#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1n h ARG 3997N 0.00 0.51 -0.24 1.61 -0.00 -1.99 -3.09 114.38 111.18 3g1n h ARG 3997Ca 0.00 -0.45 0.05 0.00 -0.00 0.00 0.00 59.98 59.58 3g1n h ARG 3997Cb 0.00 0.10 -0.05 0.00 -0.00 0.00 0.00 29.97 30.02 3g1n h ARG 3997CO 0.00 1.08 -0.10 0.93 -0.00 0.00 0.00 179.97 181.88 3g1n h GLU 3998N 0.09 -0.06 -0.29 0.08 5.08 -1.99 -1.96 114.58 115.53 3g1n h GLU 3998Ca -0.05 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 3g1n h GLU 3998Cb 1.22 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3g1n h GLU 3998CO 0.11 -0.04 -0.27 -2.95 -1.00 0.00 0.00 179.01 174.86 3g1n h ASN 3999N -0.06 0.59 -0.13 1.42 -1.07 -1.99 -1.16 115.58 113.18 3g1n h ASN 3999Ca 0.12 -0.22 -0.02 0.00 0.07 0.00 0.00 56.30 56.26 3g1n h ASN 3999Cb 0.25 -0.16 -0.01 0.00 -2.07 0.00 0.00 38.32 36.33 3g1n h ASN 3999CO -0.28 0.84 0.04 0.25 0.07 0.00 0.00 177.43 178.35 3g1n h LEU 4000N 0.51 0.24 0.13 6.14 7.12 -1.39 0.37 115.31 128.43 3g1n h LEU 4000Ca 0.07 -0.02 -0.28 0.00 0.13 0.00 0.00 57.88 57.78 3g1n h LEU 4000Cb 0.73 -0.06 0.01 0.00 -0.53 0.00 0.00 40.66 40.81 3g1n h LEU 4000CO 0.06 0.26 -1.26 0.22 -0.13 0.00 0.00 178.44 177.58 3g1n h TYR 4001N 0.27 0.58 -0.18 1.25 3.20 -1.02 -3.16 116.97 117.90 3g1n h TYR 4001Ca 0.07 -0.42 -0.16 0.00 3.14 0.00 0.00 58.73 61.36 3g1n h TYR 4001Cb 0.12 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 3g1n h TYR 4001CO 0.00 1.32 -0.55 0.74 -1.64 0.00 0.00 178.16 178.03 3g1n h PHE 4002N 0.10 0.68 -0.15 -3.82 0.04 -0.66 -2.69 116.94 110.44 3g1n h PHE 4002Ca -0.15 -0.24 0.00 0.00 2.80 0.00 0.00 57.97 60.38 3g1n h PHE 4002Cb 1.98 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 39.99 3g1n h PHE 4002CO 0.07 0.97 0.09 1.96 -0.60 0.00 0.00 178.31 180.81 3g1n h GLN 4003N 0.42 0.19 -0.16 1.51 4.20 -1.06 -1.35 115.11 118.85 3g1n h GLN 4003Ca 0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3g1n h GLN 4003Cb 1.09 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.82 3g1n h GLN 4003CO 0.10 0.12 -0.00 0.78 -0.67 0.00 0.00 178.83 179.16 3g1n h GLY 4004N 0.19 0.24 0.76 3.46 0.00 -1.51 -1.95 103.07 104.27 3g1n h GLY 4004Ca 0.06 -0.11 -0.05 0.00 0.00 0.00 0.00 47.33 47.22 3g1n h GLY 4004CO -0.02 0.11 -0.11 1.41 0.00 0.00 0.00 176.54 177.93 3g1n h LEU 4005N 0.22 0.38 -0.70 3.11 4.07 -1.36 -3.13 115.31 117.90 3g1n h LEU 4005Ca 0.05 -0.44 0.08 0.00 0.08 0.00 0.00 57.88 57.66 3g1n h LEU 4005Cb 0.16 -0.11 -0.07 0.00 1.08 0.00 0.00 40.66 41.73 3g1n h LEU 4005CO 0.00 0.74 0.36 -0.08 -1.08 0.00 0.00 178.44 178.38 3g1n h GLU 4006N 0.02 0.62 0.00 1.13 4.57 -0.52 -1.22 114.58 119.18 3g1n h GLU 4006Ca 0.03 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.10 3g1n h GLU 4006Cb 0.61 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 3g1n h GLU 4006CO 0.03 0.41 -0.34 0.00 -1.18 0.00 0.00 179.01 177.93 3g1n h ARG 4007N 0.64 0.00 -0.34 1.92 3.08 -1.50 -1.71 114.38 116.48 3g1n h ARG 4007Ca 0.33 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.25 3g1n h ARG 4007Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3g1n h ARG 4007CO -0.24 0.34 -0.32 1.25 -1.07 0.00 0.00 179.97 179.93 3g1n h LEU 4008N 0.00 0.77 -2.01 3.04 6.46 -1.17 -3.02 115.31 119.38 3g1n h LEU 4008Ca -0.00 -0.32 0.00 0.00 -0.12 0.00 0.00 57.88 57.44 3g1n h LEU 4008Cb 0.68 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.40 3g1n h LEU 4008CO 0.04 1.03 0.00 0.47 -0.62 0.00 0.00 178.44 179.37 3g1n n ASP 4009N -4.07 3.00 -0.29 1.25 10.43 -1.08 -4.71 116.55 121.07 3g1n n ASP 4009Ca -0.01 -1.93 0.09 0.00 2.57 0.00 0.00 54.79 55.51 3g1n n ASP 4009Cb 0.49 -0.08 0.21 0.00 1.84 0.00 0.00 41.12 43.58 3g1n n ASP 4009CO 0.00 0.00 0.00 -0.08 -1.07 0.00 0.00 177.20 176.05 3g1n h GLU 4010N 4.27 0.08 -2.77 -1.24 4.81 -1.17 -0.95 114.58 117.61 3g1n h GLU 4010Ca 0.00 -0.00 -0.78 0.00 -0.13 0.00 0.00 59.36 58.45 3g1n h GLU 4010Cb 0.92 -0.02 -0.30 0.00 0.63 0.00 0.00 28.75 29.99 3g1n h GLU 4010CO 0.00 0.05 0.60 0.41 -0.73 0.00 0.00 179.01 179.34 3g1n n GLY 4011N -1.45 5.20 2.99 1.92 0.00 -1.26 -4.95 105.19 107.63 3g1n n GLY 4011Ca 0.18 -2.68 -0.13 0.00 0.00 0.00 0.00 46.02 43.39 3g1n n GLY 4011CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g1n s LEU 4012N -2.86 -0.39 -0.24 0.99 0.20 -0.36 -5.13 118.68 110.88 3g1n s LEU 4012Ca 0.33 0.46 -0.16 0.00 0.69 0.00 0.00 54.13 55.45 3g1n s LEU 4012Cb 0.07 0.84 -0.03 0.00 -0.43 0.00 0.00 46.19 46.64 3g1n s LEU 4012CO 0.08 -0.26 0.43 -0.13 -0.29 0.00 0.00 176.35 176.18 3g1n s ARG 4013N 2.46 4.09 0.22 1.98 0.52 -1.26 -5.07 118.95 121.89 3g1n s ARG 4013Ca 0.04 0.20 -0.08 0.00 -0.52 0.00 0.00 55.73 55.36 3g1n s ARG 4013Cb -0.13 -3.61 -0.07 0.00 0.52 0.00 0.00 34.95 31.66 3g1n s ARG 4013CO -0.11 -0.22 0.52 0.15 0.02 0.00 0.00 175.30 175.66 3g1n s LYS 4014N 1.88 3.76 0.43 3.54 1.02 -1.26 -5.09 119.74 124.01 3g1n s LYS 4014Ca 0.19 0.19 0.02 0.00 0.02 0.00 0.00 55.97 56.39 3g1n s LYS 4014Cb -0.15 -2.69 0.02 0.00 -0.52 0.00 0.00 37.83 34.49 3g1n s LYS 4014CO 0.09 0.34 0.18 0.39 -0.92 0.00 0.00 175.35 175.43 3g1n n GLU 4015N -0.14 0.91 -4.13 1.68 1.02 -1.26 -4.98 120.64 113.74 3g1n n GLU 4015Ca -0.00 -2.88 -0.35 0.00 -0.02 0.00 0.00 57.16 53.91 3g1n n GLU 4015Cb 0.52 0.52 -0.08 0.00 -0.02 0.00 0.00 31.44 32.39 3g1n n GLU 4015CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3g1n s ASP 4016N -3.46 5.75 -0.12 1.62 1.11 -1.26 -2.19 116.67 118.12 3g1n s ASP 4016Ca 0.14 0.26 -0.01 0.00 0.18 0.00 0.00 52.55 53.12 3g1n s ASP 4016Cb -0.01 -1.72 0.03 0.00 1.07 0.00 0.00 42.92 42.29 3g1n s ASP 4016CO 0.09 0.36 -0.05 -0.32 1.18 0.00 0.00 175.17 176.43 3g1n s MET 4017N -1.15 1.30 0.23 8.23 1.75 -0.60 -4.97 119.30 124.09 3g1n s MET 4017Ca 0.16 -0.27 -0.30 0.00 -1.25 0.00 0.00 55.69 54.04 3g1n s MET 4017Cb -0.12 -1.62 -0.09 0.00 2.84 0.00 0.00 34.83 35.85 3g1n s MET 4017CO 0.06 -0.33 1.15 0.00 -0.65 0.00 0.00 175.02 175.24 3g1n s ALA 4018N 1.74 3.42 -0.22 4.11 0.00 -1.26 -0.62 121.76 128.93 3g1n s ALA 4018Ca 0.04 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.93 3g1n s ALA 4018Cb -0.13 -3.37 0.06 0.00 0.00 0.00 0.00 23.12 19.67 3g1n s ALA 4018CO -0.08 -0.28 -0.06 0.08 0.00 0.00 0.00 175.76 175.43 3g1n s VAL 4019N -0.58 1.46 -0.30 0.00 1.01 0.54 -4.89 120.40 117.65 3g1n s VAL 4019Ca 0.49 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 61.23 3g1n s VAL 4019Cb -0.32 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 3g1n s VAL 4019CO 0.39 -0.04 0.33 -1.00 0.00 0.00 0.00 175.10 174.78 3g1n s HIS 4020N 1.44 3.23 0.03 5.22 3.76 -1.26 -0.36 115.29 127.34 3g1n s HIS 4020Ca -0.04 0.20 -0.00 0.00 -0.15 0.00 0.00 55.06 55.07 3g1n s HIS 4020Cb -0.18 -2.57 -0.03 0.00 1.11 0.00 0.00 32.58 30.92 3g1n s HIS 4020CO -0.07 -0.28 -0.03 0.14 -0.85 0.00 0.00 174.74 173.65 3g1n s VAL 4021N 1.99 0.16 0.14 -0.90 -7.23 -0.84 -4.82 120.40 108.90 3g1n s VAL 4021Ca 0.12 -1.26 -0.29 0.00 -1.81 0.00 0.00 61.98 58.74 3g1n s VAL 4021Cb -0.16 -0.75 -0.07 0.00 0.56 0.00 0.00 36.38 35.96 3g1n s VAL 4021CO 0.11 -0.69 0.91 -0.13 -0.31 0.00 0.00 175.10 174.99 3g1n s ARG 4022N -2.41 4.70 0.25 4.82 3.00 -1.26 -0.19 118.95 127.86 3g1n s ARG 4022Ca -0.07 1.38 -0.04 0.00 0.00 0.00 0.00 55.73 57.00 3g1n s ARG 4022Cb -0.03 -3.34 0.50 0.00 0.00 0.00 0.00 34.95 32.08 3g1n s ARG 4022CO -0.04 0.32 1.66 -0.09 0.00 0.00 0.00 175.30 177.15 3g1n h ARG 4023N 5.15 0.19 0.00 3.54 2.43 -1.93 -1.72 114.38 122.03 3g1n h ARG 4023Ca -0.44 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3g1n h ARG 4023Cb 1.21 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3g1n h ARG 4023CO 0.70 0.12 0.00 -0.25 -1.51 0.00 0.00 179.97 179.04 3g1n n ASP 4024N -5.24 0.65 -2.06 -3.80 10.43 -1.26 -3.76 116.55 111.51 3g1n n ASP 4024Ca 0.15 0.59 -0.12 0.00 2.57 0.00 0.00 54.79 57.97 3g1n n ASP 4024Cb 0.51 -0.75 0.05 0.00 1.84 0.00 0.00 41.12 42.77 3g1n n ASP 4024CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 3g1n n HIS 4025N -2.14 1.88 -0.17 1.24 8.25 -0.68 -4.91 115.22 118.69 3g1n n HIS 4025Ca 0.05 -2.02 -0.04 0.00 -0.26 0.00 0.00 57.72 55.44 3g1n n HIS 4025Cb 0.36 -0.29 0.05 0.00 1.12 0.00 0.00 29.99 31.24 3g1n n HIS 4025CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3g1n h VAL 4026N 3.27 0.96 0.14 1.59 2.07 -1.57 -0.37 116.25 122.35 3g1n h VAL 4026Ca 0.15 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 3g1n h VAL 4026Cb 1.42 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3g1n h VAL 4026CO 0.48 0.09 -0.07 0.15 0.02 0.00 0.00 177.57 178.24 3g1n h PHE 4027N 0.51 -0.18 -0.12 1.57 3.57 -1.91 0.25 116.94 120.64 3g1n h PHE 4027Ca 0.23 -0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.59 3g1n h PHE 4027Cb 0.13 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 3g1n h PHE 4027CO -0.10 0.05 -0.52 1.49 -2.23 0.00 0.00 178.31 177.01 3g1n h GLU 4028N -0.39 0.32 -0.15 1.11 4.81 -1.94 -1.91 114.58 116.43 3g1n h GLU 4028Ca -0.02 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 58.92 3g1n h GLU 4028Cb 0.31 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.70 3g1n h GLU 4028CO 0.03 0.76 -0.32 -0.44 -0.73 0.00 0.00 179.01 178.31 3g1n h ASP 4029N 0.25 0.54 0.11 1.04 3.32 -1.00 -2.75 116.42 117.93 3g1n h ASP 4029Ca 0.01 -0.56 -0.03 0.00 0.02 0.00 0.00 57.03 56.47 3g1n h ASP 4029Cb 0.99 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 3g1n h ASP 4029CO 0.08 1.00 -0.13 0.28 -1.72 0.00 0.00 179.24 178.75 3g1n h SER 4030N 0.10 0.04 0.71 6.45 0.02 -0.42 -0.17 113.55 120.28 3g1n h SER 4030Ca 0.00 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 3g1n h SER 4030Cb 0.92 -0.01 0.01 0.00 0.14 0.00 0.00 62.40 63.45 3g1n h SER 4030CO 0.07 0.18 -0.34 0.22 -1.14 0.00 0.00 176.83 175.83 3g1n h TYR 4031N 0.05 -0.88 -0.78 3.45 3.20 -1.37 -0.63 116.97 120.01 3g1n h TYR 4031Ca 0.01 -0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.04 3g1n h TYR 4031Cb 0.26 0.29 -0.12 0.00 1.54 0.00 0.00 36.73 38.71 3g1n h TYR 4031CO 0.00 -0.52 0.20 -0.09 -1.64 0.00 0.00 178.16 176.11 3g1n h ARG 4032N -1.13 0.26 -0.11 1.82 2.43 -1.12 0.30 114.38 116.83 3g1n h ARG 4032Ca -0.10 -0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 58.88 3g1n h ARG 4032Cb 0.75 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3g1n h ARG 4032CO 0.16 0.17 -0.69 1.49 -1.51 0.00 0.00 179.97 179.59 3g1n h GLU 4033N 0.27 0.47 0.00 0.20 4.57 -1.02 -3.38 114.58 115.69 3g1n h GLU 4033Ca 0.46 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 3g1n h GLU 4033Cb 0.82 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.47 3g1n h GLU 4033CO -0.55 0.99 -0.90 1.28 -1.18 0.00 0.00 179.01 178.65 3g1n n LEU 4034N -3.88 0.20 0.25 1.64 4.77 -0.25 -4.69 117.00 115.05 3g1n n LEU 4034Ca -0.04 -0.25 0.13 0.00 -0.03 0.00 0.00 56.01 55.82 3g1n n LEU 4034Cb 0.69 0.00 0.63 0.00 -2.33 0.00 0.00 43.42 42.40 3g1n n LEU 4034CO 0.48 0.05 0.91 1.12 -1.33 0.00 0.00 177.39 178.62 3g1n h HIS 4035N 0.00 0.00 -0.75 -1.77 2.07 -0.63 -2.84 115.15 111.23 3g1n h HIS 4035Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3g1n h HIS 4035Cb 0.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.28 3g1n h HIS 4035CO 0.00 0.14 0.00 0.54 -3.07 0.00 0.00 177.93 175.54 3g1n n ARG 4036N -3.41 2.78 -2.50 5.12 1.74 -1.26 -4.95 116.66 114.17 3g1n n ARG 4036Ca -0.01 -2.70 -0.34 0.00 -0.77 0.00 0.00 57.85 54.04 3g1n n ARG 4036Cb 0.33 -1.59 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 3g1n n ARG 4036CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3g1n s LYS 4037N -1.04 3.79 0.63 5.56 -0.14 -1.08 -5.06 119.74 122.41 3g1n s LYS 4037Ca 0.50 1.30 -0.13 0.00 -1.36 0.00 0.00 55.97 56.28 3g1n s LYS 4037Cb 0.26 -2.10 -0.02 0.00 -1.68 0.00 0.00 37.83 34.30 3g1n s LYS 4037CO 0.34 -0.43 1.05 -1.54 -0.76 0.00 0.00 175.35 174.00 3g1n s SER 4038N -2.15 5.73 0.18 2.83 1.04 -1.26 -4.88 113.70 115.20 3g1n s SER 4038Ca 0.66 1.66 -0.17 0.00 0.48 0.00 0.00 55.95 58.58 3g1n s SER 4038Cb -0.15 -2.51 0.13 0.00 0.10 0.00 0.00 66.02 63.59 3g1n s SER 4038CO 0.22 -1.20 1.64 -0.65 0.98 0.00 0.00 173.24 174.23 3g1n h PRO 4039N -0.11 -0.07 0.33 4.02 0.11 -1.97 -0.08 132.00 134.23 3g1n h PRO 4039Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 3g1n h PRO 4039Cb 1.21 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3g1n h PRO 4039CO 0.58 -0.04 -0.26 1.49 -0.21 0.00 0.00 178.00 179.56 3g1n h GLU 4040N -0.07 -0.57 -0.85 1.05 4.81 -1.93 -1.95 114.58 115.07 3g1n h GLU 4040Ca 0.22 0.04 0.20 0.00 -0.13 0.00 0.00 59.36 59.69 3g1n h GLU 4040Cb 0.40 0.13 -0.15 0.00 0.63 0.00 0.00 28.75 29.76 3g1n h GLU 4040CO -0.50 -0.38 -0.04 0.93 -0.73 0.00 0.00 179.01 178.29 3g1n h GLU 4041N -0.59 0.05 0.00 1.92 5.08 -1.91 0.37 114.58 119.51 3g1n h GLU 4041Ca -0.03 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3g1n h GLU 4041Cb 0.52 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3g1n h GLU 4041CO -0.01 0.04 0.02 -0.12 -1.00 0.00 0.00 179.01 177.94 3g1n n MET 4042N -5.43 0.08 -0.02 2.33 1.56 -0.06 -0.96 117.12 114.62 3g1n n MET 4042Ca 0.16 0.57 0.13 0.00 -0.27 0.00 0.00 57.70 58.29 3g1n n MET 4042Cb 0.54 -1.77 0.60 0.00 2.15 0.00 0.00 33.22 34.74 3g1n n MET 4042CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 175.97 176.87 3g1n n LYS 4043N -1.91 1.43 -1.55 2.12 5.02 0.13 -4.91 118.16 118.50 3g1n n LYS 4043Ca -0.01 -0.63 -0.32 0.00 -2.02 0.00 0.00 58.31 55.34 3g1n n LYS 4043Cb 0.04 -1.44 0.06 0.00 -0.02 0.00 0.00 35.03 33.67 3g1n n LYS 4043CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3g1n s ASN 4044N -1.85 4.94 0.04 4.39 0.01 -0.13 -4.94 114.94 117.40 3g1n s ASN 4044Ca 0.38 1.86 -0.30 0.00 -0.71 0.00 0.00 52.86 54.08 3g1n s ASN 4044Cb 0.19 -2.53 -0.07 0.00 0.41 0.00 0.00 41.25 39.25 3g1n s ASN 4044CO 0.31 -1.74 1.55 -0.13 -1.51 0.00 0.00 177.10 175.59 3g1n s ARG 4045N -4.56 4.23 -0.02 -0.60 0.52 -0.93 -4.91 118.95 112.68 3g1n s ARG 4045Ca 0.63 2.18 -0.28 0.00 -0.52 0.00 0.00 55.73 57.74 3g1n s ARG 4045Cb -0.18 -3.61 -0.03 0.00 0.52 0.00 0.00 34.95 31.65 3g1n s ARG 4045CO 0.49 -0.68 0.92 -0.51 0.02 0.00 0.00 175.30 175.54 3g1n s LEU 4046N 2.62 4.35 -0.34 2.53 1.02 -1.26 -1.56 118.68 126.04 3g1n s LEU 4046Ca 0.70 1.54 0.01 0.00 0.02 0.00 0.00 54.13 56.40 3g1n s LEU 4046Cb -0.36 -3.45 0.09 0.00 0.02 0.00 0.00 46.19 42.49 3g1n s LEU 4046CO 0.30 -0.24 0.06 -0.47 0.02 0.00 0.00 176.35 176.02 3g1n s TYR 4047N 1.05 3.58 0.08 0.29 5.04 0.21 -4.91 117.35 122.70 3g1n s TYR 4047Ca 0.48 -2.61 -0.26 0.00 -2.44 0.00 0.00 57.07 52.25 3g1n s TYR 4047Cb -0.20 -2.76 -0.06 0.00 0.35 0.00 0.00 41.96 39.29 3g1n s TYR 4047CO 0.25 -0.93 0.81 0.42 -1.34 0.00 0.00 175.55 174.76 3g1n s ILE 4048N 1.04 4.62 -0.28 3.14 -1.09 -1.26 -0.34 121.20 127.03 3g1n s ILE 4048Ca 0.05 1.74 0.00 0.00 -2.23 0.00 0.00 60.65 60.21 3g1n s ILE 4048Cb -0.20 -4.17 0.08 0.00 -1.58 0.00 0.00 42.46 36.60 3g1n s ILE 4048CO -0.06 0.38 0.04 -0.69 -1.23 0.00 0.00 174.94 173.38 3g1n s VAL 4049N -0.23 1.22 -0.26 2.92 1.01 0.51 -4.89 120.40 120.66 3g1n s VAL 4049Ca 0.40 -1.36 -0.29 0.00 0.00 0.00 0.00 61.98 60.72 3g1n s VAL 4049Cb -0.22 -1.76 -0.00 0.00 0.00 0.00 0.00 36.38 34.40 3g1n s VAL 4049CO 0.25 -0.43 1.26 -0.36 0.00 0.00 0.00 175.10 175.81 3g1n s PHE 4050N 1.48 2.80 0.24 5.22 0.40 -1.26 -1.98 117.98 124.89 3g1n s PHE 4050Ca 0.04 0.97 -0.31 0.00 -0.60 0.00 0.00 56.93 57.03 3g1n s PHE 4050Cb -0.18 -3.75 -0.14 0.00 0.51 0.00 0.00 43.02 39.46 3g1n s PHE 4050CO -0.15 -1.56 1.27 -1.91 0.70 0.00 0.00 175.22 173.58 3g1n n GLU 4051N 7.04 1.72 -1.87 0.44 2.13 0.74 -3.13 120.64 127.70 3g1n n GLU 4051Ca 0.14 0.61 -0.13 0.00 0.66 0.00 0.00 57.16 58.44 3g1n n GLU 4051Cb 0.46 -2.17 -0.03 0.00 0.27 0.00 0.00 31.44 29.97 3g1n n GLU 4051CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3g1n n GLY 4052N 1.83 0.48 3.05 8.31 0.00 -1.26 -4.69 105.19 112.91 3g1n n GLY 4052Ca 0.11 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 3g1n n GLY 4052CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g1n s GLU 4053N -3.97 2.00 -0.25 1.61 2.02 -1.18 -5.09 118.70 113.84 3g1n s GLU 4053Ca 0.00 -0.50 -0.34 0.00 0.02 0.00 0.00 54.97 54.15 3g1n s GLU 4053Cb 0.00 -1.67 -0.15 0.00 0.10 0.00 0.00 34.13 32.41 3g1n s GLU 4053CO 0.00 -0.00 1.08 -1.91 0.02 0.00 0.00 175.26 174.44 3g1n n GLU 4054N 3.97 0.00 -1.69 1.61 4.07 -1.26 -4.77 120.64 122.57 3g1n n GLU 4054Ca -0.21 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.45 3g1n n GLU 4054Cb 0.52 -1.13 -0.03 0.00 -0.06 0.00 0.00 31.44 30.73 3g1n n GLU 4054CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3g1n n GLY 4055N 2.39 1.20 3.32 8.31 0.00 -1.26 -4.99 105.19 114.17 3g1n n GLY 4055Ca 0.21 0.59 -0.14 0.00 0.00 0.00 0.00 46.02 46.68 3g1n n GLY 4055CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3g1n s GLN 4056N 0.56 1.47 -0.27 1.61 0.74 -1.26 -5.11 119.66 117.41 3g1n s GLN 4056Ca 0.74 -1.68 -0.40 0.00 0.05 0.00 0.00 55.36 54.07 3g1n s GLN 4056Cb -0.60 0.34 -0.15 0.00 1.10 0.00 0.00 33.01 33.69 3g1n s GLN 4056CO 0.40 -0.54 1.77 -3.47 -0.55 0.00 0.00 175.29 172.89 3g1n n ASP 4057N -0.73 2.48 -0.18 6.67 2.03 -1.26 -4.86 116.55 120.70 3g1n n ASP 4057Ca 0.03 1.06 -0.01 0.00 0.52 0.00 0.00 54.79 56.39 3g1n n ASP 4057Cb 0.64 -1.16 0.08 0.00 -0.72 0.00 0.00 41.12 39.96 3g1n n ASP 4057CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3g1n h ALA 4058N 7.44 0.61 0.15 -1.67 0.00 -1.99 -1.37 119.26 122.43 3g1n h ALA 4058Ca -0.46 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3g1n h ALA 4058Cb 1.31 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.28 3g1n h ALA 4058CO 0.96 -0.31 -0.07 0.78 0.00 0.00 0.00 179.25 180.61 3g1n h GLY 4059N 0.23 -0.21 0.15 0.00 0.00 -1.97 -2.07 103.07 99.20 3g1n h GLY 4059Ca 0.28 0.08 0.09 0.00 0.00 0.00 0.00 47.33 47.78 3g1n h GLY 4059CO -0.37 -0.08 -0.06 -1.33 0.00 0.00 0.00 176.54 174.71 3g1n h GLY 4060N -0.33 0.41 0.65 4.60 0.00 -1.88 -1.79 103.07 104.73 3g1n h GLY 4060Ca -0.02 0.11 0.08 0.00 0.00 0.00 0.00 47.33 47.50 3g1n h GLY 4060CO 0.03 -0.15 0.64 1.41 0.00 0.00 0.00 176.54 178.47 3g1n h LEU 4061N 0.05 1.01 -0.60 3.11 4.07 -1.14 -2.12 115.31 119.69 3g1n h LEU 4061Ca 0.23 0.02 -0.05 0.00 0.08 0.00 0.00 57.88 58.16 3g1n h LEU 4061Cb 0.35 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.88 3g1n h LEU 4061CO -0.44 0.61 0.17 0.25 -1.08 0.00 0.00 178.44 177.96 3g1n h LEU 4062N 1.12 0.89 0.21 1.67 5.85 -0.61 -0.19 115.31 124.25 3g1n h LEU 4062Ca 0.45 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 3g1n h LEU 4062Cb 0.27 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3g1n h LEU 4062CO -0.20 0.87 -0.16 -0.09 -0.34 0.00 0.00 178.44 178.51 3g1n h ARG 4063N 0.86 -0.37 -0.55 1.25 2.43 -1.12 -1.45 114.38 115.42 3g1n h ARG 4063Ca 0.19 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.49 3g1n h ARG 4063Cb 0.31 0.08 -0.09 0.00 -0.42 0.00 0.00 29.97 29.86 3g1n h ARG 4063CO -0.00 -0.25 0.03 0.93 -1.51 0.00 0.00 179.97 179.17 3g1n h GLU 4064N -0.39 0.15 -0.06 0.20 5.08 -1.23 0.56 114.58 118.89 3g1n h GLU 4064Ca -0.01 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3g1n h GLU 4064Cb 0.34 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3g1n h GLU 4064CO -0.01 0.10 -0.02 2.35 -1.00 0.00 0.00 179.01 180.42 3g1n h TRP 4065N 0.15 -0.05 -0.61 4.33 7.01 -0.88 -0.56 115.95 125.33 3g1n h TRP 4065Ca 0.28 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.37 3g1n h TRP 4065Cb 0.43 0.03 -0.07 0.00 -2.10 0.00 0.00 29.16 27.46 3g1n h TRP 4065CO -0.31 -0.04 0.26 1.88 -2.79 0.00 0.00 178.44 177.45 3g1n h TYR 4066N -0.01 0.47 -0.59 2.65 0.05 -0.78 -0.34 116.97 118.42 3g1n h TYR 4066Ca 0.03 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.84 3g1n h TYR 4066Cb 0.06 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 37.66 3g1n h TYR 4066CO -0.13 0.16 0.35 0.52 -1.05 0.00 0.00 178.16 178.01 3g1n h MET 4067N 0.48 0.80 -0.04 4.88 2.86 -0.28 -1.55 114.93 122.07 3g1n h MET 4067Ca 0.30 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 3g1n h MET 4067Cb 0.32 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 3g1n h MET 4067CO -0.27 0.58 0.00 0.82 1.06 0.00 0.00 176.91 179.11 3g1n h ILE 4068N 0.79 1.23 -0.78 -1.22 2.04 -0.74 -2.69 117.51 116.13 3g1n h ILE 4068Ca 0.21 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 3g1n h ILE 4068Cb -0.01 1.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 3g1n h ILE 4068CO -0.04 0.19 0.37 -0.29 0.00 0.00 0.00 178.15 178.38 3g1n h ILE 4069N -0.20 1.25 -0.59 -0.67 2.10 -0.99 -0.48 117.51 117.93 3g1n h ILE 4069Ca 0.01 -0.70 0.09 0.00 1.08 0.00 0.00 64.86 65.35 3g1n h ILE 4069Cb 0.30 0.25 -0.07 0.00 -1.09 0.00 0.00 36.82 36.20 3g1n h ILE 4069CO 0.00 0.30 0.21 0.28 -1.08 0.00 0.00 178.15 177.85 3g1n h SER 4070N 1.12 0.19 -0.05 2.19 0.02 -1.27 -2.11 113.55 113.63 3g1n h SER 4070Ca 0.27 0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.27 3g1n h SER 4070Cb 0.12 0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.73 3g1n h SER 4070CO -0.03 0.11 -0.09 -0.09 -1.14 0.00 0.00 176.83 175.59 3g1n h ARG 4071N 0.38 0.16 0.00 3.45 2.43 -1.07 -3.35 114.38 116.38 3g1n h ARG 4071Ca 0.30 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.30 3g1n h ARG 4071Cb 0.38 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3g1n h ARG 4071CO -0.31 0.67 -0.35 0.93 -1.51 0.00 0.00 179.97 179.40 3g1n h GLU 4072N -0.34 0.00 -0.84 0.20 4.39 -1.05 -2.88 114.58 114.06 3g1n h GLU 4072Ca 0.00 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.83 3g1n h GLU 4072Cb 0.66 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.18 3g1n h GLU 4072CO 0.02 0.35 -0.41 1.98 -1.16 0.00 0.00 179.01 179.79 3g1n h MET 4073N 0.00 -0.07 -0.51 2.33 4.05 -1.51 -1.85 114.93 117.37 3g1n h MET 4073Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3g1n h MET 4073Cb 0.96 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.78 3g1n h MET 4073CO 0.05 -0.05 0.00 1.19 0.23 0.00 0.00 176.91 178.33 3g1n n PHE 4074N -5.43 0.42 -2.26 1.39 3.72 -1.09 -4.63 117.46 109.58 3g1n n PHE 4074Ca 0.07 -0.17 -0.42 0.00 -0.05 0.00 0.00 57.45 56.88 3g1n n PHE 4074Cb 0.37 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.78 3g1n n PHE 4074CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3g1n s ASN 4075N -0.65 6.89 0.50 4.37 3.84 -0.70 -4.86 114.94 124.34 3g1n s ASN 4075Ca 0.15 2.12 0.23 0.00 0.21 0.00 0.00 52.86 55.57 3g1n s ASN 4075Cb 0.09 -2.57 1.31 0.00 -0.55 0.00 0.00 41.25 39.53 3g1n s ASN 4075CO 0.07 -0.66 1.96 -0.65 -2.79 0.00 0.00 177.10 175.04 3g1n h PRO 4076N 7.43 0.12 -0.73 0.43 0.11 -1.90 -2.28 132.00 135.19 3g1n h PRO 4076Ca -0.39 -0.01 0.12 0.00 0.11 0.00 0.00 66.00 65.83 3g1n h PRO 4076Cb 1.19 -0.03 -0.12 0.00 0.11 0.00 0.00 31.00 32.15 3g1n h PRO 4076CO 0.88 0.08 -0.27 -1.33 -0.21 0.00 0.00 178.00 177.15 3g1n n MET 4077N -4.40 -0.15 0.00 1.05 2.81 -1.26 -0.61 117.12 114.55 3g1n n MET 4077Ca 0.12 1.12 0.14 0.00 -1.81 0.00 0.00 57.70 57.27 3g1n n MET 4077Cb 0.62 -1.67 0.49 0.00 -0.71 0.00 0.00 33.22 31.95 3g1n n MET 4077CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3g1n n TYR 4078N -5.09 0.00 -3.32 2.03 4.01 -0.86 -4.94 117.16 108.99 3g1n n TYR 4078Ca 0.08 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.62 3g1n n TYR 4078Cb 0.30 -0.14 -0.02 0.00 -0.31 0.00 0.00 39.34 39.18 3g1n n TYR 4078CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3g1n n ALA 4079N -0.71 -1.06 0.04 -0.72 0.00 0.21 -4.86 120.51 113.42 3g1n n ALA 4079Ca 0.14 -0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.37 3g1n n ALA 4079Cb 0.32 -2.00 -0.14 0.00 0.00 0.00 0.00 19.45 17.62 3g1n n ALA 4079CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3g1n h LEU 4080N -0.61 0.46 -8.17 0.00 3.38 -1.84 -3.27 115.31 105.27 3g1n h LEU 4080Ca -0.34 -0.81 -0.47 0.00 0.09 0.00 0.00 57.88 56.35 3g1n h LEU 4080Cb 1.23 -0.15 -0.29 0.00 0.09 0.00 0.00 40.66 41.53 3g1n h LEU 4080CO 0.45 1.70 -0.81 -0.36 0.09 0.00 0.00 178.44 179.52 3g1n s PHE 4081N -2.58 1.21 0.13 1.13 0.08 -1.26 -1.34 117.98 115.35 3g1n s PHE 4081Ca -0.16 -0.24 0.10 0.00 0.12 0.00 0.00 56.93 56.75 3g1n s PHE 4081Cb 0.06 -0.79 -0.04 0.00 -0.57 0.00 0.00 43.02 41.68 3g1n s PHE 4081CO 0.82 -0.04 -0.24 -0.98 -0.10 0.00 0.00 175.22 174.69 3g1n s ARG 4082N -0.24 1.54 0.46 0.44 1.70 0.00 -4.78 118.95 118.07 3g1n s ARG 4082Ca 0.04 -1.31 -0.21 0.00 -0.47 0.00 0.00 55.73 53.79 3g1n s ARG 4082Cb -0.06 -1.97 -0.10 0.00 -0.57 0.00 0.00 34.95 32.26 3g1n s ARG 4082CO -0.00 0.46 1.00 0.95 -1.08 0.00 0.00 175.30 176.62 3g1n s THR 4083N -1.13 4.05 0.06 4.99 -4.23 -1.26 -1.49 115.64 116.63 3g1n s THR 4083Ca 0.16 1.28 -0.31 0.00 -1.18 0.00 0.00 61.69 61.64 3g1n s THR 4083Cb -0.10 -3.52 -0.09 0.00 1.34 0.00 0.00 72.50 70.14 3g1n s THR 4083CO 0.08 -0.27 1.76 -0.55 -0.54 0.00 0.00 174.62 175.09 3g1n s SER 4084N -2.07 6.53 0.49 3.99 0.15 0.01 -4.88 113.70 117.93 3g1n s SER 4084Ca 0.65 2.57 0.19 0.00 0.70 0.00 0.00 55.95 60.06 3g1n s SER 4084Cb -0.13 -2.55 1.24 0.00 -1.71 0.00 0.00 66.02 62.86 3g1n s SER 4084CO 0.17 -0.95 2.07 1.55 1.20 0.00 0.00 173.24 177.27 3g1n h PRO 4085N 8.93 0.00 0.06 5.44 0.13 -1.87 0.15 132.00 144.85 3g1n h PRO 4085Ca -0.44 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3g1n h PRO 4085Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3g1n h PRO 4085CO 0.94 0.11 -0.03 0.78 -0.23 0.00 0.00 178.00 179.58 3g1n h GLY 4086N 0.43 -0.08 0.02 1.56 0.00 -1.00 -3.40 103.07 100.60 3g1n h GLY 4086Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3g1n h GLY 4086CO 0.01 -0.03 -0.98 1.22 0.00 0.00 0.00 176.54 176.76 3g1n n ASP 4087N -4.78 0.99 0.00 0.19 8.00 -1.18 -2.74 116.55 117.04 3g1n n ASP 4087Ca -0.07 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.44 3g1n n ASP 4087Cb 0.30 0.98 0.00 0.00 -0.02 0.00 0.00 41.12 42.38 3g1n n ASP 4087CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3g1n n ARG 4088N -1.49 0.00 -0.01 -1.24 5.12 0.51 -4.39 116.66 115.17 3g1n n ARG 4088Ca 0.04 0.00 0.08 0.00 -1.93 0.00 0.00 57.85 56.04 3g1n n ARG 4088Cb 0.33 -0.25 -0.11 0.00 -1.16 0.00 0.00 32.46 31.27 3g1n n ARG 4088CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 3g1n n VAL 4089N 0.00 0.00 -3.63 1.55 0.31 -1.26 -4.61 118.33 110.68 3g1n n VAL 4089Ca 0.00 -0.29 -0.22 0.00 -0.01 0.00 0.00 64.34 63.82 3g1n n VAL 4089Cb 0.00 0.40 -0.01 0.00 -0.91 0.00 0.00 33.84 33.32 3g1n n VAL 4089CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3g1n s THR 4090N -2.89 4.92 0.06 2.52 -4.23 -1.26 -4.81 115.64 109.94 3g1n s THR 4090Ca -0.02 -0.80 0.05 0.00 -1.18 0.00 0.00 61.69 59.74 3g1n s THR 4090Cb 0.10 -3.76 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 3g1n s THR 4090CO 0.64 -0.37 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.91 3g1n s TYR 4091N -2.16 1.16 0.31 3.99 2.02 -0.13 -0.81 117.35 121.73 3g1n s TYR 4091Ca 0.39 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.65 3g1n s TYR 4091Cb -0.09 -0.67 -0.01 0.00 -0.40 0.00 0.00 41.96 40.79 3g1n s TYR 4091CO 0.32 0.04 0.38 -0.08 -1.57 0.00 0.00 175.55 174.64 3g1n s THR 4092N -1.12 0.00 0.29 -0.71 -1.32 -0.56 -1.01 115.64 111.21 3g1n s THR 4092Ca -0.01 -1.72 -0.30 0.00 -1.21 0.00 0.00 61.69 58.45 3g1n s THR 4092Cb -0.09 -2.54 -0.11 0.00 -1.51 0.00 0.00 72.50 68.25 3g1n s THR 4092CO 0.02 0.00 1.49 -0.63 -2.21 0.00 0.00 174.62 173.29 3g1n s ILE 4093N -3.41 2.38 -0.37 5.08 1.01 -1.26 -0.82 121.20 123.81 3g1n s ILE 4093Ca 0.33 0.33 -0.22 0.00 0.00 0.00 0.00 60.65 61.09 3g1n s ILE 4093Cb 0.01 -3.21 0.01 0.00 0.01 0.00 0.00 42.46 39.28 3g1n s ILE 4093CO 0.19 0.06 0.72 0.21 0.00 0.00 0.00 174.94 176.12 3g1n s ASN 4094N 0.27 6.48 0.00 3.58 2.47 -0.45 -4.62 114.94 122.67 3g1n s ASN 4094Ca 0.59 0.22 0.04 0.00 0.42 0.00 0.00 52.86 54.13 3g1n s ASN 4094Cb -0.44 -2.36 0.20 0.00 -1.45 0.00 0.00 41.25 37.20 3g1n s ASN 4094CO 0.48 -0.68 1.08 -0.81 -3.72 0.00 0.00 177.10 173.45 3g1n n PRO 4095N 6.27 0.02 -0.03 0.43 -0.04 -1.26 -1.18 135.00 139.21 3g1n n PRO 4095Ca 0.01 0.36 0.12 0.00 -0.04 0.00 0.00 63.50 63.95 3g1n n PRO 4095Cb 0.48 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.63 3g1n n PRO 4095CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3g1n n SER 4096N -1.42 2.82 -0.23 3.54 7.64 -1.26 -4.43 113.62 120.28 3g1n n SER 4096Ca 0.01 -1.92 0.32 0.00 1.01 0.00 0.00 58.87 58.29 3g1n n SER 4096Cb 0.05 -0.04 0.69 0.00 -1.01 0.00 0.00 64.21 63.89 3g1n n SER 4096CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3g1n h SER 4097N 4.28 0.00 -0.04 6.43 4.64 -1.20 -1.34 113.55 126.32 3g1n h SER 4097Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3g1n h SER 4097Cb 0.91 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3g1n h SER 4097CO 0.00 0.00 0.04 1.12 -0.87 0.00 0.00 176.83 177.12 3g1n h HIS 4098N 0.00 0.00 0.00 4.77 2.07 -1.83 -1.51 115.15 118.65 3g1n h HIS 4098Ca 0.49 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.01 3g1n h HIS 4098Cb 2.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.24 3g1n h HIS 4098CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 3g1n s ASN 4100N -1.88 3.90 0.43 0.00 3.04 -0.57 -5.03 114.94 114.84 3g1n s ASN 4100Ca 0.01 -1.83 0.28 0.00 0.04 0.00 0.00 52.86 51.36 3g1n s ASN 4100Cb 0.01 -0.86 1.36 0.00 -1.54 0.00 0.00 41.25 40.21 3g1n s ASN 4100CO 0.01 -0.39 1.67 -0.65 -3.04 0.00 0.00 177.10 174.70 3g1n h PRO 4101N 7.81 0.15 -0.66 0.43 0.11 -1.84 0.42 132.00 138.42 3g1n h PRO 4101Ca -0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3g1n h PRO 4101Cb 1.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3g1n h PRO 4101CO 0.46 0.10 0.00 0.09 -0.21 0.00 0.00 178.00 178.44 3g1n n ASN 4102N -4.64 3.84 -0.14 -2.05 4.13 -1.26 -4.60 115.26 110.54 3g1n n ASN 4102Ca 0.34 -2.46 -0.03 0.00 1.68 0.00 0.00 54.58 54.10 3g1n n ASN 4102Cb 1.30 -0.55 0.05 0.00 -1.54 0.00 0.00 39.78 39.04 3g1n n ASN 4102CO 0.00 0.00 0.00 1.12 0.28 0.00 0.00 177.26 178.66 3g1n h HIS 4103N 2.82 0.13 -0.90 3.10 2.07 -0.39 -1.73 115.15 120.24 3g1n h HIS 4103Ca 0.00 0.03 0.09 0.00 -2.85 0.00 0.00 60.37 57.64 3g1n h HIS 4103Cb 1.29 0.01 -0.07 0.00 2.57 0.00 0.00 27.41 31.21 3g1n h HIS 4103CO 0.64 -0.01 0.58 -0.07 -3.07 0.00 0.00 177.93 176.01 3g1n h LEU 4104N 0.21 0.82 -0.46 6.12 4.07 -1.83 -0.64 115.31 123.60 3g1n h LEU 4104Ca 0.22 0.02 -0.11 0.00 0.08 0.00 0.00 57.88 58.09 3g1n h LEU 4104Cb 0.29 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 3g1n h LEU 4104CO -0.30 0.49 -0.16 -1.28 -1.08 0.00 0.00 178.44 176.11 3g1n h SER 4105N 0.91 0.94 -0.66 -0.43 0.87 -1.68 -2.74 113.55 110.76 3g1n h SER 4105Ca 0.42 -0.38 -0.06 0.00 -1.23 0.00 0.00 61.79 60.54 3g1n h SER 4105Cb 0.39 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.06 3g1n h SER 4105CO -0.18 1.10 0.19 1.88 -0.53 0.00 0.00 176.83 179.30 3g1n h TYR 4106N 0.77 1.10 -0.78 2.24 0.05 -0.92 -1.59 116.97 117.84 3g1n h TYR 4106Ca 0.11 -0.11 0.01 0.00 0.05 0.00 0.00 58.73 58.79 3g1n h TYR 4106Cb 0.72 -0.32 -0.04 0.00 1.01 0.00 0.00 36.73 38.10 3g1n h TYR 4106CO 0.05 0.88 0.51 0.74 -1.05 0.00 0.00 178.16 179.30 3g1n h PHE 4107N 1.02 0.98 -0.75 4.88 0.04 -1.06 0.19 116.94 122.24 3g1n h PHE 4107Ca 0.22 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.98 3g1n h PHE 4107Cb 0.32 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 3g1n h PHE 4107CO 0.02 0.62 0.34 -0.22 -0.60 0.00 0.00 178.31 178.48 3g1n h LYS 4108N 1.05 1.09 -0.14 1.51 3.64 -1.27 -0.70 116.57 121.75 3g1n h LYS 4108Ca 0.28 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 3g1n h LYS 4108Cb -0.12 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.51 3g1n h LYS 4108CO -0.06 0.86 0.01 0.35 -2.27 0.00 0.00 179.45 178.34 3g1n h PHE 4109N 1.06 0.27 -0.19 1.91 3.57 -0.53 -0.13 116.94 122.89 3g1n h PHE 4109Ca 0.25 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 3g1n h PHE 4109Cb 0.14 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 3g1n h PHE 4109CO 0.01 0.45 -0.03 -0.24 -2.23 0.00 0.00 178.31 176.27 3g1n h VAL 4110N 0.00 1.14 -0.18 1.41 3.04 -0.55 -1.08 116.25 120.03 3g1n h VAL 4110Ca 0.04 -0.56 0.02 0.00 -1.01 0.00 0.00 66.70 65.19 3g1n h VAL 4110Cb 0.34 1.03 -0.02 0.00 -2.01 0.00 0.00 31.29 30.63 3g1n h VAL 4110CO 0.01 0.18 0.06 1.23 -1.01 0.00 0.00 177.57 178.04 3g1n h GLY 4111N 0.61 0.21 0.15 3.17 0.00 -0.76 -0.87 103.07 105.59 3g1n h GLY 4111Ca 0.06 -0.03 0.09 0.00 0.00 0.00 0.00 47.33 47.45 3g1n h GLY 4111CO 0.01 0.02 -0.07 -0.09 0.00 0.00 0.00 176.54 176.41 3g1n h ARG 4112N 0.14 0.04 0.12 4.80 2.43 -0.25 -2.03 114.38 119.62 3g1n h ARG 4112Ca 0.08 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3g1n h ARG 4112Cb 0.05 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3g1n h ARG 4112CO -0.08 0.03 -0.06 0.82 -1.51 0.00 0.00 179.97 179.16 3g1n h ILE 4113N 0.04 1.00 -0.32 1.20 1.08 -0.77 0.57 117.51 120.32 3g1n h ILE 4113Ca 0.22 -0.48 0.07 0.00 -0.39 0.00 0.00 64.86 64.28 3g1n h ILE 4113Cb 0.34 1.31 -0.07 0.00 -3.07 0.00 0.00 36.82 35.32 3g1n h ILE 4113CO -0.43 0.12 -0.18 0.58 -0.69 0.00 0.00 178.15 177.55 3g1n h VAL 4114N -0.39 0.48 -0.31 1.67 2.07 -1.07 -0.40 116.25 118.31 3g1n h VAL 4114Ca -0.02 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3g1n h VAL 4114Cb 0.31 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3g1n h VAL 4114CO 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.61 3g1n h ALA 4115N 1.08 1.42 -0.10 1.67 0.00 -1.27 -1.06 119.26 121.00 3g1n h ALA 4115Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3g1n h ALA 4115Cb 0.39 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3g1n h ALA 4115CO -0.40 0.41 -0.01 -0.22 0.00 0.00 0.00 179.25 179.03 3g1n h LYS 4116N 0.45 0.17 0.24 0.00 3.11 0.04 0.13 116.57 120.71 3g1n h LYS 4116Ca 0.10 -0.06 0.01 0.00 -2.81 0.00 0.00 60.65 57.89 3g1n h LYS 4116Cb 0.31 -0.01 -0.04 0.00 -1.00 0.00 0.00 32.23 31.49 3g1n h LYS 4116CO 0.01 0.45 -0.43 0.00 -2.81 0.00 0.00 179.45 176.67 3g1n h ALA 4117N 0.72 -0.84 -0.75 5.00 0.00 -0.85 -0.70 119.26 121.85 3g1n h ALA 4117Ca 0.03 -0.11 0.15 0.00 0.00 0.00 0.00 54.91 54.98 3g1n h ALA 4117Cb 0.37 0.68 -0.10 0.00 0.00 0.00 0.00 17.79 18.74 3g1n h ALA 4117CO 0.01 -1.03 0.24 0.28 0.00 0.00 0.00 179.25 178.75 3g1n h VAL 4118N -0.74 0.57 -0.24 0.00 2.07 -1.21 -0.34 116.25 116.36 3g1n h VAL 4118Ca -0.00 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.44 3g1n h VAL 4118Cb 0.72 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 3g1n h VAL 4118CO -0.18 0.06 -0.04 0.22 0.02 0.00 0.00 177.57 177.66 3g1n h TYR 4119N 0.34 -0.09 -0.10 1.57 3.20 -0.27 -2.42 116.97 119.21 3g1n h TYR 4119Ca 0.42 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.31 3g1n h TYR 4119Cb 0.69 0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.04 3g1n h TYR 4119CO -0.22 -0.08 0.00 -0.25 -1.64 0.00 0.00 178.16 175.97 3g1n n ASP 4120N -5.20 1.23 -1.48 -2.11 8.00 -0.33 -4.91 116.55 111.75 3g1n n ASP 4120Ca -0.01 -1.58 -0.13 0.00 0.71 0.00 0.00 54.79 53.78 3g1n n ASP 4120Cb 0.14 -0.06 -0.01 0.00 -0.02 0.00 0.00 41.12 41.17 3g1n n ASP 4120CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3g1n n ASN 4121N 0.01 -4.11 -4.75 -2.24 3.02 -0.28 -5.01 115.26 101.90 3g1n n ASN 4121Ca 0.17 -0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.31 3g1n n ASN 4121Cb 0.27 -3.28 -0.05 0.00 -0.61 0.00 0.00 39.78 36.11 3g1n n ASN 4121CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3g1n s ARG 4122N -4.60 4.66 -0.13 3.52 6.06 -0.38 -5.01 118.95 123.07 3g1n s ARG 4122Ca 0.00 1.29 -0.11 0.00 -2.50 0.00 0.00 55.73 54.41 3g1n s ARG 4122Cb 0.00 -3.32 -0.05 0.00 0.06 0.00 0.00 34.95 31.65 3g1n s ARG 4122CO 0.00 0.41 0.23 -0.51 -2.50 0.00 0.00 175.30 172.93 3g1n s LEU 4123N -0.64 4.32 -0.05 -0.88 1.43 -1.26 -4.06 118.68 117.54 3g1n s LEU 4123Ca 0.40 0.51 0.05 0.00 -1.03 0.00 0.00 54.13 54.06 3g1n s LEU 4123Cb -0.23 -2.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 3g1n s LEU 4123CO 0.28 0.26 -0.18 -0.76 0.23 0.00 0.00 176.35 176.17 3g1n s LEU 4124N -0.30 2.48 -1.46 1.79 1.43 -0.69 -4.99 118.68 116.94 3g1n s LEU 4124Ca 0.15 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.84 3g1n s LEU 4124Cb -0.13 -1.49 -0.08 0.00 0.03 0.00 0.00 46.19 44.53 3g1n s LEU 4124CO 0.04 0.30 2.74 -0.62 0.23 0.00 0.00 176.35 179.05 3g1n n GLU 4125N 2.58 3.30 -4.24 1.70 1.02 -1.26 -3.85 120.64 119.89 3g1n n GLU 4125Ca -0.17 -2.05 -0.34 0.00 -0.02 0.00 0.00 57.16 54.58 3g1n n GLU 4125Cb 0.52 -2.74 -0.13 0.00 -0.02 0.00 0.00 31.44 29.07 3g1n n GLU 4125CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3g1n s TYR 4127N 0.81 2.81 0.40 0.00 1.51 -1.26 -4.74 117.35 116.89 3g1n s TYR 4127Ca -0.01 -2.34 -0.01 0.00 -1.01 0.00 0.00 57.07 53.70 3g1n s TYR 4127Cb -0.15 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.42 3g1n s TYR 4127CO 0.02 -0.89 0.64 -0.06 -1.11 0.00 0.00 175.55 174.14 3g1n s PHE 4128N 1.24 3.45 0.68 2.71 0.08 -1.26 -0.96 117.98 123.92 3g1n s PHE 4128Ca 0.07 0.43 -0.16 0.00 0.12 0.00 0.00 56.93 57.39 3g1n s PHE 4128Cb -0.18 -2.09 0.01 0.00 -0.57 0.00 0.00 43.02 40.19 3g1n s PHE 4128CO -0.14 -0.09 1.19 0.95 -0.10 0.00 0.00 175.22 177.04 3g1n s THR 4129N -2.48 2.52 0.13 0.64 -4.23 -0.18 -4.51 115.64 107.54 3g1n s THR 4129Ca 0.44 0.27 0.30 0.00 -1.18 0.00 0.00 61.69 61.52 3g1n s THR 4129Cb -0.10 -2.89 0.34 0.00 1.34 0.00 0.00 72.50 71.19 3g1n s THR 4129CO 0.39 -0.12 1.95 0.08 -0.54 0.00 0.00 174.62 176.37 3g1n h ARG 4130N 0.06 0.00 -0.38 3.99 0.11 -1.92 -1.49 114.38 114.74 3g1n h ARG 4130Ca -0.48 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.50 3g1n h ARG 4130Cb 1.29 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.35 3g1n h ARG 4130CO 0.52 0.07 -0.17 0.77 0.10 0.00 0.00 179.97 181.26 3g1n h SER 4131N 0.00 0.71 0.09 0.08 0.02 -1.94 -1.15 113.55 111.37 3g1n h SER 4131Ca -0.00 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 3g1n h SER 4131Cb 0.57 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 3g1n h SER 4131CO 0.01 0.89 -0.08 0.15 -1.14 0.00 0.00 176.83 176.66 3g1n h PHE 4132N 0.64 -0.19 -0.81 3.45 3.57 -1.62 0.21 116.94 122.19 3g1n h PHE 4132Ca 0.10 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.72 3g1n h PHE 4132Cb 0.64 0.07 -0.08 0.00 2.79 0.00 0.00 35.95 39.38 3g1n h PHE 4132CO 0.03 -0.12 0.42 1.88 -2.23 0.00 0.00 178.31 178.29 3g1n h TYR 4133N -0.18 0.75 -0.25 0.41 0.05 -1.42 -1.30 116.97 115.03 3g1n h TYR 4133Ca -0.00 0.03 0.03 0.00 0.05 0.00 0.00 58.73 58.84 3g1n h TYR 4133Cb 0.16 -0.22 -0.03 0.00 1.01 0.00 0.00 36.73 37.66 3g1n h TYR 4133CO -0.10 0.24 0.06 0.87 -1.05 0.00 0.00 178.16 178.19 3g1n h LYS 4134N 0.67 0.16 -0.68 4.88 1.57 -0.56 -2.28 116.57 120.33 3g1n h LYS 4134Ca 0.41 -0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.31 3g1n h LYS 4134Cb 0.49 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.68 3g1n h LYS 4134CO -0.31 0.11 0.22 0.45 -0.57 0.00 0.00 179.45 179.35 3g1n h HIS 4135N 0.16 0.38 -0.63 -1.35 3.86 0.47 0.99 115.15 119.02 3g1n h HIS 4135Ca 0.11 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.33 3g1n h HIS 4135Cb 0.10 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 3g1n h HIS 4135CO -0.15 0.03 0.27 0.82 0.86 0.00 0.00 177.93 179.76 3g1n h ILE 4136N 0.37 1.22 -0.00 2.45 2.04 -0.76 -1.25 117.51 121.57 3g1n h ILE 4136Ca 0.36 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.56 3g1n h ILE 4136Cb 0.53 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 3g1n h ILE 4136CO -0.39 0.27 -0.01 0.18 0.00 0.00 0.00 178.15 178.20 3g1n n LEU 4137N -4.32 0.03 -0.71 1.44 4.77 -0.82 -4.89 117.00 112.50 3g1n n LEU 4137Ca 0.06 0.27 -0.06 0.00 -0.03 0.00 0.00 56.01 56.24 3g1n n LEU 4137Cb 0.16 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3g1n n LEU 4137CO 0.39 0.01 -0.08 0.61 -1.33 0.00 0.00 177.39 176.98 3g1n n GLY 4138N 1.29 0.12 3.72 -0.72 0.00 -0.47 -4.78 105.19 104.35 3g1n n GLY 4138Ca 0.14 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 3g1n n GLY 4138CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g1n s LYS 4139N -4.29 3.00 0.26 1.61 2.20 0.28 -5.01 119.74 117.80 3g1n s LYS 4139Ca 0.00 -0.43 -0.29 0.00 -0.36 0.00 0.00 55.97 54.89 3g1n s LYS 4139Cb 0.00 -2.82 -0.09 0.00 -1.51 0.00 0.00 37.83 33.41 3g1n s LYS 4139CO 0.00 0.69 1.17 0.45 -0.36 0.00 0.00 175.35 177.30 3g1n s SER 4140N -1.16 7.11 0.24 1.43 0.15 -1.26 -4.08 113.70 116.13 3g1n s SER 4140Ca 0.16 2.35 -0.30 0.00 0.70 0.00 0.00 55.95 58.86 3g1n s SER 4140Cb -0.12 -2.63 -0.09 0.00 -1.71 0.00 0.00 66.02 61.48 3g1n s SER 4140CO 0.06 -0.29 0.96 0.68 1.20 0.00 0.00 173.24 175.84 3g1n s VAL 4141N -0.82 4.00 0.30 4.45 -7.23 -1.26 -5.04 120.40 114.80 3g1n s VAL 4141Ca 0.48 2.02 0.05 0.00 -1.81 0.00 0.00 61.98 62.72 3g1n s VAL 4141Cb -0.34 -4.28 -0.02 0.00 0.56 0.00 0.00 36.38 32.30 3g1n s VAL 4141CO 0.42 0.48 0.44 -0.13 -0.31 0.00 0.00 175.10 176.00 3g1n s ARG 4142N -1.19 3.26 0.47 4.82 0.52 -1.26 -4.65 118.95 120.92 3g1n s ARG 4142Ca 0.42 -0.86 0.32 0.00 -0.52 0.00 0.00 55.73 55.09 3g1n s ARG 4142Cb -0.27 -2.83 1.57 0.00 0.52 0.00 0.00 34.95 33.95 3g1n s ARG 4142CO 0.33 0.20 1.97 0.10 0.02 0.00 0.00 175.30 177.92 3g1n h TYR 4143N 0.97 0.00 0.00 -0.53 -0.00 -1.96 -0.09 116.97 115.36 3g1n h TYR 4143Ca -0.48 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.23 3g1n h TYR 4143Cb 1.24 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.97 3g1n h TYR 4143CO 0.44 0.00 -0.06 1.15 -0.00 0.00 0.00 178.16 179.68 3g1n h THR 4144N 0.00 0.68 0.00 -0.90 2.02 -1.99 -2.39 112.91 110.33 3g1n h THR 4144Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 3g1n h THR 4144Cb 0.20 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 3g1n h THR 4144CO 0.00 0.06 0.00 0.47 0.37 0.00 0.00 175.52 176.42 3g1n n ASP 4145N -3.93 0.00 0.12 4.18 8.00 -0.05 -3.61 116.55 121.26 3g1n n ASP 4145Ca -0.03 0.42 -0.19 0.00 0.71 0.00 0.00 54.79 55.71 3g1n n ASP 4145Cb 0.16 -0.46 -0.15 0.00 -0.02 0.00 0.00 41.12 40.65 3g1n n ASP 4145CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 3g1n h MET 4146N 0.00 0.35 -0.97 -1.24 2.86 -1.59 -3.38 114.93 110.96 3g1n h MET 4146Ca 0.00 -0.60 0.18 0.00 -2.06 0.00 0.00 59.70 57.22 3g1n h MET 4146Cb 0.29 0.23 -0.10 0.00 0.06 0.00 0.00 31.60 32.07 3g1n h MET 4146CO 0.00 1.29 0.57 1.49 1.06 0.00 0.00 176.91 181.32 3g1n h GLU 4147N 0.10 0.71 0.00 1.72 4.81 -1.74 0.63 114.58 120.80 3g1n h GLU 4147Ca -0.17 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 3g1n h GLU 4147Cb 2.03 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 31.25 3g1n h GLU 4147CO 0.23 0.47 -0.01 0.77 -0.73 0.00 0.00 179.01 179.73 3g1n h SER 4148N 0.73 0.00 0.01 1.04 0.02 -1.83 -3.12 113.55 110.40 3g1n h SER 4148Ca 0.55 -0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 61.09 3g1n h SER 4148Cb 0.84 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.32 3g1n h SER 4148CO -0.38 0.00 -2.36 -0.62 -1.14 0.00 0.00 176.83 172.33 3g1n n GLU 4149N -2.48 0.63 -3.34 3.45 -0.58 0.10 -0.33 120.64 118.09 3g1n n GLU 4149Ca 0.05 0.24 -0.23 0.00 -0.42 0.00 0.00 57.16 56.81 3g1n n GLU 4149Cb 0.46 -1.55 -0.09 0.00 -0.57 0.00 0.00 31.44 29.69 3g1n n GLU 4149CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3g1n s ASP 4150N -7.01 1.47 0.21 1.62 -1.08 0.18 -4.78 116.67 107.27 3g1n s ASP 4150Ca -0.35 -2.39 -0.12 0.00 -0.52 0.00 0.00 52.55 49.17 3g1n s ASP 4150Cb 0.11 0.03 0.25 0.00 -1.46 0.00 0.00 42.92 41.85 3g1n s ASP 4150CO 0.57 -0.21 1.65 0.22 0.52 0.00 0.00 175.17 177.91 3g1n h TYR 4151N 6.24 -0.19 -0.12 -5.34 3.20 -1.69 -1.43 116.97 117.64 3g1n h TYR 4151Ca 0.15 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.96 3g1n h TYR 4151Cb 0.98 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.43 3g1n h TYR 4151CO 0.30 -0.22 -0.35 0.45 -1.64 0.00 0.00 178.16 176.70 3g1n h HIS 4152N 0.05 0.59 -0.75 -3.82 3.86 -1.93 -2.24 115.15 110.92 3g1n h HIS 4152Ca 0.30 -0.24 0.06 0.00 -1.16 0.00 0.00 60.37 59.34 3g1n h HIS 4152Cb 0.48 -0.10 -0.06 0.00 1.06 0.00 0.00 27.41 28.79 3g1n h HIS 4152CO -0.43 0.97 0.44 0.35 0.86 0.00 0.00 177.93 180.12 3g1n h PHE 4153N 0.05 0.81 -0.56 2.45 3.57 -1.91 -0.94 116.94 120.41 3g1n h PHE 4153Ca -0.01 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.58 3g1n h PHE 4153Cb 0.97 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.40 3g1n h PHE 4153CO 0.11 0.39 0.25 -0.92 -2.23 0.00 0.00 178.31 175.91 3g1n h TYR 4154N 0.80 0.45 -0.70 0.41 3.20 -1.15 -1.88 116.97 118.09 3g1n h TYR 4154Ca 0.33 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.26 3g1n h TYR 4154Cb 0.20 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 3g1n h TYR 4154CO -0.06 0.18 0.47 1.96 -1.64 0.00 0.00 178.16 179.07 3g1n h GLN 4155N 0.47 0.84 -0.76 1.82 1.08 -0.59 -0.63 115.11 117.34 3g1n h GLN 4155Ca 0.26 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.42 3g1n h GLN 4155Cb 0.24 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.44 3g1n h GLN 4155CO -0.22 0.56 0.50 0.78 -0.95 0.00 0.00 178.83 179.50 3g1n h GLY 4156N 0.87 1.07 0.92 3.46 0.00 -0.51 -1.95 103.07 106.93 3g1n h GLY 4156Ca 0.28 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 3g1n h GLY 4156CO -0.08 0.40 0.02 1.41 0.00 0.00 0.00 176.54 178.29 3g1n h LEU 4157N 1.03 0.04 -0.37 3.11 4.07 -0.47 -0.31 115.31 122.41 3g1n h LEU 4157Ca 0.28 -0.09 0.06 0.00 0.08 0.00 0.00 57.88 58.21 3g1n h LEU 4157Cb -0.11 -0.01 -0.06 0.00 1.08 0.00 0.00 40.66 41.56 3g1n h LEU 4157CO -0.06 0.12 0.03 0.58 -1.08 0.00 0.00 178.44 178.03 3g1n h VAL 4158N -0.04 0.76 -0.43 1.22 2.07 -1.27 0.44 116.25 119.01 3g1n h VAL 4158Ca 0.01 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.49 3g1n h VAL 4158Cb 0.08 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 3g1n h VAL 4158CO -0.00 0.03 0.28 0.22 0.02 0.00 0.00 177.57 178.11 3g1n h TYR 4159N 0.14 0.53 -0.44 1.57 3.20 -1.21 -1.82 116.97 118.93 3g1n h TYR 4159Ca 0.18 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.11 3g1n h TYR 4159Cb 0.23 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.28 3g1n h TYR 4159CO -0.23 0.33 0.18 1.25 -1.64 0.00 0.00 178.16 178.06 3g1n h LEU 4160N 0.57 0.23 -1.92 2.82 5.85 -0.55 -1.35 115.31 120.97 3g1n h LEU 4160Ca 0.16 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.94 3g1n h LEU 4160Cb -0.06 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3g1n h LEU 4160CO -0.04 0.17 0.11 -0.07 -0.34 0.00 0.00 178.44 178.27 3g1n h LEU 4161N 0.37 0.09 0.00 2.25 4.07 -0.61 -3.26 115.31 118.23 3g1n h LEU 4161Ca 0.20 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3g1n h LEU 4161Cb 0.15 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.87 3g1n h LEU 4161CO -0.17 0.06 -1.01 -0.62 -1.08 0.00 0.00 178.44 175.62 3g1n n GLU 4162N -4.51 1.43 -4.50 1.13 1.02 -0.71 -5.00 120.64 109.49 3g1n n GLU 4162Ca 0.00 -0.04 -0.24 0.00 -0.02 0.00 0.00 57.16 56.86 3g1n n GLU 4162Cb 0.16 -1.29 -0.11 0.00 -0.02 0.00 0.00 31.44 30.19 3g1n n GLU 4162CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3g1n s ASN 4163N -2.87 3.25 0.21 1.62 0.01 -0.56 -5.08 114.94 111.52 3g1n s ASN 4163Ca 0.03 -1.24 -0.30 0.00 -0.71 0.00 0.00 52.86 50.64 3g1n s ASN 4163Cb 0.12 -0.26 -0.08 0.00 0.41 0.00 0.00 41.25 41.43 3g1n s ASN 4163CO 0.66 -0.34 1.13 -0.62 -1.51 0.00 0.00 177.10 176.42 3g1n s ASP 4164N -3.55 7.20 0.32 -1.22 -1.08 -1.26 -4.84 116.67 112.24 3g1n s ASP 4164Ca 0.32 2.19 0.02 0.00 -0.52 0.00 0.00 52.55 54.56 3g1n s ASP 4164Cb 0.05 -2.61 0.53 0.00 -1.46 0.00 0.00 42.92 39.43 3g1n s ASP 4164CO 0.15 -0.25 1.87 0.58 0.52 0.00 0.00 175.17 178.04 3g1n h VAL 4165N 3.56 1.20 0.00 1.11 2.07 -1.93 -1.44 116.25 120.83 3g1n h VAL 4165Ca -0.45 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.32 3g1n h VAL 4165Cb 1.21 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3g1n h VAL 4165CO 0.72 0.27 0.08 0.28 0.02 0.00 0.00 177.57 178.93 3g1n h SER 4166N 0.64 0.00 0.58 0.57 0.02 -1.94 -2.96 113.55 110.46 3g1n h SER 4166Ca 0.14 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.81 3g1n h SER 4166Cb 0.28 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 3g1n h SER 4166CO 0.00 0.00 -1.53 0.74 -1.14 0.00 0.00 176.83 174.90 3g1n h THR 4167N 0.00 1.09 -1.06 -2.27 2.02 -1.64 -3.40 112.91 107.64 3g1n h THR 4167Ca 0.00 -2.87 0.29 0.00 0.77 0.00 0.00 66.41 64.61 3g1n h THR 4167Cb 0.15 2.59 -0.06 0.00 -1.74 0.00 0.00 68.15 69.09 3g1n h THR 4167CO 0.00 0.69 0.73 -0.07 0.37 0.00 0.00 175.52 177.25 3g1n h LEU 4168N 0.02 0.19 0.08 2.58 3.38 -1.56 -3.45 115.31 116.54 3g1n h LEU 4168Ca -0.22 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 3g1n h LEU 4168Cb 1.96 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.70 3g1n h LEU 4168CO 0.11 0.04 -0.03 0.61 0.09 0.00 0.00 178.44 179.26 3g1n n GLY 4169N -1.64 0.53 3.51 0.83 0.00 -1.26 -4.98 105.19 102.19 3g1n n GLY 4169Ca 0.24 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.63 3g1n n GLY 4169CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3g1n s TYR 4170N -2.00 -0.44 0.13 1.61 1.13 -1.26 -5.18 117.35 111.34 3g1n s TYR 4170Ca 0.00 0.52 0.10 0.00 -1.41 0.00 0.00 57.07 56.28 3g1n s TYR 4170Cb 0.00 0.49 -0.04 0.00 -1.10 0.00 0.00 41.96 41.31 3g1n s TYR 4170CO 0.00 -0.55 -0.21 0.16 -2.51 0.00 0.00 175.55 172.44 3g1n s ASP 4171N -1.90 3.67 0.15 -0.18 1.47 -1.26 -5.00 116.67 113.62 3g1n s ASP 4171Ca -0.01 -0.65 0.06 0.00 1.18 0.00 0.00 52.55 53.13 3g1n s ASP 4171Cb -0.01 -0.42 -0.04 0.00 -0.34 0.00 0.00 42.92 42.11 3g1n s ASP 4171CO -0.03 0.17 0.06 -0.76 0.68 0.00 0.00 175.17 175.29 3g1n s LEU 4172N -2.17 3.58 0.25 2.11 1.43 -1.26 -5.03 118.68 117.59 3g1n s LEU 4172Ca 0.17 -0.21 0.10 0.00 -1.03 0.00 0.00 54.13 53.15 3g1n s LEU 4172Cb -0.10 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.84 3g1n s LEU 4172CO 0.09 0.11 -0.06 0.28 0.23 0.00 0.00 176.35 176.99 3g1n s THR 4173N -1.63 3.20 -1.10 5.49 -1.32 -1.26 -1.65 115.64 117.36 3g1n s THR 4173Ca 0.29 -1.96 -0.15 0.00 -1.21 0.00 0.00 61.69 58.66 3g1n s THR 4173Cb -0.10 -2.68 -0.07 0.00 -1.51 0.00 0.00 72.50 68.14 3g1n s THR 4173CO 0.21 -0.32 2.18 0.49 -2.21 0.00 0.00 174.62 174.96 3g1n n PHE 4174N -0.64 2.31 -3.65 9.09 3.72 -0.74 -4.76 117.46 122.78 3g1n n PHE 4174Ca -0.07 -2.33 -0.04 0.00 -0.05 0.00 0.00 57.45 54.96 3g1n n PHE 4174Cb 0.58 -2.04 -0.07 0.00 -0.94 0.00 0.00 39.48 37.02 3g1n n PHE 4174CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3g1n s SER 4175N 3.81 -0.21 0.17 4.37 1.04 -1.26 -1.70 113.70 119.92 3g1n s SER 4175Ca 0.52 0.39 0.01 0.00 0.48 0.00 0.00 55.95 57.35 3g1n s SER 4175Cb 0.14 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.76 3g1n s SER 4175CO 0.01 -0.07 0.03 -0.89 0.98 0.00 0.00 173.24 173.30 3g1n s THR 4176N 0.33 0.51 0.30 2.02 2.01 -1.19 -4.89 115.64 114.73 3g1n s THR 4176Ca 0.03 -1.97 -0.29 0.00 0.31 0.00 0.00 61.69 59.77 3g1n s THR 4176Cb -0.05 -2.18 -0.10 0.00 0.01 0.00 0.00 72.50 70.19 3g1n s THR 4176CO -0.12 -0.40 1.33 -1.61 -0.69 0.00 0.00 174.62 173.13 3g1n s GLU 4177N -3.97 4.34 -0.02 4.92 2.02 -1.26 -1.83 118.70 122.90 3g1n s GLU 4177Ca 0.26 2.22 0.00 0.00 0.02 0.00 0.00 54.97 57.47 3g1n s GLU 4177Cb 0.07 -3.09 0.03 0.00 0.10 0.00 0.00 34.13 31.24 3g1n s GLU 4177CO 0.05 -0.24 0.02 0.08 0.02 0.00 0.00 175.26 175.19 3g1n s VAL 4178N -0.81 0.01 -0.48 2.63 1.01 0.45 -4.95 120.40 118.26 3g1n s VAL 4178Ca 0.52 0.19 -0.11 0.00 0.00 0.00 0.00 61.98 62.57 3g1n s VAL 4178Cb -0.40 -0.14 0.11 0.00 0.00 0.00 0.00 36.38 35.95 3g1n s VAL 4178CO 0.50 0.11 0.37 -1.58 0.00 0.00 0.00 175.10 174.50 3g1n s GLN 4179N 1.12 2.67 -0.12 2.72 0.74 -1.26 -0.36 119.66 125.18 3g1n s GLN 4179Ca -0.08 -1.65 -0.03 0.00 0.05 0.00 0.00 55.36 53.65 3g1n s GLN 4179Cb -0.13 -4.00 -0.03 0.00 1.10 0.00 0.00 33.01 29.95 3g1n s GLN 4179CO -0.03 -1.16 -0.01 -2.00 -0.55 0.00 0.00 175.29 171.54 3g1n s GLU 4180N 1.46 3.29 -1.69 1.67 2.12 -0.37 -4.55 118.70 120.63 3g1n s GLU 4180Ca 0.04 -0.45 -0.15 0.00 0.36 0.00 0.00 54.97 54.77 3g1n s GLU 4180Cb -0.26 -2.85 0.14 0.00 0.26 0.00 0.00 34.13 31.42 3g1n s GLU 4180CO 0.01 0.50 0.63 1.19 -0.54 0.00 0.00 175.26 177.05 3g1n n PHE 4181N 2.75 -1.57 -0.96 5.30 3.01 -1.26 -0.27 117.46 124.46 3g1n n PHE 4181Ca -0.18 0.75 0.00 0.00 1.01 0.00 0.00 57.45 59.03 3g1n n PHE 4181Cb 0.53 -2.82 0.00 0.00 -0.01 0.00 0.00 39.48 37.18 3g1n n PHE 4181CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g1n n GLY 4182N -1.52 0.65 3.35 1.37 0.00 -1.26 -5.00 105.19 102.77 3g1n n GLY 4182Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3g1n n GLY 4182CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1n s VAL 4183N -2.74 3.52 -0.26 1.61 1.01 0.63 -5.07 120.40 119.11 3g1n s VAL 4183Ca 0.00 -0.45 -0.22 0.00 0.00 0.00 0.00 61.98 61.31 3g1n s VAL 4183Cb 0.00 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.77 3g1n s VAL 4183CO 0.00 0.43 0.73 0.00 0.00 0.00 0.00 175.10 176.26 3g1n s GLU 4185N 2.70 1.53 -0.18 0.00 2.02 0.52 -4.96 118.70 120.33 3g1n s GLU 4185Ca 0.31 -1.77 -0.03 0.00 0.02 0.00 0.00 54.97 53.49 3g1n s GLU 4185Cb -0.15 -1.16 -0.02 0.00 0.10 0.00 0.00 34.13 32.90 3g1n s GLU 4185CO 0.08 0.05 -0.05 0.08 0.02 0.00 0.00 175.26 175.45 3g1n s VAL 4186N -3.01 3.61 -0.08 2.63 1.01 -1.26 -0.41 120.40 122.90 3g1n s VAL 4186Ca 0.29 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.88 3g1n s VAL 4186Cb 0.03 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 3g1n s VAL 4186CO 0.12 0.47 -0.24 -0.13 0.00 0.00 0.00 175.10 175.31 3g1n s ARG 4187N 0.78 2.75 0.60 2.72 0.52 -0.76 -4.94 118.95 120.63 3g1n s ARG 4187Ca -0.02 -0.88 -0.19 0.00 -0.52 0.00 0.00 55.73 54.12 3g1n s ARG 4187Cb -0.15 -2.20 -0.03 0.00 0.52 0.00 0.00 34.95 33.09 3g1n s ARG 4187CO 0.02 0.28 1.28 -0.51 0.02 0.00 0.00 175.30 176.39 3g1n s ASP 4188N 0.08 4.98 0.01 0.23 1.01 -1.26 -3.15 116.67 118.58 3g1n s ASP 4188Ca -0.11 2.59 0.22 0.00 0.71 0.00 0.00 52.55 55.96 3g1n s ASP 4188Cb -0.16 -2.62 -0.19 0.00 1.01 0.00 0.00 42.92 40.97 3g1n s ASP 4188CO 0.06 -1.75 0.76 0.18 0.21 0.00 0.00 175.17 174.63 3g1n n LEU 4189N -1.55 0.45 -3.82 1.23 4.77 -0.69 -4.92 117.00 112.48 3g1n n LEU 4189Ca 0.14 -0.10 -0.09 0.00 -0.03 0.00 0.00 56.01 55.93 3g1n n LEU 4189Cb 0.48 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.56 3g1n n LEU 4189CO 0.48 0.06 0.52 -1.59 -1.33 0.00 0.00 177.39 175.52 3g1n s LYS 4190N -3.30 2.19 -0.33 3.23 -2.85 -1.26 -5.04 119.74 112.38 3g1n s LYS 4190Ca -0.01 -1.40 -0.36 0.00 -1.00 0.00 0.00 55.97 53.21 3g1n s LYS 4190Cb 0.14 0.62 -0.12 0.00 -2.06 0.00 0.00 37.83 36.42 3g1n s LYS 4190CO 0.86 -1.02 2.14 -2.30 0.10 0.00 0.00 175.35 175.13 3g1n n PRO 4191N -0.52 1.14 -2.62 1.78 -0.02 -1.26 -1.71 135.00 131.79 3g1n n PRO 4191Ca -0.08 0.33 -0.09 0.00 -2.02 0.00 0.00 63.50 61.64 3g1n n PRO 4191Cb 0.60 -2.44 0.02 0.00 -0.02 0.00 0.00 33.50 31.66 3g1n n PRO 4191CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3g1n n ASN 4192N 9.30 -3.35 -0.22 2.55 5.15 -1.26 -4.96 115.26 122.47 3g1n n ASN 4192Ca 0.39 -0.13 -0.05 0.00 -0.60 0.00 0.00 54.58 54.19 3g1n n ASN 4192Cb 0.22 -2.20 0.05 0.00 -0.53 0.00 0.00 39.78 37.32 3g1n n ASN 4192CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 3g1n h GLY 4193N -0.63 0.88 2.00 8.20 0.00 -1.53 -2.22 103.07 109.79 3g1n h GLY 4193Ca -0.20 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 3g1n h GLY 4193CO 0.22 0.30 -0.09 0.00 0.00 0.00 0.00 176.54 176.96 3g1n h ALA 4194N 1.24 1.39 -0.63 3.60 0.00 -1.87 -0.88 119.26 122.11 3g1n h ALA 4194Ca 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3g1n h ALA 4194Cb -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3g1n h ALA 4194CO -0.07 0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.39 3g1n n ASN 4195N -3.76 3.59 -4.37 0.00 3.02 -0.87 -4.79 115.26 108.08 3g1n n ASN 4195Ca -0.02 -1.99 -0.34 0.00 -0.03 0.00 0.00 54.58 52.20 3g1n n ASN 4195Cb 0.20 -0.42 -0.14 0.00 -0.61 0.00 0.00 39.78 38.81 3g1n n ASN 4195CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3g1n s ILE 4196N -1.16 3.28 0.41 2.41 1.01 -0.41 -5.06 121.20 121.66 3g1n s ILE 4196Ca 0.44 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 60.41 3g1n s ILE 4196Cb 0.24 -2.43 -0.07 0.00 0.01 0.00 0.00 42.46 40.21 3g1n s ILE 4196CO 0.31 0.49 0.81 -0.76 0.00 0.00 0.00 174.94 175.79 3g1n s LEU 4197N 0.74 3.84 0.12 2.97 1.43 -1.26 -1.84 118.68 124.68 3g1n s LEU 4197Ca -0.04 1.26 -0.25 0.00 -1.03 0.00 0.00 54.13 54.07 3g1n s LEU 4197Cb -0.15 -4.13 -0.07 0.00 0.03 0.00 0.00 46.19 41.86 3g1n s LEU 4197CO 0.02 -0.39 0.77 -0.69 0.23 0.00 0.00 176.35 176.28 3g1n s VAL 4198N -2.33 4.50 0.35 -1.59 1.01 -0.66 -4.87 120.40 116.81 3g1n s VAL 4198Ca 0.54 1.66 0.04 0.00 0.00 0.00 0.00 61.98 64.22 3g1n s VAL 4198Cb -0.10 -4.12 -0.06 0.00 0.00 0.00 0.00 36.38 32.09 3g1n s VAL 4198CO 0.28 0.47 0.05 -0.89 0.00 0.00 0.00 175.10 175.01 3g1n s THR 4199N -0.78 1.27 0.66 3.92 2.01 -1.26 -4.83 115.64 116.63 3g1n s THR 4199Ca 0.36 -2.00 0.41 0.00 0.31 0.00 0.00 61.69 60.77 3g1n s THR 4199Cb -0.22 -2.78 0.42 0.00 0.01 0.00 0.00 72.50 69.92 3g1n s THR 4199CO 0.25 0.00 2.28 -0.08 -0.69 0.00 0.00 174.62 176.38 3g1n h GLU 4200N 2.03 0.00 -0.18 4.92 4.57 -1.96 -1.05 114.58 122.90 3g1n h GLU 4200Ca -0.41 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.69 3g1n h GLU 4200Cb 1.25 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.83 3g1n h GLU 4200CO 0.71 0.00 -0.20 0.93 -1.18 0.00 0.00 179.01 179.26 3g1n h GLU 4201N 0.00 0.45 0.00 1.92 3.07 -2.00 -3.37 114.58 114.65 3g1n h GLU 4201Ca 0.00 -0.25 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 3g1n h GLU 4201Cb 0.13 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 3g1n h GLU 4201CO -0.00 0.83 -0.00 0.27 -1.40 0.00 0.00 179.01 178.70 3g1n n ASN 4202N -4.46 2.05 -0.33 1.42 2.04 -1.07 -4.79 115.26 110.11 3g1n n ASN 4202Ca -0.06 -2.29 -0.04 0.00 -0.44 0.00 0.00 54.58 51.75 3g1n n ASN 4202Cb 0.41 -0.12 0.08 0.00 -2.53 0.00 0.00 39.78 37.62 3g1n n ASN 4202CO 0.00 0.00 0.00 0.07 -0.44 0.00 0.00 177.26 176.89 3g1n h LYS 4203N 0.00 1.25 0.34 -3.83 2.10 -1.36 -0.32 116.57 114.74 3g1n h LYS 4203Ca 0.00 -0.17 0.00 0.00 -2.00 0.00 0.00 60.65 58.48 3g1n h LYS 4203Cb 0.66 -0.23 -0.03 0.00 -0.90 0.00 0.00 32.23 31.72 3g1n h LYS 4203CO 0.00 0.94 -0.43 -0.22 -2.00 0.00 0.00 179.45 177.74 3g1n h LYS 4204N 1.25 -0.78 -0.70 0.07 1.63 -1.86 -1.58 116.57 114.59 3g1n h LYS 4204Ca 0.31 0.05 0.14 0.00 -0.85 0.00 0.00 60.65 60.30 3g1n h LYS 4204Cb 0.07 0.18 -0.10 0.00 -0.60 0.00 0.00 32.23 31.78 3g1n h LYS 4204CO -0.04 -0.52 0.19 1.49 -3.45 0.00 0.00 179.45 177.11 3g1n h GLU 4205N -0.81 0.29 -0.54 1.90 4.81 -1.77 -0.81 114.58 117.66 3g1n h GLU 4205Ca -0.02 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 3g1n h GLU 4205Cb 0.74 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.02 3g1n h GLU 4205CO -0.12 0.19 0.31 -0.92 -0.73 0.00 0.00 179.01 177.75 3g1n h TYR 4206N 0.30 0.58 -0.93 0.92 3.20 -0.91 -2.48 116.97 117.65 3g1n h TYR 4206Ca 0.39 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.31 3g1n h TYR 4206Cb 0.63 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.66 3g1n h TYR 4206CO -0.24 0.32 0.61 0.28 -1.64 0.00 0.00 178.16 177.49 3g1n h VAL 4207N 0.61 1.17 -0.21 1.81 2.07 -0.13 0.18 116.25 121.75 3g1n h VAL 4207Ca 0.22 -0.41 -0.15 0.00 0.82 0.00 0.00 66.70 67.19 3g1n h VAL 4207Cb 0.06 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.70 3g1n h VAL 4207CO -0.11 0.22 -0.49 -0.74 0.02 0.00 0.00 177.57 176.46 3g1n h HIS 4208N 1.18 0.70 0.17 1.57 -0.00 -1.13 -2.12 115.15 115.52 3g1n h HIS 4208Ca 0.37 -0.23 -0.25 0.00 -0.00 0.00 0.00 60.37 60.26 3g1n h HIS 4208Cb -0.00 -0.14 0.03 0.00 -0.00 0.00 0.00 27.41 27.30 3g1n h HIS 4208CO -0.00 0.95 -1.07 -0.07 -0.00 0.00 0.00 177.93 177.74 3g1n h LEU 4209N 0.45 0.64 -1.90 0.26 -0.00 -0.99 -2.79 115.31 110.98 3g1n h LEU 4209Ca 0.02 -0.92 -0.02 0.00 -0.00 0.00 0.00 57.88 56.96 3g1n h LEU 4209Cb 1.02 -0.21 -0.00 0.00 -0.00 0.00 0.00 40.66 41.47 3g1n h LEU 4209CO 0.09 1.51 -0.10 1.62 -0.00 0.00 0.00 178.44 181.57 3g1n h VAL 4210N -0.13 0.90 0.33 1.22 3.04 -0.67 -0.25 116.25 120.70 3g1n h VAL 4210Ca -0.18 -0.38 -0.02 0.00 -1.01 0.00 0.00 66.70 65.11 3g1n h VAL 4210Cb 1.83 1.21 0.00 0.00 -2.01 0.00 0.00 31.29 32.33 3g1n h VAL 4210CO 0.20 0.10 -0.16 0.00 -1.01 0.00 0.00 177.57 176.70 3g1n h GLN 4212N -1.11 -0.00 -0.17 0.00 7.50 -1.41 -1.50 115.11 118.42 3g1n h GLN 4212Ca -0.05 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.02 3g1n h GLN 4212Cb 0.34 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.87 3g1n h GLN 4212CO 0.08 -0.00 -0.22 1.98 -1.50 0.00 0.00 178.83 179.17 3g1n h MET 4213N -0.00 0.45 0.00 1.46 4.05 -1.07 -0.86 114.93 118.95 3g1n h MET 4213Ca 0.42 -0.25 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 3g1n h MET 4213Cb 0.67 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.48 3g1n h MET 4213CO -1.01 0.84 -0.15 -0.09 0.23 0.00 0.00 176.91 176.74 3g1n h ARG 4214N 0.08 0.00 0.09 0.39 9.65 -0.85 -0.61 114.38 123.14 3g1n h ARG 4214Ca 0.02 0.00 -0.35 0.00 -1.10 0.00 0.00 59.98 58.55 3g1n h ARG 4214Cb 0.78 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.33 3g1n h ARG 4214CO 0.05 0.15 -1.94 -0.12 2.80 0.00 0.00 179.97 180.91 3g1n n MET 4215N -4.26 0.73 -0.00 0.20 1.56 -0.58 -4.60 117.12 110.17 3g1n n MET 4215Ca -0.02 0.27 0.01 0.00 -0.27 0.00 0.00 57.70 57.68 3g1n n MET 4215Cb 0.22 -1.73 -0.01 0.00 2.15 0.00 0.00 33.22 33.85 3g1n n MET 4215CO 0.00 0.00 0.00 0.25 -0.73 0.00 0.00 175.97 175.49 3g1n n THR 4216N -3.36 0.00 0.24 1.12 -2.24 -0.34 -4.74 114.28 104.96 3g1n n THR 4216Ca -0.28 -0.31 0.07 0.00 -2.27 0.00 0.00 64.05 61.26 3g1n n THR 4216Cb 1.05 0.81 0.57 0.00 -2.10 0.00 0.00 70.33 70.66 3g1n n THR 4216CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3g1n h GLY 4217N 0.48 0.00 1.07 3.38 0.00 -1.26 -0.11 103.07 106.63 3g1n h GLY 4217Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3g1n h GLY 4217CO 0.00 0.00 -0.91 0.00 0.00 0.00 0.00 176.54 175.63 3g1n h ALA 4218N 1.84 0.53 -0.20 3.60 0.00 -1.84 -3.38 119.26 119.82 3g1n h ALA 4218Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g1n h ALA 4218Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3g1n h ALA 4218CO 0.02 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.71 3g1n n ILE 4219N -2.64 0.97 -0.21 0.00 -5.35 -0.81 -4.53 119.36 106.79 3g1n n ILE 4219Ca 0.01 -0.98 -0.02 0.00 -0.27 0.00 0.00 62.75 61.49 3g1n n ILE 4219Cb 0.54 0.52 0.05 0.00 -1.74 0.00 0.00 39.64 39.01 3g1n n ILE 4219CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 3g1n h ARG 4220N 1.22 -0.04 -0.16 6.28 3.08 -1.22 0.94 114.38 124.48 3g1n h ARG 4220Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.84 3g1n h ARG 4220Cb 0.63 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.69 3g1n h ARG 4220CO 0.00 -0.03 -0.74 0.87 -1.07 0.00 0.00 179.97 179.00 3g1n h LYS 4221N -0.04 0.74 -0.27 0.04 1.57 -1.88 -1.21 116.57 115.52 3g1n h LYS 4221Ca 0.29 -0.59 0.01 0.00 -1.87 0.00 0.00 60.65 58.50 3g1n h LYS 4221Cb 0.49 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 3g1n h LYS 4221CO -0.66 1.20 0.15 1.96 -0.57 0.00 0.00 179.45 181.53 3g1n h GLN 4222N 0.52 0.30 -0.16 3.15 7.50 -1.76 -2.42 115.11 122.24 3g1n h GLN 4222Ca -0.04 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.08 3g1n h GLN 4222Cb 1.36 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.82 3g1n h GLN 4222CO 0.15 0.20 0.04 1.25 -1.50 0.00 0.00 178.83 178.98 3g1n h LEU 4223N 0.31 0.24 -0.74 1.46 5.85 -0.73 -1.79 115.31 119.91 3g1n h LEU 4223Ca 0.11 -0.22 0.11 0.00 0.84 0.00 0.00 57.88 58.72 3g1n h LEU 4223Cb 0.01 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 40.90 3g1n h LEU 4223CO -0.06 0.40 0.36 0.00 -0.34 0.00 0.00 178.44 178.80 3g1n h ALA 4224N 0.85 1.04 0.23 1.25 0.00 -1.21 0.12 119.26 121.56 3g1n h ALA 4224Ca 0.05 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3g1n h ALA 4224Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3g1n h ALA 4224CO -0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 179.25 179.06 3g1n h ALA 4225N 1.47 -0.32 -0.39 0.00 0.00 -1.19 0.20 119.26 119.03 3g1n h ALA 4225Ca 0.38 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.29 3g1n h ALA 4225Cb 0.45 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 3g1n h ALA 4225CO -0.30 -0.68 0.03 0.35 0.00 0.00 0.00 179.25 178.65 3g1n h PHE 4226N -0.32 0.04 -0.57 0.00 3.57 -0.79 -1.17 116.94 117.70 3g1n h PHE 4226Ca -0.03 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 3g1n h PHE 4226Cb 0.25 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 3g1n h PHE 4226CO -0.07 -0.04 0.23 -0.07 -2.23 0.00 0.00 178.31 176.14 3g1n h LEU 4227N 0.15 0.79 -0.68 0.59 4.07 -0.62 0.06 115.31 119.66 3g1n h LEU 4227Ca 0.19 -0.17 0.06 0.00 0.08 0.00 0.00 57.88 58.04 3g1n h LEU 4227Cb 0.25 -0.20 -0.05 0.00 1.08 0.00 0.00 40.66 41.73 3g1n h LEU 4227CO -0.29 0.74 0.38 -0.08 -1.08 0.00 0.00 178.44 178.11 3g1n h GLU 4228N 0.79 0.68 -0.45 1.13 4.81 -0.24 0.12 114.58 121.42 3g1n h GLU 4228Ca 0.19 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.32 3g1n h GLU 4228Cb 0.19 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 3g1n h GLU 4228CO -0.02 0.45 0.03 0.78 -0.73 0.00 0.00 179.01 179.53 3g1n h GLY 4229N 0.70 0.76 0.29 1.92 0.00 -0.66 -2.38 103.07 103.71 3g1n h GLY 4229Ca 0.30 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3g1n h GLY 4229CO -0.18 0.43 -0.09 -2.75 0.00 0.00 0.00 176.54 173.95 3g1n h PHE 4230N 0.67 -0.23 -0.43 5.60 3.57 -0.32 -3.13 116.94 122.67 3g1n h PHE 4230Ca 0.14 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.66 3g1n h PHE 4230Cb 0.37 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 3g1n h PHE 4230CO 0.02 0.12 0.28 1.88 -2.23 0.00 0.00 178.31 178.38 3g1n h TYR 4231N -0.96 0.46 0.00 0.41 0.05 -0.81 -0.27 116.97 115.86 3g1n h TYR 4231Ca -0.03 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.77 3g1n h TYR 4231Cb 0.45 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.04 3g1n h TYR 4231CO 0.06 0.28 0.36 0.93 -1.05 0.00 0.00 178.16 178.74 3g1n h GLU 4232N 0.49 0.00 0.00 4.88 5.08 -1.55 -2.89 114.58 120.58 3g1n h GLU 4232Ca 0.17 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 3g1n h GLU 4232Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3g1n h GLU 4232CO -0.04 0.00 -1.13 -0.89 -1.00 0.00 0.00 179.01 175.95 3g1n n ILE 4233N -2.67 0.13 -3.66 3.13 5.41 -0.24 -4.80 119.36 116.67 3g1n n ILE 4233Ca -0.02 -0.04 -0.39 0.00 1.00 0.00 0.00 62.75 63.31 3g1n n ILE 4233Cb 0.40 -1.39 -0.10 0.00 -0.71 0.00 0.00 39.64 37.84 3g1n n ILE 4233CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3g1n s ILE 4234N -2.04 3.78 0.61 1.39 -1.09 -0.43 -5.03 121.20 118.39 3g1n s ILE 4234Ca -0.03 -1.89 -0.19 0.00 -2.23 0.00 0.00 60.65 56.31 3g1n s ILE 4234Cb 0.01 -3.52 -0.02 0.00 -1.58 0.00 0.00 42.46 37.34 3g1n s ILE 4234CO 0.04 -0.72 1.32 -2.16 -1.23 0.00 0.00 174.94 172.19 3g1n s PRO 4235N 1.26 2.75 0.43 2.79 0.04 -1.09 -3.79 135.00 137.39 3g1n s PRO 4235Ca 0.07 2.12 0.14 0.00 0.04 0.00 0.00 61.00 63.37 3g1n s PRO 4235Cb -0.24 -1.98 1.02 0.00 0.04 0.00 0.00 34.50 33.34 3g1n s PRO 4235CO -0.02 -1.46 1.95 -0.22 0.04 0.00 0.00 177.00 177.29 3g1n h LYS 4236N 0.85 0.42 0.00 4.56 3.64 -1.95 -0.56 116.57 123.53 3g1n h LYS 4236Ca -0.51 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 3g1n h LYS 4236Cb 1.32 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 3g1n h LYS 4236CO 0.54 0.28 0.00 0.07 -2.27 0.00 0.00 179.45 178.07 3g1n h ARG 4237N 0.43 0.00 0.06 1.90 0.11 -1.98 -1.36 114.38 113.53 3g1n h ARG 4237Ca 0.32 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 60.02 3g1n h ARG 4237Cb 0.67 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.70 3g1n h ARG 4237CO -0.10 0.00 -2.25 1.28 0.10 0.00 0.00 179.97 179.00 3g1n n LEU 4238N -2.79 2.81 0.11 0.08 4.32 -0.23 -4.41 117.00 116.88 3g1n n LEU 4238Ca -0.01 0.03 -0.01 0.00 -0.02 0.00 0.00 56.01 56.00 3g1n n LEU 4238Cb 0.14 -1.01 -0.03 0.00 -1.62 0.00 0.00 43.42 40.90 3g1n n LEU 4238CO 0.20 0.89 0.34 -0.29 -1.22 0.00 0.00 177.39 177.30 3g1n h ILE 4239N 0.02 1.20 0.00 -0.08 6.09 -1.41 -3.31 117.51 120.01 3g1n h ILE 4239Ca -0.51 -2.70 0.00 0.00 -1.37 0.00 0.00 64.86 60.29 3g1n h ILE 4239Cb 1.95 2.59 0.00 0.00 0.47 0.00 0.00 36.82 41.84 3g1n h ILE 4239CO -0.01 0.68 0.00 -1.20 -3.07 0.00 0.00 178.15 174.55 3g1n n SER 4240N -3.27 0.00 0.11 2.19 7.64 -0.52 -2.10 113.62 117.66 3g1n n SER 4240Ca 0.01 -0.90 0.01 0.00 1.01 0.00 0.00 58.87 59.00 3g1n n SER 4240Cb 0.82 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 64.01 3g1n n SER 4240CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3g1n h ILE 4241N 0.00 0.87 -3.52 0.44 2.04 -1.82 -3.47 117.51 112.06 3g1n h ILE 4241Ca 0.00 -2.28 -0.50 0.00 1.00 0.00 0.00 64.86 63.08 3g1n h ILE 4241Cb 0.00 2.38 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 3g1n h ILE 4241CO 0.00 0.49 0.03 -0.36 0.00 0.00 0.00 178.15 178.32 3g1n s PHE 4242N -2.93 3.48 0.83 1.37 0.08 -0.89 -5.07 117.98 114.86 3g1n s PHE 4242Ca 0.02 0.88 -0.11 0.00 0.12 0.00 0.00 56.93 57.84 3g1n s PHE 4242Cb 0.08 -2.31 0.12 0.00 -0.57 0.00 0.00 43.02 40.34 3g1n s PHE 4242CO 0.77 -0.04 1.18 0.95 -0.10 0.00 0.00 175.22 177.98 3g1n s THR 4243N -2.33 2.07 -0.15 0.64 -4.23 -1.26 -4.85 115.64 105.51 3g1n s THR 4243Ca 0.48 -0.10 0.29 0.00 -1.18 0.00 0.00 61.69 61.19 3g1n s THR 4243Cb -0.10 -2.97 0.33 0.00 1.34 0.00 0.00 72.50 71.10 3g1n s THR 4243CO 0.33 0.00 1.87 1.05 -0.54 0.00 0.00 174.62 177.32 3g1n h GLU 4244N -1.13 0.00 0.03 3.99 9.09 -1.93 0.11 114.58 124.75 3g1n h GLU 4244Ca -0.44 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 58.90 3g1n h GLU 4244Cb 1.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.39 3g1n h GLU 4244CO 0.53 0.00 -0.32 1.96 0.05 0.00 0.00 179.01 181.23 3g1n h GLN 4245N 0.00 0.07 -0.61 1.06 7.50 -1.95 -3.28 115.11 117.90 3g1n h GLN 4245Ca 0.00 -0.12 -0.04 0.00 0.50 0.00 0.00 58.65 58.99 3g1n h GLN 4245Cb 0.46 0.04 -0.03 0.00 0.05 0.00 0.00 27.48 28.01 3g1n h GLN 4245CO 0.00 1.06 0.22 0.93 -1.50 0.00 0.00 178.83 179.53 3g1n h GLU 4246N -0.85 0.93 -0.43 1.46 5.08 -1.89 -2.05 114.58 116.83 3g1n h GLU 4246Ca -0.07 -0.18 0.02 0.00 -1.00 0.00 0.00 59.36 58.13 3g1n h GLU 4246Cb 1.18 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 3g1n h GLU 4246CO 0.01 0.81 0.24 1.25 -1.00 0.00 0.00 179.01 180.32 3g1n h LEU 4247N 0.86 0.39 -0.59 1.33 5.85 -0.95 -0.53 115.31 121.66 3g1n h LEU 4247Ca 0.20 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.99 3g1n h LEU 4247Cb 0.24 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 3g1n h LEU 4247CO -0.01 0.28 0.30 -0.08 -0.34 0.00 0.00 178.44 178.59 3g1n h GLU 4248N 0.49 0.55 0.00 1.25 4.81 -1.56 -1.71 114.58 118.41 3g1n h GLU 4248Ca 0.17 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 3g1n h GLU 4248Cb 0.03 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 3g1n h GLU 4248CO -0.09 0.36 -0.33 -0.07 -0.73 0.00 0.00 179.01 178.16 3g1n h LEU 4249N 0.56 0.00 -0.12 1.64 3.38 -0.76 -1.73 115.31 118.29 3g1n h LEU 4249Ca 0.27 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.20 3g1n h LEU 4249Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3g1n h LEU 4249CO -0.19 0.33 -0.08 0.25 0.09 0.00 0.00 178.44 178.83 3g1n h LEU 4250N 0.00 0.27 0.18 1.67 5.85 -0.69 -1.18 115.31 121.42 3g1n h LEU 4250Ca -0.00 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 3g1n h LEU 4250Cb 0.78 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.73 3g1n h LEU 4250CO 0.04 0.67 -0.08 0.40 -0.34 0.00 0.00 178.44 179.12 3g1n h ILE 4251N -0.12 0.93 -0.41 4.05 2.04 -0.91 -3.35 117.51 119.75 3g1n h ILE 4251Ca 0.02 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.32 3g1n h ILE 4251Cb 0.58 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.92 3g1n h ILE 4251CO 0.02 0.13 0.00 -1.54 0.00 0.00 0.00 178.15 176.76 3g1n n SER 4252N -5.07 3.08 -0.17 1.72 3.41 -0.69 -1.71 113.62 114.19 3g1n n SER 4252Ca -0.09 -2.00 0.02 0.00 -0.26 0.00 0.00 58.87 56.55 3g1n n SER 4252Cb 0.21 -0.27 -0.01 0.00 -0.26 0.00 0.00 64.21 63.88 3g1n n SER 4252CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g1n n GLY 4253N 0.70 -1.87 3.71 5.00 0.00 -0.44 -4.76 105.19 107.52 3g1n n GLY 4253Ca 0.14 -1.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 3g1n n GLY 4253CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g1n s LEU 4254N -4.65 4.30 0.77 0.99 1.02 -1.26 -4.65 118.68 115.20 3g1n s LEU 4254Ca 0.00 1.16 -0.12 0.00 0.02 0.00 0.00 54.13 55.19 3g1n s LEU 4254Cb 0.00 -3.07 0.06 0.00 0.02 0.00 0.00 46.19 43.20 3g1n s LEU 4254CO 0.00 -0.13 1.11 -2.16 0.02 0.00 0.00 176.35 175.19 3g1n s PRO 4255N 0.92 2.16 -0.20 1.29 0.04 -1.26 -5.05 135.00 132.90 3g1n s PRO 4255Ca 0.37 1.32 -0.07 0.00 0.04 0.00 0.00 61.00 62.66 3g1n s PRO 4255Cb -0.17 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 3g1n s PRO 4255CO 0.17 -1.74 0.04 0.95 0.04 0.00 0.00 177.00 176.47 3g1n s THR 4256N -2.69 4.43 -0.28 1.26 -4.23 -1.26 -4.84 115.64 108.04 3g1n s THR 4256Ca 0.64 -0.15 -0.14 0.00 -1.18 0.00 0.00 61.69 60.86 3g1n s THR 4256Cb -0.20 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 70.60 3g1n s THR 4256CO 0.53 0.42 0.32 -0.63 -0.54 0.00 0.00 174.62 174.72 3g1n s ILE 4257N 0.80 5.21 -0.57 2.99 1.09 -1.26 -4.97 121.20 124.49 3g1n s ILE 4257Ca 0.02 0.40 -0.23 0.00 -1.10 0.00 0.00 60.65 59.75 3g1n s ILE 4257Cb -0.14 -3.66 0.05 0.00 -1.06 0.00 0.00 42.46 37.65 3g1n s ILE 4257CO 0.02 0.16 0.89 -0.62 -0.10 0.00 0.00 174.94 175.29 3g1n s ASP 4258N 1.68 6.28 0.23 3.58 -1.08 -1.26 -4.94 116.67 121.16 3g1n s ASP 4258Ca 0.12 -0.59 -0.06 0.00 -0.52 0.00 0.00 52.55 51.51 3g1n s ASP 4258Cb -0.16 -2.41 0.22 0.00 -1.46 0.00 0.00 42.92 39.11 3g1n s ASP 4258CO 0.10 -1.22 1.75 0.16 0.52 0.00 0.00 175.17 176.49 3g1n h ILE 4259N 5.98 1.25 -1.00 4.11 3.07 -1.99 -1.00 117.51 127.93 3g1n h ILE 4259Ca -0.27 -0.94 0.11 0.00 1.55 0.00 0.00 64.86 65.30 3g1n h ILE 4259Cb 1.08 0.61 -0.08 0.00 -0.27 0.00 0.00 36.82 38.16 3g1n h ILE 4259CO 1.09 0.36 0.64 -0.78 -1.05 0.00 0.00 178.15 178.40 3g1n h ASP 4260N 0.97 0.95 -0.32 2.16 3.58 -1.97 0.83 116.42 122.62 3g1n h ASP 4260Ca 0.20 0.04 -0.05 0.00 0.42 0.00 0.00 57.03 57.64 3g1n h ASP 4260Cb 0.37 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 3g1n h ASP 4260CO 0.00 0.53 0.01 -0.78 -2.88 0.00 0.00 179.24 176.12 3g1n h ASP 4261N 1.03 0.54 0.29 2.28 3.58 -1.63 0.17 116.42 122.68 3g1n h ASP 4261Ca 0.48 -0.30 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 3g1n h ASP 4261Cb 0.42 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.33 3g1n h ASP 4261CO -0.24 0.71 -0.14 0.25 -2.88 0.00 0.00 179.24 176.94 3g1n h LEU 4262N 0.35 -0.33 -1.23 2.28 5.85 -0.89 -2.69 115.31 118.65 3g1n h LEU 4262Ca 0.09 -0.08 0.20 0.00 0.84 0.00 0.00 57.88 58.93 3g1n h LEU 4262Cb 0.43 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.45 3g1n h LEU 4262CO 0.01 -0.12 0.61 0.50 -0.34 0.00 0.00 178.44 179.10 3g1n h LYS 4263N -0.52 0.60 -0.00 1.25 3.64 0.74 0.41 116.57 122.69 3g1n h LYS 4263Ca -0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3g1n h LYS 4263Cb 0.39 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 3g1n h LYS 4263CO 0.07 0.40 -0.00 0.43 -2.27 0.00 0.00 179.45 178.07 3g1n n SER 4264N -4.65 0.02 -2.74 4.20 7.64 0.59 -3.80 113.62 114.88 3g1n n SER 4264Ca 0.22 -0.99 -0.03 0.00 1.01 0.00 0.00 58.87 59.07 3g1n n SER 4264Cb 0.63 -0.01 0.05 0.00 -1.01 0.00 0.00 64.21 63.87 3g1n n SER 4264CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3g1n n ASN 4265N -0.99 1.96 -4.27 6.43 3.02 0.14 -5.00 115.26 116.55 3g1n n ASN 4265Ca 0.24 -2.25 -0.32 0.00 -0.03 0.00 0.00 54.58 52.22 3g1n n ASN 4265Cb 0.12 -0.47 -0.16 0.00 -0.61 0.00 0.00 39.78 38.66 3g1n n ASN 4265CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3g1n s THR 4266N -3.88 2.28 0.18 3.41 2.01 -1.05 -3.58 115.64 115.01 3g1n s THR 4266Ca 0.30 -0.96 0.04 0.00 0.31 0.00 0.00 61.69 61.38 3g1n s THR 4266Cb 0.34 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.94 3g1n s THR 4266CO -0.03 0.56 0.27 -1.61 -0.69 0.00 0.00 174.62 173.12 3g1n s GLU 4267N 0.16 3.32 -0.08 4.92 2.02 0.63 -5.00 118.70 124.67 3g1n s GLU 4267Ca -0.12 -0.71 0.02 0.00 0.02 0.00 0.00 54.97 54.18 3g1n s GLU 4267Cb -0.16 -2.87 0.02 0.00 0.10 0.00 0.00 34.13 31.21 3g1n s GLU 4267CO 0.07 0.49 -0.12 0.71 0.02 0.00 0.00 175.26 176.42 3g1n s TYR 4268N -1.83 1.59 -0.19 1.61 2.02 -1.26 -1.24 117.35 118.06 3g1n s TYR 4268Ca 0.34 -0.67 -0.02 0.00 -0.37 0.00 0.00 57.07 56.35 3g1n s TYR 4268Cb -0.10 -1.19 -0.00 0.00 -0.40 0.00 0.00 41.96 40.27 3g1n s TYR 4268CO 0.28 -0.37 -0.10 -1.58 -1.57 0.00 0.00 175.55 172.20 3g1n s HIS 4269N 0.93 2.87 0.00 2.71 5.65 -0.41 -4.73 115.29 122.31 3g1n s HIS 4269Ca -0.09 -1.03 0.00 0.00 0.25 0.00 0.00 55.06 54.19 3g1n s HIS 4269Cb -0.15 -1.99 0.00 0.00 -1.18 0.00 0.00 32.58 29.26 3g1n s HIS 4269CO 0.00 -0.52 0.00 1.63 -0.65 0.00 0.00 174.74 175.20 3g1n n LYS 4270N 4.41 0.00 -1.92 2.88 5.02 -1.26 -2.20 118.16 125.09 3g1n n LYS 4270Ca -0.19 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.78 3g1n n LYS 4270Cb 0.51 -0.17 0.02 0.00 -0.02 0.00 0.00 35.03 35.37 3g1n n LYS 4270CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3g1n s TYR 4271N 0.00 3.04 0.39 2.13 2.02 -1.26 -4.94 117.35 118.73 3g1n s TYR 4271Ca 0.00 1.48 0.08 0.00 -0.37 0.00 0.00 57.07 58.26 3g1n s TYR 4271Cb 0.00 -2.96 -0.05 0.00 -0.40 0.00 0.00 41.96 38.55 3g1n s TYR 4271CO 0.00 -1.12 0.18 -0.65 -1.57 0.00 0.00 175.55 172.39 3g1n s GLN 4272N -4.36 2.28 0.47 -0.62 -0.21 -1.26 -4.74 119.66 111.22 3g1n s GLN 4272Ca 0.62 -1.74 0.13 0.00 0.02 0.00 0.00 55.36 54.39 3g1n s GLN 4272Cb -0.15 -2.06 1.09 0.00 1.00 0.00 0.00 33.01 32.89 3g1n s GLN 4272CO 0.42 -0.06 2.07 0.66 -2.12 0.00 0.00 175.29 176.26 3g1n h SER 4273N 1.44 0.24 -0.03 5.90 4.64 -1.99 -1.65 113.55 122.10 3g1n h SER 4273Ca -0.43 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3g1n h SER 4273Cb 1.25 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3g1n h SER 4273CO 0.67 0.16 0.00 -3.20 -0.87 0.00 0.00 176.83 173.59 3g1n n ASN 4274N -4.49 1.46 -4.68 4.97 2.85 -1.26 -4.33 115.26 109.77 3g1n n ASN 4274Ca 0.03 -1.50 -0.44 0.00 -0.11 0.00 0.00 54.58 52.56 3g1n n ASN 4274Cb 0.19 -0.01 -0.02 0.00 1.24 0.00 0.00 39.78 41.18 3g1n n ASN 4274CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 3g1n n SER 4275N 0.14 2.71 -0.26 1.20 7.64 -0.62 -4.74 113.62 119.69 3g1n n SER 4275Ca 0.19 1.17 0.05 0.00 1.01 0.00 0.00 58.87 61.29 3g1n n SER 4275Cb 0.34 -1.45 0.18 0.00 -1.01 0.00 0.00 64.21 62.28 3g1n n SER 4275CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 3g1n h ILE 4276N 2.81 0.68 0.00 0.44 6.09 -1.91 0.31 117.51 125.92 3g1n h ILE 4276Ca -0.45 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 62.88 3g1n h ILE 4276Cb 1.28 0.17 0.00 0.00 0.47 0.00 0.00 36.82 38.74 3g1n h ILE 4276CO 0.70 0.09 0.00 0.00 -3.07 0.00 0.00 178.15 175.86 3g1n n GLN 4277N -4.98 0.09 -0.01 2.19 0.00 -1.26 -0.55 117.38 112.86 3g1n n GLN 4277Ca 0.14 0.03 -0.17 0.00 0.00 0.00 0.00 57.00 57.01 3g1n n GLN 4277Cb 0.40 -1.50 -0.13 0.00 0.00 0.00 0.00 30.24 29.01 3g1n n GLN 4277CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 3g1n h ILE 4278N 0.00 1.58 -0.58 -0.39 1.08 -1.30 -1.21 117.51 116.68 3g1n h ILE 4278Ca 0.00 -2.26 0.09 0.00 -0.39 0.00 0.00 64.86 62.31 3g1n h ILE 4278Cb 0.42 3.04 -0.07 0.00 -3.07 0.00 0.00 36.82 37.13 3g1n h ILE 4278CO 0.00 0.62 0.19 1.56 -0.69 0.00 0.00 178.15 179.83 3g1n h GLN 4279N -0.51 0.34 -0.74 2.37 4.20 -0.78 -1.62 115.11 118.36 3g1n h GLN 4279Ca -0.07 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 3g1n h GLN 4279Cb 1.27 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.93 3g1n h GLN 4279CO 0.08 0.23 0.45 -1.49 -0.67 0.00 0.00 178.83 177.43 3g1n h TRP 4280N 0.36 0.98 0.02 2.96 6.55 -0.88 -2.58 115.95 123.35 3g1n h TRP 4280Ca 0.29 -0.00 0.02 0.00 0.95 0.00 0.00 58.89 60.15 3g1n h TRP 4280Cb 0.38 -0.32 -0.02 0.00 -0.86 0.00 0.00 29.16 28.33 3g1n h TRP 4280CO -0.19 0.66 -0.12 0.35 -1.05 0.00 0.00 178.44 178.09 3g1n h PHE 4281N 1.02 -0.30 -0.19 0.49 3.57 -0.31 -1.06 116.94 120.16 3g1n h PHE 4281Ca 0.27 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.74 3g1n h PHE 4281Cb -0.04 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 3g1n h PHE 4281CO -0.01 -0.18 -0.06 -1.49 -2.23 0.00 0.00 178.31 174.34 3g1n h TRP 4282N -0.21 0.29 -0.32 0.41 4.06 -1.26 -0.28 115.95 118.63 3g1n h TRP 4282Ca 0.03 -0.02 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 3g1n h TRP 4282Cb 0.25 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 3g1n h TRP 4282CO -0.17 0.35 -0.07 -0.09 -3.56 0.00 0.00 178.44 174.91 3g1n h ARG 4283N 0.28 0.61 0.01 0.49 2.43 -1.16 -2.41 114.38 114.63 3g1n h ARG 4283Ca 0.06 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3g1n h ARG 4283Cb 0.29 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3g1n h ARG 4283CO 0.01 0.79 -0.00 0.00 -1.51 0.00 0.00 179.97 179.26 3g1n h ALA 4284N 0.81 -0.01 -0.83 2.80 0.00 -0.49 -2.33 119.26 119.20 3g1n h ALA 4284Ca 0.08 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.89 3g1n h ALA 4284Cb 0.56 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 3g1n h ALA 4284CO 0.03 -0.36 0.52 1.25 0.00 0.00 0.00 179.25 180.69 3g1n h LEU 4285N -0.31 0.86 -1.53 0.00 5.85 -1.17 -1.59 115.31 117.42 3g1n h LEU 4285Ca -0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 3g1n h LEU 4285Cb 0.30 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3g1n h LEU 4285CO 0.00 0.58 -0.23 -0.09 -0.34 0.00 0.00 178.44 178.36 3g1n h ARG 4286N 1.00 0.00 -0.53 1.25 2.43 -1.28 -1.96 114.38 115.29 3g1n h ARG 4286Ca 0.34 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 3g1n h ARG 4286Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3g1n h ARG 4286CO -0.13 0.23 0.00 -1.13 -1.51 0.00 0.00 179.97 177.43 3g1n n SER 4287N -3.80 3.05 -4.85 -3.80 3.41 -0.63 -4.92 113.62 102.08 3g1n n SER 4287Ca -0.02 -1.98 -0.32 0.00 -0.26 0.00 0.00 58.87 56.30 3g1n n SER 4287Cb 0.33 -0.35 -0.05 0.00 -0.26 0.00 0.00 64.21 63.88 3g1n n SER 4287CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3g1n s PHE 4288N -1.29 3.40 0.79 7.33 0.08 -0.74 -5.05 117.98 122.50 3g1n s PHE 4288Ca 0.38 1.29 -0.16 0.00 0.12 0.00 0.00 56.93 58.56 3g1n s PHE 4288Cb 0.20 -2.62 -0.06 0.00 -0.57 0.00 0.00 43.02 39.98 3g1n s PHE 4288CO 0.27 -0.08 0.14 -0.25 -0.10 0.00 0.00 175.22 175.20 3g1n n ASP 4289N -0.88 -2.72 -0.31 1.36 8.00 -1.26 -4.69 116.55 116.05 3g1n n ASP 4289Ca 0.04 0.46 0.16 0.00 0.71 0.00 0.00 54.79 56.17 3g1n n ASP 4289Cb 0.54 -1.07 0.34 0.00 -0.02 0.00 0.00 41.12 40.91 3g1n n ASP 4289CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 3g1n h GLN 4290N -0.68 0.29 -0.04 -1.24 5.75 -1.96 -0.32 115.11 116.91 3g1n h GLN 4290Ca -0.44 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.01 3g1n h GLN 4290Cb 1.34 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.82 3g1n h GLN 4290CO 0.37 0.19 -0.09 0.00 -2.65 0.00 0.00 178.83 176.66 3g1n h ALA 4291N 1.78 0.07 -0.14 3.38 0.00 -1.93 -2.79 119.26 119.62 3g1n h ALA 4291Ca 0.60 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 3g1n h ALA 4291Cb 1.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3g1n h ALA 4291CO -0.60 -0.08 -0.23 -0.44 0.00 0.00 0.00 179.25 177.90 3g1n h ASP 4292N -0.38 0.24 -0.86 0.00 3.45 -1.84 -0.92 116.42 116.11 3g1n h ASP 4292Ca 0.00 -0.07 0.01 0.00 0.43 0.00 0.00 57.03 57.40 3g1n h ASP 4292Cb 0.66 -0.06 -0.04 0.00 -0.56 0.00 0.00 39.33 39.32 3g1n h ASP 4292CO 0.02 0.49 0.56 0.03 -1.57 0.00 0.00 179.24 178.77 3g1n h ARG 4293N 0.23 1.14 0.15 3.56 3.08 -1.11 0.10 114.38 121.53 3g1n h ARG 4293Ca 0.04 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3g1n h ARG 4293Cb 0.54 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3g1n h ARG 4293CO 0.04 0.76 -0.07 0.00 -1.07 0.00 0.00 179.97 179.63 3g1n h ALA 4294N 1.31 -0.20 -0.28 0.04 0.00 -1.08 -1.10 119.26 117.94 3g1n h ALA 4294Ca 0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3g1n h ALA 4294Cb -0.12 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3g1n h ALA 4294CO -0.07 -0.58 0.13 0.87 0.00 0.00 0.00 179.25 179.60 3g1n h LYS 4295N -0.25 0.38 -0.10 0.00 1.57 -0.94 0.16 116.57 117.39 3g1n h LYS 4295Ca -0.02 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3g1n h LYS 4295Cb 0.20 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 3g1n h LYS 4295CO 0.03 0.31 0.01 0.35 -0.57 0.00 0.00 179.45 179.59 3g1n h PHE 4296N 0.39 0.17 -0.55 -1.35 3.57 -0.56 0.26 116.94 118.87 3g1n h PHE 4296Ca 0.10 -0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.68 3g1n h PHE 4296Cb 0.06 -0.05 -0.09 0.00 2.79 0.00 0.00 35.95 38.67 3g1n h PHE 4296CO 0.00 0.37 0.05 1.25 -2.23 0.00 0.00 178.31 177.75 3g1n h LEU 4297N -0.07 -0.14 -0.33 0.59 5.85 -0.41 -0.68 115.31 120.12 3g1n h LEU 4297Ca 0.03 0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.91 3g1n h LEU 4297Cb 0.29 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 3g1n h LEU 4297CO 0.00 -0.05 0.11 1.56 -0.34 0.00 0.00 178.44 179.73 3g1n h GLN 4298N 0.17 0.25 -0.96 1.25 4.20 -0.40 -0.82 115.11 118.80 3g1n h GLN 4298Ca 0.28 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.99 3g1n h GLN 4298Cb 0.43 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 3g1n h GLN 4298CO -0.42 0.16 0.64 0.35 -0.67 0.00 0.00 178.83 178.89 3g1n h PHE 4299N 0.25 1.21 0.00 2.96 3.57 0.32 -0.91 116.94 124.34 3g1n h PHE 4299Ca 0.15 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.68 3g1n h PHE 4299Cb 0.12 -0.41 0.00 0.00 2.79 0.00 0.00 35.95 38.45 3g1n h PHE 4299CO -0.14 0.76 -1.32 1.55 -2.23 0.00 0.00 178.31 176.93 3g1n n VAL 4300N -4.39 0.06 0.00 1.41 3.14 -0.34 -4.56 118.33 113.66 3g1n n VAL 4300Ca 0.11 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.25 3g1n n VAL 4300Cb 0.01 0.42 0.00 0.00 -1.06 0.00 0.00 33.84 33.21 3g1n n VAL 4300CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 3g1n n THR 4301N -1.90 0.00 0.00 1.55 5.66 -0.33 -3.46 114.28 115.81 3g1n n THR 4301Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 3g1n n THR 4301Cb 0.44 0.13 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 3g1n n THR 4301CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3g1n n GLY 4302N 2.08 2.84 3.09 1.09 0.00 -0.35 -4.76 105.19 109.18 3g1n n GLY 4302Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 3g1n n GLY 4302CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3g1n s THR 4303N -2.56 0.23 -1.87 2.61 -1.32 -1.26 -4.58 115.64 106.89 3g1n s THR 4303Ca 0.00 -1.79 0.28 0.00 -1.21 0.00 0.00 61.69 58.98 3g1n s THR 4303Cb 0.00 -1.48 0.45 0.00 -1.51 0.00 0.00 72.50 69.96 3g1n s THR 4303CO 0.00 -0.98 1.78 -1.54 -2.21 0.00 0.00 174.62 171.67 3g1n n SER 4304N 0.15 0.80 -4.66 8.08 3.41 -1.26 -3.17 113.62 116.97 3g1n n SER 4304Ca -0.14 -0.88 -0.43 0.00 -0.26 0.00 0.00 58.87 57.16 3g1n n SER 4304Cb 0.61 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 3g1n n SER 4304CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3g1n s LYS 4305N -2.36 4.25 0.16 4.33 2.20 -1.26 -4.53 119.74 122.53 3g1n s LYS 4305Ca 0.31 1.51 -0.26 0.00 -0.36 0.00 0.00 55.97 57.16 3g1n s LYS 4305Cb 0.20 -3.70 -0.08 0.00 -1.51 0.00 0.00 37.83 32.75 3g1n s LYS 4305CO 0.45 -0.66 0.82 0.08 -0.36 0.00 0.00 175.35 175.68 3g1n s VAL 4306N 3.32 4.38 0.49 4.02 1.01 -1.26 -5.05 120.40 127.32 3g1n s VAL 4306Ca 0.49 1.79 -0.24 0.00 0.00 0.00 0.00 61.98 64.02 3g1n s VAL 4306Cb -0.18 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 31.95 3g1n s VAL 4306CO 0.10 0.48 1.40 -2.84 0.00 0.00 0.00 175.10 174.24 3g1n s PRO 4307N -0.89 3.45 0.50 2.72 0.02 -1.26 -4.89 135.00 134.65 3g1n s PRO 4307Ca 0.38 2.34 0.26 0.00 0.02 0.00 0.00 61.00 64.00 3g1n s PRO 4307Cb -0.23 -2.48 1.34 0.00 0.02 0.00 0.00 34.50 33.14 3g1n s PRO 4307CO 0.27 -0.98 2.03 -0.07 -0.33 0.00 0.00 177.00 177.92 3g1n h LEU 4308N 1.95 0.00 -1.26 -5.54 3.38 -1.96 -0.75 115.31 111.12 3g1n h LEU 4308Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3g1n h LEU 4308Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3g1n h LEU 4308CO 0.59 0.14 0.00 0.00 0.09 0.00 0.00 178.44 179.27 3g1n n GLN 4309N -3.67 1.82 0.00 1.13 3.00 -1.26 -5.06 117.38 113.34 3g1n n GLN 4309Ca -0.02 -1.24 0.00 0.00 -0.01 0.00 0.00 57.00 55.73 3g1n n GLN 4309Cb 0.26 -1.37 0.00 0.00 0.00 0.00 0.00 30.24 29.13 3g1n n GLN 4309CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3g1n n GLY 4310N 1.15 -2.30 0.12 1.08 0.00 -0.29 -4.55 105.19 100.39 3g1n n GLY 4310Ca 0.15 -1.54 0.11 0.00 0.00 0.00 0.00 46.02 44.74 3g1n n GLY 4310CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3g1n n PHE 4311N -0.90 0.69 0.34 1.61 3.72 -1.26 -1.18 117.46 120.48 3g1n n PHE 4311Ca 0.00 0.29 0.12 0.00 -0.05 0.00 0.00 57.45 57.81 3g1n n PHE 4311Cb 0.00 -0.96 0.53 0.00 -0.94 0.00 0.00 39.48 38.11 3g1n n PHE 4311CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g1n h ALA 4312N 2.23 1.00 -0.56 4.37 0.00 -1.86 -3.08 119.26 121.36 3g1n h ALA 4312Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g1n h ALA 4312Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3g1n h ALA 4312CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 3g1n n ALA 4313N -1.80 2.35 -1.63 0.00 0.00 -0.33 -4.93 120.51 114.17 3g1n n ALA 4313Ca 0.01 -1.18 -0.44 0.00 0.00 0.00 0.00 53.44 51.82 3g1n n ALA 4313Cb 0.20 -0.79 -0.04 0.00 0.00 0.00 0.00 19.45 18.82 3g1n n ALA 4313CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3g1n n LEU 4314N 1.35 3.56 -4.81 0.00 7.94 -1.16 -4.94 117.00 118.93 3g1n n LEU 4314Ca 0.20 0.64 -0.36 0.00 -1.11 0.00 0.00 56.01 55.38 3g1n n LEU 4314Cb 0.57 -1.48 -0.06 0.00 0.53 0.00 0.00 43.42 42.97 3g1n n LEU 4314CO 0.14 -0.22 0.43 -1.61 -1.11 0.00 0.00 177.39 175.02 3g1n s GLU 4315N 5.17 4.28 0.38 1.96 2.02 -1.26 -1.20 118.70 130.05 3g1n s GLU 4315Ca 0.95 0.90 0.01 0.00 0.02 0.00 0.00 54.97 56.85 3g1n s GLU 4315Cb -0.49 -2.90 0.01 0.00 0.10 0.00 0.00 34.13 30.85 3g1n s GLU 4315CO 0.42 0.40 0.07 0.41 0.02 0.00 0.00 175.26 176.58 3g1n n GLY 4316N 0.77 3.53 0.32 -1.39 0.00 0.40 -4.66 105.19 104.16 3g1n n GLY 4316Ca -0.02 -2.32 0.07 0.00 0.00 0.00 0.00 46.02 43.75 3g1n n GLY 4316CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3g1n h MET 4317N 0.00 0.70 -0.01 1.61 4.05 -0.69 -2.84 114.93 117.75 3g1n h MET 4317Ca -0.30 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.08 3g1n h MET 4317Cb 0.95 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.59 3g1n h MET 4317CO 0.50 0.46 -0.38 0.09 0.23 0.00 0.00 176.91 177.81 3g1n n ASN 4318N -4.80 1.85 0.00 1.39 3.02 -1.26 -4.92 115.26 110.54 3g1n n ASN 4318Ca 0.18 -1.40 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 3g1n n ASN 4318Cb 0.42 0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.94 3g1n n ASN 4318CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3g1n n GLY 4319N 1.39 0.12 3.69 7.41 0.00 -1.07 -5.07 105.19 111.66 3g1n n GLY 4319Ca 0.11 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 3g1n n GLY 4319CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3g1n s ILE 4320N -4.00 3.63 -0.13 -0.61 1.10 -1.26 0.15 121.20 120.07 3g1n s ILE 4320Ca 0.00 1.04 -0.04 0.00 -0.51 0.00 0.00 60.65 61.14 3g1n s ILE 4320Cb 0.00 -3.67 0.06 0.00 0.15 0.00 0.00 42.46 39.00 3g1n s ILE 4320CO 0.00 0.01 0.13 -1.58 -2.11 0.00 0.00 174.94 171.39 3g1n s GLN 4321N 2.23 0.05 0.63 3.50 2.00 -0.34 -4.71 119.66 123.02 3g1n s GLN 4321Ca 0.64 0.23 -0.17 0.00 -2.00 0.00 0.00 55.36 54.06 3g1n s GLN 4321Cb -0.33 -1.05 -0.02 0.00 0.80 0.00 0.00 33.01 32.42 3g1n s GLN 4321CO 0.27 -0.51 1.18 0.15 -0.50 0.00 0.00 175.29 175.88 3g1n s LYS 4322N 2.22 2.83 0.14 1.67 1.02 -1.26 -4.41 119.74 121.95 3g1n s LYS 4322Ca 0.04 1.71 -0.34 0.00 0.02 0.00 0.00 55.97 57.40 3g1n s LYS 4322Cb -0.14 -1.92 -0.16 0.00 -0.52 0.00 0.00 37.83 35.09 3g1n s LYS 4322CO -0.08 -1.29 1.26 0.34 -0.92 0.00 0.00 175.35 174.66 3g1n n PHE 4323N -1.92 1.46 -3.90 3.18 7.35 -1.23 -4.76 117.46 117.63 3g1n n PHE 4323Ca 0.13 0.64 -0.16 0.00 -0.76 0.00 0.00 57.45 57.30 3g1n n PHE 4323Cb 0.50 -2.32 -0.16 0.00 0.35 0.00 0.00 39.48 37.86 3g1n n PHE 4323CO 0.00 0.00 0.00 1.14 -0.76 0.00 0.00 176.76 177.14 3g1n s GLN 4324N 0.02 0.19 -0.20 -4.13 -2.07 -0.80 -0.27 119.66 112.41 3g1n s GLN 4324Ca 0.78 0.07 -0.05 0.00 -1.82 0.00 0.00 55.36 54.35 3g1n s GLN 4324Cb -0.88 -0.36 -0.02 0.00 -1.09 0.00 0.00 33.01 30.66 3g1n s GLN 4324CO 0.49 -0.11 -0.01 0.42 -1.32 0.00 0.00 175.29 174.76 3g1n s ILE 4325N 0.83 3.80 -0.00 3.63 1.01 -0.37 -1.47 121.20 128.62 3g1n s ILE 4325Ca -0.08 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.22 3g1n s ILE 4325Cb -0.11 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 3g1n s ILE 4325CO -0.02 0.43 0.00 -1.00 0.00 0.00 0.00 174.94 174.35 3g1n s HIS 4326N 1.11 3.08 -0.07 3.97 3.76 -0.68 -1.29 115.29 125.17 3g1n s HIS 4326Ca 0.02 0.09 -0.30 0.00 -0.15 0.00 0.00 55.06 54.72 3g1n s HIS 4326Cb -0.14 -1.67 -0.02 0.00 1.11 0.00 0.00 32.58 31.85 3g1n s HIS 4326CO 0.01 0.46 1.08 0.50 -0.85 0.00 0.00 174.74 175.94 3g1n s ARG 4327N -1.55 4.41 -0.47 1.40 3.52 -0.94 -1.25 118.95 124.07 3g1n s ARG 4327Ca 0.19 1.51 -0.19 0.00 -0.13 0.00 0.00 55.73 57.11 3g1n s ARG 4327Cb -0.12 -3.53 0.04 0.00 -1.56 0.00 0.00 34.95 29.78 3g1n s ARG 4327CO 0.10 -0.34 0.58 0.34 -0.81 0.00 0.00 175.30 175.17 3g1n s ASP 4328N 1.22 6.24 0.10 -2.12 2.15 -0.95 -4.84 116.67 118.46 3g1n s ASP 4328Ca 0.52 -0.72 0.22 0.00 0.43 0.00 0.00 52.55 53.00 3g1n s ASP 4328Cb -0.21 -2.28 0.89 0.00 -0.30 0.00 0.00 42.92 41.02 3g1n s ASP 4328CO 0.21 -0.78 1.69 0.47 -0.17 0.00 0.00 175.17 176.59 3g1n n ASP 4329N 6.03 0.30 -4.55 -0.34 10.43 -1.26 -3.90 116.55 123.26 3g1n n ASP 4329Ca -0.06 0.55 -0.28 0.00 2.57 0.00 0.00 54.79 57.57 3g1n n ASP 4329Cb 0.46 -0.63 0.23 0.00 1.84 0.00 0.00 41.12 43.03 3g1n n ASP 4329CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 3g1n s ARG 4330N -3.09 -0.51 0.29 -1.24 0.52 -1.26 -4.89 118.95 108.76 3g1n s ARG 4330Ca 0.09 0.77 -0.27 0.00 -0.52 0.00 0.00 55.73 55.79 3g1n s ARG 4330Cb 0.12 -1.61 -0.15 0.00 0.52 0.00 0.00 34.95 33.84 3g1n s ARG 4330CO 0.42 -3.43 0.81 -1.13 0.02 0.00 0.00 175.30 171.99 3g1n n SER 4331N -4.70 0.32 0.00 0.23 3.41 -1.26 -4.80 113.62 106.81 3g1n n SER 4331Ca 0.04 1.13 0.04 0.00 -0.26 0.00 0.00 58.87 59.82 3g1n n SER 4331Cb 0.55 -1.18 0.25 0.00 -0.26 0.00 0.00 64.21 63.58 3g1n n SER 4331CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3g1n n THR 4332N -0.00 0.00 1.10 6.66 5.66 -1.26 -2.60 114.28 123.84 3g1n n THR 4332Ca 0.12 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.24 3g1n n THR 4332Cb 0.31 -0.63 0.21 0.00 -1.55 0.00 0.00 70.33 68.68 3g1n n THR 4332CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3g1n n ASP 4333N -0.83 1.00 -4.76 1.09 10.43 -1.26 -4.89 116.55 117.33 3g1n n ASP 4333Ca 0.06 -0.79 -0.36 0.00 2.57 0.00 0.00 54.79 56.28 3g1n n ASP 4333Cb 0.03 0.34 0.02 0.00 1.84 0.00 0.00 41.12 43.35 3g1n n ASP 4333CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 3g1n s ARG 4334N -2.73 3.09 0.72 -1.24 1.81 -1.07 -5.05 118.95 114.48 3g1n s ARG 4334Ca 0.17 1.74 -0.12 0.00 -1.72 0.00 0.00 55.73 55.80 3g1n s ARG 4334Cb 0.18 -1.95 0.03 0.00 -0.45 0.00 0.00 34.95 32.75 3g1n s ARG 4334CO 0.63 -1.09 1.09 -0.51 -0.68 0.00 0.00 175.30 174.74 3g1n s LEU 4335N -4.01 3.17 0.30 2.53 1.02 -1.26 -4.90 118.68 115.53 3g1n s LEU 4335Ca 0.76 1.81 -0.30 0.00 0.02 0.00 0.00 54.13 56.42 3g1n s LEU 4335Cb -0.28 -4.52 -0.11 0.00 0.02 0.00 0.00 46.19 41.30 3g1n s LEU 4335CO 0.31 -1.75 1.55 -2.84 0.02 0.00 0.00 176.35 173.65 3g1n s PRO 4336N -4.69 4.14 0.31 1.29 0.02 -1.26 -4.86 135.00 129.95 3g1n s PRO 4336Ca 0.62 2.53 0.09 0.00 0.02 0.00 0.00 61.00 64.26 3g1n s PRO 4336Cb -0.17 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 3g1n s PRO 4336CO 0.51 -0.58 0.06 -1.54 -0.33 0.00 0.00 177.00 175.12 3g1n s SER 4337N 0.36 4.54 0.03 2.53 1.04 -0.93 -4.85 113.70 116.42 3g1n s SER 4337Ca 0.61 -0.76 0.02 0.00 0.48 0.00 0.00 55.95 56.31 3g1n s SER 4337Cb -0.47 -0.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.89 3g1n s SER 4337CO 0.50 -0.16 -0.08 0.00 0.98 0.00 0.00 173.24 174.48 3g1n s ALA 4338N -2.40 0.58 -0.44 5.32 0.00 -1.26 0.21 121.76 123.77 3g1n s ALA 4338Ca 0.35 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.70 3g1n s ALA 4338Cb -0.04 -0.01 0.13 0.00 0.00 0.00 0.00 23.12 23.20 3g1n s ALA 4338CO 0.21 0.03 0.21 -1.01 0.00 0.00 0.00 175.76 175.20 3g1n s HIS 4339N -1.03 2.55 0.42 0.00 3.76 0.25 -5.00 115.29 116.24 3g1n s HIS 4339Ca -0.06 -2.68 0.12 0.00 -0.15 0.00 0.00 55.06 52.29 3g1n s HIS 4339Cb -0.08 -2.30 0.97 0.00 1.11 0.00 0.00 32.58 32.28 3g1n s HIS 4339CO 0.00 -0.79 1.98 1.79 -0.85 0.00 0.00 174.74 176.86 3g1n h THR 4340N 5.59 0.92 0.00 1.30 1.35 -1.80 -0.79 112.91 119.49 3g1n h THR 4340Ca -0.05 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 3g1n h THR 4340Cb 0.93 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 3g1n h THR 4340CO 0.56 0.09 0.00 0.00 -0.25 0.00 0.00 175.52 175.91 3g1n n PHE 4342N -2.15 0.21 -3.92 0.00 3.72 -0.38 -0.65 117.46 114.28 3g1n n PHE 4342Ca 0.01 -0.49 -0.27 0.00 -0.05 0.00 0.00 57.45 56.65 3g1n n PHE 4342Cb 0.15 -0.04 -0.00 0.00 -0.94 0.00 0.00 39.48 38.65 3g1n n PHE 4342CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3g1n n ASN 4343N -0.03 -1.76 -4.24 4.37 3.02 0.71 -4.63 115.26 112.70 3g1n n ASN 4343Ca 0.05 -0.92 -0.33 0.00 -0.03 0.00 0.00 54.58 53.36 3g1n n ASN 4343Cb 0.33 -3.41 -0.16 0.00 -0.61 0.00 0.00 39.78 35.92 3g1n n ASN 4343CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3g1n s GLN 4344N -6.48 3.13 -0.19 3.52 0.74 -0.74 -1.89 119.66 117.75 3g1n s GLN 4344Ca 0.23 -0.81 -0.08 0.00 0.05 0.00 0.00 55.36 54.75 3g1n s GLN 4344Cb -0.12 -2.46 -0.04 0.00 1.10 0.00 0.00 33.01 31.49 3g1n s GLN 4344CO 0.86 0.09 0.07 -1.17 -0.55 0.00 0.00 175.29 174.60 3g1n s LEU 4345N 0.59 3.85 -0.33 3.68 2.96 -0.54 -0.59 118.68 128.30 3g1n s LEU 4345Ca -0.11 0.09 -0.11 0.00 -0.22 0.00 0.00 54.13 53.77 3g1n s LEU 4345Cb -0.16 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 3g1n s LEU 4345CO 0.03 0.17 0.20 -1.81 -1.32 0.00 0.00 176.35 173.62 3g1n s ASP 4346N 0.41 5.81 -0.32 3.68 -0.00 0.13 -1.69 116.67 124.70 3g1n s ASP 4346Ca 0.04 -0.52 0.01 0.00 -0.00 0.00 0.00 52.55 52.07 3g1n s ASP 4346Cb -0.12 -2.07 0.07 0.00 -0.00 0.00 0.00 42.92 40.80 3g1n s ASP 4346CO 0.00 -0.23 0.02 -0.22 -0.00 0.00 0.00 175.17 174.73 3g1n s LEU 4347N 1.66 4.22 0.81 1.23 2.96 -0.38 -2.20 118.68 126.98 3g1n s LEU 4347Ca 0.05 -1.65 -0.14 0.00 -0.22 0.00 0.00 54.13 52.18 3g1n s LEU 4347Cb -0.17 -1.67 0.07 0.00 0.50 0.00 0.00 46.19 44.91 3g1n s LEU 4347CO 0.08 -0.32 1.07 -2.65 -1.32 0.00 0.00 176.35 173.21 3g1n n PRO 4348N 4.48 0.16 -1.79 0.98 -0.02 -1.26 -2.25 135.00 135.29 3g1n n PRO 4348Ca -0.07 0.12 -0.41 0.00 -2.02 0.00 0.00 63.50 61.12 3g1n n PRO 4348Cb 0.42 -2.33 -0.01 0.00 -0.02 0.00 0.00 33.50 31.57 3g1n n PRO 4348CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1n n ALA 4349N -3.22 6.28 -1.62 3.55 0.00 -1.25 -4.84 120.51 119.40 3g1n n ALA 4349Ca 0.13 -3.92 -0.39 0.00 0.00 0.00 0.00 53.44 49.26 3g1n n ALA 4349Cb 0.51 -3.24 0.04 0.00 0.00 0.00 0.00 19.45 16.75 3g1n n ALA 4349CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3g1n n TYR 4350N 4.17 1.04 0.70 0.00 4.01 -1.26 -4.91 117.16 120.90 3g1n n TYR 4350Ca 0.58 0.47 0.13 0.00 -0.16 0.00 0.00 57.90 58.92 3g1n n TYR 4350Cb 0.32 -2.18 0.44 0.00 -0.31 0.00 0.00 39.34 37.61 3g1n n TYR 4350CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3g1n n GLU 4351N -0.64 0.21 -3.56 -0.72 4.71 -1.26 -4.89 120.64 114.49 3g1n n GLU 4351Ca 0.12 0.18 -0.14 0.00 -0.01 0.00 0.00 57.16 57.30 3g1n n GLU 4351Cb 0.45 -1.75 -0.05 0.00 -1.01 0.00 0.00 31.44 29.08 3g1n n GLU 4351CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3g1n s SER 4352N -4.25 -0.46 0.11 1.62 1.04 -1.26 -5.05 113.70 105.45 3g1n s SER 4352Ca 0.11 0.19 -0.32 0.00 0.48 0.00 0.00 55.95 56.41 3g1n s SER 4352Cb 0.14 0.50 -0.11 0.00 0.10 0.00 0.00 66.02 66.64 3g1n s SER 4352CO 0.58 -0.73 1.57 0.15 0.98 0.00 0.00 173.24 175.80 3g1n h PHE 4353N 2.75 -1.35 0.00 5.02 3.57 -1.97 -1.84 116.94 123.11 3g1n h PHE 4353Ca -0.31 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.21 3g1n h PHE 4353Cb 1.21 0.58 -0.00 0.00 2.79 0.00 0.00 35.95 40.53 3g1n h PHE 4353CO 0.36 -0.55 -0.10 1.05 -2.23 0.00 0.00 178.31 176.84 3g1n h GLU 4354N -0.67 0.00 0.04 1.11 9.09 -1.99 0.11 114.58 122.27 3g1n h GLU 4354Ca 0.02 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.43 3g1n h GLU 4354Cb 0.71 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.81 3g1n h GLU 4354CO -0.30 0.10 -0.02 -0.22 0.05 0.00 0.00 179.01 178.63 3g1n h LYS 4355N 0.00 -0.05 0.07 1.06 3.64 -1.89 -2.15 116.57 117.25 3g1n h LYS 4355Ca -0.00 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3g1n h LYS 4355Cb 0.31 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3g1n h LYS 4355CO 0.01 0.23 -0.14 1.25 -2.27 0.00 0.00 179.45 178.54 3g1n h LEU 4356N -0.33 -0.38 0.05 5.20 6.46 -0.21 0.76 115.31 126.87 3g1n h LEU 4356Ca -0.01 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 57.82 3g1n h LEU 4356Cb 0.30 0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 3g1n h LEU 4356CO 0.01 -0.20 -0.18 -0.09 -0.62 0.00 0.00 178.44 177.36 3g1n h ARG 4357N -0.27 -0.31 -0.56 1.25 2.43 -0.95 0.23 114.38 116.20 3g1n h ARG 4357Ca 0.03 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.25 3g1n h ARG 4357Cb 0.29 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 3g1n h ARG 4357CO -0.08 -0.21 0.33 1.25 -1.51 0.00 0.00 179.97 179.75 3g1n h HIS 4358N -0.32 0.62 0.00 2.20 2.76 -1.30 0.40 115.15 119.50 3g1n h HIS 4358Ca 0.04 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.15 3g1n h HIS 4358Cb 0.37 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.12 3g1n h HIS 4358CO -0.21 0.34 -0.37 1.98 -1.30 0.00 0.00 177.93 178.38 3g1n h MET 4359N 0.65 0.00 -0.02 5.26 4.05 -0.53 -2.17 114.93 122.17 3g1n h MET 4359Ca 0.23 0.00 -0.18 0.00 -0.28 0.00 0.00 59.70 59.47 3g1n h MET 4359Cb 0.04 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 30.85 3g1n h MET 4359CO -0.11 0.37 -0.67 1.25 0.23 0.00 0.00 176.91 177.98 3g1n h LEU 4360N 0.00 0.63 -0.77 3.39 6.46 0.19 -2.76 115.31 122.46 3g1n h LEU 4360Ca -0.00 -0.73 0.05 0.00 -0.12 0.00 0.00 57.88 57.08 3g1n h LEU 4360Cb 0.70 -0.19 -0.06 0.00 -0.73 0.00 0.00 40.66 40.38 3g1n h LEU 4360CO 0.05 1.28 0.46 -0.07 -0.62 0.00 0.00 178.44 179.54 3g1n h LEU 4361N 0.05 0.72 -0.25 2.25 3.38 -0.79 -2.72 115.31 117.95 3g1n h LEU 4361Ca -0.08 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3g1n h LEU 4361Cb 1.36 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 3g1n h LEU 4361CO 0.13 0.47 0.14 0.25 0.09 0.00 0.00 178.44 179.53 3g1n h LEU 4362N 0.86 0.30 -2.11 1.67 5.85 -1.43 -2.96 115.31 117.49 3g1n h LEU 4362Ca 0.33 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 3g1n h LEU 4362Cb 0.14 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3g1n h LEU 4362CO -0.16 0.28 -0.04 0.00 -0.34 0.00 0.00 178.44 178.18 3g1n h ALA 4363N 1.04 1.71 0.00 1.25 0.00 -1.24 -2.70 119.26 119.31 3g1n h ALA 4363Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3g1n h ALA 4363Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3g1n h ALA 4363CO -0.02 0.05 0.00 -0.89 0.00 0.00 0.00 179.25 178.40 3g1n n ILE 4364N -4.16 0.44 -0.54 0.00 -0.00 -1.05 -4.83 119.36 109.22 3g1n n ILE 4364Ca -0.03 0.11 0.00 0.00 -0.00 0.00 0.00 62.75 62.83 3g1n n ILE 4364Cb 0.13 -0.74 0.00 0.00 -0.00 0.00 0.00 39.64 39.02 3g1n n ILE 4364CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3g1n n GLN 4365N -1.42 2.56 0.00 0.38 1.13 -1.02 -4.78 117.38 114.23 3g1n n GLN 4365Ca 0.07 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.26 3g1n n GLN 4365Cb 0.22 0.00 0.30 0.00 0.11 0.00 0.00 30.24 30.88 3g1n n GLN 4365CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77