0.00 4.81 -1.83 -3.28 114.58 113.86 1n4c h GLU 74 Ca 0.00 -0.36 0.13 0.00 -0.13 0.00 0.00 59.36 59.00 1n4c h GLU 74 Cb 0.59 0.13 -0.09 0.00 0.63 0.00 0.00 28.75 30.01 1n4c h GLU 74 CO 0.00 1.16 0.12 0.00 -0.73 0.00 0.00 179.01 179.57 1n4c h MET 75 N -0.54 0.24 0.00 1.92 -0.00 -1.75 0.82 114.93 115.62 1n4c h MET 75 Ca -0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.59 1n4c h MET 75 Cb 1.44 -0.05 0.00 0.00 -0.00 0.00 0.00 31.60 32.99 1n4c h MET 75 CO 0.11 0.16 0.00 0.54 -0.00 0.00 0.00 176.91 177.71 1n4c n ARG 76 N -5.16 0.18 -0.15 -0.10 1.74 -1.25 -2.89 116.66 109.03 1n4c n ARG 76 Ca 0.10 0.16 0.01 0.00 -0.77 0.00 0.00 57.85 57.35 1n4c n ARG 76 Cb 0.36 -1.50 0.28 0.00 -1.02 0.00 0.00 32.46 30.58 1n4c n ARG 76 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1n4c h LYS 77 N 0.00 0.85 0.09 5.56 3.64 0.63 -2.57 116.57 124.77 1n4c h LYS 77 Ca 0.00 -0.07 -0.28 0.00 -1.27 0.00 0.00 60.65 59.03 1n4c h LYS 77 Cb 0.11 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1n4c h LYS 77 CO 0.00 0.60 -1.33 1.49 -2.27 0.00 0.00 179.45 177.94 1n4c h GLU 78 N 0.86 0.20 -1.13 1.90 4.81 -1.67 -3.28 114.58 116.27 1n4c h GLU 78 Ca 0.22 -0.34 0.32 0.00 -0.13 0.00 0.00 59.36 59.43 1n4c h GLU 78 Cb -0.02 0.13 -0.06 0.00 0.63 0.00 0.00 28.75 29.42 1n4c h GLU 78 CO -0.04 1.10 0.78 0.93 -0.73 0.00 0.00 179.01 181.05 1n4c h GLU 79 N 0.05 0.13 -0.14 1.92 5.08 -1.59 0.61 114.58 120.64 1n4c h GLU 79 Ca -0.16 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.23 1n4c h GLU 79 Cb 1.95 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.17 1n4c h GLU 79 CO 0.17 0.08 0.52 0.52 -1.00 0.00 0.00 179.01 179.30 1n4c h MET 80 N 0.13 0.00 -0.13 2.33 2.86 -1.61 1.77 114.93 120.29 1n4c h MET 80 Ca 0.57 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.21 1n4c h MET 80 Cb 2.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.66 1n4c h MET 80 CO -0.11 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.86 1n4c n ALA 81 N -1.94 2.52 0.11 6.32 0.00 0.21 -3.75 120.51 123.98 1n4c n ALA 81 Ca 0.02 -0.57 -0.21 0.00 0.00 0.00 0.00 53.44 52.68 1n4c n ALA 81 Cb 0.60 -1.06 -0.13 0.00 0.00 0.00 0.00 19.45 18.85 1n4c n ALA 81 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1n4c h LYS 82 N 2.79 0.52 -0.45 0.00 1.79 0.26 -3.44 116.57 118.03 1n4c h LYS 82 Ca 0.00 -0.75 -0.04 0.00 -2.18 0.00 0.00 60.65 57.68 1n4c h LYS 82 Cb 0.60 0.26 -0.15 0.00 -1.58 0.00 0.00 32.23 31.36 1n4c h LYS 82 CO 0.00 1.34 -0.24 -2.00 -1.08 0.00 0.00 179.45 177.47 1n4c s GLU 83 N -2.85 0.49 -0.87 3.15 2.12 -1.25 -5.03 118.70 114.46 1n4c s GLU 83 Ca -0.08 -0.48 -0.03 0.00 0.36 0.00 0.00 54.97 54.74 1n4c s GLU 83 Cb 0.06 -0.02 0.23 0.00 0.26 0.00 0.00 34.13 34.66 1n4c s GLU 83 CO 0.92 -0.60 2.23 -0.12 -0.54 0.00 0.00 175.26 177.14 1n4c n MET 84 N 2.72 3.59 -1.56 4.30 1.56 -1.25 -4.90 117.12 121.58 1n4c n MET 84 Ca 0.14 -3.49 -0.46 0.00 -0.27 0.00 0.00 57.70 53.62 1n4c n MET 84 Cb 0.62 -2.34 -0.02 0.00 2.15 0.00 0.00 33.22 33.62 1n4c n MET 84 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1n4c n ASP 85 N 0.28 1.00 0.23 6.12 2.03 -1.26 -4.37 116.55 120.58 1n4c n ASP 85 Ca 0.52 1.16 0.05 0.00 0.52 0.00 0.00 54.79 57.04 1n4c n ASP 85 Cb 0.32 -1.23 0.07 0.00 -0.72 0.00 0.00 41.12 39.56 1n4c n ASP 85 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1n4c n PRO 86 N 1.04 0.03 -0.01 -0.67 -0.02 -1.26 0.21 135.00 134.31 1n4c n PRO 86 Ca 0.12 0.92 -0.06 0.00 -2.02 0.00 0.00 63.50 62.46 1n4c n PRO 86 Cb 0.29 -2.44 -0.12 0.00 -0.02 0.00 0.00 33.50 31.20 1n4c n PRO 86 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1n4c n GLU 87 N -2.53 0.63 0.09 -0.52 4.07 -1.26 -3.89 120.64 117.23 1n4c n GLU 87 Ca 0.04 0.26 -0.05 0.00 -0.06 0.00 0.00 57.16 57.34 1n4c n GLU 87 Cb 1.04 -1.78 0.00 0.00 -0.06 0.00 0.00 31.44 30.64 1n4c n GLU 87 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1n4c h LYS 88 N 0.00 0.03 -0.72 5.31 1.57 0.23 -3.05 116.57 119.94 1n4c h LYS 88 Ca -0.26 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1n4c h LYS 88 Cb 1.90 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 34.17 1n4c h LYS 88 CO 0.07 0.85 0.48 1.25 -0.57 0.00 0.00 179.45 181.53 1n4c h LEU 89 N 0.02 0.47 -1.68 2.94 5.85 -1.48 0.16 115.31 121.59 1n4c h LEU 89 Ca -0.02 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.76 1n4c h LEU 89 Cb 1.48 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1n4c h LEU 89 CO 0.11 0.27 0.28 0.50 -0.34 0.00 0.00 178.44 179.26 1n4c h LYS 90 N 0.51 0.40 0.05 1.25 3.64 -1.68 -2.35 116.57 118.40 1n4c h LYS 90 Ca 0.34 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1n4c h LYS 90 Cb 0.63 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1n4c h LYS 90 CO -0.11 0.27 -0.02 0.82 -2.27 0.00 0.00 179.45 178.13 1n4c h ILE 91 N 0.41 1.19 -0.97 2.00 2.04 -0.82 -2.36 117.51 119.00 1n4c h ILE 91 Ca 0.17 -0.79 0.28 0.00 1.00 0.00 0.00 64.86 65.52 1n4c h ILE 91 Cb 0.18 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 1n4c h ILE 91 CO -0.04 0.20 0.73 -0.07 0.00 0.00 0.00 178.15 178.97 1n4c h LEU 92 N -0.42 0.00 0.00 1.44 3.38 -1.33 0.60 115.31 118.98 1n4c h LEU 92 Ca -0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 1n4c h LEU 92 Cb 0.38 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1n4c h LEU 92 CO 0.01 0.00 -1.07 -0.33 0.09 0.00 0.00 178.44 177.14 1n4c h GLU 93 N 0.00 0.00 -0.12 1.13 5.08 -1.31 -3.02 114.58 116.34 1n4c h GLU 93 Ca 0.46 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.67 1n4c h GLU 93 Cb 1.92 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.17 1n4c h GLU 93 CO -0.00 0.89 -0.52 2.35 -1.00 0.00 0.00 179.01 180.72 1n4c h TRP 94 N 0.00 0.76 -0.23 4.33 7.01 0.66 -3.11 115.95 125.38 1n4c h TRP 94 Ca -0.05 -0.33 -0.13 0.00 2.11 0.00 0.00 58.89 60.49 1n4c h TRP 94 Cb 1.78 -0.12 -0.00 0.00 -2.10 0.00 0.00 29.16 28.71 1n4c h TRP 94 CO 0.00 1.11 -0.38 -0.84 -2.79 0.00 0.00 178.44 175.54 1n4c h ILE 95 N 0.20 1.32 0.00 2.65 3.07 -1.34 -2.88 117.51 120.53 1n4c h ILE 95 Ca -0.03 -1.59 0.00 0.00 1.55 0.00 0.00 64.86 64.79 1n4c h ILE 95 Cb 1.16 1.78 0.00 0.00 -0.27 0.00 0.00 36.82 39.49 1n4c h ILE 95 CO 0.11 0.50 0.00 -1.84 -1.05 0.00 0.00 178.15 175.87 1n4c n GLU 96 N -4.24 0.07 -0.02 0.16 0.28 -1.14 -2.01 120.64 113.73 1n4c n GLU 96 Ca -0.05 0.26 -0.16 0.00 -0.16 0.00 0.00 57.16 57.05 1n4c n GLU 96 Cb 0.52 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.80 1n4c n GLU 96 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1n4c h GLY 97 N 1.69 0.52 -5.00 -1.84 0.00 -1.43 -3.43 103.07 93.57 1n4c h GLY 97 Ca 0.00 -0.75 -0.11 0.00 0.00 0.00 0.00 47.33 46.47 1n4c h GLY 97 CO 0.00 0.67 -0.21 0.58 0.00 0.00 0.00 176.54 177.58 1n4c n LYS 98 N -4.27 0.34 0.00 4.80 2.85 -1.00 -4.99 118.16 115.89 1n4c n LYS 98 Ca -0.08 -1.08 0.00 0.00 -1.05 0.00 0.00 58.31 56.09 1n4c n LYS 98 Cb 0.59 -0.63 0.00 0.00 -0.65 0.00 0.00 35.03 34.34 1n4c n LYS 98 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1n4c n GLU 99 N 1.73 0.77 -1.17 -1.58 0.00 -0.85 -2.74 120.64 116.80 1n4c n GLU 99 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.24 1n4c n GLU 99 Cb 0.67 -1.15 0.02 0.00 0.00 0.00 0.00 31.44 30.97 1n4c n GLU 99 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1n4c n ARG 100 N 0.54 0.01 -3.18 3.44 0.00 -1.26 -4.69 116.66 111.52 1n4c n ARG 100 Ca 0.00 -1.69 -0.21 0.00 -0.00 0.00 0.00 57.85 55.95 1n4c n ARG 100 Cb 0.36 -0.18 -0.05 0.00 0.00 0.00 0.00 32.46 32.60 1n4c n ARG 100 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1n4c n ASN 101 N 0.32 0.44 -0.36 6.15 5.15 -1.11 -4.97 115.26 120.89 1n4c n ASN 101 Ca 0.04 -2.86 0.29 0.00 -0.60 0.00 0.00 54.58 51.45 1n4c n ASN 101 Cb 1.00 -0.59 0.55 0.00 -0.53 0.00 0.00 39.78 40.21 1n4c n ASN 101 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1n4c h ILE 102 N 1.53 0.22 -0.84 -1.44 -0.00 -1.87 0.41 117.51 115.52 1n4c h ILE 102 Ca 0.08 -0.07 0.15 0.00 -0.00 0.00 0.00 64.86 65.02 1n4c h ILE 102 Cb 0.93 -0.01 -0.09 0.00 -0.00 0.00 0.00 36.82 37.64 1n4c h ILE 102 CO 0.48 0.04 0.43 0.08 -0.00 0.00 0.00 178.15 179.17 1n4c h ARG 103 N 0.21 0.60 0.23 2.19 0.11 -1.97 -2.35 114.38 113.40 1n4c h ARG 103 Ca 0.77 -0.04 -0.34 0.00 0.10 0.00 0.00 59.98 60.47 1n4c h ARG 103 Cb 2.01 -0.13 0.03 0.00 1.11 0.00 0.00 29.97 32.99 1n4c h ARG 103 CO -0.56 0.40 -1.55 0.00 0.10 0.00 0.00 179.97 178.36 1n4c h ALA 104 N 1.56 -0.06 -0.50 0.08 0.00 -0.59 -3.13 119.26 116.62 1n4c h ALA 104 Ca 0.46 -0.94 0.09 0.00 0.00 0.00 0.00 54.91 54.52 1n4c h ALA 104 Cb 0.65 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 1n4c h ALA 104 CO -0.36 0.80 0.08 -0.07 0.00 0.00 0.00 179.25 179.70 1n4c h LEU 105 N 0.13 -0.05 -0.96 0.00 3.38 -0.88 0.75 115.31 117.69 1n4c h LEU 105 Ca -0.27 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1n4c h LEU 105 Cb 2.14 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 43.03 1n4c h LEU 105 CO 0.25 0.00 -0.14 0.17 0.09 0.00 0.00 178.44 178.81 1n4c h LEU 106 N 0.20 0.00 -2.65 1.67 8.10 -1.59 -2.29 115.31 118.75 1n4c h LEU 106 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.24 1n4c h LEU 106 Cb 0.35 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.57 1n4c h LEU 106 CO -0.35 0.14 0.00 -0.24 -4.11 0.00 0.00 178.44 173.88 1n4c n SER 107 N -3.23 3.86 -0.10 0.17 2.88 0.18 -4.14 113.62 113.24 1n4c n SER 107 Ca 0.01 -2.00 0.01 0.00 -1.33 0.00 0.00 58.87 55.56 1n4c n SER 107 Cb 0.43 -0.44 0.01 0.00 -0.75 0.00 0.00 64.21 63.46 1n4c n SER 107 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1n4c n THR 108 N 1.63 0.35 0.06 2.46 -2.24 0.24 -4.55 114.28 112.23 1n4c n THR 108 Ca 0.23 -0.38 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 1n4c n THR 108 Cb 0.62 0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 69.54 1n4c n THR 108 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1n4c h MET 109 N 0.00 0.41 -0.44 -0.78 -1.53 -1.58 -3.17 114.93 107.83 1n4c h MET 109 Ca 0.00 -0.39 0.13 0.00 -3.44 0.00 0.00 59.70 56.00 1n4c h MET 109 Cb 0.97 0.10 -0.02 0.00 -0.55 0.00 0.00 31.60 32.10 1n4c h MET 109 CO 0.00 1.04 0.52 1.12 0.14 0.00 0.00 176.91 179.73 1n4c h HIS 110 N 0.25 0.00 0.00 1.39 2.07 -1.87 0.68 115.15 117.67 1n4c h HIS 110 Ca -0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 1n4c h HIS 110 Cb 1.45 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.43 1n4c h HIS 110 CO 0.05 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.16 1n4c n THR 111 N -3.59 0.00 -2.15 6.12 -2.24 -1.20 -3.48 114.28 107.74 1n4c n THR 111 Ca 0.08 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1n4c n THR 111 Cb 0.70 -0.33 -0.01 0.00 -2.10 0.00 0.00 70.33 68.59 1n4c n THR 111 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1n4c n VAL 112 N -0.74 0.00 -2.27 2.28 0.24 0.24 -5.00 118.33 113.08 1n4c n VAL 112 Ca 0.09 -0.30 -0.26 0.00 -2.04 0.00 0.00 64.34 61.83 1n4c n VAL 112 Cb 0.04 0.55 0.14 0.00 -1.47 0.00 0.00 33.84 33.10 1n4c n VAL 112 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1n4c s LEU 113 N 0.00 2.85 0.04 1.34 1.43 -1.12 -4.94 118.68 118.28 1n4c s LEU 113 Ca 0.10 -0.03 -0.19 0.00 -1.03 0.00 0.00 54.13 52.99 1n4c s LEU 113 Cb 0.12 -2.20 -0.06 0.00 0.03 0.00 0.00 46.19 44.08 1n4c s LEU 113 CO -0.05 -2.23 0.54 -1.66 0.23 0.00 0.00 176.35 173.18 1n4c s TRP 114 N -3.48 3.77 -0.15 0.29 -2.14 -1.26 -4.99 118.94 110.98 1n4c s TRP 114 Ca 0.69 1.20 -0.31 0.00 2.66 0.00 0.00 56.10 60.35 1n4c s TRP 114 Cb -0.05 -2.48 -0.08 0.00 -3.10 0.00 0.00 33.47 27.76 1n4c s TRP 114 CO 0.48 0.55 2.10 0.00 -2.66 0.00 0.00 176.95 177.43 1n4c n ALA 115 N 1.93 1.48 0.00 2.67 0.00 -1.26 -3.08 120.51 122.25 1n4c n ALA 115 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1n4c n ALA 115 Cb 0.51 -2.74 0.00 0.00 0.00 0.00 0.00 19.45 17.22 1n4c n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n4c n GLY 116 N 5.35 2.78 3.61 0.00 0.00 -1.26 -5.09 105.19 110.58 1n4c n GLY 116 Ca 0.28 -0.35 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 1n4c n GLY 116 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n4c n GLU 117 N 0.00 2.12 -0.04 1.61 4.07 -1.18 -4.78 120.64 122.43 1n4c n GLU 117 Ca 0.00 0.67 0.02 0.00 -0.06 0.00 0.00 57.16 57.79 1n4c n GLU 117 Cb 0.00 -3.01 0.04 0.00 -0.06 0.00 0.00 31.44 28.41 1n4c n GLU 117 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1n4c n THR 118 N 6.78 0.82 -0.08 6.31 -2.24 -1.26 -4.60 114.28 120.01 1n4c n THR 118 Ca 0.28 -0.91 -0.09 0.00 -2.27 0.00 0.00 64.05 61.06 1n4c n THR 118 Cb 0.39 0.60 -0.16 0.00 -2.10 0.00 0.00 70.33 69.07 1n4c n THR 118 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1n4c n LYS 119 N -0.14 0.68 -1.80 -0.78 5.02 -1.26 -4.93 118.16 114.95 1n4c n LYS 119 Ca 0.03 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.94 1n4c n LYS 119 Cb 0.26 -1.57 -0.03 0.00 -0.02 0.00 0.00 35.03 33.67 1n4c n LYS 119 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1n4c s TRP 120 N -2.56 2.91 -0.43 2.13 -0.11 -1.26 -4.97 118.94 114.66 1n4c s TRP 120 Ca -0.09 0.53 0.02 0.00 1.22 0.00 0.00 56.10 57.78 1n4c s TRP 120 Cb 0.07 -4.07 0.12 0.00 -1.50 0.00 0.00 33.47 28.09 1n4c s TRP 120 CO 0.83 -3.89 0.17 0.15 -4.62 0.00 0.00 176.95 169.59 1n4c s LYS 121 N 0.71 1.83 0.08 5.86 1.02 -1.26 -5.08 119.74 122.89 1n4c s LYS 121 Ca 0.70 -2.10 -0.21 0.00 0.02 0.00 0.00 55.97 54.39 1n4c s LYS 121 Cb -0.48 -3.38 -0.11 0.00 -0.52 0.00 0.00 37.83 33.34 1n4c s LYS 121 CO 0.36 -1.03 0.46 -2.30 -0.92 0.00 0.00 175.35 171.92 1n4c n PRO 122 N 4.00 0.00 -2.86 -1.68 -0.02 -1.26 -4.85 135.00 128.33 1n4c n PRO 122 Ca 0.03 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.10 1n4c n PRO 122 Cb 0.39 -0.75 -0.04 0.00 -0.02 0.00 0.00 33.50 33.08 1n4c n PRO 122 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1n4c s VAL 123 N -0.38 4.88 0.01 -1.45 1.01 -1.26 -4.99 120.40 118.22 1n4c s VAL 123 Ca 0.47 1.70 -0.30 0.00 0.00 0.00 0.00 61.98 63.85 1n4c s VAL 123 Cb -0.67 -4.16 -0.07 0.00 0.00 0.00 0.00 36.38 31.47 1n4c s VAL 123 CO 0.35 0.05 1.74 -0.83 0.00 0.00 0.00 175.10 176.41 1n4c s GLY 124 N 1.11 1.52 0.63 4.51 0.00 -1.26 -4.79 107.32 109.03 1n4c s GLY 124 Ca 0.40 1.13 0.17 0.00 0.00 0.00 0.00 44.72 46.43 1n4c s GLY 124 CO 0.14 3.10 1.33 -0.33 0.00 0.00 0.00 173.10 177.35 1n4c h MET 125 N 9.40 0.00 0.00 2.90 2.86 -1.94 2.86 114.93 131.01 1n4c h MET 125 Ca -0.43 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1n4c h MET 125 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1n4c h MET 125 CO 0.94 0.00 -0.07 0.00 1.06 0.00 0.00 176.91 178.84 1n4c n ALA 126 N -1.93 2.42 -0.29 6.32 0.00 -1.26 -3.55 120.51 122.22 1n4c n ALA 126 Ca 0.10 -0.09 -0.14 0.00 0.00 0.00 0.00 53.44 53.31 1n4c n ALA 126 Cb 1.09 -1.43 0.10 0.00 0.00 0.00 0.00 19.45 19.21 1n4c n ALA 126 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1n4c n ASP 127 N -1.87 3.54 -2.39 0.00 8.00 0.96 -4.07 116.55 120.72 1n4c n ASP 127 Ca 0.06 -2.92 -0.01 0.00 0.71 0.00 0.00 54.79 52.63 1n4c n ASP 127 Cb 0.39 -0.71 0.05 0.00 -0.02 0.00 0.00 41.12 40.83 1n4c n ASP 127 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n4c n LEU 128 N -0.41 0.42 -0.08 0.64 -0.00 -1.23 -4.76 117.00 111.57 1n4c n LEU 128 Ca 0.34 -2.80 0.15 0.00 -0.00 0.00 0.00 56.01 53.69 1n4c n LEU 128 Cb 1.15 0.25 0.73 0.00 -0.00 0.00 0.00 43.42 45.54 1n4c n LEU 128 CO 0.35 1.17 0.97 1.33 -0.00 0.00 0.00 177.39 181.21 1n4c n VAL 129 N -0.61 0.00 -3.97 1.47 0.24 -1.26 -4.83 118.33 109.37 1n4c n VAL 129 Ca -0.03 -0.04 -0.09 0.00 -2.04 0.00 0.00 64.34 62.14 1n4c n VAL 129 Cb 0.87 -0.26 -0.10 0.00 -1.47 0.00 0.00 33.84 32.88 1n4c n VAL 129 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1n4c s THR 130 N -2.36 0.13 0.38 3.34 -4.23 -1.26 -4.95 115.64 106.69 1n4c s THR 130 Ca 0.34 -1.06 0.05 0.00 -1.18 0.00 0.00 61.69 59.85 1n4c s THR 130 Cb 0.21 -0.60 0.24 0.00 1.34 0.00 0.00 72.50 73.68 1n4c s THR 130 CO 0.44 -0.58 2.00 1.55 -0.54 0.00 0.00 174.62 177.49 1n4c h PRO 131 N 4.17 0.60 -0.42 3.99 0.13 -1.95 -1.50 132.00 137.02 1n4c h PRO 131 Ca -0.32 -0.06 0.08 0.00 -0.87 0.00 0.00 66.00 64.83 1n4c h PRO 131 Cb 1.19 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 1n4c h PRO 131 CO 0.47 0.45 0.29 1.49 -0.23 0.00 0.00 178.00 180.47 1n4c h GLU 132 N 0.60 0.20 -0.04 0.86 4.81 -1.99 0.25 114.58 119.28 1n4c h GLU 132 Ca 0.15 -0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.18 1n4c h GLU 132 Cb 0.04 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1n4c h GLU 132 CO -0.02 0.13 -0.79 1.96 -0.73 0.00 0.00 179.01 179.56 1n4c h GLN 133 N 0.20 0.31 0.09 1.92 1.08 -1.60 -2.80 115.11 114.31 1n4c h GLN 133 Ca 0.19 -0.28 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 1n4c h GLN 133 Cb 0.50 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 1n4c h GLN 133 CO -0.03 0.95 -0.04 0.28 -0.95 0.00 0.00 178.83 179.03 1n4c h VAL 134 N 0.20 0.41 -0.95 -0.54 2.07 -0.68 -2.89 116.25 113.85 1n4c h VAL 134 Ca -0.04 -1.17 0.17 0.00 0.82 0.00 0.00 66.70 66.48 1n4c h VAL 134 Cb 1.38 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 31.81 1n4c h VAL 134 CO 0.13 0.13 0.60 0.50 0.02 0.00 0.00 177.57 178.95 1n4c h LYS 135 N -1.01 0.67 -0.39 1.57 3.64 -0.77 0.87 116.57 121.16 1n4c h LYS 135 Ca -0.01 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 1n4c h LYS 135 Cb 0.30 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1n4c h LYS 135 CO 0.02 0.45 -0.14 -0.22 -2.27 0.00 0.00 179.45 177.29 1n4c h LYS 136 N 0.70 0.79 0.04 1.90 3.64 -1.60 -3.20 116.57 118.83 1n4c h LYS 136 Ca 0.51 -0.32 -0.24 0.00 -1.27 0.00 0.00 60.65 59.32 1n4c h LYS 136 Cb 0.86 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 1n4c h LYS 136 CO -0.27 0.94 -1.19 0.28 -2.27 0.00 0.00 179.45 176.94 1n4c h VAL 137 N 0.59 1.52 -0.84 2.00 2.07 -0.95 -3.26 116.25 117.38 1n4c h VAL 137 Ca 0.09 -3.20 0.24 0.00 0.82 0.00 0.00 66.70 64.65 1n4c h VAL 137 Cb 0.68 2.81 -0.03 0.00 -1.52 0.00 0.00 31.29 33.23 1n4c h VAL 137 CO 0.05 0.89 0.68 0.22 0.02 0.00 0.00 177.57 179.42 1n4c h TYR 138 N 0.02 0.00 0.42 1.57 3.20 0.72 0.17 116.97 123.08 1n4c h TYR 138 Ca -0.09 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 1n4c h TYR 138 Cb 1.87 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.14 1n4c h TYR 138 CO 0.02 0.00 -0.20 0.00 -1.64 0.00 0.00 178.16 176.34 1n4c h ARG 139 N 0.00 -0.55 -0.68 1.82 3.08 -1.62 -2.62 114.38 113.80 1n4c h ARG 139 Ca 0.40 0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.60 1n4c h ARG 139 Cb 1.75 0.12 -0.08 0.00 0.08 0.00 0.00 29.97 31.84 1n4c h ARG 139 CO -0.00 -0.33 0.26 0.87 -1.07 0.00 0.00 179.97 179.69 1n4c h LYS 140 N -1.13 0.41 -0.99 0.04 1.57 -1.37 0.19 116.57 115.30 1n4c h LYS 140 Ca -0.06 -0.02 0.15 0.00 -1.87 0.00 0.00 60.65 58.84 1n4c h LYS 140 Cb 0.47 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.60 1n4c h LYS 140 CO 0.10 0.27 0.62 0.00 -0.57 0.00 0.00 179.45 179.87 1n4c h ALA 141 N 1.48 1.61 -0.18 3.86 0.00 -1.06 0.20 119.26 125.17 1n4c h ALA 141 Ca 0.36 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.18 1n4c h ALA 141 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1n4c h ALA 141 CO -0.36 0.10 -0.43 0.28 0.00 0.00 0.00 179.25 178.84 1n4c h VAL 142 N 0.89 1.31 0.00 0.00 2.07 -0.28 -2.50 116.25 117.74 1n4c h VAL 142 Ca 0.52 -1.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1n4c h VAL 142 Cb 0.65 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1n4c h VAL 142 CO -0.29 0.50 -0.07 -0.07 0.02 0.00 0.00 177.57 177.65 1n4c h LEU 143 N 0.36 0.00 -1.57 2.57 3.38 0.75 -0.93 115.31 119.88 1n4c h LEU 143 Ca 0.03 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1n4c h LEU 143 Cb 0.91 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1n4c h LEU 143 CO 0.08 0.07 -0.14 0.58 0.09 0.00 0.00 178.44 179.12 1n4c h VAL 144 N 0.00 1.14 -0.36 1.22 2.07 -0.88 -2.84 116.25 116.60 1n4c h VAL 144 Ca -0.00 -0.64 -0.22 0.00 0.82 0.00 0.00 66.70 66.66 1n4c h VAL 144 Cb 0.13 1.25 -0.14 0.00 -1.52 0.00 0.00 31.29 31.01 1n4c h VAL 144 CO 0.01 0.19 -0.26 1.33 0.02 0.00 0.00 177.57 178.86 1n4c n VAL 145 N -4.32 2.52 -2.16 2.57 0.24 -0.40 -4.96 118.33 111.82 1n4c n VAL 145 Ca -0.02 -3.13 -0.42 0.00 -2.04 0.00 0.00 64.34 58.74 1n4c n VAL 145 Cb 0.24 -0.47 -0.03 0.00 -1.47 0.00 0.00 33.84 32.11 1n4c n VAL 145 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1n4c s HIS 146 N -3.34 3.24 0.15 6.34 5.04 -0.92 -4.86 115.29 120.94 1n4c s HIS 146 Ca 0.45 0.95 -0.17 0.00 -1.54 0.00 0.00 55.06 54.75 1n4c s HIS 146 Cb 0.40 -3.69 0.10 0.00 0.04 0.00 0.00 32.58 29.43 1n4c s HIS 146 CO -0.02 -2.41 1.16 -2.30 -2.34 0.00 0.00 174.74 168.84 1n4c n PRO 147 N 3.89 -0.23 -0.32 2.88 -0.02 -1.26 -0.20 135.00 139.73 1n4c n PRO 147 Ca 0.11 1.15 0.29 0.00 -2.02 0.00 0.00 63.50 63.03 1n4c n PRO 147 Cb 0.42 -1.70 0.55 0.00 -0.02 0.00 0.00 33.50 32.75 1n4c n PRO 147 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1n4c h ASP 148 N 0.00 0.35 0.46 2.55 3.04 -1.98 2.06 116.42 122.89 1n4c h ASP 148 Ca 0.21 0.24 0.00 0.00 -3.24 0.00 0.00 57.03 54.24 1n4c h ASP 148 Cb 0.40 0.24 0.00 0.00 -1.04 0.00 0.00 39.33 38.93 1n4c h ASP 148 CO -0.73 -0.35 -0.16 0.29 -2.04 0.00 0.00 179.24 176.25 1n4c n LYS 149 N -5.21 0.51 -1.70 4.15 5.02 0.72 -3.69 118.16 117.96 1n4c n LYS 149 Ca 0.36 -0.19 -0.08 0.00 -2.02 0.00 0.00 58.31 56.38 1n4c n LYS 149 Cb 1.18 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 34.78 1n4c n LYS 149 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n4c n ALA 150 N -1.08 3.91 -2.55 7.82 0.00 0.68 -4.88 120.51 124.41 1n4c n ALA 150 Ca 0.12 -3.31 -0.42 0.00 0.00 0.00 0.00 53.44 49.83 1n4c n ALA 150 Cb 0.30 -0.47 -0.08 0.00 0.00 0.00 0.00 19.45 19.20 1n4c n ALA 150 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1n4c s THR 151 N -3.55 4.98 -1.19 0.00 2.01 -0.26 -4.24 115.64 113.39 1n4c s THR 151 Ca 0.41 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.69 1n4c s THR 151 Cb 0.38 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.87 1n4c s THR 151 CO -0.03 -0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.20 1n4c n GLY 152 N 4.84 0.14 3.88 4.40 0.00 -1.26 -4.93 105.19 112.26 1n4c n GLY 152 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1n4c n GLY 152 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n4c s GLN 153 N -4.31 3.63 0.39 1.61 -1.52 -1.26 -4.93 119.66 113.27 1n4c s GLN 153 Ca 0.00 -0.00 0.32 0.00 -1.95 0.00 0.00 55.36 53.72 1n4c s GLN 153 Cb 0.00 -3.07 1.28 0.00 -0.22 0.00 0.00 33.01 31.01 1n4c s GLN 153 CO 0.00 0.63 1.27 -2.30 -0.25 0.00 0.00 175.29 174.64 1n4c n PRO 154 N 1.11 -0.02 -1.04 2.91 -0.02 -1.26 0.28 135.00 136.96 1n4c n PRO 154 Ca -0.11 0.97 -0.10 0.00 -2.02 0.00 0.00 63.50 62.24 1n4c n PRO 154 Cb 0.53 -2.02 0.26 0.00 -0.02 0.00 0.00 33.50 32.25 1n4c n PRO 154 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1n4c n TYR 155 N -4.04 2.45 -0.34 6.00 0.18 -1.26 -4.58 117.16 115.57 1n4c n TYR 155 Ca 0.34 -1.41 0.02 0.00 1.88 0.00 0.00 57.90 58.73 1n4c n TYR 155 Cb 1.41 -0.73 0.18 0.00 -0.38 0.00 0.00 39.34 39.82 1n4c n TYR 155 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 1n4c h GLU 156 N 2.03 1.14 -0.43 -3.48 4.81 0.39 -2.14 114.58 116.89 1n4c h GLU 156 Ca 0.35 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.40 1n4c h GLU 156 Cb 2.39 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 31.50 1n4c h GLU 156 CO 0.79 0.75 -0.18 0.37 -0.73 0.00 0.00 179.01 180.01 1n4c h GLN 157 N 1.17 0.84 -0.56 1.92 4.15 -1.81 -3.05 115.11 117.77 1n4c h GLN 157 Ca 0.39 -0.32 0.11 0.00 0.77 0.00 0.00 58.65 59.60 1n4c h GLN 157 Cb 0.06 -0.05 -0.09 0.00 0.21 0.00 0.00 27.48 27.61 1n4c h GLN 157 CO -0.13 0.96 -0.01 1.88 -1.93 0.00 0.00 178.83 179.60 1n4c h TYR 158 N 0.74 -0.05 -0.19 3.99 -1.99 -1.72 -1.94 116.97 115.80 1n4c h TYR 158 Ca 0.11 0.04 0.05 0.00 2.00 0.00 0.00 58.73 60.93 1n4c h TYR 158 Cb 0.70 0.11 -0.07 0.00 2.00 0.00 0.00 36.73 39.47 1n4c h TYR 158 CO 0.04 -0.15 -0.35 0.00 -0.00 0.00 0.00 178.16 177.71 1n4c h ALA 159 N 1.51 -0.38 -0.54 3.88 0.00 -1.51 0.50 119.26 122.72 1n4c h ALA 159 Ca 0.29 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.36 1n4c h ALA 159 Cb 0.45 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1n4c h ALA 159 CO -0.48 -0.81 0.38 0.87 0.00 0.00 0.00 179.25 179.20 1n4c h LYS 160 N -0.39 0.16 0.10 0.00 1.57 -1.45 1.45 116.57 118.01 1n4c h LYS 160 Ca 0.11 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1n4c h LYS 160 Cb 0.56 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1n4c h LYS 160 CO -0.41 0.10 -0.05 0.52 -0.57 0.00 0.00 179.45 179.05 1n4c h MET 161 N 0.16 -0.13 0.00 3.15 2.86 -0.54 -3.19 114.93 117.24 1n4c h MET 161 Ca 0.26 0.01 -0.15 0.00 -2.06 0.00 0.00 59.70 57.75 1n4c h MET 161 Cb 0.80 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.47 1n4c h MET 161 CO -0.04 0.39 -0.74 -0.84 1.06 0.00 0.00 176.91 176.75 1n4c h ILE 162 N -0.82 1.30 -0.06 -1.22 3.07 -0.67 -2.91 117.51 116.20 1n4c h ILE 162 Ca -0.01 -2.74 -0.00 0.00 1.55 0.00 0.00 64.86 63.65 1n4c h ILE 162 Cb 0.58 2.58 -0.00 0.00 -0.27 0.00 0.00 36.82 39.70 1n4c h ILE 162 CO 0.02 0.72 0.02 0.15 -1.05 0.00 0.00 178.15 178.02 1n4c h PHE 163 N 0.00 0.09 -0.15 0.16 3.04 0.19 -1.49 116.94 118.78 1n4c h PHE 163 Ca -0.01 -0.01 -0.16 0.00 3.98 0.00 0.00 57.97 61.78 1n4c h PHE 163 Cb 1.52 -0.03 0.01 0.00 2.56 0.00 0.00 35.95 40.01 1n4c h PHE 163 CO 0.00 0.23 -0.52 0.52 -2.02 0.00 0.00 178.31 176.52 1n4c h MET 164 N -0.07 0.61 -0.81 1.11 2.86 -1.66 -2.89 114.93 114.09 1n4c h MET 164 Ca 0.02 -0.46 0.06 0.00 -2.06 0.00 0.00 59.70 57.26 1n4c h MET 164 Cb 0.17 0.08 -0.06 0.00 0.06 0.00 0.00 31.60 31.86 1n4c h MET 164 CO -0.00 1.08 0.50 0.93 1.06 0.00 0.00 176.91 180.48 1n4c h GLU 165 N 0.27 0.88 -0.58 1.72 5.08 -1.50 0.81 114.58 121.26 1n4c h GLU 165 Ca -0.02 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1n4c h GLU 165 Cb 1.15 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 1n4c h GLU 165 CO 0.11 0.58 0.20 -0.07 -1.00 0.00 0.00 179.01 178.84 1n4c h LEU 166 N 0.91 0.80 0.00 1.33 -0.00 -1.27 -1.82 115.31 115.25 1n4c h LEU 166 Ca 0.36 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 58.12 1n4c h LEU 166 Cb 0.17 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 40.63 1n4c h LEU 166 CO -0.17 0.74 -0.29 -3.20 -0.00 0.00 0.00 178.44 175.51 1n4c n ASN 167 N -4.30 0.44 -0.01 -0.43 2.85 -0.19 -3.16 115.26 110.46 1n4c n ASN 167 Ca 0.05 0.20 -0.01 0.00 -0.11 0.00 0.00 54.58 54.71 1n4c n ASN 167 Cb 0.19 -0.17 -0.01 0.00 1.24 0.00 0.00 39.78 41.03 1n4c n ASN 167 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 1n4c h ASP 168 N 0.00 -0.07 0.16 1.20 3.32 0.14 -3.21 116.42 117.97 1n4c h ASP 168 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1n4c h ASP 168 Cb 0.59 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.16 1n4c h ASP 168 CO 0.00 0.37 -0.15 0.00 -1.72 0.00 0.00 179.24 177.74 1n4c h ALA 169 N -1.12 1.71 -0.93 3.45 0.00 -1.67 -1.99 119.26 118.71 1n4c h ALA 169 Ca -0.01 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.85 1n4c h ALA 169 Cb 0.06 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 1n4c h ALA 169 CO 0.01 0.19 0.58 2.35 0.00 0.00 0.00 179.25 182.39 1n4c h TRP 170 N 0.00 1.06 -0.76 0.00 2.91 -1.65 1.47 115.95 118.99 1n4c h TRP 170 Ca -0.00 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.04 1n4c h TRP 170 Cb 0.28 -0.34 -0.04 0.00 -0.51 0.00 0.00 29.16 28.55 1n4c h TRP 170 CO 0.00 0.49 0.44 1.03 -1.03 0.00 0.00 178.44 179.37 1n4c h SER 171 N 1.00 0.91 0.92 2.65 0.87 -1.35 -1.93 113.55 116.62 1n4c h SER 171 Ca 0.43 -0.06 -0.22 0.00 -1.23 0.00 0.00 61.79 60.71 1n4c h SER 171 Cb 0.30 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 1n4c h SER 171 CO -0.21 0.71 -1.06 -0.08 -0.53 0.00 0.00 176.83 175.66 1n4c h GLU 172 N 1.04 0.05 -0.48 2.24 4.81 -0.75 -3.18 114.58 118.31 1n4c h GLU 172 Ca 0.27 -0.09 0.14 0.00 -0.13 0.00 0.00 59.36 59.55 1n4c h GLU 172 Cb -0.02 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1n4c h GLU 172 CO -0.05 1.04 0.35 0.35 -0.73 0.00 0.00 179.01 179.97 1n4c h PHE 173 N 0.01 0.00 -0.25 0.92 3.57 0.27 1.50 116.94 122.96 1n4c h PHE 173 Ca -0.04 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.34 1n4c h PHE 173 Cb 1.81 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.54 1n4c h PHE 173 CO 0.01 0.00 -0.37 0.93 -2.23 0.00 0.00 178.31 176.65 1n4c h GLU 174 N 0.00 0.57 0.12 1.11 4.39 -1.48 2.35 114.58 121.64 1n4c h GLU 174 Ca 0.23 -0.27 -0.33 0.00 0.34 0.00 0.00 59.36 59.32 1n4c h GLU 174 Cb 0.93 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.57 1n4c h GLU 174 CO -0.00 0.85 -1.75 -0.97 -1.16 0.00 0.00 179.01 175.97 1n4c h ASN 175 N 0.47 0.40 1.05 1.42 -1.24 -0.55 -3.19 115.58 113.96 1n4c h ASN 175 Ca 0.05 -0.88 -0.06 0.00 0.71 0.00 0.00 56.30 56.11 1n4c h ASN 175 Cb 0.86 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.77 1n4c h ASN 175 CO 0.07 1.76 -0.98 -0.61 -1.29 0.00 0.00 177.43 176.38 1n4c h GLN 176 N -0.12 0.00 0.00 6.67 -0.00 0.18 -3.37 115.11 118.48 1n4c h GLN 176 Ca -0.38 0.00 -0.22 0.00 -0.00 0.00 0.00 58.65 58.06 1n4c h GLN 176 Cb 1.91 0.00 -0.04 0.00 0.00 0.00 0.00 27.48 29.35 1n4c h GLN 176 CO 0.07 0.13 -1.74 0.41 0.00 0.00 0.00 178.83 177.70 1n4c n GLY 177 N 1.24 -1.10 1.95 2.39 0.00 0.79 -4.30 105.19 106.16 1n4c n GLY 177 Ca -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 45.79 1n4c n GLY 177 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1n4c n GLN 178 N -2.82 0.53 -3.63 1.61 1.13 -1.13 -4.65 117.38 108.41 1n4c n GLN 178 Ca -0.15 -0.12 -0.14 0.00 -1.94 0.00 0.00 57.00 54.64 1n4c n GLN 178 Cb 0.92 -1.42 -0.06 0.00 0.11 0.00 0.00 30.24 29.78 1n4c n GLN 178 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1n4c s LYS 179 N 1.50 0.94 -0.57 -1.09 1.02 -1.26 -5.05 119.74 115.23 1n4c s LYS 179 Ca 0.08 -0.22 -0.38 0.00 0.02 0.00 0.00 55.97 55.47 1n4c s LYS 179 Cb 0.04 0.43 -0.17 0.00 -0.52 0.00 0.00 37.83 37.60 1n4c s LYS 179 CO 0.00 -0.32 2.28 -2.30 -0.92 0.00 0.00 175.35 174.10 1n4c n PRO 180 N 0.63 0.29 -3.15 -1.68 -0.02 -1.26 -4.86 135.00 124.95 1n4c n PRO 180 Ca -0.19 0.07 -0.35 0.00 -2.02 0.00 0.00 63.50 61.01 1n4c n PRO 180 Cb 0.59 -1.81 -0.03 0.00 -0.02 0.00 0.00 33.50 32.23 1n4c n PRO 180 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1n4c n LEU 181 N 9.07 5.26 0.00 2.45 0.00 -1.26 -5.13 117.00 127.39 1n4c n LEU 181 Ca 0.53 -5.35 0.00 0.00 0.00 0.00 0.00 56.01 51.19 1n4c n LEU 181 Cb 0.06 -0.97 0.00 0.00 0.00 0.00 0.00 43.42 42.51 1n4c n LEU 181 CO 0.86 1.91 0.00 0.00 0.00 0.00 0.00 177.39 180.16